data_19095 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19095 _Entry.Title ; Backbone and side-chain 1H, 13C and 15N resonance assignments of the OB domain of the single-stranded DNA binding protein from Sulfolobus Solfataricus ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-03-17 _Entry.Accession_date 2013-03-17 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Roland Gamsjaeger . . . 19095 2 Ruvini Kariawasam . . . 19095 3 Christine Touma . . . 19095 4 Malcolm White . F . 19095 5 Liza Cubeddu . . . 19095 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19095 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 505 19095 '15N chemical shifts' 133 19095 '1H chemical shifts' 829 19095 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 . . 2014-05-05 2013-03-17 update BMRB 'update entry citation' 19095 1 . . 2013-04-17 2013-03-17 original author 'original release' 19095 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19095 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23749431 _Citation.Full_citation . _Citation.Title 'Backbone and side-chain (1)H, (13)C and (15)N resonance assignments of the OB domain of the single stranded DNA binding protein from Sulfolobus solfataricus and chemical shift mapping of the DNA-binding interface.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Roland Gamsjaeger . . . 19095 1 2 Ruvini Kariawasam . . . 19095 1 3 Christine Touma . . . 19095 1 4 Ann Kwan . H. . 19095 1 5 Malcolm White . F. . 19095 1 6 Liza Cubeddu . . . 19095 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19095 _Assembly.ID 1 _Assembly.Name SsoSSB _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 SsoSSB 1 $SsoSSB A . yes native no no . . . 19095 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SsoSSB _Entity.Sf_category entity _Entity.Sf_framecode SsoSSB _Entity.Entry_ID 19095 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SsoSSB _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MEEKVGNLKPNMESVNVTVR VLEASEARQIQTKNGVRTIS EAIVGDETGRVKLTLWGKHA GSIKEGQVVKIENAWTTAFK GQVQLNAGSKTKIAEASEDG FPESSQIPENTPTARRR ; _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 117 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1O7I . "Crystal Structure Of A Single Stranded Dna Binding Protein" . . . . . 97.44 119 100.00 100.00 3.76e-74 . . . . 19095 1 2 no PDB 2MNA . "The Structural Basis Of Dna Binding By The Single-stranded Dna-binding Protein From Sulfolobus Solfataricus" . . . . . 100.00 117 100.00 100.00 9.73e-77 . . . . 19095 1 3 no GB AAK42515 . "Single-stranded DNA binding protein (SSB) [Sulfolobus solfataricus P2]" . . . . . 97.44 148 100.00 100.00 1.35e-73 . . . . 19095 1 4 no GB ACP34347 . "nucleic acid binding OB-fold tRNA/helicase-type [Sulfolobus islandicus L.S.2.15]" . . . . . 97.44 148 97.37 99.12 1.76e-71 . . . . 19095 1 5 no GB ACP37052 . "nucleic acid binding OB-fold tRNA/helicase-type [Sulfolobus islandicus M.14.25]" . . . . . 97.44 148 97.37 99.12 1.76e-71 . . . . 19095 1 6 no GB ACP44458 . "nucleic acid binding OB-fold tRNA/helicase-type [Sulfolobus islandicus Y.G.57.14]" . . . . . 97.44 148 97.37 99.12 1.76e-71 . . . . 19095 1 7 no GB ACP54191 . "nucleic acid binding OB-fold tRNA/helicase-type [Sulfolobus islandicus M.16.27]" . . . . . 97.44 148 97.37 99.12 1.76e-71 . . . . 19095 1 8 no REF WP_009989484 . "single-stranded DNA-binding protein [Sulfolobus solfataricus]" . . . . . 97.44 148 100.00 100.00 1.35e-73 . . . . 19095 1 9 no REF WP_012710339 . "single-stranded DNA-binding protein [Sulfolobus islandicus]" . . . . . 97.44 148 97.37 99.12 1.76e-71 . . . . 19095 1 10 no SP Q97W73 . "RecName: Full=Single-stranded DNA binding protein Ssb; Short=SSB" . . . . . 97.44 148 100.00 100.00 1.35e-73 . . . . 19095 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 MET . 19095 1 2 2 GLU . 19095 1 3 3 GLU . 19095 1 4 4 LYS . 19095 1 5 5 VAL . 19095 1 6 6 GLY . 19095 1 7 7 ASN . 19095 1 8 8 LEU . 19095 1 9 9 LYS . 19095 1 10 10 PRO . 19095 1 11 11 ASN . 19095 1 12 12 MET . 19095 1 13 13 GLU . 19095 1 14 14 SER . 19095 1 15 15 VAL . 19095 1 16 16 ASN . 19095 1 17 17 VAL . 19095 1 18 18 THR . 19095 1 19 19 VAL . 19095 1 20 20 ARG . 19095 1 21 21 VAL . 19095 1 22 22 LEU . 19095 1 23 23 GLU . 19095 1 24 24 ALA . 19095 1 25 25 SER . 19095 1 26 26 GLU . 19095 1 27 27 ALA . 19095 1 28 28 ARG . 19095 1 29 29 GLN . 19095 1 30 30 ILE . 19095 1 31 31 GLN . 19095 1 32 32 THR . 19095 1 33 33 LYS . 19095 1 34 34 ASN . 19095 1 35 35 GLY . 19095 1 36 36 VAL . 19095 1 37 37 ARG . 19095 1 38 38 THR . 19095 1 39 39 ILE . 19095 1 40 40 SER . 19095 1 41 41 GLU . 19095 1 42 42 ALA . 19095 1 43 43 ILE . 19095 1 44 44 VAL . 19095 1 45 45 GLY . 19095 1 46 46 ASP . 19095 1 47 47 GLU . 19095 1 48 48 THR . 19095 1 49 49 GLY . 19095 1 50 50 ARG . 19095 1 51 51 VAL . 19095 1 52 52 LYS . 19095 1 53 53 LEU . 19095 1 54 54 THR . 19095 1 55 55 LEU . 19095 1 56 56 TRP . 19095 1 57 57 GLY . 19095 1 58 58 LYS . 19095 1 59 59 HIS . 19095 1 60 60 ALA . 19095 1 61 61 GLY . 19095 1 62 62 SER . 19095 1 63 63 ILE . 19095 1 64 64 LYS . 19095 1 65 65 GLU . 19095 1 66 66 GLY . 19095 1 67 67 GLN . 19095 1 68 68 VAL . 19095 1 69 69 VAL . 19095 1 70 70 LYS . 19095 1 71 71 ILE . 19095 1 72 72 GLU . 19095 1 73 73 ASN . 19095 1 74 74 ALA . 19095 1 75 75 TRP . 19095 1 76 76 THR . 19095 1 77 77 THR . 19095 1 78 78 ALA . 19095 1 79 79 PHE . 19095 1 80 80 LYS . 19095 1 81 81 GLY . 19095 1 82 82 GLN . 19095 1 83 83 VAL . 19095 1 84 84 GLN . 19095 1 85 85 LEU . 19095 1 86 86 ASN . 19095 1 87 87 ALA . 19095 1 88 88 GLY . 19095 1 89 89 SER . 19095 1 90 90 LYS . 19095 1 91 91 THR . 19095 1 92 92 LYS . 19095 1 93 93 ILE . 19095 1 94 94 ALA . 19095 1 95 95 GLU . 19095 1 96 96 ALA . 19095 1 97 97 SER . 19095 1 98 98 GLU . 19095 1 99 99 ASP . 19095 1 100 100 GLY . 19095 1 101 101 PHE . 19095 1 102 102 PRO . 19095 1 103 103 GLU . 19095 1 104 104 SER . 19095 1 105 105 SER . 19095 1 106 106 GLN . 19095 1 107 107 ILE . 19095 1 108 108 PRO . 19095 1 109 109 GLU . 19095 1 110 110 ASN . 19095 1 111 111 THR . 19095 1 112 112 PRO . 19095 1 113 113 THR . 19095 1 114 114 ALA . 19095 1 115 115 ARG . 19095 1 116 116 ARG . 19095 1 117 117 ARG . 19095 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 19095 1 . GLU 2 2 19095 1 . GLU 3 3 19095 1 . LYS 4 4 19095 1 . VAL 5 5 19095 1 . GLY 6 6 19095 1 . ASN 7 7 19095 1 . LEU 8 8 19095 1 . LYS 9 9 19095 1 . PRO 10 10 19095 1 . ASN 11 11 19095 1 . MET 12 12 19095 1 . GLU 13 13 19095 1 . SER 14 14 19095 1 . VAL 15 15 19095 1 . ASN 16 16 19095 1 . VAL 17 17 19095 1 . THR 18 18 19095 1 . VAL 19 19 19095 1 . ARG 20 20 19095 1 . VAL 21 21 19095 1 . LEU 22 22 19095 1 . GLU 23 23 19095 1 . ALA 24 24 19095 1 . SER 25 25 19095 1 . GLU 26 26 19095 1 . ALA 27 27 19095 1 . ARG 28 28 19095 1 . GLN 29 29 19095 1 . ILE 30 30 19095 1 . GLN 31 31 19095 1 . THR 32 32 19095 1 . LYS 33 33 19095 1 . ASN 34 34 19095 1 . GLY 35 35 19095 1 . VAL 36 36 19095 1 . ARG 37 37 19095 1 . THR 38 38 19095 1 . ILE 39 39 19095 1 . SER 40 40 19095 1 . GLU 41 41 19095 1 . ALA 42 42 19095 1 . ILE 43 43 19095 1 . VAL 44 44 19095 1 . GLY 45 45 19095 1 . ASP 46 46 19095 1 . GLU 47 47 19095 1 . THR 48 48 19095 1 . GLY 49 49 19095 1 . ARG 50 50 19095 1 . VAL 51 51 19095 1 . LYS 52 52 19095 1 . LEU 53 53 19095 1 . THR 54 54 19095 1 . LEU 55 55 19095 1 . TRP 56 56 19095 1 . GLY 57 57 19095 1 . LYS 58 58 19095 1 . HIS 59 59 19095 1 . ALA 60 60 19095 1 . GLY 61 61 19095 1 . SER 62 62 19095 1 . ILE 63 63 19095 1 . LYS 64 64 19095 1 . GLU 65 65 19095 1 . GLY 66 66 19095 1 . GLN 67 67 19095 1 . VAL 68 68 19095 1 . VAL 69 69 19095 1 . LYS 70 70 19095 1 . ILE 71 71 19095 1 . GLU 72 72 19095 1 . ASN 73 73 19095 1 . ALA 74 74 19095 1 . TRP 75 75 19095 1 . THR 76 76 19095 1 . THR 77 77 19095 1 . ALA 78 78 19095 1 . PHE 79 79 19095 1 . LYS 80 80 19095 1 . GLY 81 81 19095 1 . GLN 82 82 19095 1 . VAL 83 83 19095 1 . GLN 84 84 19095 1 . LEU 85 85 19095 1 . ASN 86 86 19095 1 . ALA 87 87 19095 1 . GLY 88 88 19095 1 . SER 89 89 19095 1 . LYS 90 90 19095 1 . THR 91 91 19095 1 . LYS 92 92 19095 1 . ILE 93 93 19095 1 . ALA 94 94 19095 1 . GLU 95 95 19095 1 . ALA 96 96 19095 1 . SER 97 97 19095 1 . GLU 98 98 19095 1 . ASP 99 99 19095 1 . GLY 100 100 19095 1 . PHE 101 101 19095 1 . PRO 102 102 19095 1 . GLU 103 103 19095 1 . SER 104 104 19095 1 . SER 105 105 19095 1 . GLN 106 106 19095 1 . ILE 107 107 19095 1 . PRO 108 108 19095 1 . GLU 109 109 19095 1 . ASN 110 110 19095 1 . THR 111 111 19095 1 . PRO 112 112 19095 1 . THR 113 113 19095 1 . ALA 114 114 19095 1 . ARG 115 115 19095 1 . ARG 116 116 19095 1 . ARG 117 117 19095 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 19095 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $SsoSSB . 2287 organism . 'Sulfolobus Solfataricus' Crenarchaeotes . . Archaea . Sulfolobus Solfataricus . . . . . . . . . . . . . . . . . . . . . 19095 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 19095 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $SsoSSB . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET28C . . . . . . 19095 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19095 _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 SsoSSB '[U-100% 13C; U-100% 15N]' . . 1 $SsoSSB . . . 0.8 1.5 mM . . . . 19095 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19095 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19095 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 19095 _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' 60 . mM 19095 1 pH 6.0 . pH 19095 1 pressure 1 . atm 19095 1 temperature 298 . K 19095 1 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 19095 _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 19095 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19095 _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 . . . 19095 1 2 spectrometer_2 Bruker Avance . 800 . . . 19095 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 19095 _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 . . . . . . . . . . . . . . . . . . . . . 19095 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 7 '3D CC(CO)NH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 8 '3D HCC(CO)NH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19095 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 19095 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19095 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19095 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19095 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 19095 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19095 1 2 '2D 1H-13C HSQC' . . . 19095 1 3 '3D CBCA(CO)NH' . . . 19095 1 4 '3D HNCACB' . . . 19095 1 5 '3D HNCO' . . . 19095 1 6 '3D HN(CA)CO' . . . 19095 1 7 '3D CC(CO)NH-TOCSY' . . . 19095 1 8 '3D HCC(CO)NH-TOCSY' . . . 19095 1 9 '3D HCCH-TOCSY' . . . 19095 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 MET HA H 1 4.221 0.050 . 1 . . . . 1 MET HA . 19095 1 2 . 1 1 1 1 MET HB2 H 1 2.271 0.050 . 1 . . . . 1 MET HB2 . 19095 1 3 . 1 1 1 1 MET HB3 H 1 2.271 0.050 . 1 . . . . 1 MET HB3 . 19095 1 4 . 1 1 1 1 MET HG2 H 1 2.660 0.050 . 1 . . . . 1 MET HG2 . 19095 1 5 . 1 1 1 1 MET HG3 H 1 2.660 0.050 . 1 . . . . 1 MET HG3 . 19095 1 6 . 1 1 1 1 MET HE1 H 1 2.170 0.050 . 1 . . . . 1 MET HE1 . 19095 1 7 . 1 1 1 1 MET HE2 H 1 2.170 0.050 . 1 . . . . 1 MET HE2 . 19095 1 8 . 1 1 1 1 MET HE3 H 1 2.170 0.050 . 1 . . . . 1 MET HE3 . 19095 1 9 . 1 1 1 1 MET C C 13 172.310 0.200 . 1 . . . . 1 MET C . 19095 1 10 . 1 1 1 1 MET CA C 13 55.179 0.200 . 1 . . . . 1 MET CA . 19095 1 11 . 1 1 1 1 MET CB C 13 32.841 0.200 . 1 . . . . 1 MET CB . 19095 1 12 . 1 1 1 1 MET CG C 13 30.967 0.200 . 1 . . . . 1 MET CG . 19095 1 13 . 1 1 1 1 MET CE C 13 17.063 0.200 . 1 . . . . 1 MET CE . 19095 1 14 . 1 1 2 2 GLU H H 1 8.845 0.050 . 1 . . . . 2 GLU H . 19095 1 15 . 1 1 2 2 GLU HA H 1 4.839 0.050 . 1 . . . . 2 GLU HA . 19095 1 16 . 1 1 2 2 GLU HB2 H 1 2.109 0.050 . 2 . . . . 2 GLU HB2 . 19095 1 17 . 1 1 2 2 GLU HB3 H 1 1.968 0.050 . 2 . . . . 2 GLU HB3 . 19095 1 18 . 1 1 2 2 GLU HG2 H 1 2.261 0.050 . 1 . . . . 2 GLU HG2 . 19095 1 19 . 1 1 2 2 GLU HG3 H 1 2.261 0.050 . 1 . . . . 2 GLU HG3 . 19095 1 20 . 1 1 2 2 GLU C C 13 175.539 0.200 . 1 . . . . 2 GLU C . 19095 1 21 . 1 1 2 2 GLU CA C 13 56.167 0.200 . 1 . . . . 2 GLU CA . 19095 1 22 . 1 1 2 2 GLU CB C 13 31.164 0.200 . 1 . . . . 2 GLU CB . 19095 1 23 . 1 1 2 2 GLU CG C 13 36.420 0.200 . 1 . . . . 2 GLU CG . 19095 1 24 . 1 1 2 2 GLU N N 15 124.610 0.200 . 1 . . . . 2 GLU N . 19095 1 25 . 1 1 3 3 GLU H H 1 8.653 0.050 . 1 . . . . 3 GLU H . 19095 1 26 . 1 1 3 3 GLU HA H 1 4.800 0.050 . 1 . . . . 3 GLU HA . 19095 1 27 . 1 1 3 3 GLU HB2 H 1 1.914 0.050 . 2 . . . . 3 GLU HB2 . 19095 1 28 . 1 1 3 3 GLU HB3 H 1 1.597 0.050 . 2 . . . . 3 GLU HB3 . 19095 1 29 . 1 1 3 3 GLU HG2 H 1 2.256 0.050 . 2 . . . . 3 GLU HG2 . 19095 1 30 . 1 1 3 3 GLU HG3 H 1 2.417 0.050 . 2 . . . . 3 GLU HG3 . 19095 1 31 . 1 1 3 3 GLU C C 13 175.448 0.200 . 1 . . . . 3 GLU C . 19095 1 32 . 1 1 3 3 GLU CA C 13 54.235 0.200 . 1 . . . . 3 GLU CA . 19095 1 33 . 1 1 3 3 GLU CB C 13 33.039 0.200 . 1 . . . . 3 GLU CB . 19095 1 34 . 1 1 3 3 GLU CG C 13 35.873 0.200 . 1 . . . . 3 GLU CG . 19095 1 35 . 1 1 3 3 GLU N N 15 123.379 0.200 . 1 . . . . 3 GLU N . 19095 1 36 . 1 1 4 4 LYS H H 1 8.857 0.050 . 1 . . . . 4 LYS H . 19095 1 37 . 1 1 4 4 LYS HA H 1 4.628 0.050 . 1 . . . . 4 LYS HA . 19095 1 38 . 1 1 4 4 LYS HB2 H 1 1.630 0.050 . 2 . . . . 4 LYS HB2 . 19095 1 39 . 1 1 4 4 LYS HB3 H 1 2.377 0.050 . 2 . . . . 4 LYS HB3 . 19095 1 40 . 1 1 4 4 LYS HG2 H 1 1.517 0.050 . 1 . . . . 4 LYS HG2 . 19095 1 41 . 1 1 4 4 LYS HG3 H 1 1.517 0.050 . 1 . . . . 4 LYS HG3 . 19095 1 42 . 1 1 4 4 LYS HD2 H 1 1.532 0.050 . 1 . . . . 4 LYS HD2 . 19095 1 43 . 1 1 4 4 LYS HD3 H 1 1.532 0.050 . 1 . . . . 4 LYS HD3 . 19095 1 44 . 1 1 4 4 LYS HE2 H 1 2.936 0.050 . 1 . . . . 4 LYS HE2 . 19095 1 45 . 1 1 4 4 LYS HE3 H 1 2.936 0.050 . 1 . . . . 4 LYS HE3 . 19095 1 46 . 1 1 4 4 LYS C C 13 178.844 0.200 . 1 . . . . 4 LYS C . 19095 1 47 . 1 1 4 4 LYS CA C 13 53.172 0.200 . 1 . . . . 4 LYS CA . 19095 1 48 . 1 1 4 4 LYS CB C 13 32.426 0.200 . 1 . . . . 4 LYS CB . 19095 1 49 . 1 1 4 4 LYS CG C 13 23.942 0.200 . 1 . . . . 4 LYS CG . 19095 1 50 . 1 1 4 4 LYS CD C 13 28.046 0.200 . 1 . . . . 4 LYS CD . 19095 1 51 . 1 1 4 4 LYS CE C 13 42.522 0.200 . 1 . . . . 4 LYS CE . 19095 1 52 . 1 1 4 4 LYS N N 15 121.326 0.200 . 1 . . . . 4 LYS N . 19095 1 53 . 1 1 5 5 VAL H H 1 9.847 0.050 . 1 . . . . 5 VAL H . 19095 1 54 . 1 1 5 5 VAL HA H 1 3.106 0.050 . 1 . . . . 5 VAL HA . 19095 1 55 . 1 1 5 5 VAL HB H 1 1.848 0.050 . 1 . . . . 5 VAL HB . 19095 1 56 . 1 1 5 5 VAL HG11 H 1 0.507 0.050 . 2 . . . . 5 VAL HG11 . 19095 1 57 . 1 1 5 5 VAL HG12 H 1 0.507 0.050 . 2 . . . . 5 VAL HG12 . 19095 1 58 . 1 1 5 5 VAL HG13 H 1 0.507 0.050 . 2 . . . . 5 VAL HG13 . 19095 1 59 . 1 1 5 5 VAL HG21 H 1 0.785 0.050 . 2 . . . . 5 VAL HG21 . 19095 1 60 . 1 1 5 5 VAL HG22 H 1 0.785 0.050 . 2 . . . . 5 VAL HG22 . 19095 1 61 . 1 1 5 5 VAL HG23 H 1 0.785 0.050 . 2 . . . . 5 VAL HG23 . 19095 1 62 . 1 1 5 5 VAL C C 13 177.943 0.200 . 1 . . . . 5 VAL C . 19095 1 63 . 1 1 5 5 VAL CA C 13 66.925 0.200 . 1 . . . . 5 VAL CA . 19095 1 64 . 1 1 5 5 VAL CB C 13 30.981 0.200 . 1 . . . . 5 VAL CB . 19095 1 65 . 1 1 5 5 VAL CG1 C 13 22.745 0.200 . 1 . . . . 5 VAL CG1 . 19095 1 66 . 1 1 5 5 VAL CG2 C 13 24.462 0.200 . 1 . . . . 5 VAL CG2 . 19095 1 67 . 1 1 5 5 VAL N N 15 123.977 0.200 . 1 . . . . 5 VAL N . 19095 1 68 . 1 1 6 6 GLY H H 1 9.647 0.050 . 1 . . . . 6 GLY H . 19095 1 69 . 1 1 6 6 GLY HA2 H 1 3.581 0.050 . 1 . . . . 6 GLY HA2 . 19095 1 70 . 1 1 6 6 GLY HA3 H 1 3.581 0.050 . 1 . . . . 6 GLY HA3 . 19095 1 71 . 1 1 6 6 GLY C C 13 174.587 0.200 . 1 . . . . 6 GLY C . 19095 1 72 . 1 1 6 6 GLY CA C 13 46.370 0.200 . 1 . . . . 6 GLY CA . 19095 1 73 . 1 1 6 6 GLY N N 15 103.432 0.200 . 1 . . . . 6 GLY N . 19095 1 74 . 1 1 7 7 ASN H H 1 7.706 0.050 . 1 . . . . 7 ASN H . 19095 1 75 . 1 1 7 7 ASN HA H 1 4.950 0.050 . 1 . . . . 7 ASN HA . 19095 1 76 . 1 1 7 7 ASN HB2 H 1 2.796 0.050 . 2 . . . . 7 ASN HB2 . 19095 1 77 . 1 1 7 7 ASN HB3 H 1 3.092 0.050 . 2 . . . . 7 ASN HB3 . 19095 1 78 . 1 1 7 7 ASN HD21 H 1 6.998 0.050 . 2 . . . . 7 ASN HD21 . 19095 1 79 . 1 1 7 7 ASN HD22 H 1 8.097 0.050 . 2 . . . . 7 ASN HD22 . 19095 1 80 . 1 1 7 7 ASN C C 13 175.738 0.200 . 1 . . . . 7 ASN C . 19095 1 81 . 1 1 7 7 ASN CA C 13 51.955 0.200 . 1 . . . . 7 ASN CA . 19095 1 82 . 1 1 7 7 ASN CB C 13 39.406 0.200 . 1 . . . . 7 ASN CB . 19095 1 83 . 1 1 7 7 ASN N N 15 116.525 0.200 . 1 . . . . 7 ASN N . 19095 1 84 . 1 1 7 7 ASN ND2 N 15 112.725 0.200 . 1 . . . . 7 ASN ND2 . 19095 1 85 . 1 1 8 8 LEU H H 1 7.491 0.050 . 1 . . . . 8 LEU H . 19095 1 86 . 1 1 8 8 LEU HA H 1 3.983 0.050 . 1 . . . . 8 LEU HA . 19095 1 87 . 1 1 8 8 LEU HB2 H 1 1.781 0.050 . 2 . . . . 8 LEU HB2 . 19095 1 88 . 1 1 8 8 LEU HB3 H 1 1.204 0.050 . 2 . . . . 8 LEU HB3 . 19095 1 89 . 1 1 8 8 LEU HG H 1 2.186 0.050 . 1 . . . . 8 LEU HG . 19095 1 90 . 1 1 8 8 LEU HD11 H 1 0.659 0.050 . 2 . . . . 8 LEU HD11 . 19095 1 91 . 1 1 8 8 LEU HD12 H 1 0.659 0.050 . 2 . . . . 8 LEU HD12 . 19095 1 92 . 1 1 8 8 LEU HD13 H 1 0.659 0.050 . 2 . . . . 8 LEU HD13 . 19095 1 93 . 1 1 8 8 LEU HD21 H 1 0.742 0.050 . 2 . . . . 8 LEU HD21 . 19095 1 94 . 1 1 8 8 LEU HD22 H 1 0.742 0.050 . 2 . . . . 8 LEU HD22 . 19095 1 95 . 1 1 8 8 LEU HD23 H 1 0.742 0.050 . 2 . . . . 8 LEU HD23 . 19095 1 96 . 1 1 8 8 LEU C C 13 175.011 0.200 . 1 . . . . 8 LEU C . 19095 1 97 . 1 1 8 8 LEU CA C 13 56.326 0.200 . 1 . . . . 8 LEU CA . 19095 1 98 . 1 1 8 8 LEU CB C 13 42.970 0.200 . 1 . . . . 8 LEU CB . 19095 1 99 . 1 1 8 8 LEU CG C 13 26.059 0.200 . 1 . . . . 8 LEU CG . 19095 1 100 . 1 1 8 8 LEU CD1 C 13 23.125 0.200 . 1 . . . . 8 LEU CD1 . 19095 1 101 . 1 1 8 8 LEU CD2 C 13 26.613 0.200 . 1 . . . . 8 LEU CD2 . 19095 1 102 . 1 1 8 8 LEU N N 15 120.035 0.200 . 1 . . . . 8 LEU N . 19095 1 103 . 1 1 9 9 LYS H H 1 7.789 0.050 . 1 . . . . 9 LYS H . 19095 1 104 . 1 1 9 9 LYS HA H 1 4.779 0.050 . 1 . . . . 9 LYS HA . 19095 1 105 . 1 1 9 9 LYS HB2 H 1 1.986 0.050 . 2 . . . . 9 LYS HB2 . 19095 1 106 . 1 1 9 9 LYS HB3 H 1 1.609 0.050 . 2 . . . . 9 LYS HB3 . 19095 1 107 . 1 1 9 9 LYS HG2 H 1 1.580 0.050 . 2 . . . . 9 LYS HG2 . 19095 1 108 . 1 1 9 9 LYS HG3 H 1 1.550 0.050 . 2 . . . . 9 LYS HG3 . 19095 1 109 . 1 1 9 9 LYS HD2 H 1 1.793 0.050 . 1 . . . . 9 LYS HD2 . 19095 1 110 . 1 1 9 9 LYS HD3 H 1 1.793 0.050 . 1 . . . . 9 LYS HD3 . 19095 1 111 . 1 1 9 9 LYS HE2 H 1 3.045 0.050 . 1 . . . . 9 LYS HE2 . 19095 1 112 . 1 1 9 9 LYS HE3 H 1 3.045 0.050 . 1 . . . . 9 LYS HE3 . 19095 1 113 . 1 1 9 9 LYS C C 13 174.222 0.200 . 1 . . . . 9 LYS C . 19095 1 114 . 1 1 9 9 LYS CA C 13 53.230 0.200 . 1 . . . . 9 LYS CA . 19095 1 115 . 1 1 9 9 LYS CB C 13 33.770 0.200 . 1 . . . . 9 LYS CB . 19095 1 116 . 1 1 9 9 LYS CG C 13 24.497 0.200 . 1 . . . . 9 LYS CG . 19095 1 117 . 1 1 9 9 LYS CD C 13 28.902 0.200 . 1 . . . . 9 LYS CD . 19095 1 118 . 1 1 9 9 LYS CE C 13 42.374 0.200 . 1 . . . . 9 LYS CE . 19095 1 119 . 1 1 9 9 LYS N N 15 120.178 0.200 . 1 . . . . 9 LYS N . 19095 1 120 . 1 1 10 10 PRO HA H 1 4.051 0.050 . 1 . . . . 10 PRO HA . 19095 1 121 . 1 1 10 10 PRO HB2 H 1 1.954 0.050 . 2 . . . . 10 PRO HB2 . 19095 1 122 . 1 1 10 10 PRO HB3 H 1 2.041 0.050 . 2 . . . . 10 PRO HB3 . 19095 1 123 . 1 1 10 10 PRO HG2 H 1 1.845 0.050 . 2 . . . . 10 PRO HG2 . 19095 1 124 . 1 1 10 10 PRO HG3 H 1 2.153 0.050 . 2 . . . . 10 PRO HG3 . 19095 1 125 . 1 1 10 10 PRO HD2 H 1 3.586 0.050 . 2 . . . . 10 PRO HD2 . 19095 1 126 . 1 1 10 10 PRO HD3 H 1 3.733 0.050 . 2 . . . . 10 PRO HD3 . 19095 1 127 . 1 1 10 10 PRO C C 13 174.082 0.200 . 1 . . . . 10 PRO C . 19095 1 128 . 1 1 10 10 PRO CA C 13 63.195 0.200 . 1 . . . . 10 PRO CA . 19095 1 129 . 1 1 10 10 PRO CB C 13 32.665 0.200 . 1 . . . . 10 PRO CB . 19095 1 130 . 1 1 10 10 PRO CG C 13 27.629 0.200 . 1 . . . . 10 PRO CG . 19095 1 131 . 1 1 10 10 PRO CD C 13 50.275 0.200 . 1 . . . . 10 PRO CD . 19095 1 132 . 1 1 11 11 ASN H H 1 7.125 0.050 . 1 . . . . 11 ASN H . 19095 1 133 . 1 1 11 11 ASN HA H 1 4.512 0.050 . 1 . . . . 11 ASN HA . 19095 1 134 . 1 1 11 11 ASN HB2 H 1 3.010 0.050 . 2 . . . . 11 ASN HB2 . 19095 1 135 . 1 1 11 11 ASN HB3 H 1 2.907 0.050 . 2 . . . . 11 ASN HB3 . 19095 1 136 . 1 1 11 11 ASN HD21 H 1 6.974 0.050 . 2 . . . . 11 ASN HD21 . 19095 1 137 . 1 1 11 11 ASN HD22 H 1 7.714 0.050 . 2 . . . . 11 ASN HD22 . 19095 1 138 . 1 1 11 11 ASN C C 13 174.390 0.200 . 1 . . . . 11 ASN C . 19095 1 139 . 1 1 11 11 ASN CA C 13 54.549 0.200 . 1 . . . . 11 ASN CA . 19095 1 140 . 1 1 11 11 ASN CB C 13 36.612 0.200 . 1 . . . . 11 ASN CB . 19095 1 141 . 1 1 11 11 ASN N N 15 114.446 0.200 . 1 . . . . 11 ASN N . 19095 1 142 . 1 1 11 11 ASN ND2 N 15 113.174 0.200 . 1 . . . . 11 ASN ND2 . 19095 1 143 . 1 1 12 12 MET H H 1 8.214 0.050 . 1 . . . . 12 MET H . 19095 1 144 . 1 1 12 12 MET HA H 1 4.547 0.050 . 1 . . . . 12 MET HA . 19095 1 145 . 1 1 12 12 MET HB2 H 1 2.306 0.050 . 2 . . . . 12 MET HB2 . 19095 1 146 . 1 1 12 12 MET HB3 H 1 2.055 0.050 . 2 . . . . 12 MET HB3 . 19095 1 147 . 1 1 12 12 MET HG2 H 1 2.589 0.050 . 1 . . . . 12 MET HG2 . 19095 1 148 . 1 1 12 12 MET HG3 H 1 2.589 0.050 . 1 . . . . 12 MET HG3 . 19095 1 149 . 1 1 12 12 MET HE1 H 1 2.197 0.050 . 1 . . . . 12 MET HE1 . 19095 1 150 . 1 1 12 12 MET HE2 H 1 2.197 0.050 . 1 . . . . 12 MET HE2 . 19095 1 151 . 1 1 12 12 MET HE3 H 1 2.197 0.050 . 1 . . . . 12 MET HE3 . 19095 1 152 . 1 1 12 12 MET C C 13 176.249 0.200 . 1 . . . . 12 MET C . 19095 1 153 . 1 1 12 12 MET CA C 13 55.632 0.200 . 1 . . . . 12 MET CA . 19095 1 154 . 1 1 12 12 MET CB C 13 34.283 0.200 . 1 . . . . 12 MET CB . 19095 1 155 . 1 1 12 12 MET CG C 13 32.473 0.200 . 1 . . . . 12 MET CG . 19095 1 156 . 1 1 12 12 MET CE C 13 18.045 0.200 . 1 . . . . 12 MET CE . 19095 1 157 . 1 1 12 12 MET N N 15 117.360 0.200 . 1 . . . . 12 MET N . 19095 1 158 . 1 1 13 13 GLU H H 1 8.734 0.050 . 1 . . . . 13 GLU H . 19095 1 159 . 1 1 13 13 GLU HA H 1 4.419 0.050 . 1 . . . . 13 GLU HA . 19095 1 160 . 1 1 13 13 GLU HB2 H 1 2.062 0.050 . 2 . . . . 13 GLU HB2 . 19095 1 161 . 1 1 13 13 GLU HB3 H 1 1.999 0.050 . 2 . . . . 13 GLU HB3 . 19095 1 162 . 1 1 13 13 GLU HG2 H 1 2.258 0.050 . 1 . . . . 13 GLU HG2 . 19095 1 163 . 1 1 13 13 GLU HG3 H 1 2.258 0.050 . 1 . . . . 13 GLU HG3 . 19095 1 164 . 1 1 13 13 GLU C C 13 175.671 0.200 . 1 . . . . 13 GLU C . 19095 1 165 . 1 1 13 13 GLU CA C 13 57.522 0.200 . 1 . . . . 13 GLU CA . 19095 1 166 . 1 1 13 13 GLU CB C 13 30.952 0.200 . 1 . . . . 13 GLU CB . 19095 1 167 . 1 1 13 13 GLU CG C 13 36.325 0.200 . 1 . . . . 13 GLU CG . 19095 1 168 . 1 1 13 13 GLU N N 15 123.436 0.200 . 1 . . . . 13 GLU N . 19095 1 169 . 1 1 14 14 SER H H 1 8.042 0.050 . 1 . . . . 14 SER H . 19095 1 170 . 1 1 14 14 SER HA H 1 4.998 0.050 . 1 . . . . 14 SER HA . 19095 1 171 . 1 1 14 14 SER HB2 H 1 3.832 0.050 . 1 . . . . 14 SER HB2 . 19095 1 172 . 1 1 14 14 SER HB3 H 1 3.832 0.050 . 1 . . . . 14 SER HB3 . 19095 1 173 . 1 1 14 14 SER C C 13 173.777 0.200 . 1 . . . . 14 SER C . 19095 1 174 . 1 1 14 14 SER CA C 13 57.878 0.200 . 1 . . . . 14 SER CA . 19095 1 175 . 1 1 14 14 SER CB C 13 63.544 0.200 . 1 . . . . 14 SER CB . 19095 1 176 . 1 1 14 14 SER N N 15 112.202 0.200 . 1 . . . . 14 SER N . 19095 1 177 . 1 1 15 15 VAL H H 1 9.117 0.050 . 1 . . . . 15 VAL H . 19095 1 178 . 1 1 15 15 VAL HA H 1 4.462 0.050 . 1 . . . . 15 VAL HA . 19095 1 179 . 1 1 15 15 VAL HB H 1 1.790 0.050 . 1 . . . . 15 VAL HB . 19095 1 180 . 1 1 15 15 VAL HG11 H 1 0.874 0.050 . 2 . . . . 15 VAL HG11 . 19095 1 181 . 1 1 15 15 VAL HG12 H 1 0.874 0.050 . 2 . . . . 15 VAL HG12 . 19095 1 182 . 1 1 15 15 VAL HG13 H 1 0.874 0.050 . 2 . . . . 15 VAL HG13 . 19095 1 183 . 1 1 15 15 VAL HG21 H 1 0.718 0.050 . 2 . . . . 15 VAL HG21 . 19095 1 184 . 1 1 15 15 VAL HG22 H 1 0.718 0.050 . 2 . . . . 15 VAL HG22 . 19095 1 185 . 1 1 15 15 VAL HG23 H 1 0.718 0.050 . 2 . . . . 15 VAL HG23 . 19095 1 186 . 1 1 15 15 VAL C C 13 172.676 0.200 . 1 . . . . 15 VAL C . 19095 1 187 . 1 1 15 15 VAL CA C 13 61.266 0.200 . 1 . . . . 15 VAL CA . 19095 1 188 . 1 1 15 15 VAL CB C 13 34.726 0.200 . 1 . . . . 15 VAL CB . 19095 1 189 . 1 1 15 15 VAL CG1 C 13 22.471 0.200 . 1 . . . . 15 VAL CG1 . 19095 1 190 . 1 1 15 15 VAL CG2 C 13 21.130 0.200 . 1 . . . . 15 VAL CG2 . 19095 1 191 . 1 1 15 15 VAL N N 15 125.640 0.200 . 1 . . . . 15 VAL N . 19095 1 192 . 1 1 16 16 ASN H H 1 8.423 0.050 . 1 . . . . 16 ASN H . 19095 1 193 . 1 1 16 16 ASN HA H 1 5.976 0.050 . 1 . . . . 16 ASN HA . 19095 1 194 . 1 1 16 16 ASN HB2 H 1 2.920 0.050 . 2 . . . . 16 ASN HB2 . 19095 1 195 . 1 1 16 16 ASN HB3 H 1 3.101 0.050 . 2 . . . . 16 ASN HB3 . 19095 1 196 . 1 1 16 16 ASN HD21 H 1 6.998 0.050 . 2 . . . . 16 ASN HD21 . 19095 1 197 . 1 1 16 16 ASN HD22 H 1 7.578 0.050 . 2 . . . . 16 ASN HD22 . 19095 1 198 . 1 1 16 16 ASN C C 13 174.382 0.200 . 1 . . . . 16 ASN C . 19095 1 199 . 1 1 16 16 ASN CA C 13 50.658 0.200 . 1 . . . . 16 ASN CA . 19095 1 200 . 1 1 16 16 ASN CB C 13 39.706 0.200 . 1 . . . . 16 ASN CB . 19095 1 201 . 1 1 16 16 ASN N N 15 125.894 0.200 . 1 . . . . 16 ASN N . 19095 1 202 . 1 1 16 16 ASN ND2 N 15 112.881 0.200 . 1 . . . . 16 ASN ND2 . 19095 1 203 . 1 1 17 17 VAL H H 1 8.807 0.050 . 1 . . . . 17 VAL H . 19095 1 204 . 1 1 17 17 VAL HA H 1 4.992 0.050 . 1 . . . . 17 VAL HA . 19095 1 205 . 1 1 17 17 VAL HB H 1 2.159 0.050 . 1 . . . . 17 VAL HB . 19095 1 206 . 1 1 17 17 VAL HG11 H 1 0.628 0.050 . 2 . . . . 17 VAL HG11 . 19095 1 207 . 1 1 17 17 VAL HG12 H 1 0.628 0.050 . 2 . . . . 17 VAL HG12 . 19095 1 208 . 1 1 17 17 VAL HG13 H 1 0.628 0.050 . 2 . . . . 17 VAL HG13 . 19095 1 209 . 1 1 17 17 VAL HG21 H 1 0.782 0.050 . 2 . . . . 17 VAL HG21 . 19095 1 210 . 1 1 17 17 VAL HG22 H 1 0.782 0.050 . 2 . . . . 17 VAL HG22 . 19095 1 211 . 1 1 17 17 VAL HG23 H 1 0.782 0.050 . 2 . . . . 17 VAL HG23 . 19095 1 212 . 1 1 17 17 VAL C C 13 174.301 0.200 . 1 . . . . 17 VAL C . 19095 1 213 . 1 1 17 17 VAL CA C 13 59.393 0.200 . 1 . . . . 17 VAL CA . 19095 1 214 . 1 1 17 17 VAL CB C 13 35.924 0.200 . 1 . . . . 17 VAL CB . 19095 1 215 . 1 1 17 17 VAL CG1 C 13 20.497 0.200 . 1 . . . . 17 VAL CG1 . 19095 1 216 . 1 1 17 17 VAL CG2 C 13 21.505 0.200 . 1 . . . . 17 VAL CG2 . 19095 1 217 . 1 1 17 17 VAL N N 15 113.901 0.200 . 1 . . . . 17 VAL N . 19095 1 218 . 1 1 18 18 THR H H 1 8.429 0.050 . 1 . . . . 18 THR H . 19095 1 219 . 1 1 18 18 THR HA H 1 5.192 0.050 . 1 . . . . 18 THR HA . 19095 1 220 . 1 1 18 18 THR HB H 1 4.059 0.050 . 1 . . . . 18 THR HB . 19095 1 221 . 1 1 18 18 THR HG21 H 1 0.787 0.050 . 1 . . . . 18 THR HG21 . 19095 1 222 . 1 1 18 18 THR HG22 H 1 0.787 0.050 . 1 . . . . 18 THR HG22 . 19095 1 223 . 1 1 18 18 THR HG23 H 1 0.787 0.050 . 1 . . . . 18 THR HG23 . 19095 1 224 . 1 1 18 18 THR C C 13 173.969 0.200 . 1 . . . . 18 THR C . 19095 1 225 . 1 1 18 18 THR CA C 13 63.302 0.200 . 1 . . . . 18 THR CA . 19095 1 226 . 1 1 18 18 THR CB C 13 69.691 0.200 . 1 . . . . 18 THR CB . 19095 1 227 . 1 1 18 18 THR CG2 C 13 21.309 0.200 . 1 . . . . 18 THR CG2 . 19095 1 228 . 1 1 18 18 THR N N 15 121.790 0.200 . 1 . . . . 18 THR N . 19095 1 229 . 1 1 19 19 VAL H H 1 8.710 0.050 . 1 . . . . 19 VAL H . 19095 1 230 . 1 1 19 19 VAL HA H 1 5.126 0.050 . 1 . . . . 19 VAL HA . 19095 1 231 . 1 1 19 19 VAL HB H 1 2.137 0.050 . 1 . . . . 19 VAL HB . 19095 1 232 . 1 1 19 19 VAL HG11 H 1 0.603 0.050 . 2 . . . . 19 VAL HG11 . 19095 1 233 . 1 1 19 19 VAL HG12 H 1 0.603 0.050 . 2 . . . . 19 VAL HG12 . 19095 1 234 . 1 1 19 19 VAL HG13 H 1 0.603 0.050 . 2 . . . . 19 VAL HG13 . 19095 1 235 . 1 1 19 19 VAL HG21 H 1 0.500 0.050 . 2 . . . . 19 VAL HG21 . 19095 1 236 . 1 1 19 19 VAL HG22 H 1 0.500 0.050 . 2 . . . . 19 VAL HG22 . 19095 1 237 . 1 1 19 19 VAL HG23 H 1 0.500 0.050 . 2 . . . . 19 VAL HG23 . 19095 1 238 . 1 1 19 19 VAL C C 13 172.820 0.200 . 1 . . . . 19 VAL C . 19095 1 239 . 1 1 19 19 VAL CA C 13 58.220 0.200 . 1 . . . . 19 VAL CA . 19095 1 240 . 1 1 19 19 VAL CB C 13 37.477 0.200 . 1 . . . . 19 VAL CB . 19095 1 241 . 1 1 19 19 VAL CG1 C 13 23.539 0.200 . 1 . . . . 19 VAL CG1 . 19095 1 242 . 1 1 19 19 VAL CG2 C 13 17.769 0.200 . 1 . . . . 19 VAL CG2 . 19095 1 243 . 1 1 19 19 VAL N N 15 114.751 0.200 . 1 . . . . 19 VAL N . 19095 1 244 . 1 1 20 20 ARG H H 1 9.397 0.050 . 1 . . . . 20 ARG H . 19095 1 245 . 1 1 20 20 ARG HA H 1 5.129 0.050 . 1 . . . . 20 ARG HA . 19095 1 246 . 1 1 20 20 ARG HB2 H 1 1.712 0.050 . 2 . . . . 20 ARG HB2 . 19095 1 247 . 1 1 20 20 ARG HB3 H 1 2.121 0.050 . 2 . . . . 20 ARG HB3 . 19095 1 248 . 1 1 20 20 ARG HG2 H 1 1.359 0.050 . 1 . . . . 20 ARG HG2 . 19095 1 249 . 1 1 20 20 ARG HG3 H 1 1.359 0.050 . 1 . . . . 20 ARG HG3 . 19095 1 250 . 1 1 20 20 ARG HD2 H 1 3.342 0.050 . 1 . . . . 20 ARG HD2 . 19095 1 251 . 1 1 20 20 ARG HD3 H 1 3.342 0.050 . 1 . . . . 20 ARG HD3 . 19095 1 252 . 1 1 20 20 ARG HE H 1 7.906 0.050 . 1 . . . . 20 ARG HE . 19095 1 253 . 1 1 20 20 ARG C C 13 176.217 0.200 . 1 . . . . 20 ARG C . 19095 1 254 . 1 1 20 20 ARG CA C 13 53.218 0.200 . 1 . . . . 20 ARG CA . 19095 1 255 . 1 1 20 20 ARG CB C 13 31.762 0.200 . 1 . . . . 20 ARG CB . 19095 1 256 . 1 1 20 20 ARG CG C 13 26.569 0.200 . 1 . . . . 20 ARG CG . 19095 1 257 . 1 1 20 20 ARG CD C 13 42.492 0.200 . 1 . . . . 20 ARG CD . 19095 1 258 . 1 1 20 20 ARG N N 15 120.564 0.200 . 1 . . . . 20 ARG N . 19095 1 259 . 1 1 20 20 ARG NE N 15 80.937 0.200 . 1 . . . . 20 ARG NE . 19095 1 260 . 1 1 21 21 VAL H H 1 9.131 0.050 . 1 . . . . 21 VAL H . 19095 1 261 . 1 1 21 21 VAL HA H 1 4.017 0.050 . 1 . . . . 21 VAL HA . 19095 1 262 . 1 1 21 21 VAL HB H 1 2.423 0.050 . 1 . . . . 21 VAL HB . 19095 1 263 . 1 1 21 21 VAL HG11 H 1 0.585 0.050 . 2 . . . . 21 VAL HG11 . 19095 1 264 . 1 1 21 21 VAL HG12 H 1 0.585 0.050 . 2 . . . . 21 VAL HG12 . 19095 1 265 . 1 1 21 21 VAL HG13 H 1 0.585 0.050 . 2 . . . . 21 VAL HG13 . 19095 1 266 . 1 1 21 21 VAL HG21 H 1 0.797 0.050 . 2 . . . . 21 VAL HG21 . 19095 1 267 . 1 1 21 21 VAL HG22 H 1 0.797 0.050 . 2 . . . . 21 VAL HG22 . 19095 1 268 . 1 1 21 21 VAL HG23 H 1 0.797 0.050 . 2 . . . . 21 VAL HG23 . 19095 1 269 . 1 1 21 21 VAL C C 13 176.190 0.200 . 1 . . . . 21 VAL C . 19095 1 270 . 1 1 21 21 VAL CA C 13 62.859 0.200 . 1 . . . . 21 VAL CA . 19095 1 271 . 1 1 21 21 VAL CB C 13 31.125 0.200 . 1 . . . . 21 VAL CB . 19095 1 272 . 1 1 21 21 VAL CG1 C 13 21.927 0.200 . 1 . . . . 21 VAL CG1 . 19095 1 273 . 1 1 21 21 VAL CG2 C 13 21.770 0.200 . 1 . . . . 21 VAL CG2 . 19095 1 274 . 1 1 21 21 VAL N N 15 126.850 0.200 . 1 . . . . 21 VAL N . 19095 1 275 . 1 1 22 22 LEU H H 1 9.379 0.050 . 1 . . . . 22 LEU H . 19095 1 276 . 1 1 22 22 LEU HA H 1 4.394 0.050 . 1 . . . . 22 LEU HA . 19095 1 277 . 1 1 22 22 LEU HB2 H 1 1.518 0.050 . 2 . . . . 22 LEU HB2 . 19095 1 278 . 1 1 22 22 LEU HB3 H 1 1.632 0.050 . 2 . . . . 22 LEU HB3 . 19095 1 279 . 1 1 22 22 LEU HG H 1 0.813 0.050 . 1 . . . . 22 LEU HG . 19095 1 280 . 1 1 22 22 LEU HD11 H 1 0.794 0.050 . 2 . . . . 22 LEU HD11 . 19095 1 281 . 1 1 22 22 LEU HD12 H 1 0.794 0.050 . 2 . . . . 22 LEU HD12 . 19095 1 282 . 1 1 22 22 LEU HD13 H 1 0.794 0.050 . 2 . . . . 22 LEU HD13 . 19095 1 283 . 1 1 22 22 LEU HD21 H 1 0.815 0.050 . 2 . . . . 22 LEU HD21 . 19095 1 284 . 1 1 22 22 LEU HD22 H 1 0.815 0.050 . 2 . . . . 22 LEU HD22 . 19095 1 285 . 1 1 22 22 LEU HD23 H 1 0.815 0.050 . 2 . . . . 22 LEU HD23 . 19095 1 286 . 1 1 22 22 LEU C C 13 176.443 0.200 . 1 . . . . 22 LEU C . 19095 1 287 . 1 1 22 22 LEU CA C 13 56.937 0.200 . 1 . . . . 22 LEU CA . 19095 1 288 . 1 1 22 22 LEU CB C 13 41.834 0.200 . 1 . . . . 22 LEU CB . 19095 1 289 . 1 1 22 22 LEU CG C 13 27.734 0.200 . 1 . . . . 22 LEU CG . 19095 1 290 . 1 1 22 22 LEU CD1 C 13 25.381 0.200 . 1 . . . . 22 LEU CD1 . 19095 1 291 . 1 1 22 22 LEU CD2 C 13 23.669 0.200 . 1 . . . . 22 LEU CD2 . 19095 1 292 . 1 1 22 22 LEU N N 15 132.769 0.200 . 1 . . . . 22 LEU N . 19095 1 293 . 1 1 23 23 GLU H H 1 7.653 0.050 . 1 . . . . 23 GLU H . 19095 1 294 . 1 1 23 23 GLU HA H 1 4.493 0.050 . 1 . . . . 23 GLU HA . 19095 1 295 . 1 1 23 23 GLU HB2 H 1 1.914 0.050 . 1 . . . . 23 GLU HB2 . 19095 1 296 . 1 1 23 23 GLU HB3 H 1 1.914 0.050 . 1 . . . . 23 GLU HB3 . 19095 1 297 . 1 1 23 23 GLU HG2 H 1 2.108 0.050 . 1 . . . . 23 GLU HG2 . 19095 1 298 . 1 1 23 23 GLU HG3 H 1 2.108 0.050 . 1 . . . . 23 GLU HG3 . 19095 1 299 . 1 1 23 23 GLU C C 13 173.862 0.200 . 1 . . . . 23 GLU C . 19095 1 300 . 1 1 23 23 GLU CA C 13 55.534 0.200 . 1 . . . . 23 GLU CA . 19095 1 301 . 1 1 23 23 GLU CB C 13 33.467 0.200 . 1 . . . . 23 GLU CB . 19095 1 302 . 1 1 23 23 GLU CG C 13 36.166 0.200 . 1 . . . . 23 GLU CG . 19095 1 303 . 1 1 23 23 GLU N N 15 116.161 0.200 . 1 . . . . 23 GLU N . 19095 1 304 . 1 1 24 24 ALA H H 1 9.251 0.050 . 1 . . . . 24 ALA H . 19095 1 305 . 1 1 24 24 ALA HA H 1 4.893 0.050 . 1 . . . . 24 ALA HA . 19095 1 306 . 1 1 24 24 ALA HB1 H 1 1.245 0.050 . 1 . . . . 24 ALA HB1 . 19095 1 307 . 1 1 24 24 ALA HB2 H 1 1.245 0.050 . 1 . . . . 24 ALA HB2 . 19095 1 308 . 1 1 24 24 ALA HB3 H 1 1.245 0.050 . 1 . . . . 24 ALA HB3 . 19095 1 309 . 1 1 24 24 ALA C C 13 175.498 0.200 . 1 . . . . 24 ALA C . 19095 1 310 . 1 1 24 24 ALA CA C 13 52.333 0.200 . 1 . . . . 24 ALA CA . 19095 1 311 . 1 1 24 24 ALA CB C 13 21.521 0.200 . 1 . . . . 24 ALA CB . 19095 1 312 . 1 1 24 24 ALA N N 15 126.540 0.200 . 1 . . . . 24 ALA N . 19095 1 313 . 1 1 25 25 SER H H 1 8.525 0.050 . 1 . . . . 25 SER H . 19095 1 314 . 1 1 25 25 SER HA H 1 4.785 0.050 . 1 . . . . 25 SER HA . 19095 1 315 . 1 1 25 25 SER HB2 H 1 4.247 0.050 . 2 . . . . 25 SER HB2 . 19095 1 316 . 1 1 25 25 SER HB3 H 1 3.977 0.050 . 2 . . . . 25 SER HB3 . 19095 1 317 . 1 1 25 25 SER C C 13 174.703 0.200 . 1 . . . . 25 SER C . 19095 1 318 . 1 1 25 25 SER CA C 13 57.508 0.200 . 1 . . . . 25 SER CA . 19095 1 319 . 1 1 25 25 SER CB C 13 65.830 0.200 . 1 . . . . 25 SER CB . 19095 1 320 . 1 1 25 25 SER N N 15 118.585 0.200 . 1 . . . . 25 SER N . 19095 1 321 . 1 1 26 26 GLU H H 1 8.803 0.050 . 1 . . . . 26 GLU H . 19095 1 322 . 1 1 26 26 GLU HA H 1 4.341 0.050 . 1 . . . . 26 GLU HA . 19095 1 323 . 1 1 26 26 GLU HB2 H 1 2.026 0.050 . 2 . . . . 26 GLU HB2 . 19095 1 324 . 1 1 26 26 GLU HB3 H 1 2.160 0.050 . 2 . . . . 26 GLU HB3 . 19095 1 325 . 1 1 26 26 GLU HG2 H 1 2.431 0.050 . 1 . . . . 26 GLU HG2 . 19095 1 326 . 1 1 26 26 GLU HG3 H 1 2.431 0.050 . 1 . . . . 26 GLU HG3 . 19095 1 327 . 1 1 26 26 GLU C C 13 176.760 0.200 . 1 . . . . 26 GLU C . 19095 1 328 . 1 1 26 26 GLU CA C 13 56.405 0.200 . 1 . . . . 26 GLU CA . 19095 1 329 . 1 1 26 26 GLU CB C 13 30.589 0.200 . 1 . . . . 26 GLU CB . 19095 1 330 . 1 1 26 26 GLU CG C 13 36.247 0.200 . 1 . . . . 26 GLU CG . 19095 1 331 . 1 1 26 26 GLU N N 15 120.493 0.200 . 1 . . . . 26 GLU N . 19095 1 332 . 1 1 27 27 ALA H H 1 8.821 0.050 . 1 . . . . 27 ALA H . 19095 1 333 . 1 1 27 27 ALA HA H 1 4.585 0.050 . 1 . . . . 27 ALA HA . 19095 1 334 . 1 1 27 27 ALA HB1 H 1 1.125 0.050 . 1 . . . . 27 ALA HB1 . 19095 1 335 . 1 1 27 27 ALA HB2 H 1 1.125 0.050 . 1 . . . . 27 ALA HB2 . 19095 1 336 . 1 1 27 27 ALA HB3 H 1 1.125 0.050 . 1 . . . . 27 ALA HB3 . 19095 1 337 . 1 1 27 27 ALA C C 13 176.839 0.200 . 1 . . . . 27 ALA C . 19095 1 338 . 1 1 27 27 ALA CA C 13 52.172 0.200 . 1 . . . . 27 ALA CA . 19095 1 339 . 1 1 27 27 ALA CB C 13 19.227 0.200 . 1 . . . . 27 ALA CB . 19095 1 340 . 1 1 27 27 ALA N N 15 124.515 0.200 . 1 . . . . 27 ALA N . 19095 1 341 . 1 1 28 28 ARG H H 1 9.391 0.050 . 1 . . . . 28 ARG H . 19095 1 342 . 1 1 28 28 ARG HA H 1 4.711 0.050 . 1 . . . . 28 ARG HA . 19095 1 343 . 1 1 28 28 ARG HB2 H 1 1.766 0.050 . 1 . . . . 28 ARG HB2 . 19095 1 344 . 1 1 28 28 ARG HB3 H 1 1.766 0.050 . 1 . . . . 28 ARG HB3 . 19095 1 345 . 1 1 28 28 ARG HG2 H 1 1.543 0.050 . 2 . . . . 28 ARG HG2 . 19095 1 346 . 1 1 28 28 ARG HG3 H 1 1.242 0.050 . 2 . . . . 28 ARG HG3 . 19095 1 347 . 1 1 28 28 ARG HD2 H 1 3.090 0.050 . 1 . . . . 28 ARG HD2 . 19095 1 348 . 1 1 28 28 ARG HD3 H 1 3.090 0.050 . 1 . . . . 28 ARG HD3 . 19095 1 349 . 1 1 28 28 ARG HE H 1 7.142 0.050 . 1 . . . . 28 ARG HE . 19095 1 350 . 1 1 28 28 ARG C C 13 173.416 0.200 . 1 . . . . 28 ARG C . 19095 1 351 . 1 1 28 28 ARG CA C 13 54.459 0.200 . 1 . . . . 28 ARG CA . 19095 1 352 . 1 1 28 28 ARG CB C 13 33.175 0.200 . 1 . . . . 28 ARG CB . 19095 1 353 . 1 1 28 28 ARG CG C 13 26.140 0.200 . 1 . . . . 28 ARG CG . 19095 1 354 . 1 1 28 28 ARG CD C 13 43.537 0.200 . 1 . . . . 28 ARG CD . 19095 1 355 . 1 1 28 28 ARG N N 15 119.574 0.200 . 1 . . . . 28 ARG N . 19095 1 356 . 1 1 28 28 ARG NE N 15 85.372 0.200 . 1 . . . . 28 ARG NE . 19095 1 357 . 1 1 29 29 GLN H H 1 8.365 0.050 . 1 . . . . 29 GLN H . 19095 1 358 . 1 1 29 29 GLN HA H 1 5.302 0.050 . 1 . . . . 29 GLN HA . 19095 1 359 . 1 1 29 29 GLN HB2 H 1 1.971 0.050 . 2 . . . . 29 GLN HB2 . 19095 1 360 . 1 1 29 29 GLN HB3 H 1 1.806 0.050 . 2 . . . . 29 GLN HB3 . 19095 1 361 . 1 1 29 29 GLN HG2 H 1 2.314 0.050 . 2 . . . . 29 GLN HG2 . 19095 1 362 . 1 1 29 29 GLN HG3 H 1 2.234 0.050 . 2 . . . . 29 GLN HG3 . 19095 1 363 . 1 1 29 29 GLN HE21 H 1 6.879 0.050 . 2 . . . . 29 GLN HE21 . 19095 1 364 . 1 1 29 29 GLN HE22 H 1 7.476 0.050 . 2 . . . . 29 GLN HE22 . 19095 1 365 . 1 1 29 29 GLN C C 13 176.564 0.200 . 1 . . . . 29 GLN C . 19095 1 366 . 1 1 29 29 GLN CA C 13 54.971 0.200 . 1 . . . . 29 GLN CA . 19095 1 367 . 1 1 29 29 GLN CB C 13 30.742 0.200 . 1 . . . . 29 GLN CB . 19095 1 368 . 1 1 29 29 GLN CG C 13 35.029 0.200 . 1 . . . . 29 GLN CG . 19095 1 369 . 1 1 29 29 GLN N N 15 118.265 0.200 . 1 . . . . 29 GLN N . 19095 1 370 . 1 1 29 29 GLN NE2 N 15 112.276 0.200 . 1 . . . . 29 GLN NE2 . 19095 1 371 . 1 1 30 30 ILE H H 1 9.285 0.050 . 1 . . . . 30 ILE H . 19095 1 372 . 1 1 30 30 ILE HA H 1 4.691 0.050 . 1 . . . . 30 ILE HA . 19095 1 373 . 1 1 30 30 ILE HB H 1 1.771 0.050 . 1 . . . . 30 ILE HB . 19095 1 374 . 1 1 30 30 ILE HG12 H 1 1.392 0.050 . 2 . . . . 30 ILE HG12 . 19095 1 375 . 1 1 30 30 ILE HG13 H 1 0.923 0.050 . 2 . . . . 30 ILE HG13 . 19095 1 376 . 1 1 30 30 ILE HG21 H 1 0.789 0.050 . 1 . . . . 30 ILE HG21 . 19095 1 377 . 1 1 30 30 ILE HG22 H 1 0.789 0.050 . 1 . . . . 30 ILE HG22 . 19095 1 378 . 1 1 30 30 ILE HG23 H 1 0.789 0.050 . 1 . . . . 30 ILE HG23 . 19095 1 379 . 1 1 30 30 ILE HD11 H 1 0.763 0.050 . 1 . . . . 30 ILE HD11 . 19095 1 380 . 1 1 30 30 ILE HD12 H 1 0.763 0.050 . 1 . . . . 30 ILE HD12 . 19095 1 381 . 1 1 30 30 ILE HD13 H 1 0.763 0.050 . 1 . . . . 30 ILE HD13 . 19095 1 382 . 1 1 30 30 ILE C C 13 173.943 0.200 . 1 . . . . 30 ILE C . 19095 1 383 . 1 1 30 30 ILE CA C 13 59.305 0.200 . 1 . . . . 30 ILE CA . 19095 1 384 . 1 1 30 30 ILE CB C 13 42.276 0.200 . 1 . . . . 30 ILE CB . 19095 1 385 . 1 1 30 30 ILE CG1 C 13 26.209 0.200 . 1 . . . . 30 ILE CG1 . 19095 1 386 . 1 1 30 30 ILE CG2 C 13 17.768 0.200 . 1 . . . . 30 ILE CG2 . 19095 1 387 . 1 1 30 30 ILE CD1 C 13 14.312 0.200 . 1 . . . . 30 ILE CD1 . 19095 1 388 . 1 1 30 30 ILE N N 15 119.373 0.200 . 1 . . . . 30 ILE N . 19095 1 389 . 1 1 31 31 GLN H H 1 8.586 0.050 . 1 . . . . 31 GLN H . 19095 1 390 . 1 1 31 31 GLN HA H 1 4.498 0.050 . 1 . . . . 31 GLN HA . 19095 1 391 . 1 1 31 31 GLN HB2 H 1 2.093 0.050 . 2 . . . . 31 GLN HB2 . 19095 1 392 . 1 1 31 31 GLN HB3 H 1 1.979 0.050 . 2 . . . . 31 GLN HB3 . 19095 1 393 . 1 1 31 31 GLN HG2 H 1 2.376 0.050 . 1 . . . . 31 GLN HG2 . 19095 1 394 . 1 1 31 31 GLN HG3 H 1 2.376 0.050 . 1 . . . . 31 GLN HG3 . 19095 1 395 . 1 1 31 31 GLN HE21 H 1 6.828 0.050 . 2 . . . . 31 GLN HE21 . 19095 1 396 . 1 1 31 31 GLN HE22 H 1 7.543 0.050 . 2 . . . . 31 GLN HE22 . 19095 1 397 . 1 1 31 31 GLN C C 13 175.896 0.200 . 1 . . . . 31 GLN C . 19095 1 398 . 1 1 31 31 GLN CA C 13 55.576 0.200 . 1 . . . . 31 GLN CA . 19095 1 399 . 1 1 31 31 GLN CB C 13 29.161 0.200 . 1 . . . . 31 GLN CB . 19095 1 400 . 1 1 31 31 GLN CG C 13 33.509 0.200 . 1 . . . . 31 GLN CG . 19095 1 401 . 1 1 31 31 GLN N N 15 122.155 0.200 . 1 . . . . 31 GLN N . 19095 1 402 . 1 1 31 31 GLN NE2 N 15 111.499 0.200 . 1 . . . . 31 GLN NE2 . 19095 1 403 . 1 1 32 32 THR H H 1 8.008 0.050 . 1 . . . . 32 THR H . 19095 1 404 . 1 1 32 32 THR HA H 1 5.025 0.050 . 1 . . . . 32 THR HA . 19095 1 405 . 1 1 32 32 THR HB H 1 4.678 0.050 . 1 . . . . 32 THR HB . 19095 1 406 . 1 1 32 32 THR HG21 H 1 1.369 0.050 . 1 . . . . 32 THR HG21 . 19095 1 407 . 1 1 32 32 THR HG22 H 1 1.369 0.050 . 1 . . . . 32 THR HG22 . 19095 1 408 . 1 1 32 32 THR HG23 H 1 1.369 0.050 . 1 . . . . 32 THR HG23 . 19095 1 409 . 1 1 32 32 THR C C 13 175.997 0.200 . 1 . . . . 32 THR C . 19095 1 410 . 1 1 32 32 THR CA C 13 60.038 0.200 . 1 . . . . 32 THR CA . 19095 1 411 . 1 1 32 32 THR CB C 13 72.843 0.200 . 1 . . . . 32 THR CB . 19095 1 412 . 1 1 32 32 THR CG2 C 13 21.664 0.200 . 1 . . . . 32 THR CG2 . 19095 1 413 . 1 1 32 32 THR N N 15 116.464 0.200 . 1 . . . . 32 THR N . 19095 1 414 . 1 1 33 33 LYS H H 1 9.101 0.050 . 1 . . . . 33 LYS H . 19095 1 415 . 1 1 33 33 LYS HA H 1 4.203 0.050 . 1 . . . . 33 LYS HA . 19095 1 416 . 1 1 33 33 LYS HB2 H 1 1.928 0.050 . 2 . . . . 33 LYS HB2 . 19095 1 417 . 1 1 33 33 LYS HB3 H 1 1.857 0.050 . 2 . . . . 33 LYS HB3 . 19095 1 418 . 1 1 33 33 LYS HG2 H 1 1.494 0.050 . 2 . . . . 33 LYS HG2 . 19095 1 419 . 1 1 33 33 LYS HG3 H 1 1.447 0.050 . 2 . . . . 33 LYS HG3 . 19095 1 420 . 1 1 33 33 LYS HD2 H 1 1.712 0.050 . 1 . . . . 33 LYS HD2 . 19095 1 421 . 1 1 33 33 LYS HD3 H 1 1.712 0.050 . 1 . . . . 33 LYS HD3 . 19095 1 422 . 1 1 33 33 LYS HE2 H 1 3.028 0.050 . 1 . . . . 33 LYS HE2 . 19095 1 423 . 1 1 33 33 LYS HE3 H 1 3.028 0.050 . 1 . . . . 33 LYS HE3 . 19095 1 424 . 1 1 33 33 LYS C C 13 176.752 0.200 . 1 . . . . 33 LYS C . 19095 1 425 . 1 1 33 33 LYS CA C 13 58.738 0.200 . 1 . . . . 33 LYS CA . 19095 1 426 . 1 1 33 33 LYS CB C 13 31.984 0.200 . 1 . . . . 33 LYS CB . 19095 1 427 . 1 1 33 33 LYS CG C 13 24.454 0.200 . 1 . . . . 33 LYS CG . 19095 1 428 . 1 1 33 33 LYS CD C 13 29.240 0.200 . 1 . . . . 33 LYS CD . 19095 1 429 . 1 1 33 33 LYS CE C 13 42.133 0.200 . 1 . . . . 33 LYS CE . 19095 1 430 . 1 1 33 33 LYS N N 15 120.792 0.200 . 1 . . . . 33 LYS N . 19095 1 431 . 1 1 34 34 ASN H H 1 8.001 0.050 . 1 . . . . 34 ASN H . 19095 1 432 . 1 1 34 34 ASN HA H 1 4.977 0.050 . 1 . . . . 34 ASN HA . 19095 1 433 . 1 1 34 34 ASN HB2 H 1 2.456 0.050 . 2 . . . . 34 ASN HB2 . 19095 1 434 . 1 1 34 34 ASN HB3 H 1 3.007 0.050 . 2 . . . . 34 ASN HB3 . 19095 1 435 . 1 1 34 34 ASN HD21 H 1 6.955 0.050 . 2 . . . . 34 ASN HD21 . 19095 1 436 . 1 1 34 34 ASN HD22 H 1 7.749 0.050 . 2 . . . . 34 ASN HD22 . 19095 1 437 . 1 1 34 34 ASN C C 13 174.229 0.200 . 1 . . . . 34 ASN C . 19095 1 438 . 1 1 34 34 ASN CA C 13 52.694 0.200 . 1 . . . . 34 ASN CA . 19095 1 439 . 1 1 34 34 ASN CB C 13 39.739 0.200 . 1 . . . . 34 ASN CB . 19095 1 440 . 1 1 34 34 ASN N N 15 115.079 0.200 . 1 . . . . 34 ASN N . 19095 1 441 . 1 1 34 34 ASN ND2 N 15 113.932 0.200 . 1 . . . . 34 ASN ND2 . 19095 1 442 . 1 1 35 35 GLY H H 1 7.519 0.050 . 1 . . . . 35 GLY H . 19095 1 443 . 1 1 35 35 GLY HA2 H 1 3.932 0.050 . 2 . . . . 35 GLY HA2 . 19095 1 444 . 1 1 35 35 GLY HA3 H 1 4.642 0.050 . 2 . . . . 35 GLY HA3 . 19095 1 445 . 1 1 35 35 GLY C C 13 174.270 0.200 . 1 . . . . 35 GLY C . 19095 1 446 . 1 1 35 35 GLY CA C 13 43.962 0.200 . 1 . . . . 35 GLY CA . 19095 1 447 . 1 1 35 35 GLY N N 15 108.126 0.200 . 1 . . . . 35 GLY N . 19095 1 448 . 1 1 36 36 VAL H H 1 8.701 0.050 . 1 . . . . 36 VAL H . 19095 1 449 . 1 1 36 36 VAL HA H 1 4.712 0.050 . 1 . . . . 36 VAL HA . 19095 1 450 . 1 1 36 36 VAL HB H 1 1.985 0.050 . 1 . . . . 36 VAL HB . 19095 1 451 . 1 1 36 36 VAL HG11 H 1 1.016 0.050 . 2 . . . . 36 VAL HG11 . 19095 1 452 . 1 1 36 36 VAL HG12 H 1 1.016 0.050 . 2 . . . . 36 VAL HG12 . 19095 1 453 . 1 1 36 36 VAL HG13 H 1 1.016 0.050 . 2 . . . . 36 VAL HG13 . 19095 1 454 . 1 1 36 36 VAL HG21 H 1 0.929 0.050 . 2 . . . . 36 VAL HG21 . 19095 1 455 . 1 1 36 36 VAL HG22 H 1 0.929 0.050 . 2 . . . . 36 VAL HG22 . 19095 1 456 . 1 1 36 36 VAL HG23 H 1 0.929 0.050 . 2 . . . . 36 VAL HG23 . 19095 1 457 . 1 1 36 36 VAL C C 13 177.183 0.200 . 1 . . . . 36 VAL C . 19095 1 458 . 1 1 36 36 VAL CA C 13 62.887 0.200 . 1 . . . . 36 VAL CA . 19095 1 459 . 1 1 36 36 VAL CB C 13 32.280 0.200 . 1 . . . . 36 VAL CB . 19095 1 460 . 1 1 36 36 VAL CG1 C 13 21.854 0.200 . 1 . . . . 36 VAL CG1 . 19095 1 461 . 1 1 36 36 VAL CG2 C 13 21.361 0.200 . 1 . . . . 36 VAL CG2 . 19095 1 462 . 1 1 36 36 VAL N N 15 122.587 0.200 . 1 . . . . 36 VAL N . 19095 1 463 . 1 1 37 37 ARG H H 1 9.183 0.050 . 1 . . . . 37 ARG H . 19095 1 464 . 1 1 37 37 ARG HA H 1 5.014 0.050 . 1 . . . . 37 ARG HA . 19095 1 465 . 1 1 37 37 ARG HB2 H 1 1.813 0.050 . 2 . . . . 37 ARG HB2 . 19095 1 466 . 1 1 37 37 ARG HB3 H 1 2.188 0.050 . 2 . . . . 37 ARG HB3 . 19095 1 467 . 1 1 37 37 ARG HG2 H 1 1.873 0.050 . 2 . . . . 37 ARG HG2 . 19095 1 468 . 1 1 37 37 ARG HG3 H 1 1.735 0.050 . 2 . . . . 37 ARG HG3 . 19095 1 469 . 1 1 37 37 ARG HD2 H 1 3.578 0.050 . 2 . . . . 37 ARG HD2 . 19095 1 470 . 1 1 37 37 ARG HD3 H 1 3.337 0.050 . 2 . . . . 37 ARG HD3 . 19095 1 471 . 1 1 37 37 ARG HE H 1 8.008 0.050 . 1 . . . . 37 ARG HE . 19095 1 472 . 1 1 37 37 ARG C C 13 174.542 0.200 . 1 . . . . 37 ARG C . 19095 1 473 . 1 1 37 37 ARG CA C 13 53.396 0.200 . 1 . . . . 37 ARG CA . 19095 1 474 . 1 1 37 37 ARG CB C 13 34.321 0.200 . 1 . . . . 37 ARG CB . 19095 1 475 . 1 1 37 37 ARG CG C 13 27.713 0.200 . 1 . . . . 37 ARG CG . 19095 1 476 . 1 1 37 37 ARG CD C 13 43.284 0.200 . 1 . . . . 37 ARG CD . 19095 1 477 . 1 1 37 37 ARG N N 15 127.527 0.200 . 1 . . . . 37 ARG N . 19095 1 478 . 1 1 37 37 ARG NE N 15 86.701 0.200 . 1 . . . . 37 ARG NE . 19095 1 479 . 1 1 38 38 THR H H 1 8.966 0.050 . 1 . . . . 38 THR H . 19095 1 480 . 1 1 38 38 THR HA H 1 5.058 0.050 . 1 . . . . 38 THR HA . 19095 1 481 . 1 1 38 38 THR HB H 1 3.932 0.050 . 1 . . . . 38 THR HB . 19095 1 482 . 1 1 38 38 THR HG21 H 1 1.098 0.050 . 1 . . . . 38 THR HG21 . 19095 1 483 . 1 1 38 38 THR HG22 H 1 1.098 0.050 . 1 . . . . 38 THR HG22 . 19095 1 484 . 1 1 38 38 THR HG23 H 1 1.098 0.050 . 1 . . . . 38 THR HG23 . 19095 1 485 . 1 1 38 38 THR C C 13 173.438 0.200 . 1 . . . . 38 THR C . 19095 1 486 . 1 1 38 38 THR CA C 13 62.353 0.200 . 1 . . . . 38 THR CA . 19095 1 487 . 1 1 38 38 THR CB C 13 69.941 0.200 . 1 . . . . 38 THR CB . 19095 1 488 . 1 1 38 38 THR CG2 C 13 22.186 0.200 . 1 . . . . 38 THR CG2 . 19095 1 489 . 1 1 38 38 THR N N 15 118.849 0.200 . 1 . . . . 38 THR N . 19095 1 490 . 1 1 39 39 ILE H H 1 8.869 0.050 . 1 . . . . 39 ILE H . 19095 1 491 . 1 1 39 39 ILE HA H 1 5.442 0.050 . 1 . . . . 39 ILE HA . 19095 1 492 . 1 1 39 39 ILE HB H 1 1.202 0.050 . 1 . . . . 39 ILE HB . 19095 1 493 . 1 1 39 39 ILE HG12 H 1 0.508 0.050 . 2 . . . . 39 ILE HG12 . 19095 1 494 . 1 1 39 39 ILE HG13 H 1 0.814 0.050 . 2 . . . . 39 ILE HG13 . 19095 1 495 . 1 1 39 39 ILE HG21 H 1 0.029 0.050 . 1 . . . . 39 ILE HG21 . 19095 1 496 . 1 1 39 39 ILE HG22 H 1 0.029 0.050 . 1 . . . . 39 ILE HG22 . 19095 1 497 . 1 1 39 39 ILE HG23 H 1 0.029 0.050 . 1 . . . . 39 ILE HG23 . 19095 1 498 . 1 1 39 39 ILE HD11 H 1 0.253 0.050 . 1 . . . . 39 ILE HD11 . 19095 1 499 . 1 1 39 39 ILE HD12 H 1 0.253 0.050 . 1 . . . . 39 ILE HD12 . 19095 1 500 . 1 1 39 39 ILE HD13 H 1 0.253 0.050 . 1 . . . . 39 ILE HD13 . 19095 1 501 . 1 1 39 39 ILE C C 13 175.759 0.200 . 1 . . . . 39 ILE C . 19095 1 502 . 1 1 39 39 ILE CA C 13 58.785 0.200 . 1 . . . . 39 ILE CA . 19095 1 503 . 1 1 39 39 ILE CB C 13 43.837 0.200 . 1 . . . . 39 ILE CB . 19095 1 504 . 1 1 39 39 ILE CG1 C 13 26.042 0.200 . 1 . . . . 39 ILE CG1 . 19095 1 505 . 1 1 39 39 ILE CG2 C 13 18.462 0.200 . 1 . . . . 39 ILE CG2 . 19095 1 506 . 1 1 39 39 ILE CD1 C 13 14.257 0.200 . 1 . . . . 39 ILE CD1 . 19095 1 507 . 1 1 39 39 ILE N N 15 120.479 0.200 . 1 . . . . 39 ILE N . 19095 1 508 . 1 1 40 40 SER H H 1 8.791 0.050 . 1 . . . . 40 SER H . 19095 1 509 . 1 1 40 40 SER HA H 1 4.563 0.050 . 1 . . . . 40 SER HA . 19095 1 510 . 1 1 40 40 SER HB2 H 1 3.338 0.050 . 2 . . . . 40 SER HB2 . 19095 1 511 . 1 1 40 40 SER HB3 H 1 4.113 0.050 . 2 . . . . 40 SER HB3 . 19095 1 512 . 1 1 40 40 SER C C 13 171.362 0.200 . 1 . . . . 40 SER C . 19095 1 513 . 1 1 40 40 SER CA C 13 58.869 0.200 . 1 . . . . 40 SER CA . 19095 1 514 . 1 1 40 40 SER CB C 13 65.798 0.200 . 1 . . . . 40 SER CB . 19095 1 515 . 1 1 40 40 SER N N 15 114.809 0.200 . 1 . . . . 40 SER N . 19095 1 516 . 1 1 41 41 GLU H H 1 8.127 0.050 . 1 . . . . 41 GLU H . 19095 1 517 . 1 1 41 41 GLU HA H 1 5.429 0.050 . 1 . . . . 41 GLU HA . 19095 1 518 . 1 1 41 41 GLU HB2 H 1 1.777 0.050 . 2 . . . . 41 GLU HB2 . 19095 1 519 . 1 1 41 41 GLU HB3 H 1 1.920 0.050 . 2 . . . . 41 GLU HB3 . 19095 1 520 . 1 1 41 41 GLU HG2 H 1 2.016 0.050 . 2 . . . . 41 GLU HG2 . 19095 1 521 . 1 1 41 41 GLU HG3 H 1 1.926 0.050 . 2 . . . . 41 GLU HG3 . 19095 1 522 . 1 1 41 41 GLU C C 13 175.825 0.200 . 1 . . . . 41 GLU C . 19095 1 523 . 1 1 41 41 GLU CA C 13 54.654 0.200 . 1 . . . . 41 GLU CA . 19095 1 524 . 1 1 41 41 GLU CB C 13 34.186 0.200 . 1 . . . . 41 GLU CB . 19095 1 525 . 1 1 41 41 GLU CG C 13 37.152 0.200 . 1 . . . . 41 GLU CG . 19095 1 526 . 1 1 41 41 GLU N N 15 117.474 0.200 . 1 . . . . 41 GLU N . 19095 1 527 . 1 1 42 42 ALA H H 1 9.383 0.050 . 1 . . . . 42 ALA H . 19095 1 528 . 1 1 42 42 ALA HA H 1 5.124 0.050 . 1 . . . . 42 ALA HA . 19095 1 529 . 1 1 42 42 ALA HB1 H 1 1.327 0.050 . 1 . . . . 42 ALA HB1 . 19095 1 530 . 1 1 42 42 ALA HB2 H 1 1.327 0.050 . 1 . . . . 42 ALA HB2 . 19095 1 531 . 1 1 42 42 ALA HB3 H 1 1.327 0.050 . 1 . . . . 42 ALA HB3 . 19095 1 532 . 1 1 42 42 ALA C C 13 175.490 0.200 . 1 . . . . 42 ALA C . 19095 1 533 . 1 1 42 42 ALA CA C 13 51.000 0.200 . 1 . . . . 42 ALA CA . 19095 1 534 . 1 1 42 42 ALA CB C 13 23.375 0.200 . 1 . . . . 42 ALA CB . 19095 1 535 . 1 1 42 42 ALA N N 15 126.512 0.200 . 1 . . . . 42 ALA N . 19095 1 536 . 1 1 43 43 ILE H H 1 8.593 0.050 . 1 . . . . 43 ILE H . 19095 1 537 . 1 1 43 43 ILE HA H 1 4.805 0.050 . 1 . . . . 43 ILE HA . 19095 1 538 . 1 1 43 43 ILE HB H 1 1.760 0.050 . 1 . . . . 43 ILE HB . 19095 1 539 . 1 1 43 43 ILE HG12 H 1 1.204 0.050 . 2 . . . . 43 ILE HG12 . 19095 1 540 . 1 1 43 43 ILE HG13 H 1 1.464 0.050 . 2 . . . . 43 ILE HG13 . 19095 1 541 . 1 1 43 43 ILE HG21 H 1 0.850 0.050 . 1 . . . . 43 ILE HG21 . 19095 1 542 . 1 1 43 43 ILE HG22 H 1 0.850 0.050 . 1 . . . . 43 ILE HG22 . 19095 1 543 . 1 1 43 43 ILE HG23 H 1 0.850 0.050 . 1 . . . . 43 ILE HG23 . 19095 1 544 . 1 1 43 43 ILE HD11 H 1 0.735 0.050 . 1 . . . . 43 ILE HD11 . 19095 1 545 . 1 1 43 43 ILE HD12 H 1 0.735 0.050 . 1 . . . . 43 ILE HD12 . 19095 1 546 . 1 1 43 43 ILE HD13 H 1 0.735 0.050 . 1 . . . . 43 ILE HD13 . 19095 1 547 . 1 1 43 43 ILE C C 13 176.138 0.200 . 1 . . . . 43 ILE C . 19095 1 548 . 1 1 43 43 ILE CA C 13 60.243 0.200 . 1 . . . . 43 ILE CA . 19095 1 549 . 1 1 43 43 ILE CB C 13 38.199 0.200 . 1 . . . . 43 ILE CB . 19095 1 550 . 1 1 43 43 ILE CG1 C 13 26.621 0.200 . 1 . . . . 43 ILE CG1 . 19095 1 551 . 1 1 43 43 ILE CG2 C 13 17.573 0.200 . 1 . . . . 43 ILE CG2 . 19095 1 552 . 1 1 43 43 ILE CD1 C 13 10.893 0.200 . 1 . . . . 43 ILE CD1 . 19095 1 553 . 1 1 43 43 ILE N N 15 120.778 0.200 . 1 . . . . 43 ILE N . 19095 1 554 . 1 1 44 44 VAL H H 1 9.067 0.050 . 1 . . . . 44 VAL H . 19095 1 555 . 1 1 44 44 VAL HA H 1 5.659 0.050 . 1 . . . . 44 VAL HA . 19095 1 556 . 1 1 44 44 VAL HB H 1 1.956 0.050 . 1 . . . . 44 VAL HB . 19095 1 557 . 1 1 44 44 VAL HG11 H 1 0.635 0.050 . 2 . . . . 44 VAL HG11 . 19095 1 558 . 1 1 44 44 VAL HG12 H 1 0.635 0.050 . 2 . . . . 44 VAL HG12 . 19095 1 559 . 1 1 44 44 VAL HG13 H 1 0.635 0.050 . 2 . . . . 44 VAL HG13 . 19095 1 560 . 1 1 44 44 VAL HG21 H 1 0.715 0.050 . 2 . . . . 44 VAL HG21 . 19095 1 561 . 1 1 44 44 VAL HG22 H 1 0.715 0.050 . 2 . . . . 44 VAL HG22 . 19095 1 562 . 1 1 44 44 VAL HG23 H 1 0.715 0.050 . 2 . . . . 44 VAL HG23 . 19095 1 563 . 1 1 44 44 VAL C C 13 174.739 0.200 . 1 . . . . 44 VAL C . 19095 1 564 . 1 1 44 44 VAL CA C 13 57.798 0.200 . 1 . . . . 44 VAL CA . 19095 1 565 . 1 1 44 44 VAL CB C 13 34.650 0.200 . 1 . . . . 44 VAL CB . 19095 1 566 . 1 1 44 44 VAL CG1 C 13 19.166 0.200 . 1 . . . . 44 VAL CG1 . 19095 1 567 . 1 1 44 44 VAL CG2 C 13 22.518 0.200 . 1 . . . . 44 VAL CG2 . 19095 1 568 . 1 1 44 44 VAL N N 15 119.777 0.200 . 1 . . . . 44 VAL N . 19095 1 569 . 1 1 45 45 GLY H H 1 8.979 0.050 . 1 . . . . 45 GLY H . 19095 1 570 . 1 1 45 45 GLY HA2 H 1 5.048 0.050 . 2 . . . . 45 GLY HA2 . 19095 1 571 . 1 1 45 45 GLY HA3 H 1 4.233 0.050 . 2 . . . . 45 GLY HA3 . 19095 1 572 . 1 1 45 45 GLY C C 13 170.890 0.200 . 1 . . . . 45 GLY C . 19095 1 573 . 1 1 45 45 GLY CA C 13 47.456 0.200 . 1 . . . . 45 GLY CA . 19095 1 574 . 1 1 45 45 GLY N N 15 105.215 0.200 . 1 . . . . 45 GLY N . 19095 1 575 . 1 1 46 46 ASP H H 1 9.315 0.050 . 1 . . . . 46 ASP H . 19095 1 576 . 1 1 46 46 ASP HA H 1 4.803 0.050 . 1 . . . . 46 ASP HA . 19095 1 577 . 1 1 46 46 ASP HB2 H 1 3.324 0.050 . 1 . . . . 46 ASP HB2 . 19095 1 578 . 1 1 46 46 ASP HB3 H 1 3.324 0.050 . 1 . . . . 46 ASP HB3 . 19095 1 579 . 1 1 46 46 ASP C C 13 174.830 0.200 . 1 . . . . 46 ASP C . 19095 1 580 . 1 1 46 46 ASP CA C 13 53.203 0.200 . 1 . . . . 46 ASP CA . 19095 1 581 . 1 1 46 46 ASP CB C 13 42.389 0.200 . 1 . . . . 46 ASP CB . 19095 1 582 . 1 1 46 46 ASP N N 15 120.944 0.200 . 1 . . . . 46 ASP N . 19095 1 583 . 1 1 47 47 GLU H H 1 10.124 0.050 . 1 . . . . 47 GLU H . 19095 1 584 . 1 1 47 47 GLU HA H 1 4.408 0.050 . 1 . . . . 47 GLU HA . 19095 1 585 . 1 1 47 47 GLU HB2 H 1 2.196 0.050 . 2 . . . . 47 GLU HB2 . 19095 1 586 . 1 1 47 47 GLU HB3 H 1 1.942 0.050 . 2 . . . . 47 GLU HB3 . 19095 1 587 . 1 1 47 47 GLU HG2 H 1 2.439 0.050 . 2 . . . . 47 GLU HG2 . 19095 1 588 . 1 1 47 47 GLU HG3 H 1 2.150 0.050 . 2 . . . . 47 GLU HG3 . 19095 1 589 . 1 1 47 47 GLU C C 13 176.200 0.200 . 1 . . . . 47 GLU C . 19095 1 590 . 1 1 47 47 GLU CA C 13 59.063 0.200 . 1 . . . . 47 GLU CA . 19095 1 591 . 1 1 47 47 GLU CB C 13 27.543 0.200 . 1 . . . . 47 GLU CB . 19095 1 592 . 1 1 47 47 GLU CG C 13 35.427 0.200 . 1 . . . . 47 GLU CG . 19095 1 593 . 1 1 47 47 GLU N N 15 116.325 0.200 . 1 . . . . 47 GLU N . 19095 1 594 . 1 1 48 48 THR H H 1 9.582 0.050 . 1 . . . . 48 THR H . 19095 1 595 . 1 1 48 48 THR HA H 1 4.613 0.050 . 1 . . . . 48 THR HA . 19095 1 596 . 1 1 48 48 THR HB H 1 4.409 0.050 . 1 . . . . 48 THR HB . 19095 1 597 . 1 1 48 48 THR HG21 H 1 1.152 0.050 . 1 . . . . 48 THR HG21 . 19095 1 598 . 1 1 48 48 THR HG22 H 1 1.152 0.050 . 1 . . . . 48 THR HG22 . 19095 1 599 . 1 1 48 48 THR HG23 H 1 1.152 0.050 . 1 . . . . 48 THR HG23 . 19095 1 600 . 1 1 48 48 THR C C 13 175.135 0.200 . 1 . . . . 48 THR C . 19095 1 601 . 1 1 48 48 THR CA C 13 62.174 0.200 . 1 . . . . 48 THR CA . 19095 1 602 . 1 1 48 48 THR CB C 13 71.280 0.200 . 1 . . . . 48 THR CB . 19095 1 603 . 1 1 48 48 THR CG2 C 13 23.206 0.200 . 1 . . . . 48 THR CG2 . 19095 1 604 . 1 1 48 48 THR N N 15 112.050 0.200 . 1 . . . . 48 THR N . 19095 1 605 . 1 1 49 49 GLY H H 1 7.760 0.050 . 1 . . . . 49 GLY H . 19095 1 606 . 1 1 49 49 GLY HA2 H 1 4.265 0.050 . 2 . . . . 49 GLY HA2 . 19095 1 607 . 1 1 49 49 GLY HA3 H 1 3.889 0.050 . 2 . . . . 49 GLY HA3 . 19095 1 608 . 1 1 49 49 GLY C C 13 168.980 0.200 . 1 . . . . 49 GLY C . 19095 1 609 . 1 1 49 49 GLY CA C 13 45.377 0.200 . 1 . . . . 49 GLY CA . 19095 1 610 . 1 1 49 49 GLY N N 15 110.867 0.200 . 1 . . . . 49 GLY N . 19095 1 611 . 1 1 50 50 ARG H H 1 8.667 0.050 . 1 . . . . 50 ARG H . 19095 1 612 . 1 1 50 50 ARG HA H 1 5.661 0.050 . 1 . . . . 50 ARG HA . 19095 1 613 . 1 1 50 50 ARG HB2 H 1 1.648 0.050 . 2 . . . . 50 ARG HB2 . 19095 1 614 . 1 1 50 50 ARG HB3 H 1 1.456 0.050 . 2 . . . . 50 ARG HB3 . 19095 1 615 . 1 1 50 50 ARG HG2 H 1 1.531 0.050 . 2 . . . . 50 ARG HG2 . 19095 1 616 . 1 1 50 50 ARG HG3 H 1 1.497 0.050 . 2 . . . . 50 ARG HG3 . 19095 1 617 . 1 1 50 50 ARG HD2 H 1 2.766 0.050 . 2 . . . . 50 ARG HD2 . 19095 1 618 . 1 1 50 50 ARG HD3 H 1 3.268 0.050 . 2 . . . . 50 ARG HD3 . 19095 1 619 . 1 1 50 50 ARG HE H 1 6.522 0.050 . 1 . . . . 50 ARG HE . 19095 1 620 . 1 1 50 50 ARG C C 13 173.559 0.200 . 1 . . . . 50 ARG C . 19095 1 621 . 1 1 50 50 ARG CA C 13 53.574 0.200 . 1 . . . . 50 ARG CA . 19095 1 622 . 1 1 50 50 ARG CB C 13 34.773 0.200 . 1 . . . . 50 ARG CB . 19095 1 623 . 1 1 50 50 ARG CG C 13 24.288 0.200 . 1 . . . . 50 ARG CG . 19095 1 624 . 1 1 50 50 ARG CD C 13 44.279 0.200 . 1 . . . . 50 ARG CD . 19095 1 625 . 1 1 50 50 ARG N N 15 114.383 0.200 . 1 . . . . 50 ARG N . 19095 1 626 . 1 1 50 50 ARG NE N 15 83.996 0.200 . 1 . . . . 50 ARG NE . 19095 1 627 . 1 1 51 51 VAL H H 1 9.254 0.050 . 1 . . . . 51 VAL H . 19095 1 628 . 1 1 51 51 VAL HA H 1 4.662 0.050 . 1 . . . . 51 VAL HA . 19095 1 629 . 1 1 51 51 VAL HB H 1 1.920 0.050 . 1 . . . . 51 VAL HB . 19095 1 630 . 1 1 51 51 VAL HG11 H 1 0.608 0.050 . 2 . . . . 51 VAL HG11 . 19095 1 631 . 1 1 51 51 VAL HG12 H 1 0.608 0.050 . 2 . . . . 51 VAL HG12 . 19095 1 632 . 1 1 51 51 VAL HG13 H 1 0.608 0.050 . 2 . . . . 51 VAL HG13 . 19095 1 633 . 1 1 51 51 VAL HG21 H 1 1.018 0.050 . 2 . . . . 51 VAL HG21 . 19095 1 634 . 1 1 51 51 VAL HG22 H 1 1.018 0.050 . 2 . . . . 51 VAL HG22 . 19095 1 635 . 1 1 51 51 VAL HG23 H 1 1.018 0.050 . 2 . . . . 51 VAL HG23 . 19095 1 636 . 1 1 51 51 VAL C C 13 172.214 0.200 . 1 . . . . 51 VAL C . 19095 1 637 . 1 1 51 51 VAL CA C 13 59.731 0.200 . 1 . . . . 51 VAL CA . 19095 1 638 . 1 1 51 51 VAL CB C 13 35.667 0.200 . 1 . . . . 51 VAL CB . 19095 1 639 . 1 1 51 51 VAL CG1 C 13 21.571 0.200 . 1 . . . . 51 VAL CG1 . 19095 1 640 . 1 1 51 51 VAL CG2 C 13 21.707 0.200 . 1 . . . . 51 VAL CG2 . 19095 1 641 . 1 1 51 51 VAL N N 15 116.410 0.200 . 1 . . . . 51 VAL N . 19095 1 642 . 1 1 52 52 LYS H H 1 8.752 0.050 . 1 . . . . 52 LYS H . 19095 1 643 . 1 1 52 52 LYS HA H 1 4.728 0.050 . 1 . . . . 52 LYS HA . 19095 1 644 . 1 1 52 52 LYS HB2 H 1 1.716 0.050 . 2 . . . . 52 LYS HB2 . 19095 1 645 . 1 1 52 52 LYS HB3 H 1 1.770 0.050 . 2 . . . . 52 LYS HB3 . 19095 1 646 . 1 1 52 52 LYS HG2 H 1 1.246 0.050 . 2 . . . . 52 LYS HG2 . 19095 1 647 . 1 1 52 52 LYS HG3 H 1 1.375 0.050 . 2 . . . . 52 LYS HG3 . 19095 1 648 . 1 1 52 52 LYS HD2 H 1 1.517 0.050 . 1 . . . . 52 LYS HD2 . 19095 1 649 . 1 1 52 52 LYS HD3 H 1 1.517 0.050 . 1 . . . . 52 LYS HD3 . 19095 1 650 . 1 1 52 52 LYS HE2 H 1 2.698 0.050 . 2 . . . . 52 LYS HE2 . 19095 1 651 . 1 1 52 52 LYS HE3 H 1 2.751 0.050 . 2 . . . . 52 LYS HE3 . 19095 1 652 . 1 1 52 52 LYS C C 13 173.944 0.200 . 1 . . . . 52 LYS C . 19095 1 653 . 1 1 52 52 LYS CA C 13 56.856 0.200 . 1 . . . . 52 LYS CA . 19095 1 654 . 1 1 52 52 LYS CB C 13 32.842 0.200 . 1 . . . . 52 LYS CB . 19095 1 655 . 1 1 52 52 LYS CG C 13 25.383 0.200 . 1 . . . . 52 LYS CG . 19095 1 656 . 1 1 52 52 LYS CD C 13 29.163 0.200 . 1 . . . . 52 LYS CD . 19095 1 657 . 1 1 52 52 LYS CE C 13 42.062 0.200 . 1 . . . . 52 LYS CE . 19095 1 658 . 1 1 52 52 LYS N N 15 126.519 0.200 . 1 . . . . 52 LYS N . 19095 1 659 . 1 1 53 53 LEU H H 1 9.165 0.050 . 1 . . . . 53 LEU H . 19095 1 660 . 1 1 53 53 LEU HA H 1 5.042 0.050 . 1 . . . . 53 LEU HA . 19095 1 661 . 1 1 53 53 LEU HB2 H 1 0.970 0.050 . 2 . . . . 53 LEU HB2 . 19095 1 662 . 1 1 53 53 LEU HB3 H 1 1.554 0.050 . 2 . . . . 53 LEU HB3 . 19095 1 663 . 1 1 53 53 LEU HG H 1 1.157 0.050 . 1 . . . . 53 LEU HG . 19095 1 664 . 1 1 53 53 LEU HD11 H 1 0.443 0.050 . 2 . . . . 53 LEU HD11 . 19095 1 665 . 1 1 53 53 LEU HD12 H 1 0.443 0.050 . 2 . . . . 53 LEU HD12 . 19095 1 666 . 1 1 53 53 LEU HD13 H 1 0.443 0.050 . 2 . . . . 53 LEU HD13 . 19095 1 667 . 1 1 53 53 LEU HD21 H 1 0.491 0.050 . 2 . . . . 53 LEU HD21 . 19095 1 668 . 1 1 53 53 LEU HD22 H 1 0.491 0.050 . 2 . . . . 53 LEU HD22 . 19095 1 669 . 1 1 53 53 LEU HD23 H 1 0.491 0.050 . 2 . . . . 53 LEU HD23 . 19095 1 670 . 1 1 53 53 LEU C C 13 174.466 0.200 . 1 . . . . 53 LEU C . 19095 1 671 . 1 1 53 53 LEU CA C 13 52.168 0.200 . 1 . . . . 53 LEU CA . 19095 1 672 . 1 1 53 53 LEU CB C 13 46.416 0.200 . 1 . . . . 53 LEU CB . 19095 1 673 . 1 1 53 53 LEU CG C 13 27.575 0.200 . 1 . . . . 53 LEU CG . 19095 1 674 . 1 1 53 53 LEU CD1 C 13 22.908 0.200 . 1 . . . . 53 LEU CD1 . 19095 1 675 . 1 1 53 53 LEU CD2 C 13 27.943 0.200 . 1 . . . . 53 LEU CD2 . 19095 1 676 . 1 1 53 53 LEU N N 15 128.378 0.200 . 1 . . . . 53 LEU N . 19095 1 677 . 1 1 54 54 THR H H 1 8.584 0.050 . 1 . . . . 54 THR H . 19095 1 678 . 1 1 54 54 THR HA H 1 4.436 0.050 . 1 . . . . 54 THR HA . 19095 1 679 . 1 1 54 54 THR HB H 1 3.851 0.050 . 1 . . . . 54 THR HB . 19095 1 680 . 1 1 54 54 THR HG21 H 1 0.307 0.050 . 1 . . . . 54 THR HG21 . 19095 1 681 . 1 1 54 54 THR HG22 H 1 0.307 0.050 . 1 . . . . 54 THR HG22 . 19095 1 682 . 1 1 54 54 THR HG23 H 1 0.307 0.050 . 1 . . . . 54 THR HG23 . 19095 1 683 . 1 1 54 54 THR C C 13 172.319 0.200 . 1 . . . . 54 THR C . 19095 1 684 . 1 1 54 54 THR CA C 13 63.034 0.200 . 1 . . . . 54 THR CA . 19095 1 685 . 1 1 54 54 THR CB C 13 69.177 0.200 . 1 . . . . 54 THR CB . 19095 1 686 . 1 1 54 54 THR CG2 C 13 21.361 0.200 . 1 . . . . 54 THR CG2 . 19095 1 687 . 1 1 54 54 THR N N 15 124.028 0.200 . 1 . . . . 54 THR N . 19095 1 688 . 1 1 55 55 LEU H H 1 8.911 0.050 . 1 . . . . 55 LEU H . 19095 1 689 . 1 1 55 55 LEU HA H 1 4.496 0.050 . 1 . . . . 55 LEU HA . 19095 1 690 . 1 1 55 55 LEU HB2 H 1 1.980 0.050 . 2 . . . . 55 LEU HB2 . 19095 1 691 . 1 1 55 55 LEU HB3 H 1 0.959 0.050 . 2 . . . . 55 LEU HB3 . 19095 1 692 . 1 1 55 55 LEU HG H 1 1.169 0.050 . 1 . . . . 55 LEU HG . 19095 1 693 . 1 1 55 55 LEU HD11 H 1 0.692 0.050 . 2 . . . . 55 LEU HD11 . 19095 1 694 . 1 1 55 55 LEU HD12 H 1 0.692 0.050 . 2 . . . . 55 LEU HD12 . 19095 1 695 . 1 1 55 55 LEU HD13 H 1 0.692 0.050 . 2 . . . . 55 LEU HD13 . 19095 1 696 . 1 1 55 55 LEU HD21 H 1 0.629 0.050 . 2 . . . . 55 LEU HD21 . 19095 1 697 . 1 1 55 55 LEU HD22 H 1 0.629 0.050 . 2 . . . . 55 LEU HD22 . 19095 1 698 . 1 1 55 55 LEU HD23 H 1 0.629 0.050 . 2 . . . . 55 LEU HD23 . 19095 1 699 . 1 1 55 55 LEU C C 13 174.086 0.200 . 1 . . . . 55 LEU C . 19095 1 700 . 1 1 55 55 LEU CA C 13 54.991 0.200 . 1 . . . . 55 LEU CA . 19095 1 701 . 1 1 55 55 LEU CB C 13 40.490 0.200 . 1 . . . . 55 LEU CB . 19095 1 702 . 1 1 55 55 LEU CG C 13 27.799 0.200 . 1 . . . . 55 LEU CG . 19095 1 703 . 1 1 55 55 LEU CD1 C 13 26.194 0.200 . 1 . . . . 55 LEU CD1 . 19095 1 704 . 1 1 55 55 LEU CD2 C 13 26.160 0.200 . 1 . . . . 55 LEU CD2 . 19095 1 705 . 1 1 55 55 LEU N N 15 128.285 0.200 . 1 . . . . 55 LEU N . 19095 1 706 . 1 1 56 56 TRP H H 1 8.726 0.050 . 1 . . . . 56 TRP H . 19095 1 707 . 1 1 56 56 TRP HA H 1 5.013 0.050 . 1 . . . . 56 TRP HA . 19095 1 708 . 1 1 56 56 TRP HB2 H 1 3.616 0.050 . 1 . . . . 56 TRP HB2 . 19095 1 709 . 1 1 56 56 TRP HB3 H 1 3.616 0.050 . 1 . . . . 56 TRP HB3 . 19095 1 710 . 1 1 56 56 TRP HD1 H 1 7.031 0.050 . 1 . . . . 56 TRP HD1 . 19095 1 711 . 1 1 56 56 TRP HE1 H 1 10.265 0.050 . 1 . . . . 56 TRP HE1 . 19095 1 712 . 1 1 56 56 TRP HE3 H 1 7.676 0.050 . 1 . . . . 56 TRP HE3 . 19095 1 713 . 1 1 56 56 TRP HZ2 H 1 7.547 0.050 . 1 . . . . 56 TRP HZ2 . 19095 1 714 . 1 1 56 56 TRP HZ3 H 1 6.821 0.050 . 1 . . . . 56 TRP HZ3 . 19095 1 715 . 1 1 56 56 TRP HH2 H 1 7.210 0.050 . 1 . . . . 56 TRP HH2 . 19095 1 716 . 1 1 56 56 TRP C C 13 179.704 0.200 . 1 . . . . 56 TRP C . 19095 1 717 . 1 1 56 56 TRP CA C 13 56.818 0.200 . 1 . . . . 56 TRP CA . 19095 1 718 . 1 1 56 56 TRP CB C 13 31.365 0.200 . 1 . . . . 56 TRP CB . 19095 1 719 . 1 1 56 56 TRP CD1 C 13 127.223 0.200 . 1 . . . . 56 TRP CD1 . 19095 1 720 . 1 1 56 56 TRP CE3 C 13 121.439 0.200 . 1 . . . . 56 TRP CE3 . 19095 1 721 . 1 1 56 56 TRP CZ2 C 13 114.691 0.200 . 1 . . . . 56 TRP CZ2 . 19095 1 722 . 1 1 56 56 TRP CZ3 C 13 120.823 0.200 . 1 . . . . 56 TRP CZ3 . 19095 1 723 . 1 1 56 56 TRP CH2 C 13 124.460 0.200 . 1 . . . . 56 TRP CH2 . 19095 1 724 . 1 1 56 56 TRP N N 15 121.397 0.200 . 1 . . . . 56 TRP N . 19095 1 725 . 1 1 56 56 TRP NE1 N 15 129.348 0.200 . 1 . . . . 56 TRP NE1 . 19095 1 726 . 1 1 57 57 GLY H H 1 9.370 0.050 . 1 . . . . 57 GLY H . 19095 1 727 . 1 1 57 57 GLY HA2 H 1 4.084 0.050 . 2 . . . . 57 GLY HA2 . 19095 1 728 . 1 1 57 57 GLY HA3 H 1 3.981 0.050 . 2 . . . . 57 GLY HA3 . 19095 1 729 . 1 1 57 57 GLY C C 13 177.562 0.200 . 1 . . . . 57 GLY C . 19095 1 730 . 1 1 57 57 GLY CA C 13 47.685 0.200 . 1 . . . . 57 GLY CA . 19095 1 731 . 1 1 57 57 GLY N N 15 110.976 0.200 . 1 . . . . 57 GLY N . 19095 1 732 . 1 1 58 58 LYS H H 1 8.953 0.050 . 1 . . . . 58 LYS H . 19095 1 733 . 1 1 58 58 LYS HA H 1 4.135 0.050 . 1 . . . . 58 LYS HA . 19095 1 734 . 1 1 58 58 LYS HB2 H 1 1.789 0.050 . 1 . . . . 58 LYS HB2 . 19095 1 735 . 1 1 58 58 LYS HB3 H 1 1.789 0.050 . 1 . . . . 58 LYS HB3 . 19095 1 736 . 1 1 58 58 LYS HG2 H 1 1.245 0.050 . 2 . . . . 58 LYS HG2 . 19095 1 737 . 1 1 58 58 LYS HG3 H 1 0.833 0.050 . 2 . . . . 58 LYS HG3 . 19095 1 738 . 1 1 58 58 LYS HD2 H 1 1.597 0.050 . 1 . . . . 58 LYS HD2 . 19095 1 739 . 1 1 58 58 LYS HD3 H 1 1.597 0.050 . 1 . . . . 58 LYS HD3 . 19095 1 740 . 1 1 58 58 LYS HE2 H 1 2.872 0.050 . 1 . . . . 58 LYS HE2 . 19095 1 741 . 1 1 58 58 LYS HE3 H 1 2.872 0.050 . 1 . . . . 58 LYS HE3 . 19095 1 742 . 1 1 58 58 LYS C C 13 176.639 0.200 . 1 . . . . 58 LYS C . 19095 1 743 . 1 1 58 58 LYS CA C 13 58.028 0.200 . 1 . . . . 58 LYS CA . 19095 1 744 . 1 1 58 58 LYS CB C 13 31.479 0.200 . 1 . . . . 58 LYS CB . 19095 1 745 . 1 1 58 58 LYS CG C 13 23.702 0.200 . 1 . . . . 58 LYS CG . 19095 1 746 . 1 1 58 58 LYS CD C 13 29.226 0.200 . 1 . . . . 58 LYS CD . 19095 1 747 . 1 1 58 58 LYS CE C 13 42.232 0.200 . 1 . . . . 58 LYS CE . 19095 1 748 . 1 1 58 58 LYS N N 15 127.417 0.200 . 1 . . . . 58 LYS N . 19095 1 749 . 1 1 59 59 HIS H H 1 7.525 0.050 . 1 . . . . 59 HIS H . 19095 1 750 . 1 1 59 59 HIS HA H 1 4.579 0.050 . 1 . . . . 59 HIS HA . 19095 1 751 . 1 1 59 59 HIS HB2 H 1 2.857 0.050 . 2 . . . . 59 HIS HB2 . 19095 1 752 . 1 1 59 59 HIS HB3 H 1 2.968 0.050 . 2 . . . . 59 HIS HB3 . 19095 1 753 . 1 1 59 59 HIS HD2 H 1 6.885 0.050 . 1 . . . . 59 HIS HD2 . 19095 1 754 . 1 1 59 59 HIS HE1 H 1 7.926 0.050 . 1 . . . . 59 HIS HE1 . 19095 1 755 . 1 1 59 59 HIS C C 13 177.992 0.200 . 1 . . . . 59 HIS C . 19095 1 756 . 1 1 59 59 HIS CA C 13 55.971 0.200 . 1 . . . . 59 HIS CA . 19095 1 757 . 1 1 59 59 HIS CB C 13 32.535 0.200 . 1 . . . . 59 HIS CB . 19095 1 758 . 1 1 59 59 HIS CD2 C 13 118.651 0.200 . 1 . . . . 59 HIS CD2 . 19095 1 759 . 1 1 59 59 HIS CE1 C 13 139.433 0.200 . 1 . . . . 59 HIS CE1 . 19095 1 760 . 1 1 59 59 HIS N N 15 114.698 0.200 . 1 . . . . 59 HIS N . 19095 1 761 . 1 1 60 60 ALA H H 1 7.850 0.050 . 1 . . . . 60 ALA H . 19095 1 762 . 1 1 60 60 ALA HA H 1 4.031 0.050 . 1 . . . . 60 ALA HA . 19095 1 763 . 1 1 60 60 ALA HB1 H 1 1.224 0.050 . 1 . . . . 60 ALA HB1 . 19095 1 764 . 1 1 60 60 ALA HB2 H 1 1.224 0.050 . 1 . . . . 60 ALA HB2 . 19095 1 765 . 1 1 60 60 ALA HB3 H 1 1.224 0.050 . 1 . . . . 60 ALA HB3 . 19095 1 766 . 1 1 60 60 ALA C C 13 178.989 0.200 . 1 . . . . 60 ALA C . 19095 1 767 . 1 1 60 60 ALA CA C 13 53.628 0.200 . 1 . . . . 60 ALA CA . 19095 1 768 . 1 1 60 60 ALA CB C 13 18.671 0.200 . 1 . . . . 60 ALA CB . 19095 1 769 . 1 1 60 60 ALA N N 15 125.214 0.200 . 1 . . . . 60 ALA N . 19095 1 770 . 1 1 61 61 GLY H H 1 9.315 0.050 . 1 . . . . 61 GLY H . 19095 1 771 . 1 1 61 61 GLY HA2 H 1 4.065 0.050 . 2 . . . . 61 GLY HA2 . 19095 1 772 . 1 1 61 61 GLY HA3 H 1 4.030 0.050 . 2 . . . . 61 GLY HA3 . 19095 1 773 . 1 1 61 61 GLY C C 13 175.973 0.200 . 1 . . . . 61 GLY C . 19095 1 774 . 1 1 61 61 GLY CA C 13 46.029 0.200 . 1 . . . . 61 GLY CA . 19095 1 775 . 1 1 61 61 GLY N N 15 109.463 0.200 . 1 . . . . 61 GLY N . 19095 1 776 . 1 1 62 62 SER H H 1 7.713 0.050 . 1 . . . . 62 SER H . 19095 1 777 . 1 1 62 62 SER HA H 1 4.267 0.050 . 1 . . . . 62 SER HA . 19095 1 778 . 1 1 62 62 SER HB2 H 1 3.739 0.050 . 2 . . . . 62 SER HB2 . 19095 1 779 . 1 1 62 62 SER HB3 H 1 4.071 0.050 . 2 . . . . 62 SER HB3 . 19095 1 780 . 1 1 62 62 SER C C 13 174.416 0.200 . 1 . . . . 62 SER C . 19095 1 781 . 1 1 62 62 SER CA C 13 60.725 0.200 . 1 . . . . 62 SER CA . 19095 1 782 . 1 1 62 62 SER CB C 13 64.857 0.200 . 1 . . . . 62 SER CB . 19095 1 783 . 1 1 62 62 SER N N 15 111.393 0.200 . 1 . . . . 62 SER N . 19095 1 784 . 1 1 63 63 ILE H H 1 7.202 0.050 . 1 . . . . 63 ILE H . 19095 1 785 . 1 1 63 63 ILE HA H 1 5.015 0.050 . 1 . . . . 63 ILE HA . 19095 1 786 . 1 1 63 63 ILE HB H 1 1.778 0.050 . 1 . . . . 63 ILE HB . 19095 1 787 . 1 1 63 63 ILE HG12 H 1 1.071 0.050 . 2 . . . . 63 ILE HG12 . 19095 1 788 . 1 1 63 63 ILE HG13 H 1 0.944 0.050 . 2 . . . . 63 ILE HG13 . 19095 1 789 . 1 1 63 63 ILE HG21 H 1 0.730 0.050 . 1 . . . . 63 ILE HG21 . 19095 1 790 . 1 1 63 63 ILE HG22 H 1 0.730 0.050 . 1 . . . . 63 ILE HG22 . 19095 1 791 . 1 1 63 63 ILE HG23 H 1 0.730 0.050 . 1 . . . . 63 ILE HG23 . 19095 1 792 . 1 1 63 63 ILE HD11 H 1 0.511 0.050 . 1 . . . . 63 ILE HD11 . 19095 1 793 . 1 1 63 63 ILE HD12 H 1 0.511 0.050 . 1 . . . . 63 ILE HD12 . 19095 1 794 . 1 1 63 63 ILE HD13 H 1 0.511 0.050 . 1 . . . . 63 ILE HD13 . 19095 1 795 . 1 1 63 63 ILE C C 13 174.500 0.200 . 1 . . . . 63 ILE C . 19095 1 796 . 1 1 63 63 ILE CA C 13 59.402 0.200 . 1 . . . . 63 ILE CA . 19095 1 797 . 1 1 63 63 ILE CB C 13 40.834 0.200 . 1 . . . . 63 ILE CB . 19095 1 798 . 1 1 63 63 ILE CG1 C 13 23.827 0.200 . 1 . . . . 63 ILE CG1 . 19095 1 799 . 1 1 63 63 ILE CG2 C 13 17.235 0.200 . 1 . . . . 63 ILE CG2 . 19095 1 800 . 1 1 63 63 ILE CD1 C 13 14.048 0.200 . 1 . . . . 63 ILE CD1 . 19095 1 801 . 1 1 63 63 ILE N N 15 113.680 0.200 . 1 . . . . 63 ILE N . 19095 1 802 . 1 1 64 64 LYS H H 1 8.422 0.050 . 1 . . . . 64 LYS H . 19095 1 803 . 1 1 64 64 LYS HA H 1 4.548 0.050 . 1 . . . . 64 LYS HA . 19095 1 804 . 1 1 64 64 LYS HB2 H 1 1.736 0.050 . 2 . . . . 64 LYS HB2 . 19095 1 805 . 1 1 64 64 LYS HB3 H 1 1.508 0.050 . 2 . . . . 64 LYS HB3 . 19095 1 806 . 1 1 64 64 LYS HG2 H 1 1.286 0.050 . 1 . . . . 64 LYS HG2 . 19095 1 807 . 1 1 64 64 LYS HG3 H 1 1.286 0.050 . 1 . . . . 64 LYS HG3 . 19095 1 808 . 1 1 64 64 LYS HD2 H 1 1.592 0.050 . 2 . . . . 64 LYS HD2 . 19095 1 809 . 1 1 64 64 LYS HD3 H 1 1.612 0.050 . 2 . . . . 64 LYS HD3 . 19095 1 810 . 1 1 64 64 LYS HE2 H 1 2.919 0.050 . 1 . . . . 64 LYS HE2 . 19095 1 811 . 1 1 64 64 LYS HE3 H 1 2.919 0.050 . 1 . . . . 64 LYS HE3 . 19095 1 812 . 1 1 64 64 LYS C C 13 175.043 0.200 . 1 . . . . 64 LYS C . 19095 1 813 . 1 1 64 64 LYS CA C 13 54.005 0.200 . 1 . . . . 64 LYS CA . 19095 1 814 . 1 1 64 64 LYS CB C 13 36.111 0.200 . 1 . . . . 64 LYS CB . 19095 1 815 . 1 1 64 64 LYS CG C 13 24.345 0.200 . 1 . . . . 64 LYS CG . 19095 1 816 . 1 1 64 64 LYS CD C 13 29.083 0.200 . 1 . . . . 64 LYS CD . 19095 1 817 . 1 1 64 64 LYS CE C 13 42.241 0.200 . 1 . . . . 64 LYS CE . 19095 1 818 . 1 1 64 64 LYS N N 15 120.384 0.200 . 1 . . . . 64 LYS N . 19095 1 819 . 1 1 65 65 GLU H H 1 8.695 0.050 . 1 . . . . 65 GLU H . 19095 1 820 . 1 1 65 65 GLU HA H 1 3.430 0.050 . 1 . . . . 65 GLU HA . 19095 1 821 . 1 1 65 65 GLU HB2 H 1 1.888 0.050 . 2 . . . . 65 GLU HB2 . 19095 1 822 . 1 1 65 65 GLU HB3 H 1 1.946 0.050 . 2 . . . . 65 GLU HB3 . 19095 1 823 . 1 1 65 65 GLU HG2 H 1 2.107 0.050 . 2 . . . . 65 GLU HG2 . 19095 1 824 . 1 1 65 65 GLU HG3 H 1 2.271 0.050 . 2 . . . . 65 GLU HG3 . 19095 1 825 . 1 1 65 65 GLU C C 13 176.565 0.200 . 1 . . . . 65 GLU C . 19095 1 826 . 1 1 65 65 GLU CA C 13 58.481 0.200 . 1 . . . . 65 GLU CA . 19095 1 827 . 1 1 65 65 GLU CB C 13 29.310 0.200 . 1 . . . . 65 GLU CB . 19095 1 828 . 1 1 65 65 GLU CG C 13 36.091 0.200 . 1 . . . . 65 GLU CG . 19095 1 829 . 1 1 65 65 GLU N N 15 120.819 0.200 . 1 . . . . 65 GLU N . 19095 1 830 . 1 1 66 66 GLY H H 1 9.077 0.050 . 1 . . . . 66 GLY H . 19095 1 831 . 1 1 66 66 GLY HA2 H 1 4.497 0.050 . 2 . . . . 66 GLY HA2 . 19095 1 832 . 1 1 66 66 GLY HA3 H 1 3.711 0.050 . 2 . . . . 66 GLY HA3 . 19095 1 833 . 1 1 66 66 GLY C C 13 174.774 0.200 . 1 . . . . 66 GLY C . 19095 1 834 . 1 1 66 66 GLY CA C 13 45.223 0.200 . 1 . . . . 66 GLY CA . 19095 1 835 . 1 1 66 66 GLY N N 15 114.129 0.200 . 1 . . . . 66 GLY N . 19095 1 836 . 1 1 67 67 GLN H H 1 7.606 0.050 . 1 . . . . 67 GLN H . 19095 1 837 . 1 1 67 67 GLN HA H 1 4.263 0.050 . 1 . . . . 67 GLN HA . 19095 1 838 . 1 1 67 67 GLN HB2 H 1 2.166 0.050 . 1 . . . . 67 GLN HB2 . 19095 1 839 . 1 1 67 67 GLN HB3 H 1 2.166 0.050 . 1 . . . . 67 GLN HB3 . 19095 1 840 . 1 1 67 67 GLN HG2 H 1 2.377 0.050 . 1 . . . . 67 GLN HG2 . 19095 1 841 . 1 1 67 67 GLN HG3 H 1 2.377 0.050 . 1 . . . . 67 GLN HG3 . 19095 1 842 . 1 1 67 67 GLN HE21 H 1 6.914 0.050 . 2 . . . . 67 GLN HE21 . 19095 1 843 . 1 1 67 67 GLN HE22 H 1 7.541 0.050 . 2 . . . . 67 GLN HE22 . 19095 1 844 . 1 1 67 67 GLN C C 13 175.048 0.200 . 1 . . . . 67 GLN C . 19095 1 845 . 1 1 67 67 GLN CA C 13 56.941 0.200 . 1 . . . . 67 GLN CA . 19095 1 846 . 1 1 67 67 GLN CB C 13 31.036 0.200 . 1 . . . . 67 GLN CB . 19095 1 847 . 1 1 67 67 GLN CG C 13 35.383 0.200 . 1 . . . . 67 GLN CG . 19095 1 848 . 1 1 67 67 GLN N N 15 119.336 0.200 . 1 . . . . 67 GLN N . 19095 1 849 . 1 1 67 67 GLN NE2 N 15 110.372 0.200 . 1 . . . . 67 GLN NE2 . 19095 1 850 . 1 1 68 68 VAL H H 1 8.543 0.050 . 1 . . . . 68 VAL H . 19095 1 851 . 1 1 68 68 VAL HA H 1 4.686 0.050 . 1 . . . . 68 VAL HA . 19095 1 852 . 1 1 68 68 VAL HB H 1 1.627 0.050 . 1 . . . . 68 VAL HB . 19095 1 853 . 1 1 68 68 VAL HG11 H 1 -0.126 0.050 . 2 . . . . 68 VAL HG11 . 19095 1 854 . 1 1 68 68 VAL HG12 H 1 -0.126 0.050 . 2 . . . . 68 VAL HG12 . 19095 1 855 . 1 1 68 68 VAL HG13 H 1 -0.126 0.050 . 2 . . . . 68 VAL HG13 . 19095 1 856 . 1 1 68 68 VAL HG21 H 1 0.660 0.050 . 2 . . . . 68 VAL HG21 . 19095 1 857 . 1 1 68 68 VAL HG22 H 1 0.660 0.050 . 2 . . . . 68 VAL HG22 . 19095 1 858 . 1 1 68 68 VAL HG23 H 1 0.660 0.050 . 2 . . . . 68 VAL HG23 . 19095 1 859 . 1 1 68 68 VAL C C 13 175.902 0.200 . 1 . . . . 68 VAL C . 19095 1 860 . 1 1 68 68 VAL CA C 13 61.689 0.200 . 1 . . . . 68 VAL CA . 19095 1 861 . 1 1 68 68 VAL CB C 13 31.582 0.200 . 1 . . . . 68 VAL CB . 19095 1 862 . 1 1 68 68 VAL CG1 C 13 20.209 0.200 . 1 . . . . 68 VAL CG1 . 19095 1 863 . 1 1 68 68 VAL CG2 C 13 21.567 0.200 . 1 . . . . 68 VAL CG2 . 19095 1 864 . 1 1 68 68 VAL N N 15 122.928 0.200 . 1 . . . . 68 VAL N . 19095 1 865 . 1 1 69 69 VAL H H 1 9.011 0.050 . 1 . . . . 69 VAL H . 19095 1 866 . 1 1 69 69 VAL HA H 1 4.995 0.050 . 1 . . . . 69 VAL HA . 19095 1 867 . 1 1 69 69 VAL HB H 1 1.748 0.050 . 1 . . . . 69 VAL HB . 19095 1 868 . 1 1 69 69 VAL HG11 H 1 0.486 0.050 . 2 . . . . 69 VAL HG11 . 19095 1 869 . 1 1 69 69 VAL HG12 H 1 0.486 0.050 . 2 . . . . 69 VAL HG12 . 19095 1 870 . 1 1 69 69 VAL HG13 H 1 0.486 0.050 . 2 . . . . 69 VAL HG13 . 19095 1 871 . 1 1 69 69 VAL HG21 H 1 0.572 0.050 . 2 . . . . 69 VAL HG21 . 19095 1 872 . 1 1 69 69 VAL HG22 H 1 0.572 0.050 . 2 . . . . 69 VAL HG22 . 19095 1 873 . 1 1 69 69 VAL HG23 H 1 0.572 0.050 . 2 . . . . 69 VAL HG23 . 19095 1 874 . 1 1 69 69 VAL C C 13 173.490 0.200 . 1 . . . . 69 VAL C . 19095 1 875 . 1 1 69 69 VAL CA C 13 58.007 0.200 . 1 . . . . 69 VAL CA . 19095 1 876 . 1 1 69 69 VAL CB C 13 34.987 0.200 . 1 . . . . 69 VAL CB . 19095 1 877 . 1 1 69 69 VAL CG1 C 13 18.059 0.200 . 1 . . . . 69 VAL CG1 . 19095 1 878 . 1 1 69 69 VAL CG2 C 13 21.722 0.200 . 1 . . . . 69 VAL CG2 . 19095 1 879 . 1 1 69 69 VAL N N 15 117.650 0.200 . 1 . . . . 69 VAL N . 19095 1 880 . 1 1 70 70 LYS H H 1 9.121 0.050 . 1 . . . . 70 LYS H . 19095 1 881 . 1 1 70 70 LYS HA H 1 4.864 0.050 . 1 . . . . 70 LYS HA . 19095 1 882 . 1 1 70 70 LYS HB2 H 1 1.759 0.050 . 2 . . . . 70 LYS HB2 . 19095 1 883 . 1 1 70 70 LYS HB3 H 1 1.520 0.050 . 2 . . . . 70 LYS HB3 . 19095 1 884 . 1 1 70 70 LYS HG2 H 1 1.369 0.050 . 2 . . . . 70 LYS HG2 . 19095 1 885 . 1 1 70 70 LYS HG3 H 1 1.263 0.050 . 2 . . . . 70 LYS HG3 . 19095 1 886 . 1 1 70 70 LYS HD2 H 1 1.627 0.050 . 1 . . . . 70 LYS HD2 . 19095 1 887 . 1 1 70 70 LYS HD3 H 1 1.627 0.050 . 1 . . . . 70 LYS HD3 . 19095 1 888 . 1 1 70 70 LYS HE2 H 1 2.977 0.050 . 1 . . . . 70 LYS HE2 . 19095 1 889 . 1 1 70 70 LYS HE3 H 1 2.977 0.050 . 1 . . . . 70 LYS HE3 . 19095 1 890 . 1 1 70 70 LYS C C 13 175.426 0.200 . 1 . . . . 70 LYS C . 19095 1 891 . 1 1 70 70 LYS CA C 13 55.270 0.200 . 1 . . . . 70 LYS CA . 19095 1 892 . 1 1 70 70 LYS CB C 13 34.105 0.200 . 1 . . . . 70 LYS CB . 19095 1 893 . 1 1 70 70 LYS CG C 13 25.254 0.200 . 1 . . . . 70 LYS CG . 19095 1 894 . 1 1 70 70 LYS CD C 13 29.181 0.200 . 1 . . . . 70 LYS CD . 19095 1 895 . 1 1 70 70 LYS CE C 13 42.182 0.200 . 1 . . . . 70 LYS CE . 19095 1 896 . 1 1 70 70 LYS N N 15 123.046 0.200 . 1 . . . . 70 LYS N . 19095 1 897 . 1 1 71 71 ILE H H 1 9.222 0.050 . 1 . . . . 71 ILE H . 19095 1 898 . 1 1 71 71 ILE HA H 1 4.739 0.050 . 1 . . . . 71 ILE HA . 19095 1 899 . 1 1 71 71 ILE HB H 1 1.800 0.050 . 1 . . . . 71 ILE HB . 19095 1 900 . 1 1 71 71 ILE HG12 H 1 1.482 0.050 . 2 . . . . 71 ILE HG12 . 19095 1 901 . 1 1 71 71 ILE HG13 H 1 0.644 0.050 . 2 . . . . 71 ILE HG13 . 19095 1 902 . 1 1 71 71 ILE HG21 H 1 0.624 0.050 . 1 . . . . 71 ILE HG21 . 19095 1 903 . 1 1 71 71 ILE HG22 H 1 0.624 0.050 . 1 . . . . 71 ILE HG22 . 19095 1 904 . 1 1 71 71 ILE HG23 H 1 0.624 0.050 . 1 . . . . 71 ILE HG23 . 19095 1 905 . 1 1 71 71 ILE HD11 H 1 0.429 0.050 . 1 . . . . 71 ILE HD11 . 19095 1 906 . 1 1 71 71 ILE HD12 H 1 0.429 0.050 . 1 . . . . 71 ILE HD12 . 19095 1 907 . 1 1 71 71 ILE HD13 H 1 0.429 0.050 . 1 . . . . 71 ILE HD13 . 19095 1 908 . 1 1 71 71 ILE C C 13 175.007 0.200 . 1 . . . . 71 ILE C . 19095 1 909 . 1 1 71 71 ILE CA C 13 60.446 0.200 . 1 . . . . 71 ILE CA . 19095 1 910 . 1 1 71 71 ILE CB C 13 38.591 0.200 . 1 . . . . 71 ILE CB . 19095 1 911 . 1 1 71 71 ILE CG1 C 13 27.069 0.200 . 1 . . . . 71 ILE CG1 . 19095 1 912 . 1 1 71 71 ILE CG2 C 13 18.204 0.200 . 1 . . . . 71 ILE CG2 . 19095 1 913 . 1 1 71 71 ILE CD1 C 13 13.785 0.200 . 1 . . . . 71 ILE CD1 . 19095 1 914 . 1 1 71 71 ILE N N 15 127.452 0.200 . 1 . . . . 71 ILE N . 19095 1 915 . 1 1 72 72 GLU H H 1 9.342 0.050 . 1 . . . . 72 GLU H . 19095 1 916 . 1 1 72 72 GLU HA H 1 4.996 0.050 . 1 . . . . 72 GLU HA . 19095 1 917 . 1 1 72 72 GLU HB2 H 1 1.993 0.050 . 2 . . . . 72 GLU HB2 . 19095 1 918 . 1 1 72 72 GLU HB3 H 1 1.874 0.050 . 2 . . . . 72 GLU HB3 . 19095 1 919 . 1 1 72 72 GLU HG2 H 1 2.130 0.050 . 2 . . . . 72 GLU HG2 . 19095 1 920 . 1 1 72 72 GLU HG3 H 1 2.035 0.050 . 2 . . . . 72 GLU HG3 . 19095 1 921 . 1 1 72 72 GLU C C 13 175.876 0.200 . 1 . . . . 72 GLU C . 19095 1 922 . 1 1 72 72 GLU CA C 13 54.003 0.200 . 1 . . . . 72 GLU CA . 19095 1 923 . 1 1 72 72 GLU CB C 13 33.195 0.200 . 1 . . . . 72 GLU CB . 19095 1 924 . 1 1 72 72 GLU CG C 13 36.834 0.200 . 1 . . . . 72 GLU CG . 19095 1 925 . 1 1 72 72 GLU N N 15 126.177 0.200 . 1 . . . . 72 GLU N . 19095 1 926 . 1 1 73 73 ASN H H 1 8.961 0.050 . 1 . . . . 73 ASN H . 19095 1 927 . 1 1 73 73 ASN HA H 1 4.392 0.050 . 1 . . . . 73 ASN HA . 19095 1 928 . 1 1 73 73 ASN HB2 H 1 3.783 0.050 . 2 . . . . 73 ASN HB2 . 19095 1 929 . 1 1 73 73 ASN HB3 H 1 2.840 0.050 . 2 . . . . 73 ASN HB3 . 19095 1 930 . 1 1 73 73 ASN HD21 H 1 7.062 0.050 . 2 . . . . 73 ASN HD21 . 19095 1 931 . 1 1 73 73 ASN HD22 H 1 7.342 0.050 . 2 . . . . 73 ASN HD22 . 19095 1 932 . 1 1 73 73 ASN C C 13 177.397 0.200 . 1 . . . . 73 ASN C . 19095 1 933 . 1 1 73 73 ASN CA C 13 54.660 0.200 . 1 . . . . 73 ASN CA . 19095 1 934 . 1 1 73 73 ASN CB C 13 36.875 0.200 . 1 . . . . 73 ASN CB . 19095 1 935 . 1 1 73 73 ASN N N 15 121.508 0.200 . 1 . . . . 73 ASN N . 19095 1 936 . 1 1 73 73 ASN ND2 N 15 111.188 0.200 . 1 . . . . 73 ASN ND2 . 19095 1 937 . 1 1 74 74 ALA H H 1 9.104 0.050 . 1 . . . . 74 ALA H . 19095 1 938 . 1 1 74 74 ALA HA H 1 4.905 0.050 . 1 . . . . 74 ALA HA . 19095 1 939 . 1 1 74 74 ALA HB1 H 1 1.294 0.050 . 1 . . . . 74 ALA HB1 . 19095 1 940 . 1 1 74 74 ALA HB2 H 1 1.294 0.050 . 1 . . . . 74 ALA HB2 . 19095 1 941 . 1 1 74 74 ALA HB3 H 1 1.294 0.050 . 1 . . . . 74 ALA HB3 . 19095 1 942 . 1 1 74 74 ALA C C 13 175.175 0.200 . 1 . . . . 74 ALA C . 19095 1 943 . 1 1 74 74 ALA CA C 13 52.271 0.200 . 1 . . . . 74 ALA CA . 19095 1 944 . 1 1 74 74 ALA CB C 13 20.774 0.200 . 1 . . . . 74 ALA CB . 19095 1 945 . 1 1 74 74 ALA N N 15 124.007 0.200 . 1 . . . . 74 ALA N . 19095 1 946 . 1 1 75 75 TRP H H 1 8.128 0.050 . 1 . . . . 75 TRP H . 19095 1 947 . 1 1 75 75 TRP HA H 1 5.526 0.050 . 1 . . . . 75 TRP HA . 19095 1 948 . 1 1 75 75 TRP HB2 H 1 3.772 0.050 . 2 . . . . 75 TRP HB2 . 19095 1 949 . 1 1 75 75 TRP HB3 H 1 3.377 0.050 . 2 . . . . 75 TRP HB3 . 19095 1 950 . 1 1 75 75 TRP HD1 H 1 7.042 0.050 . 1 . . . . 75 TRP HD1 . 19095 1 951 . 1 1 75 75 TRP HE1 H 1 10.100 0.050 . 1 . . . . 75 TRP HE1 . 19095 1 952 . 1 1 75 75 TRP HE3 H 1 7.538 0.050 . 1 . . . . 75 TRP HE3 . 19095 1 953 . 1 1 75 75 TRP HZ2 H 1 6.958 0.050 . 1 . . . . 75 TRP HZ2 . 19095 1 954 . 1 1 75 75 TRP HZ3 H 1 6.988 0.050 . 1 . . . . 75 TRP HZ3 . 19095 1 955 . 1 1 75 75 TRP HH2 H 1 6.702 0.050 . 1 . . . . 75 TRP HH2 . 19095 1 956 . 1 1 75 75 TRP C C 13 176.533 0.200 . 1 . . . . 75 TRP C . 19095 1 957 . 1 1 75 75 TRP CA C 13 56.951 0.200 . 1 . . . . 75 TRP CA . 19095 1 958 . 1 1 75 75 TRP CB C 13 32.563 0.200 . 1 . . . . 75 TRP CB . 19095 1 959 . 1 1 75 75 TRP CD1 C 13 127.835 0.200 . 1 . . . . 75 TRP CD1 . 19095 1 960 . 1 1 75 75 TRP CE3 C 13 121.933 0.200 . 1 . . . . 75 TRP CE3 . 19095 1 961 . 1 1 75 75 TRP CZ2 C 13 113.995 0.200 . 1 . . . . 75 TRP CZ2 . 19095 1 962 . 1 1 75 75 TRP CZ3 C 13 122.037 0.200 . 1 . . . . 75 TRP CZ3 . 19095 1 963 . 1 1 75 75 TRP CH2 C 13 123.353 0.200 . 1 . . . . 75 TRP CH2 . 19095 1 964 . 1 1 75 75 TRP N N 15 115.152 0.200 . 1 . . . . 75 TRP N . 19095 1 965 . 1 1 75 75 TRP NE1 N 15 130.404 0.200 . 1 . . . . 75 TRP NE1 . 19095 1 966 . 1 1 76 76 THR H H 1 9.146 0.050 . 1 . . . . 76 THR H . 19095 1 967 . 1 1 76 76 THR HA H 1 5.816 0.050 . 1 . . . . 76 THR HA . 19095 1 968 . 1 1 76 76 THR HB H 1 4.438 0.050 . 1 . . . . 76 THR HB . 19095 1 969 . 1 1 76 76 THR HG21 H 1 1.136 0.050 . 1 . . . . 76 THR HG21 . 19095 1 970 . 1 1 76 76 THR HG22 H 1 1.136 0.050 . 1 . . . . 76 THR HG22 . 19095 1 971 . 1 1 76 76 THR HG23 H 1 1.136 0.050 . 1 . . . . 76 THR HG23 . 19095 1 972 . 1 1 76 76 THR C C 13 175.123 0.200 . 1 . . . . 76 THR C . 19095 1 973 . 1 1 76 76 THR CA C 13 58.177 0.200 . 1 . . . . 76 THR CA . 19095 1 974 . 1 1 76 76 THR CB C 13 72.150 0.200 . 1 . . . . 76 THR CB . 19095 1 975 . 1 1 76 76 THR CG2 C 13 24.129 0.200 . 1 . . . . 76 THR CG2 . 19095 1 976 . 1 1 76 76 THR N N 15 110.659 0.200 . 1 . . . . 76 THR N . 19095 1 977 . 1 1 77 77 THR H H 1 8.788 0.050 . 1 . . . . 77 THR H . 19095 1 978 . 1 1 77 77 THR HA H 1 4.823 0.050 . 1 . . . . 77 THR HA . 19095 1 979 . 1 1 77 77 THR HB H 1 4.555 0.050 . 1 . . . . 77 THR HB . 19095 1 980 . 1 1 77 77 THR HG21 H 1 1.464 0.050 . 1 . . . . 77 THR HG21 . 19095 1 981 . 1 1 77 77 THR HG22 H 1 1.464 0.050 . 1 . . . . 77 THR HG22 . 19095 1 982 . 1 1 77 77 THR HG23 H 1 1.464 0.050 . 1 . . . . 77 THR HG23 . 19095 1 983 . 1 1 77 77 THR C C 13 173.083 0.200 . 1 . . . . 77 THR C . 19095 1 984 . 1 1 77 77 THR CA C 13 59.626 0.200 . 1 . . . . 77 THR CA . 19095 1 985 . 1 1 77 77 THR CB C 13 72.099 0.200 . 1 . . . . 77 THR CB . 19095 1 986 . 1 1 77 77 THR CG2 C 13 23.916 0.200 . 1 . . . . 77 THR CG2 . 19095 1 987 . 1 1 77 77 THR N N 15 112.692 0.200 . 1 . . . . 77 THR N . 19095 1 988 . 1 1 78 78 ALA H H 1 8.690 0.050 . 1 . . . . 78 ALA H . 19095 1 989 . 1 1 78 78 ALA HA H 1 5.295 0.050 . 1 . . . . 78 ALA HA . 19095 1 990 . 1 1 78 78 ALA HB1 H 1 1.250 0.050 . 1 . . . . 78 ALA HB1 . 19095 1 991 . 1 1 78 78 ALA HB2 H 1 1.250 0.050 . 1 . . . . 78 ALA HB2 . 19095 1 992 . 1 1 78 78 ALA HB3 H 1 1.250 0.050 . 1 . . . . 78 ALA HB3 . 19095 1 993 . 1 1 78 78 ALA C C 13 176.963 0.200 . 1 . . . . 78 ALA C . 19095 1 994 . 1 1 78 78 ALA CA C 13 50.980 0.200 . 1 . . . . 78 ALA CA . 19095 1 995 . 1 1 78 78 ALA CB C 13 21.639 0.200 . 1 . . . . 78 ALA CB . 19095 1 996 . 1 1 78 78 ALA N N 15 121.327 0.200 . 1 . . . . 78 ALA N . 19095 1 997 . 1 1 79 79 PHE H H 1 9.054 0.050 . 1 . . . . 79 PHE H . 19095 1 998 . 1 1 79 79 PHE HA H 1 4.730 0.050 . 1 . . . . 79 PHE HA . 19095 1 999 . 1 1 79 79 PHE HB2 H 1 3.008 0.050 . 2 . . . . 79 PHE HB2 . 19095 1 1000 . 1 1 79 79 PHE HB3 H 1 2.814 0.050 . 2 . . . . 79 PHE HB3 . 19095 1 1001 . 1 1 79 79 PHE HD1 H 1 7.317 0.050 . 3 . . . . 79 PHE HD1 . 19095 1 1002 . 1 1 79 79 PHE HD2 H 1 7.317 0.050 . 3 . . . . 79 PHE HD2 . 19095 1 1003 . 1 1 79 79 PHE HE1 H 1 7.353 0.050 . 3 . . . . 79 PHE HE1 . 19095 1 1004 . 1 1 79 79 PHE HE2 H 1 7.353 0.050 . 3 . . . . 79 PHE HE2 . 19095 1 1005 . 1 1 79 79 PHE HZ H 1 7.396 0.050 . 1 . . . . 79 PHE HZ . 19095 1 1006 . 1 1 79 79 PHE C C 13 174.708 0.200 . 1 . . . . 79 PHE C . 19095 1 1007 . 1 1 79 79 PHE CA C 13 57.901 0.200 . 1 . . . . 79 PHE CA . 19095 1 1008 . 1 1 79 79 PHE CB C 13 41.452 0.200 . 1 . . . . 79 PHE CB . 19095 1 1009 . 1 1 79 79 PHE CD1 C 13 131.687 0.200 . 3 . . . . 79 PHE CD1 . 19095 1 1010 . 1 1 79 79 PHE CD2 C 13 131.687 0.200 . 3 . . . . 79 PHE CD2 . 19095 1 1011 . 1 1 79 79 PHE CE1 C 13 130.017 0.200 . 3 . . . . 79 PHE CE1 . 19095 1 1012 . 1 1 79 79 PHE CE2 C 13 130.017 0.200 . 3 . . . . 79 PHE CE2 . 19095 1 1013 . 1 1 79 79 PHE CZ C 13 130.043 0.200 . 1 . . . . 79 PHE CZ . 19095 1 1014 . 1 1 79 79 PHE N N 15 122.795 0.200 . 1 . . . . 79 PHE N . 19095 1 1015 . 1 1 80 80 LYS H H 1 9.259 0.050 . 1 . . . . 80 LYS H . 19095 1 1016 . 1 1 80 80 LYS HA H 1 3.633 0.050 . 1 . . . . 80 LYS HA . 19095 1 1017 . 1 1 80 80 LYS HB2 H 1 1.411 0.050 . 2 . . . . 80 LYS HB2 . 19095 1 1018 . 1 1 80 80 LYS HB3 H 1 1.737 0.050 . 2 . . . . 80 LYS HB3 . 19095 1 1019 . 1 1 80 80 LYS HG2 H 1 0.754 0.050 . 2 . . . . 80 LYS HG2 . 19095 1 1020 . 1 1 80 80 LYS HG3 H 1 0.428 0.050 . 2 . . . . 80 LYS HG3 . 19095 1 1021 . 1 1 80 80 LYS HD2 H 1 1.433 0.050 . 1 . . . . 80 LYS HD2 . 19095 1 1022 . 1 1 80 80 LYS HD3 H 1 1.433 0.050 . 1 . . . . 80 LYS HD3 . 19095 1 1023 . 1 1 80 80 LYS HE2 H 1 2.810 0.050 . 1 . . . . 80 LYS HE2 . 19095 1 1024 . 1 1 80 80 LYS HE3 H 1 2.810 0.050 . 1 . . . . 80 LYS HE3 . 19095 1 1025 . 1 1 80 80 LYS C C 13 176.287 0.200 . 1 . . . . 80 LYS C . 19095 1 1026 . 1 1 80 80 LYS CA C 13 57.306 0.200 . 1 . . . . 80 LYS CA . 19095 1 1027 . 1 1 80 80 LYS CB C 13 30.150 0.200 . 1 . . . . 80 LYS CB . 19095 1 1028 . 1 1 80 80 LYS CG C 13 24.820 0.200 . 1 . . . . 80 LYS CG . 19095 1 1029 . 1 1 80 80 LYS CD C 13 29.361 0.200 . 1 . . . . 80 LYS CD . 19095 1 1030 . 1 1 80 80 LYS CE C 13 42.128 0.200 . 1 . . . . 80 LYS CE . 19095 1 1031 . 1 1 80 80 LYS N N 15 127.865 0.200 . 1 . . . . 80 LYS N . 19095 1 1032 . 1 1 81 81 GLY H H 1 8.660 0.050 . 1 . . . . 81 GLY H . 19095 1 1033 . 1 1 81 81 GLY HA2 H 1 4.205 0.050 . 2 . . . . 81 GLY HA2 . 19095 1 1034 . 1 1 81 81 GLY HA3 H 1 3.638 0.050 . 2 . . . . 81 GLY HA3 . 19095 1 1035 . 1 1 81 81 GLY C C 13 174.337 0.200 . 1 . . . . 81 GLY C . 19095 1 1036 . 1 1 81 81 GLY CA C 13 45.650 0.200 . 1 . . . . 81 GLY CA . 19095 1 1037 . 1 1 81 81 GLY N N 15 104.110 0.200 . 1 . . . . 81 GLY N . 19095 1 1038 . 1 1 82 82 GLN H H 1 8.137 0.050 . 1 . . . . 82 GLN H . 19095 1 1039 . 1 1 82 82 GLN HA H 1 4.802 0.050 . 1 . . . . 82 GLN HA . 19095 1 1040 . 1 1 82 82 GLN HB2 H 1 2.161 0.050 . 2 . . . . 82 GLN HB2 . 19095 1 1041 . 1 1 82 82 GLN HB3 H 1 2.219 0.050 . 2 . . . . 82 GLN HB3 . 19095 1 1042 . 1 1 82 82 GLN HG2 H 1 2.440 0.050 . 2 . . . . 82 GLN HG2 . 19095 1 1043 . 1 1 82 82 GLN HG3 H 1 2.362 0.050 . 2 . . . . 82 GLN HG3 . 19095 1 1044 . 1 1 82 82 GLN HE21 H 1 6.775 0.050 . 2 . . . . 82 GLN HE21 . 19095 1 1045 . 1 1 82 82 GLN HE22 H 1 7.241 0.050 . 2 . . . . 82 GLN HE22 . 19095 1 1046 . 1 1 82 82 GLN C C 13 175.229 0.200 . 1 . . . . 82 GLN C . 19095 1 1047 . 1 1 82 82 GLN CA C 13 54.373 0.200 . 1 . . . . 82 GLN CA . 19095 1 1048 . 1 1 82 82 GLN CB C 13 31.371 0.200 . 1 . . . . 82 GLN CB . 19095 1 1049 . 1 1 82 82 GLN CG C 13 34.095 0.200 . 1 . . . . 82 GLN CG . 19095 1 1050 . 1 1 82 82 GLN N N 15 120.823 0.200 . 1 . . . . 82 GLN N . 19095 1 1051 . 1 1 82 82 GLN NE2 N 15 111.294 0.200 . 1 . . . . 82 GLN NE2 . 19095 1 1052 . 1 1 83 83 VAL H H 1 8.051 0.050 . 1 . . . . 83 VAL H . 19095 1 1053 . 1 1 83 83 VAL HA H 1 4.222 0.050 . 1 . . . . 83 VAL HA . 19095 1 1054 . 1 1 83 83 VAL HB H 1 1.708 0.050 . 1 . . . . 83 VAL HB . 19095 1 1055 . 1 1 83 83 VAL HG11 H 1 0.684 0.050 . 1 . . . . 83 VAL HG1 . 19095 1 1056 . 1 1 83 83 VAL HG12 H 1 0.684 0.050 . 1 . . . . 83 VAL HG1 . 19095 1 1057 . 1 1 83 83 VAL HG13 H 1 0.684 0.050 . 1 . . . . 83 VAL HG1 . 19095 1 1058 . 1 1 83 83 VAL HG21 H 1 0.684 0.050 . 1 . . . . 83 VAL HG2 . 19095 1 1059 . 1 1 83 83 VAL HG22 H 1 0.684 0.050 . 1 . . . . 83 VAL HG2 . 19095 1 1060 . 1 1 83 83 VAL HG23 H 1 0.684 0.050 . 1 . . . . 83 VAL HG2 . 19095 1 1061 . 1 1 83 83 VAL C C 13 173.652 0.200 . 1 . . . . 83 VAL C . 19095 1 1062 . 1 1 83 83 VAL CA C 13 63.174 0.200 . 1 . . . . 83 VAL CA . 19095 1 1063 . 1 1 83 83 VAL CB C 13 31.943 0.200 . 1 . . . . 83 VAL CB . 19095 1 1064 . 1 1 83 83 VAL CG1 C 13 23.219 0.200 . 1 . . . . 83 VAL CG1 . 19095 1 1065 . 1 1 83 83 VAL CG2 C 13 22.248 0.200 . 1 . . . . 83 VAL CG2 . 19095 1 1066 . 1 1 83 83 VAL N N 15 123.557 0.200 . 1 . . . . 83 VAL N . 19095 1 1067 . 1 1 84 84 GLN H H 1 8.691 0.050 . 1 . . . . 84 GLN H . 19095 1 1068 . 1 1 84 84 GLN HA H 1 4.695 0.050 . 1 . . . . 84 GLN HA . 19095 1 1069 . 1 1 84 84 GLN HB2 H 1 2.021 0.050 . 2 . . . . 84 GLN HB2 . 19095 1 1070 . 1 1 84 84 GLN HB3 H 1 1.854 0.050 . 2 . . . . 84 GLN HB3 . 19095 1 1071 . 1 1 84 84 GLN HG2 H 1 2.205 0.050 . 2 . . . . 84 GLN HG2 . 19095 1 1072 . 1 1 84 84 GLN HG3 H 1 2.158 0.050 . 2 . . . . 84 GLN HG3 . 19095 1 1073 . 1 1 84 84 GLN HE21 H 1 6.997 0.050 . 2 . . . . 84 GLN HE21 . 19095 1 1074 . 1 1 84 84 GLN HE22 H 1 7.626 0.050 . 2 . . . . 84 GLN HE22 . 19095 1 1075 . 1 1 84 84 GLN C C 13 174.258 0.200 . 1 . . . . 84 GLN C . 19095 1 1076 . 1 1 84 84 GLN CA C 13 54.307 0.200 . 1 . . . . 84 GLN CA . 19095 1 1077 . 1 1 84 84 GLN CB C 13 31.446 0.200 . 1 . . . . 84 GLN CB . 19095 1 1078 . 1 1 84 84 GLN CG C 13 34.188 0.200 . 1 . . . . 84 GLN CG . 19095 1 1079 . 1 1 84 84 GLN N N 15 123.908 0.200 . 1 . . . . 84 GLN N . 19095 1 1080 . 1 1 84 84 GLN NE2 N 15 111.911 0.200 . 1 . . . . 84 GLN NE2 . 19095 1 1081 . 1 1 85 85 LEU H H 1 8.991 0.050 . 1 . . . . 85 LEU H . 19095 1 1082 . 1 1 85 85 LEU HA H 1 4.614 0.050 . 1 . . . . 85 LEU HA . 19095 1 1083 . 1 1 85 85 LEU HB2 H 1 1.107 0.050 . 2 . . . . 85 LEU HB2 . 19095 1 1084 . 1 1 85 85 LEU HB3 H 1 1.551 0.050 . 2 . . . . 85 LEU HB3 . 19095 1 1085 . 1 1 85 85 LEU HG H 1 1.356 0.050 . 1 . . . . 85 LEU HG . 19095 1 1086 . 1 1 85 85 LEU HD11 H 1 0.625 0.050 . 2 . . . . 85 LEU HD11 . 19095 1 1087 . 1 1 85 85 LEU HD12 H 1 0.625 0.050 . 2 . . . . 85 LEU HD12 . 19095 1 1088 . 1 1 85 85 LEU HD13 H 1 0.625 0.050 . 2 . . . . 85 LEU HD13 . 19095 1 1089 . 1 1 85 85 LEU HD21 H 1 0.549 0.050 . 2 . . . . 85 LEU HD21 . 19095 1 1090 . 1 1 85 85 LEU HD22 H 1 0.549 0.050 . 2 . . . . 85 LEU HD22 . 19095 1 1091 . 1 1 85 85 LEU HD23 H 1 0.549 0.050 . 2 . . . . 85 LEU HD23 . 19095 1 1092 . 1 1 85 85 LEU C C 13 175.173 0.200 . 1 . . . . 85 LEU C . 19095 1 1093 . 1 1 85 85 LEU CA C 13 53.406 0.200 . 1 . . . . 85 LEU CA . 19095 1 1094 . 1 1 85 85 LEU CB C 13 46.478 0.200 . 1 . . . . 85 LEU CB . 19095 1 1095 . 1 1 85 85 LEU CG C 13 26.116 0.200 . 1 . . . . 85 LEU CG . 19095 1 1096 . 1 1 85 85 LEU CD1 C 13 25.228 0.200 . 1 . . . . 85 LEU CD1 . 19095 1 1097 . 1 1 85 85 LEU CD2 C 13 25.687 0.200 . 1 . . . . 85 LEU CD2 . 19095 1 1098 . 1 1 85 85 LEU N N 15 124.399 0.200 . 1 . . . . 85 LEU N . 19095 1 1099 . 1 1 86 86 ASN H H 1 8.150 0.050 . 1 . . . . 86 ASN H . 19095 1 1100 . 1 1 86 86 ASN HA H 1 5.270 0.050 . 1 . . . . 86 ASN HA . 19095 1 1101 . 1 1 86 86 ASN HB2 H 1 0.416 0.050 . 2 . . . . 86 ASN HB2 . 19095 1 1102 . 1 1 86 86 ASN HB3 H 1 0.836 0.050 . 2 . . . . 86 ASN HB3 . 19095 1 1103 . 1 1 86 86 ASN HD21 H 1 5.751 0.050 . 2 . . . . 86 ASN HD21 . 19095 1 1104 . 1 1 86 86 ASN HD22 H 1 6.798 0.050 . 2 . . . . 86 ASN HD22 . 19095 1 1105 . 1 1 86 86 ASN C C 13 171.675 0.200 . 1 . . . . 86 ASN C . 19095 1 1106 . 1 1 86 86 ASN CA C 13 53.090 0.200 . 1 . . . . 86 ASN CA . 19095 1 1107 . 1 1 86 86 ASN CB C 13 42.613 0.200 . 1 . . . . 86 ASN CB . 19095 1 1108 . 1 1 86 86 ASN N N 15 121.121 0.200 . 1 . . . . 86 ASN N . 19095 1 1109 . 1 1 86 86 ASN ND2 N 15 113.744 0.200 . 1 . . . . 86 ASN ND2 . 19095 1 1110 . 1 1 87 87 ALA H H 1 8.545 0.050 . 1 . . . . 87 ALA H . 19095 1 1111 . 1 1 87 87 ALA HA H 1 4.986 0.050 . 1 . . . . 87 ALA HA . 19095 1 1112 . 1 1 87 87 ALA HB1 H 1 0.966 0.050 . 1 . . . . 87 ALA HB1 . 19095 1 1113 . 1 1 87 87 ALA HB2 H 1 0.966 0.050 . 1 . . . . 87 ALA HB2 . 19095 1 1114 . 1 1 87 87 ALA HB3 H 1 0.966 0.050 . 1 . . . . 87 ALA HB3 . 19095 1 1115 . 1 1 87 87 ALA C C 13 175.113 0.200 . 1 . . . . 87 ALA C . 19095 1 1116 . 1 1 87 87 ALA CA C 13 49.327 0.200 . 1 . . . . 87 ALA CA . 19095 1 1117 . 1 1 87 87 ALA CB C 13 22.222 0.200 . 1 . . . . 87 ALA CB . 19095 1 1118 . 1 1 87 87 ALA N N 15 120.850 0.200 . 1 . . . . 87 ALA N . 19095 1 1119 . 1 1 88 88 GLY H H 1 8.436 0.050 . 1 . . . . 88 GLY H . 19095 1 1120 . 1 1 88 88 GLY HA2 H 1 4.398 0.050 . 2 . . . . 88 GLY HA2 . 19095 1 1121 . 1 1 88 88 GLY HA3 H 1 5.238 0.050 . 2 . . . . 88 GLY HA3 . 19095 1 1122 . 1 1 88 88 GLY C C 13 176.258 0.200 . 1 . . . . 88 GLY C . 19095 1 1123 . 1 1 88 88 GLY CA C 13 44.536 0.200 . 1 . . . . 88 GLY CA . 19095 1 1124 . 1 1 88 88 GLY N N 15 110.342 0.200 . 1 . . . . 88 GLY N . 19095 1 1125 . 1 1 89 89 SER H H 1 10.126 0.050 . 1 . . . . 89 SER H . 19095 1 1126 . 1 1 89 89 SER HA H 1 4.222 0.050 . 1 . . . . 89 SER HA . 19095 1 1127 . 1 1 89 89 SER HB2 H 1 4.052 0.050 . 1 . . . . 89 SER HB2 . 19095 1 1128 . 1 1 89 89 SER HB3 H 1 4.052 0.050 . 1 . . . . 89 SER HB3 . 19095 1 1129 . 1 1 89 89 SER C C 13 176.726 0.200 . 1 . . . . 89 SER C . 19095 1 1130 . 1 1 89 89 SER CA C 13 62.835 0.200 . 1 . . . . 89 SER CA . 19095 1 1131 . 1 1 89 89 SER CB C 13 62.882 0.200 . 1 . . . . 89 SER CB . 19095 1 1132 . 1 1 89 89 SER N N 15 122.079 0.200 . 1 . . . . 89 SER N . 19095 1 1133 . 1 1 90 90 LYS H H 1 9.083 0.050 . 1 . . . . 90 LYS H . 19095 1 1134 . 1 1 90 90 LYS HA H 1 4.629 0.050 . 1 . . . . 90 LYS HA . 19095 1 1135 . 1 1 90 90 LYS HB2 H 1 1.964 0.050 . 1 . . . . 90 LYS HB2 . 19095 1 1136 . 1 1 90 90 LYS HB3 H 1 1.964 0.050 . 1 . . . . 90 LYS HB3 . 19095 1 1137 . 1 1 90 90 LYS HG2 H 1 1.489 0.050 . 2 . . . . 90 LYS HG2 . 19095 1 1138 . 1 1 90 90 LYS HG3 H 1 1.566 0.050 . 2 . . . . 90 LYS HG3 . 19095 1 1139 . 1 1 90 90 LYS HD2 H 1 1.663 0.050 . 1 . . . . 90 LYS HD2 . 19095 1 1140 . 1 1 90 90 LYS HD3 H 1 1.663 0.050 . 1 . . . . 90 LYS HD3 . 19095 1 1141 . 1 1 90 90 LYS HE2 H 1 2.912 0.050 . 2 . . . . 90 LYS HE2 . 19095 1 1142 . 1 1 90 90 LYS HE3 H 1 2.952 0.050 . 2 . . . . 90 LYS HE3 . 19095 1 1143 . 1 1 90 90 LYS C C 13 176.281 0.200 . 1 . . . . 90 LYS C . 19095 1 1144 . 1 1 90 90 LYS CA C 13 55.959 0.200 . 1 . . . . 90 LYS CA . 19095 1 1145 . 1 1 90 90 LYS CB C 13 32.010 0.200 . 1 . . . . 90 LYS CB . 19095 1 1146 . 1 1 90 90 LYS CG C 13 24.396 0.200 . 1 . . . . 90 LYS CG . 19095 1 1147 . 1 1 90 90 LYS CD C 13 29.348 0.200 . 1 . . . . 90 LYS CD . 19095 1 1148 . 1 1 90 90 LYS CE C 13 42.232 0.200 . 1 . . . . 90 LYS CE . 19095 1 1149 . 1 1 90 90 LYS N N 15 119.796 0.200 . 1 . . . . 90 LYS N . 19095 1 1150 . 1 1 91 91 THR H H 1 8.490 0.050 . 1 . . . . 91 THR H . 19095 1 1151 . 1 1 91 91 THR HA H 1 4.988 0.050 . 1 . . . . 91 THR HA . 19095 1 1152 . 1 1 91 91 THR HB H 1 4.200 0.050 . 1 . . . . 91 THR HB . 19095 1 1153 . 1 1 91 91 THR HG21 H 1 1.123 0.050 . 1 . . . . 91 THR HG21 . 19095 1 1154 . 1 1 91 91 THR HG22 H 1 1.123 0.050 . 1 . . . . 91 THR HG22 . 19095 1 1155 . 1 1 91 91 THR HG23 H 1 1.123 0.050 . 1 . . . . 91 THR HG23 . 19095 1 1156 . 1 1 91 91 THR C C 13 174.167 0.200 . 1 . . . . 91 THR C . 19095 1 1157 . 1 1 91 91 THR CA C 13 61.894 0.200 . 1 . . . . 91 THR CA . 19095 1 1158 . 1 1 91 91 THR CB C 13 68.620 0.200 . 1 . . . . 91 THR CB . 19095 1 1159 . 1 1 91 91 THR CG2 C 13 23.491 0.200 . 1 . . . . 91 THR CG2 . 19095 1 1160 . 1 1 91 91 THR N N 15 121.974 0.200 . 1 . . . . 91 THR N . 19095 1 1161 . 1 1 92 92 LYS H H 1 9.262 0.050 . 1 . . . . 92 LYS H . 19095 1 1162 . 1 1 92 92 LYS HA H 1 4.916 0.050 . 1 . . . . 92 LYS HA . 19095 1 1163 . 1 1 92 92 LYS HB2 H 1 1.872 0.050 . 2 . . . . 92 LYS HB2 . 19095 1 1164 . 1 1 92 92 LYS HB3 H 1 1.779 0.050 . 2 . . . . 92 LYS HB3 . 19095 1 1165 . 1 1 92 92 LYS HG2 H 1 1.521 0.050 . 2 . . . . 92 LYS HG2 . 19095 1 1166 . 1 1 92 92 LYS HG3 H 1 1.380 0.050 . 2 . . . . 92 LYS HG3 . 19095 1 1167 . 1 1 92 92 LYS HD2 H 1 1.706 0.050 . 1 . . . . 92 LYS HD2 . 19095 1 1168 . 1 1 92 92 LYS HD3 H 1 1.706 0.050 . 1 . . . . 92 LYS HD3 . 19095 1 1169 . 1 1 92 92 LYS HE2 H 1 2.980 0.050 . 1 . . . . 92 LYS HE2 . 19095 1 1170 . 1 1 92 92 LYS HE3 H 1 2.980 0.050 . 1 . . . . 92 LYS HE3 . 19095 1 1171 . 1 1 92 92 LYS C C 13 174.770 0.200 . 1 . . . . 92 LYS C . 19095 1 1172 . 1 1 92 92 LYS CA C 13 55.115 0.200 . 1 . . . . 92 LYS CA . 19095 1 1173 . 1 1 92 92 LYS CB C 13 35.230 0.200 . 1 . . . . 92 LYS CB . 19095 1 1174 . 1 1 92 92 LYS CG C 13 25.066 0.200 . 1 . . . . 92 LYS CG . 19095 1 1175 . 1 1 92 92 LYS CD C 13 29.321 0.200 . 1 . . . . 92 LYS CD . 19095 1 1176 . 1 1 92 92 LYS CE C 13 42.194 0.200 . 1 . . . . 92 LYS CE . 19095 1 1177 . 1 1 92 92 LYS N N 15 128.611 0.200 . 1 . . . . 92 LYS N . 19095 1 1178 . 1 1 93 93 ILE H H 1 8.636 0.050 . 1 . . . . 93 ILE H . 19095 1 1179 . 1 1 93 93 ILE HA H 1 4.748 0.050 . 1 . . . . 93 ILE HA . 19095 1 1180 . 1 1 93 93 ILE HB H 1 1.672 0.050 . 1 . . . . 93 ILE HB . 19095 1 1181 . 1 1 93 93 ILE HG12 H 1 1.105 0.050 . 2 . . . . 93 ILE HG12 . 19095 1 1182 . 1 1 93 93 ILE HG13 H 1 0.642 0.050 . 2 . . . . 93 ILE HG13 . 19095 1 1183 . 1 1 93 93 ILE HG21 H 1 0.536 0.050 . 1 . . . . 93 ILE HG21 . 19095 1 1184 . 1 1 93 93 ILE HG22 H 1 0.536 0.050 . 1 . . . . 93 ILE HG22 . 19095 1 1185 . 1 1 93 93 ILE HG23 H 1 0.536 0.050 . 1 . . . . 93 ILE HG23 . 19095 1 1186 . 1 1 93 93 ILE HD11 H 1 0.271 0.050 . 1 . . . . 93 ILE HD11 . 19095 1 1187 . 1 1 93 93 ILE HD12 H 1 0.271 0.050 . 1 . . . . 93 ILE HD12 . 19095 1 1188 . 1 1 93 93 ILE HD13 H 1 0.271 0.050 . 1 . . . . 93 ILE HD13 . 19095 1 1189 . 1 1 93 93 ILE C C 13 174.552 0.200 . 1 . . . . 93 ILE C . 19095 1 1190 . 1 1 93 93 ILE CA C 13 61.113 0.200 . 1 . . . . 93 ILE CA . 19095 1 1191 . 1 1 93 93 ILE CB C 13 39.787 0.200 . 1 . . . . 93 ILE CB . 19095 1 1192 . 1 1 93 93 ILE CG1 C 13 27.695 0.200 . 1 . . . . 93 ILE CG1 . 19095 1 1193 . 1 1 93 93 ILE CG2 C 13 16.310 0.200 . 1 . . . . 93 ILE CG2 . 19095 1 1194 . 1 1 93 93 ILE CD1 C 13 12.902 0.200 . 1 . . . . 93 ILE CD1 . 19095 1 1195 . 1 1 93 93 ILE N N 15 123.439 0.200 . 1 . . . . 93 ILE N . 19095 1 1196 . 1 1 94 94 ALA H H 1 8.675 0.050 . 1 . . . . 94 ALA H . 19095 1 1197 . 1 1 94 94 ALA HA H 1 4.757 0.050 . 1 . . . . 94 ALA HA . 19095 1 1198 . 1 1 94 94 ALA HB1 H 1 1.393 0.050 . 1 . . . . 94 ALA HB1 . 19095 1 1199 . 1 1 94 94 ALA HB2 H 1 1.393 0.050 . 1 . . . . 94 ALA HB2 . 19095 1 1200 . 1 1 94 94 ALA HB3 H 1 1.393 0.050 . 1 . . . . 94 ALA HB3 . 19095 1 1201 . 1 1 94 94 ALA C C 13 175.841 0.200 . 1 . . . . 94 ALA C . 19095 1 1202 . 1 1 94 94 ALA CA C 13 50.507 0.200 . 1 . . . . 94 ALA CA . 19095 1 1203 . 1 1 94 94 ALA CB C 13 22.830 0.200 . 1 . . . . 94 ALA CB . 19095 1 1204 . 1 1 94 94 ALA N N 15 130.029 0.200 . 1 . . . . 94 ALA N . 19095 1 1205 . 1 1 95 95 GLU H H 1 8.757 0.050 . 1 . . . . 95 GLU H . 19095 1 1206 . 1 1 95 95 GLU HA H 1 4.361 0.050 . 1 . . . . 95 GLU HA . 19095 1 1207 . 1 1 95 95 GLU HB2 H 1 1.969 0.050 . 2 . . . . 95 GLU HB2 . 19095 1 1208 . 1 1 95 95 GLU HB3 H 1 2.019 0.050 . 2 . . . . 95 GLU HB3 . 19095 1 1209 . 1 1 95 95 GLU HG2 H 1 2.293 0.050 . 2 . . . . 95 GLU HG2 . 19095 1 1210 . 1 1 95 95 GLU HG3 H 1 2.404 0.050 . 2 . . . . 95 GLU HG3 . 19095 1 1211 . 1 1 95 95 GLU C C 13 175.596 0.200 . 1 . . . . 95 GLU C . 19095 1 1212 . 1 1 95 95 GLU CA C 13 57.902 0.200 . 1 . . . . 95 GLU CA . 19095 1 1213 . 1 1 95 95 GLU CB C 13 30.134 0.200 . 1 . . . . 95 GLU CB . 19095 1 1214 . 1 1 95 95 GLU CG C 13 36.851 0.200 . 1 . . . . 95 GLU CG . 19095 1 1215 . 1 1 95 95 GLU N N 15 121.686 0.200 . 1 . . . . 95 GLU N . 19095 1 1216 . 1 1 96 96 ALA H H 1 8.628 0.050 . 1 . . . . 96 ALA H . 19095 1 1217 . 1 1 96 96 ALA HA H 1 4.629 0.050 . 1 . . . . 96 ALA HA . 19095 1 1218 . 1 1 96 96 ALA HB1 H 1 1.149 0.050 . 1 . . . . 96 ALA HB1 . 19095 1 1219 . 1 1 96 96 ALA HB2 H 1 1.149 0.050 . 1 . . . . 96 ALA HB2 . 19095 1 1220 . 1 1 96 96 ALA HB3 H 1 1.149 0.050 . 1 . . . . 96 ALA HB3 . 19095 1 1221 . 1 1 96 96 ALA C C 13 175.849 0.200 . 1 . . . . 96 ALA C . 19095 1 1222 . 1 1 96 96 ALA CA C 13 50.100 0.200 . 1 . . . . 96 ALA CA . 19095 1 1223 . 1 1 96 96 ALA CB C 13 21.926 0.200 . 1 . . . . 96 ALA CB . 19095 1 1224 . 1 1 96 96 ALA N N 15 128.795 0.200 . 1 . . . . 96 ALA N . 19095 1 1225 . 1 1 97 97 SER H H 1 8.270 0.050 . 1 . . . . 97 SER H . 19095 1 1226 . 1 1 97 97 SER HA H 1 4.344 0.050 . 1 . . . . 97 SER HA . 19095 1 1227 . 1 1 97 97 SER HB2 H 1 3.908 0.050 . 2 . . . . 97 SER HB2 . 19095 1 1228 . 1 1 97 97 SER HB3 H 1 3.844 0.050 . 2 . . . . 97 SER HB3 . 19095 1 1229 . 1 1 97 97 SER C C 13 175.030 0.200 . 1 . . . . 97 SER C . 19095 1 1230 . 1 1 97 97 SER CA C 13 58.214 0.200 . 1 . . . . 97 SER CA . 19095 1 1231 . 1 1 97 97 SER CB C 13 63.426 0.200 . 1 . . . . 97 SER CB . 19095 1 1232 . 1 1 97 97 SER N N 15 114.201 0.200 . 1 . . . . 97 SER N . 19095 1 1233 . 1 1 98 98 GLU H H 1 8.524 0.050 . 1 . . . . 98 GLU H . 19095 1 1234 . 1 1 98 98 GLU HA H 1 4.317 0.050 . 1 . . . . 98 GLU HA . 19095 1 1235 . 1 1 98 98 GLU HB2 H 1 2.097 0.050 . 2 . . . . 98 GLU HB2 . 19095 1 1236 . 1 1 98 98 GLU HB3 H 1 2.141 0.050 . 2 . . . . 98 GLU HB3 . 19095 1 1237 . 1 1 98 98 GLU HG2 H 1 2.322 0.050 . 1 . . . . 98 GLU HG2 . 19095 1 1238 . 1 1 98 98 GLU HG3 H 1 2.322 0.050 . 1 . . . . 98 GLU HG3 . 19095 1 1239 . 1 1 98 98 GLU C C 13 176.785 0.200 . 1 . . . . 98 GLU C . 19095 1 1240 . 1 1 98 98 GLU CA C 13 56.236 0.200 . 1 . . . . 98 GLU CA . 19095 1 1241 . 1 1 98 98 GLU CB C 13 30.429 0.200 . 1 . . . . 98 GLU CB . 19095 1 1242 . 1 1 98 98 GLU CG C 13 35.654 0.200 . 1 . . . . 98 GLU CG . 19095 1 1243 . 1 1 98 98 GLU N N 15 123.753 0.200 . 1 . . . . 98 GLU N . 19095 1 1244 . 1 1 99 99 ASP H H 1 8.265 0.050 . 1 . . . . 99 ASP H . 19095 1 1245 . 1 1 99 99 ASP HA H 1 4.454 0.050 . 1 . . . . 99 ASP HA . 19095 1 1246 . 1 1 99 99 ASP HB2 H 1 2.598 0.050 . 2 . . . . 99 ASP HB2 . 19095 1 1247 . 1 1 99 99 ASP HB3 H 1 2.645 0.050 . 2 . . . . 99 ASP HB3 . 19095 1 1248 . 1 1 99 99 ASP C C 13 177.445 0.200 . 1 . . . . 99 ASP C . 19095 1 1249 . 1 1 99 99 ASP CA C 13 55.750 0.200 . 1 . . . . 99 ASP CA . 19095 1 1250 . 1 1 99 99 ASP CB C 13 40.635 0.200 . 1 . . . . 99 ASP CB . 19095 1 1251 . 1 1 99 99 ASP N N 15 122.486 0.200 . 1 . . . . 99 ASP N . 19095 1 1252 . 1 1 100 100 GLY H H 1 8.949 0.050 . 1 . . . . 100 GLY H . 19095 1 1253 . 1 1 100 100 GLY HA2 H 1 4.056 0.050 . 2 . . . . 100 GLY HA2 . 19095 1 1254 . 1 1 100 100 GLY HA3 H 1 3.765 0.050 . 2 . . . . 100 GLY HA3 . 19095 1 1255 . 1 1 100 100 GLY C C 13 173.543 0.200 . 1 . . . . 100 GLY C . 19095 1 1256 . 1 1 100 100 GLY CA C 13 45.763 0.200 . 1 . . . . 100 GLY CA . 19095 1 1257 . 1 1 100 100 GLY N N 15 113.499 0.200 . 1 . . . . 100 GLY N . 19095 1 1258 . 1 1 101 101 PHE H H 1 8.144 0.050 . 1 . . . . 101 PHE H . 19095 1 1259 . 1 1 101 101 PHE HA H 1 4.470 0.050 . 1 . . . . 101 PHE HA . 19095 1 1260 . 1 1 101 101 PHE HB2 H 1 2.974 0.050 . 1 . . . . 101 PHE HB2 . 19095 1 1261 . 1 1 101 101 PHE HB3 H 1 2.974 0.050 . 1 . . . . 101 PHE HB3 . 19095 1 1262 . 1 1 101 101 PHE HD1 H 1 7.429 0.050 . 1 . . . . 101 PHE HD1 . 19095 1 1263 . 1 1 101 101 PHE HD2 H 1 7.429 0.050 . 1 . . . . 101 PHE HD2 . 19095 1 1264 . 1 1 101 101 PHE HE1 H 1 7.652 0.050 . 1 . . . . 101 PHE HE1 . 19095 1 1265 . 1 1 101 101 PHE HE2 H 1 7.652 0.050 . 1 . . . . 101 PHE HE2 . 19095 1 1266 . 1 1 101 101 PHE HZ H 1 7.647 0.050 . 1 . . . . 101 PHE HZ . 19095 1 1267 . 1 1 101 101 PHE C C 13 174.371 0.200 . 1 . . . . 101 PHE C . 19095 1 1268 . 1 1 101 101 PHE CA C 13 57.317 0.200 . 1 . . . . 101 PHE CA . 19095 1 1269 . 1 1 101 101 PHE CB C 13 41.176 0.200 . 1 . . . . 101 PHE CB . 19095 1 1270 . 1 1 101 101 PHE CD1 C 13 131.910 0.200 . 1 . . . . 101 PHE CD1 . 19095 1 1271 . 1 1 101 101 PHE CD2 C 13 131.992 0.200 . 1 . . . . 101 PHE CD2 . 19095 1 1272 . 1 1 101 101 PHE CE1 C 13 129.614 0.200 . 1 . . . . 101 PHE CE1 . 19095 1 1273 . 1 1 101 101 PHE CE2 C 13 129.624 0.200 . 1 . . . . 101 PHE CE2 . 19095 1 1274 . 1 1 101 101 PHE N N 15 125.876 0.200 . 1 . . . . 101 PHE N . 19095 1 1275 . 1 1 102 102 PRO HA H 1 4.324 0.050 . 1 . . . . 102 PRO HA . 19095 1 1276 . 1 1 102 102 PRO HB2 H 1 1.874 0.050 . 1 . . . . 102 PRO HB2 . 19095 1 1277 . 1 1 102 102 PRO HB3 H 1 1.874 0.050 . 1 . . . . 102 PRO HB3 . 19095 1 1278 . 1 1 102 102 PRO HG2 H 1 1.642 0.050 . 1 . . . . 102 PRO HG2 . 19095 1 1279 . 1 1 102 102 PRO HG3 H 1 1.642 0.050 . 1 . . . . 102 PRO HG3 . 19095 1 1280 . 1 1 102 102 PRO HD2 H 1 4.046 0.050 . 1 . . . . 102 PRO HD2 . 19095 1 1281 . 1 1 102 102 PRO HD3 H 1 4.046 0.050 . 1 . . . . 102 PRO HD3 . 19095 1 1282 . 1 1 102 102 PRO C C 13 176.996 0.200 . 1 . . . . 102 PRO C . 19095 1 1283 . 1 1 102 102 PRO CA C 13 56.236 0.200 . 1 . . . . 102 PRO CA . 19095 1 1284 . 1 1 102 102 PRO CB C 13 31.010 0.200 . 1 . . . . 102 PRO CB . 19095 1 1285 . 1 1 102 102 PRO CG C 13 27.193 0.200 . 1 . . . . 102 PRO CG . 19095 1 1286 . 1 1 102 102 PRO CD C 13 43.489 0.200 . 1 . . . . 102 PRO CD . 19095 1 1287 . 1 1 103 103 GLU H H 1 8.544 0.050 . 1 . . . . 103 GLU H . 19095 1 1288 . 1 1 103 103 GLU HA H 1 4.294 0.050 . 1 . . . . 103 GLU HA . 19095 1 1289 . 1 1 103 103 GLU HB2 H 1 2.336 0.050 . 2 . . . . 103 GLU HB2 . 19095 1 1290 . 1 1 103 103 GLU HB3 H 1 1.859 0.050 . 2 . . . . 103 GLU HB3 . 19095 1 1291 . 1 1 103 103 GLU HG2 H 1 2.393 0.050 . 2 . . . . 103 GLU HG2 . 19095 1 1292 . 1 1 103 103 GLU HG3 H 1 2.452 0.050 . 2 . . . . 103 GLU HG3 . 19095 1 1293 . 1 1 103 103 GLU C C 13 177.652 0.200 . 1 . . . . 103 GLU C . 19095 1 1294 . 1 1 103 103 GLU CA C 13 55.769 0.200 . 1 . . . . 103 GLU CA . 19095 1 1295 . 1 1 103 103 GLU CB C 13 31.156 0.200 . 1 . . . . 103 GLU CB . 19095 1 1296 . 1 1 103 103 GLU CG C 13 36.340 0.200 . 1 . . . . 103 GLU CG . 19095 1 1297 . 1 1 103 103 GLU N N 15 123.107 0.200 . 1 . . . . 103 GLU N . 19095 1 1298 . 1 1 104 104 SER H H 1 9.424 0.050 . 1 . . . . 104 SER H . 19095 1 1299 . 1 1 104 104 SER HB2 H 1 3.929 0.050 . 2 . . . . 104 SER HB2 . 19095 1 1300 . 1 1 104 104 SER HB3 H 1 3.863 0.050 . 2 . . . . 104 SER HB3 . 19095 1 1301 . 1 1 104 104 SER C C 13 176.449 0.200 . 1 . . . . 104 SER C . 19095 1 1302 . 1 1 104 104 SER CA C 13 62.490 0.200 . 1 . . . . 104 SER CA . 19095 1 1303 . 1 1 104 104 SER CB C 13 62.500 0.200 . 1 . . . . 104 SER CB . 19095 1 1304 . 1 1 104 104 SER N N 15 116.777 0.200 . 1 . . . . 104 SER N . 19095 1 1305 . 1 1 105 105 SER H H 1 8.047 0.050 . 1 . . . . 105 SER H . 19095 1 1306 . 1 1 105 105 SER HA H 1 4.219 0.050 . 1 . . . . 105 SER HA . 19095 1 1307 . 1 1 105 105 SER HB2 H 1 3.966 0.050 . 2 . . . . 105 SER HB2 . 19095 1 1308 . 1 1 105 105 SER HB3 H 1 3.906 0.050 . 2 . . . . 105 SER HB3 . 19095 1 1309 . 1 1 105 105 SER C C 13 175.104 0.200 . 1 . . . . 105 SER C . 19095 1 1310 . 1 1 105 105 SER CA C 13 60.203 0.200 . 1 . . . . 105 SER CA . 19095 1 1311 . 1 1 105 105 SER CB C 13 62.588 0.200 . 1 . . . . 105 SER CB . 19095 1 1312 . 1 1 105 105 SER N N 15 113.524 0.200 . 1 . . . . 105 SER N . 19095 1 1313 . 1 1 106 106 GLN H H 1 7.993 0.050 . 1 . . . . 106 GLN H . 19095 1 1314 . 1 1 106 106 GLN HA H 1 4.374 0.050 . 1 . . . . 106 GLN HA . 19095 1 1315 . 1 1 106 106 GLN HB2 H 1 2.312 0.050 . 2 . . . . 106 GLN HB2 . 19095 1 1316 . 1 1 106 106 GLN HB3 H 1 2.064 0.050 . 2 . . . . 106 GLN HB3 . 19095 1 1317 . 1 1 106 106 GLN HG2 H 1 2.350 0.050 . 2 . . . . 106 GLN HG2 . 19095 1 1318 . 1 1 106 106 GLN HG3 H 1 2.274 0.050 . 2 . . . . 106 GLN HG3 . 19095 1 1319 . 1 1 106 106 GLN HE21 H 1 7.582 0.050 . 2 . . . . 106 GLN HE21 . 19095 1 1320 . 1 1 106 106 GLN HE22 H 1 6.856 0.050 . 2 . . . . 106 GLN HE22 . 19095 1 1321 . 1 1 106 106 GLN C C 13 174.948 0.200 . 1 . . . . 106 GLN C . 19095 1 1322 . 1 1 106 106 GLN CA C 13 55.042 0.200 . 1 . . . . 106 GLN CA . 19095 1 1323 . 1 1 106 106 GLN CB C 13 30.122 0.200 . 1 . . . . 106 GLN CB . 19095 1 1324 . 1 1 106 106 GLN CG C 13 34.411 0.200 . 1 . . . . 106 GLN CG . 19095 1 1325 . 1 1 106 106 GLN N N 15 119.951 0.200 . 1 . . . . 106 GLN N . 19095 1 1326 . 1 1 106 106 GLN NE2 N 15 112.464 0.200 . 1 . . . . 106 GLN NE2 . 19095 1 1327 . 1 1 107 107 ILE H H 1 7.173 0.050 . 1 . . . . 107 ILE H . 19095 1 1328 . 1 1 107 107 ILE HA H 1 4.400 0.050 . 1 . . . . 107 ILE HA . 19095 1 1329 . 1 1 107 107 ILE HB H 1 1.924 0.050 . 1 . . . . 107 ILE HB . 19095 1 1330 . 1 1 107 107 ILE HG12 H 1 1.494 0.050 . 2 . . . . 107 ILE HG12 . 19095 1 1331 . 1 1 107 107 ILE HG13 H 1 1.114 0.050 . 2 . . . . 107 ILE HG13 . 19095 1 1332 . 1 1 107 107 ILE HG21 H 1 1.176 0.050 . 1 . . . . 107 ILE HG21 . 19095 1 1333 . 1 1 107 107 ILE HG22 H 1 1.176 0.050 . 1 . . . . 107 ILE HG22 . 19095 1 1334 . 1 1 107 107 ILE HG23 H 1 1.176 0.050 . 1 . . . . 107 ILE HG23 . 19095 1 1335 . 1 1 107 107 ILE HD11 H 1 0.639 0.050 . 1 . . . . 107 ILE HD11 . 19095 1 1336 . 1 1 107 107 ILE HD12 H 1 0.639 0.050 . 1 . . . . 107 ILE HD12 . 19095 1 1337 . 1 1 107 107 ILE HD13 H 1 0.639 0.050 . 1 . . . . 107 ILE HD13 . 19095 1 1338 . 1 1 107 107 ILE C C 13 174.861 0.200 . 1 . . . . 107 ILE C . 19095 1 1339 . 1 1 107 107 ILE CA C 13 57.953 0.200 . 1 . . . . 107 ILE CA . 19095 1 1340 . 1 1 107 107 ILE CB C 13 37.882 0.200 . 1 . . . . 107 ILE CB . 19095 1 1341 . 1 1 107 107 ILE CG1 C 13 27.302 0.200 . 1 . . . . 107 ILE CG1 . 19095 1 1342 . 1 1 107 107 ILE CG2 C 13 16.063 0.200 . 1 . . . . 107 ILE CG2 . 19095 1 1343 . 1 1 107 107 ILE CD1 C 13 13.001 0.200 . 1 . . . . 107 ILE CD1 . 19095 1 1344 . 1 1 107 107 ILE N N 15 123.828 0.200 . 1 . . . . 107 ILE N . 19095 1 1345 . 1 1 108 108 PRO HA H 1 4.523 0.050 . 1 . . . . 108 PRO HA . 19095 1 1346 . 1 1 108 108 PRO HB2 H 1 2.392 0.050 . 2 . . . . 108 PRO HB2 . 19095 1 1347 . 1 1 108 108 PRO HB3 H 1 2.058 0.050 . 2 . . . . 108 PRO HB3 . 19095 1 1348 . 1 1 108 108 PRO HG2 H 1 1.950 0.050 . 1 . . . . 108 PRO HG2 . 19095 1 1349 . 1 1 108 108 PRO HG3 H 1 1.950 0.050 . 1 . . . . 108 PRO HG3 . 19095 1 1350 . 1 1 108 108 PRO HD2 H 1 3.915 0.050 . 2 . . . . 108 PRO HD2 . 19095 1 1351 . 1 1 108 108 PRO HD3 H 1 3.964 0.050 . 2 . . . . 108 PRO HD3 . 19095 1 1352 . 1 1 108 108 PRO C C 13 177.048 0.200 . 1 . . . . 108 PRO C . 19095 1 1353 . 1 1 108 108 PRO CA C 13 63.209 0.200 . 1 . . . . 108 PRO CA . 19095 1 1354 . 1 1 108 108 PRO CB C 13 32.942 0.200 . 1 . . . . 108 PRO CB . 19095 1 1355 . 1 1 108 108 PRO CG C 13 27.406 0.200 . 1 . . . . 108 PRO CG . 19095 1 1356 . 1 1 108 108 PRO CD C 13 51.551 0.200 . 1 . . . . 108 PRO CD . 19095 1 1357 . 1 1 109 109 GLU H H 1 8.759 0.050 . 1 . . . . 109 GLU H . 19095 1 1358 . 1 1 109 109 GLU HA H 1 3.916 0.050 . 1 . . . . 109 GLU HA . 19095 1 1359 . 1 1 109 109 GLU HB2 H 1 2.141 0.050 . 2 . . . . 109 GLU HB2 . 19095 1 1360 . 1 1 109 109 GLU HB3 H 1 1.863 0.050 . 2 . . . . 109 GLU HB3 . 19095 1 1361 . 1 1 109 109 GLU HG2 H 1 2.140 0.050 . 2 . . . . 109 GLU HG2 . 19095 1 1362 . 1 1 109 109 GLU HG3 H 1 2.309 0.050 . 2 . . . . 109 GLU HG3 . 19095 1 1363 . 1 1 109 109 GLU C C 13 175.755 0.200 . 1 . . . . 109 GLU C . 19095 1 1364 . 1 1 109 109 GLU CA C 13 57.117 0.200 . 1 . . . . 109 GLU CA . 19095 1 1365 . 1 1 109 109 GLU CB C 13 29.779 0.200 . 1 . . . . 109 GLU CB . 19095 1 1366 . 1 1 109 109 GLU CG C 13 36.522 0.200 . 1 . . . . 109 GLU CG . 19095 1 1367 . 1 1 109 109 GLU N N 15 119.244 0.200 . 1 . . . . 109 GLU N . 19095 1 1368 . 1 1 110 110 ASN H H 1 7.856 0.050 . 1 . . . . 110 ASN H . 19095 1 1369 . 1 1 110 110 ASN HA H 1 4.633 0.050 . 1 . . . . 110 ASN HA . 19095 1 1370 . 1 1 110 110 ASN HB2 H 1 2.704 0.050 . 2 . . . . 110 ASN HB2 . 19095 1 1371 . 1 1 110 110 ASN HB3 H 1 2.764 0.050 . 2 . . . . 110 ASN HB3 . 19095 1 1372 . 1 1 110 110 ASN HD21 H 1 7.453 0.050 . 2 . . . . 110 ASN HD21 . 19095 1 1373 . 1 1 110 110 ASN HD22 H 1 7.702 0.050 . 2 . . . . 110 ASN HD22 . 19095 1 1374 . 1 1 110 110 ASN C C 13 173.046 0.200 . 1 . . . . 110 ASN C . 19095 1 1375 . 1 1 110 110 ASN CA C 13 54.377 0.200 . 1 . . . . 110 ASN CA . 19095 1 1376 . 1 1 110 110 ASN CB C 13 39.573 0.200 . 1 . . . . 110 ASN CB . 19095 1 1377 . 1 1 110 110 ASN N N 15 116.529 0.200 . 1 . . . . 110 ASN N . 19095 1 1378 . 1 1 110 110 ASN ND2 N 15 113.808 0.200 . 1 . . . . 110 ASN ND2 . 19095 1 1379 . 1 1 111 111 THR H H 1 8.137 0.050 . 1 . . . . 111 THR H . 19095 1 1380 . 1 1 111 111 THR HA H 1 5.711 0.050 . 1 . . . . 111 THR HA . 19095 1 1381 . 1 1 111 111 THR HB H 1 4.148 0.050 . 1 . . . . 111 THR HB . 19095 1 1382 . 1 1 111 111 THR HG21 H 1 1.397 0.050 . 1 . . . . 111 THR HG21 . 19095 1 1383 . 1 1 111 111 THR HG22 H 1 1.397 0.050 . 1 . . . . 111 THR HG22 . 19095 1 1384 . 1 1 111 111 THR HG23 H 1 1.397 0.050 . 1 . . . . 111 THR HG23 . 19095 1 1385 . 1 1 111 111 THR C C 13 173.181 0.200 . 1 . . . . 111 THR C . 19095 1 1386 . 1 1 111 111 THR CA C 13 58.093 0.200 . 1 . . . . 111 THR CA . 19095 1 1387 . 1 1 111 111 THR CB C 13 71.984 0.200 . 1 . . . . 111 THR CB . 19095 1 1388 . 1 1 111 111 THR CG2 C 13 21.129 0.200 . 1 . . . . 111 THR CG2 . 19095 1 1389 . 1 1 111 111 THR N N 15 117.078 0.200 . 1 . . . . 111 THR N . 19095 1 1390 . 1 1 112 112 PRO HA H 1 4.636 0.050 . 1 . . . . 112 PRO HA . 19095 1 1391 . 1 1 112 112 PRO HB2 H 1 2.338 0.050 . 2 . . . . 112 PRO HB2 . 19095 1 1392 . 1 1 112 112 PRO HB3 H 1 1.932 0.050 . 2 . . . . 112 PRO HB3 . 19095 1 1393 . 1 1 112 112 PRO HG2 H 1 2.013 0.050 . 2 . . . . 112 PRO HG2 . 19095 1 1394 . 1 1 112 112 PRO HG3 H 1 2.164 0.050 . 2 . . . . 112 PRO HG3 . 19095 1 1395 . 1 1 112 112 PRO HD2 H 1 3.492 0.050 . 2 . . . . 112 PRO HD2 . 19095 1 1396 . 1 1 112 112 PRO HD3 H 1 4.200 0.050 . 2 . . . . 112 PRO HD3 . 19095 1 1397 . 1 1 112 112 PRO C C 13 176.640 0.200 . 1 . . . . 112 PRO C . 19095 1 1398 . 1 1 112 112 PRO CA C 13 62.915 0.200 . 1 . . . . 112 PRO CA . 19095 1 1399 . 1 1 112 112 PRO CB C 13 31.970 0.200 . 1 . . . . 112 PRO CB . 19095 1 1400 . 1 1 112 112 PRO CG C 13 27.705 0.200 . 1 . . . . 112 PRO CG . 19095 1 1401 . 1 1 112 112 PRO CD C 13 51.270 0.200 . 1 . . . . 112 PRO CD . 19095 1 1402 . 1 1 113 113 THR H H 1 8.355 0.050 . 1 . . . . 113 THR H . 19095 1 1403 . 1 1 113 113 THR HA H 1 4.706 0.050 . 1 . . . . 113 THR HA . 19095 1 1404 . 1 1 113 113 THR HB H 1 4.334 0.050 . 1 . . . . 113 THR HB . 19095 1 1405 . 1 1 113 113 THR HG21 H 1 1.319 0.050 . 1 . . . . 113 THR HG21 . 19095 1 1406 . 1 1 113 113 THR HG22 H 1 1.319 0.050 . 1 . . . . 113 THR HG22 . 19095 1 1407 . 1 1 113 113 THR HG23 H 1 1.319 0.050 . 1 . . . . 113 THR HG23 . 19095 1 1408 . 1 1 113 113 THR C C 13 173.942 0.200 . 1 . . . . 113 THR C . 19095 1 1409 . 1 1 113 113 THR CA C 13 60.823 0.200 . 1 . . . . 113 THR CA . 19095 1 1410 . 1 1 113 113 THR CB C 13 71.106 0.200 . 1 . . . . 113 THR CB . 19095 1 1411 . 1 1 113 113 THR CG2 C 13 21.553 0.200 . 1 . . . . 113 THR CG2 . 19095 1 1412 . 1 1 113 113 THR N N 15 115.040 0.200 . 1 . . . . 113 THR N . 19095 1 1413 . 1 1 114 114 ALA H H 1 8.316 0.050 . 1 . . . . 114 ALA H . 19095 1 1414 . 1 1 114 114 ALA HA H 1 4.274 0.050 . 1 . . . . 114 ALA HA . 19095 1 1415 . 1 1 114 114 ALA HB1 H 1 1.187 0.050 . 1 . . . . 114 ALA HB1 . 19095 1 1416 . 1 1 114 114 ALA HB2 H 1 1.187 0.050 . 1 . . . . 114 ALA HB2 . 19095 1 1417 . 1 1 114 114 ALA HB3 H 1 1.187 0.050 . 1 . . . . 114 ALA HB3 . 19095 1 1418 . 1 1 114 114 ALA C C 13 176.524 0.200 . 1 . . . . 114 ALA C . 19095 1 1419 . 1 1 114 114 ALA CA C 13 51.807 0.200 . 1 . . . . 114 ALA CA . 19095 1 1420 . 1 1 114 114 ALA CB C 13 19.619 0.200 . 1 . . . . 114 ALA CB . 19095 1 1421 . 1 1 114 114 ALA N N 15 125.178 0.200 . 1 . . . . 114 ALA N . 19095 1 1422 . 1 1 115 115 ARG H H 1 8.258 0.050 . 1 . . . . 115 ARG H . 19095 1 1423 . 1 1 115 115 ARG HA H 1 4.323 0.050 . 1 . . . . 115 ARG HA . 19095 1 1424 . 1 1 115 115 ARG HB2 H 1 1.777 0.050 . 2 . . . . 115 ARG HB2 . 19095 1 1425 . 1 1 115 115 ARG HB3 H 1 1.839 0.050 . 2 . . . . 115 ARG HB3 . 19095 1 1426 . 1 1 115 115 ARG HG2 H 1 1.630 0.050 . 1 . . . . 115 ARG HG2 . 19095 1 1427 . 1 1 115 115 ARG HG3 H 1 1.630 0.050 . 1 . . . . 115 ARG HG3 . 19095 1 1428 . 1 1 115 115 ARG HD2 H 1 3.212 0.050 . 1 . . . . 115 ARG HD2 . 19095 1 1429 . 1 1 115 115 ARG HD3 H 1 3.212 0.050 . 1 . . . . 115 ARG HD3 . 19095 1 1430 . 1 1 115 115 ARG HE H 1 7.261 0.050 . 1 . . . . 115 ARG HE . 19095 1 1431 . 1 1 115 115 ARG C C 13 176.013 0.200 . 1 . . . . 115 ARG C . 19095 1 1432 . 1 1 115 115 ARG CA C 13 56.138 0.200 . 1 . . . . 115 ARG CA . 19095 1 1433 . 1 1 115 115 ARG CB C 13 30.981 0.200 . 1 . . . . 115 ARG CB . 19095 1 1434 . 1 1 115 115 ARG CG C 13 27.159 0.200 . 1 . . . . 115 ARG CG . 19095 1 1435 . 1 1 115 115 ARG CD C 13 43.438 0.200 . 1 . . . . 115 ARG CD . 19095 1 1436 . 1 1 115 115 ARG N N 15 120.796 0.200 . 1 . . . . 115 ARG N . 19095 1 1437 . 1 1 115 115 ARG NE N 15 85.074 0.200 . 1 . . . . 115 ARG NE . 19095 1 1438 . 1 1 116 116 ARG H H 1 8.499 0.050 . 1 . . . . 116 ARG H . 19095 1 1439 . 1 1 116 116 ARG HA H 1 4.309 0.050 . 1 . . . . 116 ARG HA . 19095 1 1440 . 1 1 116 116 ARG HB2 H 1 1.878 0.050 . 2 . . . . 116 ARG HB2 . 19095 1 1441 . 1 1 116 116 ARG HB3 H 1 1.773 0.050 . 2 . . . . 116 ARG HB3 . 19095 1 1442 . 1 1 116 116 ARG HG2 H 1 1.656 0.050 . 1 . . . . 116 ARG HG2 . 19095 1 1443 . 1 1 116 116 ARG HG3 H 1 1.656 0.050 . 1 . . . . 116 ARG HG3 . 19095 1 1444 . 1 1 116 116 ARG HD2 H 1 3.209 0.050 . 1 . . . . 116 ARG HD2 . 19095 1 1445 . 1 1 116 116 ARG HD3 H 1 3.209 0.050 . 1 . . . . 116 ARG HD3 . 19095 1 1446 . 1 1 116 116 ARG HE H 1 7.261 0.050 . 1 . . . . 116 ARG HE . 19095 1 1447 . 1 1 116 116 ARG C C 13 175.405 0.200 . 1 . . . . 116 ARG C . 19095 1 1448 . 1 1 116 116 ARG CA C 13 56.359 0.200 . 1 . . . . 116 ARG CA . 19095 1 1449 . 1 1 116 116 ARG CB C 13 30.890 0.200 . 1 . . . . 116 ARG CB . 19095 1 1450 . 1 1 116 116 ARG CG C 13 27.127 0.200 . 1 . . . . 116 ARG CG . 19095 1 1451 . 1 1 116 116 ARG CD C 13 43.442 0.200 . 1 . . . . 116 ARG CD . 19095 1 1452 . 1 1 116 116 ARG N N 15 123.849 0.200 . 1 . . . . 116 ARG N . 19095 1 1453 . 1 1 116 116 ARG NE N 15 85.074 0.200 . 1 . . . . 116 ARG NE . 19095 1 1454 . 1 1 117 117 ARG H H 1 8.051 0.050 . 1 . . . . 117 ARG H . 19095 1 1455 . 1 1 117 117 ARG HA H 1 4.164 0.050 . 1 . . . . 117 ARG HA . 19095 1 1456 . 1 1 117 117 ARG HB2 H 1 1.728 0.050 . 2 . . . . 117 ARG HB2 . 19095 1 1457 . 1 1 117 117 ARG HB3 H 1 1.846 0.050 . 2 . . . . 117 ARG HB3 . 19095 1 1458 . 1 1 117 117 ARG HG2 H 1 1.608 0.050 . 1 . . . . 117 ARG HG2 . 19095 1 1459 . 1 1 117 117 ARG HG3 H 1 1.608 0.050 . 1 . . . . 117 ARG HG3 . 19095 1 1460 . 1 1 117 117 ARG HD2 H 1 3.207 0.050 . 1 . . . . 117 ARG HD2 . 19095 1 1461 . 1 1 117 117 ARG HD3 H 1 3.207 0.050 . 1 . . . . 117 ARG HD3 . 19095 1 1462 . 1 1 117 117 ARG C C 13 180.934 0.200 . 1 . . . . 117 ARG C . 19095 1 1463 . 1 1 117 117 ARG CA C 13 57.567 0.200 . 1 . . . . 117 ARG CA . 19095 1 1464 . 1 1 117 117 ARG CB C 13 31.461 0.200 . 1 . . . . 117 ARG CB . 19095 1 1465 . 1 1 117 117 ARG CG C 13 27.249 0.200 . 1 . . . . 117 ARG CG . 19095 1 1466 . 1 1 117 117 ARG CD C 13 43.549 0.200 . 1 . . . . 117 ARG CD . 19095 1 1467 . 1 1 117 117 ARG N N 15 127.862 0.200 . 1 . . . . 117 ARG N . 19095 1 stop_ save_