data_16494 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16494 _Entry.Title ; Backbone and side chain 1H chemical shift assignments for acidic fibrobast growth factor ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-09-15 _Entry.Accession_date 2009-09-15 _Entry.Last_release_date 2009-09-15 _Entry.Original_release_date 2009-09-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.0.9.13 _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.ORCID _Entry_author.Entry_ID 1 Antonio Pineda-Lucena . . . . 16494 2 'M. Angeles' Jimenez . . . . 16494 3 Rosa Lozano . M. . . 16494 4 Jose Nieto . L. . . 16494 5 Jorge Santoro . . . . 16494 6 Manuel Rico . . . . 16494 7 Guillermo Gimenez-Gallego . . . . 16494 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'NMR group, Instituto Quimica-Fisica Rocasolano, CSIC, Madrid, Spain' . 16494 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16494 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 847 16494 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2009-10-06 . original BMRB . 16494 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16493 'Entry containing chemical shifts for aFGF in its complex with MIHS' 16494 stop_ save_ ############### # Citations # ############### save_entry_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode entry_citation_1 _Citation.Entry_ID 16494 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1006/jmbi.1994.1558 _Citation.PubMed_ID 7521397 _Citation.Full_citation . _Citation.Title ; 1H-NMR assignment and solution structure of human acidic fibroblast growth factor activated by inositol hexasulfate ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 242 _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 81 _Citation.Page_last 98 _Citation.Year 1994 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Antonio Pineda-Lucena . . . . 16494 1 2 'M. Angeles' Jimenez . . . . 16494 1 3 Jose Nieto . L. . . 16494 1 4 Jorge Santoro . . . . 16494 1 5 Manuel Rico . . . . 16494 1 6 Guillermo Gimenez-Gallego . . . . 16494 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'acidic fibroblast growth factor' 16494 1 heparin 16494 1 stop_ save_ save_entry_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode entry_citation_2 _Citation.Entry_ID 16494 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1006/jmbi.1996.0631 _Citation.PubMed_ID 8950275 _Citation.Full_citation . _Citation.Title ; Three-dimensional structure of acidic fibroblast growth factor in solution: effects of binding to a heparin functional analog. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 264 _Citation.Journal_issue 1 _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 162 _Citation.Page_last 178 _Citation.Year 1996 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Antonio Pineda-Lucena . . . . 16494 2 2 'M. Angeles' Jimenez . . . . 16494 2 3 Rosa Lozano . M. . . 16494 2 4 Jose Nieto . L. . . 16494 2 5 Jorge Santoro . . . . 16494 2 6 Manuel Rico . . . . 16494 2 7 Guillermo Gimenez-Gallego . . . . 16494 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'FGF activation' 16494 2 'acidic fibroblast growth factor' 16494 2 'heparin functional analog' 16494 2 'mitogenic activity regulation' 16494 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16494 _Assembly.ID 1 _Assembly.Name aFGF _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 15000 _Assembly.Enzyme_commission_number . _Assembly.Details 'acidic fibroblast growth factor' _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 'acidic fibroblast growth factor' 1 $aFGF A . yes native no no . . . 16494 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Growth factor' 16494 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_aFGF _Entity.Sf_category entity _Entity.Sf_framecode aFGF _Entity.Entry_ID 16494 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name aFGF _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 ; KKPKLLYCSNGGHFLRILPD GTVDGTRDRSDQHIQLQLSA ESVGEVYIKSTETGQYLAMD TDGLLYGSQTPNEECLFLER LEENHYNTYISKKHAEKNWF VGLKKNGSCKRGPRTHYGQK AILFLPLPVSSD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'N-terminal residue corresponds to Lys23' _Entity.Polymer_author_seq_details 'Protein construct lacks the 22 N-terminal residues.' _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 132 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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 . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Growth Factor' 16494 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 23 LYS . 16494 1 2 24 LYS . 16494 1 3 25 PRO . 16494 1 4 26 LYS . 16494 1 5 27 LEU . 16494 1 6 28 LEU . 16494 1 7 29 TYR . 16494 1 8 30 CYS . 16494 1 9 31 SER . 16494 1 10 32 ASN . 16494 1 11 33 GLY . 16494 1 12 34 GLY . 16494 1 13 35 HIS . 16494 1 14 36 PHE . 16494 1 15 37 LEU . 16494 1 16 38 ARG . 16494 1 17 39 ILE . 16494 1 18 40 LEU . 16494 1 19 41 PRO . 16494 1 20 42 ASP . 16494 1 21 43 GLY . 16494 1 22 44 THR . 16494 1 23 45 VAL . 16494 1 24 46 ASP . 16494 1 25 47 GLY . 16494 1 26 48 THR . 16494 1 27 49 ARG . 16494 1 28 50 ASP . 16494 1 29 51 ARG . 16494 1 30 52 SER . 16494 1 31 53 ASP . 16494 1 32 54 GLN . 16494 1 33 55 HIS . 16494 1 34 56 ILE . 16494 1 35 57 GLN . 16494 1 36 58 LEU . 16494 1 37 59 GLN . 16494 1 38 60 LEU . 16494 1 39 61 SER . 16494 1 40 62 ALA . 16494 1 41 63 GLU . 16494 1 42 64 SER . 16494 1 43 65 VAL . 16494 1 44 66 GLY . 16494 1 45 67 GLU . 16494 1 46 68 VAL . 16494 1 47 69 TYR . 16494 1 48 70 ILE . 16494 1 49 71 LYS . 16494 1 50 72 SER . 16494 1 51 73 THR . 16494 1 52 74 GLU . 16494 1 53 75 THR . 16494 1 54 76 GLY . 16494 1 55 77 GLN . 16494 1 56 78 TYR . 16494 1 57 79 LEU . 16494 1 58 80 ALA . 16494 1 59 81 MET . 16494 1 60 82 ASP . 16494 1 61 83 THR . 16494 1 62 84 ASP . 16494 1 63 85 GLY . 16494 1 64 86 LEU . 16494 1 65 87 LEU . 16494 1 66 88 TYR . 16494 1 67 89 GLY . 16494 1 68 90 SER . 16494 1 69 91 GLN . 16494 1 70 92 THR . 16494 1 71 93 PRO . 16494 1 72 94 ASN . 16494 1 73 95 GLU . 16494 1 74 96 GLU . 16494 1 75 97 CYS . 16494 1 76 98 LEU . 16494 1 77 99 PHE . 16494 1 78 100 LEU . 16494 1 79 101 GLU . 16494 1 80 102 ARG . 16494 1 81 103 LEU . 16494 1 82 104 GLU . 16494 1 83 105 GLU . 16494 1 84 106 ASN . 16494 1 85 107 HIS . 16494 1 86 108 TYR . 16494 1 87 109 ASN . 16494 1 88 110 THR . 16494 1 89 111 TYR . 16494 1 90 112 ILE . 16494 1 91 113 SER . 16494 1 92 114 LYS . 16494 1 93 115 LYS . 16494 1 94 116 HIS . 16494 1 95 117 ALA . 16494 1 96 118 GLU . 16494 1 97 119 LYS . 16494 1 98 120 ASN . 16494 1 99 121 TRP . 16494 1 100 122 PHE . 16494 1 101 123 VAL . 16494 1 102 124 GLY . 16494 1 103 125 LEU . 16494 1 104 126 LYS . 16494 1 105 127 LYS . 16494 1 106 128 ASN . 16494 1 107 129 GLY . 16494 1 108 130 SER . 16494 1 109 131 CYS . 16494 1 110 132 LYS . 16494 1 111 133 ARG . 16494 1 112 134 GLY . 16494 1 113 135 PRO . 16494 1 114 136 ARG . 16494 1 115 137 THR . 16494 1 116 138 HIS . 16494 1 117 139 TYR . 16494 1 118 140 GLY . 16494 1 119 141 GLN . 16494 1 120 142 LYS . 16494 1 121 143 ALA . 16494 1 122 144 ILE . 16494 1 123 145 LEU . 16494 1 124 146 PHE . 16494 1 125 147 LEU . 16494 1 126 148 PRO . 16494 1 127 149 LEU . 16494 1 128 150 PRO . 16494 1 129 151 VAL . 16494 1 130 152 SER . 16494 1 131 153 SER . 16494 1 132 154 ASP . 16494 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 . LYS 1 1 16494 1 . LYS 2 2 16494 1 . PRO 3 3 16494 1 . LYS 4 4 16494 1 . LEU 5 5 16494 1 . LEU 6 6 16494 1 . TYR 7 7 16494 1 . CYS 8 8 16494 1 . SER 9 9 16494 1 . ASN 10 10 16494 1 . GLY 11 11 16494 1 . GLY 12 12 16494 1 . HIS 13 13 16494 1 . PHE 14 14 16494 1 . LEU 15 15 16494 1 . ARG 16 16 16494 1 . ILE 17 17 16494 1 . LEU 18 18 16494 1 . PRO 19 19 16494 1 . ASP 20 20 16494 1 . GLY 21 21 16494 1 . THR 22 22 16494 1 . VAL 23 23 16494 1 . ASP 24 24 16494 1 . GLY 25 25 16494 1 . THR 26 26 16494 1 . ARG 27 27 16494 1 . ASP 28 28 16494 1 . ARG 29 29 16494 1 . SER 30 30 16494 1 . ASP 31 31 16494 1 . GLN 32 32 16494 1 . HIS 33 33 16494 1 . ILE 34 34 16494 1 . GLN 35 35 16494 1 . LEU 36 36 16494 1 . GLN 37 37 16494 1 . LEU 38 38 16494 1 . SER 39 39 16494 1 . ALA 40 40 16494 1 . GLU 41 41 16494 1 . SER 42 42 16494 1 . VAL 43 43 16494 1 . GLY 44 44 16494 1 . GLU 45 45 16494 1 . VAL 46 46 16494 1 . TYR 47 47 16494 1 . ILE 48 48 16494 1 . LYS 49 49 16494 1 . SER 50 50 16494 1 . THR 51 51 16494 1 . GLU 52 52 16494 1 . THR 53 53 16494 1 . GLY 54 54 16494 1 . GLN 55 55 16494 1 . TYR 56 56 16494 1 . LEU 57 57 16494 1 . ALA 58 58 16494 1 . MET 59 59 16494 1 . ASP 60 60 16494 1 . THR 61 61 16494 1 . ASP 62 62 16494 1 . GLY 63 63 16494 1 . LEU 64 64 16494 1 . LEU 65 65 16494 1 . TYR 66 66 16494 1 . GLY 67 67 16494 1 . SER 68 68 16494 1 . GLN 69 69 16494 1 . THR 70 70 16494 1 . PRO 71 71 16494 1 . ASN 72 72 16494 1 . GLU 73 73 16494 1 . GLU 74 74 16494 1 . CYS 75 75 16494 1 . LEU 76 76 16494 1 . PHE 77 77 16494 1 . LEU 78 78 16494 1 . GLU 79 79 16494 1 . ARG 80 80 16494 1 . LEU 81 81 16494 1 . GLU 82 82 16494 1 . GLU 83 83 16494 1 . ASN 84 84 16494 1 . HIS 85 85 16494 1 . TYR 86 86 16494 1 . ASN 87 87 16494 1 . THR 88 88 16494 1 . TYR 89 89 16494 1 . ILE 90 90 16494 1 . SER 91 91 16494 1 . LYS 92 92 16494 1 . LYS 93 93 16494 1 . HIS 94 94 16494 1 . ALA 95 95 16494 1 . GLU 96 96 16494 1 . LYS 97 97 16494 1 . ASN 98 98 16494 1 . TRP 99 99 16494 1 . PHE 100 100 16494 1 . VAL 101 101 16494 1 . GLY 102 102 16494 1 . LEU 103 103 16494 1 . LYS 104 104 16494 1 . LYS 105 105 16494 1 . ASN 106 106 16494 1 . GLY 107 107 16494 1 . SER 108 108 16494 1 . CYS 109 109 16494 1 . LYS 110 110 16494 1 . ARG 111 111 16494 1 . GLY 112 112 16494 1 . PRO 113 113 16494 1 . ARG 114 114 16494 1 . THR 115 115 16494 1 . HIS 116 116 16494 1 . TYR 117 117 16494 1 . GLY 118 118 16494 1 . GLN 119 119 16494 1 . LYS 120 120 16494 1 . ALA 121 121 16494 1 . ILE 122 122 16494 1 . LEU 123 123 16494 1 . PHE 124 124 16494 1 . LEU 125 125 16494 1 . PRO 126 126 16494 1 . LEU 127 127 16494 1 . PRO 128 128 16494 1 . VAL 129 129 16494 1 . SER 130 130 16494 1 . SER 131 131 16494 1 . ASP 132 132 16494 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 16494 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $aFGF . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 16494 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 16494 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $aFGF . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pMG47 . . . 16494 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16494 _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 aFGF 'natural abundance' . . 1 $aFGF . . . 1 2 mM . . . . 16494 1 2 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 16494 1 3 TSP 'natural abundance' . . . . . . . 0.1 0.2 mM . . . . 16494 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16494 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16494 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16494 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 aFGF 'natural abundance' . . 1 $aFGF . . . 1 2 mM . . . . 16494 2 2 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 16494 2 3 TSP 'natural abundance' . . . . . . . 0.1 0.2 mM . . . . 16494 2 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 16494 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16494 _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' 10 . mM 16494 1 pH 6 . pH 16494 1 pressure 1 . atm 16494 1 temperature 298 . K 16494 1 stop_ save_ ############################ # Computer software used # ############################ save_UXNMR _Software.Sf_category software _Software.Sf_framecode UXNMR _Software.Entry_ID 16494 _Software.ID 1 _Software.Name UXNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16494 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16494 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 16494 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 16494 _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 AMX . 600 . . . 16494 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 16494 _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-1H COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 1 2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 1 4 '2D 1H-1H COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 1 6 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16494 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 16494 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TSP 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 16494 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 16494 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _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-1H COSY' . . . 16494 1 2 '2D 1H-1H TOCSY' . . . 16494 1 3 '2D 1H-1H NOESY' . . . 16494 1 5 '2D 1H-1H TOCSY' . . . 16494 1 6 '2D 1H-1H NOESY' . . . 16494 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 LYS HA H 1 4.26 0.01 . 1 . . . . 23 LYS HA . 16494 1 2 . 1 1 1 1 LYS HB2 H 1 1.96 0.01 . 2 . . . . 23 LYS HB2 . 16494 1 3 . 1 1 1 1 LYS HB3 H 1 1.96 0.01 . 2 . . . . 23 LYS HB3 . 16494 1 4 . 1 1 1 1 LYS HG2 H 1 1.66 0.01 . 2 . . . . 23 LYS HG2 . 16494 1 5 . 1 1 1 1 LYS HG3 H 1 1.66 0.01 . 2 . . . . 23 LYS HG3 . 16494 1 6 . 1 1 2 2 LYS HA H 1 4.69 0.01 . 1 . . . . 24 LYS HA . 16494 1 7 . 1 1 2 2 LYS HB2 H 1 1.84 0.01 . 2 . . . . 24 LYS HB2 . 16494 1 8 . 1 1 2 2 LYS HB3 H 1 1.84 0.01 . 2 . . . . 24 LYS HB3 . 16494 1 9 . 1 1 3 3 PRO HA H 1 4.27 0.01 . 1 . . . . 25 PRO HA . 16494 1 10 . 1 1 3 3 PRO HB2 H 1 2.21 0.01 . 2 . . . . 25 PRO HB2 . 16494 1 11 . 1 1 3 3 PRO HB3 H 1 2.21 0.01 . 2 . . . . 25 PRO HB3 . 16494 1 12 . 1 1 3 3 PRO HD2 H 1 3.88 0.01 . 2 . . . . 25 PRO HD2 . 16494 1 13 . 1 1 3 3 PRO HD3 H 1 3.67 0.01 . 2 . . . . 25 PRO HD3 . 16494 1 14 . 1 1 4 4 LYS H H 1 9.40 0.01 . 1 . . . . 26 LYS HN . 16494 1 15 . 1 1 4 4 LYS HA H 1 5.00 0.01 . 1 . . . . 26 LYS HA . 16494 1 16 . 1 1 4 4 LYS HB2 H 1 1.82 0.01 . 2 . . . . 26 LYS HB2 . 16494 1 17 . 1 1 4 4 LYS HB3 H 1 1.50 0.01 . 2 . . . . 26 LYS HB3 . 16494 1 18 . 1 1 4 4 LYS HD2 H 1 1.83 0.01 . 2 . . . . 26 LYS HD2 . 16494 1 19 . 1 1 4 4 LYS HD3 H 1 1.83 0.01 . 2 . . . . 26 LYS HD3 . 16494 1 20 . 1 1 4 4 LYS HE2 H 1 3.22 0.01 . 2 . . . . 26 LYS HE2 . 16494 1 21 . 1 1 4 4 LYS HE3 H 1 3.22 0.01 . 2 . . . . 26 LYS HE3 . 16494 1 22 . 1 1 4 4 LYS HG2 H 1 1.50 0.01 . 2 . . . . 26 LYS HG2 . 16494 1 23 . 1 1 4 4 LYS HG3 H 1 1.50 0.01 . 2 . . . . 26 LYS HG3 . 16494 1 24 . 1 1 4 4 LYS HZ1 H 1 6.90 0.01 . 1 . . . . 26 LYS HZ1 . 16494 1 25 . 1 1 4 4 LYS HZ2 H 1 6.90 0.01 . 1 . . . . 26 LYS HZ2 . 16494 1 26 . 1 1 4 4 LYS HZ3 H 1 6.90 0.01 . 1 . . . . 26 LYS HZ3 . 16494 1 27 . 1 1 5 5 LEU H H 1 9.09 0.01 . 1 . . . . 27 LEU HN . 16494 1 28 . 1 1 5 5 LEU HA H 1 4.92 0.01 . 1 . . . . 27 LEU HA . 16494 1 29 . 1 1 5 5 LEU HB2 H 1 1.79 0.01 . 2 . . . . 27 LEU HB2 . 16494 1 30 . 1 1 5 5 LEU HB3 H 1 1.62 0.01 . 2 . . . . 27 LEU HB3 . 16494 1 31 . 1 1 5 5 LEU HD11 H 1 0.60 0.01 . 2 . . . . 27 LEU HD1 . 16494 1 32 . 1 1 5 5 LEU HD12 H 1 0.60 0.01 . 2 . . . . 27 LEU HD1 . 16494 1 33 . 1 1 5 5 LEU HD13 H 1 0.60 0.01 . 2 . . . . 27 LEU HD1 . 16494 1 34 . 1 1 5 5 LEU HD21 H 1 0.50 0.01 . 2 . . . . 27 LEU HD2 . 16494 1 35 . 1 1 5 5 LEU HD22 H 1 0.50 0.01 . 2 . . . . 27 LEU HD2 . 16494 1 36 . 1 1 5 5 LEU HD23 H 1 0.50 0.01 . 2 . . . . 27 LEU HD2 . 16494 1 37 . 1 1 5 5 LEU HG H 1 1.52 0.01 . 1 . . . . 27 LEU HG . 16494 1 38 . 1 1 6 6 LEU H H 1 10.42 0.01 . 1 . . . . 28 LEU HN . 16494 1 39 . 1 1 6 6 LEU HA H 1 4.99 0.01 . 1 . . . . 28 LEU HA . 16494 1 40 . 1 1 6 6 LEU HB2 H 1 1.66 0.01 . 2 . . . . 28 LEU HB2 . 16494 1 41 . 1 1 6 6 LEU HB3 H 1 1.36 0.01 . 2 . . . . 28 LEU HB3 . 16494 1 42 . 1 1 6 6 LEU HD11 H 1 0.66 0.01 . 2 . . . . 28 LEU HD1 . 16494 1 43 . 1 1 6 6 LEU HD12 H 1 0.66 0.01 . 2 . . . . 28 LEU HD1 . 16494 1 44 . 1 1 6 6 LEU HD13 H 1 0.66 0.01 . 2 . . . . 28 LEU HD1 . 16494 1 45 . 1 1 6 6 LEU HD21 H 1 0.40 0.01 . 2 . . . . 28 LEU HD2 . 16494 1 46 . 1 1 6 6 LEU HD22 H 1 0.40 0.01 . 2 . . . . 28 LEU HD2 . 16494 1 47 . 1 1 6 6 LEU HD23 H 1 0.40 0.01 . 2 . . . . 28 LEU HD2 . 16494 1 48 . 1 1 6 6 LEU HG H 1 1.44 0.01 . 1 . . . . 28 LEU HG . 16494 1 49 . 1 1 7 7 TYR H H 1 8.63 0.01 . 1 . . . . 29 TYR HN . 16494 1 50 . 1 1 7 7 TYR HA H 1 4.57 0.01 . 1 . . . . 29 TYR HA . 16494 1 51 . 1 1 7 7 TYR HB2 H 1 3.40 0.01 . 2 . . . . 29 TYR HB2 . 16494 1 52 . 1 1 7 7 TYR HB3 H 1 2.94 0.01 . 2 . . . . 29 TYR HB3 . 16494 1 53 . 1 1 7 7 TYR HD1 H 1 6.44 0.01 . 3 . . . . 29 TYR HD1 . 16494 1 54 . 1 1 7 7 TYR HD2 H 1 6.44 0.01 . 3 . . . . 29 TYR HD2 . 16494 1 55 . 1 1 7 7 TYR HE1 H 1 6.50 0.01 . 3 . . . . 29 TYR HE1 . 16494 1 56 . 1 1 7 7 TYR HE2 H 1 6.50 0.01 . 3 . . . . 29 TYR HE2 . 16494 1 57 . 1 1 8 8 CYS H H 1 9.36 0.01 . 1 . . . . 30 CYS HN . 16494 1 58 . 1 1 8 8 CYS HA H 1 4.17 0.01 . 1 . . . . 30 CYS HA . 16494 1 59 . 1 1 8 8 CYS HB2 H 1 2.60 0.01 . 2 . . . . 30 CYS HB2 . 16494 1 60 . 1 1 8 8 CYS HB3 H 1 2.52 0.01 . 2 . . . . 30 CYS HB3 . 16494 1 61 . 1 1 9 9 SER H H 1 8.28 0.01 . 1 . . . . 31 SER HN . 16494 1 62 . 1 1 9 9 SER HA H 1 3.90 0.01 . 1 . . . . 31 SER HA . 16494 1 63 . 1 1 10 10 ASN H H 1 7.47 0.01 . 1 . . . . 32 ASN HN . 16494 1 64 . 1 1 10 10 ASN HA H 1 4.35 0.01 . 1 . . . . 32 ASN HA . 16494 1 65 . 1 1 10 10 ASN HB2 H 1 2.87 0.01 . 2 . . . . 32 ASN HB2 . 16494 1 66 . 1 1 10 10 ASN HB3 H 1 2.87 0.01 . 2 . . . . 32 ASN HB3 . 16494 1 67 . 1 1 10 10 ASN HD21 H 1 7.63 0.01 . 2 . . . . 32 ASN HD21 . 16494 1 68 . 1 1 10 10 ASN HD22 H 1 6.47 0.01 . 2 . . . . 32 ASN HD22 . 16494 1 69 . 1 1 11 11 GLY H H 1 8.52 0.01 . 1 . . . . 33 GLY HN . 16494 1 70 . 1 1 11 11 GLY HA2 H 1 4.65 0.01 . 2 . . . . 33 GLY HA1 . 16494 1 71 . 1 1 12 12 GLY H H 1 7.22 0.01 . 1 . . . . 34 GLY HN . 16494 1 72 . 1 1 12 12 GLY HA2 H 1 3.58 0.01 . 2 . . . . 34 GLY HA1 . 16494 1 73 . 1 1 12 12 GLY HA3 H 1 3.19 0.01 . 2 . . . . 34 GLY HA2 . 16494 1 74 . 1 1 13 13 HIS H H 1 6.42 0.01 . 1 . . . . 35 HIS HN . 16494 1 75 . 1 1 13 13 HIS HA H 1 4.06 0.01 . 1 . . . . 35 HIS HA . 16494 1 76 . 1 1 13 13 HIS HB2 H 1 2.63 0.01 . 2 . . . . 35 HIS HB2 . 16494 1 77 . 1 1 13 13 HIS HB3 H 1 2.47 0.01 . 2 . . . . 35 HIS HB3 . 16494 1 78 . 1 1 13 13 HIS HD1 H 1 6.45 0.01 . 1 . . . . 35 HIS HD1 . 16494 1 79 . 1 1 13 13 HIS HE2 H 1 7.70 0.01 . 1 . . . . 35 HIS HE2 . 16494 1 80 . 1 1 14 14 PHE H H 1 9.38 0.01 . 1 . . . . 36 PHE HN . 16494 1 81 . 1 1 14 14 PHE HA H 1 5.41 0.01 . 1 . . . . 36 PHE HA . 16494 1 82 . 1 1 14 14 PHE HB2 H 1 3.55 0.01 . 2 . . . . 36 PHE HB2 . 16494 1 83 . 1 1 14 14 PHE HB3 H 1 2.93 0.01 . 2 . . . . 36 PHE HB3 . 16494 1 84 . 1 1 14 14 PHE HD1 H 1 7.28 0.01 . 3 . . . . 36 PHE HD1 . 16494 1 85 . 1 1 14 14 PHE HD2 H 1 7.28 0.01 . 3 . . . . 36 PHE HD2 . 16494 1 86 . 1 1 14 14 PHE HE1 H 1 7.20 0.01 . 3 . . . . 36 PHE HE1 . 16494 1 87 . 1 1 14 14 PHE HE2 H 1 7.20 0.01 . 3 . . . . 36 PHE HE2 . 16494 1 88 . 1 1 15 15 LEU H H 1 8.56 0.01 . 1 . . . . 37 LEU HN . 16494 1 89 . 1 1 15 15 LEU HA H 1 4.34 0.01 . 1 . . . . 37 LEU HA . 16494 1 90 . 1 1 15 15 LEU HB2 H 1 1.88 0.01 . 2 . . . . 37 LEU HB2 . 16494 1 91 . 1 1 15 15 LEU HB3 H 1 1.35 0.01 . 2 . . . . 37 LEU HB3 . 16494 1 92 . 1 1 15 15 LEU HD11 H 1 0.66 0.01 . 2 . . . . 37 LEU HD1 . 16494 1 93 . 1 1 15 15 LEU HD12 H 1 0.66 0.01 . 2 . . . . 37 LEU HD1 . 16494 1 94 . 1 1 15 15 LEU HD13 H 1 0.66 0.01 . 2 . . . . 37 LEU HD1 . 16494 1 95 . 1 1 15 15 LEU HD21 H 1 0.42 0.01 . 2 . . . . 37 LEU HD2 . 16494 1 96 . 1 1 15 15 LEU HD22 H 1 0.42 0.01 . 2 . . . . 37 LEU HD2 . 16494 1 97 . 1 1 15 15 LEU HD23 H 1 0.42 0.01 . 2 . . . . 37 LEU HD2 . 16494 1 98 . 1 1 15 15 LEU HG H 1 1.46 0.01 . 1 . . . . 37 LEU HG . 16494 1 99 . 1 1 16 16 ARG H H 1 9.46 0.01 . 1 . . . . 38 ARG HN . 16494 1 100 . 1 1 16 16 ARG HA H 1 4.68 0.01 . 1 . . . . 38 ARG HA . 16494 1 101 . 1 1 16 16 ARG HB2 H 1 2.58 0.01 . 2 . . . . 38 ARG HB2 . 16494 1 102 . 1 1 16 16 ARG HB3 H 1 2.58 0.01 . 2 . . . . 38 ARG HB3 . 16494 1 103 . 1 1 16 16 ARG HD2 H 1 3.36 0.01 . 2 . . . . 38 ARG HD2 . 16494 1 104 . 1 1 16 16 ARG HD3 H 1 2.75 0.01 . 2 . . . . 38 ARG HD3 . 16494 1 105 . 1 1 16 16 ARG HE H 1 9.80 0.01 . 1 . . . . 38 ARG HE . 16494 1 106 . 1 1 16 16 ARG HG2 H 1 1.35 0.01 . 2 . . . . 38 ARG HG2 . 16494 1 107 . 1 1 16 16 ARG HG3 H 1 1.23 0.01 . 2 . . . . 38 ARG HG3 . 16494 1 108 . 1 1 17 17 ILE H H 1 7.09 0.01 . 1 . . . . 39 ILE HN . 16494 1 109 . 1 1 17 17 ILE HA H 1 4.55 0.01 . 1 . . . . 39 ILE HA . 16494 1 110 . 1 1 17 17 ILE HB H 1 1.67 0.01 . 1 . . . . 39 ILE HB . 16494 1 111 . 1 1 17 17 ILE HG21 H 1 0.61 0.01 . 1 . . . . 39 ILE HG2 . 16494 1 112 . 1 1 17 17 ILE HG22 H 1 0.61 0.01 . 1 . . . . 39 ILE HG2 . 16494 1 113 . 1 1 17 17 ILE HG23 H 1 0.61 0.01 . 1 . . . . 39 ILE HG2 . 16494 1 114 . 1 1 18 18 LEU H H 1 9.03 0.01 . 1 . . . . 40 LEU HN . 16494 1 115 . 1 1 18 18 LEU HA H 1 4.14 0.01 . 1 . . . . 40 LEU HA . 16494 1 116 . 1 1 18 18 LEU HB2 H 1 2.01 0.01 . 2 . . . . 40 LEU HB2 . 16494 1 117 . 1 1 18 18 LEU HB3 H 1 1.37 0.01 . 2 . . . . 40 LEU HB3 . 16494 1 118 . 1 1 18 18 LEU HD11 H 1 0.80 0.01 . 2 . . . . 40 LEU HD1 . 16494 1 119 . 1 1 18 18 LEU HD12 H 1 0.80 0.01 . 2 . . . . 40 LEU HD1 . 16494 1 120 . 1 1 18 18 LEU HD13 H 1 0.80 0.01 . 2 . . . . 40 LEU HD1 . 16494 1 121 . 1 1 18 18 LEU HD21 H 1 0.66 0.01 . 2 . . . . 40 LEU HD2 . 16494 1 122 . 1 1 18 18 LEU HD22 H 1 0.66 0.01 . 2 . . . . 40 LEU HD2 . 16494 1 123 . 1 1 18 18 LEU HD23 H 1 0.66 0.01 . 2 . . . . 40 LEU HD2 . 16494 1 124 . 1 1 19 19 PRO HA H 1 4.28 0.01 . 1 . . . . 41 PRO HA . 16494 1 125 . 1 1 19 19 PRO HB2 H 1 2.33 0.01 . 2 . . . . 41 PRO HB2 . 16494 1 126 . 1 1 19 19 PRO HB3 H 1 1.96 0.01 . 2 . . . . 41 PRO HB3 . 16494 1 127 . 1 1 19 19 PRO HD2 H 1 3.48 0.01 . 2 . . . . 41 PRO HD2 . 16494 1 128 . 1 1 19 19 PRO HD3 H 1 2.45 0.01 . 2 . . . . 41 PRO HD3 . 16494 1 129 . 1 1 19 19 PRO HG2 H 1 1.77 0.01 . 2 . . . . 41 PRO HG2 . 16494 1 130 . 1 1 19 19 PRO HG3 H 1 1.77 0.01 . 2 . . . . 41 PRO HG3 . 16494 1 131 . 1 1 20 20 ASP H H 1 7.53 0.01 . 1 . . . . 42 ASP HN . 16494 1 132 . 1 1 20 20 ASP HA H 1 4.51 0.01 . 1 . . . . 42 ASP HA . 16494 1 133 . 1 1 20 20 ASP HB2 H 1 3.08 0.01 . 2 . . . . 42 ASP HB2 . 16494 1 134 . 1 1 20 20 ASP HB3 H 1 2.59 0.01 . 2 . . . . 42 ASP HB3 . 16494 1 135 . 1 1 21 21 GLY H H 1 8.50 0.01 . 1 . . . . 43 GLY HN . 16494 1 136 . 1 1 22 22 THR H H 1 7.99 0.01 . 1 . . . . 44 THR HN . 16494 1 137 . 1 1 22 22 THR HA H 1 4.46 0.01 . 1 . . . . 44 THR HA . 16494 1 138 . 1 1 22 22 THR HB H 1 4.20 0.01 . 1 . . . . 44 THR HB . 16494 1 139 . 1 1 22 22 THR HG21 H 1 1.17 0.01 . 1 . . . . 44 THR HG2 . 16494 1 140 . 1 1 22 22 THR HG22 H 1 1.17 0.01 . 1 . . . . 44 THR HG2 . 16494 1 141 . 1 1 22 22 THR HG23 H 1 1.17 0.01 . 1 . . . . 44 THR HG2 . 16494 1 142 . 1 1 23 23 VAL H H 1 7.92 0.01 . 1 . . . . 45 VAL HN . 16494 1 143 . 1 1 23 23 VAL HA H 1 5.08 0.01 . 1 . . . . 45 VAL HA . 16494 1 144 . 1 1 23 23 VAL HB H 1 1.59 0.01 . 1 . . . . 45 VAL HB . 16494 1 145 . 1 1 23 23 VAL HG11 H 1 0.88 0.01 . 2 . . . . 45 VAL HG1 . 16494 1 146 . 1 1 23 23 VAL HG12 H 1 0.88 0.01 . 2 . . . . 45 VAL HG1 . 16494 1 147 . 1 1 23 23 VAL HG13 H 1 0.88 0.01 . 2 . . . . 45 VAL HG1 . 16494 1 148 . 1 1 23 23 VAL HG21 H 1 0.76 0.01 . 2 . . . . 45 VAL HG2 . 16494 1 149 . 1 1 23 23 VAL HG22 H 1 0.76 0.01 . 2 . . . . 45 VAL HG2 . 16494 1 150 . 1 1 23 23 VAL HG23 H 1 0.76 0.01 . 2 . . . . 45 VAL HG2 . 16494 1 151 . 1 1 24 24 ASP H H 1 9.04 0.01 . 1 . . . . 46 ASP HN . 16494 1 152 . 1 1 24 24 ASP HA H 1 4.30 0.01 . 1 . . . . 46 ASP HA . 16494 1 153 . 1 1 24 24 ASP HB2 H 1 2.99 0.01 . 2 . . . . 46 ASP HB2 . 16494 1 154 . 1 1 24 24 ASP HB3 H 1 2.72 0.01 . 2 . . . . 46 ASP HB3 . 16494 1 155 . 1 1 25 25 GLY H H 1 8.00 0.01 . 1 . . . . 47 GLY HN . 16494 1 156 . 1 1 25 25 GLY HA2 H 1 5.51 0.01 . 2 . . . . 47 GLY HA1 . 16494 1 157 . 1 1 25 25 GLY HA3 H 1 3.01 0.01 . 2 . . . . 47 GLY HA2 . 16494 1 158 . 1 1 26 26 THR H H 1 8.63 0.01 . 1 . . . . 48 THR HN . 16494 1 159 . 1 1 26 26 THR HA H 1 5.18 0.01 . 1 . . . . 48 THR HA . 16494 1 160 . 1 1 26 26 THR HB H 1 3.98 0.01 . 1 . . . . 48 THR HB . 16494 1 161 . 1 1 26 26 THR HG21 H 1 1.34 0.01 . 1 . . . . 48 THR HG2 . 16494 1 162 . 1 1 26 26 THR HG22 H 1 1.34 0.01 . 1 . . . . 48 THR HG2 . 16494 1 163 . 1 1 26 26 THR HG23 H 1 1.34 0.01 . 1 . . . . 48 THR HG2 . 16494 1 164 . 1 1 27 27 ARG H H 1 9.11 0.01 . 1 . . . . 49 ARG HN . 16494 1 165 . 1 1 27 27 ARG HA H 1 4.64 0.01 . 1 . . . . 49 ARG HA . 16494 1 166 . 1 1 27 27 ARG HB2 H 1 2.20 0.01 . 2 . . . . 49 ARG HB2 . 16494 1 167 . 1 1 27 27 ARG HB3 H 1 1.75 0.01 . 2 . . . . 49 ARG HB3 . 16494 1 168 . 1 1 28 28 ASP H H 1 8.45 0.01 . 1 . . . . 50 ASP HN . 16494 1 169 . 1 1 28 28 ASP HA H 1 4.64 0.01 . 1 . . . . 50 ASP HA . 16494 1 170 . 1 1 28 28 ASP HB2 H 1 3.22 0.01 . 2 . . . . 50 ASP HB2 . 16494 1 171 . 1 1 28 28 ASP HB3 H 1 2.66 0.01 . 2 . . . . 50 ASP HB3 . 16494 1 172 . 1 1 29 29 ARG H H 1 8.44 0.01 . 1 . . . . 51 ARG HN . 16494 1 173 . 1 1 29 29 ARG HA H 1 3.58 0.01 . 1 . . . . 51 ARG HA . 16494 1 174 . 1 1 29 29 ARG HB2 H 1 1.77 0.01 . 2 . . . . 51 ARG HB2 . 16494 1 175 . 1 1 29 29 ARG HB3 H 1 1.70 0.01 . 2 . . . . 51 ARG HB3 . 16494 1 176 . 1 1 29 29 ARG HD2 H 1 3.12 0.01 . 2 . . . . 51 ARG HD2 . 16494 1 177 . 1 1 29 29 ARG HD3 H 1 3.12 0.01 . 2 . . . . 51 ARG HD3 . 16494 1 178 . 1 1 29 29 ARG HE H 1 7.06 0.01 . 1 . . . . 51 ARG HE . 16494 1 179 . 1 1 29 29 ARG HG2 H 1 1.29 0.01 . 2 . . . . 51 ARG HG2 . 16494 1 180 . 1 1 29 29 ARG HG3 H 1 1.29 0.01 . 2 . . . . 51 ARG HG3 . 16494 1 181 . 1 1 30 30 SER H H 1 8.51 0.01 . 1 . . . . 52 SER HN . 16494 1 182 . 1 1 30 30 SER HA H 1 4.38 0.01 . 1 . . . . 52 SER HA . 16494 1 183 . 1 1 30 30 SER HB2 H 1 4.01 0.01 . 2 . . . . 52 SER HB2 . 16494 1 184 . 1 1 30 30 SER HB3 H 1 3.84 0.01 . 2 . . . . 52 SER HB3 . 16494 1 185 . 1 1 31 31 ASP H H 1 7.21 0.01 . 1 . . . . 53 ASP HN . 16494 1 186 . 1 1 31 31 ASP HA H 1 4.26 0.01 . 1 . . . . 53 ASP HA . 16494 1 187 . 1 1 31 31 ASP HB2 H 1 2.78 0.01 . 2 . . . . 53 ASP HB2 . 16494 1 188 . 1 1 31 31 ASP HB3 H 1 2.69 0.01 . 2 . . . . 53 ASP HB3 . 16494 1 189 . 1 1 32 32 GLN H H 1 8.97 0.01 . 1 . . . . 54 GLN HN . 16494 1 190 . 1 1 32 32 GLN HA H 1 4.00 0.01 . 1 . . . . 54 GLN HA . 16494 1 191 . 1 1 32 32 GLN HB2 H 1 1.75 0.01 . 2 . . . . 54 GLN HB2 . 16494 1 192 . 1 1 32 32 GLN HB3 H 1 1.52 0.01 . 2 . . . . 54 GLN HB3 . 16494 1 193 . 1 1 32 32 GLN HG2 H 1 2.06 0.01 . 2 . . . . 54 GLN HG2 . 16494 1 194 . 1 1 32 32 GLN HG3 H 1 2.06 0.01 . 2 . . . . 54 GLN HG3 . 16494 1 195 . 1 1 33 33 HIS H H 1 9.79 0.01 . 1 . . . . 55 HIS HN . 16494 1 196 . 1 1 33 33 HIS HB2 H 1 3.85 0.01 . 2 . . . . 55 HIS HB2 . 16494 1 197 . 1 1 33 33 HIS HB3 H 1 3.00 0.01 . 2 . . . . 55 HIS HB3 . 16494 1 198 . 1 1 33 33 HIS HD1 H 1 7.14 0.01 . 1 . . . . 55 HIS HD1 . 16494 1 199 . 1 1 33 33 HIS HE2 H 1 8.08 0.01 . 1 . . . . 55 HIS HE2 . 16494 1 200 . 1 1 34 34 ILE H H 1 6.80 0.01 . 1 . . . . 56 ILE HN . 16494 1 201 . 1 1 34 34 ILE HA H 1 5.12 0.01 . 1 . . . . 56 ILE HA . 16494 1 202 . 1 1 34 34 ILE HB H 1 2.43 0.01 . 1 . . . . 56 ILE HB . 16494 1 203 . 1 1 34 34 ILE HD11 H 1 0.58 0.01 . 1 . . . . 56 ILE HD1 . 16494 1 204 . 1 1 34 34 ILE HD12 H 1 0.58 0.01 . 1 . . . . 56 ILE HD1 . 16494 1 205 . 1 1 34 34 ILE HD13 H 1 0.58 0.01 . 1 . . . . 56 ILE HD1 . 16494 1 206 . 1 1 34 34 ILE HG12 H 1 1.58 0.01 . 2 . . . . 56 ILE HG12 . 16494 1 207 . 1 1 34 34 ILE HG21 H 1 0.82 0.01 . 1 . . . . 56 ILE HG2 . 16494 1 208 . 1 1 34 34 ILE HG22 H 1 0.82 0.01 . 1 . . . . 56 ILE HG2 . 16494 1 209 . 1 1 34 34 ILE HG23 H 1 0.82 0.01 . 1 . . . . 56 ILE HG2 . 16494 1 210 . 1 1 35 35 GLN H H 1 7.16 0.01 . 1 . . . . 57 GLN HN . 16494 1 211 . 1 1 35 35 GLN HA H 1 4.26 0.01 . 1 . . . . 57 GLN HA . 16494 1 212 . 1 1 36 36 LEU H H 1 9.28 0.01 . 1 . . . . 58 LEU HN . 16494 1 213 . 1 1 36 36 LEU HA H 1 5.34 0.01 . 1 . . . . 58 LEU HA . 16494 1 214 . 1 1 36 36 LEU HB2 H 1 1.58 0.01 . 2 . . . . 58 LEU HB2 . 16494 1 215 . 1 1 36 36 LEU HB3 H 1 1.04 0.01 . 2 . . . . 58 LEU HB3 . 16494 1 216 . 1 1 36 36 LEU HD11 H 1 0.73 0.01 . 2 . . . . 58 LEU HD1 . 16494 1 217 . 1 1 36 36 LEU HD12 H 1 0.73 0.01 . 2 . . . . 58 LEU HD1 . 16494 1 218 . 1 1 36 36 LEU HD13 H 1 0.73 0.01 . 2 . . . . 58 LEU HD1 . 16494 1 219 . 1 1 36 36 LEU HD21 H 1 0.60 0.01 . 2 . . . . 58 LEU HD2 . 16494 1 220 . 1 1 36 36 LEU HD22 H 1 0.60 0.01 . 2 . . . . 58 LEU HD2 . 16494 1 221 . 1 1 36 36 LEU HD23 H 1 0.60 0.01 . 2 . . . . 58 LEU HD2 . 16494 1 222 . 1 1 36 36 LEU HG H 1 1.93 0.01 . 1 . . . . 58 LEU HG . 16494 1 223 . 1 1 37 37 GLN H H 1 9.60 0.01 . 1 . . . . 59 GLN HN . 16494 1 224 . 1 1 37 37 GLN HA H 1 4.65 0.01 . 1 . . . . 59 GLN HA . 16494 1 225 . 1 1 37 37 GLN HB2 H 1 1.89 0.01 . 2 . . . . 59 GLN HB2 . 16494 1 226 . 1 1 37 37 GLN HB3 H 1 1.74 0.01 . 2 . . . . 59 GLN HB3 . 16494 1 227 . 1 1 37 37 GLN HG2 H 1 2.12 0.01 . 2 . . . . 59 GLN HG2 . 16494 1 228 . 1 1 37 37 GLN HG3 H 1 2.12 0.01 . 2 . . . . 59 GLN HG3 . 16494 1 229 . 1 1 38 38 LEU H H 1 8.79 0.01 . 1 . . . . 60 LEU HN . 16494 1 230 . 1 1 38 38 LEU HA H 1 5.44 0.01 . 1 . . . . 60 LEU HA . 16494 1 231 . 1 1 38 38 LEU HB2 H 1 1.66 0.01 . 2 . . . . 60 LEU HB2 . 16494 1 232 . 1 1 38 38 LEU HB3 H 1 1.59 0.01 . 2 . . . . 60 LEU HB3 . 16494 1 233 . 1 1 38 38 LEU HD11 H 1 0.86 0.01 . 2 . . . . 60 LEU HD1 . 16494 1 234 . 1 1 38 38 LEU HD12 H 1 0.86 0.01 . 2 . . . . 60 LEU HD1 . 16494 1 235 . 1 1 38 38 LEU HD13 H 1 0.86 0.01 . 2 . . . . 60 LEU HD1 . 16494 1 236 . 1 1 38 38 LEU HD21 H 1 0.80 0.01 . 2 . . . . 60 LEU HD2 . 16494 1 237 . 1 1 38 38 LEU HD22 H 1 0.80 0.01 . 2 . . . . 60 LEU HD2 . 16494 1 238 . 1 1 38 38 LEU HD23 H 1 0.80 0.01 . 2 . . . . 60 LEU HD2 . 16494 1 239 . 1 1 38 38 LEU HG H 1 1.66 0.01 . 1 . . . . 60 LEU HG . 16494 1 240 . 1 1 39 39 SER H H 1 8.85 0.01 . 1 . . . . 61 SER HN . 16494 1 241 . 1 1 39 39 SER HB2 H 1 3.95 0.01 . 2 . . . . 61 SER HB2 . 16494 1 242 . 1 1 39 39 SER HB3 H 1 3.85 0.01 . 2 . . . . 61 SER HB3 . 16494 1 243 . 1 1 40 40 ALA H H 1 8.74 0.01 . 1 . . . . 62 ALA HN . 16494 1 244 . 1 1 40 40 ALA HA H 1 5.08 0.01 . 1 . . . . 62 ALA HA . 16494 1 245 . 1 1 40 40 ALA HB1 H 1 1.44 0.01 . 1 . . . . 62 ALA HB . 16494 1 246 . 1 1 40 40 ALA HB2 H 1 1.44 0.01 . 1 . . . . 62 ALA HB . 16494 1 247 . 1 1 40 40 ALA HB3 H 1 1.44 0.01 . 1 . . . . 62 ALA HB . 16494 1 248 . 1 1 41 41 GLU H H 1 8.58 0.01 . 1 . . . . 63 GLU HN . 16494 1 249 . 1 1 41 41 GLU HA H 1 4.45 0.01 . 1 . . . . 63 GLU HA . 16494 1 250 . 1 1 41 41 GLU HB2 H 1 1.99 0.01 . 2 . . . . 63 GLU HB2 . 16494 1 251 . 1 1 41 41 GLU HB3 H 1 1.80 0.01 . 2 . . . . 63 GLU HB3 . 16494 1 252 . 1 1 41 41 GLU HG2 H 1 2.21 0.01 . 2 . . . . 63 GLU HG2 . 16494 1 253 . 1 1 41 41 GLU HG3 H 1 2.07 0.01 . 2 . . . . 63 GLU HG3 . 16494 1 254 . 1 1 42 42 SER H H 1 8.16 0.01 . 1 . . . . 64 SER HN . 16494 1 255 . 1 1 42 42 SER HA H 1 4.53 0.01 . 1 . . . . 64 SER HA . 16494 1 256 . 1 1 42 42 SER HB2 H 1 3.83 0.01 . 2 . . . . 64 SER HB2 . 16494 1 257 . 1 1 42 42 SER HB3 H 1 3.70 0.01 . 2 . . . . 64 SER HB3 . 16494 1 258 . 1 1 43 43 VAL H H 1 8.23 0.01 . 1 . . . . 65 VAL HN . 16494 1 259 . 1 1 43 43 VAL HA H 1 3.84 0.01 . 1 . . . . 65 VAL HA . 16494 1 260 . 1 1 43 43 VAL HB H 1 2.04 0.01 . 1 . . . . 65 VAL HB . 16494 1 261 . 1 1 43 43 VAL HG11 H 1 1.08 0.01 . 2 . . . . 65 VAL HG1 . 16494 1 262 . 1 1 43 43 VAL HG12 H 1 1.08 0.01 . 2 . . . . 65 VAL HG1 . 16494 1 263 . 1 1 43 43 VAL HG13 H 1 1.08 0.01 . 2 . . . . 65 VAL HG1 . 16494 1 264 . 1 1 43 43 VAL HG21 H 1 0.98 0.01 . 2 . . . . 65 VAL HG2 . 16494 1 265 . 1 1 43 43 VAL HG22 H 1 0.98 0.01 . 2 . . . . 65 VAL HG2 . 16494 1 266 . 1 1 43 43 VAL HG23 H 1 0.98 0.01 . 2 . . . . 65 VAL HG2 . 16494 1 267 . 1 1 44 44 GLY H H 1 8.92 0.01 . 1 . . . . 66 GLY HN . 16494 1 268 . 1 1 44 44 GLY HA2 H 1 4.30 0.01 . 2 . . . . 66 GLY HA1 . 16494 1 269 . 1 1 44 44 GLY HA3 H 1 3.98 0.01 . 2 . . . . 66 GLY HA2 . 16494 1 270 . 1 1 45 45 GLU H H 1 8.14 0.01 . 1 . . . . 67 GLU HN . 16494 1 271 . 1 1 45 45 GLU HA H 1 5.44 0.01 . 1 . . . . 67 GLU HA . 16494 1 272 . 1 1 45 45 GLU HB2 H 1 1.87 0.01 . 2 . . . . 67 GLU HB2 . 16494 1 273 . 1 1 45 45 GLU HB3 H 1 1.80 0.01 . 2 . . . . 67 GLU HB3 . 16494 1 274 . 1 1 45 45 GLU HG2 H 1 2.10 0.01 . 2 . . . . 67 GLU HG2 . 16494 1 275 . 1 1 45 45 GLU HG3 H 1 1.99 0.01 . 2 . . . . 67 GLU HG3 . 16494 1 276 . 1 1 46 46 VAL H H 1 9.68 0.01 . 1 . . . . 68 VAL HN . 16494 1 277 . 1 1 46 46 VAL HA H 1 5.49 0.01 . 1 . . . . 68 VAL HA . 16494 1 278 . 1 1 46 46 VAL HB H 1 2.26 0.01 . 1 . . . . 68 VAL HB . 16494 1 279 . 1 1 46 46 VAL HG11 H 1 0.98 0.01 . 2 . . . . 68 VAL HG1 . 16494 1 280 . 1 1 46 46 VAL HG12 H 1 0.98 0.01 . 2 . . . . 68 VAL HG1 . 16494 1 281 . 1 1 46 46 VAL HG13 H 1 0.98 0.01 . 2 . . . . 68 VAL HG1 . 16494 1 282 . 1 1 46 46 VAL HG21 H 1 0.90 0.01 . 2 . . . . 68 VAL HG2 . 16494 1 283 . 1 1 46 46 VAL HG22 H 1 0.90 0.01 . 2 . . . . 68 VAL HG2 . 16494 1 284 . 1 1 46 46 VAL HG23 H 1 0.90 0.01 . 2 . . . . 68 VAL HG2 . 16494 1 285 . 1 1 47 47 TYR H H 1 8.54 0.01 . 1 . . . . 69 TYR HN . 16494 1 286 . 1 1 47 47 TYR HA H 1 5.31 0.01 . 1 . . . . 69 TYR HA . 16494 1 287 . 1 1 47 47 TYR HB2 H 1 3.28 0.01 . 2 . . . . 69 TYR HB2 . 16494 1 288 . 1 1 47 47 TYR HB3 H 1 3.00 0.01 . 2 . . . . 69 TYR HB3 . 16494 1 289 . 1 1 47 47 TYR HD1 H 1 7.20 0.01 . 3 . . . . 69 TYR HD1 . 16494 1 290 . 1 1 47 47 TYR HD2 H 1 7.20 0.01 . 3 . . . . 69 TYR HD2 . 16494 1 291 . 1 1 47 47 TYR HE1 H 1 6.58 0.01 . 3 . . . . 69 TYR HE1 . 16494 1 292 . 1 1 47 47 TYR HE2 H 1 6.58 0.01 . 3 . . . . 69 TYR HE2 . 16494 1 293 . 1 1 48 48 ILE H H 1 10.66 0.01 . 1 . . . . 70 ILE HN . 16494 1 294 . 1 1 48 48 ILE HA H 1 4.41 0.01 . 1 . . . . 70 ILE HA . 16494 1 295 . 1 1 48 48 ILE HB H 1 1.60 0.01 . 1 . . . . 70 ILE HB . 16494 1 296 . 1 1 48 48 ILE HD11 H 1 -0.20 0.01 . 1 . . . . 70 ILE HD1 . 16494 1 297 . 1 1 48 48 ILE HD12 H 1 -0.20 0.01 . 1 . . . . 70 ILE HD1 . 16494 1 298 . 1 1 48 48 ILE HD13 H 1 -0.20 0.01 . 1 . . . . 70 ILE HD1 . 16494 1 299 . 1 1 48 48 ILE HG12 H 1 1.38 0.01 . 2 . . . . 70 ILE HG12 . 16494 1 300 . 1 1 48 48 ILE HG13 H 1 0.52 0.01 . 2 . . . . 70 ILE HG13 . 16494 1 301 . 1 1 48 48 ILE HG21 H 1 0.48 0.01 . 1 . . . . 70 ILE HG2 . 16494 1 302 . 1 1 48 48 ILE HG22 H 1 0.48 0.01 . 1 . . . . 70 ILE HG2 . 16494 1 303 . 1 1 48 48 ILE HG23 H 1 0.48 0.01 . 1 . . . . 70 ILE HG2 . 16494 1 304 . 1 1 49 49 LYS H H 1 8.67 0.01 . 1 . . . . 71 LYS HN . 16494 1 305 . 1 1 49 49 LYS HA H 1 4.97 0.01 . 1 . . . . 71 LYS HA . 16494 1 306 . 1 1 49 49 LYS HB2 H 1 1.30 0.01 . 2 . . . . 71 LYS HB2 . 16494 1 307 . 1 1 49 49 LYS HB3 H 1 1.10 0.01 . 2 . . . . 71 LYS HB3 . 16494 1 308 . 1 1 49 49 LYS HD2 H 1 1.19 0.01 . 2 . . . . 71 LYS HD2 . 16494 1 309 . 1 1 49 49 LYS HD3 H 1 1.19 0.01 . 2 . . . . 71 LYS HD3 . 16494 1 310 . 1 1 49 49 LYS HE2 H 1 2.62 0.01 . 2 . . . . 71 LYS HE2 . 16494 1 311 . 1 1 49 49 LYS HE3 H 1 2.50 0.01 . 2 . . . . 71 LYS HE3 . 16494 1 312 . 1 1 49 49 LYS HG2 H 1 0.63 0.01 . 2 . . . . 71 LYS HG2 . 16494 1 313 . 1 1 49 49 LYS HG3 H 1 0.29 0.01 . 2 . . . . 71 LYS HG3 . 16494 1 314 . 1 1 50 50 SER H H 1 9.04 0.01 . 1 . . . . 72 SER HN . 16494 1 315 . 1 1 50 50 SER HA H 1 4.68 0.01 . 1 . . . . 72 SER HA . 16494 1 316 . 1 1 50 50 SER HB2 H 1 3.87 0.01 . 2 . . . . 72 SER HB2 . 16494 1 317 . 1 1 50 50 SER HB3 H 1 3.10 0.01 . 2 . . . . 72 SER HB3 . 16494 1 318 . 1 1 51 51 THR H H 1 8.52 0.01 . 1 . . . . 73 THR HN . 16494 1 319 . 1 1 51 51 THR HA H 1 3.99 0.01 . 1 . . . . 73 THR HA . 16494 1 320 . 1 1 51 51 THR HB H 1 4.16 0.01 . 1 . . . . 73 THR HB . 16494 1 321 . 1 1 51 51 THR HG21 H 1 1.16 0.01 . 1 . . . . 73 THR HG2 . 16494 1 322 . 1 1 51 51 THR HG22 H 1 1.16 0.01 . 1 . . . . 73 THR HG2 . 16494 1 323 . 1 1 51 51 THR HG23 H 1 1.16 0.01 . 1 . . . . 73 THR HG2 . 16494 1 324 . 1 1 52 52 GLU H H 1 8.52 0.01 . 1 . . . . 74 GLU HN . 16494 1 325 . 1 1 52 52 GLU HA H 1 4.29 0.01 . 1 . . . . 74 GLU HA . 16494 1 326 . 1 1 52 52 GLU HB2 H 1 1.84 0.01 . 2 . . . . 74 GLU HB2 . 16494 1 327 . 1 1 52 52 GLU HB3 H 1 1.84 0.01 . 2 . . . . 74 GLU HB3 . 16494 1 328 . 1 1 52 52 GLU HG2 H 1 2.15 0.01 . 2 . . . . 74 GLU HG2 . 16494 1 329 . 1 1 52 52 GLU HG3 H 1 2.15 0.01 . 2 . . . . 74 GLU HG3 . 16494 1 330 . 1 1 53 53 THR H H 1 7.82 0.01 . 1 . . . . 75 THR HN . 16494 1 331 . 1 1 53 53 THR HA H 1 4.69 0.01 . 1 . . . . 75 THR HA . 16494 1 332 . 1 1 53 53 THR HB H 1 4.54 0.01 . 1 . . . . 75 THR HB . 16494 1 333 . 1 1 53 53 THR HG21 H 1 1.28 0.01 . 1 . . . . 75 THR HG2 . 16494 1 334 . 1 1 53 53 THR HG22 H 1 1.28 0.01 . 1 . . . . 75 THR HG2 . 16494 1 335 . 1 1 53 53 THR HG23 H 1 1.28 0.01 . 1 . . . . 75 THR HG2 . 16494 1 336 . 1 1 54 54 GLY H H 1 7.77 0.01 . 1 . . . . 76 GLY HN . 16494 1 337 . 1 1 54 54 GLY HA2 H 1 4.14 0.01 . 2 . . . . 76 GLY HA1 . 16494 1 338 . 1 1 54 54 GLY HA3 H 1 3.60 0.01 . 2 . . . . 76 GLY HA2 . 16494 1 339 . 1 1 55 55 GLN H H 1 7.27 0.01 . 1 . . . . 77 GLN HN . 16494 1 340 . 1 1 55 55 GLN HA H 1 4.30 0.01 . 1 . . . . 77 GLN HA . 16494 1 341 . 1 1 55 55 GLN HB2 H 1 1.55 0.01 . 2 . . . . 77 GLN HB2 . 16494 1 342 . 1 1 55 55 GLN HB3 H 1 1.55 0.01 . 2 . . . . 77 GLN HB3 . 16494 1 343 . 1 1 56 56 TYR H H 1 9.38 0.01 . 1 . . . . 78 TYR HN . 16494 1 344 . 1 1 56 56 TYR HA H 1 4.78 0.01 . 1 . . . . 78 TYR HA . 16494 1 345 . 1 1 56 56 TYR HB3 H 1 2.80 0.01 . 2 . . . . 78 TYR HB3 . 16494 1 346 . 1 1 56 56 TYR HD1 H 1 7.09 0.01 . 3 . . . . 78 TYR HD1 . 16494 1 347 . 1 1 56 56 TYR HD2 H 1 7.09 0.01 . 3 . . . . 78 TYR HD2 . 16494 1 348 . 1 1 56 56 TYR HE1 H 1 6.51 0.01 . 3 . . . . 78 TYR HE1 . 16494 1 349 . 1 1 56 56 TYR HE2 H 1 6.51 0.01 . 3 . . . . 78 TYR HE2 . 16494 1 350 . 1 1 57 57 LEU H H 1 9.26 0.01 . 1 . . . . 79 LEU HN . 16494 1 351 . 1 1 57 57 LEU HA H 1 4.12 0.01 . 1 . . . . 79 LEU HA . 16494 1 352 . 1 1 57 57 LEU HB2 H 1 1.96 0.01 . 2 . . . . 79 LEU HB2 . 16494 1 353 . 1 1 57 57 LEU HB3 H 1 1.04 0.01 . 2 . . . . 79 LEU HB3 . 16494 1 354 . 1 1 57 57 LEU HD21 H 1 0.18 0.01 . 2 . . . . 79 LEU HD2 . 16494 1 355 . 1 1 57 57 LEU HD22 H 1 0.18 0.01 . 2 . . . . 79 LEU HD2 . 16494 1 356 . 1 1 57 57 LEU HD23 H 1 0.18 0.01 . 2 . . . . 79 LEU HD2 . 16494 1 357 . 1 1 57 57 LEU HG H 1 1.63 0.01 . 1 . . . . 79 LEU HG . 16494 1 358 . 1 1 58 58 ALA H H 1 8.76 0.01 . 1 . . . . 80 ALA HN . 16494 1 359 . 1 1 58 58 ALA HA H 1 5.12 0.01 . 1 . . . . 80 ALA HA . 16494 1 360 . 1 1 58 58 ALA HB1 H 1 0.60 0.01 . 1 . . . . 80 ALA HB . 16494 1 361 . 1 1 58 58 ALA HB2 H 1 0.60 0.01 . 1 . . . . 80 ALA HB . 16494 1 362 . 1 1 58 58 ALA HB3 H 1 0.60 0.01 . 1 . . . . 80 ALA HB . 16494 1 363 . 1 1 59 59 MET H H 1 7.64 0.01 . 1 . . . . 81 MET HN . 16494 1 364 . 1 1 59 59 MET HA H 1 5.50 0.01 . 1 . . . . 81 MET HA . 16494 1 365 . 1 1 59 59 MET HB2 H 1 2.40 0.01 . 2 . . . . 81 MET HB2 . 16494 1 366 . 1 1 59 59 MET HB3 H 1 2.40 0.01 . 2 . . . . 81 MET HB3 . 16494 1 367 . 1 1 59 59 MET HG2 H 1 2.63 0.01 . 2 . . . . 81 MET HG2 . 16494 1 368 . 1 1 59 59 MET HG3 H 1 2.20 0.01 . 2 . . . . 81 MET HG3 . 16494 1 369 . 1 1 60 60 ASP H H 1 9.27 0.01 . 1 . . . . 82 ASP HN . 16494 1 370 . 1 1 60 60 ASP HA H 1 5.04 0.01 . 1 . . . . 82 ASP HA . 16494 1 371 . 1 1 60 60 ASP HB2 H 1 3.56 0.01 . 2 . . . . 82 ASP HB2 . 16494 1 372 . 1 1 60 60 ASP HB3 H 1 2.85 0.01 . 2 . . . . 82 ASP HB3 . 16494 1 373 . 1 1 61 61 THR H H 1 8.06 0.01 . 1 . . . . 83 THR HN . 16494 1 374 . 1 1 61 61 THR HA H 1 4.15 0.01 . 1 . . . . 83 THR HA . 16494 1 375 . 1 1 61 61 THR HB H 1 4.53 0.01 . 1 . . . . 83 THR HB . 16494 1 376 . 1 1 61 61 THR HG21 H 1 1.46 0.01 . 1 . . . . 83 THR HG2 . 16494 1 377 . 1 1 61 61 THR HG22 H 1 1.46 0.01 . 1 . . . . 83 THR HG2 . 16494 1 378 . 1 1 61 61 THR HG23 H 1 1.46 0.01 . 1 . . . . 83 THR HG2 . 16494 1 379 . 1 1 62 62 ASP H H 1 8.48 0.01 . 1 . . . . 84 ASP HN . 16494 1 380 . 1 1 62 62 ASP HA H 1 4.94 0.01 . 1 . . . . 84 ASP HA . 16494 1 381 . 1 1 62 62 ASP HB2 H 1 2.75 0.01 . 2 . . . . 84 ASP HB2 . 16494 1 382 . 1 1 62 62 ASP HB3 H 1 2.75 0.01 . 2 . . . . 84 ASP HB3 . 16494 1 383 . 1 1 63 63 GLY H H 1 8.38 0.01 . 1 . . . . 85 GLY HN . 16494 1 384 . 1 1 63 63 GLY HA2 H 1 3.62 0.01 . 2 . . . . 85 GLY HA1 . 16494 1 385 . 1 1 63 63 GLY HA3 H 1 3.34 0.01 . 2 . . . . 85 GLY HA2 . 16494 1 386 . 1 1 64 64 LEU H H 1 8.73 0.01 . 1 . . . . 86 LEU HN . 16494 1 387 . 1 1 64 64 LEU HA H 1 4.54 0.01 . 1 . . . . 86 LEU HA . 16494 1 388 . 1 1 64 64 LEU HB2 H 1 2.05 0.01 . 2 . . . . 86 LEU HB2 . 16494 1 389 . 1 1 64 64 LEU HB3 H 1 1.62 0.01 . 2 . . . . 86 LEU HB3 . 16494 1 390 . 1 1 64 64 LEU HD11 H 1 1.00 0.01 . 2 . . . . 86 LEU HD1 . 16494 1 391 . 1 1 64 64 LEU HD12 H 1 1.00 0.01 . 2 . . . . 86 LEU HD1 . 16494 1 392 . 1 1 64 64 LEU HD13 H 1 1.00 0.01 . 2 . . . . 86 LEU HD1 . 16494 1 393 . 1 1 64 64 LEU HD21 H 1 0.91 0.01 . 2 . . . . 86 LEU HD2 . 16494 1 394 . 1 1 64 64 LEU HD22 H 1 0.91 0.01 . 2 . . . . 86 LEU HD2 . 16494 1 395 . 1 1 64 64 LEU HD23 H 1 0.91 0.01 . 2 . . . . 86 LEU HD2 . 16494 1 396 . 1 1 64 64 LEU HG H 1 1.75 0.01 . 1 . . . . 86 LEU HG . 16494 1 397 . 1 1 65 65 LEU H H 1 7.57 0.01 . 1 . . . . 87 LEU HN . 16494 1 398 . 1 1 65 65 LEU HA H 1 5.70 0.01 . 1 . . . . 87 LEU HA . 16494 1 399 . 1 1 65 65 LEU HB2 H 1 1.95 0.01 . 2 . . . . 87 LEU HB2 . 16494 1 400 . 1 1 65 65 LEU HB3 H 1 1.44 0.01 . 2 . . . . 87 LEU HB3 . 16494 1 401 . 1 1 65 65 LEU HD11 H 1 1.09 0.01 . 2 . . . . 87 LEU HD1 . 16494 1 402 . 1 1 65 65 LEU HD12 H 1 1.09 0.01 . 2 . . . . 87 LEU HD1 . 16494 1 403 . 1 1 65 65 LEU HD13 H 1 1.09 0.01 . 2 . . . . 87 LEU HD1 . 16494 1 404 . 1 1 65 65 LEU HD21 H 1 1.02 0.01 . 2 . . . . 87 LEU HD2 . 16494 1 405 . 1 1 65 65 LEU HD22 H 1 1.02 0.01 . 2 . . . . 87 LEU HD2 . 16494 1 406 . 1 1 65 65 LEU HD23 H 1 1.02 0.01 . 2 . . . . 87 LEU HD2 . 16494 1 407 . 1 1 65 65 LEU HG H 1 2.20 0.01 . 1 . . . . 87 LEU HG . 16494 1 408 . 1 1 66 66 TYR H H 1 9.37 0.01 . 1 . . . . 88 TYR HN . 16494 1 409 . 1 1 66 66 TYR HA H 1 5.01 0.01 . 1 . . . . 88 TYR HA . 16494 1 410 . 1 1 66 66 TYR HB2 H 1 3.10 0.01 . 2 . . . . 88 TYR HB2 . 16494 1 411 . 1 1 66 66 TYR HB3 H 1 3.10 0.01 . 2 . . . . 88 TYR HB3 . 16494 1 412 . 1 1 66 66 TYR HD1 H 1 7.14 0.01 . 3 . . . . 88 TYR HD1 . 16494 1 413 . 1 1 66 66 TYR HD2 H 1 7.14 0.01 . 3 . . . . 88 TYR HD2 . 16494 1 414 . 1 1 66 66 TYR HE1 H 1 6.57 0.01 . 3 . . . . 88 TYR HE1 . 16494 1 415 . 1 1 66 66 TYR HE2 H 1 6.57 0.01 . 3 . . . . 88 TYR HE2 . 16494 1 416 . 1 1 67 67 GLY HA2 H 1 4.68 0.01 . 2 . . . . 89 GLY HA1 . 16494 1 417 . 1 1 68 68 SER H H 1 9.73 0.01 . 1 . . . . 90 SER HN . 16494 1 418 . 1 1 68 68 SER HA H 1 4.97 0.01 . 1 . . . . 90 SER HA . 16494 1 419 . 1 1 68 68 SER HB2 H 1 3.88 0.01 . 2 . . . . 90 SER HB2 . 16494 1 420 . 1 1 68 68 SER HB3 H 1 3.53 0.01 . 2 . . . . 90 SER HB3 . 16494 1 421 . 1 1 69 69 GLN H H 1 9.45 0.01 . 1 . . . . 91 GLN HN . 16494 1 422 . 1 1 69 69 GLN HA H 1 4.27 0.01 . 1 . . . . 91 GLN HA . 16494 1 423 . 1 1 69 69 GLN HB2 H 1 2.32 0.01 . 2 . . . . 91 GLN HB2 . 16494 1 424 . 1 1 69 69 GLN HB3 H 1 2.20 0.01 . 2 . . . . 91 GLN HB3 . 16494 1 425 . 1 1 69 69 GLN HG2 H 1 2.64 0.01 . 2 . . . . 91 GLN HG2 . 16494 1 426 . 1 1 69 69 GLN HG3 H 1 2.54 0.01 . 2 . . . . 91 GLN HG3 . 16494 1 427 . 1 1 70 70 THR H H 1 7.64 0.01 . 1 . . . . 92 THR HN . 16494 1 428 . 1 1 70 70 THR HA H 1 4.84 0.01 . 1 . . . . 92 THR HA . 16494 1 429 . 1 1 70 70 THR HB H 1 4.11 0.01 . 1 . . . . 92 THR HB . 16494 1 430 . 1 1 70 70 THR HG21 H 1 1.20 0.01 . 1 . . . . 92 THR HG2 . 16494 1 431 . 1 1 70 70 THR HG22 H 1 1.20 0.01 . 1 . . . . 92 THR HG2 . 16494 1 432 . 1 1 70 70 THR HG23 H 1 1.20 0.01 . 1 . . . . 92 THR HG2 . 16494 1 433 . 1 1 71 71 PRO HA H 1 4.14 0.01 . 1 . . . . 93 PRO HA . 16494 1 434 . 1 1 71 71 PRO HB2 H 1 0.30 0.01 . 2 . . . . 93 PRO HB2 . 16494 1 435 . 1 1 71 71 PRO HB3 H 1 1.83 0.01 . 2 . . . . 93 PRO HB3 . 16494 1 436 . 1 1 71 71 PRO HD2 H 1 3.64 0.01 . 2 . . . . 93 PRO HD2 . 16494 1 437 . 1 1 71 71 PRO HD3 H 1 3.43 0.01 . 2 . . . . 93 PRO HD3 . 16494 1 438 . 1 1 71 71 PRO HG2 H 1 1.83 0.01 . 2 . . . . 93 PRO HG2 . 16494 1 439 . 1 1 71 71 PRO HG3 H 1 1.83 0.01 . 2 . . . . 93 PRO HG3 . 16494 1 440 . 1 1 72 72 ASN H H 1 7.44 0.01 . 1 . . . . 94 ASN HN . 16494 1 441 . 1 1 72 72 ASN HA H 1 4.74 0.01 . 1 . . . . 94 ASN HA . 16494 1 442 . 1 1 72 72 ASN HB2 H 1 3.20 0.01 . 2 . . . . 94 ASN HB2 . 16494 1 443 . 1 1 72 72 ASN HB3 H 1 2.97 0.01 . 2 . . . . 94 ASN HB3 . 16494 1 444 . 1 1 73 73 GLU H H 1 9.04 0.01 . 1 . . . . 95 GLU HN . 16494 1 445 . 1 1 73 73 GLU HA H 1 4.13 0.01 . 1 . . . . 95 GLU HA . 16494 1 446 . 1 1 73 73 GLU HB2 H 1 2.29 0.01 . 2 . . . . 95 GLU HB2 . 16494 1 447 . 1 1 73 73 GLU HB3 H 1 2.12 0.01 . 2 . . . . 95 GLU HB3 . 16494 1 448 . 1 1 73 73 GLU HG2 H 1 2.37 0.01 . 2 . . . . 95 GLU HG2 . 16494 1 449 . 1 1 73 73 GLU HG3 H 1 2.37 0.01 . 2 . . . . 95 GLU HG3 . 16494 1 450 . 1 1 74 74 GLU H H 1 8.70 0.01 . 1 . . . . 96 GLU HN . 16494 1 451 . 1 1 74 74 GLU HA H 1 4.19 0.01 . 1 . . . . 96 GLU HA . 16494 1 452 . 1 1 74 74 GLU HB2 H 1 2.53 0.01 . 2 . . . . 96 GLU HB2 . 16494 1 453 . 1 1 74 74 GLU HB3 H 1 2.46 0.01 . 2 . . . . 96 GLU HB3 . 16494 1 454 . 1 1 74 74 GLU HG2 H 1 2.61 0.01 . 2 . . . . 96 GLU HG2 . 16494 1 455 . 1 1 74 74 GLU HG3 H 1 2.28 0.01 . 2 . . . . 96 GLU HG3 . 16494 1 456 . 1 1 75 75 CYS H H 1 7.84 0.01 . 1 . . . . 97 CYS HN . 16494 1 457 . 1 1 75 75 CYS HA H 1 5.42 0.01 . 1 . . . . 97 CYS HA . 16494 1 458 . 1 1 75 75 CYS HB2 H 1 3.69 0.01 . 2 . . . . 97 CYS HB2 . 16494 1 459 . 1 1 75 75 CYS HB3 H 1 3.31 0.01 . 2 . . . . 97 CYS HB3 . 16494 1 460 . 1 1 76 76 LEU H H 1 6.36 0.01 . 1 . . . . 98 LEU HN . 16494 1 461 . 1 1 76 76 LEU HA H 1 4.55 0.01 . 1 . . . . 98 LEU HA . 16494 1 462 . 1 1 76 76 LEU HB2 H 1 1.41 0.01 . 2 . . . . 98 LEU HB2 . 16494 1 463 . 1 1 76 76 LEU HB3 H 1 1.16 0.01 . 2 . . . . 98 LEU HB3 . 16494 1 464 . 1 1 76 76 LEU HD11 H 1 0.62 0.01 . 2 . . . . 98 LEU HD1 . 16494 1 465 . 1 1 76 76 LEU HD12 H 1 0.62 0.01 . 2 . . . . 98 LEU HD1 . 16494 1 466 . 1 1 76 76 LEU HD13 H 1 0.62 0.01 . 2 . . . . 98 LEU HD1 . 16494 1 467 . 1 1 76 76 LEU HD21 H 1 0.39 0.01 . 2 . . . . 98 LEU HD2 . 16494 1 468 . 1 1 76 76 LEU HD22 H 1 0.39 0.01 . 2 . . . . 98 LEU HD2 . 16494 1 469 . 1 1 76 76 LEU HD23 H 1 0.39 0.01 . 2 . . . . 98 LEU HD2 . 16494 1 470 . 1 1 76 76 LEU HG H 1 1.26 0.01 . 1 . . . . 98 LEU HG . 16494 1 471 . 1 1 77 77 PHE H H 1 9.16 0.01 . 1 . . . . 99 PHE HN . 16494 1 472 . 1 1 77 77 PHE HA H 1 5.14 0.01 . 1 . . . . 99 PHE HA . 16494 1 473 . 1 1 77 77 PHE HB2 H 1 2.92 0.01 . 2 . . . . 99 PHE HB2 . 16494 1 474 . 1 1 77 77 PHE HB3 H 1 2.78 0.01 . 2 . . . . 99 PHE HB3 . 16494 1 475 . 1 1 77 77 PHE HD1 H 1 7.05 0.01 . 3 . . . . 99 PHE HD1 . 16494 1 476 . 1 1 77 77 PHE HD2 H 1 7.05 0.01 . 3 . . . . 99 PHE HD2 . 16494 1 477 . 1 1 77 77 PHE HE1 H 1 7.15 0.01 . 3 . . . . 99 PHE HE1 . 16494 1 478 . 1 1 77 77 PHE HE2 H 1 7.15 0.01 . 3 . . . . 99 PHE HE2 . 16494 1 479 . 1 1 77 77 PHE HZ H 1 6.80 0.01 . 1 . . . . 99 PHE HZ . 16494 1 480 . 1 1 78 78 LEU H H 1 10.08 0.01 . 1 . . . . 100 LEU HN . 16494 1 481 . 1 1 78 78 LEU HA H 1 5.18 0.01 . 1 . . . . 100 LEU HA . 16494 1 482 . 1 1 78 78 LEU HB2 H 1 1.88 0.01 . 2 . . . . 100 LEU HB2 . 16494 1 483 . 1 1 78 78 LEU HB3 H 1 1.88 0.01 . 2 . . . . 100 LEU HB3 . 16494 1 484 . 1 1 78 78 LEU HD11 H 1 0.86 0.01 . 2 . . . . 100 LEU HD1 . 16494 1 485 . 1 1 78 78 LEU HD12 H 1 0.86 0.01 . 2 . . . . 100 LEU HD1 . 16494 1 486 . 1 1 78 78 LEU HD13 H 1 0.86 0.01 . 2 . . . . 100 LEU HD1 . 16494 1 487 . 1 1 78 78 LEU HD21 H 1 0.86 0.01 . 2 . . . . 100 LEU HD2 . 16494 1 488 . 1 1 78 78 LEU HD22 H 1 0.86 0.01 . 2 . . . . 100 LEU HD2 . 16494 1 489 . 1 1 78 78 LEU HD23 H 1 0.86 0.01 . 2 . . . . 100 LEU HD2 . 16494 1 490 . 1 1 78 78 LEU HG H 1 1.50 0.01 . 1 . . . . 100 LEU HG . 16494 1 491 . 1 1 79 79 GLU H H 1 8.29 0.01 . 1 . . . . 101 GLU HN . 16494 1 492 . 1 1 79 79 GLU HB2 H 1 2.01 0.01 . 2 . . . . 101 GLU HB2 . 16494 1 493 . 1 1 79 79 GLU HB3 H 1 1.78 0.01 . 2 . . . . 101 GLU HB3 . 16494 1 494 . 1 1 79 79 GLU HG2 H 1 1.88 0.01 . 2 . . . . 101 GLU HG2 . 16494 1 495 . 1 1 79 79 GLU HG3 H 1 1.88 0.01 . 2 . . . . 101 GLU HG3 . 16494 1 496 . 1 1 80 80 ARG H H 1 8.95 0.01 . 1 . . . . 102 ARG HN . 16494 1 497 . 1 1 80 80 ARG HA H 1 4.68 0.01 . 1 . . . . 102 ARG HA . 16494 1 498 . 1 1 80 80 ARG HB2 H 1 1.83 0.01 . 2 . . . . 102 ARG HB2 . 16494 1 499 . 1 1 80 80 ARG HB3 H 1 1.83 0.01 . 2 . . . . 102 ARG HB3 . 16494 1 500 . 1 1 80 80 ARG HD2 H 1 3.20 0.01 . 2 . . . . 102 ARG HD2 . 16494 1 501 . 1 1 80 80 ARG HD3 H 1 3.20 0.01 . 2 . . . . 102 ARG HD3 . 16494 1 502 . 1 1 80 80 ARG HE H 1 7.52 0.01 . 1 . . . . 102 ARG HE . 16494 1 503 . 1 1 80 80 ARG HG2 H 1 1.54 0.01 . 2 . . . . 102 ARG HG2 . 16494 1 504 . 1 1 80 80 ARG HG3 H 1 1.47 0.01 . 2 . . . . 102 ARG HG3 . 16494 1 505 . 1 1 81 81 LEU H H 1 8.44 0.01 . 1 . . . . 103 LEU HN . 16494 1 506 . 1 1 81 81 LEU HB2 H 1 1.74 0.01 . 2 . . . . 103 LEU HB2 . 16494 1 507 . 1 1 81 81 LEU HB3 H 1 1.51 0.01 . 2 . . . . 103 LEU HB3 . 16494 1 508 . 1 1 81 81 LEU HD11 H 1 0.87 0.01 . 2 . . . . 103 LEU HD1 . 16494 1 509 . 1 1 81 81 LEU HD12 H 1 0.87 0.01 . 2 . . . . 103 LEU HD1 . 16494 1 510 . 1 1 81 81 LEU HD13 H 1 0.87 0.01 . 2 . . . . 103 LEU HD1 . 16494 1 511 . 1 1 81 81 LEU HD21 H 1 0.87 0.01 . 2 . . . . 103 LEU HD2 . 16494 1 512 . 1 1 81 81 LEU HD22 H 1 0.87 0.01 . 2 . . . . 103 LEU HD2 . 16494 1 513 . 1 1 81 81 LEU HD23 H 1 0.87 0.01 . 2 . . . . 103 LEU HD2 . 16494 1 514 . 1 1 81 81 LEU HG H 1 1.64 0.01 . 1 . . . . 103 LEU HG . 16494 1 515 . 1 1 82 82 GLU H H 1 9.18 0.01 . 1 . . . . 104 GLU HN . 16494 1 516 . 1 1 82 82 GLU HB2 H 1 2.28 0.01 . 2 . . . . 104 GLU HB2 . 16494 1 517 . 1 1 82 82 GLU HB3 H 1 2.01 0.01 . 2 . . . . 104 GLU HB3 . 16494 1 518 . 1 1 82 82 GLU HG2 H 1 2.38 0.01 . 2 . . . . 104 GLU HG2 . 16494 1 519 . 1 1 82 82 GLU HG3 H 1 2.38 0.01 . 2 . . . . 104 GLU HG3 . 16494 1 520 . 1 1 83 83 GLU H H 1 8.84 0.01 . 1 . . . . 105 GLU HN . 16494 1 521 . 1 1 83 83 GLU HA H 1 4.12 0.01 . 1 . . . . 105 GLU HA . 16494 1 522 . 1 1 83 83 GLU HB2 H 1 2.13 0.01 . 2 . . . . 105 GLU HB2 . 16494 1 523 . 1 1 83 83 GLU HB3 H 1 2.07 0.01 . 2 . . . . 105 GLU HB3 . 16494 1 524 . 1 1 83 83 GLU HG2 H 1 2.37 0.01 . 2 . . . . 105 GLU HG2 . 16494 1 525 . 1 1 83 83 GLU HG3 H 1 2.37 0.01 . 2 . . . . 105 GLU HG3 . 16494 1 526 . 1 1 84 84 ASN H H 1 7.71 0.01 . 1 . . . . 106 ASN HN . 16494 1 527 . 1 1 84 84 ASN HA H 1 4.34 0.01 . 1 . . . . 106 ASN HA . 16494 1 528 . 1 1 84 84 ASN HB2 H 1 3.08 0.01 . 2 . . . . 106 ASN HB2 . 16494 1 529 . 1 1 84 84 ASN HB3 H 1 2.99 0.01 . 2 . . . . 106 ASN HB3 . 16494 1 530 . 1 1 85 85 HIS H H 1 8.21 0.01 . 1 . . . . 107 HIS HN . 16494 1 531 . 1 1 85 85 HIS HA H 1 4.22 0.01 . 1 . . . . 107 HIS HA . 16494 1 532 . 1 1 85 85 HIS HB2 H 1 3.46 0.01 . 2 . . . . 107 HIS HB2 . 16494 1 533 . 1 1 85 85 HIS HB3 H 1 3.29 0.01 . 2 . . . . 107 HIS HB3 . 16494 1 534 . 1 1 85 85 HIS HD2 H 1 7.06 0.01 . 1 . . . . 107 HIS HD2 . 16494 1 535 . 1 1 85 85 HIS HE1 H 1 8.56 0.01 . 1 . . . . 107 HIS HE1 . 16494 1 536 . 1 1 86 86 TYR H H 1 7.65 0.01 . 1 . . . . 108 TYR HN . 16494 1 537 . 1 1 86 86 TYR HA H 1 4.84 0.01 . 1 . . . . 108 TYR HA . 16494 1 538 . 1 1 86 86 TYR HB2 H 1 2.95 0.01 . 2 . . . . 108 TYR HB2 . 16494 1 539 . 1 1 86 86 TYR HB3 H 1 2.95 0.01 . 2 . . . . 108 TYR HB3 . 16494 1 540 . 1 1 86 86 TYR HD1 H 1 7.07 0.01 . 3 . . . . 108 TYR HD1 . 16494 1 541 . 1 1 86 86 TYR HD2 H 1 7.07 0.01 . 3 . . . . 108 TYR HD2 . 16494 1 542 . 1 1 86 86 TYR HE1 H 1 6.84 0.01 . 3 . . . . 108 TYR HE1 . 16494 1 543 . 1 1 86 86 TYR HE2 H 1 6.84 0.01 . 3 . . . . 108 TYR HE2 . 16494 1 544 . 1 1 87 87 ASN H H 1 9.95 0.01 . 1 . . . . 109 ASN HN . 16494 1 545 . 1 1 87 87 ASN HA H 1 5.84 0.01 . 1 . . . . 109 ASN HA . 16494 1 546 . 1 1 87 87 ASN HB2 H 1 2.65 0.01 . 2 . . . . 109 ASN HB2 . 16494 1 547 . 1 1 87 87 ASN HB3 H 1 2.44 0.01 . 2 . . . . 109 ASN HB3 . 16494 1 548 . 1 1 88 88 THR H H 1 8.52 0.01 . 1 . . . . 110 THR HN . 16494 1 549 . 1 1 88 88 THR HA H 1 5.11 0.01 . 1 . . . . 110 THR HA . 16494 1 550 . 1 1 88 88 THR HB H 1 4.57 0.01 . 1 . . . . 110 THR HB . 16494 1 551 . 1 1 88 88 THR HG21 H 1 1.32 0.01 . 1 . . . . 110 THR HG2 . 16494 1 552 . 1 1 88 88 THR HG22 H 1 1.32 0.01 . 1 . . . . 110 THR HG2 . 16494 1 553 . 1 1 88 88 THR HG23 H 1 1.32 0.01 . 1 . . . . 110 THR HG2 . 16494 1 554 . 1 1 89 89 TYR H H 1 10.38 0.01 . 1 . . . . 111 TYR HN . 16494 1 555 . 1 1 89 89 TYR HA H 1 5.44 0.01 . 1 . . . . 111 TYR HA . 16494 1 556 . 1 1 89 89 TYR HB2 H 1 2.47 0.01 . 2 . . . . 111 TYR HB2 . 16494 1 557 . 1 1 89 89 TYR HB3 H 1 2.47 0.01 . 2 . . . . 111 TYR HB3 . 16494 1 558 . 1 1 89 89 TYR HD1 H 1 6.66 0.01 . 3 . . . . 111 TYR HD1 . 16494 1 559 . 1 1 89 89 TYR HD2 H 1 6.66 0.01 . 3 . . . . 111 TYR HD2 . 16494 1 560 . 1 1 89 89 TYR HE1 H 1 6.52 0.01 . 3 . . . . 111 TYR HE1 . 16494 1 561 . 1 1 89 89 TYR HE2 H 1 6.52 0.01 . 3 . . . . 111 TYR HE2 . 16494 1 562 . 1 1 90 90 ILE H H 1 8.85 0.01 . 1 . . . . 112 ILE HN . 16494 1 563 . 1 1 90 90 ILE HA H 1 4.62 0.01 . 1 . . . . 112 ILE HA . 16494 1 564 . 1 1 90 90 ILE HB H 1 1.51 0.01 . 1 . . . . 112 ILE HB . 16494 1 565 . 1 1 90 90 ILE HD11 H 1 0.56 0.01 . 1 . . . . 112 ILE HD1 . 16494 1 566 . 1 1 90 90 ILE HD12 H 1 0.56 0.01 . 1 . . . . 112 ILE HD1 . 16494 1 567 . 1 1 90 90 ILE HD13 H 1 0.56 0.01 . 1 . . . . 112 ILE HD1 . 16494 1 568 . 1 1 90 90 ILE HG12 H 1 1.32 0.01 . 2 . . . . 112 ILE HG12 . 16494 1 569 . 1 1 90 90 ILE HG13 H 1 0.03 0.01 . 2 . . . . 112 ILE HG13 . 16494 1 570 . 1 1 90 90 ILE HG21 H 1 0.65 0.01 . 1 . . . . 112 ILE HG2 . 16494 1 571 . 1 1 90 90 ILE HG22 H 1 0.65 0.01 . 1 . . . . 112 ILE HG2 . 16494 1 572 . 1 1 90 90 ILE HG23 H 1 0.65 0.01 . 1 . . . . 112 ILE HG2 . 16494 1 573 . 1 1 91 91 SER H H 1 8.34 0.01 . 1 . . . . 113 SER HN . 16494 1 574 . 1 1 91 91 SER HB2 H 1 4.02 0.01 . 2 . . . . 113 SER HB2 . 16494 1 575 . 1 1 91 91 SER HB3 H 1 3.82 0.01 . 2 . . . . 113 SER HB3 . 16494 1 576 . 1 1 92 92 LYS H H 1 8.10 0.01 . 1 . . . . 114 LYS HN . 16494 1 577 . 1 1 92 92 LYS HA H 1 3.77 0.01 . 1 . . . . 114 LYS HA . 16494 1 578 . 1 1 92 92 LYS HB2 H 1 1.74 0.01 . 2 . . . . 114 LYS HB2 . 16494 1 579 . 1 1 92 92 LYS HB3 H 1 1.74 0.01 . 2 . . . . 114 LYS HB3 . 16494 1 580 . 1 1 92 92 LYS HG2 H 1 1.20 0.01 . 2 . . . . 114 LYS HG2 . 16494 1 581 . 1 1 92 92 LYS HG3 H 1 1.20 0.01 . 2 . . . . 114 LYS HG3 . 16494 1 582 . 1 1 93 93 LYS H H 1 8.73 0.01 . 1 . . . . 115 LYS HN . 16494 1 583 . 1 1 93 93 LYS HA H 1 3.83 0.01 . 1 . . . . 115 LYS HA . 16494 1 584 . 1 1 93 93 LYS HB2 H 1 1.32 0.01 . 2 . . . . 115 LYS HB2 . 16494 1 585 . 1 1 93 93 LYS HD2 H 1 1.54 0.01 . 2 . . . . 115 LYS HD2 . 16494 1 586 . 1 1 93 93 LYS HD3 H 1 1.36 0.01 . 2 . . . . 115 LYS HD3 . 16494 1 587 . 1 1 93 93 LYS HE2 H 1 2.92 0.01 . 2 . . . . 115 LYS HE2 . 16494 1 588 . 1 1 93 93 LYS HE3 H 1 2.82 0.01 . 2 . . . . 115 LYS HE3 . 16494 1 589 . 1 1 93 93 LYS HG2 H 1 0.94 0.01 . 2 . . . . 115 LYS HG2 . 16494 1 590 . 1 1 93 93 LYS HG3 H 1 0.54 0.01 . 2 . . . . 115 LYS HG3 . 16494 1 591 . 1 1 94 94 HIS H H 1 7.40 0.01 . 1 . . . . 116 HIS HN . 16494 1 592 . 1 1 94 94 HIS HA H 1 4.58 0.01 . 1 . . . . 116 HIS HA . 16494 1 593 . 1 1 94 94 HIS HB2 H 1 2.53 0.01 . 2 . . . . 116 HIS HB2 . 16494 1 594 . 1 1 94 94 HIS HB3 H 1 2.53 0.01 . 2 . . . . 116 HIS HB3 . 16494 1 595 . 1 1 94 94 HIS HD2 H 1 7.98 0.01 . 1 . . . . 116 HIS HD2 . 16494 1 596 . 1 1 94 94 HIS HE1 H 1 7.05 0.01 . 1 . . . . 116 HIS HE1 . 16494 1 597 . 1 1 95 95 ALA H H 1 7.21 0.01 . 1 . . . . 117 ALA HN . 16494 1 598 . 1 1 95 95 ALA HA H 1 3.80 0.01 . 1 . . . . 117 ALA HA . 16494 1 599 . 1 1 95 95 ALA HB1 H 1 1.45 0.01 . 1 . . . . 117 ALA HB . 16494 1 600 . 1 1 95 95 ALA HB2 H 1 1.45 0.01 . 1 . . . . 117 ALA HB . 16494 1 601 . 1 1 95 95 ALA HB3 H 1 1.45 0.01 . 1 . . . . 117 ALA HB . 16494 1 602 . 1 1 96 96 GLU H H 1 8.92 0.01 . 1 . . . . 118 GLU HN . 16494 1 603 . 1 1 96 96 GLU HA H 1 4.05 0.01 . 1 . . . . 118 GLU HA . 16494 1 604 . 1 1 96 96 GLU HB2 H 1 1.96 0.01 . 2 . . . . 118 GLU HB2 . 16494 1 605 . 1 1 96 96 GLU HB3 H 1 1.94 0.01 . 2 . . . . 118 GLU HB3 . 16494 1 606 . 1 1 96 96 GLU HG2 H 1 2.28 0.01 . 2 . . . . 118 GLU HG2 . 16494 1 607 . 1 1 96 96 GLU HG3 H 1 2.18 0.01 . 2 . . . . 118 GLU HG3 . 16494 1 608 . 1 1 97 97 LYS H H 1 7.28 0.01 . 1 . . . . 119 LYS HN . 16494 1 609 . 1 1 97 97 LYS HA H 1 4.23 0.01 . 1 . . . . 119 LYS HA . 16494 1 610 . 1 1 97 97 LYS HB2 H 1 1.14 0.01 . 2 . . . . 119 LYS HB2 . 16494 1 611 . 1 1 97 97 LYS HB3 H 1 0.73 0.01 . 2 . . . . 119 LYS HB3 . 16494 1 612 . 1 1 97 97 LYS HD2 H 1 1.36 0.01 . 2 . . . . 119 LYS HD2 . 16494 1 613 . 1 1 97 97 LYS HD3 H 1 1.36 0.01 . 2 . . . . 119 LYS HD3 . 16494 1 614 . 1 1 97 97 LYS HE2 H 1 2.53 0.01 . 2 . . . . 119 LYS HE2 . 16494 1 615 . 1 1 97 97 LYS HE3 H 1 2.35 0.01 . 2 . . . . 119 LYS HE3 . 16494 1 616 . 1 1 97 97 LYS HG2 H 1 0.94 0.01 . 2 . . . . 119 LYS HG2 . 16494 1 617 . 1 1 97 97 LYS HG3 H 1 0.94 0.01 . 2 . . . . 119 LYS HG3 . 16494 1 618 . 1 1 98 98 ASN H H 1 7.96 0.01 . 1 . . . . 120 ASN HN . 16494 1 619 . 1 1 98 98 ASN HA H 1 3.76 0.01 . 1 . . . . 120 ASN HA . 16494 1 620 . 1 1 98 98 ASN HB2 H 1 2.98 0.01 . 2 . . . . 120 ASN HB2 . 16494 1 621 . 1 1 98 98 ASN HB3 H 1 2.84 0.01 . 2 . . . . 120 ASN HB3 . 16494 1 622 . 1 1 98 98 ASN HD21 H 1 7.44 0.01 . 2 . . . . 120 ASN HD21 . 16494 1 623 . 1 1 98 98 ASN HD22 H 1 6.72 0.01 . 2 . . . . 120 ASN HD22 . 16494 1 624 . 1 1 99 99 TRP H H 1 6.45 0.01 . 1 . . . . 121 TRP HN . 16494 1 625 . 1 1 99 99 TRP HA H 1 4.83 0.01 . 1 . . . . 121 TRP HA . 16494 1 626 . 1 1 99 99 TRP HB2 H 1 3.14 0.01 . 2 . . . . 121 TRP HB2 . 16494 1 627 . 1 1 99 99 TRP HB3 H 1 2.90 0.01 . 2 . . . . 121 TRP HB3 . 16494 1 628 . 1 1 99 99 TRP HD1 H 1 6.85 0.01 . 1 . . . . 121 TRP HD1 . 16494 1 629 . 1 1 99 99 TRP HE1 H 1 10.42 0.01 . 1 . . . . 121 TRP HE1 . 16494 1 630 . 1 1 99 99 TRP HE3 H 1 7.36 0.01 . 1 . . . . 121 TRP HE3 . 16494 1 631 . 1 1 99 99 TRP HH2 H 1 7.06 0.01 . 1 . . . . 121 TRP HH2 . 16494 1 632 . 1 1 99 99 TRP HZ2 H 1 7.41 0.01 . 1 . . . . 121 TRP HZ2 . 16494 1 633 . 1 1 99 99 TRP HZ3 H 1 6.20 0.01 . 1 . . . . 121 TRP HZ3 . 16494 1 634 . 1 1 100 100 PHE H H 1 8.14 0.01 . 1 . . . . 122 PHE HN . 16494 1 635 . 1 1 100 100 PHE HA H 1 5.35 0.01 . 1 . . . . 122 PHE HA . 16494 1 636 . 1 1 100 100 PHE HB2 H 1 3.43 0.01 . 2 . . . . 122 PHE HB2 . 16494 1 637 . 1 1 100 100 PHE HB3 H 1 2.69 0.01 . 2 . . . . 122 PHE HB3 . 16494 1 638 . 1 1 100 100 PHE HD1 H 1 7.48 0.01 . 3 . . . . 122 PHE HD1 . 16494 1 639 . 1 1 100 100 PHE HD2 H 1 7.48 0.01 . 3 . . . . 122 PHE HD2 . 16494 1 640 . 1 1 100 100 PHE HE1 H 1 7.22 0.01 . 3 . . . . 122 PHE HE1 . 16494 1 641 . 1 1 100 100 PHE HE2 H 1 7.22 0.01 . 3 . . . . 122 PHE HE2 . 16494 1 642 . 1 1 100 100 PHE HZ H 1 6.94 0.01 . 1 . . . . 122 PHE HZ . 16494 1 643 . 1 1 101 101 VAL H H 1 8.61 0.01 . 1 . . . . 123 VAL HN . 16494 1 644 . 1 1 101 101 VAL HA H 1 3.92 0.01 . 1 . . . . 123 VAL HA . 16494 1 645 . 1 1 101 101 VAL HB H 1 2.03 0.01 . 1 . . . . 123 VAL HB . 16494 1 646 . 1 1 101 101 VAL HG11 H 1 0.51 0.01 . 2 . . . . 123 VAL HG1 . 16494 1 647 . 1 1 101 101 VAL HG12 H 1 0.51 0.01 . 2 . . . . 123 VAL HG1 . 16494 1 648 . 1 1 101 101 VAL HG13 H 1 0.51 0.01 . 2 . . . . 123 VAL HG1 . 16494 1 649 . 1 1 101 101 VAL HG21 H 1 0.48 0.01 . 2 . . . . 123 VAL HG2 . 16494 1 650 . 1 1 101 101 VAL HG22 H 1 0.48 0.01 . 2 . . . . 123 VAL HG2 . 16494 1 651 . 1 1 101 101 VAL HG23 H 1 0.48 0.01 . 2 . . . . 123 VAL HG2 . 16494 1 652 . 1 1 102 102 GLY H H 1 9.09 0.01 . 1 . . . . 124 GLY HN . 16494 1 653 . 1 1 102 102 GLY HA2 H 1 5.27 0.01 . 2 . . . . 124 GLY HA1 . 16494 1 654 . 1 1 102 102 GLY HA3 H 1 3.15 0.01 . 2 . . . . 124 GLY HA2 . 16494 1 655 . 1 1 103 103 LEU H H 1 8.25 0.01 . 1 . . . . 125 LEU HN . 16494 1 656 . 1 1 103 103 LEU HA H 1 4.94 0.01 . 1 . . . . 125 LEU HA . 16494 1 657 . 1 1 103 103 LEU HB2 H 1 2.23 0.01 . 2 . . . . 125 LEU HB2 . 16494 1 658 . 1 1 103 103 LEU HD11 H 1 0.76 0.01 . 2 . . . . 125 LEU HD1 . 16494 1 659 . 1 1 103 103 LEU HD12 H 1 0.76 0.01 . 2 . . . . 125 LEU HD1 . 16494 1 660 . 1 1 103 103 LEU HD13 H 1 0.76 0.01 . 2 . . . . 125 LEU HD1 . 16494 1 661 . 1 1 103 103 LEU HG H 1 1.58 0.01 . 1 . . . . 125 LEU HG . 16494 1 662 . 1 1 104 104 LYS H H 1 8.95 0.01 . 1 . . . . 126 LYS HN . 16494 1 663 . 1 1 104 104 LYS HA H 1 4.20 0.01 . 1 . . . . 126 LYS HA . 16494 1 664 . 1 1 104 104 LYS HB2 H 1 1.76 0.01 . 2 . . . . 126 LYS HB2 . 16494 1 665 . 1 1 104 104 LYS HB3 H 1 1.76 0.01 . 2 . . . . 126 LYS HB3 . 16494 1 666 . 1 1 104 104 LYS HD2 H 1 1.71 0.01 . 2 . . . . 126 LYS HD2 . 16494 1 667 . 1 1 104 104 LYS HD3 H 1 1.44 0.01 . 2 . . . . 126 LYS HD3 . 16494 1 668 . 1 1 104 104 LYS HE2 H 1 2.99 0.01 . 2 . . . . 126 LYS HE2 . 16494 1 669 . 1 1 104 104 LYS HE3 H 1 2.99 0.01 . 2 . . . . 126 LYS HE3 . 16494 1 670 . 1 1 105 105 LYS HA H 1 3.61 0.01 . 1 . . . . 127 LYS HA . 16494 1 671 . 1 1 105 105 LYS HB2 H 1 1.78 0.01 . 2 . . . . 127 LYS HB2 . 16494 1 672 . 1 1 105 105 LYS HB3 H 1 1.72 0.01 . 2 . . . . 127 LYS HB3 . 16494 1 673 . 1 1 105 105 LYS HD2 H 1 1.71 0.01 . 2 . . . . 127 LYS HD2 . 16494 1 674 . 1 1 105 105 LYS HD3 H 1 1.21 0.01 . 2 . . . . 127 LYS HD3 . 16494 1 675 . 1 1 105 105 LYS HE2 H 1 3.06 0.01 . 2 . . . . 127 LYS HE2 . 16494 1 676 . 1 1 105 105 LYS HE3 H 1 3.06 0.01 . 2 . . . . 127 LYS HE3 . 16494 1 677 . 1 1 105 105 LYS HG2 H 1 1.53 0.01 . 2 . . . . 127 LYS HG2 . 16494 1 678 . 1 1 105 105 LYS HG3 H 1 1.53 0.01 . 2 . . . . 127 LYS HG3 . 16494 1 679 . 1 1 106 106 ASN H H 1 7.47 0.01 . 1 . . . . 128 ASN HN . 16494 1 680 . 1 1 106 106 ASN HA H 1 4.70 0.01 . 1 . . . . 128 ASN HA . 16494 1 681 . 1 1 106 106 ASN HB2 H 1 3.31 0.01 . 2 . . . . 128 ASN HB2 . 16494 1 682 . 1 1 106 106 ASN HB3 H 1 2.77 0.01 . 2 . . . . 128 ASN HB3 . 16494 1 683 . 1 1 106 106 ASN HD21 H 1 7.59 0.01 . 2 . . . . 128 ASN HD21 . 16494 1 684 . 1 1 106 106 ASN HD22 H 1 6.75 0.01 . 2 . . . . 128 ASN HD22 . 16494 1 685 . 1 1 107 107 GLY H H 1 7.76 0.01 . 1 . . . . 129 GLY HN . 16494 1 686 . 1 1 107 107 GLY HA2 H 1 3.35 0.01 . 2 . . . . 129 GLY HA1 . 16494 1 687 . 1 1 107 107 GLY HA3 H 1 2.10 0.01 . 2 . . . . 129 GLY HA2 . 16494 1 688 . 1 1 108 108 SER H H 1 7.42 0.01 . 1 . . . . 130 SER HN . 16494 1 689 . 1 1 108 108 SER HA H 1 4.74 0.01 . 1 . . . . 130 SER HA . 16494 1 690 . 1 1 108 108 SER HB2 H 1 3.90 0.01 . 2 . . . . 130 SER HB2 . 16494 1 691 . 1 1 108 108 SER HB3 H 1 3.90 0.01 . 2 . . . . 130 SER HB3 . 16494 1 692 . 1 1 109 109 CYS H H 1 9.17 0.01 . 1 . . . . 131 CYS HN . 16494 1 693 . 1 1 109 109 CYS HA H 1 4.40 0.01 . 1 . . . . 131 CYS HA . 16494 1 694 . 1 1 109 109 CYS HB2 H 1 3.10 0.01 . 2 . . . . 131 CYS HB2 . 16494 1 695 . 1 1 109 109 CYS HB3 H 1 2.87 0.01 . 2 . . . . 131 CYS HB3 . 16494 1 696 . 1 1 110 110 LYS H H 1 8.21 0.01 . 1 . . . . 132 LYS HN . 16494 1 697 . 1 1 110 110 LYS HA H 1 4.38 0.01 . 1 . . . . 132 LYS HA . 16494 1 698 . 1 1 110 110 LYS HB2 H 1 1.43 0.01 . 2 . . . . 132 LYS HB2 . 16494 1 699 . 1 1 110 110 LYS HB3 H 1 1.43 0.01 . 2 . . . . 132 LYS HB3 . 16494 1 700 . 1 1 110 110 LYS HD2 H 1 1.30 0.01 . 2 . . . . 132 LYS HD2 . 16494 1 701 . 1 1 110 110 LYS HD3 H 1 1.30 0.01 . 2 . . . . 132 LYS HD3 . 16494 1 702 . 1 1 110 110 LYS HE2 H 1 2.87 0.01 . 2 . . . . 132 LYS HE2 . 16494 1 703 . 1 1 110 110 LYS HE3 H 1 2.87 0.01 . 2 . . . . 132 LYS HE3 . 16494 1 704 . 1 1 110 110 LYS HG2 H 1 1.14 0.01 . 2 . . . . 132 LYS HG2 . 16494 1 705 . 1 1 110 110 LYS HG3 H 1 1.14 0.01 . 2 . . . . 132 LYS HG3 . 16494 1 706 . 1 1 111 111 ARG H H 1 8.70 0.01 . 1 . . . . 133 ARG HN . 16494 1 707 . 1 1 111 111 ARG HA H 1 4.24 0.01 . 1 . . . . 133 ARG HA . 16494 1 708 . 1 1 111 111 ARG HB2 H 1 1.55 0.01 . 2 . . . . 133 ARG HB2 . 16494 1 709 . 1 1 111 111 ARG HB3 H 1 1.55 0.01 . 2 . . . . 133 ARG HB3 . 16494 1 710 . 1 1 111 111 ARG HD2 H 1 3.15 0.01 . 2 . . . . 133 ARG HD2 . 16494 1 711 . 1 1 111 111 ARG HD3 H 1 3.15 0.01 . 2 . . . . 133 ARG HD3 . 16494 1 712 . 1 1 111 111 ARG HE H 1 7.35 0.01 . 1 . . . . 133 ARG HE . 16494 1 713 . 1 1 111 111 ARG HG2 H 1 1.64 0.01 . 2 . . . . 133 ARG HG2 . 16494 1 714 . 1 1 112 112 GLY H H 1 9.54 0.01 . 1 . . . . 134 GLY HN . 16494 1 715 . 1 1 112 112 GLY HA2 H 1 3.88 0.01 . 2 . . . . 134 GLY HA1 . 16494 1 716 . 1 1 112 112 GLY HA3 H 1 3.18 0.01 . 2 . . . . 134 GLY HA2 . 16494 1 717 . 1 1 113 113 PRO HA H 1 4.34 0.01 . 1 . . . . 135 PRO HA . 16494 1 718 . 1 1 113 113 PRO HB2 H 1 2.38 0.01 . 2 . . . . 135 PRO HB2 . 16494 1 719 . 1 1 113 113 PRO HB3 H 1 1.92 0.01 . 2 . . . . 135 PRO HB3 . 16494 1 720 . 1 1 113 113 PRO HG2 H 1 1.68 0.01 . 2 . . . . 135 PRO HG2 . 16494 1 721 . 1 1 113 113 PRO HG3 H 1 1.52 0.01 . 2 . . . . 135 PRO HG3 . 16494 1 722 . 1 1 114 114 ARG H H 1 8.17 0.01 . 1 . . . . 136 ARG HN . 16494 1 723 . 1 1 114 114 ARG HA H 1 4.50 0.01 . 1 . . . . 136 ARG HA . 16494 1 724 . 1 1 114 114 ARG HB2 H 1 2.12 0.01 . 2 . . . . 136 ARG HB2 . 16494 1 725 . 1 1 114 114 ARG HB3 H 1 1.94 0.01 . 2 . . . . 136 ARG HB3 . 16494 1 726 . 1 1 114 114 ARG HD2 H 1 3.22 0.01 . 2 . . . . 136 ARG HD2 . 16494 1 727 . 1 1 114 114 ARG HD3 H 1 3.17 0.01 . 2 . . . . 136 ARG HD3 . 16494 1 728 . 1 1 115 115 THR H H 1 7.76 0.01 . 1 . . . . 137 THR HN . 16494 1 729 . 1 1 115 115 THR HA H 1 5.17 0.01 . 1 . . . . 137 THR HA . 16494 1 730 . 1 1 115 115 THR HB H 1 4.08 0.01 . 1 . . . . 137 THR HB . 16494 1 731 . 1 1 115 115 THR HG1 H 1 6.22 0.01 . 1 . . . . 137 THR HG1 . 16494 1 732 . 1 1 115 115 THR HG21 H 1 1.12 0.01 . 1 . . . . 137 THR HG2 . 16494 1 733 . 1 1 115 115 THR HG22 H 1 1.12 0.01 . 1 . . . . 137 THR HG2 . 16494 1 734 . 1 1 115 115 THR HG23 H 1 1.12 0.01 . 1 . . . . 137 THR HG2 . 16494 1 735 . 1 1 116 116 HIS H H 1 7.23 0.01 . 1 . . . . 138 HIS HN . 16494 1 736 . 1 1 116 116 HIS HA H 1 4.88 0.01 . 1 . . . . 138 HIS HA . 16494 1 737 . 1 1 116 116 HIS HB2 H 1 3.38 0.01 . 2 . . . . 138 HIS HB2 . 16494 1 738 . 1 1 116 116 HIS HB3 H 1 3.20 0.01 . 2 . . . . 138 HIS HB3 . 16494 1 739 . 1 1 116 116 HIS HD2 H 1 7.28 0.01 . 1 . . . . 138 HIS HD2 . 16494 1 740 . 1 1 116 116 HIS HE1 H 1 8.63 0.01 . 1 . . . . 138 HIS HE1 . 16494 1 741 . 1 1 117 117 TYR H H 1 9.12 0.01 . 1 . . . . 139 TYR HN . 16494 1 742 . 1 1 117 117 TYR HA H 1 3.91 0.01 . 1 . . . . 139 TYR HA . 16494 1 743 . 1 1 117 117 TYR HB2 H 1 3.08 0.01 . 2 . . . . 139 TYR HB2 . 16494 1 744 . 1 1 117 117 TYR HB3 H 1 2.94 0.01 . 2 . . . . 139 TYR HB3 . 16494 1 745 . 1 1 117 117 TYR HD1 H 1 7.10 0.01 . 3 . . . . 139 TYR HD1 . 16494 1 746 . 1 1 117 117 TYR HD2 H 1 7.10 0.01 . 3 . . . . 139 TYR HD2 . 16494 1 747 . 1 1 117 117 TYR HE1 H 1 6.90 0.01 . 3 . . . . 139 TYR HE1 . 16494 1 748 . 1 1 117 117 TYR HE2 H 1 6.90 0.01 . 3 . . . . 139 TYR HE2 . 16494 1 749 . 1 1 118 118 GLY H H 1 8.12 0.01 . 1 . . . . 140 GLY HN . 16494 1 750 . 1 1 118 118 GLY HA2 H 1 4.38 0.01 . 2 . . . . 140 GLY HA1 . 16494 1 751 . 1 1 118 118 GLY HA3 H 1 3.28 0.01 . 2 . . . . 140 GLY HA2 . 16494 1 752 . 1 1 119 119 GLN H H 1 7.10 0.01 . 1 . . . . 141 GLN HN . 16494 1 753 . 1 1 119 119 GLN HA H 1 4.26 0.01 . 1 . . . . 141 GLN HA . 16494 1 754 . 1 1 119 119 GLN HB2 H 1 2.08 0.01 . 2 . . . . 141 GLN HB2 . 16494 1 755 . 1 1 120 120 LYS H H 1 8.58 0.01 . 1 . . . . 142 LYS HN . 16494 1 756 . 1 1 120 120 LYS HA H 1 3.80 0.01 . 1 . . . . 142 LYS HA . 16494 1 757 . 1 1 120 120 LYS HB2 H 1 1.56 0.01 . 2 . . . . 142 LYS HB2 . 16494 1 758 . 1 1 120 120 LYS HB3 H 1 1.44 0.01 . 2 . . . . 142 LYS HB3 . 16494 1 759 . 1 1 120 120 LYS HD2 H 1 1.58 0.01 . 2 . . . . 142 LYS HD2 . 16494 1 760 . 1 1 120 120 LYS HD3 H 1 1.58 0.01 . 2 . . . . 142 LYS HD3 . 16494 1 761 . 1 1 120 120 LYS HE2 H 1 2.93 0.01 . 2 . . . . 142 LYS HE2 . 16494 1 762 . 1 1 120 120 LYS HE3 H 1 2.93 0.01 . 2 . . . . 142 LYS HE3 . 16494 1 763 . 1 1 120 120 LYS HG2 H 1 1.28 0.01 . 2 . . . . 142 LYS HG2 . 16494 1 764 . 1 1 120 120 LYS HG3 H 1 1.28 0.01 . 2 . . . . 142 LYS HG3 . 16494 1 765 . 1 1 121 121 ALA H H 1 7.68 0.01 . 1 . . . . 143 ALA HN . 16494 1 766 . 1 1 121 121 ALA HA H 1 3.92 0.01 . 1 . . . . 143 ALA HA . 16494 1 767 . 1 1 121 121 ALA HB1 H 1 1.12 0.01 . 1 . . . . 143 ALA HB . 16494 1 768 . 1 1 121 121 ALA HB2 H 1 1.12 0.01 . 1 . . . . 143 ALA HB . 16494 1 769 . 1 1 121 121 ALA HB3 H 1 1.12 0.01 . 1 . . . . 143 ALA HB . 16494 1 770 . 1 1 122 122 ILE H H 1 5.88 0.01 . 1 . . . . 144 ILE HN . 16494 1 771 . 1 1 122 122 ILE HA H 1 5.17 0.01 . 1 . . . . 144 ILE HA . 16494 1 772 . 1 1 122 122 ILE HB H 1 2.22 0.01 . 1 . . . . 144 ILE HB . 16494 1 773 . 1 1 122 122 ILE HD11 H 1 -0.13 0.01 . 1 . . . . 144 ILE HD1 . 16494 1 774 . 1 1 122 122 ILE HD12 H 1 -0.13 0.01 . 1 . . . . 144 ILE HD1 . 16494 1 775 . 1 1 122 122 ILE HD13 H 1 -0.13 0.01 . 1 . . . . 144 ILE HD1 . 16494 1 776 . 1 1 122 122 ILE HG12 H 1 1.06 0.01 . 2 . . . . 144 ILE HG12 . 16494 1 777 . 1 1 122 122 ILE HG13 H 1 0.82 0.01 . 2 . . . . 144 ILE HG13 . 16494 1 778 . 1 1 122 122 ILE HG21 H 1 0.60 0.01 . 1 . . . . 144 ILE HG2 . 16494 1 779 . 1 1 122 122 ILE HG22 H 1 0.60 0.01 . 1 . . . . 144 ILE HG2 . 16494 1 780 . 1 1 122 122 ILE HG23 H 1 0.60 0.01 . 1 . . . . 144 ILE HG2 . 16494 1 781 . 1 1 123 123 LEU H H 1 6.84 0.01 . 1 . . . . 145 LEU HN . 16494 1 782 . 1 1 123 123 LEU HA H 1 4.61 0.01 . 1 . . . . 145 LEU HA . 16494 1 783 . 1 1 123 123 LEU HB2 H 1 1.54 0.01 . 2 . . . . 145 LEU HB2 . 16494 1 784 . 1 1 123 123 LEU HB3 H 1 1.54 0.01 . 2 . . . . 145 LEU HB3 . 16494 1 785 . 1 1 124 124 PHE H H 1 9.36 0.01 . 1 . . . . 146 PHE HN . 16494 1 786 . 1 1 124 124 PHE HA H 1 5.63 0.01 . 1 . . . . 146 PHE HA . 16494 1 787 . 1 1 124 124 PHE HB2 H 1 3.14 0.01 . 2 . . . . 146 PHE HB2 . 16494 1 788 . 1 1 124 124 PHE HB3 H 1 2.79 0.01 . 2 . . . . 146 PHE HB3 . 16494 1 789 . 1 1 124 124 PHE HD1 H 1 7.20 0.01 . 3 . . . . 146 PHE HD1 . 16494 1 790 . 1 1 124 124 PHE HD2 H 1 7.20 0.01 . 3 . . . . 146 PHE HD2 . 16494 1 791 . 1 1 124 124 PHE HE1 H 1 7.32 0.01 . 3 . . . . 146 PHE HE1 . 16494 1 792 . 1 1 124 124 PHE HE2 H 1 7.32 0.01 . 3 . . . . 146 PHE HE2 . 16494 1 793 . 1 1 124 124 PHE HZ H 1 6.90 0.01 . 1 . . . . 146 PHE HZ . 16494 1 794 . 1 1 125 125 LEU H H 1 10.06 0.01 . 1 . . . . 147 LEU HN . 16494 1 795 . 1 1 125 125 LEU HA H 1 5.25 0.01 . 1 . . . . 147 LEU HA . 16494 1 796 . 1 1 125 125 LEU HB2 H 1 1.94 0.01 . 2 . . . . 147 LEU HB2 . 16494 1 797 . 1 1 125 125 LEU HB3 H 1 1.38 0.01 . 2 . . . . 147 LEU HB3 . 16494 1 798 . 1 1 125 125 LEU HD11 H 1 0.74 0.01 . 2 . . . . 147 LEU HD1 . 16494 1 799 . 1 1 125 125 LEU HD12 H 1 0.74 0.01 . 2 . . . . 147 LEU HD1 . 16494 1 800 . 1 1 125 125 LEU HD13 H 1 0.74 0.01 . 2 . . . . 147 LEU HD1 . 16494 1 801 . 1 1 125 125 LEU HD21 H 1 0.74 0.01 . 2 . . . . 147 LEU HD2 . 16494 1 802 . 1 1 125 125 LEU HD22 H 1 0.74 0.01 . 2 . . . . 147 LEU HD2 . 16494 1 803 . 1 1 125 125 LEU HD23 H 1 0.74 0.01 . 2 . . . . 147 LEU HD2 . 16494 1 804 . 1 1 125 125 LEU HG H 1 1.50 0.01 . 1 . . . . 147 LEU HG . 16494 1 805 . 1 1 126 126 PRO HA H 1 5.60 0.01 . 1 . . . . 148 PRO HA . 16494 1 806 . 1 1 126 126 PRO HB2 H 1 2.04 0.01 . 2 . . . . 148 PRO HB2 . 16494 1 807 . 1 1 126 126 PRO HB3 H 1 2.04 0.01 . 2 . . . . 148 PRO HB3 . 16494 1 808 . 1 1 126 126 PRO HD2 H 1 4.22 0.01 . 2 . . . . 148 PRO HD2 . 16494 1 809 . 1 1 126 126 PRO HD3 H 1 3.94 0.01 . 2 . . . . 148 PRO HD3 . 16494 1 810 . 1 1 126 126 PRO HG2 H 1 2.36 0.01 . 2 . . . . 148 PRO HG2 . 16494 1 811 . 1 1 126 126 PRO HG3 H 1 2.36 0.01 . 2 . . . . 148 PRO HG3 . 16494 1 812 . 1 1 127 127 LEU H H 1 9.80 0.01 . 1 . . . . 149 LEU HN . 16494 1 813 . 1 1 127 127 LEU HA H 1 5.04 0.01 . 1 . . . . 149 LEU HA . 16494 1 814 . 1 1 127 127 LEU HB2 H 1 1.72 0.01 . 2 . . . . 149 LEU HB2 . 16494 1 815 . 1 1 127 127 LEU HB3 H 1 1.72 0.01 . 2 . . . . 149 LEU HB3 . 16494 1 816 . 1 1 127 127 LEU HD11 H 1 0.90 0.01 . 2 . . . . 149 LEU HD1 . 16494 1 817 . 1 1 127 127 LEU HD12 H 1 0.90 0.01 . 2 . . . . 149 LEU HD1 . 16494 1 818 . 1 1 127 127 LEU HD13 H 1 0.90 0.01 . 2 . . . . 149 LEU HD1 . 16494 1 819 . 1 1 127 127 LEU HD21 H 1 0.90 0.01 . 2 . . . . 149 LEU HD2 . 16494 1 820 . 1 1 127 127 LEU HD22 H 1 0.90 0.01 . 2 . . . . 149 LEU HD2 . 16494 1 821 . 1 1 127 127 LEU HD23 H 1 0.90 0.01 . 2 . . . . 149 LEU HD2 . 16494 1 822 . 1 1 127 127 LEU HG H 1 1.86 0.01 . 1 . . . . 149 LEU HG . 16494 1 823 . 1 1 128 128 PRO HB2 H 1 2.36 0.01 . 2 . . . . 150 PRO HB2 . 16494 1 824 . 1 1 128 128 PRO HD2 H 1 3.84 0.01 . 2 . . . . 150 PRO HD2 . 16494 1 825 . 1 1 128 128 PRO HD3 H 1 3.66 0.01 . 2 . . . . 150 PRO HD3 . 16494 1 826 . 1 1 128 128 PRO HG2 H 1 2.04 0.01 . 2 . . . . 150 PRO HG2 . 16494 1 827 . 1 1 128 128 PRO HG3 H 1 2.04 0.01 . 2 . . . . 150 PRO HG3 . 16494 1 828 . 1 1 129 129 VAL H H 1 8.14 0.01 . 1 . . . . 151 VAL HN . 16494 1 829 . 1 1 129 129 VAL HA H 1 3.78 0.01 . 1 . . . . 151 VAL HA . 16494 1 830 . 1 1 129 129 VAL HB H 1 1.96 0.01 . 1 . . . . 151 VAL HB . 16494 1 831 . 1 1 129 129 VAL HG11 H 1 0.84 0.01 . 2 . . . . 151 VAL HG1 . 16494 1 832 . 1 1 129 129 VAL HG12 H 1 0.84 0.01 . 2 . . . . 151 VAL HG1 . 16494 1 833 . 1 1 129 129 VAL HG13 H 1 0.84 0.01 . 2 . . . . 151 VAL HG1 . 16494 1 834 . 1 1 129 129 VAL HG21 H 1 0.84 0.01 . 2 . . . . 151 VAL HG2 . 16494 1 835 . 1 1 129 129 VAL HG22 H 1 0.84 0.01 . 2 . . . . 151 VAL HG2 . 16494 1 836 . 1 1 129 129 VAL HG23 H 1 0.84 0.01 . 2 . . . . 151 VAL HG2 . 16494 1 837 . 1 1 130 130 SER H H 1 7.98 0.01 . 1 . . . . 152 SER HN . 16494 1 838 . 1 1 130 130 SER HA H 1 4.55 0.01 . 1 . . . . 152 SER HA . 16494 1 839 . 1 1 130 130 SER HB2 H 1 3.85 0.01 . 2 . . . . 152 SER HB2 . 16494 1 840 . 1 1 130 130 SER HB3 H 1 3.78 0.01 . 2 . . . . 152 SER HB3 . 16494 1 841 . 1 1 131 131 SER H H 1 8.51 0.01 . 1 . . . . 153 SER HN . 16494 1 842 . 1 1 131 131 SER HA H 1 4.46 0.01 . 1 . . . . 153 SER HA . 16494 1 843 . 1 1 131 131 SER HB2 H 1 3.89 0.01 . 2 . . . . 153 SER HB2 . 16494 1 844 . 1 1 131 131 SER HB3 H 1 3.83 0.01 . 2 . . . . 153 SER HB3 . 16494 1 845 . 1 1 132 132 ASP H H 1 8.05 0.01 . 1 . . . . 154 ASP HN . 16494 1 846 . 1 1 132 132 ASP HA H 1 4.40 0.01 . 1 . . . . 154 ASP HA . 16494 1 847 . 1 1 132 132 ASP HB2 H 1 2.68 0.01 . 2 . . . . 154 ASP HB2 . 16494 1 848 . 1 1 132 132 ASP HB3 H 1 2.54 0.01 . 2 . . . . 154 ASP HB3 . 16494 1 stop_ save_