data_30133 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30133 _Entry.Title ; Solution Structure of Antibiotic-Resistance Factor ANT(2'')-Ia Reveals Substrate-Regulated Conformation Dynamics ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-07-06 _Entry.Accession_date 2016-07-06 _Entry.Last_release_date 2016-07-15 _Entry.Original_release_date 2016-07-15 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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 V. Bacot-Davis V. R. . . 30133 2 A. Berghuis A. M. . . 30133 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Antibiotic resistance' . 30133 aminoglycoside . 30133 transferase . 30133 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30133 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 778 30133 '15N chemical shifts' 167 30133 '1H chemical shifts' 1069 30133 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 . . 2022-08-01 2016-07-06 update BMRB 'update entry citation' 30133 1 . . 2017-07-07 2016-07-06 original author 'original release' 30133 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 30122 "Solution Structure of Antibiotic-Resistance Factor ANT(2'')-Ia Reveals Substrate-Regulated Conformation Dynamics" 30133 PDB 5KQJ 'BMRB Entry Tracking System' 30133 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30133 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 28734024 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Effect of solvent and protein dynamics in ligand recognition and inhibition of aminoglycoside adenyltransferase 2"-Ia ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full 'Protein science : a publication of the Protein Society' _Citation.Journal_volume 26 _Citation.Journal_issue 9 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1469-896X _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1852 _Citation.Page_last 1863 _Citation.Year 2017 _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 Valjean Bacot-Davis V. R. . . 30133 1 2 Angelia Bassenden A. V. . . 30133 1 3 Tara Sprules T. . . . 30133 1 4 Albert Berghuis A. M. . . 30133 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30133 _Assembly.ID 1 _Assembly.Name "2''-aminoglycoside nucleotidyltransferase (E.C.2.7.7.46)" _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 entity_1 1 $entity_1 A A yes . . . . . . 30133 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30133 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name "2''-aminoglycoside nucleotidyltransferase" _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MDTTQVTLIHKILAAADERN LPLWIGGGWAIDARLGRVTR KHDDIDLTFPGERRGELEAI VEMLGGRVMEELDYGFLAEI GDELLDCEPAWWADEAYEIA EAPQGSCPEAAEGVIAGRPV RCNSWEAIIWDYFYYADEVP PVDWPTKHIESYRLACTSLG AEKVEVLRAAFRSRYAALEH HHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 185 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 2.7.7.46 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20964.516 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID AAD(2'') na 30133 1 "Gentamicin 2''-nucleotidyltransferase" na 30133 1 'Gentamicin resistance protein' na 30133 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 . 30133 1 2 2 ASP . 30133 1 3 3 THR . 30133 1 4 4 THR . 30133 1 5 5 GLN . 30133 1 6 6 VAL . 30133 1 7 7 THR . 30133 1 8 8 LEU . 30133 1 9 9 ILE . 30133 1 10 10 HIS . 30133 1 11 11 LYS . 30133 1 12 12 ILE . 30133 1 13 13 LEU . 30133 1 14 14 ALA . 30133 1 15 15 ALA . 30133 1 16 16 ALA . 30133 1 17 17 ASP . 30133 1 18 18 GLU . 30133 1 19 19 ARG . 30133 1 20 20 ASN . 30133 1 21 21 LEU . 30133 1 22 22 PRO . 30133 1 23 23 LEU . 30133 1 24 24 TRP . 30133 1 25 25 ILE . 30133 1 26 26 GLY . 30133 1 27 27 GLY . 30133 1 28 28 GLY . 30133 1 29 29 TRP . 30133 1 30 30 ALA . 30133 1 31 31 ILE . 30133 1 32 32 ASP . 30133 1 33 33 ALA . 30133 1 34 34 ARG . 30133 1 35 35 LEU . 30133 1 36 36 GLY . 30133 1 37 37 ARG . 30133 1 38 38 VAL . 30133 1 39 39 THR . 30133 1 40 40 ARG . 30133 1 41 41 LYS . 30133 1 42 42 HIS . 30133 1 43 43 ASP . 30133 1 44 44 ASP . 30133 1 45 45 ILE . 30133 1 46 46 ASP . 30133 1 47 47 LEU . 30133 1 48 48 THR . 30133 1 49 49 PHE . 30133 1 50 50 PRO . 30133 1 51 51 GLY . 30133 1 52 52 GLU . 30133 1 53 53 ARG . 30133 1 54 54 ARG . 30133 1 55 55 GLY . 30133 1 56 56 GLU . 30133 1 57 57 LEU . 30133 1 58 58 GLU . 30133 1 59 59 ALA . 30133 1 60 60 ILE . 30133 1 61 61 VAL . 30133 1 62 62 GLU . 30133 1 63 63 MET . 30133 1 64 64 LEU . 30133 1 65 65 GLY . 30133 1 66 66 GLY . 30133 1 67 67 ARG . 30133 1 68 68 VAL . 30133 1 69 69 MET . 30133 1 70 70 GLU . 30133 1 71 71 GLU . 30133 1 72 72 LEU . 30133 1 73 73 ASP . 30133 1 74 74 TYR . 30133 1 75 75 GLY . 30133 1 76 76 PHE . 30133 1 77 77 LEU . 30133 1 78 78 ALA . 30133 1 79 79 GLU . 30133 1 80 80 ILE . 30133 1 81 81 GLY . 30133 1 82 82 ASP . 30133 1 83 83 GLU . 30133 1 84 84 LEU . 30133 1 85 85 LEU . 30133 1 86 86 ASP . 30133 1 87 87 CYS . 30133 1 88 88 GLU . 30133 1 89 89 PRO . 30133 1 90 90 ALA . 30133 1 91 91 TRP . 30133 1 92 92 TRP . 30133 1 93 93 ALA . 30133 1 94 94 ASP . 30133 1 95 95 GLU . 30133 1 96 96 ALA . 30133 1 97 97 TYR . 30133 1 98 98 GLU . 30133 1 99 99 ILE . 30133 1 100 100 ALA . 30133 1 101 101 GLU . 30133 1 102 102 ALA . 30133 1 103 103 PRO . 30133 1 104 104 GLN . 30133 1 105 105 GLY . 30133 1 106 106 SER . 30133 1 107 107 CYS . 30133 1 108 108 PRO . 30133 1 109 109 GLU . 30133 1 110 110 ALA . 30133 1 111 111 ALA . 30133 1 112 112 GLU . 30133 1 113 113 GLY . 30133 1 114 114 VAL . 30133 1 115 115 ILE . 30133 1 116 116 ALA . 30133 1 117 117 GLY . 30133 1 118 118 ARG . 30133 1 119 119 PRO . 30133 1 120 120 VAL . 30133 1 121 121 ARG . 30133 1 122 122 CYS . 30133 1 123 123 ASN . 30133 1 124 124 SER . 30133 1 125 125 TRP . 30133 1 126 126 GLU . 30133 1 127 127 ALA . 30133 1 128 128 ILE . 30133 1 129 129 ILE . 30133 1 130 130 TRP . 30133 1 131 131 ASP . 30133 1 132 132 TYR . 30133 1 133 133 PHE . 30133 1 134 134 TYR . 30133 1 135 135 TYR . 30133 1 136 136 ALA . 30133 1 137 137 ASP . 30133 1 138 138 GLU . 30133 1 139 139 VAL . 30133 1 140 140 PRO . 30133 1 141 141 PRO . 30133 1 142 142 VAL . 30133 1 143 143 ASP . 30133 1 144 144 TRP . 30133 1 145 145 PRO . 30133 1 146 146 THR . 30133 1 147 147 LYS . 30133 1 148 148 HIS . 30133 1 149 149 ILE . 30133 1 150 150 GLU . 30133 1 151 151 SER . 30133 1 152 152 TYR . 30133 1 153 153 ARG . 30133 1 154 154 LEU . 30133 1 155 155 ALA . 30133 1 156 156 CYS . 30133 1 157 157 THR . 30133 1 158 158 SER . 30133 1 159 159 LEU . 30133 1 160 160 GLY . 30133 1 161 161 ALA . 30133 1 162 162 GLU . 30133 1 163 163 LYS . 30133 1 164 164 VAL . 30133 1 165 165 GLU . 30133 1 166 166 VAL . 30133 1 167 167 LEU . 30133 1 168 168 ARG . 30133 1 169 169 ALA . 30133 1 170 170 ALA . 30133 1 171 171 PHE . 30133 1 172 172 ARG . 30133 1 173 173 SER . 30133 1 174 174 ARG . 30133 1 175 175 TYR . 30133 1 176 176 ALA . 30133 1 177 177 ALA . 30133 1 178 178 LEU . 30133 1 179 179 GLU . 30133 1 180 180 HIS . 30133 1 181 181 HIS . 30133 1 182 182 HIS . 30133 1 183 183 HIS . 30133 1 184 184 HIS . 30133 1 185 185 HIS . 30133 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 30133 1 . ASP 2 2 30133 1 . THR 3 3 30133 1 . THR 4 4 30133 1 . GLN 5 5 30133 1 . VAL 6 6 30133 1 . THR 7 7 30133 1 . LEU 8 8 30133 1 . ILE 9 9 30133 1 . HIS 10 10 30133 1 . LYS 11 11 30133 1 . ILE 12 12 30133 1 . LEU 13 13 30133 1 . ALA 14 14 30133 1 . ALA 15 15 30133 1 . ALA 16 16 30133 1 . ASP 17 17 30133 1 . GLU 18 18 30133 1 . ARG 19 19 30133 1 . ASN 20 20 30133 1 . LEU 21 21 30133 1 . PRO 22 22 30133 1 . LEU 23 23 30133 1 . TRP 24 24 30133 1 . ILE 25 25 30133 1 . GLY 26 26 30133 1 . GLY 27 27 30133 1 . GLY 28 28 30133 1 . TRP 29 29 30133 1 . ALA 30 30 30133 1 . ILE 31 31 30133 1 . ASP 32 32 30133 1 . ALA 33 33 30133 1 . ARG 34 34 30133 1 . LEU 35 35 30133 1 . GLY 36 36 30133 1 . ARG 37 37 30133 1 . VAL 38 38 30133 1 . THR 39 39 30133 1 . ARG 40 40 30133 1 . LYS 41 41 30133 1 . HIS 42 42 30133 1 . ASP 43 43 30133 1 . ASP 44 44 30133 1 . ILE 45 45 30133 1 . ASP 46 46 30133 1 . LEU 47 47 30133 1 . THR 48 48 30133 1 . PHE 49 49 30133 1 . PRO 50 50 30133 1 . GLY 51 51 30133 1 . GLU 52 52 30133 1 . ARG 53 53 30133 1 . ARG 54 54 30133 1 . GLY 55 55 30133 1 . GLU 56 56 30133 1 . LEU 57 57 30133 1 . GLU 58 58 30133 1 . ALA 59 59 30133 1 . ILE 60 60 30133 1 . VAL 61 61 30133 1 . GLU 62 62 30133 1 . MET 63 63 30133 1 . LEU 64 64 30133 1 . GLY 65 65 30133 1 . GLY 66 66 30133 1 . ARG 67 67 30133 1 . VAL 68 68 30133 1 . MET 69 69 30133 1 . GLU 70 70 30133 1 . GLU 71 71 30133 1 . LEU 72 72 30133 1 . ASP 73 73 30133 1 . TYR 74 74 30133 1 . GLY 75 75 30133 1 . PHE 76 76 30133 1 . LEU 77 77 30133 1 . ALA 78 78 30133 1 . GLU 79 79 30133 1 . ILE 80 80 30133 1 . GLY 81 81 30133 1 . ASP 82 82 30133 1 . GLU 83 83 30133 1 . LEU 84 84 30133 1 . LEU 85 85 30133 1 . ASP 86 86 30133 1 . CYS 87 87 30133 1 . GLU 88 88 30133 1 . PRO 89 89 30133 1 . ALA 90 90 30133 1 . TRP 91 91 30133 1 . TRP 92 92 30133 1 . ALA 93 93 30133 1 . ASP 94 94 30133 1 . GLU 95 95 30133 1 . ALA 96 96 30133 1 . TYR 97 97 30133 1 . GLU 98 98 30133 1 . ILE 99 99 30133 1 . ALA 100 100 30133 1 . GLU 101 101 30133 1 . ALA 102 102 30133 1 . PRO 103 103 30133 1 . GLN 104 104 30133 1 . GLY 105 105 30133 1 . SER 106 106 30133 1 . CYS 107 107 30133 1 . PRO 108 108 30133 1 . GLU 109 109 30133 1 . ALA 110 110 30133 1 . ALA 111 111 30133 1 . GLU 112 112 30133 1 . GLY 113 113 30133 1 . VAL 114 114 30133 1 . ILE 115 115 30133 1 . ALA 116 116 30133 1 . GLY 117 117 30133 1 . ARG 118 118 30133 1 . PRO 119 119 30133 1 . VAL 120 120 30133 1 . ARG 121 121 30133 1 . CYS 122 122 30133 1 . ASN 123 123 30133 1 . SER 124 124 30133 1 . TRP 125 125 30133 1 . GLU 126 126 30133 1 . ALA 127 127 30133 1 . ILE 128 128 30133 1 . ILE 129 129 30133 1 . TRP 130 130 30133 1 . ASP 131 131 30133 1 . TYR 132 132 30133 1 . PHE 133 133 30133 1 . TYR 134 134 30133 1 . TYR 135 135 30133 1 . ALA 136 136 30133 1 . ASP 137 137 30133 1 . GLU 138 138 30133 1 . VAL 139 139 30133 1 . PRO 140 140 30133 1 . PRO 141 141 30133 1 . VAL 142 142 30133 1 . ASP 143 143 30133 1 . TRP 144 144 30133 1 . PRO 145 145 30133 1 . THR 146 146 30133 1 . LYS 147 147 30133 1 . HIS 148 148 30133 1 . ILE 149 149 30133 1 . GLU 150 150 30133 1 . SER 151 151 30133 1 . TYR 152 152 30133 1 . ARG 153 153 30133 1 . LEU 154 154 30133 1 . ALA 155 155 30133 1 . CYS 156 156 30133 1 . THR 157 157 30133 1 . SER 158 158 30133 1 . LEU 159 159 30133 1 . GLY 160 160 30133 1 . ALA 161 161 30133 1 . GLU 162 162 30133 1 . LYS 163 163 30133 1 . VAL 164 164 30133 1 . GLU 165 165 30133 1 . VAL 166 166 30133 1 . LEU 167 167 30133 1 . ARG 168 168 30133 1 . ALA 169 169 30133 1 . ALA 170 170 30133 1 . PHE 171 171 30133 1 . ARG 172 172 30133 1 . SER 173 173 30133 1 . ARG 174 174 30133 1 . TYR 175 175 30133 1 . ALA 176 176 30133 1 . ALA 177 177 30133 1 . LEU 178 178 30133 1 . GLU 179 179 30133 1 . HIS 180 180 30133 1 . HIS 181 181 30133 1 . HIS 182 182 30133 1 . HIS 183 183 30133 1 . HIS 184 184 30133 1 . HIS 185 185 30133 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 30133 _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 $entity_1 . 573 organism . 'Klebsiella pneumoniae' enterobacteria . . Bacteria . Klebsiella pneumoniae . . . . . . . . . . . aadB . 30133 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 30133 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 469008 Escherichia coli BL21 DE3 . . . . . . . . 30133 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30133 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details "0.5 mM [U-100% 13C; U-100% 15N] ANT(2'')-Ia, 90% H2O/10% D2O" _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 "2''-aminoglycoside nucleotidyltransferase" '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.5 . . mM . . . . 30133 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 30133 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 30133 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 30133 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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 30133 1 pH 7 . pH 30133 1 pressure 1 . atm 30133 1 temperature 298 . K 30133 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30133 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 30133 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 30133 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30133 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30133 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 30133 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30133 _Software.ID 3 _Software.Type . _Software.Name PONDEROSA-C/S _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee W, Kim JH, Westler WM, Markley JL (2011) PONDEROSA. Bioinformatics 27: 1727-1728' . . 30133 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 30133 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30133 _Software.ID 4 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 30133 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 30133 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30133 _Software.ID 5 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 30133 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 30133 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30133 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30133 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 30133 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 30133 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Varian INOVA . 500 . . . 30133 1 2 NMR_spectrometer_2 Varian INOVA . 800 . . . 30133 1 3 NMR_spectrometer_3 Bruker DRX . 600 . . . 30133 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 30133 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30133 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 4 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 6 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 8 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 10 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 11 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30133 1 14 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 30133 1 15 '2D 1H-1H NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 30133 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30133 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 30133 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30133 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30133 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30133 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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' . . . 30133 1 2 '2D 1H-13C HSQC aliphatic' . . . 30133 1 3 '2D 1H-13C HSQC aromatic' . . . 30133 1 4 '3D HNCO' . . . 30133 1 5 '3D HNCA' . . . 30133 1 6 '3D HNCACB' . . . 30133 1 7 '3D CBCA(CO)NH' . . . 30133 1 8 '3D HN(CO)CA' . . . 30133 1 9 '3D HCCH-TOCSY' . . . 30133 1 10 '3D H(CCO)NH' . . . 30133 1 11 '3D C(CO)NH' . . . 30133 1 12 '3D 1H-15N NOESY' . . . 30133 1 13 '3D 1H-13C NOESY' . . . 30133 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 30133 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 3.913 0.000 . 9 . . . . A 1 MET HA . 30133 1 2 . 1 . 1 1 1 MET HB2 H 1 1.762 0.275 . 9 . . . . A 1 MET HB2 . 30133 1 3 . 1 . 1 1 1 MET HB3 H 1 1.735 0.266 . 9 . . . . A 1 MET HB3 . 30133 1 4 . 1 . 1 1 1 MET HG2 H 1 1.537 0.604 . 9 . . . . A 1 MET HG2 . 30133 1 5 . 1 . 1 1 1 MET HG3 H 1 1.936 0.881 . 9 . . . . A 1 MET HG3 . 30133 1 6 . 1 . 1 1 1 MET HE1 H 1 1.955 0.000 . 9 . . . . A 1 MET HE1 . 30133 1 7 . 1 . 1 1 1 MET HE2 H 1 1.955 0.000 . 9 . . . . A 1 MET HE2 . 30133 1 8 . 1 . 1 1 1 MET HE3 H 1 1.955 0.000 . 9 . . . . A 1 MET HE3 . 30133 1 9 . 1 . 1 1 1 MET H H 1 2.238 1.031 . 9 . . . . A 1 MET H1 . 30133 1 10 . 1 . 1 1 1 MET C C 13 172.899 0.000 . 9 . . . . A 1 MET C . 30133 1 11 . 1 . 1 1 1 MET CA C 13 62.665 0.036 . 9 . . . . A 1 MET CA . 30133 1 12 . 1 . 1 1 1 MET CB C 13 30.866 0.029 . 9 . . . . A 1 MET CB . 30133 1 13 . 1 . 1 1 1 MET CG C 13 26.795 0.028 . 9 . . . . A 1 MET CG . 30133 1 14 . 1 . 1 1 1 MET CE C 13 19.751 0.186 . 9 . . . . A 1 MET CE . 30133 1 15 . 1 . 1 2 2 ASP H H 1 6.149 0.507 . 9 . . . . A 2 ASP H . 30133 1 16 . 1 . 1 2 2 ASP HA H 1 4.835 0.000 . 9 . . . . A 2 ASP HA . 30133 1 17 . 1 . 1 2 2 ASP HB2 H 1 3.703 0.472 . 9 . . . . A 2 ASP HB2 . 30133 1 18 . 1 . 1 2 2 ASP HB3 H 1 3.468 0.614 . 9 . . . . A 2 ASP HB3 . 30133 1 19 . 1 . 1 2 2 ASP C C 13 176.139 0.000 . 9 . . . . A 2 ASP C . 30133 1 20 . 1 . 1 2 2 ASP CA C 13 53.056 0.191 . 9 . . . . A 2 ASP CA . 30133 1 21 . 1 . 1 2 2 ASP CB C 13 47.243 0.093 . 9 . . . . A 2 ASP CB . 30133 1 22 . 1 . 1 2 2 ASP N N 15 114.930 0.016 . 9 . . . . A 2 ASP N . 30133 1 23 . 1 . 1 3 3 THR H H 1 8.954 2.026 . 9 . . . . A 3 THR H . 30133 1 24 . 1 . 1 3 3 THR HA H 1 4.456 0.000 . 9 . . . . A 3 THR HA . 30133 1 25 . 1 . 1 3 3 THR HB H 1 3.213 0.000 . 9 . . . . A 3 THR HB . 30133 1 26 . 1 . 1 3 3 THR HG21 H 1 1.276 0.017 . 9 . . . . A 3 THR HG21 . 30133 1 27 . 1 . 1 3 3 THR HG22 H 1 1.276 0.017 . 9 . . . . A 3 THR HG22 . 30133 1 28 . 1 . 1 3 3 THR HG23 H 1 1.276 0.017 . 9 . . . . A 3 THR HG23 . 30133 1 29 . 1 . 1 3 3 THR C C 13 175.822 0.000 . 9 . . . . A 3 THR C . 30133 1 30 . 1 . 1 3 3 THR CA C 13 61.662 0.750 . 9 . . . . A 3 THR CA . 30133 1 31 . 1 . 1 3 3 THR CB C 13 69.631 0.105 . 9 . . . . A 3 THR CB . 30133 1 32 . 1 . 1 3 3 THR CG2 C 13 21.912 0.012 . 9 . . . . A 3 THR CG2 . 30133 1 33 . 1 . 1 3 3 THR N N 15 121.376 0.007 . 9 . . . . A 3 THR N . 30133 1 34 . 1 . 1 4 4 THR H H 1 7.577 1.974 . 9 . . . . A 4 THR H . 30133 1 35 . 1 . 1 4 4 THR HA H 1 4.347 0.000 . 9 . . . . A 4 THR HA . 30133 1 36 . 1 . 1 4 4 THR HB H 1 4.034 0.000 . 9 . . . . A 4 THR HB . 30133 1 37 . 1 . 1 4 4 THR HG21 H 1 1.150 0.100 . 9 . . . . A 4 THR HG21 . 30133 1 38 . 1 . 1 4 4 THR HG22 H 1 1.150 0.100 . 9 . . . . A 4 THR HG22 . 30133 1 39 . 1 . 1 4 4 THR HG23 H 1 1.150 0.100 . 9 . . . . A 4 THR HG23 . 30133 1 40 . 1 . 1 4 4 THR C C 13 176.648 0.000 . 9 . . . . A 4 THR C . 30133 1 41 . 1 . 1 4 4 THR CA C 13 65.330 0.065 . 9 . . . . A 4 THR CA . 30133 1 42 . 1 . 1 4 4 THR CB C 13 69.123 0.068 . 9 . . . . A 4 THR CB . 30133 1 43 . 1 . 1 4 4 THR CG2 C 13 21.539 0.432 . 9 . . . . A 4 THR CG2 . 30133 1 44 . 1 . 1 4 4 THR N N 15 118.040 0.000 . 9 . . . . A 4 THR N . 30133 1 45 . 1 . 1 5 5 GLN H H 1 7.960 1.784 . 9 . . . . A 5 GLN H . 30133 1 46 . 1 . 1 5 5 GLN HA H 1 4.319 0.000 . 9 . . . . A 5 GLN HA . 30133 1 47 . 1 . 1 5 5 GLN HB2 H 1 2.124 0.087 . 9 . . . . A 5 GLN HB2 . 30133 1 48 . 1 . 1 5 5 GLN HB3 H 1 1.969 0.204 . 9 . . . . A 5 GLN HB3 . 30133 1 49 . 1 . 1 5 5 GLN HG2 H 1 2.215 0.087 . 9 . . . . A 5 GLN HG2 . 30133 1 50 . 1 . 1 5 5 GLN HG3 H 1 2.171 0.108 . 9 . . . . A 5 GLN HG3 . 30133 1 51 . 1 . 1 5 5 GLN HE21 H 1 7.535 0.000 . 9 . . . . A 5 GLN HE21 . 30133 1 52 . 1 . 1 5 5 GLN HE22 H 1 6.792 0.000 . 9 . . . . A 5 GLN HE22 . 30133 1 53 . 1 . 1 5 5 GLN C C 13 177.410 0.000 . 9 . . . . A 5 GLN C . 30133 1 54 . 1 . 1 5 5 GLN CA C 13 60.270 0.018 . 9 . . . . A 5 GLN CA . 30133 1 55 . 1 . 1 5 5 GLN CB C 13 29.628 0.102 . 9 . . . . A 5 GLN CB . 30133 1 56 . 1 . 1 5 5 GLN CG C 13 33.777 2.603 . 9 . . . . A 5 GLN CG . 30133 1 57 . 1 . 1 5 5 GLN N N 15 120.360 0.008 . 9 . . . . A 5 GLN N . 30133 1 58 . 1 . 1 5 5 GLN NE2 N 15 112.622 0.001 . 9 . . . . A 5 GLN NE2 . 30133 1 59 . 1 . 1 6 6 VAL H H 1 7.041 1.921 . 9 . . . . A 6 VAL H . 30133 1 60 . 1 . 1 6 6 VAL HA H 1 3.018 0.000 . 9 . . . . A 6 VAL HA . 30133 1 61 . 1 . 1 6 6 VAL HB H 1 1.990 0.054 . 9 . . . . A 6 VAL HB . 30133 1 62 . 1 . 1 6 6 VAL HG11 H 1 0.872 0.116 . 9 . . . . A 6 VAL HG11 . 30133 1 63 . 1 . 1 6 6 VAL HG12 H 1 0.872 0.116 . 9 . . . . A 6 VAL HG12 . 30133 1 64 . 1 . 1 6 6 VAL HG13 H 1 0.872 0.116 . 9 . . . . A 6 VAL HG13 . 30133 1 65 . 1 . 1 6 6 VAL HG21 H 1 0.691 0.261 . 9 . . . . A 6 VAL HG21 . 30133 1 66 . 1 . 1 6 6 VAL HG22 H 1 0.691 0.261 . 9 . . . . A 6 VAL HG22 . 30133 1 67 . 1 . 1 6 6 VAL HG23 H 1 0.691 0.261 . 9 . . . . A 6 VAL HG23 . 30133 1 68 . 1 . 1 6 6 VAL C C 13 176.457 0.000 . 9 . . . . A 6 VAL C . 30133 1 69 . 1 . 1 6 6 VAL CA C 13 66.948 0.038 . 9 . . . . A 6 VAL CA . 30133 1 70 . 1 . 1 6 6 VAL CB C 13 31.839 0.243 . 9 . . . . A 6 VAL CB . 30133 1 71 . 1 . 1 6 6 VAL CG1 C 13 23.220 0.010 . 9 . . . . A 6 VAL CG1 . 30133 1 72 . 1 . 1 6 6 VAL CG2 C 13 21.518 0.005 . 9 . . . . A 6 VAL CG2 . 30133 1 73 . 1 . 1 6 6 VAL N N 15 117.727 0.007 . 9 . . . . A 6 VAL N . 30133 1 74 . 1 . 1 7 7 THR H H 1 7.218 1.556 . 9 . . . . A 7 THR H . 30133 1 75 . 1 . 1 7 7 THR HA H 1 4.194 0.000 . 9 . . . . A 7 THR HA . 30133 1 76 . 1 . 1 7 7 THR HB H 1 3.256 0.000 . 9 . . . . A 7 THR HB . 30133 1 77 . 1 . 1 7 7 THR HG21 H 1 1.001 0.166 . 9 . . . . A 7 THR HG21 . 30133 1 78 . 1 . 1 7 7 THR HG22 H 1 1.001 0.166 . 9 . . . . A 7 THR HG22 . 30133 1 79 . 1 . 1 7 7 THR HG23 H 1 1.001 0.166 . 9 . . . . A 7 THR HG23 . 30133 1 80 . 1 . 1 7 7 THR C C 13 176.489 0.000 . 9 . . . . A 7 THR C . 30133 1 81 . 1 . 1 7 7 THR CA C 13 66.181 0.091 . 9 . . . . A 7 THR CA . 30133 1 82 . 1 . 1 7 7 THR CB C 13 68.679 0.058 . 9 . . . . A 7 THR CB . 30133 1 83 . 1 . 1 7 7 THR CG2 C 13 21.940 0.001 . 9 . . . . A 7 THR CG2 . 30133 1 84 . 1 . 1 7 7 THR N N 15 114.290 0.003 . 9 . . . . A 7 THR N . 30133 1 85 . 1 . 1 8 8 LEU H H 1 6.819 2.263 . 9 . . . . A 8 LEU H . 30133 1 86 . 1 . 1 8 8 LEU HA H 1 4.061 0.000 . 9 . . . . A 8 LEU HA . 30133 1 87 . 1 . 1 8 8 LEU HB2 H 1 1.748 0.030 . 9 . . . . A 8 LEU HB2 . 30133 1 88 . 1 . 1 8 8 LEU HB3 H 1 1.706 0.051 . 9 . . . . A 8 LEU HB3 . 30133 1 89 . 1 . 1 8 8 LEU HG H 1 1.087 0.654 . 9 . . . . A 8 LEU HG . 30133 1 90 . 1 . 1 8 8 LEU HD11 H 1 0.964 0.413 . 9 . . . . A 8 LEU HD11 . 30133 1 91 . 1 . 1 8 8 LEU HD12 H 1 0.964 0.413 . 9 . . . . A 8 LEU HD12 . 30133 1 92 . 1 . 1 8 8 LEU HD13 H 1 0.964 0.413 . 9 . . . . A 8 LEU HD13 . 30133 1 93 . 1 . 1 8 8 LEU HD21 H 1 0.987 0.356 . 9 . . . . A 8 LEU HD21 . 30133 1 94 . 1 . 1 8 8 LEU HD22 H 1 0.987 0.356 . 9 . . . . A 8 LEU HD22 . 30133 1 95 . 1 . 1 8 8 LEU HD23 H 1 0.987 0.356 . 9 . . . . A 8 LEU HD23 . 30133 1 96 . 1 . 1 8 8 LEU C C 13 177.918 0.000 . 9 . . . . A 8 LEU C . 30133 1 97 . 1 . 1 8 8 LEU CA C 13 58.244 0.060 . 9 . . . . A 8 LEU CA . 30133 1 98 . 1 . 1 8 8 LEU CB C 13 41.494 0.081 . 9 . . . . A 8 LEU CB . 30133 1 99 . 1 . 1 8 8 LEU CG C 13 25.332 0.015 . 9 . . . . A 8 LEU CG . 30133 1 100 . 1 . 1 8 8 LEU CD1 C 13 23.539 0.014 . 9 . . . . A 8 LEU CD1 . 30133 1 101 . 1 . 1 8 8 LEU CD2 C 13 23.253 0.008 . 9 . . . . A 8 LEU CD2 . 30133 1 102 . 1 . 1 8 8 LEU N N 15 121.919 0.007 . 9 . . . . A 8 LEU N . 30133 1 103 . 1 . 1 9 9 ILE H H 1 7.348 2.215 . 9 . . . . A 9 ILE H . 30133 1 104 . 1 . 1 9 9 ILE HA H 1 4.316 0.000 . 9 . . . . A 9 ILE HA . 30133 1 105 . 1 . 1 9 9 ILE HB H 1 2.125 0.610 . 9 . . . . A 9 ILE HB . 30133 1 106 . 1 . 1 9 9 ILE HG12 H 1 1.294 0.755 . 9 . . . . A 9 ILE HG12 . 30133 1 107 . 1 . 1 9 9 ILE HG13 H 1 1.294 0.755 . 9 . . . . A 9 ILE HG13 . 30133 1 108 . 1 . 1 9 9 ILE HG21 H 1 1.611 0.000 . 9 . . . . A 9 ILE HG21 . 30133 1 109 . 1 . 1 9 9 ILE HG22 H 1 1.611 0.000 . 9 . . . . A 9 ILE HG22 . 30133 1 110 . 1 . 1 9 9 ILE HG23 H 1 1.611 0.000 . 9 . . . . A 9 ILE HG23 . 30133 1 111 . 1 . 1 9 9 ILE HD11 H 1 1.556 0.000 . 9 . . . . A 9 ILE HD11 . 30133 1 112 . 1 . 1 9 9 ILE HD12 H 1 1.556 0.000 . 9 . . . . A 9 ILE HD12 . 30133 1 113 . 1 . 1 9 9 ILE HD13 H 1 1.556 0.000 . 9 . . . . A 9 ILE HD13 . 30133 1 114 . 1 . 1 9 9 ILE C C 13 177.601 0.000 . 9 . . . . A 9 ILE C . 30133 1 115 . 1 . 1 9 9 ILE CA C 13 66.751 0.018 . 9 . . . . A 9 ILE CA . 30133 1 116 . 1 . 1 9 9 ILE CB C 13 37.842 0.053 . 9 . . . . A 9 ILE CB . 30133 1 117 . 1 . 1 9 9 ILE CG1 C 13 30.828 0.089 . 9 . . . . A 9 ILE CG1 . 30133 1 118 . 1 . 1 9 9 ILE CG2 C 13 17.936 0.031 . 9 . . . . A 9 ILE CG2 . 30133 1 119 . 1 . 1 9 9 ILE CD1 C 13 13.053 0.043 . 9 . . . . A 9 ILE CD1 . 30133 1 120 . 1 . 1 9 9 ILE N N 15 119.416 0.008 . 9 . . . . A 9 ILE N . 30133 1 121 . 1 . 1 10 10 HIS H H 1 7.373 1.272 . 9 . . . . A 10 HIS H . 30133 1 122 . 1 . 1 10 10 HIS HA H 1 3.995 0.000 . 9 . . . . A 10 HIS HA . 30133 1 123 . 1 . 1 10 10 HIS HB2 H 1 3.323 0.000 . 9 . . . . A 10 HIS HB2 . 30133 1 124 . 1 . 1 10 10 HIS HB3 H 1 3.065 0.000 . 9 . . . . A 10 HIS HB3 . 30133 1 125 . 1 . 1 10 10 HIS C C 13 177.521 0.000 . 9 . . . . A 10 HIS C . 30133 1 126 . 1 . 1 10 10 HIS CA C 13 59.223 0.044 . 9 . . . . A 10 HIS CA . 30133 1 127 . 1 . 1 10 10 HIS CB C 13 31.452 0.070 . 9 . . . . A 10 HIS CB . 30133 1 128 . 1 . 1 10 10 HIS CG C 13 130.096 0.000 . 9 . . . . A 10 HIS CG . 30133 1 129 . 1 . 1 10 10 HIS CD2 C 13 120.536 0.008 . 9 . . . . A 10 HIS CD2 . 30133 1 130 . 1 . 1 10 10 HIS CE1 C 13 137.393 0.000 . 9 . . . . A 10 HIS CE1 . 30133 1 131 . 1 . 1 10 10 HIS N N 15 116.568 0.000 . 9 . . . . A 10 HIS N . 30133 1 132 . 1 . 1 11 11 LYS H H 1 7.396 2.166 . 9 . . . . A 11 LYS H . 30133 1 133 . 1 . 1 11 11 LYS HA H 1 5.285 0.000 . 9 . . . . A 11 LYS HA . 30133 1 134 . 1 . 1 11 11 LYS HB2 H 1 1.814 0.008 . 9 . . . . A 11 LYS HB2 . 30133 1 135 . 1 . 1 11 11 LYS HB3 H 1 5.676 10.488 . 9 . . . . A 11 LYS HB3 . 30133 1 136 . 1 . 1 11 11 LYS HG2 H 1 1.462 0.000 . 9 . . . . A 11 LYS HG2 . 30133 1 137 . 1 . 1 11 11 LYS HG3 H 1 1.400 0.000 . 9 . . . . A 11 LYS HG3 . 30133 1 138 . 1 . 1 11 11 LYS HD2 H 1 1.661 0.003 . 9 . . . . A 11 LYS HD2 . 30133 1 139 . 1 . 1 11 11 LYS HD3 H 1 1.637 0.018 . 9 . . . . A 11 LYS HD3 . 30133 1 140 . 1 . 1 11 11 LYS HE2 H 1 3.136 0.245 . 9 . . . . A 11 LYS HE2 . 30133 1 141 . 1 . 1 11 11 LYS HE3 H 1 3.099 0.227 . 9 . . . . A 11 LYS HE3 . 30133 1 142 . 1 . 1 11 11 LYS C C 13 180.015 0.000 . 9 . . . . A 11 LYS C . 30133 1 143 . 1 . 1 11 11 LYS CA C 13 60.219 0.035 . 9 . . . . A 11 LYS CA . 30133 1 144 . 1 . 1 11 11 LYS CB C 13 33.479 0.086 . 9 . . . . A 11 LYS CB . 30133 1 145 . 1 . 1 11 11 LYS CG C 13 23.016 0.002 . 9 . . . . A 11 LYS CG . 30133 1 146 . 1 . 1 11 11 LYS CD C 13 26.423 0.018 . 9 . . . . A 11 LYS CD . 30133 1 147 . 1 . 1 11 11 LYS CE C 13 43.416 0.000 . 9 . . . . A 11 LYS CE . 30133 1 148 . 1 . 1 11 11 LYS N N 15 120.356 0.000 . 9 . . . . A 11 LYS N . 30133 1 149 . 1 . 1 12 12 ILE H H 1 7.813 2.377 . 9 . . . . A 12 ILE H . 30133 1 150 . 1 . 1 12 12 ILE HA H 1 5.179 0.000 . 9 . . . . A 12 ILE HA . 30133 1 151 . 1 . 1 12 12 ILE HB H 1 1.873 0.000 . 9 . . . . A 12 ILE HB . 30133 1 152 . 1 . 1 12 12 ILE HG12 H 1 1.748 0.000 . 9 . . . . A 12 ILE HG12 . 30133 1 153 . 1 . 1 12 12 ILE HG13 H 1 1.748 0.000 . 9 . . . . A 12 ILE HG13 . 30133 1 154 . 1 . 1 12 12 ILE HG21 H 1 0.774 0.030 . 9 . . . . A 12 ILE HG21 . 30133 1 155 . 1 . 1 12 12 ILE HG22 H 1 0.774 0.030 . 9 . . . . A 12 ILE HG22 . 30133 1 156 . 1 . 1 12 12 ILE HG23 H 1 0.774 0.030 . 9 . . . . A 12 ILE HG23 . 30133 1 157 . 1 . 1 12 12 ILE HD11 H 1 0.598 0.304 . 9 . . . . A 12 ILE HD11 . 30133 1 158 . 1 . 1 12 12 ILE HD12 H 1 0.598 0.304 . 9 . . . . A 12 ILE HD12 . 30133 1 159 . 1 . 1 12 12 ILE HD13 H 1 0.598 0.304 . 9 . . . . A 12 ILE HD13 . 30133 1 160 . 1 . 1 12 12 ILE C C 13 177.156 0.000 . 9 . . . . A 12 ILE C . 30133 1 161 . 1 . 1 12 12 ILE CA C 13 65.455 0.227 . 9 . . . . A 12 ILE CA . 30133 1 162 . 1 . 1 12 12 ILE CB C 13 38.445 0.062 . 9 . . . . A 12 ILE CB . 30133 1 163 . 1 . 1 12 12 ILE CG1 C 13 27.788 0.464 . 9 . . . . A 12 ILE CG1 . 30133 1 164 . 1 . 1 12 12 ILE CG2 C 13 24.965 0.031 . 9 . . . . A 12 ILE CG2 . 30133 1 165 . 1 . 1 12 12 ILE CD1 C 13 24.603 0.058 . 9 . . . . A 12 ILE CD1 . 30133 1 166 . 1 . 1 12 12 ILE N N 15 121.527 0.000 . 9 . . . . A 12 ILE N . 30133 1 167 . 1 . 1 13 13 LEU H H 1 6.561 2.122 . 9 . . . . A 13 LEU H . 30133 1 168 . 1 . 1 13 13 LEU HA H 1 4.132 0.000 . 9 . . . . A 13 LEU HA . 30133 1 169 . 1 . 1 13 13 LEU HB2 H 1 2.795 0.000 . 9 . . . . A 13 LEU HB2 . 30133 1 170 . 1 . 1 13 13 LEU HB3 H 1 2.736 0.000 . 9 . . . . A 13 LEU HB3 . 30133 1 171 . 1 . 1 13 13 LEU HG H 1 2.103 0.000 . 9 . . . . A 13 LEU HG . 30133 1 172 . 1 . 1 13 13 LEU HD11 H 1 0.771 0.283 . 9 . . . . A 13 LEU HD11 . 30133 1 173 . 1 . 1 13 13 LEU HD12 H 1 0.771 0.283 . 9 . . . . A 13 LEU HD12 . 30133 1 174 . 1 . 1 13 13 LEU HD13 H 1 0.771 0.283 . 9 . . . . A 13 LEU HD13 . 30133 1 175 . 1 . 1 13 13 LEU HD21 H 1 1.048 0.000 . 9 . . . . A 13 LEU HD21 . 30133 1 176 . 1 . 1 13 13 LEU HD22 H 1 1.048 0.000 . 9 . . . . A 13 LEU HD22 . 30133 1 177 . 1 . 1 13 13 LEU HD23 H 1 1.048 0.000 . 9 . . . . A 13 LEU HD23 . 30133 1 178 . 1 . 1 13 13 LEU C C 13 175.853 0.000 . 9 . . . . A 13 LEU C . 30133 1 179 . 1 . 1 13 13 LEU CA C 13 58.013 0.287 . 9 . . . . A 13 LEU CA . 30133 1 180 . 1 . 1 13 13 LEU CB C 13 40.514 1.013 . 9 . . . . A 13 LEU CB . 30133 1 181 . 1 . 1 13 13 LEU CG C 13 30.210 0.020 . 9 . . . . A 13 LEU CG . 30133 1 182 . 1 . 1 13 13 LEU CD1 C 13 21.063 0.009 . 9 . . . . A 13 LEU CD1 . 30133 1 183 . 1 . 1 13 13 LEU CD2 C 13 20.130 0.002 . 9 . . . . A 13 LEU CD2 . 30133 1 184 . 1 . 1 13 13 LEU N N 15 119.914 0.007 . 9 . . . . A 13 LEU N . 30133 1 185 . 1 . 1 14 14 ALA H H 1 7.904 1.583 . 9 . . . . A 14 ALA H . 30133 1 186 . 1 . 1 14 14 ALA HA H 1 4.323 0.000 . 9 . . . . A 14 ALA HA . 30133 1 187 . 1 . 1 14 14 ALA HB1 H 1 1.384 0.000 . 9 . . . . A 14 ALA HB1 . 30133 1 188 . 1 . 1 14 14 ALA HB2 H 1 1.384 0.000 . 9 . . . . A 14 ALA HB2 . 30133 1 189 . 1 . 1 14 14 ALA HB3 H 1 1.384 0.000 . 9 . . . . A 14 ALA HB3 . 30133 1 190 . 1 . 1 14 14 ALA C C 13 177.061 0.000 . 9 . . . . A 14 ALA C . 30133 1 191 . 1 . 1 14 14 ALA CA C 13 52.253 0.153 . 9 . . . . A 14 ALA CA . 30133 1 192 . 1 . 1 14 14 ALA CB C 13 18.935 0.574 . 9 . . . . A 14 ALA CB . 30133 1 193 . 1 . 1 14 14 ALA N N 15 123.644 0.000 . 9 . . . . A 14 ALA N . 30133 1 194 . 1 . 1 15 15 ALA H H 1 7.558 1.552 . 9 . . . . A 15 ALA H . 30133 1 195 . 1 . 1 15 15 ALA HA H 1 4.249 0.000 . 9 . . . . A 15 ALA HA . 30133 1 196 . 1 . 1 15 15 ALA HB1 H 1 1.412 0.000 . 9 . . . . A 15 ALA HB1 . 30133 1 197 . 1 . 1 15 15 ALA HB2 H 1 1.412 0.000 . 9 . . . . A 15 ALA HB2 . 30133 1 198 . 1 . 1 15 15 ALA HB3 H 1 1.412 0.000 . 9 . . . . A 15 ALA HB3 . 30133 1 199 . 1 . 1 15 15 ALA C C 13 176.298 0.000 . 9 . . . . A 15 ALA C . 30133 1 200 . 1 . 1 15 15 ALA CA C 13 52.072 0.417 . 9 . . . . A 15 ALA CA . 30133 1 201 . 1 . 1 15 15 ALA CB C 13 19.633 0.038 . 9 . . . . A 15 ALA CB . 30133 1 202 . 1 . 1 15 15 ALA N N 15 121.662 0.016 . 9 . . . . A 15 ALA N . 30133 1 203 . 1 . 1 16 16 ALA H H 1 8.184 1.396 . 9 . . . . A 16 ALA H . 30133 1 204 . 1 . 1 16 16 ALA HA H 1 4.433 0.000 . 9 . . . . A 16 ALA HA . 30133 1 205 . 1 . 1 16 16 ALA HB1 H 1 1.189 0.000 . 9 . . . . A 16 ALA HB1 . 30133 1 206 . 1 . 1 16 16 ALA HB2 H 1 1.189 0.000 . 9 . . . . A 16 ALA HB2 . 30133 1 207 . 1 . 1 16 16 ALA HB3 H 1 1.189 0.000 . 9 . . . . A 16 ALA HB3 . 30133 1 208 . 1 . 1 16 16 ALA C C 13 175.266 0.000 . 9 . . . . A 16 ALA C . 30133 1 209 . 1 . 1 16 16 ALA CA C 13 51.816 0.331 . 9 . . . . A 16 ALA CA . 30133 1 210 . 1 . 1 16 16 ALA CB C 13 18.037 0.596 . 9 . . . . A 16 ALA CB . 30133 1 211 . 1 . 1 16 16 ALA N N 15 123.453 0.000 . 9 . . . . A 16 ALA N . 30133 1 212 . 1 . 1 17 17 ASP H H 1 7.184 1.434 . 9 . . . . A 17 ASP H . 30133 1 213 . 1 . 1 17 17 ASP HA H 1 4.620 0.000 . 9 . . . . A 17 ASP HA . 30133 1 214 . 1 . 1 17 17 ASP HB2 H 1 2.920 0.000 . 9 . . . . A 17 ASP HB2 . 30133 1 215 . 1 . 1 17 17 ASP HB3 H 1 2.850 0.000 . 9 . . . . A 17 ASP HB3 . 30133 1 216 . 1 . 1 17 17 ASP C C 13 176.870 0.000 . 9 . . . . A 17 ASP C . 30133 1 217 . 1 . 1 17 17 ASP CA C 13 56.184 0.718 . 9 . . . . A 17 ASP CA . 30133 1 218 . 1 . 1 17 17 ASP CB C 13 41.199 0.300 . 9 . . . . A 17 ASP CB . 30133 1 219 . 1 . 1 17 17 ASP N N 15 118.301 0.000 . 9 . . . . A 17 ASP N . 30133 1 220 . 1 . 1 18 18 GLU H H 1 7.131 1.572 . 9 . . . . A 18 GLU H . 30133 1 221 . 1 . 1 18 18 GLU HA H 1 4.202 0.000 . 9 . . . . A 18 GLU HA . 30133 1 222 . 1 . 1 18 18 GLU HB2 H 1 1.801 0.034 . 9 . . . . A 18 GLU HB2 . 30133 1 223 . 1 . 1 18 18 GLU HB3 H 1 1.739 0.090 . 9 . . . . A 18 GLU HB3 . 30133 1 224 . 1 . 1 18 18 GLU HG2 H 1 1.994 0.000 . 9 . . . . A 18 GLU HG2 . 30133 1 225 . 1 . 1 18 18 GLU HG3 H 1 1.951 0.000 . 9 . . . . A 18 GLU HG3 . 30133 1 226 . 1 . 1 18 18 GLU C C 13 177.918 0.000 . 9 . . . . A 18 GLU C . 30133 1 227 . 1 . 1 18 18 GLU CA C 13 58.730 0.521 . 9 . . . . A 18 GLU CA . 30133 1 228 . 1 . 1 18 18 GLU CB C 13 31.849 0.275 . 9 . . . . A 18 GLU CB . 30133 1 229 . 1 . 1 18 18 GLU CG C 13 35.372 0.004 . 9 . . . . A 18 GLU CG . 30133 1 230 . 1 . 1 18 18 GLU N N 15 120.398 0.001 . 9 . . . . A 18 GLU N . 30133 1 231 . 1 . 1 19 19 ARG H H 1 6.693 1.610 . 9 . . . . A 19 ARG H . 30133 1 232 . 1 . 1 19 19 ARG HA H 1 4.261 0.000 . 9 . . . . A 19 ARG HA . 30133 1 233 . 1 . 1 19 19 ARG HB2 H 1 1.884 0.112 . 9 . . . . A 19 ARG HB2 . 30133 1 234 . 1 . 1 19 19 ARG HB3 H 1 1.815 0.092 . 9 . . . . A 19 ARG HB3 . 30133 1 235 . 1 . 1 19 19 ARG HG2 H 1 1.423 0.000 . 9 . . . . A 19 ARG HG2 . 30133 1 236 . 1 . 1 19 19 ARG HG3 H 1 1.361 0.000 . 9 . . . . A 19 ARG HG3 . 30133 1 237 . 1 . 1 19 19 ARG HD2 H 1 3.573 0.000 . 9 . . . . A 19 ARG HD2 . 30133 1 238 . 1 . 1 19 19 ARG HD3 H 1 3.041 0.000 . 9 . . . . A 19 ARG HD3 . 30133 1 239 . 1 . 1 19 19 ARG C C 13 174.948 0.000 . 9 . . . . A 19 ARG C . 30133 1 240 . 1 . 1 19 19 ARG CA C 13 58.267 0.178 . 9 . . . . A 19 ARG CA . 30133 1 241 . 1 . 1 19 19 ARG CB C 13 32.657 0.039 . 9 . . . . A 19 ARG CB . 30133 1 242 . 1 . 1 19 19 ARG CG C 13 32.468 0.015 . 9 . . . . A 19 ARG CG . 30133 1 243 . 1 . 1 19 19 ARG CD C 13 49.088 0.497 . 9 . . . . A 19 ARG CD . 30133 1 244 . 1 . 1 19 19 ARG N N 15 118.963 0.015 . 9 . . . . A 19 ARG N . 30133 1 245 . 1 . 1 20 20 ASN H H 1 8.111 1.398 . 9 . . . . A 20 ASN H . 30133 1 246 . 1 . 1 20 20 ASN HA H 1 5.261 0.000 . 9 . . . . A 20 ASN HA . 30133 1 247 . 1 . 1 20 20 ASN HB2 H 1 3.753 0.000 . 9 . . . . A 20 ASN HB2 . 30133 1 248 . 1 . 1 20 20 ASN HB3 H 1 3.714 0.000 . 9 . . . . A 20 ASN HB3 . 30133 1 249 . 1 . 1 20 20 ASN C C 13 174.487 0.000 . 9 . . . . A 20 ASN C . 30133 1 250 . 1 . 1 20 20 ASN CA C 13 60.791 0.604 . 9 . . . . A 20 ASN CA . 30133 1 251 . 1 . 1 20 20 ASN CB C 13 36.608 0.725 . 9 . . . . A 20 ASN CB . 30133 1 252 . 1 . 1 20 20 ASN N N 15 123.614 0.000 . 9 . . . . A 20 ASN N . 30133 1 253 . 1 . 1 21 21 LEU H H 1 7.645 1.983 . 9 . . . . A 21 LEU H . 30133 1 254 . 1 . 1 21 21 LEU HB2 H 1 1.682 0.003 . 9 . . . . A 21 LEU HB2 . 30133 1 255 . 1 . 1 21 21 LEU CA C 13 60.872 0.015 . 9 . . . . A 21 LEU CA . 30133 1 256 . 1 . 1 21 21 LEU CB C 13 41.620 0.002 . 9 . . . . A 21 LEU CB . 30133 1 257 . 1 . 1 21 21 LEU N N 15 123.885 0.000 . 9 . . . . A 21 LEU N . 30133 1 258 . 1 . 1 22 22 PRO HA H 1 4.949 0.000 . 9 . . . . A 22 PRO HA . 30133 1 259 . 1 . 1 22 22 PRO HB2 H 1 2.893 0.000 . 9 . . . . A 22 PRO HB2 . 30133 1 260 . 1 . 1 22 22 PRO HB3 H 1 2.854 0.000 . 9 . . . . A 22 PRO HB3 . 30133 1 261 . 1 . 1 22 22 PRO HG2 H 1 2.572 0.000 . 9 . . . . A 22 PRO HG2 . 30133 1 262 . 1 . 1 22 22 PRO HG3 H 1 1.603 0.000 . 9 . . . . A 22 PRO HG3 . 30133 1 263 . 1 . 1 22 22 PRO HD2 H 1 3.432 0.000 . 9 . . . . A 22 PRO HD2 . 30133 1 264 . 1 . 1 22 22 PRO HD3 H 1 3.393 0.000 . 9 . . . . A 22 PRO HD3 . 30133 1 265 . 1 . 1 22 22 PRO C C 13 175.059 0.000 . 9 . . . . A 22 PRO C . 30133 1 266 . 1 . 1 22 22 PRO CA C 13 55.217 0.072 . 9 . . . . A 22 PRO CA . 30133 1 267 . 1 . 1 22 22 PRO CB C 13 31.867 0.034 . 9 . . . . A 22 PRO CB . 30133 1 268 . 1 . 1 22 22 PRO CG C 13 25.088 0.005 . 9 . . . . A 22 PRO CG . 30133 1 269 . 1 . 1 22 22 PRO CD C 13 52.787 0.094 . 9 . . . . A 22 PRO CD . 30133 1 270 . 1 . 1 23 23 LEU H H 1 7.555 2.555 . 9 . . . . A 23 LEU H . 30133 1 271 . 1 . 1 23 23 LEU HA H 1 3.401 0.000 . 9 . . . . A 23 LEU HA . 30133 1 272 . 1 . 1 23 23 LEU HB2 H 1 2.705 0.000 . 9 . . . . A 23 LEU HB2 . 30133 1 273 . 1 . 1 23 23 LEU HB3 H 1 2.619 0.000 . 9 . . . . A 23 LEU HB3 . 30133 1 274 . 1 . 1 23 23 LEU HG H 1 1.118 0.692 . 9 . . . . A 23 LEU HG . 30133 1 275 . 1 . 1 23 23 LEU HD11 H 1 1.431 0.000 . 9 . . . . A 23 LEU HD11 . 30133 1 276 . 1 . 1 23 23 LEU HD12 H 1 1.431 0.000 . 9 . . . . A 23 LEU HD12 . 30133 1 277 . 1 . 1 23 23 LEU HD13 H 1 1.431 0.000 . 9 . . . . A 23 LEU HD13 . 30133 1 278 . 1 . 1 23 23 LEU HD21 H 1 1.306 0.000 . 9 . . . . A 23 LEU HD21 . 30133 1 279 . 1 . 1 23 23 LEU HD22 H 1 1.306 0.000 . 9 . . . . A 23 LEU HD22 . 30133 1 280 . 1 . 1 23 23 LEU HD23 H 1 1.306 0.000 . 9 . . . . A 23 LEU HD23 . 30133 1 281 . 1 . 1 23 23 LEU C C 13 176.393 0.000 . 9 . . . . A 23 LEU C . 30133 1 282 . 1 . 1 23 23 LEU CA C 13 54.407 1.072 . 9 . . . . A 23 LEU CA . 30133 1 283 . 1 . 1 23 23 LEU CB C 13 41.135 0.408 . 9 . . . . A 23 LEU CB . 30133 1 284 . 1 . 1 23 23 LEU CG C 13 20.356 0.015 . 9 . . . . A 23 LEU CG . 30133 1 285 . 1 . 1 23 23 LEU CD1 C 13 17.603 0.017 . 9 . . . . A 23 LEU CD1 . 30133 1 286 . 1 . 1 23 23 LEU CD2 C 13 17.448 0.021 . 9 . . . . A 23 LEU CD2 . 30133 1 287 . 1 . 1 23 23 LEU N N 15 120.388 0.002 . 9 . . . . A 23 LEU N . 30133 1 288 . 1 . 1 24 24 TRP H H 1 7.355 1.301 . 9 . . . . A 24 TRP H . 30133 1 289 . 1 . 1 24 24 TRP HA H 1 4.230 0.000 . 9 . . . . A 24 TRP HA . 30133 1 290 . 1 . 1 24 24 TRP HB2 H 1 2.815 0.334 . 9 . . . . A 24 TRP HB2 . 30133 1 291 . 1 . 1 24 24 TRP HB3 H 1 2.700 0.361 . 9 . . . . A 24 TRP HB3 . 30133 1 292 . 1 . 1 24 24 TRP C C 13 176.044 0.000 . 9 . . . . A 24 TRP C . 30133 1 293 . 1 . 1 24 24 TRP CA C 13 56.754 0.238 . 9 . . . . A 24 TRP CA . 30133 1 294 . 1 . 1 24 24 TRP CB C 13 30.361 0.182 . 9 . . . . A 24 TRP CB . 30133 1 295 . 1 . 1 24 24 TRP CD1 C 13 127.666 0.000 . 9 . . . . A 24 TRP CD1 . 30133 1 296 . 1 . 1 24 24 TRP CD2 C 13 126.914 0.000 . 9 . . . . A 24 TRP CD2 . 30133 1 297 . 1 . 1 24 24 TRP CE2 C 13 139.125 0.000 . 9 . . . . A 24 TRP CE2 . 30133 1 298 . 1 . 1 24 24 TRP N N 15 121.038 0.000 . 9 . . . . A 24 TRP N . 30133 1 299 . 1 . 1 25 25 ILE H H 1 7.528 2.217 . 9 . . . . A 25 ILE H . 30133 1 300 . 1 . 1 25 25 ILE HA H 1 4.448 0.000 . 9 . . . . A 25 ILE HA . 30133 1 301 . 1 . 1 25 25 ILE HB H 1 0.884 0.000 . 9 . . . . A 25 ILE HB . 30133 1 302 . 1 . 1 25 25 ILE HG12 H 1 0.618 0.000 . 9 . . . . A 25 ILE HG12 . 30133 1 303 . 1 . 1 25 25 ILE HG13 H 1 0.618 0.000 . 9 . . . . A 25 ILE HG13 . 30133 1 304 . 1 . 1 25 25 ILE HG21 H 1 0.454 0.000 . 9 . . . . A 25 ILE HG21 . 30133 1 305 . 1 . 1 25 25 ILE HG22 H 1 0.454 0.000 . 9 . . . . A 25 ILE HG22 . 30133 1 306 . 1 . 1 25 25 ILE HG23 H 1 0.454 0.000 . 9 . . . . A 25 ILE HG23 . 30133 1 307 . 1 . 1 25 25 ILE HD11 H 1 0.251 0.000 . 9 . . . . A 25 ILE HD11 . 30133 1 308 . 1 . 1 25 25 ILE HD12 H 1 0.251 0.000 . 9 . . . . A 25 ILE HD12 . 30133 1 309 . 1 . 1 25 25 ILE HD13 H 1 0.251 0.000 . 9 . . . . A 25 ILE HD13 . 30133 1 310 . 1 . 1 25 25 ILE C C 13 174.932 0.000 . 9 . . . . A 25 ILE C . 30133 1 311 . 1 . 1 25 25 ILE CA C 13 60.358 0.265 . 9 . . . . A 25 ILE CA . 30133 1 312 . 1 . 1 25 25 ILE CB C 13 38.212 0.867 . 9 . . . . A 25 ILE CB . 30133 1 313 . 1 . 1 25 25 ILE CG1 C 13 29.460 0.102 . 9 . . . . A 25 ILE CG1 . 30133 1 314 . 1 . 1 25 25 ILE CG2 C 13 18.743 0.013 . 9 . . . . A 25 ILE CG2 . 30133 1 315 . 1 . 1 25 25 ILE CD1 C 13 18.430 0.050 . 9 . . . . A 25 ILE CD1 . 30133 1 316 . 1 . 1 25 25 ILE N N 15 122.055 0.000 . 9 . . . . A 25 ILE N . 30133 1 317 . 1 . 1 26 26 GLY H H 1 8.285 0.670 . 9 . . . . A 26 GLY H . 30133 1 318 . 1 . 1 26 26 GLY HA2 H 1 4.003 0.000 . 9 . . . . A 26 GLY HA2 . 30133 1 319 . 1 . 1 26 26 GLY HA3 H 1 3.768 0.000 . 9 . . . . A 26 GLY HA3 . 30133 1 320 . 1 . 1 26 26 GLY C C 13 175.520 0.000 . 9 . . . . A 26 GLY C . 30133 1 321 . 1 . 1 26 26 GLY CA C 13 44.181 0.072 . 9 . . . . A 26 GLY CA . 30133 1 322 . 1 . 1 26 26 GLY N N 15 115.142 0.000 . 9 . . . . A 26 GLY N . 30133 1 323 . 1 . 1 27 27 GLY H H 1 8.411 1.412 . 9 . . . . A 27 GLY H . 30133 1 324 . 1 . 1 27 27 GLY HA2 H 1 4.011 0.000 . 9 . . . . A 27 GLY HA2 . 30133 1 325 . 1 . 1 27 27 GLY HA3 H 1 4.151 0.000 . 9 . . . . A 27 GLY HA3 . 30133 1 326 . 1 . 1 27 27 GLY C C 13 174.964 0.000 . 9 . . . . A 27 GLY C . 30133 1 327 . 1 . 1 27 27 GLY CA C 13 46.592 0.104 . 9 . . . . A 27 GLY CA . 30133 1 328 . 1 . 1 27 27 GLY N N 15 107.904 0.000 . 9 . . . . A 27 GLY N . 30133 1 329 . 1 . 1 28 28 GLY H H 1 8.274 1.254 . 9 . . . . A 28 GLY H . 30133 1 330 . 1 . 1 28 28 GLY HA2 H 1 3.729 0.000 . 9 . . . . A 28 GLY HA2 . 30133 1 331 . 1 . 1 28 28 GLY HA3 H 1 3.694 0.000 . 9 . . . . A 28 GLY HA3 . 30133 1 332 . 1 . 1 28 28 GLY C C 13 174.360 0.000 . 9 . . . . A 28 GLY C . 30133 1 333 . 1 . 1 28 28 GLY CA C 13 47.245 0.555 . 9 . . . . A 28 GLY CA . 30133 1 334 . 1 . 1 28 28 GLY N N 15 110.544 0.000 . 9 . . . . A 28 GLY N . 30133 1 335 . 1 . 1 29 29 TRP H H 1 8.181 1.331 . 9 . . . . A 29 TRP H . 30133 1 336 . 1 . 1 29 29 TRP HA H 1 5.105 0.000 . 9 . . . . A 29 TRP HA . 30133 1 337 . 1 . 1 29 29 TRP HB2 H 1 3.843 0.000 . 9 . . . . A 29 TRP HB2 . 30133 1 338 . 1 . 1 29 29 TRP HB3 H 1 2.862 0.000 . 9 . . . . A 29 TRP HB3 . 30133 1 339 . 1 . 1 29 29 TRP C C 13 175.663 0.000 . 9 . . . . A 29 TRP C . 30133 1 340 . 1 . 1 29 29 TRP CA C 13 59.240 3.541 . 9 . . . . A 29 TRP CA . 30133 1 341 . 1 . 1 29 29 TRP CB C 13 40.320 0.750 . 9 . . . . A 29 TRP CB . 30133 1 342 . 1 . 1 29 29 TRP CD1 C 13 127.732 0.000 . 9 . . . . A 29 TRP CD1 . 30133 1 343 . 1 . 1 29 29 TRP CD2 C 13 127.637 0.000 . 9 . . . . A 29 TRP CD2 . 30133 1 344 . 1 . 1 29 29 TRP CE2 C 13 136.472 0.000 . 9 . . . . A 29 TRP CE2 . 30133 1 345 . 1 . 1 29 29 TRP N N 15 116.682 26.275 . 9 . . . . A 29 TRP N . 30133 1 346 . 1 . 1 30 30 ALA H H 1 8.555 1.881 . 9 . . . . A 30 ALA H . 30133 1 347 . 1 . 1 30 30 ALA HA H 1 4.132 0.000 . 9 . . . . A 30 ALA HA . 30133 1 348 . 1 . 1 30 30 ALA HB1 H 1 1.498 0.000 . 9 . . . . A 30 ALA HB1 . 30133 1 349 . 1 . 1 30 30 ALA HB2 H 1 1.498 0.000 . 9 . . . . A 30 ALA HB2 . 30133 1 350 . 1 . 1 30 30 ALA HB3 H 1 1.498 0.000 . 9 . . . . A 30 ALA HB3 . 30133 1 351 . 1 . 1 30 30 ALA C C 13 180.968 0.000 . 9 . . . . A 30 ALA C . 30133 1 352 . 1 . 1 30 30 ALA CA C 13 54.896 0.251 . 9 . . . . A 30 ALA CA . 30133 1 353 . 1 . 1 30 30 ALA CB C 13 18.125 0.462 . 9 . . . . A 30 ALA CB . 30133 1 354 . 1 . 1 30 30 ALA N N 15 131.833 0.017 . 9 . . . . A 30 ALA N . 30133 1 355 . 1 . 1 31 31 ILE H H 1 6.413 2.227 . 9 . . . . A 31 ILE H . 30133 1 356 . 1 . 1 31 31 ILE HA H 1 3.862 0.000 . 9 . . . . A 31 ILE HA . 30133 1 357 . 1 . 1 31 31 ILE HB H 1 2.838 0.000 . 9 . . . . A 31 ILE HB . 30133 1 358 . 1 . 1 31 31 ILE HG12 H 1 1.814 0.000 . 9 . . . . A 31 ILE HG12 . 30133 1 359 . 1 . 1 31 31 ILE HG13 H 1 1.814 0.000 . 9 . . . . A 31 ILE HG13 . 30133 1 360 . 1 . 1 31 31 ILE HG21 H 1 1.103 0.000 . 9 . . . . A 31 ILE HG21 . 30133 1 361 . 1 . 1 31 31 ILE HG22 H 1 1.103 0.000 . 9 . . . . A 31 ILE HG22 . 30133 1 362 . 1 . 1 31 31 ILE HG23 H 1 1.103 0.000 . 9 . . . . A 31 ILE HG23 . 30133 1 363 . 1 . 1 31 31 ILE HD11 H 1 1.048 0.000 . 9 . . . . A 31 ILE HD11 . 30133 1 364 . 1 . 1 31 31 ILE HD12 H 1 1.048 0.000 . 9 . . . . A 31 ILE HD12 . 30133 1 365 . 1 . 1 31 31 ILE HD13 H 1 1.048 0.000 . 9 . . . . A 31 ILE HD13 . 30133 1 366 . 1 . 1 31 31 ILE C C 13 179.411 0.000 . 9 . . . . A 31 ILE C . 30133 1 367 . 1 . 1 31 31 ILE CA C 13 66.303 0.442 . 9 . . . . A 31 ILE CA . 30133 1 368 . 1 . 1 31 31 ILE CB C 13 38.828 0.232 . 9 . . . . A 31 ILE CB . 30133 1 369 . 1 . 1 31 31 ILE CG1 C 13 33.154 0.001 . 9 . . . . A 31 ILE CG1 . 30133 1 370 . 1 . 1 31 31 ILE CG2 C 13 19.588 0.001 . 9 . . . . A 31 ILE CG2 . 30133 1 371 . 1 . 1 31 31 ILE CD1 C 13 14.514 0.073 . 9 . . . . A 31 ILE CD1 . 30133 1 372 . 1 . 1 31 31 ILE N N 15 121.059 0.009 . 9 . . . . A 31 ILE N . 30133 1 373 . 1 . 1 32 32 ASP H H 1 7.856 1.086 . 9 . . . . A 32 ASP H . 30133 1 374 . 1 . 1 32 32 ASP HA H 1 4.104 0.000 . 9 . . . . A 32 ASP HA . 30133 1 375 . 1 . 1 32 32 ASP HB2 H 1 2.611 0.000 . 9 . . . . A 32 ASP HB2 . 30133 1 376 . 1 . 1 32 32 ASP HB3 H 1 2.572 0.000 . 9 . . . . A 32 ASP HB3 . 30133 1 377 . 1 . 1 32 32 ASP C C 13 176.441 0.000 . 9 . . . . A 32 ASP C . 30133 1 378 . 1 . 1 32 32 ASP CA C 13 54.745 0.128 . 9 . . . . A 32 ASP CA . 30133 1 379 . 1 . 1 32 32 ASP CB C 13 43.577 0.990 . 9 . . . . A 32 ASP CB . 30133 1 380 . 1 . 1 32 32 ASP N N 15 122.443 0.020 . 9 . . . . A 32 ASP N . 30133 1 381 . 1 . 1 33 33 ALA H H 1 7.431 1.794 . 9 . . . . A 33 ALA H . 30133 1 382 . 1 . 1 33 33 ALA HA H 1 4.175 0.000 . 9 . . . . A 33 ALA HA . 30133 1 383 . 1 . 1 33 33 ALA HB1 H 1 2.643 0.000 . 9 . . . . A 33 ALA HB1 . 30133 1 384 . 1 . 1 33 33 ALA HB2 H 1 2.643 0.000 . 9 . . . . A 33 ALA HB2 . 30133 1 385 . 1 . 1 33 33 ALA HB3 H 1 2.643 0.000 . 9 . . . . A 33 ALA HB3 . 30133 1 386 . 1 . 1 33 33 ALA C C 13 178.061 0.000 . 9 . . . . A 33 ALA C . 30133 1 387 . 1 . 1 33 33 ALA CA C 13 56.147 3.101 . 9 . . . . A 33 ALA CA . 30133 1 388 . 1 . 1 33 33 ALA CB C 13 18.875 0.408 . 9 . . . . A 33 ALA CB . 30133 1 389 . 1 . 1 33 33 ALA N N 15 124.962 0.000 . 9 . . . . A 33 ALA N . 30133 1 390 . 1 . 1 34 34 ARG H H 1 6.465 2.215 . 9 . . . . A 34 ARG H . 30133 1 391 . 1 . 1 34 34 ARG HA H 1 5.097 0.000 . 9 . . . . A 34 ARG HA . 30133 1 392 . 1 . 1 34 34 ARG HB2 H 1 1.861 0.057 . 9 . . . . A 34 ARG HB2 . 30133 1 393 . 1 . 1 34 34 ARG HB3 H 1 1.802 0.056 . 9 . . . . A 34 ARG HB3 . 30133 1 394 . 1 . 1 34 34 ARG HG2 H 1 0.610 0.000 . 9 . . . . A 34 ARG HG2 . 30133 1 395 . 1 . 1 34 34 ARG HG3 H 1 0.571 0.000 . 9 . . . . A 34 ARG HG3 . 30133 1 396 . 1 . 1 34 34 ARG HD2 H 1 2.354 0.257 . 9 . . . . A 34 ARG HD2 . 30133 1 397 . 1 . 1 34 34 ARG HD3 H 1 2.305 0.256 . 9 . . . . A 34 ARG HD3 . 30133 1 398 . 1 . 1 34 34 ARG C C 13 177.346 0.000 . 9 . . . . A 34 ARG C . 30133 1 399 . 1 . 1 34 34 ARG CA C 13 56.913 1.780 . 9 . . . . A 34 ARG CA . 30133 1 400 . 1 . 1 34 34 ARG CB C 13 32.261 0.110 . 9 . . . . A 34 ARG CB . 30133 1 401 . 1 . 1 34 34 ARG CG C 13 22.221 0.003 . 9 . . . . A 34 ARG CG . 30133 1 402 . 1 . 1 34 34 ARG CD C 13 34.020 0.024 . 9 . . . . A 34 ARG CD . 30133 1 403 . 1 . 1 34 34 ARG N N 15 118.180 0.000 . 9 . . . . A 34 ARG N . 30133 1 404 . 1 . 1 35 35 LEU H H 1 7.095 1.988 . 9 . . . . A 35 LEU H . 30133 1 405 . 1 . 1 35 35 LEU HA H 1 4.331 0.000 . 9 . . . . A 35 LEU HA . 30133 1 406 . 1 . 1 35 35 LEU HB2 H 1 2.916 0.000 . 9 . . . . A 35 LEU HB2 . 30133 1 407 . 1 . 1 35 35 LEU HB3 H 1 2.877 0.000 . 9 . . . . A 35 LEU HB3 . 30133 1 408 . 1 . 1 35 35 LEU HG H 1 3.041 0.000 . 9 . . . . A 35 LEU HG . 30133 1 409 . 1 . 1 35 35 LEU HD11 H 1 1.095 0.000 . 9 . . . . A 35 LEU HD11 . 30133 1 410 . 1 . 1 35 35 LEU HD12 H 1 1.095 0.000 . 9 . . . . A 35 LEU HD12 . 30133 1 411 . 1 . 1 35 35 LEU HD13 H 1 1.095 0.000 . 9 . . . . A 35 LEU HD13 . 30133 1 412 . 1 . 1 35 35 LEU HD21 H 1 1.056 0.000 . 9 . . . . A 35 LEU HD21 . 30133 1 413 . 1 . 1 35 35 LEU HD22 H 1 1.056 0.000 . 9 . . . . A 35 LEU HD22 . 30133 1 414 . 1 . 1 35 35 LEU HD23 H 1 1.056 0.000 . 9 . . . . A 35 LEU HD23 . 30133 1 415 . 1 . 1 35 35 LEU C C 13 175.281 0.000 . 9 . . . . A 35 LEU C . 30133 1 416 . 1 . 1 35 35 LEU CA C 13 58.129 0.026 . 9 . . . . A 35 LEU CA . 30133 1 417 . 1 . 1 35 35 LEU CB C 13 38.951 0.463 . 9 . . . . A 35 LEU CB . 30133 1 418 . 1 . 1 35 35 LEU CG C 13 32.213 0.013 . 9 . . . . A 35 LEU CG . 30133 1 419 . 1 . 1 35 35 LEU CD1 C 13 31.510 0.340 . 9 . . . . A 35 LEU CD1 . 30133 1 420 . 1 . 1 35 35 LEU CD2 C 13 31.339 0.130 . 9 . . . . A 35 LEU CD2 . 30133 1 421 . 1 . 1 35 35 LEU N N 15 121.713 0.002 . 9 . . . . A 35 LEU N . 30133 1 422 . 1 . 1 36 36 GLY H H 1 7.831 0.693 . 9 . . . . A 36 GLY H . 30133 1 423 . 1 . 1 36 36 GLY HA2 H 1 4.464 0.000 . 9 . . . . A 36 GLY HA2 . 30133 1 424 . 1 . 1 36 36 GLY HA3 H 1 4.409 0.000 . 9 . . . . A 36 GLY HA3 . 30133 1 425 . 1 . 1 36 36 GLY C C 13 175.154 0.000 . 9 . . . . A 36 GLY C . 30133 1 426 . 1 . 1 36 36 GLY CA C 13 45.619 0.743 . 9 . . . . A 36 GLY CA . 30133 1 427 . 1 . 1 36 36 GLY N N 15 108.741 0.010 . 9 . . . . A 36 GLY N . 30133 1 428 . 1 . 1 37 37 ARG H H 1 7.563 1.685 . 9 . . . . A 37 ARG H . 30133 1 429 . 1 . 1 37 37 ARG CB C 13 30.969 0.005 . 9 . . . . A 37 ARG CB . 30133 1 430 . 1 . 1 37 37 ARG N N 15 117.778 0.000 . 9 . . . . A 37 ARG N . 30133 1 431 . 1 . 1 38 38 VAL H H 1 0.715 0.071 . 9 . . . . A 38 VAL H . 30133 1 432 . 1 . 1 38 38 VAL HA H 1 4.550 0.000 . 9 . . . . A 38 VAL HA . 30133 1 433 . 1 . 1 38 38 VAL HB H 1 2.010 0.000 . 9 . . . . A 38 VAL HB . 30133 1 434 . 1 . 1 38 38 VAL HG11 H 1 1.447 0.000 . 9 . . . . A 38 VAL HG11 . 30133 1 435 . 1 . 1 38 38 VAL HG12 H 1 1.447 0.000 . 9 . . . . A 38 VAL HG12 . 30133 1 436 . 1 . 1 38 38 VAL HG13 H 1 1.447 0.000 . 9 . . . . A 38 VAL HG13 . 30133 1 437 . 1 . 1 38 38 VAL HG21 H 1 1.392 0.000 . 9 . . . . A 38 VAL HG21 . 30133 1 438 . 1 . 1 38 38 VAL HG22 H 1 1.392 0.000 . 9 . . . . A 38 VAL HG22 . 30133 1 439 . 1 . 1 38 38 VAL HG23 H 1 1.392 0.000 . 9 . . . . A 38 VAL HG23 . 30133 1 440 . 1 . 1 38 38 VAL C C 13 178.585 0.000 . 9 . . . . A 38 VAL C . 30133 1 441 . 1 . 1 38 38 VAL CA C 13 62.491 0.016 . 9 . . . . A 38 VAL CA . 30133 1 442 . 1 . 1 38 38 VAL CB C 13 32.740 0.032 . 9 . . . . A 38 VAL CB . 30133 1 443 . 1 . 1 38 38 VAL CG1 C 13 27.795 0.052 . 9 . . . . A 38 VAL CG1 . 30133 1 444 . 1 . 1 38 38 VAL CG2 C 13 18.159 0.031 . 9 . . . . A 38 VAL CG2 . 30133 1 445 . 1 . 1 39 39 THR H H 1 8.427 1.287 . 9 . . . . A 39 THR H . 30133 1 446 . 1 . 1 39 39 THR CA C 13 66.779 0.064 . 9 . . . . A 39 THR CA . 30133 1 447 . 1 . 1 39 39 THR CB C 13 68.815 0.003 . 9 . . . . A 39 THR CB . 30133 1 448 . 1 . 1 39 39 THR N N 15 119.851 0.000 . 9 . . . . A 39 THR N . 30133 1 449 . 1 . 1 40 40 ARG H H 1 2.336 0.904 . 9 . . . . A 40 ARG H . 30133 1 450 . 1 . 1 40 40 ARG HA H 1 4.390 0.000 . 9 . . . . A 40 ARG HA . 30133 1 451 . 1 . 1 40 40 ARG HB2 H 1 1.415 0.000 . 9 . . . . A 40 ARG HB2 . 30133 1 452 . 1 . 1 40 40 ARG HB3 H 1 1.365 0.000 . 9 . . . . A 40 ARG HB3 . 30133 1 453 . 1 . 1 40 40 ARG HG2 H 1 0.212 0.000 . 9 . . . . A 40 ARG HG2 . 30133 1 454 . 1 . 1 40 40 ARG HG3 H 1 0.176 0.000 . 9 . . . . A 40 ARG HG3 . 30133 1 455 . 1 . 1 40 40 ARG HD2 H 1 3.620 0.000 . 9 . . . . A 40 ARG HD2 . 30133 1 456 . 1 . 1 40 40 ARG HD3 H 1 3.581 0.000 . 9 . . . . A 40 ARG HD3 . 30133 1 457 . 1 . 1 40 40 ARG C C 13 173.630 0.000 . 9 . . . . A 40 ARG C . 30133 1 458 . 1 . 1 40 40 ARG CA C 13 54.750 0.027 . 9 . . . . A 40 ARG CA . 30133 1 459 . 1 . 1 40 40 ARG CB C 13 31.300 0.128 . 9 . . . . A 40 ARG CB . 30133 1 460 . 1 . 1 40 40 ARG CG C 13 23.555 0.028 . 9 . . . . A 40 ARG CG . 30133 1 461 . 1 . 1 40 40 ARG CD C 13 43.769 0.165 . 9 . . . . A 40 ARG CD . 30133 1 462 . 1 . 1 41 41 LYS H H 1 7.112 2.063 . 9 . . . . A 41 LYS H . 30133 1 463 . 1 . 1 41 41 LYS HA H 1 3.917 0.000 . 9 . . . . A 41 LYS HA . 30133 1 464 . 1 . 1 41 41 LYS HB2 H 1 1.881 0.205 . 9 . . . . A 41 LYS HB2 . 30133 1 465 . 1 . 1 41 41 LYS HB3 H 1 1.793 0.244 . 9 . . . . A 41 LYS HB3 . 30133 1 466 . 1 . 1 41 41 LYS HG2 H 1 1.630 0.000 . 9 . . . . A 41 LYS HG2 . 30133 1 467 . 1 . 1 41 41 LYS HG3 H 1 1.419 0.000 . 9 . . . . A 41 LYS HG3 . 30133 1 468 . 1 . 1 41 41 LYS HD2 H 1 0.847 0.351 . 9 . . . . A 41 LYS HD2 . 30133 1 469 . 1 . 1 41 41 LYS HD3 H 1 0.828 0.432 . 9 . . . . A 41 LYS HD3 . 30133 1 470 . 1 . 1 41 41 LYS C C 13 176.616 0.000 . 9 . . . . A 41 LYS C . 30133 1 471 . 1 . 1 41 41 LYS CA C 13 56.792 0.620 . 9 . . . . A 41 LYS CA . 30133 1 472 . 1 . 1 41 41 LYS CB C 13 32.086 2.034 . 9 . . . . A 41 LYS CB . 30133 1 473 . 1 . 1 41 41 LYS CG C 13 17.221 0.047 . 9 . . . . A 41 LYS CG . 30133 1 474 . 1 . 1 41 41 LYS CD C 13 23.004 0.033 . 9 . . . . A 41 LYS CD . 30133 1 475 . 1 . 1 41 41 LYS CE C 13 36.234 0.000 . 9 . . . . A 41 LYS CE . 30133 1 476 . 1 . 1 41 41 LYS N N 15 118.248 0.000 . 9 . . . . A 41 LYS N . 30133 1 477 . 1 . 1 42 42 HIS H H 1 7.267 1.261 . 9 . . . . A 42 HIS H . 30133 1 478 . 1 . 1 42 42 HIS HA H 1 4.112 0.000 . 9 . . . . A 42 HIS HA . 30133 1 479 . 1 . 1 42 42 HIS HB2 H 1 2.338 0.000 . 9 . . . . A 42 HIS HB2 . 30133 1 480 . 1 . 1 42 42 HIS HB3 H 1 2.260 0.000 . 9 . . . . A 42 HIS HB3 . 30133 1 481 . 1 . 1 42 42 HIS C C 13 178.045 0.000 . 9 . . . . A 42 HIS C . 30133 1 482 . 1 . 1 42 42 HIS CA C 13 57.254 1.708 . 9 . . . . A 42 HIS CA . 30133 1 483 . 1 . 1 42 42 HIS CB C 13 31.588 0.436 . 9 . . . . A 42 HIS CB . 30133 1 484 . 1 . 1 42 42 HIS CG C 13 131.072 0.027 . 9 . . . . A 42 HIS CG . 30133 1 485 . 1 . 1 42 42 HIS CD2 C 13 119.875 0.009 . 9 . . . . A 42 HIS CD2 . 30133 1 486 . 1 . 1 42 42 HIS CE1 C 13 139.136 0.000 . 9 . . . . A 42 HIS CE1 . 30133 1 487 . 1 . 1 42 42 HIS N N 15 121.412 0.000 . 9 . . . . A 42 HIS N . 30133 1 488 . 1 . 1 43 43 ASP H H 1 7.298 1.028 . 9 . . . . A 43 ASP H . 30133 1 489 . 1 . 1 43 43 ASP HA H 1 4.167 0.000 . 9 . . . . A 43 ASP HA . 30133 1 490 . 1 . 1 43 43 ASP HB2 H 1 2.793 0.221 . 9 . . . . A 43 ASP HB2 . 30133 1 491 . 1 . 1 43 43 ASP HB3 H 1 2.818 0.132 . 9 . . . . A 43 ASP HB3 . 30133 1 492 . 1 . 1 43 43 ASP C C 13 177.918 0.000 . 9 . . . . A 43 ASP C . 30133 1 493 . 1 . 1 43 43 ASP CA C 13 59.747 0.742 . 9 . . . . A 43 ASP CA . 30133 1 494 . 1 . 1 43 43 ASP CB C 13 41.626 0.574 . 9 . . . . A 43 ASP CB . 30133 1 495 . 1 . 1 43 43 ASP N N 15 118.254 0.000 . 9 . . . . A 43 ASP N . 30133 1 496 . 1 . 1 44 44 ASP H H 1 7.849 1.404 . 9 . . . . A 44 ASP H . 30133 1 497 . 1 . 1 44 44 ASP HA H 1 3.995 0.000 . 9 . . . . A 44 ASP HA . 30133 1 498 . 1 . 1 44 44 ASP HB2 H 1 1.494 0.000 . 9 . . . . A 44 ASP HB2 . 30133 1 499 . 1 . 1 44 44 ASP HB3 H 1 1.408 0.000 . 9 . . . . A 44 ASP HB3 . 30133 1 500 . 1 . 1 44 44 ASP C C 13 173.804 0.000 . 9 . . . . A 44 ASP C . 30133 1 501 . 1 . 1 44 44 ASP CA C 13 54.994 0.106 . 9 . . . . A 44 ASP CA . 30133 1 502 . 1 . 1 44 44 ASP CB C 13 42.838 0.259 . 9 . . . . A 44 ASP CB . 30133 1 503 . 1 . 1 44 44 ASP N N 15 118.090 0.000 . 9 . . . . A 44 ASP N . 30133 1 504 . 1 . 1 45 45 ILE H H 1 6.665 2.911 . 9 . . . . A 45 ILE H . 30133 1 505 . 1 . 1 45 45 ILE HA H 1 4.448 0.000 . 9 . . . . A 45 ILE HA . 30133 1 506 . 1 . 1 45 45 ILE HB H 1 2.611 0.000 . 9 . . . . A 45 ILE HB . 30133 1 507 . 1 . 1 45 45 ILE HG12 H 1 2.213 0.000 . 9 . . . . A 45 ILE HG12 . 30133 1 508 . 1 . 1 45 45 ILE HG13 H 1 2.213 0.000 . 9 . . . . A 45 ILE HG13 . 30133 1 509 . 1 . 1 45 45 ILE HG21 H 1 0.618 0.000 . 9 . . . . A 45 ILE HG21 . 30133 1 510 . 1 . 1 45 45 ILE HG22 H 1 0.618 0.000 . 9 . . . . A 45 ILE HG22 . 30133 1 511 . 1 . 1 45 45 ILE HG23 H 1 0.618 0.000 . 9 . . . . A 45 ILE HG23 . 30133 1 512 . 1 . 1 45 45 ILE HD11 H 1 0.571 0.000 . 9 . . . . A 45 ILE HD11 . 30133 1 513 . 1 . 1 45 45 ILE HD12 H 1 0.571 0.000 . 9 . . . . A 45 ILE HD12 . 30133 1 514 . 1 . 1 45 45 ILE HD13 H 1 0.571 0.000 . 9 . . . . A 45 ILE HD13 . 30133 1 515 . 1 . 1 45 45 ILE C C 13 179.300 0.000 . 9 . . . . A 45 ILE C . 30133 1 516 . 1 . 1 45 45 ILE CA C 13 65.410 0.422 . 9 . . . . A 45 ILE CA . 30133 1 517 . 1 . 1 45 45 ILE CB C 13 39.517 1.603 . 9 . . . . A 45 ILE CB . 30133 1 518 . 1 . 1 45 45 ILE CG1 C 13 29.810 0.025 . 9 . . . . A 45 ILE CG1 . 30133 1 519 . 1 . 1 45 45 ILE CG2 C 13 16.357 0.023 . 9 . . . . A 45 ILE CG2 . 30133 1 520 . 1 . 1 45 45 ILE CD1 C 13 14.692 0.067 . 9 . . . . A 45 ILE CD1 . 30133 1 521 . 1 . 1 45 45 ILE N N 15 121.018 0.000 . 9 . . . . A 45 ILE N . 30133 1 522 . 1 . 1 46 46 ASP H H 1 7.863 1.311 . 9 . . . . A 46 ASP H . 30133 1 523 . 1 . 1 46 46 ASP HA H 1 5.285 0.000 . 9 . . . . A 46 ASP HA . 30133 1 524 . 1 . 1 46 46 ASP HB2 H 1 3.120 0.000 . 9 . . . . A 46 ASP HB2 . 30133 1 525 . 1 . 1 46 46 ASP HB3 H 1 3.026 0.000 . 9 . . . . A 46 ASP HB3 . 30133 1 526 . 1 . 1 46 46 ASP C C 13 175.552 0.000 . 9 . . . . A 46 ASP C . 30133 1 527 . 1 . 1 46 46 ASP CA C 13 57.778 0.108 . 9 . . . . A 46 ASP CA . 30133 1 528 . 1 . 1 46 46 ASP CB C 13 40.114 0.523 . 9 . . . . A 46 ASP CB . 30133 1 529 . 1 . 1 46 46 ASP N N 15 117.847 0.112 . 9 . . . . A 46 ASP N . 30133 1 530 . 1 . 1 47 47 LEU H H 1 6.253 2.906 . 9 . . . . A 47 LEU H . 30133 1 531 . 1 . 1 47 47 LEU HA H 1 4.960 0.000 . 9 . . . . A 47 LEU HA . 30133 1 532 . 1 . 1 47 47 LEU HB2 H 1 2.838 0.000 . 9 . . . . A 47 LEU HB2 . 30133 1 533 . 1 . 1 47 47 LEU HB3 H 1 2.666 0.000 . 9 . . . . A 47 LEU HB3 . 30133 1 534 . 1 . 1 47 47 LEU HG H 1 2.088 0.000 . 9 . . . . A 47 LEU HG . 30133 1 535 . 1 . 1 47 47 LEU HD11 H 1 0.954 0.000 . 9 . . . . A 47 LEU HD11 . 30133 1 536 . 1 . 1 47 47 LEU HD12 H 1 0.954 0.000 . 9 . . . . A 47 LEU HD12 . 30133 1 537 . 1 . 1 47 47 LEU HD13 H 1 0.954 0.000 . 9 . . . . A 47 LEU HD13 . 30133 1 538 . 1 . 1 47 47 LEU HD21 H 1 0.399 0.000 . 9 . . . . A 47 LEU HD21 . 30133 1 539 . 1 . 1 47 47 LEU HD22 H 1 0.399 0.000 . 9 . . . . A 47 LEU HD22 . 30133 1 540 . 1 . 1 47 47 LEU HD23 H 1 0.399 0.000 . 9 . . . . A 47 LEU HD23 . 30133 1 541 . 1 . 1 47 47 LEU C C 13 176.584 0.000 . 9 . . . . A 47 LEU C . 30133 1 542 . 1 . 1 47 47 LEU CA C 13 54.798 0.049 . 9 . . . . A 47 LEU CA . 30133 1 543 . 1 . 1 47 47 LEU CB C 13 42.065 0.470 . 9 . . . . A 47 LEU CB . 30133 1 544 . 1 . 1 47 47 LEU CG C 13 26.295 0.027 . 9 . . . . A 47 LEU CG . 30133 1 545 . 1 . 1 47 47 LEU CD1 C 13 22.704 0.091 . 9 . . . . A 47 LEU CD1 . 30133 1 546 . 1 . 1 47 47 LEU CD2 C 13 22.488 0.009 . 9 . . . . A 47 LEU CD2 . 30133 1 547 . 1 . 1 47 47 LEU N N 15 124.278 0.000 . 9 . . . . A 47 LEU N . 30133 1 548 . 1 . 1 48 48 THR H H 1 8.106 1.067 . 9 . . . . A 48 THR H . 30133 1 549 . 1 . 1 48 48 THR CA C 13 62.260 0.009 . 9 . . . . A 48 THR CA . 30133 1 550 . 1 . 1 48 48 THR CB C 13 69.523 0.013 . 9 . . . . A 48 THR CB . 30133 1 551 . 1 . 1 48 48 THR N N 15 114.543 0.013 . 9 . . . . A 48 THR N . 30133 1 552 . 1 . 1 49 49 PHE H H 1 6.796 0.231 . 9 . . . . A 49 PHE H . 30133 1 553 . 1 . 1 49 49 PHE CG C 13 131.800 0.000 . 9 . . . . A 49 PHE CG . 30133 1 554 . 1 . 1 49 49 PHE CD1 C 13 132.238 0.000 . 9 . . . . A 49 PHE CD1 . 30133 1 555 . 1 . 1 49 49 PHE CD2 C 13 133.032 0.000 . 9 . . . . A 49 PHE CD2 . 30133 1 556 . 1 . 1 49 49 PHE CE1 C 13 129.920 0.000 . 9 . . . . A 49 PHE CE1 . 30133 1 557 . 1 . 1 49 49 PHE CE2 C 13 130.895 0.000 . 9 . . . . A 49 PHE CE2 . 30133 1 558 . 1 . 1 49 49 PHE CZ C 13 123.350 0.000 . 9 . . . . A 49 PHE CZ . 30133 1 559 . 1 . 1 50 50 PRO HA H 1 4.601 0.000 . 9 . . . . A 50 PRO HA . 30133 1 560 . 1 . 1 50 50 PRO HB2 H 1 2.127 0.000 . 9 . . . . A 50 PRO HB2 . 30133 1 561 . 1 . 1 50 50 PRO HB3 H 1 1.580 0.000 . 9 . . . . A 50 PRO HB3 . 30133 1 562 . 1 . 1 50 50 PRO HG2 H 1 1.134 0.000 . 9 . . . . A 50 PRO HG2 . 30133 1 563 . 1 . 1 50 50 PRO HG3 H 1 1.091 0.000 . 9 . . . . A 50 PRO HG3 . 30133 1 564 . 1 . 1 50 50 PRO HD2 H 1 3.315 0.000 . 9 . . . . A 50 PRO HD2 . 30133 1 565 . 1 . 1 50 50 PRO HD3 H 1 3.268 0.000 . 9 . . . . A 50 PRO HD3 . 30133 1 566 . 1 . 1 50 50 PRO C C 13 178.442 0.000 . 9 . . . . A 50 PRO C . 30133 1 567 . 1 . 1 51 51 GLY H H 1 8.054 0.789 . 9 . . . . A 51 GLY H . 30133 1 568 . 1 . 1 51 51 GLY HA2 H 1 4.106 0.011 . 9 . . . . A 51 GLY HA2 . 30133 1 569 . 1 . 1 51 51 GLY HA3 H 1 4.024 0.055 . 9 . . . . A 51 GLY HA3 . 30133 1 570 . 1 . 1 51 51 GLY C C 13 174.074 0.000 . 9 . . . . A 51 GLY C . 30133 1 571 . 1 . 1 51 51 GLY CA C 13 46.248 0.030 . 9 . . . . A 51 GLY CA . 30133 1 572 . 1 . 1 51 51 GLY N N 15 109.094 0.000 . 9 . . . . A 51 GLY N . 30133 1 573 . 1 . 1 52 52 GLU H H 1 7.455 1.737 . 9 . . . . A 52 GLU H . 30133 1 574 . 1 . 1 52 52 GLU HA H 1 4.417 0.000 . 9 . . . . A 52 GLU HA . 30133 1 575 . 1 . 1 52 52 GLU HB2 H 1 2.041 0.000 . 9 . . . . A 52 GLU HB2 . 30133 1 576 . 1 . 1 52 52 GLU HB3 H 1 1.924 0.000 . 9 . . . . A 52 GLU HB3 . 30133 1 577 . 1 . 1 52 52 GLU HG2 H 1 2.322 0.000 . 9 . . . . A 52 GLU HG2 . 30133 1 578 . 1 . 1 52 52 GLU HG3 H 1 2.283 0.000 . 9 . . . . A 52 GLU HG3 . 30133 1 579 . 1 . 1 52 52 GLU C C 13 177.045 0.000 . 9 . . . . A 52 GLU C . 30133 1 580 . 1 . 1 52 52 GLU CA C 13 54.638 0.099 . 9 . . . . A 52 GLU CA . 30133 1 581 . 1 . 1 52 52 GLU CB C 13 32.510 0.274 . 9 . . . . A 52 GLU CB . 30133 1 582 . 1 . 1 52 52 GLU CG C 13 41.183 0.007 . 9 . . . . A 52 GLU CG . 30133 1 583 . 1 . 1 52 52 GLU N N 15 117.473 0.015 . 9 . . . . A 52 GLU N . 30133 1 584 . 1 . 1 53 53 ARG H H 1 7.596 2.083 . 9 . . . . A 53 ARG H . 30133 1 585 . 1 . 1 53 53 ARG HA H 1 3.854 0.000 . 9 . . . . A 53 ARG HA . 30133 1 586 . 1 . 1 53 53 ARG HB2 H 1 2.077 0.129 . 9 . . . . A 53 ARG HB2 . 30133 1 587 . 1 . 1 53 53 ARG HB3 H 1 2.003 0.088 . 9 . . . . A 53 ARG HB3 . 30133 1 588 . 1 . 1 53 53 ARG HG2 H 1 2.301 0.661 . 9 . . . . A 53 ARG HG2 . 30133 1 589 . 1 . 1 53 53 ARG HG3 H 1 2.233 0.698 . 9 . . . . A 53 ARG HG3 . 30133 1 590 . 1 . 1 53 53 ARG HD2 H 1 3.284 0.000 . 9 . . . . A 53 ARG HD2 . 30133 1 591 . 1 . 1 53 53 ARG HD3 H 1 3.237 0.000 . 9 . . . . A 53 ARG HD3 . 30133 1 592 . 1 . 1 53 53 ARG C C 13 176.600 0.000 . 9 . . . . A 53 ARG C . 30133 1 593 . 1 . 1 53 53 ARG CA C 13 56.923 0.128 . 9 . . . . A 53 ARG CA . 30133 1 594 . 1 . 1 53 53 ARG CB C 13 30.095 0.192 . 9 . . . . A 53 ARG CB . 30133 1 595 . 1 . 1 53 53 ARG CG C 13 27.604 0.035 . 9 . . . . A 53 ARG CG . 30133 1 596 . 1 . 1 53 53 ARG CD C 13 47.025 0.074 . 9 . . . . A 53 ARG CD . 30133 1 597 . 1 . 1 53 53 ARG N N 15 121.078 0.000 . 9 . . . . A 53 ARG N . 30133 1 598 . 1 . 1 54 54 ARG H H 1 7.842 1.655 . 9 . . . . A 54 ARG H . 30133 1 599 . 1 . 1 54 54 ARG HA H 1 5.316 0.000 . 9 . . . . A 54 ARG HA . 30133 1 600 . 1 . 1 54 54 ARG HB2 H 1 2.979 0.000 . 9 . . . . A 54 ARG HB2 . 30133 1 601 . 1 . 1 54 54 ARG HB3 H 1 2.369 0.000 . 9 . . . . A 54 ARG HB3 . 30133 1 602 . 1 . 1 54 54 ARG HG2 H 1 0.579 0.000 . 9 . . . . A 54 ARG HG2 . 30133 1 603 . 1 . 1 54 54 ARG HG3 H 1 0.266 0.000 . 9 . . . . A 54 ARG HG3 . 30133 1 604 . 1 . 1 54 54 ARG HD2 H 1 3.885 0.132 . 9 . . . . A 54 ARG HD2 . 30133 1 605 . 1 . 1 54 54 ARG HD3 H 1 3.828 0.141 . 9 . . . . A 54 ARG HD3 . 30133 1 606 . 1 . 1 54 54 ARG C C 13 177.632 0.000 . 9 . . . . A 54 ARG C . 30133 1 607 . 1 . 1 54 54 ARG CA C 13 60.599 0.126 . 9 . . . . A 54 ARG CA . 30133 1 608 . 1 . 1 54 54 ARG CB C 13 32.863 3.286 . 9 . . . . A 54 ARG CB . 30133 1 609 . 1 . 1 54 54 ARG CG C 13 30.483 0.049 . 9 . . . . A 54 ARG CG . 30133 1 610 . 1 . 1 54 54 ARG CD C 13 45.304 0.064 . 9 . . . . A 54 ARG CD . 30133 1 611 . 1 . 1 54 54 ARG N N 15 121.702 0.000 . 9 . . . . A 54 ARG N . 30133 1 612 . 1 . 1 55 55 GLY H H 1 8.847 1.016 . 9 . . . . A 55 GLY H . 30133 1 613 . 1 . 1 55 55 GLY HA2 H 1 3.315 0.000 . 9 . . . . A 55 GLY HA2 . 30133 1 614 . 1 . 1 55 55 GLY HA3 H 1 3.276 0.000 . 9 . . . . A 55 GLY HA3 . 30133 1 615 . 1 . 1 55 55 GLY C C 13 179.538 0.000 . 9 . . . . A 55 GLY C . 30133 1 616 . 1 . 1 55 55 GLY CA C 13 47.072 0.086 . 9 . . . . A 55 GLY CA . 30133 1 617 . 1 . 1 55 55 GLY N N 15 105.017 0.007 . 9 . . . . A 55 GLY N . 30133 1 618 . 1 . 1 56 56 GLU H H 1 6.815 1.776 . 9 . . . . A 56 GLU H . 30133 1 619 . 1 . 1 56 56 GLU HA H 1 4.304 0.000 . 9 . . . . A 56 GLU HA . 30133 1 620 . 1 . 1 56 56 GLU HB2 H 1 2.373 0.000 . 9 . . . . A 56 GLU HB2 . 30133 1 621 . 1 . 1 56 56 GLU HB3 H 1 2.123 0.000 . 9 . . . . A 56 GLU HB3 . 30133 1 622 . 1 . 1 56 56 GLU HG2 H 1 2.391 0.156 . 9 . . . . A 56 GLU HG2 . 30133 1 623 . 1 . 1 56 56 GLU HG3 H 1 2.323 0.108 . 9 . . . . A 56 GLU HG3 . 30133 1 624 . 1 . 1 56 56 GLU C C 13 176.584 0.000 . 9 . . . . A 56 GLU C . 30133 1 625 . 1 . 1 56 56 GLU CA C 13 58.176 0.026 . 9 . . . . A 56 GLU CA . 30133 1 626 . 1 . 1 56 56 GLU CB C 13 32.999 1.415 . 9 . . . . A 56 GLU CB . 30133 1 627 . 1 . 1 56 56 GLU CG C 13 36.401 0.012 . 9 . . . . A 56 GLU CG . 30133 1 628 . 1 . 1 56 56 GLU N N 15 121.008 0.000 . 9 . . . . A 56 GLU N . 30133 1 629 . 1 . 1 57 57 LEU H H 1 7.541 2.739 . 9 . . . . A 57 LEU H . 30133 1 630 . 1 . 1 57 57 LEU HA H 1 3.651 0.000 . 9 . . . . A 57 LEU HA . 30133 1 631 . 1 . 1 57 57 LEU HB2 H 1 2.213 0.000 . 9 . . . . A 57 LEU HB2 . 30133 1 632 . 1 . 1 57 57 LEU HB3 H 1 2.127 0.000 . 9 . . . . A 57 LEU HB3 . 30133 1 633 . 1 . 1 57 57 LEU HG H 1 2.565 0.000 . 9 . . . . A 57 LEU HG . 30133 1 634 . 1 . 1 57 57 LEU HD11 H 1 0.850 0.362 . 9 . . . . A 57 LEU HD11 . 30133 1 635 . 1 . 1 57 57 LEU HD12 H 1 0.850 0.362 . 9 . . . . A 57 LEU HD12 . 30133 1 636 . 1 . 1 57 57 LEU HD13 H 1 0.850 0.362 . 9 . . . . A 57 LEU HD13 . 30133 1 637 . 1 . 1 57 57 LEU HD21 H 1 0.775 0.314 . 9 . . . . A 57 LEU HD21 . 30133 1 638 . 1 . 1 57 57 LEU HD22 H 1 0.775 0.314 . 9 . . . . A 57 LEU HD22 . 30133 1 639 . 1 . 1 57 57 LEU HD23 H 1 0.775 0.314 . 9 . . . . A 57 LEU HD23 . 30133 1 640 . 1 . 1 57 57 LEU C C 13 175.996 0.000 . 9 . . . . A 57 LEU C . 30133 1 641 . 1 . 1 57 57 LEU CA C 13 59.048 0.183 . 9 . . . . A 57 LEU CA . 30133 1 642 . 1 . 1 57 57 LEU CB C 13 35.198 1.002 . 9 . . . . A 57 LEU CB . 30133 1 643 . 1 . 1 57 57 LEU CG C 13 27.023 0.001 . 9 . . . . A 57 LEU CG . 30133 1 644 . 1 . 1 57 57 LEU CD1 C 13 22.115 0.024 . 9 . . . . A 57 LEU CD1 . 30133 1 645 . 1 . 1 57 57 LEU CD2 C 13 22.087 0.042 . 9 . . . . A 57 LEU CD2 . 30133 1 646 . 1 . 1 57 57 LEU N N 15 122.132 0.007 . 9 . . . . A 57 LEU N . 30133 1 647 . 1 . 1 58 58 GLU H H 1 7.770 1.843 . 9 . . . . A 58 GLU H . 30133 1 648 . 1 . 1 58 58 GLU HA H 1 4.382 0.000 . 9 . . . . A 58 GLU HA . 30133 1 649 . 1 . 1 58 58 GLU HB2 H 1 2.076 0.000 . 9 . . . . A 58 GLU HB2 . 30133 1 650 . 1 . 1 58 58 GLU HB3 H 1 1.451 0.000 . 9 . . . . A 58 GLU HB3 . 30133 1 651 . 1 . 1 58 58 GLU HG2 H 1 2.529 0.000 . 9 . . . . A 58 GLU HG2 . 30133 1 652 . 1 . 1 58 58 GLU C C 13 177.219 0.000 . 9 . . . . A 58 GLU C . 30133 1 653 . 1 . 1 58 58 GLU CA C 13 58.940 0.141 . 9 . . . . A 58 GLU CA . 30133 1 654 . 1 . 1 58 58 GLU CB C 13 29.936 0.014 . 9 . . . . A 58 GLU CB . 30133 1 655 . 1 . 1 58 58 GLU CG C 13 35.889 0.059 . 9 . . . . A 58 GLU CG . 30133 1 656 . 1 . 1 58 58 GLU N N 15 122.856 0.017 . 9 . . . . A 58 GLU N . 30133 1 657 . 1 . 1 59 59 ALA H H 1 7.684 1.397 . 9 . . . . A 59 ALA H . 30133 1 658 . 1 . 1 59 59 ALA HA H 1 4.448 0.000 . 9 . . . . A 59 ALA HA . 30133 1 659 . 1 . 1 59 59 ALA HB1 H 1 1.197 0.000 . 9 . . . . A 59 ALA HB1 . 30133 1 660 . 1 . 1 59 59 ALA HB2 H 1 1.197 0.000 . 9 . . . . A 59 ALA HB2 . 30133 1 661 . 1 . 1 59 59 ALA HB3 H 1 1.197 0.000 . 9 . . . . A 59 ALA HB3 . 30133 1 662 . 1 . 1 59 59 ALA C C 13 175.266 0.000 . 9 . . . . A 59 ALA C . 30133 1 663 . 1 . 1 59 59 ALA CA C 13 51.682 0.111 . 9 . . . . A 59 ALA CA . 30133 1 664 . 1 . 1 59 59 ALA CB C 13 19.077 0.643 . 9 . . . . A 59 ALA CB . 30133 1 665 . 1 . 1 59 59 ALA N N 15 119.320 0.006 . 9 . . . . A 59 ALA N . 30133 1 666 . 1 . 1 60 60 ILE H H 1 6.437 2.459 . 9 . . . . A 60 ILE H . 30133 1 667 . 1 . 1 60 60 ILE HA H 1 4.073 0.000 . 9 . . . . A 60 ILE HA . 30133 1 668 . 1 . 1 60 60 ILE HB H 1 2.317 0.058 . 9 . . . . A 60 ILE HB . 30133 1 669 . 1 . 1 60 60 ILE HG12 H 1 2.189 0.000 . 9 . . . . A 60 ILE HG12 . 30133 1 670 . 1 . 1 60 60 ILE HG13 H 1 2.189 0.000 . 9 . . . . A 60 ILE HG13 . 30133 1 671 . 1 . 1 60 60 ILE HG21 H 1 0.873 0.372 . 9 . . . . A 60 ILE HG21 . 30133 1 672 . 1 . 1 60 60 ILE HG22 H 1 0.873 0.372 . 9 . . . . A 60 ILE HG22 . 30133 1 673 . 1 . 1 60 60 ILE HG23 H 1 0.873 0.372 . 9 . . . . A 60 ILE HG23 . 30133 1 674 . 1 . 1 60 60 ILE HD11 H 1 0.931 0.000 . 9 . . . . A 60 ILE HD11 . 30133 1 675 . 1 . 1 60 60 ILE HD12 H 1 0.931 0.000 . 9 . . . . A 60 ILE HD12 . 30133 1 676 . 1 . 1 60 60 ILE HD13 H 1 0.931 0.000 . 9 . . . . A 60 ILE HD13 . 30133 1 677 . 1 . 1 60 60 ILE C C 13 179.824 0.000 . 9 . . . . A 60 ILE C . 30133 1 678 . 1 . 1 60 60 ILE CA C 13 57.701 0.458 . 9 . . . . A 60 ILE CA . 30133 1 679 . 1 . 1 60 60 ILE CB C 13 41.232 0.949 . 9 . . . . A 60 ILE CB . 30133 1 680 . 1 . 1 60 60 ILE CG1 C 13 29.679 0.021 . 9 . . . . A 60 ILE CG1 . 30133 1 681 . 1 . 1 60 60 ILE CG2 C 13 22.668 0.041 . 9 . . . . A 60 ILE CG2 . 30133 1 682 . 1 . 1 60 60 ILE CD1 C 13 15.136 0.099 . 9 . . . . A 60 ILE CD1 . 30133 1 683 . 1 . 1 60 60 ILE N N 15 118.019 0.000 . 9 . . . . A 60 ILE N . 30133 1 684 . 1 . 1 61 61 VAL H H 1 7.768 1.920 . 9 . . . . A 61 VAL H . 30133 1 685 . 1 . 1 61 61 VAL HA H 1 3.878 0.000 . 9 . . . . A 61 VAL HA . 30133 1 686 . 1 . 1 61 61 VAL HB H 1 1.884 0.000 . 9 . . . . A 61 VAL HB . 30133 1 687 . 1 . 1 61 61 VAL HG11 H 1 1.423 0.000 . 9 . . . . A 61 VAL HG11 . 30133 1 688 . 1 . 1 61 61 VAL HG12 H 1 1.423 0.000 . 9 . . . . A 61 VAL HG12 . 30133 1 689 . 1 . 1 61 61 VAL HG13 H 1 1.423 0.000 . 9 . . . . A 61 VAL HG13 . 30133 1 690 . 1 . 1 61 61 VAL HG21 H 1 1.369 0.000 . 9 . . . . A 61 VAL HG21 . 30133 1 691 . 1 . 1 61 61 VAL HG22 H 1 1.369 0.000 . 9 . . . . A 61 VAL HG22 . 30133 1 692 . 1 . 1 61 61 VAL HG23 H 1 1.369 0.000 . 9 . . . . A 61 VAL HG23 . 30133 1 693 . 1 . 1 61 61 VAL C C 13 175.393 0.000 . 9 . . . . A 61 VAL C . 30133 1 694 . 1 . 1 61 61 VAL CA C 13 61.834 0.695 . 9 . . . . A 61 VAL CA . 30133 1 695 . 1 . 1 61 61 VAL CB C 13 31.488 0.628 . 9 . . . . A 61 VAL CB . 30133 1 696 . 1 . 1 61 61 VAL CG1 C 13 28.459 0.087 . 9 . . . . A 61 VAL CG1 . 30133 1 697 . 1 . 1 61 61 VAL CG2 C 13 28.214 0.015 . 9 . . . . A 61 VAL CG2 . 30133 1 698 . 1 . 1 61 61 VAL N N 15 123.209 0.001 . 9 . . . . A 61 VAL N . 30133 1 699 . 1 . 1 62 62 GLU H H 1 7.405 1.653 . 9 . . . . A 62 GLU H . 30133 1 700 . 1 . 1 62 62 GLU HA H 1 4.061 0.000 . 9 . . . . A 62 GLU HA . 30133 1 701 . 1 . 1 62 62 GLU HB2 H 1 2.189 0.000 . 9 . . . . A 62 GLU HB2 . 30133 1 702 . 1 . 1 62 62 GLU HB3 H 1 2.111 0.000 . 9 . . . . A 62 GLU HB3 . 30133 1 703 . 1 . 1 62 62 GLU HG2 H 1 2.471 0.000 . 9 . . . . A 62 GLU HG2 . 30133 1 704 . 1 . 1 62 62 GLU HG3 H 1 2.291 0.000 . 9 . . . . A 62 GLU HG3 . 30133 1 705 . 1 . 1 62 62 GLU C C 13 177.283 0.000 . 9 . . . . A 62 GLU C . 30133 1 706 . 1 . 1 62 62 GLU CA C 13 58.449 0.742 . 9 . . . . A 62 GLU CA . 30133 1 707 . 1 . 1 62 62 GLU CB C 13 29.401 0.530 . 9 . . . . A 62 GLU CB . 30133 1 708 . 1 . 1 62 62 GLU CG C 13 36.442 0.030 . 9 . . . . A 62 GLU CG . 30133 1 709 . 1 . 1 62 62 GLU N N 15 122.624 0.010 . 9 . . . . A 62 GLU N . 30133 1 710 . 1 . 1 63 63 MET H H 1 6.584 1.615 . 9 . . . . A 63 MET H . 30133 1 711 . 1 . 1 63 63 MET HA H 1 4.663 0.000 . 9 . . . . A 63 MET HA . 30133 1 712 . 1 . 1 63 63 MET HB2 H 1 1.957 0.045 . 9 . . . . A 63 MET HB2 . 30133 1 713 . 1 . 1 63 63 MET HB3 H 1 1.798 0.000 . 9 . . . . A 63 MET HB3 . 30133 1 714 . 1 . 1 63 63 MET HG2 H 1 1.965 0.064 . 9 . . . . A 63 MET HG2 . 30133 1 715 . 1 . 1 63 63 MET HG3 H 1 1.988 0.127 . 9 . . . . A 63 MET HG3 . 30133 1 716 . 1 . 1 63 63 MET HE1 H 1 0.728 0.000 . 9 . . . . A 63 MET HE1 . 30133 1 717 . 1 . 1 63 63 MET HE2 H 1 0.728 0.000 . 9 . . . . A 63 MET HE2 . 30133 1 718 . 1 . 1 63 63 MET HE3 H 1 0.728 0.000 . 9 . . . . A 63 MET HE3 . 30133 1 719 . 1 . 1 63 63 MET C C 13 174.741 0.000 . 9 . . . . A 63 MET C . 30133 1 720 . 1 . 1 63 63 MET CA C 13 54.675 0.104 . 9 . . . . A 63 MET CA . 30133 1 721 . 1 . 1 63 63 MET CB C 13 30.409 0.046 . 9 . . . . A 63 MET CB . 30133 1 722 . 1 . 1 63 63 MET CG C 13 33.052 0.001 . 9 . . . . A 63 MET CG . 30133 1 723 . 1 . 1 63 63 MET CE C 13 13.771 0.124 . 9 . . . . A 63 MET CE . 30133 1 724 . 1 . 1 63 63 MET N N 15 116.161 0.015 . 9 . . . . A 63 MET N . 30133 1 725 . 1 . 1 64 64 LEU H H 1 7.694 2.581 . 9 . . . . A 64 LEU H . 30133 1 726 . 1 . 1 64 64 LEU HA H 1 4.288 0.000 . 9 . . . . A 64 LEU HA . 30133 1 727 . 1 . 1 64 64 LEU HB2 H 1 1.686 0.012 . 9 . . . . A 64 LEU HB2 . 30133 1 728 . 1 . 1 64 64 LEU HB3 H 1 1.628 0.016 . 9 . . . . A 64 LEU HB3 . 30133 1 729 . 1 . 1 64 64 LEU HG H 1 1.326 0.000 . 9 . . . . A 64 LEU HG . 30133 1 730 . 1 . 1 64 64 LEU HD11 H 1 0.763 0.000 . 9 . . . . A 64 LEU HD11 . 30133 1 731 . 1 . 1 64 64 LEU HD12 H 1 0.763 0.000 . 9 . . . . A 64 LEU HD12 . 30133 1 732 . 1 . 1 64 64 LEU HD13 H 1 0.763 0.000 . 9 . . . . A 64 LEU HD13 . 30133 1 733 . 1 . 1 64 64 LEU HD21 H 1 0.762 0.014 . 9 . . . . A 64 LEU HD21 . 30133 1 734 . 1 . 1 64 64 LEU HD22 H 1 0.762 0.014 . 9 . . . . A 64 LEU HD22 . 30133 1 735 . 1 . 1 64 64 LEU HD23 H 1 0.762 0.014 . 9 . . . . A 64 LEU HD23 . 30133 1 736 . 1 . 1 64 64 LEU C C 13 176.044 0.000 . 9 . . . . A 64 LEU C . 30133 1 737 . 1 . 1 64 64 LEU CA C 13 54.531 0.282 . 9 . . . . A 64 LEU CA . 30133 1 738 . 1 . 1 64 64 LEU CB C 13 44.497 0.971 . 9 . . . . A 64 LEU CB . 30133 1 739 . 1 . 1 64 64 LEU CG C 13 27.077 0.087 . 9 . . . . A 64 LEU CG . 30133 1 740 . 1 . 1 64 64 LEU CD1 C 13 23.039 0.053 . 9 . . . . A 64 LEU CD1 . 30133 1 741 . 1 . 1 64 64 LEU CD2 C 13 22.830 0.000 . 9 . . . . A 64 LEU CD2 . 30133 1 742 . 1 . 1 64 64 LEU N N 15 123.614 0.003 . 9 . . . . A 64 LEU N . 30133 1 743 . 1 . 1 65 65 GLY H H 1 7.808 0.750 . 9 . . . . A 65 GLY H . 30133 1 744 . 1 . 1 65 65 GLY HA2 H 1 4.002 0.134 . 9 . . . . A 65 GLY HA2 . 30133 1 745 . 1 . 1 65 65 GLY HA3 H 1 3.866 0.009 . 9 . . . . A 65 GLY HA3 . 30133 1 746 . 1 . 1 65 65 GLY C C 13 175.567 0.000 . 9 . . . . A 65 GLY C . 30133 1 747 . 1 . 1 65 65 GLY CA C 13 45.381 0.067 . 9 . . . . A 65 GLY CA . 30133 1 748 . 1 . 1 65 65 GLY N N 15 106.685 0.010 . 9 . . . . A 65 GLY N . 30133 1 749 . 1 . 1 66 66 GLY H H 1 8.286 0.718 . 9 . . . . A 66 GLY H . 30133 1 750 . 1 . 1 66 66 GLY HA2 H 1 4.812 0.000 . 9 . . . . A 66 GLY HA2 . 30133 1 751 . 1 . 1 66 66 GLY HA3 H 1 3.788 0.000 . 9 . . . . A 66 GLY HA3 . 30133 1 752 . 1 . 1 66 66 GLY C C 13 172.105 0.000 . 9 . . . . A 66 GLY C . 30133 1 753 . 1 . 1 66 66 GLY CA C 13 44.990 0.070 . 9 . . . . A 66 GLY CA . 30133 1 754 . 1 . 1 66 66 GLY N N 15 108.783 0.007 . 9 . . . . A 66 GLY N . 30133 1 755 . 1 . 1 67 67 ARG H H 1 7.688 2.001 . 9 . . . . A 67 ARG H . 30133 1 756 . 1 . 1 67 67 ARG HA H 1 4.710 0.000 . 9 . . . . A 67 ARG HA . 30133 1 757 . 1 . 1 67 67 ARG HB2 H 1 1.979 0.038 . 9 . . . . A 67 ARG HB2 . 30133 1 758 . 1 . 1 67 67 ARG HB3 H 1 1.927 0.035 . 9 . . . . A 67 ARG HB3 . 30133 1 759 . 1 . 1 67 67 ARG HG2 H 1 1.402 0.119 . 9 . . . . A 67 ARG HG2 . 30133 1 760 . 1 . 1 67 67 ARG HG3 H 1 1.358 0.125 . 9 . . . . A 67 ARG HG3 . 30133 1 761 . 1 . 1 67 67 ARG HD2 H 1 3.128 0.014 . 9 . . . . A 67 ARG HD2 . 30133 1 762 . 1 . 1 67 67 ARG HD3 H 1 3.069 0.029 . 9 . . . . A 67 ARG HD3 . 30133 1 763 . 1 . 1 67 67 ARG C C 13 174.741 0.000 . 9 . . . . A 67 ARG C . 30133 1 764 . 1 . 1 67 67 ARG CA C 13 54.211 0.029 . 9 . . . . A 67 ARG CA . 30133 1 765 . 1 . 1 67 67 ARG CB C 13 33.412 0.037 . 9 . . . . A 67 ARG CB . 30133 1 766 . 1 . 1 67 67 ARG CG C 13 26.380 0.032 . 9 . . . . A 67 ARG CG . 30133 1 767 . 1 . 1 67 67 ARG CD C 13 39.316 0.013 . 9 . . . . A 67 ARG CD . 30133 1 768 . 1 . 1 67 67 ARG N N 15 113.698 0.001 . 9 . . . . A 67 ARG N . 30133 1 769 . 1 . 1 68 68 VAL H H 1 7.975 2.441 . 9 . . . . A 68 VAL H . 30133 1 770 . 1 . 1 68 68 VAL HA H 1 3.858 0.000 . 9 . . . . A 68 VAL HA . 30133 1 771 . 1 . 1 68 68 VAL HB H 1 2.007 0.215 . 9 . . . . A 68 VAL HB . 30133 1 772 . 1 . 1 68 68 VAL HG11 H 1 0.712 0.000 . 9 . . . . A 68 VAL HG11 . 30133 1 773 . 1 . 1 68 68 VAL HG12 H 1 0.712 0.000 . 9 . . . . A 68 VAL HG12 . 30133 1 774 . 1 . 1 68 68 VAL HG13 H 1 0.712 0.000 . 9 . . . . A 68 VAL HG13 . 30133 1 775 . 1 . 1 68 68 VAL HG21 H 1 0.655 0.336 . 9 . . . . A 68 VAL HG21 . 30133 1 776 . 1 . 1 68 68 VAL HG22 H 1 0.655 0.336 . 9 . . . . A 68 VAL HG22 . 30133 1 777 . 1 . 1 68 68 VAL HG23 H 1 0.655 0.336 . 9 . . . . A 68 VAL HG23 . 30133 1 778 . 1 . 1 68 68 VAL C C 13 175.853 0.000 . 9 . . . . A 68 VAL C . 30133 1 779 . 1 . 1 68 68 VAL CA C 13 64.510 0.034 . 9 . . . . A 68 VAL CA . 30133 1 780 . 1 . 1 68 68 VAL CB C 13 31.575 0.025 . 9 . . . . A 68 VAL CB . 30133 1 781 . 1 . 1 68 68 VAL CG1 C 13 20.976 0.010 . 9 . . . . A 68 VAL CG1 . 30133 1 782 . 1 . 1 68 68 VAL CG2 C 13 20.637 0.001 . 9 . . . . A 68 VAL CG2 . 30133 1 783 . 1 . 1 68 68 VAL N N 15 123.514 0.009 . 9 . . . . A 68 VAL N . 30133 1 784 . 1 . 1 69 69 MET H H 1 8.845 1.838 . 9 . . . . A 69 MET H . 30133 1 785 . 1 . 1 69 69 MET HA H 1 4.523 0.000 . 9 . . . . A 69 MET HA . 30133 1 786 . 1 . 1 69 69 MET HB2 H 1 2.076 0.000 . 9 . . . . A 69 MET HB2 . 30133 1 787 . 1 . 1 69 69 MET HB3 H 1 1.818 0.000 . 9 . . . . A 69 MET HB3 . 30133 1 788 . 1 . 1 69 69 MET HG2 H 1 2.467 0.000 . 9 . . . . A 69 MET HG2 . 30133 1 789 . 1 . 1 69 69 MET HG3 H 1 2.357 0.000 . 9 . . . . A 69 MET HG3 . 30133 1 790 . 1 . 1 69 69 MET HE1 H 1 1.548 0.000 . 9 . . . . A 69 MET HE1 . 30133 1 791 . 1 . 1 69 69 MET HE2 H 1 1.548 0.000 . 9 . . . . A 69 MET HE2 . 30133 1 792 . 1 . 1 69 69 MET HE3 H 1 1.548 0.000 . 9 . . . . A 69 MET HE3 . 30133 1 793 . 1 . 1 69 69 MET C C 13 175.917 0.000 . 9 . . . . A 69 MET C . 30133 1 794 . 1 . 1 69 69 MET CA C 13 56.332 0.062 . 9 . . . . A 69 MET CA . 30133 1 795 . 1 . 1 69 69 MET CB C 13 34.877 0.075 . 9 . . . . A 69 MET CB . 30133 1 796 . 1 . 1 69 69 MET CG C 13 31.669 0.025 . 9 . . . . A 69 MET CG . 30133 1 797 . 1 . 1 69 69 MET CE C 13 9.930 0.000 . 9 . . . . A 69 MET CE . 30133 1 798 . 1 . 1 69 69 MET N N 15 128.300 0.000 . 9 . . . . A 69 MET N . 30133 1 799 . 1 . 1 70 70 GLU H H 1 7.252 1.378 . 9 . . . . A 70 GLU H . 30133 1 800 . 1 . 1 70 70 GLU HA H 1 4.538 0.000 . 9 . . . . A 70 GLU HA . 30133 1 801 . 1 . 1 70 70 GLU HB2 H 1 2.025 0.015 . 9 . . . . A 70 GLU HB2 . 30133 1 802 . 1 . 1 70 70 GLU HB3 H 1 1.945 0.008 . 9 . . . . A 70 GLU HB3 . 30133 1 803 . 1 . 1 70 70 GLU HG2 H 1 1.972 0.128 . 9 . . . . A 70 GLU HG2 . 30133 1 804 . 1 . 1 70 70 GLU HG3 H 1 1.870 0.066 . 9 . . . . A 70 GLU HG3 . 30133 1 805 . 1 . 1 70 70 GLU C C 13 174.170 0.000 . 9 . . . . A 70 GLU C . 30133 1 806 . 1 . 1 70 70 GLU CA C 13 56.119 0.091 . 9 . . . . A 70 GLU CA . 30133 1 807 . 1 . 1 70 70 GLU CB C 13 33.509 0.019 . 9 . . . . A 70 GLU CB . 30133 1 808 . 1 . 1 70 70 GLU CG C 13 35.703 0.026 . 9 . . . . A 70 GLU CG . 30133 1 809 . 1 . 1 70 70 GLU N N 15 116.774 0.005 . 9 . . . . A 70 GLU N . 30133 1 810 . 1 . 1 71 71 GLU H H 1 8.146 1.853 . 9 . . . . A 71 GLU H . 30133 1 811 . 1 . 1 71 71 GLU HA H 1 4.581 0.000 . 9 . . . . A 71 GLU HA . 30133 1 812 . 1 . 1 71 71 GLU HB2 H 1 1.961 0.095 . 9 . . . . A 71 GLU HB2 . 30133 1 813 . 1 . 1 71 71 GLU HB3 H 1 1.895 0.089 . 9 . . . . A 71 GLU HB3 . 30133 1 814 . 1 . 1 71 71 GLU HG2 H 1 2.416 0.000 . 9 . . . . A 71 GLU HG2 . 30133 1 815 . 1 . 1 71 71 GLU HG3 H 1 2.353 0.000 . 9 . . . . A 71 GLU HG3 . 30133 1 816 . 1 . 1 71 71 GLU C C 13 175.917 0.000 . 9 . . . . A 71 GLU C . 30133 1 817 . 1 . 1 71 71 GLU CA C 13 56.075 0.070 . 9 . . . . A 71 GLU CA . 30133 1 818 . 1 . 1 71 71 GLU CB C 13 30.489 0.067 . 9 . . . . A 71 GLU CB . 30133 1 819 . 1 . 1 71 71 GLU CG C 13 35.389 0.051 . 9 . . . . A 71 GLU CG . 30133 1 820 . 1 . 1 71 71 GLU N N 15 124.391 0.004 . 9 . . . . A 71 GLU N . 30133 1 821 . 1 . 1 72 72 LEU H H 1 7.350 2.245 . 9 . . . . A 72 LEU H . 30133 1 822 . 1 . 1 72 72 LEU HA H 1 4.679 0.000 . 9 . . . . A 72 LEU HA . 30133 1 823 . 1 . 1 72 72 LEU HB2 H 1 1.470 0.000 . 9 . . . . A 72 LEU HB2 . 30133 1 824 . 1 . 1 72 72 LEU HB3 H 1 1.419 0.000 . 9 . . . . A 72 LEU HB3 . 30133 1 825 . 1 . 1 72 72 LEU HG H 1 2.146 0.000 . 9 . . . . A 72 LEU HG . 30133 1 826 . 1 . 1 72 72 LEU HD11 H 1 1.326 0.000 . 9 . . . . A 72 LEU HD11 . 30133 1 827 . 1 . 1 72 72 LEU HD12 H 1 1.326 0.000 . 9 . . . . A 72 LEU HD12 . 30133 1 828 . 1 . 1 72 72 LEU HD13 H 1 1.326 0.000 . 9 . . . . A 72 LEU HD13 . 30133 1 829 . 1 . 1 72 72 LEU HD21 H 1 0.805 0.162 . 9 . . . . A 72 LEU HD21 . 30133 1 830 . 1 . 1 72 72 LEU HD22 H 1 0.805 0.162 . 9 . . . . A 72 LEU HD22 . 30133 1 831 . 1 . 1 72 72 LEU HD23 H 1 0.805 0.162 . 9 . . . . A 72 LEU HD23 . 30133 1 832 . 1 . 1 72 72 LEU C C 13 176.266 0.000 . 9 . . . . A 72 LEU C . 30133 1 833 . 1 . 1 72 72 LEU CA C 13 53.269 0.022 . 9 . . . . A 72 LEU CA . 30133 1 834 . 1 . 1 72 72 LEU CB C 13 43.146 0.017 . 9 . . . . A 72 LEU CB . 30133 1 835 . 1 . 1 72 72 LEU CG C 13 27.474 0.025 . 9 . . . . A 72 LEU CG . 30133 1 836 . 1 . 1 72 72 LEU CD1 C 13 22.559 0.015 . 9 . . . . A 72 LEU CD1 . 30133 1 837 . 1 . 1 72 72 LEU CD2 C 13 22.303 0.016 . 9 . . . . A 72 LEU CD2 . 30133 1 838 . 1 . 1 72 72 LEU N N 15 125.488 0.005 . 9 . . . . A 72 LEU N . 30133 1 839 . 1 . 1 73 73 ASP H H 1 8.154 1.386 . 9 . . . . A 73 ASP H . 30133 1 840 . 1 . 1 73 73 ASP HA H 1 5.308 0.000 . 9 . . . . A 73 ASP HA . 30133 1 841 . 1 . 1 73 73 ASP HB2 H 1 2.885 0.000 . 9 . . . . A 73 ASP HB2 . 30133 1 842 . 1 . 1 73 73 ASP HB3 H 1 2.830 0.000 . 9 . . . . A 73 ASP HB3 . 30133 1 843 . 1 . 1 73 73 ASP C C 13 179.920 0.000 . 9 . . . . A 73 ASP C . 30133 1 844 . 1 . 1 73 73 ASP CA C 13 57.488 0.241 . 9 . . . . A 73 ASP CA . 30133 1 845 . 1 . 1 73 73 ASP CB C 13 41.098 0.857 . 9 . . . . A 73 ASP CB . 30133 1 846 . 1 . 1 73 73 ASP N N 15 120.665 0.014 . 9 . . . . A 73 ASP N . 30133 1 847 . 1 . 1 74 74 TYR H H 1 6.765 0.897 . 9 . . . . A 74 TYR H . 30133 1 848 . 1 . 1 74 74 TYR HA H 1 3.956 0.000 . 9 . . . . A 74 TYR HA . 30133 1 849 . 1 . 1 74 74 TYR HB2 H 1 3.526 0.000 . 9 . . . . A 74 TYR HB2 . 30133 1 850 . 1 . 1 74 74 TYR HB3 H 1 3.456 0.000 . 9 . . . . A 74 TYR HB3 . 30133 1 851 . 1 . 1 74 74 TYR C C 13 178.363 0.000 . 9 . . . . A 74 TYR C . 30133 1 852 . 1 . 1 74 74 TYR CA C 13 62.944 0.146 . 9 . . . . A 74 TYR CA . 30133 1 853 . 1 . 1 74 74 TYR CB C 13 41.554 2.099 . 9 . . . . A 74 TYR CB . 30133 1 854 . 1 . 1 74 74 TYR CG C 13 124.994 0.021 . 9 . . . . A 74 TYR CG . 30133 1 855 . 1 . 1 74 74 TYR CD1 C 13 133.424 0.000 . 9 . . . . A 74 TYR CD1 . 30133 1 856 . 1 . 1 74 74 TYR CD2 C 13 132.753 0.000 . 9 . . . . A 74 TYR CD2 . 30133 1 857 . 1 . 1 74 74 TYR CE1 C 13 112.383 0.002 . 9 . . . . A 74 TYR CE1 . 30133 1 858 . 1 . 1 74 74 TYR CE2 C 13 118.260 0.000 . 9 . . . . A 74 TYR CE2 . 30133 1 859 . 1 . 1 74 74 TYR N N 15 118.281 0.000 . 9 . . . . A 74 TYR N . 30133 1 860 . 1 . 1 75 75 GLY H H 1 9.120 1.241 . 9 . . . . A 75 GLY H . 30133 1 861 . 1 . 1 75 75 GLY HA2 H 1 3.737 0.000 . 9 . . . . A 75 GLY HA2 . 30133 1 862 . 1 . 1 75 75 GLY HA3 H 1 3.698 0.000 . 9 . . . . A 75 GLY HA3 . 30133 1 863 . 1 . 1 75 75 GLY C C 13 174.344 0.000 . 9 . . . . A 75 GLY C . 30133 1 864 . 1 . 1 75 75 GLY CA C 13 47.430 0.135 . 9 . . . . A 75 GLY CA . 30133 1 865 . 1 . 1 75 75 GLY N N 15 116.923 0.000 . 9 . . . . A 75 GLY N . 30133 1 866 . 1 . 1 76 76 PHE H H 1 8.612 12.433 . 9 . . . . A 76 PHE H . 30133 1 867 . 1 . 1 76 76 PHE HA H 1 4.331 0.000 . 9 . . . . A 76 PHE HA . 30133 1 868 . 1 . 1 76 76 PHE HB2 H 1 2.510 0.000 . 9 . . . . A 76 PHE HB2 . 30133 1 869 . 1 . 1 76 76 PHE HB3 H 1 2.455 0.000 . 9 . . . . A 76 PHE HB3 . 30133 1 870 . 1 . 1 76 76 PHE C C 13 175.536 0.000 . 9 . . . . A 76 PHE C . 30133 1 871 . 1 . 1 76 76 PHE CA C 13 53.731 0.451 . 9 . . . . A 76 PHE CA . 30133 1 872 . 1 . 1 76 76 PHE CB C 13 43.299 1.782 . 9 . . . . A 76 PHE CB . 30133 1 873 . 1 . 1 76 76 PHE CG C 13 131.999 0.000 . 9 . . . . A 76 PHE CG . 30133 1 874 . 1 . 1 76 76 PHE CD1 C 13 133.061 0.000 . 9 . . . . A 76 PHE CD1 . 30133 1 875 . 1 . 1 76 76 PHE CD2 C 13 133.722 0.000 . 9 . . . . A 76 PHE CD2 . 30133 1 876 . 1 . 1 76 76 PHE CE1 C 13 130.816 0.000 . 9 . . . . A 76 PHE CE1 . 30133 1 877 . 1 . 1 76 76 PHE CE2 C 13 130.730 0.000 . 9 . . . . A 76 PHE CE2 . 30133 1 878 . 1 . 1 76 76 PHE CZ C 13 121.475 0.014 . 9 . . . . A 76 PHE CZ . 30133 1 879 . 1 . 1 76 76 PHE N N 15 122.909 0.000 . 9 . . . . A 76 PHE N . 30133 1 880 . 1 . 1 77 77 LEU H H 1 8.010 2.705 . 9 . . . . A 77 LEU H . 30133 1 881 . 1 . 1 77 77 LEU HA H 1 5.125 0.000 . 9 . . . . A 77 LEU HA . 30133 1 882 . 1 . 1 77 77 LEU HB2 H 1 1.658 0.000 . 9 . . . . A 77 LEU HB2 . 30133 1 883 . 1 . 1 77 77 LEU HB3 H 1 1.595 0.000 . 9 . . . . A 77 LEU HB3 . 30133 1 884 . 1 . 1 77 77 LEU HG H 1 1.736 0.000 . 9 . . . . A 77 LEU HG . 30133 1 885 . 1 . 1 77 77 LEU HD11 H 1 1.337 0.000 . 9 . . . . A 77 LEU HD11 . 30133 1 886 . 1 . 1 77 77 LEU HD12 H 1 1.337 0.000 . 9 . . . . A 77 LEU HD12 . 30133 1 887 . 1 . 1 77 77 LEU HD13 H 1 1.337 0.000 . 9 . . . . A 77 LEU HD13 . 30133 1 888 . 1 . 1 77 77 LEU HD21 H 1 1.290 0.000 . 9 . . . . A 77 LEU HD21 . 30133 1 889 . 1 . 1 77 77 LEU HD22 H 1 1.290 0.000 . 9 . . . . A 77 LEU HD22 . 30133 1 890 . 1 . 1 77 77 LEU HD23 H 1 1.290 0.000 . 9 . . . . A 77 LEU HD23 . 30133 1 891 . 1 . 1 77 77 LEU C C 13 176.743 0.000 . 9 . . . . A 77 LEU C . 30133 1 892 . 1 . 1 77 77 LEU CA C 13 53.015 0.430 . 9 . . . . A 77 LEU CA . 30133 1 893 . 1 . 1 77 77 LEU CB C 13 44.840 0.248 . 9 . . . . A 77 LEU CB . 30133 1 894 . 1 . 1 77 77 LEU CG C 13 31.502 0.001 . 9 . . . . A 77 LEU CG . 30133 1 895 . 1 . 1 77 77 LEU CD1 C 13 21.263 0.008 . 9 . . . . A 77 LEU CD1 . 30133 1 896 . 1 . 1 77 77 LEU CD2 C 13 21.045 0.028 . 9 . . . . A 77 LEU CD2 . 30133 1 897 . 1 . 1 77 77 LEU N N 15 123.071 0.008 . 9 . . . . A 77 LEU N . 30133 1 898 . 1 . 1 78 78 ALA H H 1 9.272 1.554 . 9 . . . . A 78 ALA H . 30133 1 899 . 1 . 1 78 78 ALA HA H 1 4.159 0.000 . 9 . . . . A 78 ALA HA . 30133 1 900 . 1 . 1 78 78 ALA HB1 H 1 1.447 0.000 . 9 . . . . A 78 ALA HB1 . 30133 1 901 . 1 . 1 78 78 ALA HB2 H 1 1.447 0.000 . 9 . . . . A 78 ALA HB2 . 30133 1 902 . 1 . 1 78 78 ALA HB3 H 1 1.447 0.000 . 9 . . . . A 78 ALA HB3 . 30133 1 903 . 1 . 1 78 78 ALA C C 13 173.693 0.000 . 9 . . . . A 78 ALA C . 30133 1 904 . 1 . 1 78 78 ALA CA C 13 50.058 0.045 . 9 . . . . A 78 ALA CA . 30133 1 905 . 1 . 1 78 78 ALA CB C 13 23.609 0.145 . 9 . . . . A 78 ALA CB . 30133 1 906 . 1 . 1 78 78 ALA N N 15 126.832 0.016 . 9 . . . . A 78 ALA N . 30133 1 907 . 1 . 1 79 79 GLU H H 1 8.224 1.447 . 9 . . . . A 79 GLU H . 30133 1 908 . 1 . 1 79 79 GLU HA H 1 4.495 0.000 . 9 . . . . A 79 GLU HA . 30133 1 909 . 1 . 1 79 79 GLU HB2 H 1 2.557 0.000 . 9 . . . . A 79 GLU HB2 . 30133 1 910 . 1 . 1 79 79 GLU HB3 H 1 2.510 0.000 . 9 . . . . A 79 GLU HB3 . 30133 1 911 . 1 . 1 79 79 GLU HG2 H 1 2.979 0.000 . 9 . . . . A 79 GLU HG2 . 30133 1 912 . 1 . 1 79 79 GLU HG3 H 1 2.940 0.000 . 9 . . . . A 79 GLU HG3 . 30133 1 913 . 1 . 1 79 79 GLU C C 13 174.662 0.000 . 9 . . . . A 79 GLU C . 30133 1 914 . 1 . 1 79 79 GLU CA C 13 54.104 0.032 . 9 . . . . A 79 GLU CA . 30133 1 915 . 1 . 1 79 79 GLU CB C 13 33.840 0.025 . 9 . . . . A 79 GLU CB . 30133 1 916 . 1 . 1 79 79 GLU N N 15 119.680 0.000 . 9 . . . . A 79 GLU N . 30133 1 917 . 1 . 1 80 80 ILE H H 1 6.739 3.390 . 9 . . . . A 80 ILE H . 30133 1 918 . 1 . 1 80 80 ILE HA H 1 3.886 0.000 . 9 . . . . A 80 ILE HA . 30133 1 919 . 1 . 1 80 80 ILE HB H 1 1.939 0.000 . 9 . . . . A 80 ILE HB . 30133 1 920 . 1 . 1 80 80 ILE HG12 H 1 1.705 0.000 . 9 . . . . A 80 ILE HG12 . 30133 1 921 . 1 . 1 80 80 ILE HG13 H 1 1.705 0.000 . 9 . . . . A 80 ILE HG13 . 30133 1 922 . 1 . 1 80 80 ILE HG21 H 1 1.666 0.000 . 9 . . . . A 80 ILE HG21 . 30133 1 923 . 1 . 1 80 80 ILE HG22 H 1 1.666 0.000 . 9 . . . . A 80 ILE HG22 . 30133 1 924 . 1 . 1 80 80 ILE HG23 H 1 1.666 0.000 . 9 . . . . A 80 ILE HG23 . 30133 1 925 . 1 . 1 80 80 ILE HD11 H 1 1.494 0.000 . 9 . . . . A 80 ILE HD11 . 30133 1 926 . 1 . 1 80 80 ILE HD12 H 1 1.494 0.000 . 9 . . . . A 80 ILE HD12 . 30133 1 927 . 1 . 1 80 80 ILE HD13 H 1 1.494 0.000 . 9 . . . . A 80 ILE HD13 . 30133 1 928 . 1 . 1 80 80 ILE C C 13 171.914 0.000 . 9 . . . . A 80 ILE C . 30133 1 929 . 1 . 1 80 80 ILE CA C 13 67.252 0.043 . 9 . . . . A 80 ILE CA . 30133 1 930 . 1 . 1 80 80 ILE CB C 13 44.410 0.167 . 9 . . . . A 80 ILE CB . 30133 1 931 . 1 . 1 80 80 ILE CG1 C 13 28.445 0.069 . 9 . . . . A 80 ILE CG1 . 30133 1 932 . 1 . 1 80 80 ILE CG2 C 13 24.524 0.013 . 9 . . . . A 80 ILE CG2 . 30133 1 933 . 1 . 1 80 80 ILE CD1 C 13 22.113 0.016 . 9 . . . . A 80 ILE CD1 . 30133 1 934 . 1 . 1 80 80 ILE N N 15 123.482 0.018 . 9 . . . . A 80 ILE N . 30133 1 935 . 1 . 1 81 81 GLY H H 1 7.055 1.007 . 9 . . . . A 81 GLY H . 30133 1 936 . 1 . 1 81 81 GLY HA2 H 1 4.104 0.000 . 9 . . . . A 81 GLY HA2 . 30133 1 937 . 1 . 1 81 81 GLY HA3 H 1 3.385 0.000 . 9 . . . . A 81 GLY HA3 . 30133 1 938 . 1 . 1 81 81 GLY C C 13 173.264 0.000 . 9 . . . . A 81 GLY C . 30133 1 939 . 1 . 1 81 81 GLY CA C 13 43.617 0.139 . 9 . . . . A 81 GLY CA . 30133 1 940 . 1 . 1 81 81 GLY N N 15 118.503 0.032 . 9 . . . . A 81 GLY N . 30133 1 941 . 1 . 1 82 82 ASP H H 1 14.785 26.686 . 9 . . . . A 82 ASP H . 30133 1 942 . 1 . 1 82 82 ASP HA H 1 4.065 0.000 . 9 . . . . A 82 ASP HA . 30133 1 943 . 1 . 1 82 82 ASP HB2 H 1 2.563 0.017 . 9 . . . . A 82 ASP HB2 . 30133 1 944 . 1 . 1 82 82 ASP HB3 H 1 2.504 0.011 . 9 . . . . A 82 ASP HB3 . 30133 1 945 . 1 . 1 82 82 ASP C C 13 178.840 0.000 . 9 . . . . A 82 ASP C . 30133 1 946 . 1 . 1 82 82 ASP CA C 13 63.981 2.118 . 9 . . . . A 82 ASP CA . 30133 1 947 . 1 . 1 82 82 ASP CB C 13 36.274 0.817 . 9 . . . . A 82 ASP CB . 30133 1 948 . 1 . 1 82 82 ASP N N 15 113.280 28.987 . 9 . . . . A 82 ASP N . 30133 1 949 . 1 . 1 83 83 GLU H H 1 7.938 1.720 . 9 . . . . A 83 GLU H . 30133 1 950 . 1 . 1 83 83 GLU HA H 1 4.132 0.000 . 9 . . . . A 83 GLU HA . 30133 1 951 . 1 . 1 83 83 GLU HB2 H 1 1.064 0.000 . 9 . . . . A 83 GLU HB2 . 30133 1 952 . 1 . 1 83 83 GLU HB3 H 1 1.001 0.000 . 9 . . . . A 83 GLU HB3 . 30133 1 953 . 1 . 1 83 83 GLU HG2 H 1 2.247 0.065 . 9 . . . . A 83 GLU HG2 . 30133 1 954 . 1 . 1 83 83 GLU HG3 H 1 2.041 0.000 . 9 . . . . A 83 GLU HG3 . 30133 1 955 . 1 . 1 83 83 GLU C C 13 178.395 0.000 . 9 . . . . A 83 GLU C . 30133 1 956 . 1 . 1 83 83 GLU CA C 13 59.248 0.065 . 9 . . . . A 83 GLU CA . 30133 1 957 . 1 . 1 83 83 GLU CB C 13 30.835 0.952 . 9 . . . . A 83 GLU CB . 30133 1 958 . 1 . 1 83 83 GLU CG C 13 38.059 0.029 . 9 . . . . A 83 GLU CG . 30133 1 959 . 1 . 1 83 83 GLU N N 15 118.214 0.007 . 9 . . . . A 83 GLU N . 30133 1 960 . 1 . 1 84 84 LEU H H 1 6.365 1.803 . 9 . . . . A 84 LEU H . 30133 1 961 . 1 . 1 84 84 LEU HA H 1 5.265 0.000 . 9 . . . . A 84 LEU HA . 30133 1 962 . 1 . 1 84 84 LEU HB2 H 1 2.588 0.000 . 9 . . . . A 84 LEU HB2 . 30133 1 963 . 1 . 1 84 84 LEU HB3 H 1 2.549 0.000 . 9 . . . . A 84 LEU HB3 . 30133 1 964 . 1 . 1 84 84 LEU HG H 1 1.556 0.000 . 9 . . . . A 84 LEU HG . 30133 1 965 . 1 . 1 84 84 LEU HD11 H 1 0.087 0.000 . 9 . . . . A 84 LEU HD11 . 30133 1 966 . 1 . 1 84 84 LEU HD12 H 1 0.087 0.000 . 9 . . . . A 84 LEU HD12 . 30133 1 967 . 1 . 1 84 84 LEU HD13 H 1 0.087 0.000 . 9 . . . . A 84 LEU HD13 . 30133 1 968 . 1 . 1 84 84 LEU HD21 H 1 0.040 0.000 . 9 . . . . A 84 LEU HD21 . 30133 1 969 . 1 . 1 84 84 LEU HD22 H 1 0.040 0.000 . 9 . . . . A 84 LEU HD22 . 30133 1 970 . 1 . 1 84 84 LEU HD23 H 1 0.040 0.000 . 9 . . . . A 84 LEU HD23 . 30133 1 971 . 1 . 1 84 84 LEU C C 13 175.266 0.000 . 9 . . . . A 84 LEU C . 30133 1 972 . 1 . 1 84 84 LEU CA C 13 56.792 0.267 . 9 . . . . A 84 LEU CA . 30133 1 973 . 1 . 1 84 84 LEU CB C 13 41.436 0.194 . 9 . . . . A 84 LEU CB . 30133 1 974 . 1 . 1 84 84 LEU CG C 13 32.028 0.051 . 9 . . . . A 84 LEU CG . 30133 1 975 . 1 . 1 84 84 LEU CD1 C 13 12.154 0.031 . 9 . . . . A 84 LEU CD1 . 30133 1 976 . 1 . 1 84 84 LEU CD2 C 13 11.765 0.039 . 9 . . . . A 84 LEU CD2 . 30133 1 977 . 1 . 1 84 84 LEU N N 15 118.899 0.000 . 9 . . . . A 84 LEU N . 30133 1 978 . 1 . 1 85 85 LEU H H 1 8.161 0.000 . 9 . . . . A 85 LEU H . 30133 1 979 . 1 . 1 85 85 LEU HA H 1 4.327 0.000 . 9 . . . . A 85 LEU HA . 30133 1 980 . 1 . 1 85 85 LEU HB2 H 1 2.348 0.516 . 9 . . . . A 85 LEU HB2 . 30133 1 981 . 1 . 1 85 85 LEU HB3 H 1 2.429 0.420 . 9 . . . . A 85 LEU HB3 . 30133 1 982 . 1 . 1 85 85 LEU HG H 1 2.039 0.478 . 9 . . . . A 85 LEU HG . 30133 1 983 . 1 . 1 85 85 LEU HD11 H 1 0.243 0.000 . 9 . . . . A 85 LEU HD11 . 30133 1 984 . 1 . 1 85 85 LEU HD12 H 1 0.243 0.000 . 9 . . . . A 85 LEU HD12 . 30133 1 985 . 1 . 1 85 85 LEU HD13 H 1 0.243 0.000 . 9 . . . . A 85 LEU HD13 . 30133 1 986 . 1 . 1 85 85 LEU HD21 H 1 0.204 0.000 . 9 . . . . A 85 LEU HD21 . 30133 1 987 . 1 . 1 85 85 LEU HD22 H 1 0.204 0.000 . 9 . . . . A 85 LEU HD22 . 30133 1 988 . 1 . 1 85 85 LEU HD23 H 1 0.204 0.000 . 9 . . . . A 85 LEU HD23 . 30133 1 989 . 1 . 1 85 85 LEU C C 13 177.410 0.000 . 9 . . . . A 85 LEU C . 30133 1 990 . 1 . 1 85 85 LEU CA C 13 52.497 0.072 . 9 . . . . A 85 LEU CA . 30133 1 991 . 1 . 1 85 85 LEU CB C 13 41.328 1.269 . 9 . . . . A 85 LEU CB . 30133 1 992 . 1 . 1 85 85 LEU CG C 13 30.969 0.315 . 9 . . . . A 85 LEU CG . 30133 1 993 . 1 . 1 85 85 LEU CD1 C 13 19.350 0.079 . 9 . . . . A 85 LEU CD1 . 30133 1 994 . 1 . 1 85 85 LEU CD2 C 13 19.080 0.033 . 9 . . . . A 85 LEU CD2 . 30133 1 995 . 1 . 1 85 85 LEU N N 15 116.057 0.013 . 9 . . . . A 85 LEU N . 30133 1 996 . 1 . 1 86 86 ASP H H 1 7.786 1.317 . 9 . . . . A 86 ASP H . 30133 1 997 . 1 . 1 86 86 ASP HA H 1 3.972 0.000 . 9 . . . . A 86 ASP HA . 30133 1 998 . 1 . 1 86 86 ASP HB2 H 1 1.572 0.000 . 9 . . . . A 86 ASP HB2 . 30133 1 999 . 1 . 1 86 86 ASP HB3 H 1 1.423 0.000 . 9 . . . . A 86 ASP HB3 . 30133 1 1000 . 1 . 1 86 86 ASP C C 13 173.455 0.000 . 9 . . . . A 86 ASP C . 30133 1 1001 . 1 . 1 86 86 ASP CA C 13 54.927 0.154 . 9 . . . . A 86 ASP CA . 30133 1 1002 . 1 . 1 86 86 ASP CB C 13 41.994 0.769 . 9 . . . . A 86 ASP CB . 30133 1 1003 . 1 . 1 86 86 ASP N N 15 123.186 0.003 . 9 . . . . A 86 ASP N . 30133 1 1004 . 1 . 1 87 87 CYS H H 1 7.757 1.510 . 9 . . . . A 87 CYS H . 30133 1 1005 . 1 . 1 87 87 CYS HA H 1 4.538 0.000 . 9 . . . . A 87 CYS HA . 30133 1 1006 . 1 . 1 87 87 CYS HB2 H 1 2.674 0.000 . 9 . . . . A 87 CYS HB2 . 30133 1 1007 . 1 . 1 87 87 CYS HB3 H 1 2.604 0.000 . 9 . . . . A 87 CYS HB3 . 30133 1 1008 . 1 . 1 87 87 CYS C C 13 176.616 0.000 . 9 . . . . A 87 CYS C . 30133 1 1009 . 1 . 1 87 87 CYS CA C 13 56.694 0.204 . 9 . . . . A 87 CYS CA . 30133 1 1010 . 1 . 1 87 87 CYS CB C 13 30.125 0.423 . 9 . . . . A 87 CYS CB . 30133 1 1011 . 1 . 1 87 87 CYS N N 15 120.535 0.000 . 9 . . . . A 87 CYS N . 30133 1 1012 . 1 . 1 88 88 GLU H H 1 8.899 1.700 . 9 . . . . A 88 GLU H . 30133 1 1013 . 1 . 1 88 88 GLU CA C 13 55.276 0.004 . 9 . . . . A 88 GLU CA . 30133 1 1014 . 1 . 1 88 88 GLU CB C 13 31.984 0.026 . 9 . . . . A 88 GLU CB . 30133 1 1015 . 1 . 1 88 88 GLU N N 15 117.615 0.007 . 9 . . . . A 88 GLU N . 30133 1 1016 . 1 . 1 89 89 PRO HA H 1 4.503 0.000 . 9 . . . . A 89 PRO HA . 30133 1 1017 . 1 . 1 89 89 PRO HB2 H 1 3.284 0.000 . 9 . . . . A 89 PRO HB2 . 30133 1 1018 . 1 . 1 89 89 PRO HB3 H 1 2.666 0.000 . 9 . . . . A 89 PRO HB3 . 30133 1 1019 . 1 . 1 89 89 PRO HG2 H 1 1.611 0.000 . 9 . . . . A 89 PRO HG2 . 30133 1 1020 . 1 . 1 89 89 PRO HG3 H 1 1.478 0.000 . 9 . . . . A 89 PRO HG3 . 30133 1 1021 . 1 . 1 89 89 PRO HD2 H 1 3.886 0.000 . 9 . . . . A 89 PRO HD2 . 30133 1 1022 . 1 . 1 89 89 PRO HD3 H 1 3.846 0.000 . 9 . . . . A 89 PRO HD3 . 30133 1 1023 . 1 . 1 89 89 PRO C C 13 171.422 0.000 . 9 . . . . A 89 PRO C . 30133 1 1024 . 1 . 1 90 90 ALA H H 1 8.347 1.734 . 9 . . . . A 90 ALA H . 30133 1 1025 . 1 . 1 90 90 ALA HA H 1 4.175 0.000 . 9 . . . . A 90 ALA HA . 30133 1 1026 . 1 . 1 90 90 ALA HB1 H 1 1.533 0.000 . 9 . . . . A 90 ALA HB1 . 30133 1 1027 . 1 . 1 90 90 ALA HB2 H 1 1.533 0.000 . 9 . . . . A 90 ALA HB2 . 30133 1 1028 . 1 . 1 90 90 ALA HB3 H 1 1.533 0.000 . 9 . . . . A 90 ALA HB3 . 30133 1 1029 . 1 . 1 90 90 ALA C C 13 175.377 0.000 . 9 . . . . A 90 ALA C . 30133 1 1030 . 1 . 1 90 90 ALA CA C 13 60.377 0.045 . 9 . . . . A 90 ALA CA . 30133 1 1031 . 1 . 1 90 90 ALA CB C 13 23.132 0.443 . 9 . . . . A 90 ALA CB . 30133 1 1032 . 1 . 1 90 90 ALA N N 15 118.921 0.013 . 9 . . . . A 90 ALA N . 30133 1 1033 . 1 . 1 91 91 TRP H H 1 7.732 1.073 . 9 . . . . A 91 TRP H . 30133 1 1034 . 1 . 1 91 91 TRP HA H 1 4.515 0.000 . 9 . . . . A 91 TRP HA . 30133 1 1035 . 1 . 1 91 91 TRP HB2 H 1 1.931 0.268 . 9 . . . . A 91 TRP HB2 . 30133 1 1036 . 1 . 1 91 91 TRP HB3 H 1 2.178 0.000 . 9 . . . . A 91 TRP HB3 . 30133 1 1037 . 1 . 1 91 91 TRP C C 13 178.045 0.000 . 9 . . . . A 91 TRP C . 30133 1 1038 . 1 . 1 91 91 TRP CA C 13 55.960 0.062 . 9 . . . . A 91 TRP CA . 30133 1 1039 . 1 . 1 91 91 TRP CB C 13 31.275 0.663 . 9 . . . . A 91 TRP CB . 30133 1 1040 . 1 . 1 91 91 TRP CD1 C 13 126.901 0.000 . 9 . . . . A 91 TRP CD1 . 30133 1 1041 . 1 . 1 91 91 TRP CD2 C 13 128.005 0.000 . 9 . . . . A 91 TRP CD2 . 30133 1 1042 . 1 . 1 91 91 TRP CE2 C 13 137.642 0.000 . 9 . . . . A 91 TRP CE2 . 30133 1 1043 . 1 . 1 91 91 TRP N N 15 117.933 0.008 . 9 . . . . A 91 TRP N . 30133 1 1044 . 1 . 1 92 92 TRP H H 1 7.926 1.140 . 9 . . . . A 92 TRP H . 30133 1 1045 . 1 . 1 92 92 TRP HA H 1 3.964 0.000 . 9 . . . . A 92 TRP HA . 30133 1 1046 . 1 . 1 92 92 TRP HB2 H 1 3.136 0.006 . 9 . . . . A 92 TRP HB2 . 30133 1 1047 . 1 . 1 92 92 TRP HB3 H 1 2.869 0.000 . 9 . . . . A 92 TRP HB3 . 30133 1 1048 . 1 . 1 92 92 TRP C C 13 175.949 0.000 . 9 . . . . A 92 TRP C . 30133 1 1049 . 1 . 1 92 92 TRP CA C 13 58.708 0.107 . 9 . . . . A 92 TRP CA . 30133 1 1050 . 1 . 1 92 92 TRP CB C 13 29.941 0.301 . 9 . . . . A 92 TRP CB . 30133 1 1051 . 1 . 1 92 92 TRP CD1 C 13 127.757 0.000 . 9 . . . . A 92 TRP CD1 . 30133 1 1052 . 1 . 1 92 92 TRP CD2 C 13 127.333 0.000 . 9 . . . . A 92 TRP CD2 . 30133 1 1053 . 1 . 1 92 92 TRP CE2 C 13 136.435 0.000 . 9 . . . . A 92 TRP CE2 . 30133 1 1054 . 1 . 1 92 92 TRP N N 15 124.033 0.011 . 9 . . . . A 92 TRP N . 30133 1 1055 . 1 . 1 93 93 ALA H H 1 7.816 1.492 . 9 . . . . A 93 ALA H . 30133 1 1056 . 1 . 1 93 93 ALA HA H 1 3.338 0.000 . 9 . . . . A 93 ALA HA . 30133 1 1057 . 1 . 1 93 93 ALA HB1 H 1 1.419 0.000 . 9 . . . . A 93 ALA HB1 . 30133 1 1058 . 1 . 1 93 93 ALA HB2 H 1 1.419 0.000 . 9 . . . . A 93 ALA HB2 . 30133 1 1059 . 1 . 1 93 93 ALA HB3 H 1 1.419 0.000 . 9 . . . . A 93 ALA HB3 . 30133 1 1060 . 1 . 1 93 93 ALA C C 13 173.661 0.000 . 9 . . . . A 93 ALA C . 30133 1 1061 . 1 . 1 93 93 ALA CA C 13 55.653 3.272 . 9 . . . . A 93 ALA CA . 30133 1 1062 . 1 . 1 93 93 ALA CB C 13 21.757 2.426 . 9 . . . . A 93 ALA CB . 30133 1 1063 . 1 . 1 93 93 ALA N N 15 134.107 0.003 . 9 . . . . A 93 ALA N . 30133 1 1064 . 1 . 1 94 94 ASP H H 1 8.391 1.182 . 9 . . . . A 94 ASP H . 30133 1 1065 . 1 . 1 94 94 ASP HA H 1 4.714 0.000 . 9 . . . . A 94 ASP HA . 30133 1 1066 . 1 . 1 94 94 ASP HB2 H 1 2.042 0.009 . 9 . . . . A 94 ASP HB2 . 30133 1 1067 . 1 . 1 94 94 ASP HB3 H 1 1.970 0.000 . 9 . . . . A 94 ASP HB3 . 30133 1 1068 . 1 . 1 94 94 ASP C C 13 175.123 0.000 . 9 . . . . A 94 ASP C . 30133 1 1069 . 1 . 1 94 94 ASP CA C 13 56.461 2.050 . 9 . . . . A 94 ASP CA . 30133 1 1070 . 1 . 1 94 94 ASP CB C 13 34.384 0.821 . 9 . . . . A 94 ASP CB . 30133 1 1071 . 1 . 1 94 94 ASP N N 15 119.330 0.016 . 9 . . . . A 94 ASP N . 30133 1 1072 . 1 . 1 95 95 GLU H H 1 7.929 1.650 . 9 . . . . A 95 GLU H . 30133 1 1073 . 1 . 1 95 95 GLU HA H 1 4.202 0.000 . 9 . . . . A 95 GLU HA . 30133 1 1074 . 1 . 1 95 95 GLU HB2 H 1 1.998 0.000 . 9 . . . . A 95 GLU HB2 . 30133 1 1075 . 1 . 1 95 95 GLU HB3 H 1 1.943 0.000 . 9 . . . . A 95 GLU HB3 . 30133 1 1076 . 1 . 1 95 95 GLU HG2 H 1 2.412 0.044 . 9 . . . . A 95 GLU HG2 . 30133 1 1077 . 1 . 1 95 95 GLU HG3 H 1 2.361 0.046 . 9 . . . . A 95 GLU HG3 . 30133 1 1078 . 1 . 1 95 95 GLU C C 13 176.314 0.000 . 9 . . . . A 95 GLU C . 30133 1 1079 . 1 . 1 95 95 GLU CA C 13 56.967 0.050 . 9 . . . . A 95 GLU CA . 30133 1 1080 . 1 . 1 95 95 GLU CB C 13 29.959 0.125 . 9 . . . . A 95 GLU CB . 30133 1 1081 . 1 . 1 95 95 GLU CG C 13 36.388 0.014 . 9 . . . . A 95 GLU CG . 30133 1 1082 . 1 . 1 95 95 GLU N N 15 122.906 0.002 . 9 . . . . A 95 GLU N . 30133 1 1083 . 1 . 1 96 96 ALA H H 1 7.724 1.510 . 9 . . . . A 96 ALA H . 30133 1 1084 . 1 . 1 96 96 ALA HA H 1 4.327 0.000 . 9 . . . . A 96 ALA HA . 30133 1 1085 . 1 . 1 96 96 ALA HB1 H 1 1.408 0.000 . 9 . . . . A 96 ALA HB1 . 30133 1 1086 . 1 . 1 96 96 ALA HB2 H 1 1.408 0.000 . 9 . . . . A 96 ALA HB2 . 30133 1 1087 . 1 . 1 96 96 ALA HB3 H 1 1.408 0.000 . 9 . . . . A 96 ALA HB3 . 30133 1 1088 . 1 . 1 96 96 ALA C C 13 177.378 0.000 . 9 . . . . A 96 ALA C . 30133 1 1089 . 1 . 1 96 96 ALA CA C 13 52.702 0.115 . 9 . . . . A 96 ALA CA . 30133 1 1090 . 1 . 1 96 96 ALA CB C 13 19.352 0.144 . 9 . . . . A 96 ALA CB . 30133 1 1091 . 1 . 1 96 96 ALA N N 15 124.680 0.000 . 9 . . . . A 96 ALA N . 30133 1 1092 . 1 . 1 97 97 TYR H H 1 7.068 0.837 . 9 . . . . A 97 TYR H . 30133 1 1093 . 1 . 1 97 97 TYR HA H 1 5.203 0.000 . 9 . . . . A 97 TYR HA . 30133 1 1094 . 1 . 1 97 97 TYR HB2 H 1 2.709 0.000 . 9 . . . . A 97 TYR HB2 . 30133 1 1095 . 1 . 1 97 97 TYR HB3 H 1 2.608 0.000 . 9 . . . . A 97 TYR HB3 . 30133 1 1096 . 1 . 1 97 97 TYR C C 13 176.457 0.000 . 9 . . . . A 97 TYR C . 30133 1 1097 . 1 . 1 97 97 TYR CA C 13 54.767 0.228 . 9 . . . . A 97 TYR CA . 30133 1 1098 . 1 . 1 97 97 TYR CB C 13 42.047 0.590 . 9 . . . . A 97 TYR CB . 30133 1 1099 . 1 . 1 97 97 TYR CG C 13 124.759 0.000 . 9 . . . . A 97 TYR CG . 30133 1 1100 . 1 . 1 97 97 TYR CD1 C 13 133.614 0.000 . 9 . . . . A 97 TYR CD1 . 30133 1 1101 . 1 . 1 97 97 TYR CD2 C 13 133.105 0.000 . 9 . . . . A 97 TYR CD2 . 30133 1 1102 . 1 . 1 97 97 TYR CE1 C 13 114.274 0.000 . 9 . . . . A 97 TYR CE1 . 30133 1 1103 . 1 . 1 97 97 TYR CE2 C 13 118.200 0.000 . 9 . . . . A 97 TYR CE2 . 30133 1 1104 . 1 . 1 97 97 TYR N N 15 120.680 0.000 . 9 . . . . A 97 TYR N . 30133 1 1105 . 1 . 1 98 98 GLU H H 1 7.612 2.093 . 9 . . . . A 98 GLU H . 30133 1 1106 . 1 . 1 98 98 GLU HA H 1 4.284 0.000 . 9 . . . . A 98 GLU HA . 30133 1 1107 . 1 . 1 98 98 GLU HB2 H 1 2.133 0.085 . 9 . . . . A 98 GLU HB2 . 30133 1 1108 . 1 . 1 98 98 GLU HB3 H 1 2.146 0.066 . 9 . . . . A 98 GLU HB3 . 30133 1 1109 . 1 . 1 98 98 GLU HG2 H 1 2.568 0.000 . 9 . . . . A 98 GLU HG2 . 30133 1 1110 . 1 . 1 98 98 GLU HG3 H 1 2.138 0.000 . 9 . . . . A 98 GLU HG3 . 30133 1 1111 . 1 . 1 98 98 GLU C C 13 175.917 0.000 . 9 . . . . A 98 GLU C . 30133 1 1112 . 1 . 1 98 98 GLU CA C 13 54.362 0.111 . 9 . . . . A 98 GLU CA . 30133 1 1113 . 1 . 1 98 98 GLU CB C 13 30.878 1.228 . 9 . . . . A 98 GLU CB . 30133 1 1114 . 1 . 1 98 98 GLU CG C 13 36.320 0.010 . 9 . . . . A 98 GLU CG . 30133 1 1115 . 1 . 1 98 98 GLU N N 15 121.270 0.015 . 9 . . . . A 98 GLU N . 30133 1 1116 . 1 . 1 99 99 ILE H H 1 7.568 2.292 . 9 . . . . A 99 ILE H . 30133 1 1117 . 1 . 1 99 99 ILE HA H 1 3.999 0.000 . 9 . . . . A 99 ILE HA . 30133 1 1118 . 1 . 1 99 99 ILE HB H 1 1.680 0.037 . 9 . . . . A 99 ILE HB . 30133 1 1119 . 1 . 1 99 99 ILE HG12 H 1 0.817 0.000 . 9 . . . . A 99 ILE HG12 . 30133 1 1120 . 1 . 1 99 99 ILE HG13 H 1 0.817 0.000 . 9 . . . . A 99 ILE HG13 . 30133 1 1121 . 1 . 1 99 99 ILE HG21 H 1 0.708 0.000 . 9 . . . . A 99 ILE HG21 . 30133 1 1122 . 1 . 1 99 99 ILE HG22 H 1 0.708 0.000 . 9 . . . . A 99 ILE HG22 . 30133 1 1123 . 1 . 1 99 99 ILE HG23 H 1 0.708 0.000 . 9 . . . . A 99 ILE HG23 . 30133 1 1124 . 1 . 1 99 99 ILE HD11 H 1 0.520 0.000 . 9 . . . . A 99 ILE HD11 . 30133 1 1125 . 1 . 1 99 99 ILE HD12 H 1 0.520 0.000 . 9 . . . . A 99 ILE HD12 . 30133 1 1126 . 1 . 1 99 99 ILE HD13 H 1 0.520 0.000 . 9 . . . . A 99 ILE HD13 . 30133 1 1127 . 1 . 1 99 99 ILE C C 13 176.266 0.000 . 9 . . . . A 99 ILE C . 30133 1 1128 . 1 . 1 99 99 ILE CA C 13 62.079 0.033 . 9 . . . . A 99 ILE CA . 30133 1 1129 . 1 . 1 99 99 ILE CB C 13 40.273 0.023 . 9 . . . . A 99 ILE CB . 30133 1 1130 . 1 . 1 99 99 ILE CG1 C 13 27.337 0.130 . 9 . . . . A 99 ILE CG1 . 30133 1 1131 . 1 . 1 99 99 ILE CG2 C 13 18.270 0.047 . 9 . . . . A 99 ILE CG2 . 30133 1 1132 . 1 . 1 99 99 ILE CD1 C 13 17.663 0.082 . 9 . . . . A 99 ILE CD1 . 30133 1 1133 . 1 . 1 99 99 ILE N N 15 122.575 0.013 . 9 . . . . A 99 ILE N . 30133 1 1134 . 1 . 1 100 100 ALA H H 1 9.103 0.943 . 9 . . . . A 100 ALA H . 30133 1 1135 . 1 . 1 100 100 ALA HA H 1 4.538 0.000 . 9 . . . . A 100 ALA HA . 30133 1 1136 . 1 . 1 100 100 ALA HB1 H 1 1.818 0.000 . 9 . . . . A 100 ALA HB1 . 30133 1 1137 . 1 . 1 100 100 ALA HB2 H 1 1.818 0.000 . 9 . . . . A 100 ALA HB2 . 30133 1 1138 . 1 . 1 100 100 ALA HB3 H 1 1.818 0.000 . 9 . . . . A 100 ALA HB3 . 30133 1 1139 . 1 . 1 100 100 ALA C C 13 175.504 0.000 . 9 . . . . A 100 ALA C . 30133 1 1140 . 1 . 1 100 100 ALA CA C 13 47.513 0.173 . 9 . . . . A 100 ALA CA . 30133 1 1141 . 1 . 1 100 100 ALA CB C 13 7.721 0.046 . 9 . . . . A 100 ALA CB . 30133 1 1142 . 1 . 1 100 100 ALA N N 15 119.732 0.022 . 9 . . . . A 100 ALA N . 30133 1 1143 . 1 . 1 101 101 GLU H H 1 9.778 2.462 . 9 . . . . A 101 GLU H . 30133 1 1144 . 1 . 1 101 101 GLU HA H 1 3.909 0.000 . 9 . . . . A 101 GLU HA . 30133 1 1145 . 1 . 1 101 101 GLU HB2 H 1 2.346 0.000 . 9 . . . . A 101 GLU HB2 . 30133 1 1146 . 1 . 1 101 101 GLU HB3 H 1 2.283 0.000 . 9 . . . . A 101 GLU HB3 . 30133 1 1147 . 1 . 1 101 101 GLU HG2 H 1 2.386 0.022 . 9 . . . . A 101 GLU HG2 . 30133 1 1148 . 1 . 1 101 101 GLU HG3 H 1 2.329 0.022 . 9 . . . . A 101 GLU HG3 . 30133 1 1149 . 1 . 1 101 101 GLU C C 13 174.360 0.000 . 9 . . . . A 101 GLU C . 30133 1 1150 . 1 . 1 101 101 GLU CA C 13 57.907 0.491 . 9 . . . . A 101 GLU CA . 30133 1 1151 . 1 . 1 101 101 GLU CB C 13 27.900 0.051 . 9 . . . . A 101 GLU CB . 30133 1 1152 . 1 . 1 101 101 GLU CG C 13 36.839 0.007 . 9 . . . . A 101 GLU CG . 30133 1 1153 . 1 . 1 101 101 GLU N N 15 123.217 0.009 . 9 . . . . A 101 GLU N . 30133 1 1154 . 1 . 1 102 102 ALA H H 1 7.162 1.398 . 9 . . . . A 102 ALA H . 30133 1 1155 . 1 . 1 102 102 ALA CA C 13 49.977 0.060 . 9 . . . . A 102 ALA CA . 30133 1 1156 . 1 . 1 102 102 ALA CB C 13 18.092 0.048 . 9 . . . . A 102 ALA CB . 30133 1 1157 . 1 . 1 102 102 ALA N N 15 121.517 0.007 . 9 . . . . A 102 ALA N . 30133 1 1158 . 1 . 1 103 103 PRO HA H 1 5.113 0.000 . 9 . . . . A 103 PRO HA . 30133 1 1159 . 1 . 1 103 103 PRO HB2 H 1 2.012 0.003 . 9 . . . . A 103 PRO HB2 . 30133 1 1160 . 1 . 1 103 103 PRO HB3 H 1 1.952 0.012 . 9 . . . . A 103 PRO HB3 . 30133 1 1161 . 1 . 1 103 103 PRO HG2 H 1 0.634 0.000 . 9 . . . . A 103 PRO HG2 . 30133 1 1162 . 1 . 1 103 103 PRO HG3 H 1 0.587 0.000 . 9 . . . . A 103 PRO HG3 . 30133 1 1163 . 1 . 1 103 103 PRO HD2 H 1 4.464 0.000 . 9 . . . . A 103 PRO HD2 . 30133 1 1164 . 1 . 1 103 103 PRO HD3 H 1 4.417 0.000 . 9 . . . . A 103 PRO HD3 . 30133 1 1165 . 1 . 1 103 103 PRO C C 13 177.124 0.000 . 9 . . . . A 103 PRO C . 30133 1 1166 . 1 . 1 103 103 PRO CA C 13 63.178 0.061 . 9 . . . . A 103 PRO CA . 30133 1 1167 . 1 . 1 103 103 PRO CB C 13 32.567 0.179 . 9 . . . . A 103 PRO CB . 30133 1 1168 . 1 . 1 103 103 PRO CG C 13 27.520 0.011 . 9 . . . . A 103 PRO CG . 30133 1 1169 . 1 . 1 104 104 GLN H H 1 7.926 1.844 . 9 . . . . A 104 GLN H . 30133 1 1170 . 1 . 1 104 104 GLN HA H 1 3.905 0.000 . 9 . . . . A 104 GLN HA . 30133 1 1171 . 1 . 1 104 104 GLN HB2 H 1 2.059 0.059 . 9 . . . . A 104 GLN HB2 . 30133 1 1172 . 1 . 1 104 104 GLN HB3 H 1 2.007 0.046 . 9 . . . . A 104 GLN HB3 . 30133 1 1173 . 1 . 1 104 104 GLN HG2 H 1 2.334 0.000 . 9 . . . . A 104 GLN HG2 . 30133 1 1174 . 1 . 1 104 104 GLN HG3 H 1 2.279 0.000 . 9 . . . . A 104 GLN HG3 . 30133 1 1175 . 1 . 1 104 104 GLN HE21 H 1 7.478 0.000 . 9 . . . . A 104 GLN HE21 . 30133 1 1176 . 1 . 1 104 104 GLN HE22 H 1 6.743 0.000 . 9 . . . . A 104 GLN HE22 . 30133 1 1177 . 1 . 1 104 104 GLN C C 13 176.806 0.000 . 9 . . . . A 104 GLN C . 30133 1 1178 . 1 . 1 104 104 GLN CA C 13 56.986 0.728 . 9 . . . . A 104 GLN CA . 30133 1 1179 . 1 . 1 104 104 GLN CB C 13 29.430 0.354 . 9 . . . . A 104 GLN CB . 30133 1 1180 . 1 . 1 104 104 GLN CG C 13 34.017 0.008 . 9 . . . . A 104 GLN CG . 30133 1 1181 . 1 . 1 104 104 GLN N N 15 115.664 0.000 . 9 . . . . A 104 GLN N . 30133 1 1182 . 1 . 1 104 104 GLN NE2 N 15 111.890 0.001 . 9 . . . . A 104 GLN NE2 . 30133 1 1183 . 1 . 1 105 105 GLY H H 1 10.174 1.184 . 9 . . . . A 105 GLY H . 30133 1 1184 . 1 . 1 105 105 GLY HA2 H 1 4.233 0.000 . 9 . . . . A 105 GLY HA2 . 30133 1 1185 . 1 . 1 105 105 GLY HA3 H 1 3.452 0.000 . 9 . . . . A 105 GLY HA3 . 30133 1 1186 . 1 . 1 105 105 GLY C C 13 175.853 0.000 . 9 . . . . A 105 GLY C . 30133 1 1187 . 1 . 1 105 105 GLY CA C 13 44.554 0.049 . 9 . . . . A 105 GLY CA . 30133 1 1188 . 1 . 1 105 105 GLY N N 15 115.675 0.017 . 9 . . . . A 105 GLY N . 30133 1 1189 . 1 . 1 106 106 SER H H 1 8.323 1.385 . 9 . . . . A 106 SER H . 30133 1 1190 . 1 . 1 106 106 SER CA C 13 61.782 0.042 . 9 . . . . A 106 SER CA . 30133 1 1191 . 1 . 1 106 106 SER CB C 13 64.779 0.002 . 9 . . . . A 106 SER CB . 30133 1 1192 . 1 . 1 106 106 SER N N 15 115.837 0.009 . 9 . . . . A 106 SER N . 30133 1 1193 . 1 . 1 108 108 PRO HA H 1 4.910 0.000 . 9 . . . . A 108 PRO HA . 30133 1 1194 . 1 . 1 108 108 PRO HB2 H 1 2.584 0.000 . 9 . . . . A 108 PRO HB2 . 30133 1 1195 . 1 . 1 108 108 PRO HB3 H 1 2.326 0.000 . 9 . . . . A 108 PRO HB3 . 30133 1 1196 . 1 . 1 108 108 PRO HG2 H 1 1.752 0.000 . 9 . . . . A 108 PRO HG2 . 30133 1 1197 . 1 . 1 108 108 PRO HG3 H 1 1.697 0.000 . 9 . . . . A 108 PRO HG3 . 30133 1 1198 . 1 . 1 108 108 PRO HD2 H 1 4.144 0.000 . 9 . . . . A 108 PRO HD2 . 30133 1 1199 . 1 . 1 108 108 PRO HD3 H 1 4.108 0.000 . 9 . . . . A 108 PRO HD3 . 30133 1 1200 . 1 . 1 108 108 PRO C C 13 178.490 0.000 . 9 . . . . A 108 PRO C . 30133 1 1201 . 1 . 1 108 108 PRO CA C 13 57.188 0.020 . 9 . . . . A 108 PRO CA . 30133 1 1202 . 1 . 1 109 109 GLU H H 1 7.819 1.665 . 9 . . . . A 109 GLU H . 30133 1 1203 . 1 . 1 109 109 GLU HA H 1 3.362 0.000 . 9 . . . . A 109 GLU HA . 30133 1 1204 . 1 . 1 109 109 GLU HB2 H 1 1.829 0.017 . 9 . . . . A 109 GLU HB2 . 30133 1 1205 . 1 . 1 109 109 GLU HB3 H 1 1.779 0.015 . 9 . . . . A 109 GLU HB3 . 30133 1 1206 . 1 . 1 109 109 GLU HG2 H 1 2.979 0.000 . 9 . . . . A 109 GLU HG2 . 30133 1 1207 . 1 . 1 109 109 GLU HG3 H 1 2.670 0.000 . 9 . . . . A 109 GLU HG3 . 30133 1 1208 . 1 . 1 109 109 GLU C C 13 178.045 0.000 . 9 . . . . A 109 GLU C . 30133 1 1209 . 1 . 1 109 109 GLU CA C 13 60.878 0.027 . 9 . . . . A 109 GLU CA . 30133 1 1210 . 1 . 1 109 109 GLU CB C 13 29.024 0.047 . 9 . . . . A 109 GLU CB . 30133 1 1211 . 1 . 1 109 109 GLU CG C 13 37.181 0.153 . 9 . . . . A 109 GLU CG . 30133 1 1212 . 1 . 1 109 109 GLU N N 15 118.738 0.018 . 9 . . . . A 109 GLU N . 30133 1 1213 . 1 . 1 110 110 ALA H H 1 7.329 1.226 . 9 . . . . A 110 ALA H . 30133 1 1214 . 1 . 1 110 110 ALA HA H 1 4.226 0.000 . 9 . . . . A 110 ALA HA . 30133 1 1215 . 1 . 1 110 110 ALA HB1 H 1 1.400 0.000 . 9 . . . . A 110 ALA HB1 . 30133 1 1216 . 1 . 1 110 110 ALA HB2 H 1 1.400 0.000 . 9 . . . . A 110 ALA HB2 . 30133 1 1217 . 1 . 1 110 110 ALA HB3 H 1 1.400 0.000 . 9 . . . . A 110 ALA HB3 . 30133 1 1218 . 1 . 1 110 110 ALA C C 13 177.696 0.000 . 9 . . . . A 110 ALA C . 30133 1 1219 . 1 . 1 110 110 ALA CA C 13 54.145 0.725 . 9 . . . . A 110 ALA CA . 30133 1 1220 . 1 . 1 110 110 ALA CB C 13 18.456 0.403 . 9 . . . . A 110 ALA CB . 30133 1 1221 . 1 . 1 110 110 ALA N N 15 119.461 0.016 . 9 . . . . A 110 ALA N . 30133 1 1222 . 1 . 1 111 111 ALA H H 1 7.558 1.523 . 9 . . . . A 111 ALA H . 30133 1 1223 . 1 . 1 111 111 ALA HB1 H 1 1.169 0.000 . 9 . . . . A 111 ALA HB1 . 30133 1 1224 . 1 . 1 111 111 ALA HB2 H 1 1.169 0.000 . 9 . . . . A 111 ALA HB2 . 30133 1 1225 . 1 . 1 111 111 ALA HB3 H 1 1.169 0.000 . 9 . . . . A 111 ALA HB3 . 30133 1 1226 . 1 . 1 111 111 ALA C C 13 177.108 0.000 . 9 . . . . A 111 ALA C . 30133 1 1227 . 1 . 1 111 111 ALA CA C 13 52.171 0.028 . 9 . . . . A 111 ALA CA . 30133 1 1228 . 1 . 1 111 111 ALA CB C 13 18.131 1.254 . 9 . . . . A 111 ALA CB . 30133 1 1229 . 1 . 1 111 111 ALA N N 15 121.137 0.003 . 9 . . . . A 111 ALA N . 30133 1 1230 . 1 . 1 112 112 GLU H H 1 6.797 1.403 . 9 . . . . A 112 GLU H . 30133 1 1231 . 1 . 1 112 112 GLU HA H 1 4.319 0.000 . 9 . . . . A 112 GLU HA . 30133 1 1232 . 1 . 1 112 112 GLU HB2 H 1 2.485 0.388 . 9 . . . . A 112 GLU HB2 . 30133 1 1233 . 1 . 1 112 112 GLU HB3 H 1 2.423 0.385 . 9 . . . . A 112 GLU HB3 . 30133 1 1234 . 1 . 1 112 112 GLU HG2 H 1 2.494 0.000 . 9 . . . . A 112 GLU HG2 . 30133 1 1235 . 1 . 1 112 112 GLU HG3 H 1 2.436 0.000 . 9 . . . . A 112 GLU HG3 . 30133 1 1236 . 1 . 1 112 112 GLU C C 13 176.711 0.000 . 9 . . . . A 112 GLU C . 30133 1 1237 . 1 . 1 112 112 GLU CA C 13 56.315 0.217 . 9 . . . . A 112 GLU CA . 30133 1 1238 . 1 . 1 112 112 GLU CB C 13 31.139 0.646 . 9 . . . . A 112 GLU CB . 30133 1 1239 . 1 . 1 112 112 GLU CG C 13 33.852 0.065 . 9 . . . . A 112 GLU CG . 30133 1 1240 . 1 . 1 112 112 GLU N N 15 122.166 0.020 . 9 . . . . A 112 GLU N . 30133 1 1241 . 1 . 1 113 113 GLY H H 1 8.263 0.925 . 9 . . . . A 113 GLY H . 30133 1 1242 . 1 . 1 113 113 GLY HA2 H 1 3.960 0.000 . 9 . . . . A 113 GLY HA2 . 30133 1 1243 . 1 . 1 113 113 GLY HA3 H 1 3.850 0.000 . 9 . . . . A 113 GLY HA3 . 30133 1 1244 . 1 . 1 113 113 GLY C C 13 173.915 0.000 . 9 . . . . A 113 GLY C . 30133 1 1245 . 1 . 1 113 113 GLY CA C 13 45.447 0.138 . 9 . . . . A 113 GLY CA . 30133 1 1246 . 1 . 1 113 113 GLY N N 15 110.443 0.000 . 9 . . . . A 113 GLY N . 30133 1 1247 . 1 . 1 114 114 VAL H H 1 6.455 2.616 . 9 . . . . A 114 VAL H . 30133 1 1248 . 1 . 1 114 114 VAL HA H 1 3.960 0.000 . 9 . . . . A 114 VAL HA . 30133 1 1249 . 1 . 1 114 114 VAL HB H 1 3.174 0.000 . 9 . . . . A 114 VAL HB . 30133 1 1250 . 1 . 1 114 114 VAL HG11 H 1 1.470 0.000 . 9 . . . . A 114 VAL HG11 . 30133 1 1251 . 1 . 1 114 114 VAL HG12 H 1 1.470 0.000 . 9 . . . . A 114 VAL HG12 . 30133 1 1252 . 1 . 1 114 114 VAL HG13 H 1 1.470 0.000 . 9 . . . . A 114 VAL HG13 . 30133 1 1253 . 1 . 1 114 114 VAL C C 13 179.729 0.000 . 9 . . . . A 114 VAL C . 30133 1 1254 . 1 . 1 114 114 VAL CA C 13 60.962 1.266 . 9 . . . . A 114 VAL CA . 30133 1 1255 . 1 . 1 114 114 VAL CB C 13 31.221 1.390 . 9 . . . . A 114 VAL CB . 30133 1 1256 . 1 . 1 114 114 VAL CG1 C 13 18.572 0.033 . 9 . . . . A 114 VAL CG1 . 30133 1 1257 . 1 . 1 114 114 VAL CG2 C 13 18.032 0.033 . 9 . . . . A 114 VAL CG2 . 30133 1 1258 . 1 . 1 114 114 VAL N N 15 119.769 0.022 . 9 . . . . A 114 VAL N . 30133 1 1259 . 1 . 1 115 115 ILE H H 1 7.611 1.892 . 9 . . . . A 115 ILE H . 30133 1 1260 . 1 . 1 115 115 ILE HA H 1 2.971 0.000 . 9 . . . . A 115 ILE HA . 30133 1 1261 . 1 . 1 115 115 ILE HB H 1 1.542 0.123 . 9 . . . . A 115 ILE HB . 30133 1 1262 . 1 . 1 115 115 ILE HG21 H 1 1.434 0.215 . 9 . . . . A 115 ILE HG21 . 30133 1 1263 . 1 . 1 115 115 ILE HG22 H 1 1.434 0.215 . 9 . . . . A 115 ILE HG22 . 30133 1 1264 . 1 . 1 115 115 ILE HG23 H 1 1.434 0.215 . 9 . . . . A 115 ILE HG23 . 30133 1 1265 . 1 . 1 115 115 ILE HD11 H 1 0.857 0.318 . 9 . . . . A 115 ILE HD11 . 30133 1 1266 . 1 . 1 115 115 ILE HD12 H 1 0.857 0.318 . 9 . . . . A 115 ILE HD12 . 30133 1 1267 . 1 . 1 115 115 ILE HD13 H 1 0.857 0.318 . 9 . . . . A 115 ILE HD13 . 30133 1 1268 . 1 . 1 115 115 ILE C C 13 175.536 0.000 . 9 . . . . A 115 ILE C . 30133 1 1269 . 1 . 1 115 115 ILE CA C 13 57.711 0.125 . 9 . . . . A 115 ILE CA . 30133 1 1270 . 1 . 1 115 115 ILE CB C 13 41.556 1.928 . 9 . . . . A 115 ILE CB . 30133 1 1271 . 1 . 1 115 115 ILE CG1 C 13 28.293 0.038 . 9 . . . . A 115 ILE CG1 . 30133 1 1272 . 1 . 1 115 115 ILE CD1 C 13 21.729 0.047 . 9 . . . . A 115 ILE CD1 . 30133 1 1273 . 1 . 1 115 115 ILE N N 15 121.230 0.000 . 9 . . . . A 115 ILE N . 30133 1 1274 . 1 . 1 116 116 ALA H H 1 7.534 1.623 . 9 . . . . A 116 ALA H . 30133 1 1275 . 1 . 1 116 116 ALA HA H 1 4.085 0.000 . 9 . . . . A 116 ALA HA . 30133 1 1276 . 1 . 1 116 116 ALA HB1 H 1 1.427 0.000 . 9 . . . . A 116 ALA HB1 . 30133 1 1277 . 1 . 1 116 116 ALA HB2 H 1 1.427 0.000 . 9 . . . . A 116 ALA HB2 . 30133 1 1278 . 1 . 1 116 116 ALA HB3 H 1 1.427 0.000 . 9 . . . . A 116 ALA HB3 . 30133 1 1279 . 1 . 1 116 116 ALA C C 13 176.743 0.000 . 9 . . . . A 116 ALA C . 30133 1 1280 . 1 . 1 116 116 ALA CA C 13 53.130 0.357 . 9 . . . . A 116 ALA CA . 30133 1 1281 . 1 . 1 116 116 ALA CB C 13 18.704 0.192 . 9 . . . . A 116 ALA CB . 30133 1 1282 . 1 . 1 116 116 ALA N N 15 125.433 0.016 . 9 . . . . A 116 ALA N . 30133 1 1283 . 1 . 1 117 117 GLY H H 1 7.985 0.996 . 9 . . . . A 117 GLY H . 30133 1 1284 . 1 . 1 117 117 GLY HA2 H 1 3.534 0.000 . 9 . . . . A 117 GLY HA2 . 30133 1 1285 . 1 . 1 117 117 GLY HA3 H 1 3.471 0.000 . 9 . . . . A 117 GLY HA3 . 30133 1 1286 . 1 . 1 117 117 GLY C C 13 172.994 0.000 . 9 . . . . A 117 GLY C . 30133 1 1287 . 1 . 1 117 117 GLY CA C 13 45.324 0.051 . 9 . . . . A 117 GLY CA . 30133 1 1288 . 1 . 1 117 117 GLY N N 15 103.560 0.018 . 9 . . . . A 117 GLY N . 30133 1 1289 . 1 . 1 118 118 ARG H H 1 7.244 1.426 . 9 . . . . A 118 ARG H . 30133 1 1290 . 1 . 1 118 118 ARG CA C 13 52.390 0.001 . 9 . . . . A 118 ARG CA . 30133 1 1291 . 1 . 1 118 118 ARG CB C 13 33.129 0.058 . 9 . . . . A 118 ARG CB . 30133 1 1292 . 1 . 1 118 118 ARG N N 15 123.277 0.013 . 9 . . . . A 118 ARG N . 30133 1 1293 . 1 . 1 119 119 PRO HA H 1 4.632 0.000 . 9 . . . . A 119 PRO HA . 30133 1 1294 . 1 . 1 119 119 PRO HB2 H 1 1.838 0.272 . 9 . . . . A 119 PRO HB2 . 30133 1 1295 . 1 . 1 119 119 PRO HB3 H 1 1.803 0.250 . 9 . . . . A 119 PRO HB3 . 30133 1 1296 . 1 . 1 119 119 PRO HG2 H 1 1.089 0.461 . 9 . . . . A 119 PRO HG2 . 30133 1 1297 . 1 . 1 119 119 PRO HG3 H 1 1.701 0.000 . 9 . . . . A 119 PRO HG3 . 30133 1 1298 . 1 . 1 119 119 PRO HD2 H 1 2.328 0.556 . 9 . . . . A 119 PRO HD2 . 30133 1 1299 . 1 . 1 119 119 PRO HD3 H 1 2.298 0.503 . 9 . . . . A 119 PRO HD3 . 30133 1 1300 . 1 . 1 119 119 PRO C C 13 179.411 0.000 . 9 . . . . A 119 PRO C . 30133 1 1301 . 1 . 1 119 119 PRO CA C 13 59.293 0.015 . 9 . . . . A 119 PRO CA . 30133 1 1302 . 1 . 1 119 119 PRO CB C 13 29.754 0.055 . 9 . . . . A 119 PRO CB . 30133 1 1303 . 1 . 1 119 119 PRO CG C 13 24.006 0.017 . 9 . . . . A 119 PRO CG . 30133 1 1304 . 1 . 1 119 119 PRO CD C 13 36.265 0.012 . 9 . . . . A 119 PRO CD . 30133 1 1305 . 1 . 1 120 120 VAL H H 1 7.237 2.171 . 9 . . . . A 120 VAL H . 30133 1 1306 . 1 . 1 120 120 VAL HA H 1 4.269 0.000 . 9 . . . . A 120 VAL HA . 30133 1 1307 . 1 . 1 120 120 VAL HB H 1 1.609 0.018 . 9 . . . . A 120 VAL HB . 30133 1 1308 . 1 . 1 120 120 VAL HG11 H 1 1.165 0.000 . 9 . . . . A 120 VAL HG11 . 30133 1 1309 . 1 . 1 120 120 VAL HG12 H 1 1.165 0.000 . 9 . . . . A 120 VAL HG12 . 30133 1 1310 . 1 . 1 120 120 VAL HG13 H 1 1.165 0.000 . 9 . . . . A 120 VAL HG13 . 30133 1 1311 . 1 . 1 120 120 VAL HG21 H 1 1.126 0.000 . 9 . . . . A 120 VAL HG21 . 30133 1 1312 . 1 . 1 120 120 VAL HG22 H 1 1.126 0.000 . 9 . . . . A 120 VAL HG22 . 30133 1 1313 . 1 . 1 120 120 VAL HG23 H 1 1.126 0.000 . 9 . . . . A 120 VAL HG23 . 30133 1 1314 . 1 . 1 120 120 VAL C C 13 178.363 0.000 . 9 . . . . A 120 VAL C . 30133 1 1315 . 1 . 1 120 120 VAL CA C 13 63.931 0.111 . 9 . . . . A 120 VAL CA . 30133 1 1316 . 1 . 1 120 120 VAL CB C 13 29.861 0.605 . 9 . . . . A 120 VAL CB . 30133 1 1317 . 1 . 1 120 120 VAL CG1 C 13 26.578 0.001 . 9 . . . . A 120 VAL CG1 . 30133 1 1318 . 1 . 1 120 120 VAL CG2 C 13 26.788 0.074 . 9 . . . . A 120 VAL CG2 . 30133 1 1319 . 1 . 1 120 120 VAL N N 15 116.869 0.015 . 9 . . . . A 120 VAL N . 30133 1 1320 . 1 . 1 121 121 ARG H H 1 6.894 1.137 . 9 . . . . A 121 ARG H . 30133 1 1321 . 1 . 1 121 121 ARG HB2 H 1 1.917 0.010 . 9 . . . . A 121 ARG HB2 . 30133 1 1322 . 1 . 1 121 121 ARG HB3 H 1 1.859 0.004 . 9 . . . . A 121 ARG HB3 . 30133 1 1323 . 1 . 1 121 121 ARG CA C 13 63.651 0.016 . 9 . . . . A 121 ARG CA . 30133 1 1324 . 1 . 1 121 121 ARG CB C 13 31.479 0.001 . 9 . . . . A 121 ARG CB . 30133 1 1325 . 1 . 1 121 121 ARG N N 15 112.335 0.000 . 9 . . . . A 121 ARG N . 30133 1 1326 . 1 . 1 123 123 ASN H H 1 3.119 0.000 . 9 . . . . A 123 ASN H . 30133 1 1327 . 1 . 1 123 123 ASN HA H 1 3.874 0.000 . 9 . . . . A 123 ASN HA . 30133 1 1328 . 1 . 1 123 123 ASN HB2 H 1 2.310 0.000 . 9 . . . . A 123 ASN HB2 . 30133 1 1329 . 1 . 1 123 123 ASN HB3 H 1 2.232 0.000 . 9 . . . . A 123 ASN HB3 . 30133 1 1330 . 1 . 1 123 123 ASN C C 13 174.138 0.000 . 9 . . . . A 123 ASN C . 30133 1 1331 . 1 . 1 123 123 ASN CA C 13 55.439 0.013 . 9 . . . . A 123 ASN CA . 30133 1 1332 . 1 . 1 123 123 ASN CB C 13 40.670 0.141 . 9 . . . . A 123 ASN CB . 30133 1 1333 . 1 . 1 124 124 SER H H 1 7.290 0.804 . 9 . . . . A 124 SER H . 30133 1 1334 . 1 . 1 124 124 SER HA H 1 4.198 0.000 . 9 . . . . A 124 SER HA . 30133 1 1335 . 1 . 1 124 124 SER HB2 H 1 3.932 0.000 . 9 . . . . A 124 SER HB2 . 30133 1 1336 . 1 . 1 124 124 SER HB3 H 1 3.893 0.000 . 9 . . . . A 124 SER HB3 . 30133 1 1337 . 1 . 1 124 124 SER C C 13 175.234 0.000 . 9 . . . . A 124 SER C . 30133 1 1338 . 1 . 1 124 124 SER CA C 13 57.168 0.099 . 9 . . . . A 124 SER CA . 30133 1 1339 . 1 . 1 124 124 SER CB C 13 64.619 0.030 . 9 . . . . A 124 SER CB . 30133 1 1340 . 1 . 1 124 124 SER N N 15 116.418 0.007 . 9 . . . . A 124 SER N . 30133 1 1341 . 1 . 1 125 125 TRP H H 1 8.096 1.156 . 9 . . . . A 125 TRP H . 30133 1 1342 . 1 . 1 125 125 TRP HA H 1 4.046 0.000 . 9 . . . . A 125 TRP HA . 30133 1 1343 . 1 . 1 125 125 TRP HB2 H 1 2.951 0.000 . 9 . . . . A 125 TRP HB2 . 30133 1 1344 . 1 . 1 125 125 TRP HB3 H 1 2.889 0.000 . 9 . . . . A 125 TRP HB3 . 30133 1 1345 . 1 . 1 125 125 TRP C C 13 174.106 0.000 . 9 . . . . A 125 TRP C . 30133 1 1346 . 1 . 1 125 125 TRP CA C 13 57.629 0.242 . 9 . . . . A 125 TRP CA . 30133 1 1347 . 1 . 1 125 125 TRP CB C 13 32.354 0.478 . 9 . . . . A 125 TRP CB . 30133 1 1348 . 1 . 1 125 125 TRP CD1 C 13 128.184 0.000 . 9 . . . . A 125 TRP CD1 . 30133 1 1349 . 1 . 1 125 125 TRP CD2 C 13 127.963 0.000 . 9 . . . . A 125 TRP CD2 . 30133 1 1350 . 1 . 1 125 125 TRP CE2 C 13 137.571 0.000 . 9 . . . . A 125 TRP CE2 . 30133 1 1351 . 1 . 1 125 125 TRP N N 15 118.874 0.016 . 9 . . . . A 125 TRP N . 30133 1 1352 . 1 . 1 126 126 GLU H H 1 7.465 2.148 . 9 . . . . A 126 GLU H . 30133 1 1353 . 1 . 1 126 126 GLU HA H 1 4.187 0.000 . 9 . . . . A 126 GLU HA . 30133 1 1354 . 1 . 1 126 126 GLU HB2 H 1 2.044 0.076 . 9 . . . . A 126 GLU HB2 . 30133 1 1355 . 1 . 1 126 126 GLU HB3 H 1 2.003 0.056 . 9 . . . . A 126 GLU HB3 . 30133 1 1356 . 1 . 1 126 126 GLU HG2 H 1 2.145 0.008 . 9 . . . . A 126 GLU HG2 . 30133 1 1357 . 1 . 1 126 126 GLU HG3 H 1 2.094 0.010 . 9 . . . . A 126 GLU HG3 . 30133 1 1358 . 1 . 1 126 126 GLU C C 13 173.836 0.000 . 9 . . . . A 126 GLU C . 30133 1 1359 . 1 . 1 126 126 GLU CA C 13 55.394 0.542 . 9 . . . . A 126 GLU CA . 30133 1 1360 . 1 . 1 126 126 GLU CB C 13 29.924 0.230 . 9 . . . . A 126 GLU CB . 30133 1 1361 . 1 . 1 126 126 GLU CG C 13 36.001 0.010 . 9 . . . . A 126 GLU CG . 30133 1 1362 . 1 . 1 126 126 GLU N N 15 124.548 0.044 . 9 . . . . A 126 GLU N . 30133 1 1363 . 1 . 1 127 127 ALA H H 1 6.010 0.939 . 9 . . . . A 127 ALA H . 30133 1 1364 . 1 . 1 127 127 ALA HA H 1 4.136 0.000 . 9 . . . . A 127 ALA HA . 30133 1 1365 . 1 . 1 127 127 ALA HB1 H 1 0.626 0.000 . 9 . . . . A 127 ALA HB1 . 30133 1 1366 . 1 . 1 127 127 ALA HB2 H 1 0.626 0.000 . 9 . . . . A 127 ALA HB2 . 30133 1 1367 . 1 . 1 127 127 ALA HB3 H 1 0.626 0.000 . 9 . . . . A 127 ALA HB3 . 30133 1 1368 . 1 . 1 127 127 ALA C C 13 175.377 0.000 . 9 . . . . A 127 ALA C . 30133 1 1369 . 1 . 1 127 127 ALA CA C 13 50.506 0.794 . 9 . . . . A 127 ALA CA . 30133 1 1370 . 1 . 1 127 127 ALA CB C 13 23.179 0.383 . 9 . . . . A 127 ALA CB . 30133 1 1371 . 1 . 1 127 127 ALA N N 15 120.493 0.002 . 9 . . . . A 127 ALA N . 30133 1 1372 . 1 . 1 128 128 ILE H H 1 7.350 2.421 . 9 . . . . A 128 ILE H . 30133 1 1373 . 1 . 1 128 128 ILE HA H 1 5.097 0.000 . 9 . . . . A 128 ILE HA . 30133 1 1374 . 1 . 1 128 128 ILE HB H 1 2.169 0.408 . 9 . . . . A 128 ILE HB . 30133 1 1375 . 1 . 1 128 128 ILE HG12 H 1 3.034 0.000 . 9 . . . . A 128 ILE HG12 . 30133 1 1376 . 1 . 1 128 128 ILE HG13 H 1 3.034 0.000 . 9 . . . . A 128 ILE HG13 . 30133 1 1377 . 1 . 1 128 128 ILE HG21 H 1 2.479 0.000 . 9 . . . . A 128 ILE HG21 . 30133 1 1378 . 1 . 1 128 128 ILE HG22 H 1 2.479 0.000 . 9 . . . . A 128 ILE HG22 . 30133 1 1379 . 1 . 1 128 128 ILE HG23 H 1 2.479 0.000 . 9 . . . . A 128 ILE HG23 . 30133 1 1380 . 1 . 1 128 128 ILE HD11 H 1 1.544 0.000 . 9 . . . . A 128 ILE HD11 . 30133 1 1381 . 1 . 1 128 128 ILE HD12 H 1 1.544 0.000 . 9 . . . . A 128 ILE HD12 . 30133 1 1382 . 1 . 1 128 128 ILE HD13 H 1 1.544 0.000 . 9 . . . . A 128 ILE HD13 . 30133 1 1383 . 1 . 1 128 128 ILE C C 13 176.139 0.000 . 9 . . . . A 128 ILE C . 30133 1 1384 . 1 . 1 128 128 ILE CA C 13 55.141 0.061 . 9 . . . . A 128 ILE CA . 30133 1 1385 . 1 . 1 128 128 ILE CB C 13 32.705 1.290 . 9 . . . . A 128 ILE CB . 30133 1 1386 . 1 . 1 128 128 ILE CG1 C 13 26.483 0.062 . 9 . . . . A 128 ILE CG1 . 30133 1 1387 . 1 . 1 128 128 ILE CG2 C 13 18.715 0.110 . 9 . . . . A 128 ILE CG2 . 30133 1 1388 . 1 . 1 128 128 ILE CD1 C 13 18.294 0.023 . 9 . . . . A 128 ILE CD1 . 30133 1 1389 . 1 . 1 128 128 ILE N N 15 118.272 0.005 . 9 . . . . A 128 ILE N . 30133 1 1390 . 1 . 1 129 129 ILE H H 1 6.606 1.904 . 9 . . . . A 129 ILE H . 30133 1 1391 . 1 . 1 129 129 ILE HA H 1 4.265 0.000 . 9 . . . . A 129 ILE HA . 30133 1 1392 . 1 . 1 129 129 ILE HB H 1 2.381 0.000 . 9 . . . . A 129 ILE HB . 30133 1 1393 . 1 . 1 129 129 ILE HG12 H 1 2.310 0.000 . 9 . . . . A 129 ILE HG12 . 30133 1 1394 . 1 . 1 129 129 ILE HG13 H 1 2.310 0.000 . 9 . . . . A 129 ILE HG13 . 30133 1 1395 . 1 . 1 129 129 ILE HG21 H 1 2.248 0.000 . 9 . . . . A 129 ILE HG21 . 30133 1 1396 . 1 . 1 129 129 ILE HG22 H 1 2.248 0.000 . 9 . . . . A 129 ILE HG22 . 30133 1 1397 . 1 . 1 129 129 ILE HG23 H 1 2.248 0.000 . 9 . . . . A 129 ILE HG23 . 30133 1 1398 . 1 . 1 129 129 ILE HD11 H 1 2.201 0.000 . 9 . . . . A 129 ILE HD11 . 30133 1 1399 . 1 . 1 129 129 ILE HD12 H 1 2.201 0.000 . 9 . . . . A 129 ILE HD12 . 30133 1 1400 . 1 . 1 129 129 ILE HD13 H 1 2.201 0.000 . 9 . . . . A 129 ILE HD13 . 30133 1 1401 . 1 . 1 129 129 ILE C C 13 175.694 0.000 . 9 . . . . A 129 ILE C . 30133 1 1402 . 1 . 1 129 129 ILE CA C 13 60.381 0.048 . 9 . . . . A 129 ILE CA . 30133 1 1403 . 1 . 1 129 129 ILE CB C 13 40.570 2.108 . 9 . . . . A 129 ILE CB . 30133 1 1404 . 1 . 1 129 129 ILE CG1 C 13 29.786 0.017 . 9 . . . . A 129 ILE CG1 . 30133 1 1405 . 1 . 1 129 129 ILE CG2 C 13 23.340 0.066 . 9 . . . . A 129 ILE CG2 . 30133 1 1406 . 1 . 1 129 129 ILE CD1 C 13 11.523 0.227 . 9 . . . . A 129 ILE CD1 . 30133 1 1407 . 1 . 1 129 129 ILE N N 15 120.071 0.000 . 9 . . . . A 129 ILE N . 30133 1 1408 . 1 . 1 130 130 TRP H H 1 7.999 1.064 . 9 . . . . A 130 TRP H . 30133 1 1409 . 1 . 1 130 130 TRP HA H 1 4.429 0.000 . 9 . . . . A 130 TRP HA . 30133 1 1410 . 1 . 1 130 130 TRP HB2 H 1 2.138 0.061 . 9 . . . . A 130 TRP HB2 . 30133 1 1411 . 1 . 1 130 130 TRP HB3 H 1 2.037 0.025 . 9 . . . . A 130 TRP HB3 . 30133 1 1412 . 1 . 1 130 130 TRP C C 13 177.537 0.000 . 9 . . . . A 130 TRP C . 30133 1 1413 . 1 . 1 130 130 TRP CA C 13 54.125 0.020 . 9 . . . . A 130 TRP CA . 30133 1 1414 . 1 . 1 130 130 TRP CB C 13 33.307 0.056 . 9 . . . . A 130 TRP CB . 30133 1 1415 . 1 . 1 130 130 TRP CD1 C 13 127.283 0.000 . 9 . . . . A 130 TRP CD1 . 30133 1 1416 . 1 . 1 130 130 TRP CD2 C 13 128.569 0.000 . 9 . . . . A 130 TRP CD2 . 30133 1 1417 . 1 . 1 130 130 TRP CE2 C 13 138.002 0.000 . 9 . . . . A 130 TRP CE2 . 30133 1 1418 . 1 . 1 130 130 TRP N N 15 115.528 0.014 . 9 . . . . A 130 TRP N . 30133 1 1419 . 1 . 1 131 131 ASP H H 1 7.347 1.250 . 9 . . . . A 131 ASP H . 30133 1 1420 . 1 . 1 131 131 ASP HA H 1 4.175 0.000 . 9 . . . . A 131 ASP HA . 30133 1 1421 . 1 . 1 131 131 ASP HB2 H 1 2.471 0.000 . 9 . . . . A 131 ASP HB2 . 30133 1 1422 . 1 . 1 131 131 ASP HB3 H 1 2.111 0.000 . 9 . . . . A 131 ASP HB3 . 30133 1 1423 . 1 . 1 131 131 ASP C C 13 179.268 0.000 . 9 . . . . A 131 ASP C . 30133 1 1424 . 1 . 1 131 131 ASP CA C 13 62.254 0.093 . 9 . . . . A 131 ASP CA . 30133 1 1425 . 1 . 1 131 131 ASP CB C 13 39.590 0.197 . 9 . . . . A 131 ASP CB . 30133 1 1426 . 1 . 1 131 131 ASP N N 15 127.564 0.019 . 9 . . . . A 131 ASP N . 30133 1 1427 . 1 . 1 132 132 TYR H H 1 6.827 1.225 . 9 . . . . A 132 TYR H . 30133 1 1428 . 1 . 1 132 132 TYR HA H 1 4.230 0.000 . 9 . . . . A 132 TYR HA . 30133 1 1429 . 1 . 1 132 132 TYR HB2 H 1 3.776 0.000 . 9 . . . . A 132 TYR HB2 . 30133 1 1430 . 1 . 1 132 132 TYR HB3 H 1 3.729 0.000 . 9 . . . . A 132 TYR HB3 . 30133 1 1431 . 1 . 1 132 132 TYR C C 13 173.979 0.000 . 9 . . . . A 132 TYR C . 30133 1 1432 . 1 . 1 132 132 TYR CA C 13 59.631 1.384 . 9 . . . . A 132 TYR CA . 30133 1 1433 . 1 . 1 132 132 TYR CB C 13 42.265 0.708 . 9 . . . . A 132 TYR CB . 30133 1 1434 . 1 . 1 132 132 TYR CG C 13 124.435 0.000 . 9 . . . . A 132 TYR CG . 30133 1 1435 . 1 . 1 132 132 TYR CD1 C 13 133.330 0.000 . 9 . . . . A 132 TYR CD1 . 30133 1 1436 . 1 . 1 132 132 TYR CD2 C 13 133.065 0.000 . 9 . . . . A 132 TYR CD2 . 30133 1 1437 . 1 . 1 132 132 TYR CE1 C 13 114.029 0.041 . 9 . . . . A 132 TYR CE1 . 30133 1 1438 . 1 . 1 132 132 TYR CE2 C 13 116.396 0.000 . 9 . . . . A 132 TYR CE2 . 30133 1 1439 . 1 . 1 132 132 TYR N N 15 118.241 0.089 . 9 . . . . A 132 TYR N . 30133 1 1440 . 1 . 1 133 133 PHE H H 1 7.450 0.984 . 9 . . . . A 133 PHE H . 30133 1 1441 . 1 . 1 133 133 PHE HA H 1 5.097 0.000 . 9 . . . . A 133 PHE HA . 30133 1 1442 . 1 . 1 133 133 PHE HB2 H 1 3.149 0.102 . 9 . . . . A 133 PHE HB2 . 30133 1 1443 . 1 . 1 133 133 PHE HB3 H 1 3.109 0.070 . 9 . . . . A 133 PHE HB3 . 30133 1 1444 . 1 . 1 133 133 PHE C C 13 174.011 0.000 . 9 . . . . A 133 PHE C . 30133 1 1445 . 1 . 1 133 133 PHE CA C 13 52.361 0.278 . 9 . . . . A 133 PHE CA . 30133 1 1446 . 1 . 1 133 133 PHE CB C 13 43.232 0.457 . 9 . . . . A 133 PHE CB . 30133 1 1447 . 1 . 1 133 133 PHE CG C 13 130.800 0.000 . 9 . . . . A 133 PHE CG . 30133 1 1448 . 1 . 1 133 133 PHE CD1 C 13 133.192 0.007 . 9 . . . . A 133 PHE CD1 . 30133 1 1449 . 1 . 1 133 133 PHE CD2 C 13 133.538 0.000 . 9 . . . . A 133 PHE CD2 . 30133 1 1450 . 1 . 1 133 133 PHE CE1 C 13 130.474 0.000 . 9 . . . . A 133 PHE CE1 . 30133 1 1451 . 1 . 1 133 133 PHE CE2 C 13 130.158 0.000 . 9 . . . . A 133 PHE CE2 . 30133 1 1452 . 1 . 1 133 133 PHE CZ C 13 121.580 0.000 . 9 . . . . A 133 PHE CZ . 30133 1 1453 . 1 . 1 133 133 PHE N N 15 123.214 0.000 . 9 . . . . A 133 PHE N . 30133 1 1454 . 1 . 1 134 134 TYR H H 1 7.503 1.024 . 9 . . . . A 134 TYR H . 30133 1 1455 . 1 . 1 134 134 TYR HA H 1 3.854 0.000 . 9 . . . . A 134 TYR HA . 30133 1 1456 . 1 . 1 134 134 TYR HB2 H 1 2.681 0.012 . 9 . . . . A 134 TYR HB2 . 30133 1 1457 . 1 . 1 134 134 TYR HB3 H 1 2.587 0.030 . 9 . . . . A 134 TYR HB3 . 30133 1 1458 . 1 . 1 134 134 TYR C C 13 177.680 0.000 . 9 . . . . A 134 TYR C . 30133 1 1459 . 1 . 1 134 134 TYR CA C 13 61.277 0.101 . 9 . . . . A 134 TYR CA . 30133 1 1460 . 1 . 1 134 134 TYR CB C 13 40.169 0.773 . 9 . . . . A 134 TYR CB . 30133 1 1461 . 1 . 1 134 134 TYR CG C 13 124.660 0.000 . 9 . . . . A 134 TYR CG . 30133 1 1462 . 1 . 1 134 134 TYR CD1 C 13 133.159 0.000 . 9 . . . . A 134 TYR CD1 . 30133 1 1463 . 1 . 1 134 134 TYR CD2 C 13 133.465 0.000 . 9 . . . . A 134 TYR CD2 . 30133 1 1464 . 1 . 1 134 134 TYR CE1 C 13 114.294 0.000 . 9 . . . . A 134 TYR CE1 . 30133 1 1465 . 1 . 1 134 134 TYR CE2 C 13 117.260 0.000 . 9 . . . . A 134 TYR CE2 . 30133 1 1466 . 1 . 1 134 134 TYR N N 15 118.628 0.006 . 9 . . . . A 134 TYR N . 30133 1 1467 . 1 . 1 135 135 TYR H H 1 7.314 0.988 . 9 . . . . A 135 TYR H . 30133 1 1468 . 1 . 1 135 135 TYR HA H 1 4.120 0.000 . 9 . . . . A 135 TYR HA . 30133 1 1469 . 1 . 1 135 135 TYR HB2 H 1 3.362 0.000 . 9 . . . . A 135 TYR HB2 . 30133 1 1470 . 1 . 1 135 135 TYR HB3 H 1 2.794 0.305 . 9 . . . . A 135 TYR HB3 . 30133 1 1471 . 1 . 1 135 135 TYR C C 13 180.905 0.000 . 9 . . . . A 135 TYR C . 30133 1 1472 . 1 . 1 135 135 TYR CA C 13 54.667 0.450 . 9 . . . . A 135 TYR CA . 30133 1 1473 . 1 . 1 135 135 TYR CB C 13 41.162 1.882 . 9 . . . . A 135 TYR CB . 30133 1 1474 . 1 . 1 135 135 TYR CG C 13 124.988 0.006 . 9 . . . . A 135 TYR CG . 30133 1 1475 . 1 . 1 135 135 TYR CD1 C 13 133.324 0.000 . 9 . . . . A 135 TYR CD1 . 30133 1 1476 . 1 . 1 135 135 TYR CD2 C 13 133.174 0.000 . 9 . . . . A 135 TYR CD2 . 30133 1 1477 . 1 . 1 135 135 TYR CE1 C 13 115.839 0.025 . 9 . . . . A 135 TYR CE1 . 30133 1 1478 . 1 . 1 135 135 TYR CE2 C 13 117.719 0.006 . 9 . . . . A 135 TYR CE2 . 30133 1 1479 . 1 . 1 135 135 TYR N N 15 119.629 0.000 . 9 . . . . A 135 TYR N . 30133 1 1480 . 1 . 1 136 136 ALA H H 1 7.536 1.452 . 9 . . . . A 136 ALA H . 30133 1 1481 . 1 . 1 136 136 ALA HA H 1 4.316 0.000 . 9 . . . . A 136 ALA HA . 30133 1 1482 . 1 . 1 136 136 ALA HB1 H 1 1.892 0.000 . 9 . . . . A 136 ALA HB1 . 30133 1 1483 . 1 . 1 136 136 ALA HB2 H 1 1.892 0.000 . 9 . . . . A 136 ALA HB2 . 30133 1 1484 . 1 . 1 136 136 ALA HB3 H 1 1.892 0.000 . 9 . . . . A 136 ALA HB3 . 30133 1 1485 . 1 . 1 136 136 ALA C C 13 180.428 0.000 . 9 . . . . A 136 ALA C . 30133 1 1486 . 1 . 1 136 136 ALA CA C 13 55.115 0.082 . 9 . . . . A 136 ALA CA . 30133 1 1487 . 1 . 1 136 136 ALA CB C 13 17.772 0.058 . 9 . . . . A 136 ALA CB . 30133 1 1488 . 1 . 1 136 136 ALA N N 15 122.808 0.002 . 9 . . . . A 136 ALA N . 30133 1 1489 . 1 . 1 137 137 ASP H H 1 8.500 1.489 . 9 . . . . A 137 ASP H . 30133 1 1490 . 1 . 1 137 137 ASP HA H 1 4.652 0.000 . 9 . . . . A 137 ASP HA . 30133 1 1491 . 1 . 1 137 137 ASP HB2 H 1 2.901 0.000 . 9 . . . . A 137 ASP HB2 . 30133 1 1492 . 1 . 1 137 137 ASP HB3 H 1 2.721 0.000 . 9 . . . . A 137 ASP HB3 . 30133 1 1493 . 1 . 1 137 137 ASP C C 13 175.409 0.000 . 9 . . . . A 137 ASP C . 30133 1 1494 . 1 . 1 137 137 ASP CA C 13 54.963 0.235 . 9 . . . . A 137 ASP CA . 30133 1 1495 . 1 . 1 137 137 ASP CB C 13 40.412 0.753 . 9 . . . . A 137 ASP CB . 30133 1 1496 . 1 . 1 137 137 ASP N N 15 122.815 0.004 . 9 . . . . A 137 ASP N . 30133 1 1497 . 1 . 1 138 138 GLU H H 1 7.556 1.376 . 9 . . . . A 138 GLU H . 30133 1 1498 . 1 . 1 138 138 GLU CA C 13 54.640 0.171 . 9 . . . . A 138 GLU CA . 30133 1 1499 . 1 . 1 138 138 GLU CB C 13 28.364 1.531 . 9 . . . . A 138 GLU CB . 30133 1 1500 . 1 . 1 138 138 GLU CG C 13 30.319 0.038 . 9 . . . . A 138 GLU CG . 30133 1 1501 . 1 . 1 138 138 GLU N N 15 118.863 0.006 . 9 . . . . A 138 GLU N . 30133 1 1502 . 1 . 1 139 139 VAL H H 1 8.059 0.004 . 9 . . . . A 139 VAL H . 30133 1 1503 . 1 . 1 139 139 VAL N N 15 118.076 0.000 . 9 . . . . A 139 VAL N . 30133 1 1504 . 1 . 1 141 141 PRO HA H 1 3.956 0.000 . 9 . . . . A 141 PRO HA . 30133 1 1505 . 1 . 1 141 141 PRO HB2 H 1 2.385 0.000 . 9 . . . . A 141 PRO HB2 . 30133 1 1506 . 1 . 1 141 141 PRO HB3 H 1 2.307 0.000 . 9 . . . . A 141 PRO HB3 . 30133 1 1507 . 1 . 1 141 141 PRO HG2 H 1 2.064 0.000 . 9 . . . . A 141 PRO HG2 . 30133 1 1508 . 1 . 1 141 141 PRO HG3 H 1 2.017 0.000 . 9 . . . . A 141 PRO HG3 . 30133 1 1509 . 1 . 1 141 141 PRO HD2 H 1 2.940 0.000 . 9 . . . . A 141 PRO HD2 . 30133 1 1510 . 1 . 1 141 141 PRO HD3 H 1 2.885 0.000 . 9 . . . . A 141 PRO HD3 . 30133 1 1511 . 1 . 1 141 141 PRO C C 13 173.931 0.000 . 9 . . . . A 141 PRO C . 30133 1 1512 . 1 . 1 141 141 PRO CA C 13 59.934 0.031 . 9 . . . . A 141 PRO CA . 30133 1 1513 . 1 . 1 141 141 PRO CB C 13 28.854 0.107 . 9 . . . . A 141 PRO CB . 30133 1 1514 . 1 . 1 141 141 PRO CG C 13 19.242 0.028 . 9 . . . . A 141 PRO CG . 30133 1 1515 . 1 . 1 141 141 PRO CD C 13 52.468 0.000 . 9 . . . . A 141 PRO CD . 30133 1 1516 . 1 . 1 142 142 VAL H H 1 6.920 2.248 . 9 . . . . A 142 VAL H . 30133 1 1517 . 1 . 1 142 142 VAL HA H 1 4.155 0.000 . 9 . . . . A 142 VAL HA . 30133 1 1518 . 1 . 1 142 142 VAL HB H 1 2.131 0.238 . 9 . . . . A 142 VAL HB . 30133 1 1519 . 1 . 1 142 142 VAL HG11 H 1 0.360 0.000 . 9 . . . . A 142 VAL HG11 . 30133 1 1520 . 1 . 1 142 142 VAL HG12 H 1 0.360 0.000 . 9 . . . . A 142 VAL HG12 . 30133 1 1521 . 1 . 1 142 142 VAL HG13 H 1 0.360 0.000 . 9 . . . . A 142 VAL HG13 . 30133 1 1522 . 1 . 1 142 142 VAL HG21 H 1 0.313 0.000 . 9 . . . . A 142 VAL HG21 . 30133 1 1523 . 1 . 1 142 142 VAL HG22 H 1 0.313 0.000 . 9 . . . . A 142 VAL HG22 . 30133 1 1524 . 1 . 1 142 142 VAL HG23 H 1 0.313 0.000 . 9 . . . . A 142 VAL HG23 . 30133 1 1525 . 1 . 1 142 142 VAL C C 13 178.141 0.000 . 9 . . . . A 142 VAL C . 30133 1 1526 . 1 . 1 142 142 VAL CA C 13 58.394 0.345 . 9 . . . . A 142 VAL CA . 30133 1 1527 . 1 . 1 142 142 VAL CB C 13 32.510 0.484 . 9 . . . . A 142 VAL CB . 30133 1 1528 . 1 . 1 142 142 VAL CG1 C 13 18.649 0.017 . 9 . . . . A 142 VAL CG1 . 30133 1 1529 . 1 . 1 142 142 VAL CG2 C 13 18.445 0.192 . 9 . . . . A 142 VAL CG2 . 30133 1 1530 . 1 . 1 142 142 VAL N N 15 119.820 0.000 . 9 . . . . A 142 VAL N . 30133 1 1531 . 1 . 1 143 143 ASP H H 1 7.204 1.171 . 9 . . . . A 143 ASP H . 30133 1 1532 . 1 . 1 143 143 ASP HA H 1 5.078 0.000 . 9 . . . . A 143 ASP HA . 30133 1 1533 . 1 . 1 143 143 ASP HB2 H 1 2.924 0.000 . 9 . . . . A 143 ASP HB2 . 30133 1 1534 . 1 . 1 143 143 ASP HB3 H 1 2.627 0.000 . 9 . . . . A 143 ASP HB3 . 30133 1 1535 . 1 . 1 143 143 ASP C C 13 176.838 0.000 . 9 . . . . A 143 ASP C . 30133 1 1536 . 1 . 1 143 143 ASP CA C 13 54.362 0.301 . 9 . . . . A 143 ASP CA . 30133 1 1537 . 1 . 1 143 143 ASP CB C 13 42.007 0.230 . 9 . . . . A 143 ASP CB . 30133 1 1538 . 1 . 1 143 143 ASP N N 15 118.613 0.000 . 9 . . . . A 143 ASP N . 30133 1 1539 . 1 . 1 144 144 TRP H H 1 7.504 0.610 . 9 . . . . A 144 TRP H . 30133 1 1540 . 1 . 1 144 144 TRP CA C 13 54.946 0.000 . 9 . . . . A 144 TRP CA . 30133 1 1541 . 1 . 1 144 144 TRP CB C 13 29.552 0.024 . 9 . . . . A 144 TRP CB . 30133 1 1542 . 1 . 1 144 144 TRP CD1 C 13 128.316 0.000 . 9 . . . . A 144 TRP CD1 . 30133 1 1543 . 1 . 1 144 144 TRP CD2 C 13 128.808 0.000 . 9 . . . . A 144 TRP CD2 . 30133 1 1544 . 1 . 1 144 144 TRP CE2 C 13 139.309 0.000 . 9 . . . . A 144 TRP CE2 . 30133 1 1545 . 1 . 1 144 144 TRP N N 15 123.274 0.003 . 9 . . . . A 144 TRP N . 30133 1 1546 . 1 . 1 146 146 THR H H 1 2.709 1.470 . 9 . . . . A 146 THR H . 30133 1 1547 . 1 . 1 146 146 THR HA H 1 4.847 0.000 . 9 . . . . A 146 THR HA . 30133 1 1548 . 1 . 1 146 146 THR HB H 1 4.179 0.000 . 9 . . . . A 146 THR HB . 30133 1 1549 . 1 . 1 146 146 THR HG21 H 1 0.169 0.000 . 9 . . . . A 146 THR HG21 . 30133 1 1550 . 1 . 1 146 146 THR HG22 H 1 0.169 0.000 . 9 . . . . A 146 THR HG22 . 30133 1 1551 . 1 . 1 146 146 THR HG23 H 1 0.169 0.000 . 9 . . . . A 146 THR HG23 . 30133 1 1552 . 1 . 1 146 146 THR C C 13 176.171 0.000 . 9 . . . . A 146 THR C . 30133 1 1553 . 1 . 1 146 146 THR CA C 13 66.791 0.008 . 9 . . . . A 146 THR CA . 30133 1 1554 . 1 . 1 146 146 THR CB C 13 68.865 0.045 . 9 . . . . A 146 THR CB . 30133 1 1555 . 1 . 1 146 146 THR CG2 C 13 22.242 0.014 . 9 . . . . A 146 THR CG2 . 30133 1 1556 . 1 . 1 147 147 LYS H H 1 7.555 2.441 . 9 . . . . A 147 LYS H . 30133 1 1557 . 1 . 1 147 147 LYS HA H 1 4.628 0.000 . 9 . . . . A 147 LYS HA . 30133 1 1558 . 1 . 1 147 147 LYS HB2 H 1 1.853 0.000 . 9 . . . . A 147 LYS HB2 . 30133 1 1559 . 1 . 1 147 147 LYS HB3 H 1 1.798 0.000 . 9 . . . . A 147 LYS HB3 . 30133 1 1560 . 1 . 1 147 147 LYS HG2 H 1 0.962 0.000 . 9 . . . . A 147 LYS HG2 . 30133 1 1561 . 1 . 1 147 147 LYS HG3 H 1 0.907 0.000 . 9 . . . . A 147 LYS HG3 . 30133 1 1562 . 1 . 1 147 147 LYS HD2 H 1 1.415 0.000 . 9 . . . . A 147 LYS HD2 . 30133 1 1563 . 1 . 1 147 147 LYS HD3 H 1 1.353 0.000 . 9 . . . . A 147 LYS HD3 . 30133 1 1564 . 1 . 1 147 147 LYS HE2 H 1 3.201 0.048 . 9 . . . . A 147 LYS HE2 . 30133 1 1565 . 1 . 1 147 147 LYS HE3 H 1 3.108 0.099 . 9 . . . . A 147 LYS HE3 . 30133 1 1566 . 1 . 1 147 147 LYS C C 13 173.407 0.000 . 9 . . . . A 147 LYS C . 30133 1 1567 . 1 . 1 147 147 LYS CA C 13 56.469 2.228 . 9 . . . . A 147 LYS CA . 30133 1 1568 . 1 . 1 147 147 LYS CB C 13 32.181 0.797 . 9 . . . . A 147 LYS CB . 30133 1 1569 . 1 . 1 147 147 LYS CG C 13 19.461 0.096 . 9 . . . . A 147 LYS CG . 30133 1 1570 . 1 . 1 147 147 LYS CD C 13 26.613 0.027 . 9 . . . . A 147 LYS CD . 30133 1 1571 . 1 . 1 147 147 LYS CE C 13 43.543 0.000 . 9 . . . . A 147 LYS CE . 30133 1 1572 . 1 . 1 147 147 LYS N N 15 117.774 0.016 . 9 . . . . A 147 LYS N . 30133 1 1573 . 1 . 1 148 148 HIS H H 1 7.512 0.941 . 9 . . . . A 148 HIS H . 30133 1 1574 . 1 . 1 148 148 HIS HA H 1 3.835 0.000 . 9 . . . . A 148 HIS HA . 30133 1 1575 . 1 . 1 148 148 HIS HB2 H 1 2.979 0.000 . 9 . . . . A 148 HIS HB2 . 30133 1 1576 . 1 . 1 148 148 HIS HB3 H 1 2.541 0.000 . 9 . . . . A 148 HIS HB3 . 30133 1 1577 . 1 . 1 148 148 HIS C C 13 176.076 0.000 . 9 . . . . A 148 HIS C . 30133 1 1578 . 1 . 1 148 148 HIS CA C 13 61.476 0.503 . 9 . . . . A 148 HIS CA . 30133 1 1579 . 1 . 1 148 148 HIS CB C 13 31.803 0.627 . 9 . . . . A 148 HIS CB . 30133 1 1580 . 1 . 1 148 148 HIS CG C 13 130.221 0.000 . 9 . . . . A 148 HIS CG . 30133 1 1581 . 1 . 1 148 148 HIS CD2 C 13 119.368 0.000 . 9 . . . . A 148 HIS CD2 . 30133 1 1582 . 1 . 1 148 148 HIS CE1 C 13 137.628 0.000 . 9 . . . . A 148 HIS CE1 . 30133 1 1583 . 1 . 1 148 148 HIS N N 15 120.212 0.007 . 9 . . . . A 148 HIS N . 30133 1 1584 . 1 . 1 149 149 ILE H H 1 7.404 2.295 . 9 . . . . A 149 ILE H . 30133 1 1585 . 1 . 1 149 149 ILE HA H 1 3.807 0.000 . 9 . . . . A 149 ILE HA . 30133 1 1586 . 1 . 1 149 149 ILE HB H 1 2.283 0.000 . 9 . . . . A 149 ILE HB . 30133 1 1587 . 1 . 1 149 149 ILE HG12 H 1 1.415 0.000 . 9 . . . . A 149 ILE HG12 . 30133 1 1588 . 1 . 1 149 149 ILE HG13 H 1 1.415 0.000 . 9 . . . . A 149 ILE HG13 . 30133 1 1589 . 1 . 1 149 149 ILE HG21 H 1 1.361 0.000 . 9 . . . . A 149 ILE HG21 . 30133 1 1590 . 1 . 1 149 149 ILE HG22 H 1 1.361 0.000 . 9 . . . . A 149 ILE HG22 . 30133 1 1591 . 1 . 1 149 149 ILE HG23 H 1 1.361 0.000 . 9 . . . . A 149 ILE HG23 . 30133 1 1592 . 1 . 1 149 149 ILE HD11 H 1 0.954 0.000 . 9 . . . . A 149 ILE HD11 . 30133 1 1593 . 1 . 1 149 149 ILE HD12 H 1 0.954 0.000 . 9 . . . . A 149 ILE HD12 . 30133 1 1594 . 1 . 1 149 149 ILE HD13 H 1 0.954 0.000 . 9 . . . . A 149 ILE HD13 . 30133 1 1595 . 1 . 1 149 149 ILE C C 13 177.696 0.000 . 9 . . . . A 149 ILE C . 30133 1 1596 . 1 . 1 149 149 ILE CA C 13 54.027 0.209 . 9 . . . . A 149 ILE CA . 30133 1 1597 . 1 . 1 149 149 ILE CB C 13 41.844 0.489 . 9 . . . . A 149 ILE CB . 30133 1 1598 . 1 . 1 149 149 ILE CG1 C 13 27.957 0.014 . 9 . . . . A 149 ILE CG1 . 30133 1 1599 . 1 . 1 149 149 ILE CG2 C 13 14.447 0.133 . 9 . . . . A 149 ILE CG2 . 30133 1 1600 . 1 . 1 149 149 ILE CD1 C 13 13.987 0.073 . 9 . . . . A 149 ILE CD1 . 30133 1 1601 . 1 . 1 149 149 ILE N N 15 119.860 0.007 . 9 . . . . A 149 ILE N . 30133 1 1602 . 1 . 1 150 150 GLU H H 1 7.627 1.528 . 9 . . . . A 150 GLU H . 30133 1 1603 . 1 . 1 150 150 GLU HA H 1 4.401 0.000 . 9 . . . . A 150 GLU HA . 30133 1 1604 . 1 . 1 150 150 GLU HB2 H 1 1.586 0.096 . 9 . . . . A 150 GLU HB2 . 30133 1 1605 . 1 . 1 150 150 GLU HB3 H 1 1.512 0.107 . 9 . . . . A 150 GLU HB3 . 30133 1 1606 . 1 . 1 150 150 GLU HG2 H 1 2.549 0.000 . 9 . . . . A 150 GLU HG2 . 30133 1 1607 . 1 . 1 150 150 GLU HG3 H 1 2.510 0.000 . 9 . . . . A 150 GLU HG3 . 30133 1 1608 . 1 . 1 150 150 GLU C C 13 178.125 0.000 . 9 . . . . A 150 GLU C . 30133 1 1609 . 1 . 1 150 150 GLU CA C 13 55.164 0.032 . 9 . . . . A 150 GLU CA . 30133 1 1610 . 1 . 1 150 150 GLU CB C 13 27.105 0.239 . 9 . . . . A 150 GLU CB . 30133 1 1611 . 1 . 1 150 150 GLU CG C 13 28.011 0.038 . 9 . . . . A 150 GLU CG . 30133 1 1612 . 1 . 1 150 150 GLU N N 15 121.315 0.000 . 9 . . . . A 150 GLU N . 30133 1 1613 . 1 . 1 151 151 SER H H 1 7.826 1.305 . 9 . . . . A 151 SER H . 30133 1 1614 . 1 . 1 151 151 SER HA H 1 4.464 0.000 . 9 . . . . A 151 SER HA . 30133 1 1615 . 1 . 1 151 151 SER HB2 H 1 4.276 0.000 . 9 . . . . A 151 SER HB2 . 30133 1 1616 . 1 . 1 151 151 SER HB3 H 1 3.854 0.000 . 9 . . . . A 151 SER HB3 . 30133 1 1617 . 1 . 1 151 151 SER C C 13 174.074 0.000 . 9 . . . . A 151 SER C . 30133 1 1618 . 1 . 1 151 151 SER CA C 13 64.553 0.917 . 9 . . . . A 151 SER CA . 30133 1 1619 . 1 . 1 151 151 SER CB C 13 66.715 2.431 . 9 . . . . A 151 SER CB . 30133 1 1620 . 1 . 1 151 151 SER N N 15 115.263 0.000 . 9 . . . . A 151 SER N . 30133 1 1621 . 1 . 1 152 152 TYR H H 1 6.981 1.088 . 9 . . . . A 152 TYR H . 30133 1 1622 . 1 . 1 152 152 TYR HA H 1 4.269 0.000 . 9 . . . . A 152 TYR HA . 30133 1 1623 . 1 . 1 152 152 TYR HB2 H 1 3.002 0.000 . 9 . . . . A 152 TYR HB2 . 30133 1 1624 . 1 . 1 152 152 TYR HB3 H 1 2.948 0.000 . 9 . . . . A 152 TYR HB3 . 30133 1 1625 . 1 . 1 152 152 TYR C C 13 178.776 0.000 . 9 . . . . A 152 TYR C . 30133 1 1626 . 1 . 1 152 152 TYR CA C 13 61.487 0.103 . 9 . . . . A 152 TYR CA . 30133 1 1627 . 1 . 1 152 152 TYR CB C 13 40.390 1.114 . 9 . . . . A 152 TYR CB . 30133 1 1628 . 1 . 1 152 152 TYR CG C 13 123.287 0.000 . 9 . . . . A 152 TYR CG . 30133 1 1629 . 1 . 1 152 152 TYR CD1 C 13 133.511 0.000 . 9 . . . . A 152 TYR CD1 . 30133 1 1630 . 1 . 1 152 152 TYR CD2 C 13 133.202 0.000 . 9 . . . . A 152 TYR CD2 . 30133 1 1631 . 1 . 1 152 152 TYR CE1 C 13 113.745 0.000 . 9 . . . . A 152 TYR CE1 . 30133 1 1632 . 1 . 1 152 152 TYR CE2 C 13 118.303 0.000 . 9 . . . . A 152 TYR CE2 . 30133 1 1633 . 1 . 1 152 152 TYR N N 15 122.104 0.000 . 9 . . . . A 152 TYR N . 30133 1 1634 . 1 . 1 153 153 ARG H H 1 7.397 1.789 . 9 . . . . A 153 ARG H . 30133 1 1635 . 1 . 1 153 153 ARG HA H 1 4.992 0.000 . 9 . . . . A 153 ARG HA . 30133 1 1636 . 1 . 1 153 153 ARG HB2 H 1 1.962 0.220 . 9 . . . . A 153 ARG HB2 . 30133 1 1637 . 1 . 1 153 153 ARG HB3 H 1 1.228 0.000 . 9 . . . . A 153 ARG HB3 . 30133 1 1638 . 1 . 1 153 153 ARG HG2 H 1 0.509 0.000 . 9 . . . . A 153 ARG HG2 . 30133 1 1639 . 1 . 1 153 153 ARG HG3 H 1 0.454 0.000 . 9 . . . . A 153 ARG HG3 . 30133 1 1640 . 1 . 1 153 153 ARG HD2 H 1 2.744 0.000 . 9 . . . . A 153 ARG HD2 . 30133 1 1641 . 1 . 1 153 153 ARG HD3 H 1 2.690 0.000 . 9 . . . . A 153 ARG HD3 . 30133 1 1642 . 1 . 1 153 153 ARG C C 13 177.156 0.000 . 9 . . . . A 153 ARG C . 30133 1 1643 . 1 . 1 153 153 ARG CA C 13 62.719 0.366 . 9 . . . . A 153 ARG CA . 30133 1 1644 . 1 . 1 153 153 ARG CB C 13 32.813 0.413 . 9 . . . . A 153 ARG CB . 30133 1 1645 . 1 . 1 153 153 ARG CG C 13 27.640 0.096 . 9 . . . . A 153 ARG CG . 30133 1 1646 . 1 . 1 153 153 ARG CD C 13 38.669 0.084 . 9 . . . . A 153 ARG CD . 30133 1 1647 . 1 . 1 153 153 ARG N N 15 121.744 0.012 . 9 . . . . A 153 ARG N . 30133 1 1648 . 1 . 1 154 154 LEU H H 1 7.571 2.265 . 9 . . . . A 154 LEU H . 30133 1 1649 . 1 . 1 154 154 LEU HB2 H 1 0.821 0.000 . 9 . . . . A 154 LEU HB2 . 30133 1 1650 . 1 . 1 154 154 LEU HB3 H 1 0.774 0.000 . 9 . . . . A 154 LEU HB3 . 30133 1 1651 . 1 . 1 154 154 LEU HG H 1 1.258 0.377 . 9 . . . . A 154 LEU HG . 30133 1 1652 . 1 . 1 154 154 LEU HD11 H 1 0.638 0.401 . 9 . . . . A 154 LEU HD11 . 30133 1 1653 . 1 . 1 154 154 LEU HD12 H 1 0.638 0.401 . 9 . . . . A 154 LEU HD12 . 30133 1 1654 . 1 . 1 154 154 LEU HD13 H 1 0.638 0.401 . 9 . . . . A 154 LEU HD13 . 30133 1 1655 . 1 . 1 154 154 LEU HD21 H 1 0.659 0.362 . 9 . . . . A 154 LEU HD21 . 30133 1 1656 . 1 . 1 154 154 LEU HD22 H 1 0.659 0.362 . 9 . . . . A 154 LEU HD22 . 30133 1 1657 . 1 . 1 154 154 LEU HD23 H 1 0.659 0.362 . 9 . . . . A 154 LEU HD23 . 30133 1 1658 . 1 . 1 154 154 LEU C C 13 174.392 0.000 . 9 . . . . A 154 LEU C . 30133 1 1659 . 1 . 1 154 154 LEU CA C 13 58.208 0.285 . 9 . . . . A 154 LEU CA . 30133 1 1660 . 1 . 1 154 154 LEU CB C 13 35.789 0.253 . 9 . . . . A 154 LEU CB . 30133 1 1661 . 1 . 1 154 154 LEU CG C 13 21.380 0.007 . 9 . . . . A 154 LEU CG . 30133 1 1662 . 1 . 1 154 154 LEU CD1 C 13 20.976 0.006 . 9 . . . . A 154 LEU CD1 . 30133 1 1663 . 1 . 1 154 154 LEU CD2 C 13 20.872 0.104 . 9 . . . . A 154 LEU CD2 . 30133 1 1664 . 1 . 1 154 154 LEU N N 15 116.096 0.002 . 9 . . . . A 154 LEU N . 30133 1 1665 . 1 . 1 155 155 ALA H H 1 8.105 1.313 . 9 . . . . A 155 ALA H . 30133 1 1666 . 1 . 1 155 155 ALA HA H 1 3.628 0.000 . 9 . . . . A 155 ALA HA . 30133 1 1667 . 1 . 1 155 155 ALA HB1 H 1 1.603 0.000 . 9 . . . . A 155 ALA HB1 . 30133 1 1668 . 1 . 1 155 155 ALA HB2 H 1 1.603 0.000 . 9 . . . . A 155 ALA HB2 . 30133 1 1669 . 1 . 1 155 155 ALA HB3 H 1 1.603 0.000 . 9 . . . . A 155 ALA HB3 . 30133 1 1670 . 1 . 1 155 155 ALA C C 13 178.585 0.000 . 9 . . . . A 155 ALA C . 30133 1 1671 . 1 . 1 155 155 ALA CA C 13 55.190 0.109 . 9 . . . . A 155 ALA CA . 30133 1 1672 . 1 . 1 155 155 ALA CB C 13 17.925 0.098 . 9 . . . . A 155 ALA CB . 30133 1 1673 . 1 . 1 155 155 ALA N N 15 123.573 0.000 . 9 . . . . A 155 ALA N . 30133 1 1674 . 1 . 1 156 156 CYS H H 1 7.932 1.367 . 9 . . . . A 156 CYS H . 30133 1 1675 . 1 . 1 156 156 CYS HA H 1 3.987 0.000 . 9 . . . . A 156 CYS HA . 30133 1 1676 . 1 . 1 156 156 CYS HB2 H 1 2.222 0.244 . 9 . . . . A 156 CYS HB2 . 30133 1 1677 . 1 . 1 156 156 CYS HB3 H 1 2.125 0.163 . 9 . . . . A 156 CYS HB3 . 30133 1 1678 . 1 . 1 156 156 CYS C C 13 178.141 0.000 . 9 . . . . A 156 CYS C . 30133 1 1679 . 1 . 1 156 156 CYS CA C 13 63.754 0.038 . 9 . . . . A 156 CYS CA . 30133 1 1680 . 1 . 1 156 156 CYS CB C 13 26.884 0.062 . 9 . . . . A 156 CYS CB . 30133 1 1681 . 1 . 1 156 156 CYS N N 15 115.068 0.007 . 9 . . . . A 156 CYS N . 30133 1 1682 . 1 . 1 157 157 THR H H 1 7.630 1.738 . 9 . . . . A 157 THR H . 30133 1 1683 . 1 . 1 157 157 THR HA H 1 4.132 0.000 . 9 . . . . A 157 THR HA . 30133 1 1684 . 1 . 1 157 157 THR HB H 1 3.811 0.000 . 9 . . . . A 157 THR HB . 30133 1 1685 . 1 . 1 157 157 THR HG21 H 1 1.061 0.047 . 9 . . . . A 157 THR HG21 . 30133 1 1686 . 1 . 1 157 157 THR HG22 H 1 1.061 0.047 . 9 . . . . A 157 THR HG22 . 30133 1 1687 . 1 . 1 157 157 THR HG23 H 1 1.061 0.047 . 9 . . . . A 157 THR HG23 . 30133 1 1688 . 1 . 1 157 157 THR C C 13 175.885 0.000 . 9 . . . . A 157 THR C . 30133 1 1689 . 1 . 1 157 157 THR CA C 13 65.772 0.026 . 9 . . . . A 157 THR CA . 30133 1 1690 . 1 . 1 157 157 THR CB C 13 69.054 0.082 . 9 . . . . A 157 THR CB . 30133 1 1691 . 1 . 1 157 157 THR CG2 C 13 21.272 0.020 . 9 . . . . A 157 THR CG2 . 30133 1 1692 . 1 . 1 157 157 THR N N 15 115.602 0.001 . 9 . . . . A 157 THR N . 30133 1 1693 . 1 . 1 158 158 SER H H 1 7.055 0.877 . 9 . . . . A 158 SER H . 30133 1 1694 . 1 . 1 158 158 SER CA C 13 61.943 0.008 . 9 . . . . A 158 SER CA . 30133 1 1695 . 1 . 1 158 158 SER CB C 13 62.364 0.013 . 9 . . . . A 158 SER CB . 30133 1 1696 . 1 . 1 158 158 SER N N 15 117.572 0.016 . 9 . . . . A 158 SER N . 30133 1 1697 . 1 . 1 159 159 LEU H H 1 1.710 1.477 . 9 . . . . A 159 LEU H . 30133 1 1698 . 1 . 1 159 159 LEU HA H 1 3.944 0.000 . 9 . . . . A 159 LEU HA . 30133 1 1699 . 1 . 1 159 159 LEU HB2 H 1 1.107 0.133 . 9 . . . . A 159 LEU HB2 . 30133 1 1700 . 1 . 1 159 159 LEU HB3 H 1 1.091 0.121 . 9 . . . . A 159 LEU HB3 . 30133 1 1701 . 1 . 1 159 159 LEU HG H 1 1.465 0.116 . 9 . . . . A 159 LEU HG . 30133 1 1702 . 1 . 1 159 159 LEU HD11 H 1 0.534 0.186 . 9 . . . . A 159 LEU HD11 . 30133 1 1703 . 1 . 1 159 159 LEU HD12 H 1 0.534 0.186 . 9 . . . . A 159 LEU HD12 . 30133 1 1704 . 1 . 1 159 159 LEU HD13 H 1 0.534 0.186 . 9 . . . . A 159 LEU HD13 . 30133 1 1705 . 1 . 1 159 159 LEU HD21 H 1 0.567 0.144 . 9 . . . . A 159 LEU HD21 . 30133 1 1706 . 1 . 1 159 159 LEU HD22 H 1 0.567 0.144 . 9 . . . . A 159 LEU HD22 . 30133 1 1707 . 1 . 1 159 159 LEU HD23 H 1 0.567 0.144 . 9 . . . . A 159 LEU HD23 . 30133 1 1708 . 1 . 1 159 159 LEU C C 13 177.537 0.000 . 9 . . . . A 159 LEU C . 30133 1 1709 . 1 . 1 159 159 LEU CA C 13 56.698 0.063 . 9 . . . . A 159 LEU CA . 30133 1 1710 . 1 . 1 159 159 LEU CB C 13 42.871 0.038 . 9 . . . . A 159 LEU CB . 30133 1 1711 . 1 . 1 159 159 LEU CG C 13 27.409 0.055 . 9 . . . . A 159 LEU CG . 30133 1 1712 . 1 . 1 159 159 LEU CD1 C 13 26.755 0.066 . 9 . . . . A 159 LEU CD1 . 30133 1 1713 . 1 . 1 159 159 LEU CD2 C 13 26.704 0.235 . 9 . . . . A 159 LEU CD2 . 30133 1 1714 . 1 . 1 160 160 GLY H H 1 7.429 0.514 . 9 . . . . A 160 GLY H . 30133 1 1715 . 1 . 1 160 160 GLY HA2 H 1 3.585 0.000 . 9 . . . . A 160 GLY HA2 . 30133 1 1716 . 1 . 1 160 160 GLY HA3 H 1 4.538 0.000 . 9 . . . . A 160 GLY HA3 . 30133 1 1717 . 1 . 1 160 160 GLY C C 13 173.598 0.000 . 9 . . . . A 160 GLY C . 30133 1 1718 . 1 . 1 160 160 GLY CA C 13 43.999 0.040 . 9 . . . . A 160 GLY CA . 30133 1 1719 . 1 . 1 160 160 GLY N N 15 107.140 0.007 . 9 . . . . A 160 GLY N . 30133 1 1720 . 1 . 1 161 161 ALA H H 1 7.832 1.796 . 9 . . . . A 161 ALA H . 30133 1 1721 . 1 . 1 161 161 ALA HA H 1 3.893 0.000 . 9 . . . . A 161 ALA HA . 30133 1 1722 . 1 . 1 161 161 ALA HB1 H 1 1.423 0.000 . 9 . . . . A 161 ALA HB1 . 30133 1 1723 . 1 . 1 161 161 ALA HB2 H 1 1.423 0.000 . 9 . . . . A 161 ALA HB2 . 30133 1 1724 . 1 . 1 161 161 ALA HB3 H 1 1.423 0.000 . 9 . . . . A 161 ALA HB3 . 30133 1 1725 . 1 . 1 161 161 ALA C C 13 180.110 0.000 . 9 . . . . A 161 ALA C . 30133 1 1726 . 1 . 1 161 161 ALA CA C 13 55.919 0.071 . 9 . . . . A 161 ALA CA . 30133 1 1727 . 1 . 1 161 161 ALA CB C 13 18.935 0.094 . 9 . . . . A 161 ALA CB . 30133 1 1728 . 1 . 1 161 161 ALA N N 15 125.075 0.007 . 9 . . . . A 161 ALA N . 30133 1 1729 . 1 . 1 162 162 GLU H H 1 8.110 2.033 . 9 . . . . A 162 GLU H . 30133 1 1730 . 1 . 1 162 162 GLU HA H 1 4.104 0.000 . 9 . . . . A 162 GLU HA . 30133 1 1731 . 1 . 1 162 162 GLU HB2 H 1 1.314 0.000 . 9 . . . . A 162 GLU HB2 . 30133 1 1732 . 1 . 1 162 162 GLU HB3 H 1 1.259 0.000 . 9 . . . . A 162 GLU HB3 . 30133 1 1733 . 1 . 1 162 162 GLU HG2 H 1 2.412 0.025 . 9 . . . . A 162 GLU HG2 . 30133 1 1734 . 1 . 1 162 162 GLU HG3 H 1 2.314 0.000 . 9 . . . . A 162 GLU HG3 . 30133 1 1735 . 1 . 1 162 162 GLU C C 13 179.348 0.000 . 9 . . . . A 162 GLU C . 30133 1 1736 . 1 . 1 162 162 GLU CA C 13 60.178 0.052 . 9 . . . . A 162 GLU CA . 30133 1 1737 . 1 . 1 162 162 GLU CB C 13 29.001 0.059 . 9 . . . . A 162 GLU CB . 30133 1 1738 . 1 . 1 162 162 GLU CG C 13 36.786 0.008 . 9 . . . . A 162 GLU CG . 30133 1 1739 . 1 . 1 162 162 GLU N N 15 117.667 0.022 . 9 . . . . A 162 GLU N . 30133 1 1740 . 1 . 1 163 163 LYS H H 1 7.114 2.086 . 9 . . . . A 163 LYS H . 30133 1 1741 . 1 . 1 163 163 LYS HA H 1 4.331 0.000 . 9 . . . . A 163 LYS HA . 30133 1 1742 . 1 . 1 163 163 LYS HB2 H 1 1.869 0.000 . 9 . . . . A 163 LYS HB2 . 30133 1 1743 . 1 . 1 163 163 LYS HB3 H 1 1.783 0.000 . 9 . . . . A 163 LYS HB3 . 30133 1 1744 . 1 . 1 163 163 LYS HG2 H 1 0.878 0.003 . 9 . . . . A 163 LYS HG2 . 30133 1 1745 . 1 . 1 163 163 LYS HG3 H 1 0.829 0.003 . 9 . . . . A 163 LYS HG3 . 30133 1 1746 . 1 . 1 163 163 LYS HD2 H 1 1.144 0.213 . 9 . . . . A 163 LYS HD2 . 30133 1 1747 . 1 . 1 163 163 LYS HD3 H 1 1.054 0.170 . 9 . . . . A 163 LYS HD3 . 30133 1 1748 . 1 . 1 163 163 LYS HE2 H 1 3.120 0.000 . 9 . . . . A 163 LYS HE2 . 30133 1 1749 . 1 . 1 163 163 LYS HE3 H 1 3.065 0.000 . 9 . . . . A 163 LYS HE3 . 30133 1 1750 . 1 . 1 163 163 LYS C C 13 179.888 0.000 . 9 . . . . A 163 LYS C . 30133 1 1751 . 1 . 1 163 163 LYS CA C 13 59.218 0.024 . 9 . . . . A 163 LYS CA . 30133 1 1752 . 1 . 1 163 163 LYS CB C 13 32.707 0.059 . 9 . . . . A 163 LYS CB . 30133 1 1753 . 1 . 1 163 163 LYS CG C 13 23.638 0.004 . 9 . . . . A 163 LYS CG . 30133 1 1754 . 1 . 1 163 163 LYS CD C 13 26.666 0.017 . 9 . . . . A 163 LYS CD . 30133 1 1755 . 1 . 1 163 163 LYS CE C 13 42.724 0.168 . 9 . . . . A 163 LYS CE . 30133 1 1756 . 1 . 1 163 163 LYS N N 15 119.727 0.000 . 9 . . . . A 163 LYS N . 30133 1 1757 . 1 . 1 164 164 VAL H H 1 7.539 1.914 . 9 . . . . A 164 VAL H . 30133 1 1758 . 1 . 1 164 164 VAL HA H 1 3.604 0.000 . 9 . . . . A 164 VAL HA . 30133 1 1759 . 1 . 1 164 164 VAL HB H 1 2.029 0.346 . 9 . . . . A 164 VAL HB . 30133 1 1760 . 1 . 1 164 164 VAL HG11 H 1 1.173 0.000 . 9 . . . . A 164 VAL HG11 . 30133 1 1761 . 1 . 1 164 164 VAL HG12 H 1 1.173 0.000 . 9 . . . . A 164 VAL HG12 . 30133 1 1762 . 1 . 1 164 164 VAL HG13 H 1 1.173 0.000 . 9 . . . . A 164 VAL HG13 . 30133 1 1763 . 1 . 1 164 164 VAL HG21 H 1 1.148 0.019 . 9 . . . . A 164 VAL HG21 . 30133 1 1764 . 1 . 1 164 164 VAL HG22 H 1 1.148 0.019 . 9 . . . . A 164 VAL HG22 . 30133 1 1765 . 1 . 1 164 164 VAL HG23 H 1 1.148 0.019 . 9 . . . . A 164 VAL HG23 . 30133 1 1766 . 1 . 1 164 164 VAL C C 13 177.537 0.000 . 9 . . . . A 164 VAL C . 30133 1 1767 . 1 . 1 164 164 VAL CA C 13 67.872 0.012 . 9 . . . . A 164 VAL CA . 30133 1 1768 . 1 . 1 164 164 VAL CB C 13 31.914 0.098 . 9 . . . . A 164 VAL CB . 30133 1 1769 . 1 . 1 164 164 VAL CG1 C 13 24.890 0.061 . 9 . . . . A 164 VAL CG1 . 30133 1 1770 . 1 . 1 164 164 VAL CG2 C 13 21.702 0.007 . 9 . . . . A 164 VAL CG2 . 30133 1 1771 . 1 . 1 164 164 VAL N N 15 120.464 0.000 . 9 . . . . A 164 VAL N . 30133 1 1772 . 1 . 1 165 165 GLU H H 1 7.465 1.435 . 9 . . . . A 165 GLU H . 30133 1 1773 . 1 . 1 165 165 GLU HA H 1 4.237 0.000 . 9 . . . . A 165 GLU HA . 30133 1 1774 . 1 . 1 165 165 GLU HB2 H 1 2.228 0.000 . 9 . . . . A 165 GLU HB2 . 30133 1 1775 . 1 . 1 165 165 GLU HB3 H 1 2.174 0.000 . 9 . . . . A 165 GLU HB3 . 30133 1 1776 . 1 . 1 165 165 GLU HG2 H 1 2.504 0.007 . 9 . . . . A 165 GLU HG2 . 30133 1 1777 . 1 . 1 165 165 GLU HG3 H 1 2.442 0.005 . 9 . . . . A 165 GLU HG3 . 30133 1 1778 . 1 . 1 165 165 GLU C C 13 179.920 0.000 . 9 . . . . A 165 GLU C . 30133 1 1779 . 1 . 1 165 165 GLU CA C 13 59.100 0.039 . 9 . . . . A 165 GLU CA . 30133 1 1780 . 1 . 1 165 165 GLU CB C 13 28.863 0.059 . 9 . . . . A 165 GLU CB . 30133 1 1781 . 1 . 1 165 165 GLU CG C 13 35.673 0.001 . 9 . . . . A 165 GLU CG . 30133 1 1782 . 1 . 1 165 165 GLU N N 15 117.925 0.000 . 9 . . . . A 165 GLU N . 30133 1 1783 . 1 . 1 166 166 VAL H H 1 7.042 1.776 . 9 . . . . A 166 VAL H . 30133 1 1784 . 1 . 1 166 166 VAL HA H 1 4.261 0.000 . 9 . . . . A 166 VAL HA . 30133 1 1785 . 1 . 1 166 166 VAL HB H 1 2.213 0.000 . 9 . . . . A 166 VAL HB . 30133 1 1786 . 1 . 1 166 166 VAL HG11 H 1 1.259 0.000 . 9 . . . . A 166 VAL HG11 . 30133 1 1787 . 1 . 1 166 166 VAL HG12 H 1 1.259 0.000 . 9 . . . . A 166 VAL HG12 . 30133 1 1788 . 1 . 1 166 166 VAL HG13 H 1 1.259 0.000 . 9 . . . . A 166 VAL HG13 . 30133 1 1789 . 1 . 1 166 166 VAL HG21 H 1 1.212 0.000 . 9 . . . . A 166 VAL HG21 . 30133 1 1790 . 1 . 1 166 166 VAL HG22 H 1 1.212 0.000 . 9 . . . . A 166 VAL HG22 . 30133 1 1791 . 1 . 1 166 166 VAL HG23 H 1 1.212 0.000 . 9 . . . . A 166 VAL HG23 . 30133 1 1792 . 1 . 1 166 166 VAL C C 13 175.885 0.000 . 9 . . . . A 166 VAL C . 30133 1 1793 . 1 . 1 166 166 VAL CA C 13 58.262 0.521 . 9 . . . . A 166 VAL CA . 30133 1 1794 . 1 . 1 166 166 VAL CB C 13 31.526 0.762 . 9 . . . . A 166 VAL CB . 30133 1 1795 . 1 . 1 166 166 VAL CG1 C 13 22.793 0.003 . 9 . . . . A 166 VAL CG1 . 30133 1 1796 . 1 . 1 166 166 VAL CG2 C 13 21.209 0.001 . 9 . . . . A 166 VAL CG2 . 30133 1 1797 . 1 . 1 166 166 VAL N N 15 121.588 0.002 . 9 . . . . A 166 VAL N . 30133 1 1798 . 1 . 1 167 167 LEU H H 1 7.034 2.332 . 9 . . . . A 167 LEU H . 30133 1 1799 . 1 . 1 167 167 LEU HA H 1 4.499 0.000 . 9 . . . . A 167 LEU HA . 30133 1 1800 . 1 . 1 167 167 LEU HB2 H 1 1.566 0.252 . 9 . . . . A 167 LEU HB2 . 30133 1 1801 . 1 . 1 167 167 LEU HB3 H 1 1.469 0.189 . 9 . . . . A 167 LEU HB3 . 30133 1 1802 . 1 . 1 167 167 LEU HG H 1 1.470 0.000 . 9 . . . . A 167 LEU HG . 30133 1 1803 . 1 . 1 167 167 LEU HD11 H 1 1.262 0.047 . 9 . . . . A 167 LEU HD11 . 30133 1 1804 . 1 . 1 167 167 LEU HD12 H 1 1.262 0.047 . 9 . . . . A 167 LEU HD12 . 30133 1 1805 . 1 . 1 167 167 LEU HD13 H 1 1.262 0.047 . 9 . . . . A 167 LEU HD13 . 30133 1 1806 . 1 . 1 167 167 LEU HD21 H 1 1.194 0.026 . 9 . . . . A 167 LEU HD21 . 30133 1 1807 . 1 . 1 167 167 LEU HD22 H 1 1.194 0.026 . 9 . . . . A 167 LEU HD22 . 30133 1 1808 . 1 . 1 167 167 LEU HD23 H 1 1.194 0.026 . 9 . . . . A 167 LEU HD23 . 30133 1 1809 . 1 . 1 167 167 LEU C C 13 178.840 0.000 . 9 . . . . A 167 LEU C . 30133 1 1810 . 1 . 1 167 167 LEU CA C 13 58.088 0.090 . 9 . . . . A 167 LEU CA . 30133 1 1811 . 1 . 1 167 167 LEU CB C 13 42.937 0.014 . 9 . . . . A 167 LEU CB . 30133 1 1812 . 1 . 1 167 167 LEU CG C 13 36.284 0.050 . 9 . . . . A 167 LEU CG . 30133 1 1813 . 1 . 1 167 167 LEU CD1 C 13 26.765 0.129 . 9 . . . . A 167 LEU CD1 . 30133 1 1814 . 1 . 1 167 167 LEU CD2 C 13 26.736 0.088 . 9 . . . . A 167 LEU CD2 . 30133 1 1815 . 1 . 1 167 167 LEU N N 15 122.435 0.008 . 9 . . . . A 167 LEU N . 30133 1 1816 . 1 . 1 168 168 ARG H H 1 8.575 1.919 . 9 . . . . A 168 ARG H . 30133 1 1817 . 1 . 1 168 168 ARG HA H 1 3.284 0.000 . 9 . . . . A 168 ARG HA . 30133 1 1818 . 1 . 1 168 168 ARG HB2 H 1 2.090 0.109 . 9 . . . . A 168 ARG HB2 . 30133 1 1819 . 1 . 1 168 168 ARG HB3 H 1 1.767 0.000 . 9 . . . . A 168 ARG HB3 . 30133 1 1820 . 1 . 1 168 168 ARG HG2 H 1 1.259 0.000 . 9 . . . . A 168 ARG HG2 . 30133 1 1821 . 1 . 1 168 168 ARG HG3 H 1 1.204 0.000 . 9 . . . . A 168 ARG HG3 . 30133 1 1822 . 1 . 1 168 168 ARG HD2 H 1 3.135 0.083 . 9 . . . . A 168 ARG HD2 . 30133 1 1823 . 1 . 1 168 168 ARG HD3 H 1 3.093 0.052 . 9 . . . . A 168 ARG HD3 . 30133 1 1824 . 1 . 1 168 168 ARG C C 13 178.458 0.000 . 9 . . . . A 168 ARG C . 30133 1 1825 . 1 . 1 168 168 ARG CA C 13 59.433 0.021 . 9 . . . . A 168 ARG CA . 30133 1 1826 . 1 . 1 168 168 ARG CB C 13 30.004 0.043 . 9 . . . . A 168 ARG CB . 30133 1 1827 . 1 . 1 168 168 ARG CG C 13 26.901 0.007 . 9 . . . . A 168 ARG CG . 30133 1 1828 . 1 . 1 168 168 ARG CD C 13 43.029 0.008 . 9 . . . . A 168 ARG CD . 30133 1 1829 . 1 . 1 168 168 ARG N N 15 121.583 0.008 . 9 . . . . A 168 ARG N . 30133 1 1830 . 1 . 1 169 169 ALA H H 1 7.672 1.232 . 9 . . . . A 169 ALA H . 30133 1 1831 . 1 . 1 169 169 ALA HA H 1 4.081 0.000 . 9 . . . . A 169 ALA HA . 30133 1 1832 . 1 . 1 169 169 ALA HB1 H 1 1.486 0.000 . 9 . . . . A 169 ALA HB1 . 30133 1 1833 . 1 . 1 169 169 ALA HB2 H 1 1.486 0.000 . 9 . . . . A 169 ALA HB2 . 30133 1 1834 . 1 . 1 169 169 ALA HB3 H 1 1.486 0.000 . 9 . . . . A 169 ALA HB3 . 30133 1 1835 . 1 . 1 169 169 ALA C C 13 180.603 0.000 . 9 . . . . A 169 ALA C . 30133 1 1836 . 1 . 1 169 169 ALA CA C 13 55.961 1.898 . 9 . . . . A 169 ALA CA . 30133 1 1837 . 1 . 1 169 169 ALA CB C 13 18.029 0.094 . 9 . . . . A 169 ALA CB . 30133 1 1838 . 1 . 1 169 169 ALA N N 15 121.124 0.004 . 9 . . . . A 169 ALA N . 30133 1 1839 . 1 . 1 170 170 ALA H H 1 7.339 1.195 . 9 . . . . A 170 ALA H . 30133 1 1840 . 1 . 1 170 170 ALA HA H 1 4.144 0.000 . 9 . . . . A 170 ALA HA . 30133 1 1841 . 1 . 1 170 170 ALA HB1 H 1 1.752 0.000 . 9 . . . . A 170 ALA HB1 . 30133 1 1842 . 1 . 1 170 170 ALA HB2 H 1 1.752 0.000 . 9 . . . . A 170 ALA HB2 . 30133 1 1843 . 1 . 1 170 170 ALA HB3 H 1 1.752 0.000 . 9 . . . . A 170 ALA HB3 . 30133 1 1844 . 1 . 1 170 170 ALA C C 13 175.250 0.000 . 9 . . . . A 170 ALA C . 30133 1 1845 . 1 . 1 170 170 ALA CA C 13 59.724 0.440 . 9 . . . . A 170 ALA CA . 30133 1 1846 . 1 . 1 170 170 ALA CB C 13 18.688 0.132 . 9 . . . . A 170 ALA CB . 30133 1 1847 . 1 . 1 170 170 ALA N N 15 120.810 0.000 . 9 . . . . A 170 ALA N . 30133 1 1848 . 1 . 1 171 171 PHE H H 1 7.156 0.792 . 9 . . . . A 171 PHE H . 30133 1 1849 . 1 . 1 171 171 PHE HA H 1 4.456 0.000 . 9 . . . . A 171 PHE HA . 30133 1 1850 . 1 . 1 171 171 PHE HB2 H 1 2.875 0.059 . 9 . . . . A 171 PHE HB2 . 30133 1 1851 . 1 . 1 171 171 PHE HB3 H 1 2.851 0.037 . 9 . . . . A 171 PHE HB3 . 30133 1 1852 . 1 . 1 171 171 PHE C C 13 175.043 0.000 . 9 . . . . A 171 PHE C . 30133 1 1853 . 1 . 1 171 171 PHE CA C 13 57.064 0.055 . 9 . . . . A 171 PHE CA . 30133 1 1854 . 1 . 1 171 171 PHE CB C 13 40.724 0.037 . 9 . . . . A 171 PHE CB . 30133 1 1855 . 1 . 1 171 171 PHE CG C 13 134.865 0.000 . 9 . . . . A 171 PHE CG . 30133 1 1856 . 1 . 1 171 171 PHE CD1 C 13 132.923 0.000 . 9 . . . . A 171 PHE CD1 . 30133 1 1857 . 1 . 1 171 171 PHE CD2 C 13 131.680 0.000 . 9 . . . . A 171 PHE CD2 . 30133 1 1858 . 1 . 1 171 171 PHE CE1 C 13 129.688 0.000 . 9 . . . . A 171 PHE CE1 . 30133 1 1859 . 1 . 1 171 171 PHE CE2 C 13 130.801 0.000 . 9 . . . . A 171 PHE CE2 . 30133 1 1860 . 1 . 1 171 171 PHE CZ C 13 121.945 0.018 . 9 . . . . A 171 PHE CZ . 30133 1 1861 . 1 . 1 171 171 PHE N N 15 118.133 0.013 . 9 . . . . A 171 PHE N . 30133 1 1862 . 1 . 1 172 172 ARG H H 1 7.192 2.057 . 9 . . . . A 172 ARG H . 30133 1 1863 . 1 . 1 172 172 ARG HA H 1 4.038 0.000 . 9 . . . . A 172 ARG HA . 30133 1 1864 . 1 . 1 172 172 ARG HB2 H 1 1.939 0.000 . 9 . . . . A 172 ARG HB2 . 30133 1 1865 . 1 . 1 172 172 ARG HB3 H 1 1.896 0.000 . 9 . . . . A 172 ARG HB3 . 30133 1 1866 . 1 . 1 172 172 ARG HG2 H 1 2.090 0.216 . 9 . . . . A 172 ARG HG2 . 30133 1 1867 . 1 . 1 172 172 ARG HG3 H 1 2.038 0.239 . 9 . . . . A 172 ARG HG3 . 30133 1 1868 . 1 . 1 172 172 ARG HD2 H 1 1.640 0.748 . 9 . . . . A 172 ARG HD2 . 30133 1 1869 . 1 . 1 172 172 ARG HD3 H 1 1.504 0.680 . 9 . . . . A 172 ARG HD3 . 30133 1 1870 . 1 . 1 172 172 ARG C C 13 178.141 0.000 . 9 . . . . A 172 ARG C . 30133 1 1871 . 1 . 1 172 172 ARG CA C 13 57.071 1.036 . 9 . . . . A 172 ARG CA . 30133 1 1872 . 1 . 1 172 172 ARG CB C 13 30.647 0.097 . 9 . . . . A 172 ARG CB . 30133 1 1873 . 1 . 1 172 172 ARG CG C 13 30.235 0.014 . 9 . . . . A 172 ARG CG . 30133 1 1874 . 1 . 1 172 172 ARG CD C 13 44.175 0.008 . 9 . . . . A 172 ARG CD . 30133 1 1875 . 1 . 1 172 172 ARG N N 15 115.045 0.014 . 9 . . . . A 172 ARG N . 30133 1 1876 . 1 . 1 173 173 SER H H 1 7.495 0.871 . 9 . . . . A 173 SER H . 30133 1 1877 . 1 . 1 173 173 SER HA H 1 5.644 0.000 . 9 . . . . A 173 SER HA . 30133 1 1878 . 1 . 1 173 173 SER HB2 H 1 3.987 0.000 . 9 . . . . A 173 SER HB2 . 30133 1 1879 . 1 . 1 173 173 SER HB3 H 1 3.925 0.000 . 9 . . . . A 173 SER HB3 . 30133 1 1880 . 1 . 1 173 173 SER C C 13 175.027 0.000 . 9 . . . . A 173 SER C . 30133 1 1881 . 1 . 1 173 173 SER CA C 13 59.908 0.048 . 9 . . . . A 173 SER CA . 30133 1 1882 . 1 . 1 173 173 SER CB C 13 63.572 0.072 . 9 . . . . A 173 SER CB . 30133 1 1883 . 1 . 1 173 173 SER N N 15 113.025 0.011 . 9 . . . . A 173 SER N . 30133 1 1884 . 1 . 1 174 174 ARG H H 1 6.697 1.607 . 9 . . . . A 174 ARG H . 30133 1 1885 . 1 . 1 174 174 ARG HA H 1 5.113 0.000 . 9 . . . . A 174 ARG HA . 30133 1 1886 . 1 . 1 174 174 ARG HB2 H 1 1.626 0.000 . 9 . . . . A 174 ARG HB2 . 30133 1 1887 . 1 . 1 174 174 ARG HB3 H 1 1.576 0.000 . 9 . . . . A 174 ARG HB3 . 30133 1 1888 . 1 . 1 174 174 ARG HG2 H 1 1.941 0.242 . 9 . . . . A 174 ARG HG2 . 30133 1 1889 . 1 . 1 174 174 ARG HG3 H 1 1.925 0.224 . 9 . . . . A 174 ARG HG3 . 30133 1 1890 . 1 . 1 174 174 ARG HD2 H 1 3.055 0.290 . 9 . . . . A 174 ARG HD2 . 30133 1 1891 . 1 . 1 174 174 ARG HD3 H 1 2.946 0.252 . 9 . . . . A 174 ARG HD3 . 30133 1 1892 . 1 . 1 174 174 ARG C C 13 176.362 0.000 . 9 . . . . A 174 ARG C . 30133 1 1893 . 1 . 1 174 174 ARG CA C 13 56.800 0.078 . 9 . . . . A 174 ARG CA . 30133 1 1894 . 1 . 1 174 174 ARG CB C 13 30.218 0.070 . 9 . . . . A 174 ARG CB . 30133 1 1895 . 1 . 1 174 174 ARG CG C 13 28.848 0.005 . 9 . . . . A 174 ARG CG . 30133 1 1896 . 1 . 1 174 174 ARG CD C 13 41.252 0.011 . 9 . . . . A 174 ARG CD . 30133 1 1897 . 1 . 1 174 174 ARG N N 15 121.117 0.006 . 9 . . . . A 174 ARG N . 30133 1 1898 . 1 . 1 175 175 TYR H H 1 7.336 0.979 . 9 . . . . A 175 TYR H . 30133 1 1899 . 1 . 1 175 175 TYR HA H 1 4.597 0.000 . 9 . . . . A 175 TYR HA . 30133 1 1900 . 1 . 1 175 175 TYR HB2 H 1 2.961 0.117 . 9 . . . . A 175 TYR HB2 . 30133 1 1901 . 1 . 1 175 175 TYR HB3 H 1 2.838 0.021 . 9 . . . . A 175 TYR HB3 . 30133 1 1902 . 1 . 1 175 175 TYR C C 13 179.824 0.000 . 9 . . . . A 175 TYR C . 30133 1 1903 . 1 . 1 175 175 TYR CA C 13 57.716 0.080 . 9 . . . . A 175 TYR CA . 30133 1 1904 . 1 . 1 175 175 TYR CB C 13 41.419 0.315 . 9 . . . . A 175 TYR CB . 30133 1 1905 . 1 . 1 175 175 TYR CG C 13 124.003 0.000 . 9 . . . . A 175 TYR CG . 30133 1 1906 . 1 . 1 175 175 TYR CD1 C 13 133.317 0.000 . 9 . . . . A 175 TYR CD1 . 30133 1 1907 . 1 . 1 175 175 TYR CD2 C 13 133.112 0.000 . 9 . . . . A 175 TYR CD2 . 30133 1 1908 . 1 . 1 175 175 TYR CE1 C 13 116.204 0.004 . 9 . . . . A 175 TYR CE1 . 30133 1 1909 . 1 . 1 175 175 TYR CE2 C 13 117.884 0.000 . 9 . . . . A 175 TYR CE2 . 30133 1 1910 . 1 . 1 175 175 TYR N N 15 119.862 0.007 . 9 . . . . A 175 TYR N . 30133 1 1911 . 1 . 1 176 176 ALA H H 1 8.587 1.750 . 9 . . . . A 176 ALA H . 30133 1 1912 . 1 . 1 176 176 ALA HA H 1 4.175 0.000 . 9 . . . . A 176 ALA HA . 30133 1 1913 . 1 . 1 176 176 ALA HB1 H 1 1.455 0.000 . 9 . . . . A 176 ALA HB1 . 30133 1 1914 . 1 . 1 176 176 ALA HB2 H 1 1.455 0.000 . 9 . . . . A 176 ALA HB2 . 30133 1 1915 . 1 . 1 176 176 ALA HB3 H 1 1.455 0.000 . 9 . . . . A 176 ALA HB3 . 30133 1 1916 . 1 . 1 176 176 ALA C C 13 180.364 0.000 . 9 . . . . A 176 ALA C . 30133 1 1917 . 1 . 1 176 176 ALA CA C 13 54.358 0.229 . 9 . . . . A 176 ALA CA . 30133 1 1918 . 1 . 1 176 176 ALA CB C 13 18.980 0.212 . 9 . . . . A 176 ALA CB . 30133 1 1919 . 1 . 1 176 176 ALA N N 15 123.106 0.007 . 9 . . . . A 176 ALA N . 30133 1 1920 . 1 . 1 177 177 ALA H H 1 8.130 1.485 . 9 . . . . A 177 ALA H . 30133 1 1921 . 1 . 1 177 177 ALA HA H 1 3.901 0.000 . 9 . . . . A 177 ALA HA . 30133 1 1922 . 1 . 1 177 177 ALA HB1 H 1 1.658 0.000 . 9 . . . . A 177 ALA HB1 . 30133 1 1923 . 1 . 1 177 177 ALA HB2 H 1 1.658 0.000 . 9 . . . . A 177 ALA HB2 . 30133 1 1924 . 1 . 1 177 177 ALA HB3 H 1 1.658 0.000 . 9 . . . . A 177 ALA HB3 . 30133 1 1925 . 1 . 1 177 177 ALA C C 13 180.269 0.000 . 9 . . . . A 177 ALA C . 30133 1 1926 . 1 . 1 177 177 ALA CA C 13 55.604 0.025 . 9 . . . . A 177 ALA CA . 30133 1 1927 . 1 . 1 177 177 ALA CB C 13 17.744 0.055 . 9 . . . . A 177 ALA CB . 30133 1 1928 . 1 . 1 177 177 ALA N N 15 122.834 0.006 . 9 . . . . A 177 ALA N . 30133 1 1929 . 1 . 1 178 178 LEU H H 1 7.895 2.517 . 9 . . . . A 178 LEU H . 30133 1 1930 . 1 . 1 178 178 LEU HA H 1 4.198 0.000 . 9 . . . . A 178 LEU HA . 30133 1 1931 . 1 . 1 178 178 LEU HB2 H 1 1.891 0.437 . 9 . . . . A 178 LEU HB2 . 30133 1 1932 . 1 . 1 178 178 LEU HB3 H 1 1.785 0.427 . 9 . . . . A 178 LEU HB3 . 30133 1 1933 . 1 . 1 178 178 LEU HG H 1 2.697 0.000 . 9 . . . . A 178 LEU HG . 30133 1 1934 . 1 . 1 178 178 LEU HD11 H 1 2.651 0.000 . 9 . . . . A 178 LEU HD11 . 30133 1 1935 . 1 . 1 178 178 LEU HD12 H 1 2.651 0.000 . 9 . . . . A 178 LEU HD12 . 30133 1 1936 . 1 . 1 178 178 LEU HD13 H 1 2.651 0.000 . 9 . . . . A 178 LEU HD13 . 30133 1 1937 . 1 . 1 178 178 LEU HD21 H 1 2.596 0.000 . 9 . . . . A 178 LEU HD21 . 30133 1 1938 . 1 . 1 178 178 LEU HD22 H 1 2.596 0.000 . 9 . . . . A 178 LEU HD22 . 30133 1 1939 . 1 . 1 178 178 LEU HD23 H 1 2.596 0.000 . 9 . . . . A 178 LEU HD23 . 30133 1 1940 . 1 . 1 178 178 LEU C C 13 180.650 0.000 . 9 . . . . A 178 LEU C . 30133 1 1941 . 1 . 1 178 178 LEU CA C 13 57.577 0.035 . 9 . . . . A 178 LEU CA . 30133 1 1942 . 1 . 1 178 178 LEU CB C 13 40.097 0.076 . 9 . . . . A 178 LEU CB . 30133 1 1943 . 1 . 1 178 178 LEU CG C 13 28.725 0.021 . 9 . . . . A 178 LEU CG . 30133 1 1944 . 1 . 1 178 178 LEU CD1 C 13 14.950 0.095 . 9 . . . . A 178 LEU CD1 . 30133 1 1945 . 1 . 1 178 178 LEU CD2 C 13 14.626 0.069 . 9 . . . . A 178 LEU CD2 . 30133 1 1946 . 1 . 1 178 178 LEU N N 15 121.337 0.017 . 9 . . . . A 178 LEU N . 30133 1 1947 . 1 . 1 179 179 GLU H H 1 7.191 1.255 . 9 . . . . A 179 GLU H . 30133 1 1948 . 1 . 1 179 179 GLU HA H 1 3.940 0.000 . 9 . . . . A 179 GLU HA . 30133 1 1949 . 1 . 1 179 179 GLU HB2 H 1 1.017 0.000 . 9 . . . . A 179 GLU HB2 . 30133 1 1950 . 1 . 1 179 179 GLU HB3 H 1 0.970 0.000 . 9 . . . . A 179 GLU HB3 . 30133 1 1951 . 1 . 1 179 179 GLU HG2 H 1 1.431 0.000 . 9 . . . . A 179 GLU HG2 . 30133 1 1952 . 1 . 1 179 179 GLU HG3 H 1 1.361 0.000 . 9 . . . . A 179 GLU HG3 . 30133 1 1953 . 1 . 1 179 179 GLU C C 13 174.249 0.000 . 9 . . . . A 179 GLU C . 30133 1 1954 . 1 . 1 179 179 GLU CA C 13 59.117 0.071 . 9 . . . . A 179 GLU CA . 30133 1 1955 . 1 . 1 179 179 GLU CB C 13 30.855 0.670 . 9 . . . . A 179 GLU CB . 30133 1 1956 . 1 . 1 179 179 GLU CG C 13 41.485 0.023 . 9 . . . . A 179 GLU CG . 30133 1 1957 . 1 . 1 179 179 GLU N N 15 119.478 0.003 . 9 . . . . A 179 GLU N . 30133 1 1958 . 1 . 1 180 180 HIS H H 1 7.711 1.051 . 9 . . . . A 180 HIS H . 30133 1 1959 . 1 . 1 180 180 HIS HB2 H 1 3.056 0.008 . 9 . . . . A 180 HIS HB2 . 30133 1 1960 . 1 . 1 180 180 HIS HB3 H 1 2.996 0.003 . 9 . . . . A 180 HIS HB3 . 30133 1 1961 . 1 . 1 180 180 HIS CA C 13 60.242 0.056 . 9 . . . . A 180 HIS CA . 30133 1 1962 . 1 . 1 180 180 HIS CB C 13 30.335 0.009 . 9 . . . . A 180 HIS CB . 30133 1 1963 . 1 . 1 180 180 HIS CG C 13 131.384 0.000 . 9 . . . . A 180 HIS CG . 30133 1 1964 . 1 . 1 180 180 HIS CD2 C 13 119.114 0.033 . 9 . . . . A 180 HIS CD2 . 30133 1 1965 . 1 . 1 180 180 HIS CE1 C 13 137.429 0.000 . 9 . . . . A 180 HIS CE1 . 30133 1 1966 . 1 . 1 180 180 HIS N N 15 120.736 0.000 . 9 . . . . A 180 HIS N . 30133 1 1967 . 1 . 1 181 181 HIS H H 1 7.151 0.910 . 9 . . . . A 181 HIS H . 30133 1 1968 . 1 . 1 181 181 HIS HA H 1 4.257 0.000 . 9 . . . . A 181 HIS HA . 30133 1 1969 . 1 . 1 181 181 HIS HB2 H 1 2.381 0.000 . 9 . . . . A 181 HIS HB2 . 30133 1 1970 . 1 . 1 181 181 HIS HB3 H 1 2.076 0.000 . 9 . . . . A 181 HIS HB3 . 30133 1 1971 . 1 . 1 181 181 HIS C C 13 176.775 0.000 . 9 . . . . A 181 HIS C . 30133 1 1972 . 1 . 1 181 181 HIS CA C 13 54.994 0.013 . 9 . . . . A 181 HIS CA . 30133 1 1973 . 1 . 1 181 181 HIS CB C 13 32.688 0.033 . 9 . . . . A 181 HIS CB . 30133 1 1974 . 1 . 1 181 181 HIS CG C 13 130.734 0.000 . 9 . . . . A 181 HIS CG . 30133 1 1975 . 1 . 1 181 181 HIS CD2 C 13 119.953 0.000 . 9 . . . . A 181 HIS CD2 . 30133 1 1976 . 1 . 1 181 181 HIS CE1 C 13 137.269 0.000 . 9 . . . . A 181 HIS CE1 . 30133 1 1977 . 1 . 1 182 182 HIS H H 1 8.665 1.555 . 9 . . . . A 182 HIS H . 30133 1 1978 . 1 . 1 182 182 HIS HB2 H 1 2.942 0.002 . 9 . . . . A 182 HIS HB2 . 30133 1 1979 . 1 . 1 182 182 HIS HB3 H 1 2.892 0.006 . 9 . . . . A 182 HIS HB3 . 30133 1 1980 . 1 . 1 182 182 HIS CA C 13 58.601 0.001 . 9 . . . . A 182 HIS CA . 30133 1 1981 . 1 . 1 182 182 HIS CB C 13 29.649 0.016 . 9 . . . . A 182 HIS CB . 30133 1 1982 . 1 . 1 182 182 HIS CG C 13 129.379 0.000 . 9 . . . . A 182 HIS CG . 30133 1 1983 . 1 . 1 182 182 HIS CD2 C 13 120.388 0.000 . 9 . . . . A 182 HIS CD2 . 30133 1 1984 . 1 . 1 182 182 HIS CE1 C 13 136.548 0.000 . 9 . . . . A 182 HIS CE1 . 30133 1 1985 . 1 . 1 182 182 HIS N N 15 127.775 0.015 . 9 . . . . A 182 HIS N . 30133 1 1986 . 1 . 1 183 183 HIS H H 1 6.797 0.764 . 9 . . . . A 183 HIS H . 30133 1 1987 . 1 . 1 183 183 HIS HA H 1 4.226 0.000 . 9 . . . . A 183 HIS HA . 30133 1 1988 . 1 . 1 183 183 HIS HB2 H 1 2.658 0.000 . 9 . . . . A 183 HIS HB2 . 30133 1 1989 . 1 . 1 183 183 HIS HB3 H 1 2.619 0.000 . 9 . . . . A 183 HIS HB3 . 30133 1 1990 . 1 . 1 183 183 HIS C C 13 174.900 0.000 . 9 . . . . A 183 HIS C . 30133 1 1991 . 1 . 1 183 183 HIS CA C 13 53.364 0.068 . 9 . . . . A 183 HIS CA . 30133 1 1992 . 1 . 1 183 183 HIS CB C 13 33.634 0.019 . 9 . . . . A 183 HIS CB . 30133 1 1993 . 1 . 1 183 183 HIS CG C 13 130.186 0.000 . 9 . . . . A 183 HIS CG . 30133 1 1994 . 1 . 1 183 183 HIS CD2 C 13 121.188 0.000 . 9 . . . . A 183 HIS CD2 . 30133 1 1995 . 1 . 1 183 183 HIS CE1 C 13 136.388 0.000 . 9 . . . . A 183 HIS CE1 . 30133 1 1996 . 1 . 1 184 184 HIS H H 1 7.329 1.198 . 9 . . . . A 184 HIS H . 30133 1 1997 . 1 . 1 184 184 HIS HA H 1 3.893 0.000 . 9 . . . . A 184 HIS HA . 30133 1 1998 . 1 . 1 184 184 HIS HB2 H 1 2.986 0.352 . 9 . . . . A 184 HIS HB2 . 30133 1 1999 . 1 . 1 184 184 HIS HB3 H 1 2.338 0.000 . 9 . . . . A 184 HIS HB3 . 30133 1 2000 . 1 . 1 184 184 HIS C C 13 175.980 0.000 . 9 . . . . A 184 HIS C . 30133 1 2001 . 1 . 1 184 184 HIS CA C 13 53.068 0.046 . 9 . . . . A 184 HIS CA . 30133 1 2002 . 1 . 1 184 184 HIS CB C 13 30.261 0.211 . 9 . . . . A 184 HIS CB . 30133 1 2003 . 1 . 1 184 184 HIS CG C 13 129.761 0.000 . 9 . . . . A 184 HIS CG . 30133 1 2004 . 1 . 1 184 184 HIS CD2 C 13 121.466 0.008 . 9 . . . . A 184 HIS CD2 . 30133 1 2005 . 1 . 1 184 184 HIS CE1 C 13 136.249 0.000 . 9 . . . . A 184 HIS CE1 . 30133 1 2006 . 1 . 1 184 184 HIS N N 15 124.778 0.000 . 9 . . . . A 184 HIS N . 30133 1 2007 . 1 . 1 185 185 HIS H H 1 7.280 1.350 . 9 . . . . A 185 HIS H . 30133 1 2008 . 1 . 1 185 185 HIS HB2 H 1 2.905 0.009 . 9 . . . . A 185 HIS HB2 . 30133 1 2009 . 1 . 1 185 185 HIS HB3 H 1 2.873 0.020 . 9 . . . . A 185 HIS HB3 . 30133 1 2010 . 1 . 1 185 185 HIS CA C 13 57.385 0.150 . 9 . . . . A 185 HIS CA . 30133 1 2011 . 1 . 1 185 185 HIS CB C 13 27.584 0.096 . 9 . . . . A 185 HIS CB . 30133 1 2012 . 1 . 1 185 185 HIS CG C 13 130.980 0.000 . 9 . . . . A 185 HIS CG . 30133 1 2013 . 1 . 1 185 185 HIS CD2 C 13 119.826 0.000 . 9 . . . . A 185 HIS CD2 . 30133 1 2014 . 1 . 1 185 185 HIS CE1 C 13 136.240 0.003 . 9 . . . . A 185 HIS CE1 . 30133 1 2015 . 1 . 1 185 185 HIS N N 15 124.988 0.005 . 9 . . . . A 185 HIS N . 30133 1 stop_ save_