data_26659 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26659 _Entry.Title ; 1H, 13C, and 15N Chemical Shift Assignments for SRC in the sugar-free state ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-09-16 _Entry.Accession_date 2015-09-16 _Entry.Last_release_date 2015-09-16 _Entry.Original_release_date 2015-09-16 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _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 Hikaru Hemmi . . . . 26659 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 26659 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 444 26659 '15N chemical shifts' 133 26659 '1H chemical shifts' 746 26659 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-03-03 . original BMRB . 26659 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26660 src-lactose 26659 BMRB 26661 src-6'-sialyllactose 26659 stop_ save_ ############### # Citations # ############### save_citation1 _Citation.Sf_category citations _Citation.Sf_framecode citation1 _Citation.Entry_ID 26659 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1002/1873-3468.12212 _Citation.PubMed_ID 27172906 _Citation.Full_citation . _Citation.Title ; NMR analysis on the sialic acid-binding mechanism of an R-type lectin mutant by natural evolution-mimicry ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS Lett.' _Citation.Journal_name_full 'FEBS letters' _Citation.Journal_volume 590 _Citation.Journal_issue 12 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1873-3468 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1720 _Citation.Page_last 1728 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Hikaru Hemmi H. . . . 26659 1 2 Atsushi Kuno A. . . . 26659 1 3 Sachiko Unno S. . . . 26659 1 4 Jun Hirabayashi J. . . . 26659 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR spectroscopy' 26659 1 'R-type lectin' 26659 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26659 _Assembly.ID 1 _Assembly.Name src _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 src 1 $src A . yes native no no . . . 26659 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_src _Entity.Sf_category entity _Entity.Sf_framecode src _Entity.Entry_ID 26659 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name src _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; PKFFYIKSELNGKVLDIGGQ NPAPGSKIITWDQKKGPTAV NQLWYTDQQGVIRSKLNDFA IDASHEQIETQPFDPNNPKR AWIVSGNTIAQLSDRDNVLG VIKSDKGASAHICAWKQHGG PNQKFIIESE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 130 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 1 131 PRO . 26659 1 2 132 LYS . 26659 1 3 133 PHE . 26659 1 4 134 PHE . 26659 1 5 135 TYR . 26659 1 6 136 ILE . 26659 1 7 137 LYS . 26659 1 8 138 SER . 26659 1 9 139 GLU . 26659 1 10 140 LEU . 26659 1 11 141 ASN . 26659 1 12 142 GLY . 26659 1 13 143 LYS . 26659 1 14 144 VAL . 26659 1 15 145 LEU . 26659 1 16 146 ASP . 26659 1 17 147 ILE . 26659 1 18 148 GLY . 26659 1 19 149 GLY . 26659 1 20 150 GLN . 26659 1 21 151 ASN . 26659 1 22 152 PRO . 26659 1 23 153 ALA . 26659 1 24 154 PRO . 26659 1 25 155 GLY . 26659 1 26 156 SER . 26659 1 27 157 LYS . 26659 1 28 158 ILE . 26659 1 29 159 ILE . 26659 1 30 160 THR . 26659 1 31 161 TRP . 26659 1 32 162 ASP . 26659 1 33 163 GLN . 26659 1 34 164 LYS . 26659 1 35 165 LYS . 26659 1 36 166 GLY . 26659 1 37 167 PRO . 26659 1 38 168 THR . 26659 1 39 169 ALA . 26659 1 40 170 VAL . 26659 1 41 171 ASN . 26659 1 42 172 GLN . 26659 1 43 173 LEU . 26659 1 44 174 TRP . 26659 1 45 175 TYR . 26659 1 46 176 THR . 26659 1 47 177 ASP . 26659 1 48 178 GLN . 26659 1 49 179 GLN . 26659 1 50 180 GLY . 26659 1 51 181 VAL . 26659 1 52 182 ILE . 26659 1 53 183 ARG . 26659 1 54 184 SER . 26659 1 55 185 LYS . 26659 1 56 186 LEU . 26659 1 57 187 ASN . 26659 1 58 188 ASP . 26659 1 59 189 PHE . 26659 1 60 190 ALA . 26659 1 61 191 ILE . 26659 1 62 192 ASP . 26659 1 63 193 ALA . 26659 1 64 194 SER . 26659 1 65 195 HIS . 26659 1 66 196 GLU . 26659 1 67 197 GLN . 26659 1 68 198 ILE . 26659 1 69 199 GLU . 26659 1 70 200 THR . 26659 1 71 201 GLN . 26659 1 72 202 PRO . 26659 1 73 203 PHE . 26659 1 74 204 ASP . 26659 1 75 205 PRO . 26659 1 76 206 ASN . 26659 1 77 207 ASN . 26659 1 78 208 PRO . 26659 1 79 209 LYS . 26659 1 80 210 ARG . 26659 1 81 211 ALA . 26659 1 82 212 TRP . 26659 1 83 213 ILE . 26659 1 84 214 VAL . 26659 1 85 215 SER . 26659 1 86 216 GLY . 26659 1 87 217 ASN . 26659 1 88 218 THR . 26659 1 89 219 ILE . 26659 1 90 220 ALA . 26659 1 91 221 GLN . 26659 1 92 222 LEU . 26659 1 93 223 SER . 26659 1 94 224 ASP . 26659 1 95 225 ARG . 26659 1 96 226 ASP . 26659 1 97 227 ASN . 26659 1 98 228 VAL . 26659 1 99 229 LEU . 26659 1 100 230 GLY . 26659 1 101 231 VAL . 26659 1 102 232 ILE . 26659 1 103 233 LYS . 26659 1 104 234 SER . 26659 1 105 235 ASP . 26659 1 106 236 LYS . 26659 1 107 237 GLY . 26659 1 108 238 ALA . 26659 1 109 239 SER . 26659 1 110 240 ALA . 26659 1 111 241 HIS . 26659 1 112 242 ILE . 26659 1 113 243 CYS . 26659 1 114 244 ALA . 26659 1 115 245 TRP . 26659 1 116 246 LYS . 26659 1 117 247 GLN . 26659 1 118 248 HIS . 26659 1 119 249 GLY . 26659 1 120 250 GLY . 26659 1 121 251 PRO . 26659 1 122 252 ASN . 26659 1 123 253 GLN . 26659 1 124 254 LYS . 26659 1 125 255 PHE . 26659 1 126 256 ILE . 26659 1 127 257 ILE . 26659 1 128 258 GLU . 26659 1 129 259 SER . 26659 1 130 260 GLU . 26659 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 . PRO 1 1 26659 1 . LYS 2 2 26659 1 . PHE 3 3 26659 1 . PHE 4 4 26659 1 . TYR 5 5 26659 1 . ILE 6 6 26659 1 . LYS 7 7 26659 1 . SER 8 8 26659 1 . GLU 9 9 26659 1 . LEU 10 10 26659 1 . ASN 11 11 26659 1 . GLY 12 12 26659 1 . LYS 13 13 26659 1 . VAL 14 14 26659 1 . LEU 15 15 26659 1 . ASP 16 16 26659 1 . ILE 17 17 26659 1 . GLY 18 18 26659 1 . GLY 19 19 26659 1 . GLN 20 20 26659 1 . ASN 21 21 26659 1 . PRO 22 22 26659 1 . ALA 23 23 26659 1 . PRO 24 24 26659 1 . GLY 25 25 26659 1 . SER 26 26 26659 1 . LYS 27 27 26659 1 . ILE 28 28 26659 1 . ILE 29 29 26659 1 . THR 30 30 26659 1 . TRP 31 31 26659 1 . ASP 32 32 26659 1 . GLN 33 33 26659 1 . LYS 34 34 26659 1 . LYS 35 35 26659 1 . GLY 36 36 26659 1 . PRO 37 37 26659 1 . THR 38 38 26659 1 . ALA 39 39 26659 1 . VAL 40 40 26659 1 . ASN 41 41 26659 1 . GLN 42 42 26659 1 . LEU 43 43 26659 1 . TRP 44 44 26659 1 . TYR 45 45 26659 1 . THR 46 46 26659 1 . ASP 47 47 26659 1 . GLN 48 48 26659 1 . GLN 49 49 26659 1 . GLY 50 50 26659 1 . VAL 51 51 26659 1 . ILE 52 52 26659 1 . ARG 53 53 26659 1 . SER 54 54 26659 1 . LYS 55 55 26659 1 . LEU 56 56 26659 1 . ASN 57 57 26659 1 . ASP 58 58 26659 1 . PHE 59 59 26659 1 . ALA 60 60 26659 1 . ILE 61 61 26659 1 . ASP 62 62 26659 1 . ALA 63 63 26659 1 . SER 64 64 26659 1 . HIS 65 65 26659 1 . GLU 66 66 26659 1 . GLN 67 67 26659 1 . ILE 68 68 26659 1 . GLU 69 69 26659 1 . THR 70 70 26659 1 . GLN 71 71 26659 1 . PRO 72 72 26659 1 . PHE 73 73 26659 1 . ASP 74 74 26659 1 . PRO 75 75 26659 1 . ASN 76 76 26659 1 . ASN 77 77 26659 1 . PRO 78 78 26659 1 . LYS 79 79 26659 1 . ARG 80 80 26659 1 . ALA 81 81 26659 1 . TRP 82 82 26659 1 . ILE 83 83 26659 1 . VAL 84 84 26659 1 . SER 85 85 26659 1 . GLY 86 86 26659 1 . ASN 87 87 26659 1 . THR 88 88 26659 1 . ILE 89 89 26659 1 . ALA 90 90 26659 1 . GLN 91 91 26659 1 . LEU 92 92 26659 1 . SER 93 93 26659 1 . ASP 94 94 26659 1 . ARG 95 95 26659 1 . ASP 96 96 26659 1 . ASN 97 97 26659 1 . VAL 98 98 26659 1 . LEU 99 99 26659 1 . GLY 100 100 26659 1 . VAL 101 101 26659 1 . ILE 102 102 26659 1 . LYS 103 103 26659 1 . SER 104 104 26659 1 . ASP 105 105 26659 1 . LYS 106 106 26659 1 . GLY 107 107 26659 1 . ALA 108 108 26659 1 . SER 109 109 26659 1 . ALA 110 110 26659 1 . HIS 111 111 26659 1 . ILE 112 112 26659 1 . CYS 113 113 26659 1 . ALA 114 114 26659 1 . TRP 115 115 26659 1 . LYS 116 116 26659 1 . GLN 117 117 26659 1 . HIS 118 118 26659 1 . GLY 119 119 26659 1 . GLY 120 120 26659 1 . PRO 121 121 26659 1 . ASN 122 122 26659 1 . GLN 123 123 26659 1 . LYS 124 124 26659 1 . PHE 125 125 26659 1 . ILE 126 126 26659 1 . ILE 127 127 26659 1 . GLU 128 128 26659 1 . SER 129 129 26659 1 . GLU 130 130 26659 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 26659 _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 $src . 6398 organism . 'Lumbricus terrestris' earthworm . . Eukaryota Metazoa Lumbricus terrestris . . . . . . . . . . . . . 26659 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 26659 _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 $src . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-27b . . . 26659 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26659 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 src '[U-95% 13C; U-95% 15N]' . . 1 $src . . 0.9 . . mM . . . . 26659 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26659 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26659 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 26659 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 26659 1 pressure 1 . atm 26659 1 temperature 288 . K 26659 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 26659 _Software.ID 1 _Software.Name Felix _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 26659 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26659 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26659 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26659 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26659 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26659 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 26659 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26659 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26659 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26659 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26659 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 26659 1 2 spectrometer_2 Bruker Avance . 800 . . . 26659 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 26659 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 2 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 4 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 9 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 12 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 13 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 14 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 15 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26659 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26659 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26659 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.0 . . . . . 26659 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26659 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26659 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26659 1 2 '2D 1H-13C HSQC aromatic' . . . 26659 1 3 '3D CBCA(CO)NH' . . . 26659 1 4 '3D C(CO)NH' . . . 26659 1 5 '3D HNCO' . . . 26659 1 6 '3D HNCA' . . . 26659 1 7 '3D HNCACB' . . . 26659 1 9 '3D H(CCO)NH' . . . 26659 1 10 '3D HCCH-TOCSY' . . . 26659 1 12 '3D 1H-15N TOCSY' . . . 26659 1 13 '3D 1H-13C NOESY aromatic' . . . 26659 1 14 '3D HCCH-COSY' . . . 26659 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 PRO HA H 1 4.452 . . 1 . . . . 131 PRO HA . 26659 1 2 . 1 1 1 1 PRO HB2 H 1 2.180 . . 1 . . . . 131 PRO HB2 . 26659 1 3 . 1 1 1 1 PRO HB3 H 1 1.518 . . 1 . . . . 131 PRO HB3 . 26659 1 4 . 1 1 1 1 PRO HG2 H 1 1.796 . . 2 . . . . 131 PRO HG# . 26659 1 5 . 1 1 1 1 PRO HG3 H 1 1.796 . . 2 . . . . 131 PRO HG# . 26659 1 6 . 1 1 1 1 PRO HD2 H 1 3.852 . . 1 . . . . 131 PRO HD2 . 26659 1 7 . 1 1 1 1 PRO HD3 H 1 3.592 . . 1 . . . . 131 PRO HD3 . 26659 1 8 . 1 1 1 1 PRO C C 13 175.517 . . 1 . . . . 131 PRO C . 26659 1 9 . 1 1 1 1 PRO CA C 13 62.884 . . 1 . . . . 131 PRO CA . 26659 1 10 . 1 1 1 1 PRO CB C 13 32.393 . . 1 . . . . 131 PRO CB . 26659 1 11 . 1 1 1 1 PRO CG C 13 27.282 . . 1 . . . . 131 PRO CG . 26659 1 12 . 1 1 1 1 PRO CD C 13 50.754 . . 1 . . . . 131 PRO CD . 26659 1 13 . 1 1 2 2 LYS H H 1 8.222 . . 1 . . . . 132 LYS H . 26659 1 14 . 1 1 2 2 LYS HA H 1 4.324 . . 1 . . . . 132 LYS HA . 26659 1 15 . 1 1 2 2 LYS HB2 H 1 1.825 . . 2 . . . . 132 LYS HB# . 26659 1 16 . 1 1 2 2 LYS HB3 H 1 1.825 . . 2 . . . . 132 LYS HB# . 26659 1 17 . 1 1 2 2 LYS HG2 H 1 1.466 . . 1 . . . . 132 LYS HG2 . 26659 1 18 . 1 1 2 2 LYS HG3 H 1 1.298 . . 1 . . . . 132 LYS HG3 . 26659 1 19 . 1 1 2 2 LYS HD2 H 1 1.759 . . 2 . . . . 132 LYS HD# . 26659 1 20 . 1 1 2 2 LYS HD3 H 1 1.759 . . 2 . . . . 132 LYS HD# . 26659 1 21 . 1 1 2 2 LYS HE2 H 1 3.014 . . 2 . . . . 132 LYS HE# . 26659 1 22 . 1 1 2 2 LYS HE3 H 1 3.014 . . 2 . . . . 132 LYS HE# . 26659 1 23 . 1 1 2 2 LYS C C 13 175.751 . . 1 . . . . 132 LYS C . 26659 1 24 . 1 1 2 2 LYS CA C 13 56.332 . . 1 . . . . 132 LYS CA . 26659 1 25 . 1 1 2 2 LYS CB C 13 33.385 . . 1 . . . . 132 LYS CB . 26659 1 26 . 1 1 2 2 LYS CG C 13 24.896 . . 1 . . . . 132 LYS CG . 26659 1 27 . 1 1 2 2 LYS CD C 13 29.078 . . 1 . . . . 132 LYS CD . 26659 1 28 . 1 1 2 2 LYS CE C 13 42.270 . . 1 . . . . 132 LYS CE . 26659 1 29 . 1 1 2 2 LYS N N 15 121.469 . . 1 . . . . 132 LYS N . 26659 1 30 . 1 1 3 3 PHE H H 1 8.378 . . 1 . . . . 133 PHE H . 26659 1 31 . 1 1 3 3 PHE HA H 1 5.707 . . 1 . . . . 133 PHE HA . 26659 1 32 . 1 1 3 3 PHE HB2 H 1 3.083 . . 2 . . . . 133 PHE HB# . 26659 1 33 . 1 1 3 3 PHE HB3 H 1 3.083 . . 2 . . . . 133 PHE HB# . 26659 1 34 . 1 1 3 3 PHE HD1 H 1 7.339 . . 3 . . . . 133 PHE HD# . 26659 1 35 . 1 1 3 3 PHE HD2 H 1 7.339 . . 3 . . . . 133 PHE HD# . 26659 1 36 . 1 1 3 3 PHE HE1 H 1 7.226 . . 3 . . . . 133 PHE HE# . 26659 1 37 . 1 1 3 3 PHE HE2 H 1 7.226 . . 3 . . . . 133 PHE HE# . 26659 1 38 . 1 1 3 3 PHE HZ H 1 6.988 . . 1 . . . . 133 PHE HZ . 26659 1 39 . 1 1 3 3 PHE C C 13 176.468 . . 1 . . . . 133 PHE C . 26659 1 40 . 1 1 3 3 PHE CA C 13 56.868 . . 1 . . . . 133 PHE CA . 26659 1 41 . 1 1 3 3 PHE CB C 13 42.477 . . 1 . . . . 133 PHE CB . 26659 1 42 . 1 1 3 3 PHE CD1 C 13 132.211 . . 3 . . . . 133 PHE CD# . 26659 1 43 . 1 1 3 3 PHE CD2 C 13 132.211 . . 3 . . . . 133 PHE CD# . 26659 1 44 . 1 1 3 3 PHE CE1 C 13 131.041 . . 3 . . . . 133 PHE CE# . 26659 1 45 . 1 1 3 3 PHE CE2 C 13 131.041 . . 3 . . . . 133 PHE CE# . 26659 1 46 . 1 1 3 3 PHE CZ C 13 128.011 . . 1 . . . . 133 PHE CZ . 26659 1 47 . 1 1 3 3 PHE N N 15 118.959 . . 1 . . . . 133 PHE N . 26659 1 48 . 1 1 4 4 PHE H H 1 9.481 . . 1 . . . . 134 PHE H . 26659 1 49 . 1 1 4 4 PHE HA H 1 5.582 . . 1 . . . . 134 PHE HA . 26659 1 50 . 1 1 4 4 PHE HB2 H 1 3.129 . . 2 . . . . 134 PHE HB# . 26659 1 51 . 1 1 4 4 PHE HB3 H 1 3.129 . . 2 . . . . 134 PHE HB# . 26659 1 52 . 1 1 4 4 PHE HD1 H 1 7.335 . . 3 . . . . 134 PHE HD# . 26659 1 53 . 1 1 4 4 PHE HD2 H 1 7.335 . . 3 . . . . 134 PHE HD# . 26659 1 54 . 1 1 4 4 PHE HE1 H 1 7.237 . . 3 . . . . 134 PHE HE# . 26659 1 55 . 1 1 4 4 PHE HE2 H 1 7.237 . . 3 . . . . 134 PHE HE# . 26659 1 56 . 1 1 4 4 PHE HZ H 1 7.002 . . 1 . . . . 134 PHE HZ . 26659 1 57 . 1 1 4 4 PHE C C 13 174.420 . . 1 . . . . 134 PHE C . 26659 1 58 . 1 1 4 4 PHE CA C 13 55.724 . . 1 . . . . 134 PHE CA . 26659 1 59 . 1 1 4 4 PHE CB C 13 42.424 . . 1 . . . . 134 PHE CB . 26659 1 60 . 1 1 4 4 PHE CD1 C 13 132.131 . . 3 . . . . 134 PHE CD# . 26659 1 61 . 1 1 4 4 PHE CD2 C 13 132.131 . . 3 . . . . 134 PHE CD# . 26659 1 62 . 1 1 4 4 PHE CE1 C 13 130.163 . . 3 . . . . 134 PHE CE# . 26659 1 63 . 1 1 4 4 PHE CE2 C 13 130.163 . . 3 . . . . 134 PHE CE# . 26659 1 64 . 1 1 4 4 PHE CZ C 13 128.011 . . 1 . . . . 134 PHE CZ . 26659 1 65 . 1 1 4 4 PHE N N 15 117.392 . . 1 . . . . 134 PHE N . 26659 1 66 . 1 1 5 5 TYR H H 1 10.031 . . 1 . . . . 135 TYR H . 26659 1 67 . 1 1 5 5 TYR HA H 1 5.408 . . 1 . . . . 135 TYR HA . 26659 1 68 . 1 1 5 5 TYR HB2 H 1 3.281 . . 1 . . . . 135 TYR HB2 . 26659 1 69 . 1 1 5 5 TYR HB3 H 1 3.115 . . 1 . . . . 135 TYR HB3 . 26659 1 70 . 1 1 5 5 TYR HD1 H 1 7.193 . . 3 . . . . 135 TYR HD# . 26659 1 71 . 1 1 5 5 TYR HD2 H 1 7.193 . . 3 . . . . 135 TYR HD# . 26659 1 72 . 1 1 5 5 TYR HE1 H 1 6.777 . . 3 . . . . 135 TYR HE# . 26659 1 73 . 1 1 5 5 TYR HE2 H 1 6.777 . . 3 . . . . 135 TYR HE# . 26659 1 74 . 1 1 5 5 TYR C C 13 176.395 . . 1 . . . . 135 TYR C . 26659 1 75 . 1 1 5 5 TYR CA C 13 57.073 . . 1 . . . . 135 TYR CA . 26659 1 76 . 1 1 5 5 TYR CB C 13 41.634 . . 1 . . . . 135 TYR CB . 26659 1 77 . 1 1 5 5 TYR CD1 C 13 134.399 . . 3 . . . . 135 TYR CD# . 26659 1 78 . 1 1 5 5 TYR CD2 C 13 134.399 . . 3 . . . . 135 TYR CD# . 26659 1 79 . 1 1 5 5 TYR CE1 C 13 117.958 . . 3 . . . . 135 TYR CE# . 26659 1 80 . 1 1 5 5 TYR CE2 C 13 117.958 . . 3 . . . . 135 TYR CE# . 26659 1 81 . 1 1 5 5 TYR N N 15 117.667 . . 1 . . . . 135 TYR N . 26659 1 82 . 1 1 6 6 ILE H H 1 9.744 . . 1 . . . . 136 ILE H . 26659 1 83 . 1 1 6 6 ILE HB H 1 1.516 . . 1 . . . . 136 ILE HB . 26659 1 84 . 1 1 6 6 ILE HG12 H 1 1.776 . . 1 . . . . 136 ILE HG1# . 26659 1 85 . 1 1 6 6 ILE HG13 H 1 1.776 . . 1 . . . . 136 ILE HG1# . 26659 1 86 . 1 1 6 6 ILE HG21 H 1 0.484 . . 1 . . . . 136 ILE HG2 . 26659 1 87 . 1 1 6 6 ILE HG22 H 1 0.484 . . 1 . . . . 136 ILE HG2 . 26659 1 88 . 1 1 6 6 ILE HG23 H 1 0.484 . . 1 . . . . 136 ILE HG2 . 26659 1 89 . 1 1 6 6 ILE HD11 H 1 -0.057 . . 1 . . . . 136 ILE HD1 . 26659 1 90 . 1 1 6 6 ILE HD12 H 1 -0.057 . . 1 . . . . 136 ILE HD1 . 26659 1 91 . 1 1 6 6 ILE HD13 H 1 -0.057 . . 1 . . . . 136 ILE HD1 . 26659 1 92 . 1 1 6 6 ILE C C 13 173.995 . . 1 . . . . 136 ILE C . 26659 1 93 . 1 1 6 6 ILE CA C 13 61.924 . . 1 . . . . 136 ILE CA . 26659 1 94 . 1 1 6 6 ILE CB C 13 39.014 . . 1 . . . . 136 ILE CB . 26659 1 95 . 1 1 6 6 ILE CG1 C 13 26.890 . . 1 . . . . 136 ILE CG1 . 26659 1 96 . 1 1 6 6 ILE CG2 C 13 18.908 . . 1 . . . . 136 ILE CG2 . 26659 1 97 . 1 1 6 6 ILE CD1 C 13 12.820 . . 1 . . . . 136 ILE CD1 . 26659 1 98 . 1 1 6 6 ILE N N 15 121.812 . . 1 . . . . 136 ILE N . 26659 1 99 . 1 1 7 7 LYS H H 1 9.597 . . 1 . . . . 137 LYS H . 26659 1 100 . 1 1 7 7 LYS HA H 1 5.118 . . 1 . . . . 137 LYS HA . 26659 1 101 . 1 1 7 7 LYS HB2 H 1 2.118 . . 2 . . . . 137 LYS HB# . 26659 1 102 . 1 1 7 7 LYS HB3 H 1 2.118 . . 2 . . . . 137 LYS HB# . 26659 1 103 . 1 1 7 7 LYS HG2 H 1 1.430 . . 2 . . . . 137 LYS HG# . 26659 1 104 . 1 1 7 7 LYS HG3 H 1 1.430 . . 2 . . . . 137 LYS HG# . 26659 1 105 . 1 1 7 7 LYS HD2 H 1 1.829 . . 1 . . . . 137 LYS HD2 . 26659 1 106 . 1 1 7 7 LYS HD3 H 1 1.456 . . 1 . . . . 137 LYS HD3 . 26659 1 107 . 1 1 7 7 LYS HE2 H 1 2.670 . . 2 . . . . 137 LYS HE# . 26659 1 108 . 1 1 7 7 LYS HE3 H 1 2.670 . . 2 . . . . 137 LYS HE# . 26659 1 109 . 1 1 7 7 LYS C C 13 175.751 . . 1 . . . . 137 LYS C . 26659 1 110 . 1 1 7 7 LYS CA C 13 54.899 . . 1 . . . . 137 LYS CA . 26659 1 111 . 1 1 7 7 LYS CB C 13 35.041 . . 1 . . . . 137 LYS CB . 26659 1 112 . 1 1 7 7 LYS CG C 13 23.891 . . 1 . . . . 137 LYS CG . 26659 1 113 . 1 1 7 7 LYS CD C 13 29.312 . . 1 . . . . 137 LYS CD . 26659 1 114 . 1 1 7 7 LYS CE C 13 41.348 . . 1 . . . . 137 LYS CE . 26659 1 115 . 1 1 7 7 LYS N N 15 127.858 . . 1 . . . . 137 LYS N . 26659 1 116 . 1 1 8 8 SER H H 1 9.485 . . 1 . . . . 138 SER H . 26659 1 117 . 1 1 8 8 SER HA H 1 4.324 . . 1 . . . . 138 SER HA . 26659 1 118 . 1 1 8 8 SER HB2 H 1 3.775 . . 2 . . . . 138 SER HB# . 26659 1 119 . 1 1 8 8 SER HB3 H 1 3.775 . . 2 . . . . 138 SER HB# . 26659 1 120 . 1 1 8 8 SER C C 13 177.332 . . 1 . . . . 138 SER C . 26659 1 121 . 1 1 8 8 SER CA C 13 58.338 . . 1 . . . . 138 SER CA . 26659 1 122 . 1 1 8 8 SER CB C 13 64.147 . . 1 . . . . 138 SER CB . 26659 1 123 . 1 1 8 8 SER N N 15 120.496 . . 1 . . . . 138 SER N . 26659 1 124 . 1 1 9 9 GLU H H 1 8.246 . . 1 . . . . 139 GLU H . 26659 1 125 . 1 1 9 9 GLU HA H 1 4.159 . . 1 . . . . 139 GLU HA . 26659 1 126 . 1 1 9 9 GLU HB2 H 1 2.158 . . 1 . . . . 139 GLU HB2 . 26659 1 127 . 1 1 9 9 GLU HB3 H 1 1.873 . . 1 . . . . 139 GLU HB3 . 26659 1 128 . 1 1 9 9 GLU HG2 H 1 2.180 . . 2 . . . . 139 GLU HG# . 26659 1 129 . 1 1 9 9 GLU HG3 H 1 2.180 . . 2 . . . . 139 GLU HG# . 26659 1 130 . 1 1 9 9 GLU C C 13 176.768 . . 1 . . . . 139 GLU C . 26659 1 131 . 1 1 9 9 GLU CA C 13 58.960 . . 1 . . . . 139 GLU CA . 26659 1 132 . 1 1 9 9 GLU CB C 13 30.263 . . 1 . . . . 139 GLU CB . 26659 1 133 . 1 1 9 9 GLU CG C 13 37.324 . . 1 . . . . 139 GLU CG . 26659 1 134 . 1 1 9 9 GLU N N 15 129.790 . . 1 . . . . 139 GLU N . 26659 1 135 . 1 1 10 10 LEU H H 1 7.648 . . 1 . . . . 140 LEU H . 26659 1 136 . 1 1 10 10 LEU HA H 1 4.115 . . 1 . . . . 140 LEU HA . 26659 1 137 . 1 1 10 10 LEU HB2 H 1 1.627 . . 1 . . . . 140 LEU HB2 . 26659 1 138 . 1 1 10 10 LEU HB3 H 1 1.280 . . 1 . . . . 140 LEU HB3 . 26659 1 139 . 1 1 10 10 LEU HG H 1 1.529 . . 1 . . . . 140 LEU HG . 26659 1 140 . 1 1 10 10 LEU HD11 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 141 . 1 1 10 10 LEU HD12 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 142 . 1 1 10 10 LEU HD13 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 143 . 1 1 10 10 LEU HD21 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 144 . 1 1 10 10 LEU HD22 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 145 . 1 1 10 10 LEU HD23 H 1 0.980 . . 2 . . . . 140 LEU HD# . 26659 1 146 . 1 1 10 10 LEU C C 13 177.529 . . 1 . . . . 140 LEU C . 26659 1 147 . 1 1 10 10 LEU CA C 13 57.336 . . 1 . . . . 140 LEU CA . 26659 1 148 . 1 1 10 10 LEU CB C 13 43.039 . . 1 . . . . 140 LEU CB . 26659 1 149 . 1 1 10 10 LEU CG C 13 26.115 . . 1 . . . . 140 LEU CG . 26659 1 150 . 1 1 10 10 LEU CD1 C 13 23.766 . . 1 . . . . 140 LEU CD1 . 26659 1 151 . 1 1 10 10 LEU CD2 C 13 23.796 . . 1 . . . . 140 LEU CD2 . 26659 1 152 . 1 1 10 10 LEU N N 15 118.013 . . 1 . . . . 140 LEU N . 26659 1 153 . 1 1 11 11 ASN H H 1 7.003 . . 1 . . . . 141 ASN H . 26659 1 154 . 1 1 11 11 ASN HA H 1 5.032 . . 1 . . . . 141 ASN HA . 26659 1 155 . 1 1 11 11 ASN HB2 H 1 3.330 . . 1 . . . . 141 ASN HB2 . 26659 1 156 . 1 1 11 11 ASN HB3 H 1 2.654 . . 1 . . . . 141 ASN HB3 . 26659 1 157 . 1 1 11 11 ASN HD21 H 1 7.820 . . 1 . . . . 141 ASN HD21 . 26659 1 158 . 1 1 11 11 ASN HD22 H 1 6.375 . . 1 . . . . 141 ASN HD22 . 26659 1 159 . 1 1 11 11 ASN C C 13 176.505 . . 1 . . . . 141 ASN C . 26659 1 160 . 1 1 11 11 ASN CA C 13 51.541 . . 1 . . . . 141 ASN CA . 26659 1 161 . 1 1 11 11 ASN CB C 13 39.856 . . 1 . . . . 141 ASN CB . 26659 1 162 . 1 1 11 11 ASN N N 15 109.162 . . 1 . . . . 141 ASN N . 26659 1 163 . 1 1 11 11 ASN ND2 N 15 107.453 . . 1 . . . . 141 ASN ND2 . 26659 1 164 . 1 1 12 12 GLY H H 1 8.148 . . 1 . . . . 142 GLY H . 26659 1 165 . 1 1 12 12 GLY HA2 H 1 4.192 . . 1 . . . . 142 GLY HA2 . 26659 1 166 . 1 1 12 12 GLY HA3 H 1 3.885 . . 1 . . . . 142 GLY HA3 . 26659 1 167 . 1 1 12 12 GLY C C 13 173.761 . . 1 . . . . 142 GLY C . 26659 1 168 . 1 1 12 12 GLY CA C 13 46.565 . . 1 . . . . 142 GLY CA . 26659 1 169 . 1 1 12 12 GLY N N 15 108.802 . . 1 . . . . 142 GLY N . 26659 1 170 . 1 1 13 13 LYS H H 1 7.988 . . 1 . . . . 143 LYS H . 26659 1 171 . 1 1 13 13 LYS HA H 1 4.572 . . 1 . . . . 143 LYS HA . 26659 1 172 . 1 1 13 13 LYS HB2 H 1 1.909 . . 2 . . . . 143 LYS HB# . 26659 1 173 . 1 1 13 13 LYS HB3 H 1 1.909 . . 2 . . . . 143 LYS HB# . 26659 1 174 . 1 1 13 13 LYS HG2 H 1 1.265 . . 2 . . . . 143 LYS HG# . 26659 1 175 . 1 1 13 13 LYS HG3 H 1 1.265 . . 2 . . . . 143 LYS HG# . 26659 1 176 . 1 1 13 13 LYS HD2 H 1 1.404 . . 2 . . . . 143 LYS HD# . 26659 1 177 . 1 1 13 13 LYS HD3 H 1 1.404 . . 2 . . . . 143 LYS HD# . 26659 1 178 . 1 1 13 13 LYS HE2 H 1 2.919 . . 2 . . . . 143 LYS HE# . 26659 1 179 . 1 1 13 13 LYS HE3 H 1 2.919 . . 2 . . . . 143 LYS HE# . 26659 1 180 . 1 1 13 13 LYS C C 13 174.880 . . 1 . . . . 143 LYS C . 26659 1 181 . 1 1 13 13 LYS CA C 13 55.726 . . 1 . . . . 143 LYS CA . 26659 1 182 . 1 1 13 13 LYS CB C 13 34.119 . . 1 . . . . 143 LYS CB . 26659 1 183 . 1 1 13 13 LYS CG C 13 26.093 . . 1 . . . . 143 LYS CG . 26659 1 184 . 1 1 13 13 LYS CD C 13 29.276 . . 1 . . . . 143 LYS CD . 26659 1 185 . 1 1 13 13 LYS CE C 13 42.526 . . 1 . . . . 143 LYS CE . 26659 1 186 . 1 1 13 13 LYS N N 15 120.185 . . 1 . . . . 143 LYS N . 26659 1 187 . 1 1 14 14 VAL H H 1 9.024 . . 1 . . . . 144 VAL H . 26659 1 188 . 1 1 14 14 VAL HA H 1 5.875 . . 1 . . . . 144 VAL HA . 26659 1 189 . 1 1 14 14 VAL HB H 1 3.230 . . 1 . . . . 144 VAL HB . 26659 1 190 . 1 1 14 14 VAL HG11 H 1 1.265 . . 1 . . . . 144 VAL HG1 . 26659 1 191 . 1 1 14 14 VAL HG12 H 1 1.265 . . 1 . . . . 144 VAL HG1 . 26659 1 192 . 1 1 14 14 VAL HG13 H 1 1.265 . . 1 . . . . 144 VAL HG1 . 26659 1 193 . 1 1 14 14 VAL HG21 H 1 0.907 . . 1 . . . . 144 VAL HG2 . 26659 1 194 . 1 1 14 14 VAL HG22 H 1 0.907 . . 1 . . . . 144 VAL HG2 . 26659 1 195 . 1 1 14 14 VAL HG23 H 1 0.907 . . 1 . . . . 144 VAL HG2 . 26659 1 196 . 1 1 14 14 VAL C C 13 175.320 . . 1 . . . . 144 VAL C . 26659 1 197 . 1 1 14 14 VAL CA C 13 58.367 . . 1 . . . . 144 VAL CA . 26659 1 198 . 1 1 14 14 VAL CB C 13 33.622 . . 1 . . . . 144 VAL CB . 26659 1 199 . 1 1 14 14 VAL CG1 C 13 19.018 . . 1 . . . . 144 VAL CG1 . 26659 1 200 . 1 1 14 14 VAL CG2 C 13 21.725 . . 1 . . . . 144 VAL CG2 . 26659 1 201 . 1 1 14 14 VAL N N 15 109.831 . . 1 . . . . 144 VAL N . 26659 1 202 . 1 1 15 15 LEU H H 1 8.836 . . 1 . . . . 145 LEU H . 26659 1 203 . 1 1 15 15 LEU N N 15 120.839 . . 1 . . . . 145 LEU N . 26659 1 204 . 1 1 16 16 ASP H H 1 9.184 . . 1 . . . . 146 ASP H . 26659 1 205 . 1 1 16 16 ASP HA H 1 5.316 . . 1 . . . . 146 ASP HA . 26659 1 206 . 1 1 16 16 ASP C C 13 174.390 . . 1 . . . . 146 ASP C . 26659 1 207 . 1 1 16 16 ASP N N 15 125.337 . . 1 . . . . 146 ASP N . 26659 1 208 . 1 1 17 17 ILE H H 1 8.537 . . 1 . . . . 147 ILE H . 26659 1 209 . 1 1 17 17 ILE N N 15 123.273 . . 1 . . . . 147 ILE N . 26659 1 210 . 1 1 20 20 GLN H H 1 8.439 . . 1 . . . . 150 GLN H . 26659 1 211 . 1 1 20 20 GLN HE21 H 1 7.526 . . 1 . . . . 150 GLN HE21 . 26659 1 212 . 1 1 20 20 GLN HE22 H 1 6.922 . . 1 . . . . 150 GLN HE22 . 26659 1 213 . 1 1 20 20 GLN N N 15 113.488 . . 1 . . . . 150 GLN N . 26659 1 214 . 1 1 20 20 GLN NE2 N 15 111.693 . . 1 . . . . 150 GLN NE2 . 26659 1 215 . 1 1 25 25 GLY H H 1 9.484 . . 1 . . . . 155 GLY H . 26659 1 216 . 1 1 25 25 GLY HA2 H 1 4.219 . . 1 . . . . 155 GLY HA2 . 26659 1 217 . 1 1 25 25 GLY HA3 H 1 3.841 . . 1 . . . . 155 GLY HA3 . 26659 1 218 . 1 1 25 25 GLY CA C 13 46.283 . . 1 . . . . 155 GLY CA . 26659 1 219 . 1 1 25 25 GLY N N 15 113.206 . . 1 . . . . 155 GLY N . 26659 1 220 . 1 1 26 26 SER C C 13 173.600 . . 1 . . . . 156 SER C . 26659 1 221 . 1 1 27 27 LYS H H 1 8.739 . . 1 . . . . 157 LYS H . 26659 1 222 . 1 1 27 27 LYS HA H 1 4.565 . . 1 . . . . 157 LYS HA . 26659 1 223 . 1 1 27 27 LYS HB2 H 1 2.068 . . 2 . . . . 157 LYS HB# . 26659 1 224 . 1 1 27 27 LYS HB3 H 1 2.068 . . 2 . . . . 157 LYS HB# . 26659 1 225 . 1 1 27 27 LYS HG2 H 1 1.774 . . 2 . . . . 157 LYS HG# . 26659 1 226 . 1 1 27 27 LYS HG3 H 1 1.774 . . 2 . . . . 157 LYS HG# . 26659 1 227 . 1 1 27 27 LYS HD2 H 1 2.008 . . 2 . . . . 157 LYS HD# . 26659 1 228 . 1 1 27 27 LYS HD3 H 1 2.008 . . 2 . . . . 157 LYS HD# . 26659 1 229 . 1 1 27 27 LYS HE2 H 1 3.137 . . 2 . . . . 157 LYS HE# . 26659 1 230 . 1 1 27 27 LYS HE3 H 1 3.137 . . 2 . . . . 157 LYS HE# . 26659 1 231 . 1 1 27 27 LYS C C 13 176.454 . . 1 . . . . 157 LYS C . 26659 1 232 . 1 1 27 27 LYS CA C 13 57.114 . . 1 . . . . 157 LYS CA . 26659 1 233 . 1 1 27 27 LYS CB C 13 32.909 . . 1 . . . . 157 LYS CB . 26659 1 234 . 1 1 27 27 LYS CG C 13 25.657 . . 1 . . . . 157 LYS CG . 26659 1 235 . 1 1 27 27 LYS CD C 13 28.998 . . 1 . . . . 157 LYS CD . 26659 1 236 . 1 1 27 27 LYS CE C 13 42.484 . . 1 . . . . 157 LYS CE . 26659 1 237 . 1 1 27 27 LYS N N 15 124.070 . . 1 . . . . 157 LYS N . 26659 1 238 . 1 1 28 28 ILE H H 1 7.601 . . 1 . . . . 158 ILE H . 26659 1 239 . 1 1 28 28 ILE HA H 1 4.886 . . 1 . . . . 158 ILE HA . 26659 1 240 . 1 1 28 28 ILE HB H 1 1.612 . . 1 . . . . 158 ILE HB . 26659 1 241 . 1 1 28 28 ILE HG21 H 1 1.060 . . 1 . . . . 158 ILE HG2 . 26659 1 242 . 1 1 28 28 ILE HG22 H 1 1.060 . . 1 . . . . 158 ILE HG2 . 26659 1 243 . 1 1 28 28 ILE HG23 H 1 1.060 . . 1 . . . . 158 ILE HG2 . 26659 1 244 . 1 1 28 28 ILE HD11 H 1 1.022 . . 1 . . . . 158 ILE HD1 . 26659 1 245 . 1 1 28 28 ILE HD12 H 1 1.022 . . 1 . . . . 158 ILE HD1 . 26659 1 246 . 1 1 28 28 ILE HD13 H 1 1.022 . . 1 . . . . 158 ILE HD1 . 26659 1 247 . 1 1 28 28 ILE N N 15 122.883 . . 1 . . . . 158 ILE N . 26659 1 248 . 1 1 29 29 ILE C C 13 176.073 . . 1 . . . . 159 ILE C . 26659 1 249 . 1 1 29 29 ILE CA C 13 59.699 . . 1 . . . . 159 ILE CA . 26659 1 250 . 1 1 29 29 ILE CB C 13 42.022 . . 1 . . . . 159 ILE CB . 26659 1 251 . 1 1 30 30 THR H H 1 8.179 . . 1 . . . . 160 THR H . 26659 1 252 . 1 1 30 30 THR HA H 1 5.600 . . 1 . . . . 160 THR HA . 26659 1 253 . 1 1 30 30 THR HB H 1 4.239 . . 1 . . . . 160 THR HB . 26659 1 254 . 1 1 30 30 THR HG21 H 1 1.245 . . 1 . . . . 160 THR HG2 . 26659 1 255 . 1 1 30 30 THR HG22 H 1 1.245 . . 1 . . . . 160 THR HG2 . 26659 1 256 . 1 1 30 30 THR HG23 H 1 1.245 . . 1 . . . . 160 THR HG2 . 26659 1 257 . 1 1 30 30 THR C C 13 174.800 . . 1 . . . . 160 THR C . 26659 1 258 . 1 1 30 30 THR CA C 13 59.447 . . 1 . . . . 160 THR CA . 26659 1 259 . 1 1 30 30 THR CB C 13 70.151 . . 1 . . . . 160 THR CB . 26659 1 260 . 1 1 30 30 THR N N 15 106.431 . . 1 . . . . 160 THR N . 26659 1 261 . 1 1 31 31 TRP H H 1 9.519 . . 1 . . . . 161 TRP H . 26659 1 262 . 1 1 31 31 TRP HD1 H 1 7.575 . . 1 . . . . 161 TRP HD1 . 26659 1 263 . 1 1 31 31 TRP HE1 H 1 10.609 . . 1 . . . . 161 TRP HE1 . 26659 1 264 . 1 1 31 31 TRP HZ2 H 1 7.683 . . 1 . . . . 161 TRP HZ2 . 26659 1 265 . 1 1 31 31 TRP HH2 H 1 7.423 . . 1 . . . . 161 TRP HH2 . 26659 1 266 . 1 1 31 31 TRP C C 13 173.293 . . 1 . . . . 161 TRP C . 26659 1 267 . 1 1 31 31 TRP CA C 13 55.503 . . 1 . . . . 161 TRP CA . 26659 1 268 . 1 1 31 31 TRP CD1 C 13 128.787 . . 1 . . . . 161 TRP CD1 . 26659 1 269 . 1 1 31 31 TRP CZ2 C 13 114.812 . . 1 . . . . 161 TRP CZ2 . 26659 1 270 . 1 1 31 31 TRP CH2 C 13 125.026 . . 1 . . . . 161 TRP CH2 . 26659 1 271 . 1 1 31 31 TRP N N 15 124.737 . . 1 . . . . 161 TRP N . 26659 1 272 . 1 1 31 31 TRP NE1 N 15 129.980 . . 1 . . . . 161 TRP NE1 . 26659 1 273 . 1 1 32 32 ASP H H 1 6.611 . . 1 . . . . 162 ASP H . 26659 1 274 . 1 1 32 32 ASP HA H 1 4.507 . . 1 . . . . 162 ASP HA . 26659 1 275 . 1 1 32 32 ASP HB2 H 1 2.603 . . 1 . . . . 162 ASP HB2 . 26659 1 276 . 1 1 32 32 ASP HB3 H 1 2.177 . . 1 . . . . 162 ASP HB3 . 26659 1 277 . 1 1 32 32 ASP C C 13 176.082 . . 1 . . . . 162 ASP C . 26659 1 278 . 1 1 32 32 ASP CA C 13 55.836 . . 1 . . . . 162 ASP CA . 26659 1 279 . 1 1 32 32 ASP CB C 13 41.378 . . 1 . . . . 162 ASP CB . 26659 1 280 . 1 1 32 32 ASP N N 15 124.369 . . 1 . . . . 162 ASP N . 26659 1 281 . 1 1 33 33 GLN H H 1 8.863 . . 1 . . . . 163 GLN H . 26659 1 282 . 1 1 33 33 GLN HA H 1 4.373 . . 1 . . . . 163 GLN HA . 26659 1 283 . 1 1 33 33 GLN HB2 H 1 2.041 . . 2 . . . . 163 GLN HB# . 26659 1 284 . 1 1 33 33 GLN HB3 H 1 2.041 . . 2 . . . . 163 GLN HB# . 26659 1 285 . 1 1 33 33 GLN HG2 H 1 1.803 . . 2 . . . . 163 GLN HG# . 26659 1 286 . 1 1 33 33 GLN HG3 H 1 1.803 . . 2 . . . . 163 GLN HG# . 26659 1 287 . 1 1 33 33 GLN HE21 H 1 7.282 . . 1 . . . . 163 GLN HE21 . 26659 1 288 . 1 1 33 33 GLN HE22 H 1 3.644 . . 1 . . . . 163 GLN HE22 . 26659 1 289 . 1 1 33 33 GLN C C 13 175.916 . . 1 . . . . 163 GLN C . 26659 1 290 . 1 1 33 33 GLN CA C 13 57.416 . . 1 . . . . 163 GLN CA . 26659 1 291 . 1 1 33 33 GLN CB C 13 29.671 . . 1 . . . . 163 GLN CB . 26659 1 292 . 1 1 33 33 GLN CG C 13 33.241 . . 1 . . . . 163 GLN CG . 26659 1 293 . 1 1 33 33 GLN N N 15 123.182 . . 1 . . . . 163 GLN N . 26659 1 294 . 1 1 33 33 GLN NE2 N 15 107.818 . . 1 . . . . 163 GLN NE2 . 26659 1 295 . 1 1 34 34 LYS H H 1 10.576 . . 1 . . . . 164 LYS H . 26659 1 296 . 1 1 34 34 LYS HA H 1 4.760 . . 1 . . . . 164 LYS HA . 26659 1 297 . 1 1 34 34 LYS C C 13 175.334 . . 1 . . . . 164 LYS C . 26659 1 298 . 1 1 34 34 LYS CA C 13 55.250 . . 1 . . . . 164 LYS CA . 26659 1 299 . 1 1 34 34 LYS CB C 13 35.056 . . 1 . . . . 164 LYS CB . 26659 1 300 . 1 1 34 34 LYS CE C 13 41.948 . . 1 . . . . 164 LYS CE . 26659 1 301 . 1 1 34 34 LYS N N 15 131.781 . . 1 . . . . 164 LYS N . 26659 1 302 . 1 1 35 35 LYS H H 1 8.852 . . 1 . . . . 165 LYS H . 26659 1 303 . 1 1 35 35 LYS HA H 1 4.620 . . 1 . . . . 165 LYS HA . 26659 1 304 . 1 1 35 35 LYS HB2 H 1 1.984 . . 1 . . . . 165 LYS HB2 . 26659 1 305 . 1 1 35 35 LYS HB3 H 1 1.860 . . 1 . . . . 165 LYS HB3 . 26659 1 306 . 1 1 35 35 LYS HG2 H 1 1.527 . . 2 . . . . 165 LYS HG# . 26659 1 307 . 1 1 35 35 LYS HG3 H 1 1.527 . . 2 . . . . 165 LYS HG# . 26659 1 308 . 1 1 35 35 LYS HD2 H 1 1.816 . . 2 . . . . 165 LYS HD# . 26659 1 309 . 1 1 35 35 LYS HD3 H 1 1.816 . . 2 . . . . 165 LYS HD# . 26659 1 310 . 1 1 35 35 LYS HE2 H 1 2.961 . . 2 . . . . 165 LYS HE# . 26659 1 311 . 1 1 35 35 LYS HE3 H 1 2.961 . . 2 . . . . 165 LYS HE# . 26659 1 312 . 1 1 35 35 LYS C C 13 175.952 . . 1 . . . . 165 LYS C . 26659 1 313 . 1 1 35 35 LYS CA C 13 55.470 . . 1 . . . . 165 LYS CA . 26659 1 314 . 1 1 35 35 LYS CB C 13 35.949 . . 1 . . . . 165 LYS CB . 26659 1 315 . 1 1 35 35 LYS CG C 13 25.032 . . 1 . . . . 165 LYS CG . 26659 1 316 . 1 1 35 35 LYS CD C 13 28.998 . . 1 . . . . 165 LYS CD . 26659 1 317 . 1 1 35 35 LYS CE C 13 42.241 . . 1 . . . . 165 LYS CE . 26659 1 318 . 1 1 35 35 LYS N N 15 120.789 . . 1 . . . . 165 LYS N . 26659 1 319 . 1 1 36 36 GLY H H 1 9.074 . . 1 . . . . 166 GLY H . 26659 1 320 . 1 1 36 36 GLY N N 15 110.761 . . 1 . . . . 166 GLY N . 26659 1 321 . 1 1 37 37 PRO HA H 1 4.282 . . 1 . . . . 167 PRO HA . 26659 1 322 . 1 1 37 37 PRO HB2 H 1 2.493 . . 1 . . . . 167 PRO HB2 . 26659 1 323 . 1 1 37 37 PRO HB3 H 1 2.061 . . 1 . . . . 167 PRO HB3 . 26659 1 324 . 1 1 37 37 PRO HG2 H 1 2.204 . . 2 . . . . 167 PRO HG# . 26659 1 325 . 1 1 37 37 PRO HG3 H 1 2.204 . . 2 . . . . 167 PRO HG# . 26659 1 326 . 1 1 37 37 PRO HD2 H 1 3.967 . . 1 . . . . 167 PRO HD2 . 26659 1 327 . 1 1 37 37 PRO HD3 H 1 3.780 . . 1 . . . . 167 PRO HD3 . 26659 1 328 . 1 1 37 37 PRO C C 13 179.150 . . 1 . . . . 167 PRO C . 26659 1 329 . 1 1 37 37 PRO CA C 13 65.635 . . 1 . . . . 167 PRO CA . 26659 1 330 . 1 1 37 37 PRO CB C 13 32.376 . . 1 . . . . 167 PRO CB . 26659 1 331 . 1 1 37 37 PRO CG C 13 27.661 . . 1 . . . . 167 PRO CG . 26659 1 332 . 1 1 37 37 PRO CD C 13 49.969 . . 1 . . . . 167 PRO CD . 26659 1 333 . 1 1 38 38 THR H H 1 8.418 . . 1 . . . . 168 THR H . 26659 1 334 . 1 1 38 38 THR HA H 1 4.402 . . 1 . . . . 168 THR HA . 26659 1 335 . 1 1 38 38 THR HB H 1 4.633 . . 1 . . . . 168 THR HB . 26659 1 336 . 1 1 38 38 THR HG21 H 1 1.366 . . 1 . . . . 168 THR HG2 . 26659 1 337 . 1 1 38 38 THR HG22 H 1 1.366 . . 1 . . . . 168 THR HG2 . 26659 1 338 . 1 1 38 38 THR HG23 H 1 1.366 . . 1 . . . . 168 THR HG2 . 26659 1 339 . 1 1 38 38 THR C C 13 174.774 . . 1 . . . . 168 THR C . 26659 1 340 . 1 1 38 38 THR CA C 13 62.918 . . 1 . . . . 168 THR CA . 26659 1 341 . 1 1 38 38 THR CB C 13 68.947 . . 1 . . . . 168 THR CB . 26659 1 342 . 1 1 38 38 THR CG2 C 13 21.798 . . 1 . . . . 168 THR CG2 . 26659 1 343 . 1 1 38 38 THR N N 15 106.775 . . 1 . . . . 168 THR N . 26659 1 344 . 1 1 39 39 ALA H H 1 8.108 . . 1 . . . . 169 ALA H . 26659 1 345 . 1 1 39 39 ALA HA H 1 4.160 . . 1 . . . . 169 ALA HA . 26659 1 346 . 1 1 39 39 ALA HB1 H 1 1.537 . . 1 . . . . 169 ALA HB . 26659 1 347 . 1 1 39 39 ALA HB2 H 1 1.537 . . 1 . . . . 169 ALA HB . 26659 1 348 . 1 1 39 39 ALA HB3 H 1 1.537 . . 1 . . . . 169 ALA HB . 26659 1 349 . 1 1 39 39 ALA C C 13 176.582 . . 1 . . . . 169 ALA C . 26659 1 350 . 1 1 39 39 ALA CA C 13 52.440 . . 1 . . . . 169 ALA CA . 26659 1 351 . 1 1 39 39 ALA N N 15 122.000 . . 1 . . . . 169 ALA N . 26659 1 352 . 1 1 40 40 VAL H H 1 6.786 . . 1 . . . . 170 VAL H . 26659 1 353 . 1 1 40 40 VAL HA H 1 3.519 . . 1 . . . . 170 VAL HA . 26659 1 354 . 1 1 40 40 VAL HB H 1 2.130 . . 1 . . . . 170 VAL HB . 26659 1 355 . 1 1 40 40 VAL HG11 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 356 . 1 1 40 40 VAL HG12 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 357 . 1 1 40 40 VAL HG13 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 358 . 1 1 40 40 VAL HG21 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 359 . 1 1 40 40 VAL HG22 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 360 . 1 1 40 40 VAL HG23 H 1 0.839 . . 2 . . . . 170 VAL HG# . 26659 1 361 . 1 1 40 40 VAL N N 15 116.584 . . 1 . . . . 170 VAL N . 26659 1 362 . 1 1 42 42 GLN H H 1 8.489 . . 1 . . . . 172 GLN H . 26659 1 363 . 1 1 42 42 GLN C C 13 174.313 . . 1 . . . . 172 GLN C . 26659 1 364 . 1 1 42 42 GLN CA C 13 53.688 . . 1 . . . . 172 GLN CA . 26659 1 365 . 1 1 42 42 GLN CB C 13 30.538 . . 1 . . . . 172 GLN CB . 26659 1 366 . 1 1 42 42 GLN N N 15 116.940 . . 1 . . . . 172 GLN N . 26659 1 367 . 1 1 43 43 LEU H H 1 6.687 . . 1 . . . . 173 LEU H . 26659 1 368 . 1 1 43 43 LEU HA H 1 4.929 . . 1 . . . . 173 LEU HA . 26659 1 369 . 1 1 43 43 LEU HB2 H 1 1.398 . . 1 . . . . 173 LEU HB2 . 26659 1 370 . 1 1 43 43 LEU HB3 H 1 0.804 . . 1 . . . . 173 LEU HB3 . 26659 1 371 . 1 1 43 43 LEU HG H 1 1.283 . . 1 . . . . 173 LEU HG . 26659 1 372 . 1 1 43 43 LEU HD11 H 1 0.476 . . 1 . . . . 173 LEU HD1 . 26659 1 373 . 1 1 43 43 LEU HD12 H 1 0.476 . . 1 . . . . 173 LEU HD1 . 26659 1 374 . 1 1 43 43 LEU HD13 H 1 0.476 . . 1 . . . . 173 LEU HD1 . 26659 1 375 . 1 1 43 43 LEU HD21 H 1 -0.038 . . 1 . . . . 173 LEU HD2 . 26659 1 376 . 1 1 43 43 LEU HD22 H 1 -0.038 . . 1 . . . . 173 LEU HD2 . 26659 1 377 . 1 1 43 43 LEU HD23 H 1 -0.038 . . 1 . . . . 173 LEU HD2 . 26659 1 378 . 1 1 43 43 LEU C C 13 176.348 . . 1 . . . . 173 LEU C . 26659 1 379 . 1 1 43 43 LEU CA C 13 52.976 . . 1 . . . . 173 LEU CA . 26659 1 380 . 1 1 43 43 LEU CB C 13 45.997 . . 1 . . . . 173 LEU CB . 26659 1 381 . 1 1 43 43 LEU N N 15 118.379 . . 1 . . . . 173 LEU N . 26659 1 382 . 1 1 44 44 TRP H H 1 9.043 . . 1 . . . . 174 TRP H . 26659 1 383 . 1 1 44 44 TRP HA H 1 5.386 . . 1 . . . . 174 TRP HA . 26659 1 384 . 1 1 44 44 TRP HB2 H 1 3.111 . . 1 . . . . 174 TRP HB2 . 26659 1 385 . 1 1 44 44 TRP HB3 H 1 2.105 . . 1 . . . . 174 TRP HB3 . 26659 1 386 . 1 1 44 44 TRP HD1 H 1 7.612 . . 1 . . . . 174 TRP HD1 . 26659 1 387 . 1 1 44 44 TRP HE1 H 1 9.145 . . 1 . . . . 174 TRP HE1 . 26659 1 388 . 1 1 44 44 TRP HZ2 H 1 6.924 . . 1 . . . . 174 TRP HZ2 . 26659 1 389 . 1 1 44 44 TRP HZ3 H 1 7.242 . . 1 . . . . 174 TRP HZ3 . 26659 1 390 . 1 1 44 44 TRP HH2 H 1 6.741 . . 1 . . . . 174 TRP HH2 . 26659 1 391 . 1 1 44 44 TRP C C 13 172.770 . . 1 . . . . 174 TRP C . 26659 1 392 . 1 1 44 44 TRP CD1 C 13 129.870 . . 1 . . . . 174 TRP CD1 . 26659 1 393 . 1 1 44 44 TRP CZ2 C 13 111.600 . . 1 . . . . 174 TRP CZ2 . 26659 1 394 . 1 1 44 44 TRP CZ3 C 13 121.280 . . 1 . . . . 174 TRP CZ3 . 26659 1 395 . 1 1 44 44 TRP CH2 C 13 122.934 . . 1 . . . . 174 TRP CH2 . 26659 1 396 . 1 1 44 44 TRP N N 15 124.994 . . 1 . . . . 174 TRP N . 26659 1 397 . 1 1 44 44 TRP NE1 N 15 126.397 . . 1 . . . . 174 TRP NE1 . 26659 1 398 . 1 1 45 45 TYR H H 1 9.450 . . 1 . . . . 175 TYR H . 26659 1 399 . 1 1 45 45 TYR HA H 1 5.211 . . 1 . . . . 175 TYR HA . 26659 1 400 . 1 1 45 45 TYR HB2 H 1 2.977 . . 2 . . . . 175 TYR HB# . 26659 1 401 . 1 1 45 45 TYR HB3 H 1 2.977 . . 2 . . . . 175 TYR HB# . 26659 1 402 . 1 1 45 45 TYR HD1 H 1 6.893 . . 3 . . . . 175 TYR HD# . 26659 1 403 . 1 1 45 45 TYR HD2 H 1 6.893 . . 3 . . . . 175 TYR HD# . 26659 1 404 . 1 1 45 45 TYR HE1 H 1 6.777 . . 3 . . . . 175 TYR HE# . 26659 1 405 . 1 1 45 45 TYR HE2 H 1 6.777 . . 3 . . . . 175 TYR HE# . 26659 1 406 . 1 1 45 45 TYR C C 13 173.399 . . 1 . . . . 175 TYR C . 26659 1 407 . 1 1 45 45 TYR CA C 13 56.294 . . 1 . . . . 175 TYR CA . 26659 1 408 . 1 1 45 45 TYR CB C 13 41.599 . . 1 . . . . 175 TYR CB . 26659 1 409 . 1 1 45 45 TYR CD1 C 13 133.638 . . 3 . . . . 175 TYR CD# . 26659 1 410 . 1 1 45 45 TYR CD2 C 13 133.638 . . 3 . . . . 175 TYR CD# . 26659 1 411 . 1 1 45 45 TYR CE1 C 13 117.958 . . 3 . . . . 175 TYR CE# . 26659 1 412 . 1 1 45 45 TYR CE2 C 13 117.958 . . 3 . . . . 175 TYR CE# . 26659 1 413 . 1 1 45 45 TYR N N 15 116.002 . . 1 . . . . 175 TYR N . 26659 1 414 . 1 1 46 46 THR H H 1 8.898 . . 1 . . . . 176 THR H . 26659 1 415 . 1 1 46 46 THR HA H 1 5.238 . . 1 . . . . 176 THR HA . 26659 1 416 . 1 1 46 46 THR HB H 1 4.089 . . 1 . . . . 176 THR HB . 26659 1 417 . 1 1 46 46 THR HG21 H 1 1.352 . . 1 . . . . 176 THR HG2 . 26659 1 418 . 1 1 46 46 THR HG22 H 1 1.352 . . 1 . . . . 176 THR HG2 . 26659 1 419 . 1 1 46 46 THR HG23 H 1 1.352 . . 1 . . . . 176 THR HG2 . 26659 1 420 . 1 1 46 46 THR C C 13 175.440 . . 1 . . . . 176 THR C . 26659 1 421 . 1 1 46 46 THR CA C 13 58.966 . . 1 . . . . 176 THR CA . 26659 1 422 . 1 1 46 46 THR CB C 13 71.077 . . 1 . . . . 176 THR CB . 26659 1 423 . 1 1 46 46 THR CG2 C 13 22.283 . . 1 . . . . 176 THR CG2 . 26659 1 424 . 1 1 46 46 THR N N 15 108.097 . . 1 . . . . 176 THR N . 26659 1 425 . 1 1 47 47 ASP H H 1 8.986 . . 1 . . . . 177 ASP H . 26659 1 426 . 1 1 47 47 ASP HA H 1 4.782 . . 1 . . . . 177 ASP HA . 26659 1 427 . 1 1 47 47 ASP HB2 H 1 2.524 . . 2 . . . . 177 ASP HB# . 26659 1 428 . 1 1 47 47 ASP HB3 H 1 2.524 . . 2 . . . . 177 ASP HB# . 26659 1 429 . 1 1 47 47 ASP C C 13 178.564 . . 1 . . . . 177 ASP C . 26659 1 430 . 1 1 47 47 ASP CA C 13 52.806 . . 1 . . . . 177 ASP CA . 26659 1 431 . 1 1 47 47 ASP CB C 13 40.948 . . 1 . . . . 177 ASP CB . 26659 1 432 . 1 1 47 47 ASP N N 15 124.966 . . 1 . . . . 177 ASP N . 26659 1 433 . 1 1 48 48 GLN H H 1 8.680 . . 1 . . . . 178 GLN H . 26659 1 434 . 1 1 48 48 GLN HA H 1 4.221 . . 1 . . . . 178 GLN HA . 26659 1 435 . 1 1 48 48 GLN HB2 H 1 2.254 . . 2 . . . . 178 GLN HB# . 26659 1 436 . 1 1 48 48 GLN HB3 H 1 2.254 . . 2 . . . . 178 GLN HB# . 26659 1 437 . 1 1 48 48 GLN HG2 H 1 2.559 . . 2 . . . . 178 GLN HG# . 26659 1 438 . 1 1 48 48 GLN HG3 H 1 2.559 . . 2 . . . . 178 GLN HG# . 26659 1 439 . 1 1 48 48 GLN HE21 H 1 7.794 . . 1 . . . . 178 GLN HE21 . 26659 1 440 . 1 1 48 48 GLN HE22 H 1 7.079 . . 1 . . . . 178 GLN HE22 . 26659 1 441 . 1 1 48 48 GLN C C 13 177.394 . . 1 . . . . 178 GLN C . 26659 1 442 . 1 1 48 48 GLN CA C 13 59.339 . . 1 . . . . 178 GLN CA . 26659 1 443 . 1 1 48 48 GLN CB C 13 28.508 . . 1 . . . . 178 GLN CB . 26659 1 444 . 1 1 48 48 GLN CG C 13 34.282 . . 1 . . . . 178 GLN CG . 26659 1 445 . 1 1 48 48 GLN N N 15 116.800 . . 1 . . . . 178 GLN N . 26659 1 446 . 1 1 48 48 GLN NE2 N 15 112.947 . . 1 . . . . 178 GLN NE2 . 26659 1 447 . 1 1 49 49 GLN H H 1 8.601 . . 1 . . . . 179 GLN H . 26659 1 448 . 1 1 49 49 GLN HA H 1 4.554 . . 1 . . . . 179 GLN HA . 26659 1 449 . 1 1 49 49 GLN HB2 H 1 2.327 . . 2 . . . . 179 GLN HB# . 26659 1 450 . 1 1 49 49 GLN HB3 H 1 2.327 . . 2 . . . . 179 GLN HB# . 26659 1 451 . 1 1 49 49 GLN HG2 H 1 2.504 . . 2 . . . . 179 GLN HG# . 26659 1 452 . 1 1 49 49 GLN HG3 H 1 2.504 . . 2 . . . . 179 GLN HG# . 26659 1 453 . 1 1 49 49 GLN HE21 H 1 7.794 . . 1 . . . . 179 GLN HE21 . 26659 1 454 . 1 1 49 49 GLN HE22 H 1 6.954 . . 1 . . . . 179 GLN HE22 . 26659 1 455 . 1 1 49 49 GLN C C 13 175.444 . . 1 . . . . 179 GLN C . 26659 1 456 . 1 1 49 49 GLN CA C 13 56.088 . . 1 . . . . 179 GLN CA . 26659 1 457 . 1 1 49 49 GLN CB C 13 29.678 . . 1 . . . . 179 GLN CB . 26659 1 458 . 1 1 49 49 GLN CG C 13 35.318 . . 1 . . . . 179 GLN CG . 26659 1 459 . 1 1 49 49 GLN N N 15 118.355 . . 1 . . . . 179 GLN N . 26659 1 460 . 1 1 49 49 GLN NE2 N 15 111.775 . . 1 . . . . 179 GLN NE2 . 26659 1 461 . 1 1 50 50 GLY H H 1 8.328 . . 1 . . . . 180 GLY H . 26659 1 462 . 1 1 50 50 GLY HA2 H 1 4.390 . . 1 . . . . 180 GLY HA2 . 26659 1 463 . 1 1 50 50 GLY HA3 H 1 3.672 . . 1 . . . . 180 GLY HA3 . 26659 1 464 . 1 1 50 50 GLY C C 13 173.011 . . 1 . . . . 180 GLY C . 26659 1 465 . 1 1 50 50 GLY CA C 13 45.224 . . 1 . . . . 180 GLY CA . 26659 1 466 . 1 1 50 50 GLY N N 15 108.281 . . 1 . . . . 180 GLY N . 26659 1 467 . 1 1 51 51 VAL H H 1 8.218 . . 1 . . . . 181 VAL H . 26659 1 468 . 1 1 51 51 VAL HA H 1 4.210 . . 1 . . . . 181 VAL HA . 26659 1 469 . 1 1 51 51 VAL HB H 1 2.535 . . 1 . . . . 181 VAL HB . 26659 1 470 . 1 1 51 51 VAL HG11 H 1 1.170 . . 1 . . . . 181 VAL HG1 . 26659 1 471 . 1 1 51 51 VAL HG12 H 1 1.170 . . 1 . . . . 181 VAL HG1 . 26659 1 472 . 1 1 51 51 VAL HG13 H 1 1.170 . . 1 . . . . 181 VAL HG1 . 26659 1 473 . 1 1 51 51 VAL HG21 H 1 0.877 . . 1 . . . . 181 VAL HG2 . 26659 1 474 . 1 1 51 51 VAL HG22 H 1 0.877 . . 1 . . . . 181 VAL HG2 . 26659 1 475 . 1 1 51 51 VAL HG23 H 1 0.877 . . 1 . . . . 181 VAL HG2 . 26659 1 476 . 1 1 51 51 VAL C C 13 176.538 . . 1 . . . . 181 VAL C . 26659 1 477 . 1 1 51 51 VAL CA C 13 63.282 . . 1 . . . . 181 VAL CA . 26659 1 478 . 1 1 51 51 VAL CB C 13 31.116 . . 1 . . . . 181 VAL CB . 26659 1 479 . 1 1 51 51 VAL CG1 C 13 23.183 . . 2 . . . . 181 VAL CG# . 26659 1 480 . 1 1 51 51 VAL CG2 C 13 23.183 . . 2 . . . . 181 VAL CG# . 26659 1 481 . 1 1 51 51 VAL N N 15 123.223 . . 1 . . . . 181 VAL N . 26659 1 482 . 1 1 52 52 ILE H H 1 8.943 . . 1 . . . . 182 ILE H . 26659 1 483 . 1 1 52 52 ILE HA H 1 4.329 . . 1 . . . . 182 ILE HA . 26659 1 484 . 1 1 52 52 ILE HB H 1 1.536 . . 1 . . . . 182 ILE HB . 26659 1 485 . 1 1 52 52 ILE HG12 H 1 1.403 . . 1 . . . . 182 ILE HG12 . 26659 1 486 . 1 1 52 52 ILE HG13 H 1 1.137 . . 1 . . . . 182 ILE HG13 . 26659 1 487 . 1 1 52 52 ILE HG21 H 1 0.857 . . 1 . . . . 182 ILE HG2 . 26659 1 488 . 1 1 52 52 ILE HG22 H 1 0.857 . . 1 . . . . 182 ILE HG2 . 26659 1 489 . 1 1 52 52 ILE HG23 H 1 0.857 . . 1 . . . . 182 ILE HG2 . 26659 1 490 . 1 1 52 52 ILE HD11 H 1 0.584 . . 1 . . . . 182 ILE HD1 . 26659 1 491 . 1 1 52 52 ILE HD12 H 1 0.584 . . 1 . . . . 182 ILE HD1 . 26659 1 492 . 1 1 52 52 ILE HD13 H 1 0.584 . . 1 . . . . 182 ILE HD1 . 26659 1 493 . 1 1 52 52 ILE C C 13 175.023 . . 1 . . . . 182 ILE C . 26659 1 494 . 1 1 52 52 ILE CA C 13 63.245 . . 1 . . . . 182 ILE CA . 26659 1 495 . 1 1 52 52 ILE CB C 13 39.777 . . 1 . . . . 182 ILE CB . 26659 1 496 . 1 1 52 52 ILE CG2 C 13 19.255 . . 1 . . . . 182 ILE CG2 . 26659 1 497 . 1 1 52 52 ILE N N 15 127.884 . . 1 . . . . 182 ILE N . 26659 1 498 . 1 1 53 53 ARG H H 1 9.041 . . 1 . . . . 183 ARG H . 26659 1 499 . 1 1 53 53 ARG HA H 1 5.358 . . 1 . . . . 183 ARG HA . 26659 1 500 . 1 1 53 53 ARG HB2 H 1 1.263 . . 2 . . . . 183 ARG HB# . 26659 1 501 . 1 1 53 53 ARG HB3 H 1 1.263 . . 2 . . . . 183 ARG HB# . 26659 1 502 . 1 1 53 53 ARG HG2 H 1 1.530 . . 2 . . . . 183 ARG HG# . 26659 1 503 . 1 1 53 53 ARG HG3 H 1 1.530 . . 2 . . . . 183 ARG HG# . 26659 1 504 . 1 1 53 53 ARG HD2 H 1 3.224 . . 1 . . . . 183 ARG HD2 . 26659 1 505 . 1 1 53 53 ARG HD3 H 1 2.995 . . 1 . . . . 183 ARG HD3 . 26659 1 506 . 1 1 53 53 ARG HE H 1 7.011 . . 1 . . . . 183 ARG HE . 26659 1 507 . 1 1 53 53 ARG CA C 13 51.650 . . 1 . . . . 183 ARG CA . 26659 1 508 . 1 1 53 53 ARG CB C 13 34.612 . . 1 . . . . 183 ARG CB . 26659 1 509 . 1 1 53 53 ARG N N 15 123.054 . . 1 . . . . 183 ARG N . 26659 1 510 . 1 1 53 53 ARG NE N 15 84.174 . . 1 . . . . 183 ARG NE . 26659 1 511 . 1 1 55 55 LYS H H 1 8.500 . . 1 . . . . 185 LYS H . 26659 1 512 . 1 1 55 55 LYS N N 15 128.411 . . 1 . . . . 185 LYS N . 26659 1 513 . 1 1 56 56 LEU H H 1 8.130 . . 1 . . . . 186 LEU H . 26659 1 514 . 1 1 56 56 LEU N N 15 118.089 . . 1 . . . . 186 LEU N . 26659 1 515 . 1 1 58 58 ASP H H 1 8.444 . . 1 . . . . 188 ASP H . 26659 1 516 . 1 1 58 58 ASP C C 13 176.611 . . 1 . . . . 188 ASP C . 26659 1 517 . 1 1 58 58 ASP N N 15 112.720 . . 1 . . . . 188 ASP N . 26659 1 518 . 1 1 59 59 PHE H H 1 8.186 . . 1 . . . . 189 PHE H . 26659 1 519 . 1 1 59 59 PHE HA H 1 4.465 . . 1 . . . . 189 PHE HA . 26659 1 520 . 1 1 59 59 PHE C C 13 175.327 . . 1 . . . . 189 PHE C . 26659 1 521 . 1 1 59 59 PHE N N 15 120.754 . . 1 . . . . 189 PHE N . 26659 1 522 . 1 1 60 60 ALA H H 1 8.848 . . 1 . . . . 190 ALA H . 26659 1 523 . 1 1 60 60 ALA N N 15 120.789 . . 1 . . . . 190 ALA N . 26659 1 524 . 1 1 61 61 ILE H H 1 8.110 . . 1 . . . . 191 ILE H . 26659 1 525 . 1 1 61 61 ILE HA H 1 3.841 . . 1 . . . . 191 ILE HA . 26659 1 526 . 1 1 61 61 ILE HB H 1 1.727 . . 1 . . . . 191 ILE HB . 26659 1 527 . 1 1 61 61 ILE HG12 H 1 1.549 . . 1 . . . . 191 ILE HG12 . 26659 1 528 . 1 1 61 61 ILE HG13 H 1 0.458 . . 1 . . . . 191 ILE HG13 . 26659 1 529 . 1 1 61 61 ILE HG21 H 1 0.062 . . 1 . . . . 191 ILE HG2 . 26659 1 530 . 1 1 61 61 ILE HG22 H 1 0.062 . . 1 . . . . 191 ILE HG2 . 26659 1 531 . 1 1 61 61 ILE HG23 H 1 0.062 . . 1 . . . . 191 ILE HG2 . 26659 1 532 . 1 1 61 61 ILE HD11 H 1 -0.006 . . 1 . . . . 191 ILE HD1 . 26659 1 533 . 1 1 61 61 ILE HD12 H 1 -0.006 . . 1 . . . . 191 ILE HD1 . 26659 1 534 . 1 1 61 61 ILE HD13 H 1 -0.006 . . 1 . . . . 191 ILE HD1 . 26659 1 535 . 1 1 61 61 ILE C C 13 173.428 . . 1 . . . . 191 ILE C . 26659 1 536 . 1 1 61 61 ILE CA C 13 63.021 . . 1 . . . . 191 ILE CA . 26659 1 537 . 1 1 61 61 ILE CB C 13 38.427 . . 1 . . . . 191 ILE CB . 26659 1 538 . 1 1 61 61 ILE N N 15 120.094 . . 1 . . . . 191 ILE N . 26659 1 539 . 1 1 62 62 ASP H H 1 9.213 . . 1 . . . . 192 ASP H . 26659 1 540 . 1 1 62 62 ASP HA H 1 5.513 . . 1 . . . . 192 ASP HA . 26659 1 541 . 1 1 62 62 ASP HB2 H 1 2.999 . . 1 . . . . 192 ASP HB2 . 26659 1 542 . 1 1 62 62 ASP HB3 H 1 2.163 . . 1 . . . . 192 ASP HB3 . 26659 1 543 . 1 1 62 62 ASP C C 13 175.682 . . 1 . . . . 192 ASP C . 26659 1 544 . 1 1 62 62 ASP CA C 13 53.206 . . 1 . . . . 192 ASP CA . 26659 1 545 . 1 1 62 62 ASP CB C 13 45.946 . . 1 . . . . 192 ASP CB . 26659 1 546 . 1 1 62 62 ASP N N 15 122.624 . . 1 . . . . 192 ASP N . 26659 1 547 . 1 1 63 63 ALA H H 1 8.134 . . 1 . . . . 193 ALA H . 26659 1 548 . 1 1 63 63 ALA HA H 1 5.099 . . 1 . . . . 193 ALA HA . 26659 1 549 . 1 1 63 63 ALA HB1 H 1 1.549 . . 1 . . . . 193 ALA HB . 26659 1 550 . 1 1 63 63 ALA HB2 H 1 1.549 . . 1 . . . . 193 ALA HB . 26659 1 551 . 1 1 63 63 ALA HB3 H 1 1.549 . . 1 . . . . 193 ALA HB . 26659 1 552 . 1 1 63 63 ALA C C 13 176.794 . . 1 . . . . 193 ALA C . 26659 1 553 . 1 1 63 63 ALA CA C 13 50.051 . . 1 . . . . 193 ALA CA . 26659 1 554 . 1 1 63 63 ALA CB C 13 21.739 . . 1 . . . . 193 ALA CB . 26659 1 555 . 1 1 63 63 ALA N N 15 128.882 . . 1 . . . . 193 ALA N . 26659 1 556 . 1 1 64 64 SER H H 1 9.188 . . 1 . . . . 194 SER H . 26659 1 557 . 1 1 64 64 SER HA H 1 4.192 . . 1 . . . . 194 SER HA . 26659 1 558 . 1 1 64 64 SER HB2 H 1 3.701 . . 2 . . . . 194 SER HB# . 26659 1 559 . 1 1 64 64 SER HB3 H 1 3.701 . . 2 . . . . 194 SER HB# . 26659 1 560 . 1 1 64 64 SER C C 13 174.474 . . 1 . . . . 194 SER C . 26659 1 561 . 1 1 64 64 SER CA C 13 62.133 . . 1 . . . . 194 SER CA . 26659 1 562 . 1 1 64 64 SER CB C 13 62.447 . . 1 . . . . 194 SER CB . 26659 1 563 . 1 1 64 64 SER N N 15 117.914 . . 1 . . . . 194 SER N . 26659 1 564 . 1 1 65 65 HIS H H 1 9.069 . . 1 . . . . 195 HIS H . 26659 1 565 . 1 1 65 65 HIS HA H 1 5.089 . . 1 . . . . 195 HIS HA . 26659 1 566 . 1 1 65 65 HIS HB2 H 1 3.629 . . 1 . . . . 195 HIS HB2 . 26659 1 567 . 1 1 65 65 HIS HB3 H 1 3.292 . . 1 . . . . 195 HIS HB3 . 26659 1 568 . 1 1 65 65 HIS HD2 H 1 7.381 . . 1 . . . . 195 HIS HD2 . 26659 1 569 . 1 1 65 65 HIS HE1 H 1 8.528 . . 1 . . . . 195 HIS HE1 . 26659 1 570 . 1 1 65 65 HIS C C 13 173.479 . . 1 . . . . 195 HIS C . 26659 1 571 . 1 1 65 65 HIS CA C 13 53.699 . . 1 . . . . 195 HIS CA . 26659 1 572 . 1 1 65 65 HIS CB C 13 29.858 . . 1 . . . . 195 HIS CB . 26659 1 573 . 1 1 65 65 HIS CD2 C 13 120.036 . . 1 . . . . 195 HIS CD2 . 26659 1 574 . 1 1 65 65 HIS CE1 C 13 136.335 . . 1 . . . . 195 HIS CE1 . 26659 1 575 . 1 1 65 65 HIS N N 15 120.576 . . 1 . . . . 195 HIS N . 26659 1 576 . 1 1 66 66 GLU H H 1 8.635 . . 1 . . . . 196 GLU H . 26659 1 577 . 1 1 66 66 GLU HA H 1 4.152 . . 1 . . . . 196 GLU HA . 26659 1 578 . 1 1 66 66 GLU HB2 H 1 2.231 . . 2 . . . . 196 GLU HB# . 26659 1 579 . 1 1 66 66 GLU HB3 H 1 2.231 . . 2 . . . . 196 GLU HB# . 26659 1 580 . 1 1 66 66 GLU HG2 H 1 2.465 . . 2 . . . . 196 GLU HG# . 26659 1 581 . 1 1 66 66 GLU HG3 H 1 2.465 . . 2 . . . . 196 GLU HG# . 26659 1 582 . 1 1 66 66 GLU C C 13 176.801 . . 1 . . . . 196 GLU C . 26659 1 583 . 1 1 66 66 GLU CA C 13 60.071 . . 1 . . . . 196 GLU CA . 26659 1 584 . 1 1 66 66 GLU CB C 13 30.012 . . 1 . . . . 196 GLU CB . 26659 1 585 . 1 1 66 66 GLU CG C 13 36.907 . . 1 . . . . 196 GLU CG . 26659 1 586 . 1 1 66 66 GLU N N 15 118.388 . . 1 . . . . 196 GLU N . 26659 1 587 . 1 1 67 67 GLN H H 1 7.852 . . 1 . . . . 197 GLN H . 26659 1 588 . 1 1 67 67 GLN HA H 1 5.150 . . 1 . . . . 197 GLN HA . 26659 1 589 . 1 1 67 67 GLN HB2 H 1 2.279 . . 1 . . . . 197 GLN HB2 . 26659 1 590 . 1 1 67 67 GLN HB3 H 1 2.146 . . 1 . . . . 197 GLN HB3 . 26659 1 591 . 1 1 67 67 GLN HG2 H 1 2.392 . . 2 . . . . 197 GLN HG# . 26659 1 592 . 1 1 67 67 GLN HG3 H 1 2.392 . . 2 . . . . 197 GLN HG# . 26659 1 593 . 1 1 67 67 GLN HE21 H 1 7.770 . . 1 . . . . 197 GLN HE21 . 26659 1 594 . 1 1 67 67 GLN HE22 H 1 6.811 . . 1 . . . . 197 GLN HE22 . 26659 1 595 . 1 1 67 67 GLN C C 13 177.087 . . 1 . . . . 197 GLN C . 26659 1 596 . 1 1 67 67 GLN CA C 13 54.361 . . 1 . . . . 197 GLN CA . 26659 1 597 . 1 1 67 67 GLN CB C 13 30.103 . . 1 . . . . 197 GLN CB . 26659 1 598 . 1 1 67 67 GLN CG C 13 33.907 . . 1 . . . . 197 GLN CG . 26659 1 599 . 1 1 67 67 GLN N N 15 114.686 . . 1 . . . . 197 GLN N . 26659 1 600 . 1 1 67 67 GLN NE2 N 15 111.730 . . 1 . . . . 197 GLN NE2 . 26659 1 601 . 1 1 68 68 ILE H H 1 8.534 . . 1 . . . . 198 ILE H . 26659 1 602 . 1 1 68 68 ILE HA H 1 4.748 . . 1 . . . . 198 ILE HA . 26659 1 603 . 1 1 68 68 ILE HB H 1 1.819 . . 1 . . . . 198 ILE HB . 26659 1 604 . 1 1 68 68 ILE HG12 H 1 1.542 . . 1 . . . . 198 ILE HG1# . 26659 1 605 . 1 1 68 68 ILE HG13 H 1 1.542 . . 1 . . . . 198 ILE HG1# . 26659 1 606 . 1 1 68 68 ILE HG21 H 1 0.738 . . 1 . . . . 198 ILE HG2 . 26659 1 607 . 1 1 68 68 ILE HG22 H 1 0.738 . . 1 . . . . 198 ILE HG2 . 26659 1 608 . 1 1 68 68 ILE HG23 H 1 0.738 . . 1 . . . . 198 ILE HG2 . 26659 1 609 . 1 1 68 68 ILE HD11 H 1 0.605 . . 1 . . . . 198 ILE HD1 . 26659 1 610 . 1 1 68 68 ILE HD12 H 1 0.605 . . 1 . . . . 198 ILE HD1 . 26659 1 611 . 1 1 68 68 ILE HD13 H 1 0.605 . . 1 . . . . 198 ILE HD1 . 26659 1 612 . 1 1 68 68 ILE C C 13 175.345 . . 1 . . . . 198 ILE C . 26659 1 613 . 1 1 68 68 ILE CA C 13 62.336 . . 1 . . . . 198 ILE CA . 26659 1 614 . 1 1 68 68 ILE CB C 13 38.516 . . 1 . . . . 198 ILE CB . 26659 1 615 . 1 1 68 68 ILE N N 15 121.191 . . 1 . . . . 198 ILE N . 26659 1 616 . 1 1 69 69 GLU H H 1 8.763 . . 1 . . . . 199 GLU H . 26659 1 617 . 1 1 69 69 GLU HA H 1 5.563 . . 1 . . . . 199 GLU HA . 26659 1 618 . 1 1 69 69 GLU N N 15 120.575 . . 1 . . . . 199 GLU N . 26659 1 619 . 1 1 70 70 THR HA H 1 5.437 . . 1 . . . . 200 THR HA . 26659 1 620 . 1 1 71 71 GLN H H 1 8.749 . . 1 . . . . 201 GLN H . 26659 1 621 . 1 1 71 71 GLN HA H 1 4.636 . . 1 . . . . 201 GLN HA . 26659 1 622 . 1 1 71 71 GLN HE21 H 1 7.952 . . 1 . . . . 201 GLN HE21 . 26659 1 623 . 1 1 71 71 GLN HE22 H 1 6.825 . . 1 . . . . 201 GLN HE22 . 26659 1 624 . 1 1 71 71 GLN N N 15 121.400 . . 1 . . . . 201 GLN N . 26659 1 625 . 1 1 71 71 GLN NE2 N 15 108.555 . . 1 . . . . 201 GLN NE2 . 26659 1 626 . 1 1 72 72 PRO HA H 1 4.307 . . 1 . . . . 202 PRO HA . 26659 1 627 . 1 1 72 72 PRO HB2 H 1 2.237 . . 2 . . . . 202 PRO HB# . 26659 1 628 . 1 1 72 72 PRO HB3 H 1 2.237 . . 2 . . . . 202 PRO HB# . 26659 1 629 . 1 1 72 72 PRO HG2 H 1 1.856 . . 2 . . . . 202 PRO HG# . 26659 1 630 . 1 1 72 72 PRO HG3 H 1 1.856 . . 2 . . . . 202 PRO HG# . 26659 1 631 . 1 1 72 72 PRO HD2 H 1 3.971 . . 2 . . . . 202 PRO HD# . 26659 1 632 . 1 1 72 72 PRO HD3 H 1 3.971 . . 2 . . . . 202 PRO HD# . 26659 1 633 . 1 1 72 72 PRO C C 13 176.121 . . 1 . . . . 202 PRO C . 26659 1 634 . 1 1 72 72 PRO CA C 13 62.426 . . 1 . . . . 202 PRO CA . 26659 1 635 . 1 1 72 72 PRO CB C 13 31.541 . . 1 . . . . 202 PRO CB . 26659 1 636 . 1 1 72 72 PRO CG C 13 27.696 . . 1 . . . . 202 PRO CG . 26659 1 637 . 1 1 72 72 PRO CD C 13 50.072 . . 1 . . . . 202 PRO CD . 26659 1 638 . 1 1 73 73 PHE H H 1 9.827 . . 1 . . . . 203 PHE H . 26659 1 639 . 1 1 73 73 PHE HA H 1 3.987 . . 1 . . . . 203 PHE HA . 26659 1 640 . 1 1 73 73 PHE HB2 H 1 3.235 . . 1 . . . . 203 PHE HB2 . 26659 1 641 . 1 1 73 73 PHE HB3 H 1 3.089 . . 1 . . . . 203 PHE HB3 . 26659 1 642 . 1 1 73 73 PHE HD1 H 1 7.350 . . 3 . . . . 203 PHE HD# . 26659 1 643 . 1 1 73 73 PHE HD2 H 1 7.350 . . 3 . . . . 203 PHE HD# . 26659 1 644 . 1 1 73 73 PHE HE1 H 1 7.438 . . 3 . . . . 203 PHE HE# . 26659 1 645 . 1 1 73 73 PHE HE2 H 1 7.438 . . 3 . . . . 203 PHE HE# . 26659 1 646 . 1 1 73 73 PHE HZ H 1 7.452 . . 1 . . . . 203 PHE HZ . 26659 1 647 . 1 1 73 73 PHE CA C 13 61.605 . . 1 . . . . 203 PHE CA . 26659 1 648 . 1 1 73 73 PHE CB C 13 39.011 . . 1 . . . . 203 PHE CB . 26659 1 649 . 1 1 73 73 PHE CD1 C 13 130.777 . . 3 . . . . 203 PHE CD# . 26659 1 650 . 1 1 73 73 PHE CD2 C 13 130.777 . . 3 . . . . 203 PHE CD# . 26659 1 651 . 1 1 73 73 PHE CE1 C 13 130.060 . . 3 . . . . 203 PHE CE# . 26659 1 652 . 1 1 73 73 PHE CE2 C 13 130.060 . . 3 . . . . 203 PHE CE# . 26659 1 653 . 1 1 73 73 PHE CZ C 13 129.014 . . 1 . . . . 203 PHE CZ . 26659 1 654 . 1 1 73 73 PHE N N 15 122.693 . . 1 . . . . 203 PHE N . 26659 1 655 . 1 1 75 75 PRO C C 13 176.274 . . 1 . . . . 205 PRO C . 26659 1 656 . 1 1 75 75 PRO CA C 13 64.077 . . 1 . . . . 205 PRO CA . 26659 1 657 . 1 1 75 75 PRO CB C 13 32.557 . . 1 . . . . 205 PRO CB . 26659 1 658 . 1 1 75 75 PRO CG C 13 26.510 . . 1 . . . . 205 PRO CG . 26659 1 659 . 1 1 75 75 PRO CD C 13 51.654 . . 1 . . . . 205 PRO CD . 26659 1 660 . 1 1 76 76 ASN H H 1 8.386 . . 1 . . . . 206 ASN H . 26659 1 661 . 1 1 76 76 ASN HA H 1 4.825 . . 1 . . . . 206 ASN HA . 26659 1 662 . 1 1 76 76 ASN HB2 H 1 3.000 . . 1 . . . . 206 ASN HB2 . 26659 1 663 . 1 1 76 76 ASN HB3 H 1 2.748 . . 1 . . . . 206 ASN HB3 . 26659 1 664 . 1 1 76 76 ASN HD21 H 1 7.986 . . 1 . . . . 206 ASN HD21 . 26659 1 665 . 1 1 76 76 ASN HD22 H 1 7.106 . . 1 . . . . 206 ASN HD22 . 26659 1 666 . 1 1 76 76 ASN C C 13 173.743 . . 1 . . . . 206 ASN C . 26659 1 667 . 1 1 76 76 ASN CA C 13 53.057 . . 1 . . . . 206 ASN CA . 26659 1 668 . 1 1 76 76 ASN CB C 13 39.338 . . 1 . . . . 206 ASN CB . 26659 1 669 . 1 1 76 76 ASN N N 15 115.560 . . 1 . . . . 206 ASN N . 26659 1 670 . 1 1 76 76 ASN ND2 N 15 115.233 . . 1 . . . . 206 ASN ND2 . 26659 1 671 . 1 1 77 77 ASN H H 1 7.197 . . 1 . . . . 207 ASN H . 26659 1 672 . 1 1 77 77 ASN HA H 1 5.306 . . 1 . . . . 207 ASN HA . 26659 1 673 . 1 1 77 77 ASN HB2 H 1 2.987 . . 1 . . . . 207 ASN HB2 . 26659 1 674 . 1 1 77 77 ASN HB3 H 1 2.516 . . 1 . . . . 207 ASN HB3 . 26659 1 675 . 1 1 77 77 ASN HD21 H 1 8.127 . . 1 . . . . 207 ASN HD21 . 26659 1 676 . 1 1 77 77 ASN HD22 H 1 6.937 . . 1 . . . . 207 ASN HD22 . 26659 1 677 . 1 1 77 77 ASN N N 15 117.006 . . 1 . . . . 207 ASN N . 26659 1 678 . 1 1 77 77 ASN ND2 N 15 111.876 . . 1 . . . . 207 ASN ND2 . 26659 1 679 . 1 1 78 78 PRO HA H 1 4.424 . . 1 . . . . 208 PRO HA . 26659 1 680 . 1 1 78 78 PRO HB2 H 1 2.515 . . 1 . . . . 208 PRO HB2 . 26659 1 681 . 1 1 78 78 PRO HB3 H 1 1.948 . . 1 . . . . 208 PRO HB3 . 26659 1 682 . 1 1 78 78 PRO HG2 H 1 2.145 . . 2 . . . . 208 PRO HG# . 26659 1 683 . 1 1 78 78 PRO HG3 H 1 2.145 . . 2 . . . . 208 PRO HG# . 26659 1 684 . 1 1 78 78 PRO HD2 H 1 4.080 . . 1 . . . . 208 PRO HD2 . 26659 1 685 . 1 1 78 78 PRO HD3 H 1 3.967 . . 1 . . . . 208 PRO HD3 . 26659 1 686 . 1 1 78 78 PRO C C 13 179.062 . . 1 . . . . 208 PRO C . 26659 1 687 . 1 1 78 78 PRO CA C 13 64.622 . . 1 . . . . 208 PRO CA . 26659 1 688 . 1 1 78 78 PRO CB C 13 32.741 . . 1 . . . . 208 PRO CB . 26659 1 689 . 1 1 78 78 PRO CG C 13 27.260 . . 1 . . . . 208 PRO CG . 26659 1 690 . 1 1 78 78 PRO CD C 13 51.545 . . 1 . . . . 208 PRO CD . 26659 1 691 . 1 1 79 79 LYS H H 1 7.988 . . 1 . . . . 209 LYS H . 26659 1 692 . 1 1 79 79 LYS HA H 1 4.271 . . 1 . . . . 209 LYS HA . 26659 1 693 . 1 1 79 79 LYS HB2 H 1 2.076 . . 1 . . . . 209 LYS HB2 . 26659 1 694 . 1 1 79 79 LYS HB3 H 1 1.907 . . 1 . . . . 209 LYS HB3 . 26659 1 695 . 1 1 79 79 LYS HG2 H 1 1.465 . . 2 . . . . 209 LYS HG# . 26659 1 696 . 1 1 79 79 LYS HG3 H 1 1.465 . . 2 . . . . 209 LYS HG# . 26659 1 697 . 1 1 79 79 LYS HD2 H 1 1.655 . . 2 . . . . 209 LYS HD# . 26659 1 698 . 1 1 79 79 LYS HD3 H 1 1.655 . . 2 . . . . 209 LYS HD# . 26659 1 699 . 1 1 79 79 LYS HE2 H 1 3.133 . . 2 . . . . 209 LYS HE# . 26659 1 700 . 1 1 79 79 LYS HE3 H 1 3.133 . . 2 . . . . 209 LYS HE# . 26659 1 701 . 1 1 79 79 LYS C C 13 177.405 . . 1 . . . . 209 LYS C . 26659 1 702 . 1 1 79 79 LYS CA C 13 56.318 . . 1 . . . . 209 LYS CA . 26659 1 703 . 1 1 79 79 LYS CB C 13 31.637 . . 1 . . . . 209 LYS CB . 26659 1 704 . 1 1 79 79 LYS CG C 13 25.842 . . 1 . . . . 209 LYS CG . 26659 1 705 . 1 1 79 79 LYS CD C 13 28.473 . . 1 . . . . 209 LYS CD . 26659 1 706 . 1 1 79 79 LYS CE C 13 42.436 . . 1 . . . . 209 LYS CE . 26659 1 707 . 1 1 79 79 LYS N N 15 113.005 . . 1 . . . . 209 LYS N . 26659 1 708 . 1 1 80 80 ARG H H 1 7.780 . . 1 . . . . 210 ARG H . 26659 1 709 . 1 1 80 80 ARG HA H 1 6.618 . . 1 . . . . 210 ARG HA . 26659 1 710 . 1 1 80 80 ARG HB2 H 1 2.465 . . 1 . . . . 210 ARG HB2 . 26659 1 711 . 1 1 80 80 ARG HB3 H 1 1.749 . . 1 . . . . 210 ARG HB3 . 26659 1 712 . 1 1 80 80 ARG HG2 H 1 1.906 . . 2 . . . . 210 ARG HG# . 26659 1 713 . 1 1 80 80 ARG HG3 H 1 1.906 . . 2 . . . . 210 ARG HG# . 26659 1 714 . 1 1 80 80 ARG HD2 H 1 3.413 . . 1 . . . . 210 ARG HD2 . 26659 1 715 . 1 1 80 80 ARG HD3 H 1 3.045 . . 1 . . . . 210 ARG HD3 . 26659 1 716 . 1 1 80 80 ARG HE H 1 8.372 . . 1 . . . . 210 ARG HE . 26659 1 717 . 1 1 80 80 ARG C C 13 173.542 . . 1 . . . . 210 ARG C . 26659 1 718 . 1 1 80 80 ARG CA C 13 56.018 . . 1 . . . . 210 ARG CA . 26659 1 719 . 1 1 80 80 ARG CB C 13 31.350 . . 1 . . . . 210 ARG CB . 26659 1 720 . 1 1 80 80 ARG CG C 13 28.623 . . 1 . . . . 210 ARG CG . 26659 1 721 . 1 1 80 80 ARG CD C 13 45.313 . . 1 . . . . 210 ARG CD . 26659 1 722 . 1 1 80 80 ARG N N 15 118.475 . . 1 . . . . 210 ARG N . 26659 1 723 . 1 1 80 80 ARG NE N 15 86.277 . . 1 . . . . 210 ARG NE . 26659 1 724 . 1 1 81 81 ALA H H 1 6.761 . . 1 . . . . 211 ALA H . 26659 1 725 . 1 1 81 81 ALA HA H 1 5.104 . . 1 . . . . 211 ALA HA . 26659 1 726 . 1 1 81 81 ALA HB1 H 1 1.554 . . 1 . . . . 211 ALA HB . 26659 1 727 . 1 1 81 81 ALA HB2 H 1 1.554 . . 1 . . . . 211 ALA HB . 26659 1 728 . 1 1 81 81 ALA HB3 H 1 1.554 . . 1 . . . . 211 ALA HB . 26659 1 729 . 1 1 81 81 ALA C C 13 172.451 . . 1 . . . . 211 ALA C . 26659 1 730 . 1 1 81 81 ALA CA C 13 50.780 . . 1 . . . . 211 ALA CA . 26659 1 731 . 1 1 81 81 ALA CB C 13 20.149 . . 1 . . . . 211 ALA CB . 26659 1 732 . 1 1 81 81 ALA N N 15 122.892 . . 1 . . . . 211 ALA N . 26659 1 733 . 1 1 82 82 TRP H H 1 7.217 . . 1 . . . . 212 TRP H . 26659 1 734 . 1 1 82 82 TRP HA H 1 4.876 . . 1 . . . . 212 TRP HA . 26659 1 735 . 1 1 82 82 TRP HB2 H 1 2.939 . . 2 . . . . 212 TRP HB# . 26659 1 736 . 1 1 82 82 TRP HB3 H 1 2.939 . . 2 . . . . 212 TRP HB# . 26659 1 737 . 1 1 82 82 TRP HD1 H 1 7.381 . . 1 . . . . 212 TRP HD1 . 26659 1 738 . 1 1 82 82 TRP HE1 H 1 9.145 . . 1 . . . . 212 TRP HE1 . 26659 1 739 . 1 1 82 82 TRP HZ2 H 1 7.013 . . 1 . . . . 212 TRP HZ2 . 26659 1 740 . 1 1 82 82 TRP HZ3 H 1 7.176 . . 1 . . . . 212 TRP HZ3 . 26659 1 741 . 1 1 82 82 TRP HH2 H 1 6.818 . . 1 . . . . 212 TRP HH2 . 26659 1 742 . 1 1 82 82 TRP C C 13 174.361 . . 1 . . . . 212 TRP C . 26659 1 743 . 1 1 82 82 TRP CA C 13 55.780 . . 1 . . . . 212 TRP CA . 26659 1 744 . 1 1 82 82 TRP CB C 13 31.116 . . 1 . . . . 212 TRP CB . 26659 1 745 . 1 1 82 82 TRP CD1 C 13 128.816 . . 1 . . . . 212 TRP CD1 . 26659 1 746 . 1 1 82 82 TRP CZ2 C 13 111.856 . . 1 . . . . 212 TRP CZ2 . 26659 1 747 . 1 1 82 82 TRP CZ3 C 13 119.517 . . 1 . . . . 212 TRP CZ3 . 26659 1 748 . 1 1 82 82 TRP CH2 C 13 123.460 . . 1 . . . . 212 TRP CH2 . 26659 1 749 . 1 1 82 82 TRP N N 15 127.102 . . 1 . . . . 212 TRP N . 26659 1 750 . 1 1 82 82 TRP NE1 N 15 126.397 . . 1 . . . . 212 TRP NE1 . 26659 1 751 . 1 1 83 83 ILE H H 1 9.575 . . 1 . . . . 213 ILE H . 26659 1 752 . 1 1 83 83 ILE HA H 1 5.147 . . 1 . . . . 213 ILE HA . 26659 1 753 . 1 1 83 83 ILE HB H 1 2.055 . . 1 . . . . 213 ILE HB . 26659 1 754 . 1 1 83 83 ILE HG12 H 1 1.258 . . 1 . . . . 213 ILE HG1# . 26659 1 755 . 1 1 83 83 ILE HG13 H 1 1.258 . . 1 . . . . 213 ILE HG1# . 26659 1 756 . 1 1 83 83 ILE HG21 H 1 0.863 . . 1 . . . . 213 ILE HG2 . 26659 1 757 . 1 1 83 83 ILE HG22 H 1 0.863 . . 1 . . . . 213 ILE HG2 . 26659 1 758 . 1 1 83 83 ILE HG23 H 1 0.863 . . 1 . . . . 213 ILE HG2 . 26659 1 759 . 1 1 83 83 ILE HD11 H 1 0.834 . . 1 . . . . 213 ILE HD1 . 26659 1 760 . 1 1 83 83 ILE HD12 H 1 0.834 . . 1 . . . . 213 ILE HD1 . 26659 1 761 . 1 1 83 83 ILE HD13 H 1 0.834 . . 1 . . . . 213 ILE HD1 . 26659 1 762 . 1 1 83 83 ILE C C 13 174.990 . . 1 . . . . 213 ILE C . 26659 1 763 . 1 1 83 83 ILE CA C 13 58.458 . . 1 . . . . 213 ILE CA . 26659 1 764 . 1 1 83 83 ILE CB C 13 42.095 . . 1 . . . . 213 ILE CB . 26659 1 765 . 1 1 83 83 ILE CG1 C 13 26.005 . . 1 . . . . 213 ILE CG1 . 26659 1 766 . 1 1 83 83 ILE CG2 C 13 18.778 . . 1 . . . . 213 ILE CG2 . 26659 1 767 . 1 1 83 83 ILE CD1 C 13 14.197 . . 1 . . . . 213 ILE CD1 . 26659 1 768 . 1 1 83 83 ILE N N 15 115.198 . . 1 . . . . 213 ILE N . 26659 1 769 . 1 1 84 84 VAL H H 1 8.980 . . 1 . . . . 214 VAL H . 26659 1 770 . 1 1 84 84 VAL HA H 1 4.303 . . 1 . . . . 214 VAL HA . 26659 1 771 . 1 1 84 84 VAL HB H 1 2.049 . . 1 . . . . 214 VAL HB . 26659 1 772 . 1 1 84 84 VAL HG11 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 773 . 1 1 84 84 VAL HG12 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 774 . 1 1 84 84 VAL HG13 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 775 . 1 1 84 84 VAL HG21 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 776 . 1 1 84 84 VAL HG22 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 777 . 1 1 84 84 VAL HG23 H 1 0.883 . . 2 . . . . 214 VAL HG# . 26659 1 778 . 1 1 84 84 VAL C C 13 176.563 . . 1 . . . . 214 VAL C . 26659 1 779 . 1 1 84 84 VAL CA C 13 62.672 . . 1 . . . . 214 VAL CA . 26659 1 780 . 1 1 84 84 VAL CB C 13 32.073 . . 1 . . . . 214 VAL CB . 26659 1 781 . 1 1 84 84 VAL CG1 C 13 21.274 . . 2 . . . . 214 VAL CG# . 26659 1 782 . 1 1 84 84 VAL CG2 C 13 21.274 . . 2 . . . . 214 VAL CG# . 26659 1 783 . 1 1 84 84 VAL N N 15 121.100 . . 1 . . . . 214 VAL N . 26659 1 784 . 1 1 85 85 SER H H 1 8.865 . . 1 . . . . 215 SER H . 26659 1 785 . 1 1 85 85 SER HA H 1 4.832 . . 1 . . . . 215 SER HA . 26659 1 786 . 1 1 85 85 SER HB2 H 1 3.833 . . 1 . . . . 215 SER HB2 . 26659 1 787 . 1 1 85 85 SER HB3 H 1 3.373 . . 1 . . . . 215 SER HB3 . 26659 1 788 . 1 1 85 85 SER C C 13 175.276 . . 1 . . . . 215 SER C . 26659 1 789 . 1 1 85 85 SER CA C 13 55.706 . . 1 . . . . 215 SER CA . 26659 1 790 . 1 1 85 85 SER CB C 13 62.855 . . 1 . . . . 215 SER CB . 26659 1 791 . 1 1 85 85 SER N N 15 123.191 . . 1 . . . . 215 SER N . 26659 1 792 . 1 1 86 86 GLY H H 1 9.407 . . 1 . . . . 216 GLY H . 26659 1 793 . 1 1 86 86 GLY HA2 H 1 4.174 . . 1 . . . . 216 GLY HA2 . 26659 1 794 . 1 1 86 86 GLY HA3 H 1 3.768 . . 1 . . . . 216 GLY HA3 . 26659 1 795 . 1 1 86 86 GLY C C 13 174.112 . . 1 . . . . 216 GLY C . 26659 1 796 . 1 1 86 86 GLY CA C 13 47.928 . . 1 . . . . 216 GLY CA . 26659 1 797 . 1 1 86 86 GLY N N 15 120.046 . . 1 . . . . 216 GLY N . 26659 1 798 . 1 1 87 87 ASN H H 1 8.873 . . 1 . . . . 217 ASN H . 26659 1 799 . 1 1 87 87 ASN HA H 1 5.271 . . 1 . . . . 217 ASN HA . 26659 1 800 . 1 1 87 87 ASN HB2 H 1 3.242 . . 1 . . . . 217 ASN HB2 . 26659 1 801 . 1 1 87 87 ASN HB3 H 1 3.113 . . 1 . . . . 217 ASN HB3 . 26659 1 802 . 1 1 87 87 ASN HD21 H 1 8.084 . . 1 . . . . 217 ASN HD21 . 26659 1 803 . 1 1 87 87 ASN HD22 H 1 7.089 . . 1 . . . . 217 ASN HD22 . 26659 1 804 . 1 1 87 87 ASN C C 13 173.805 . . 1 . . . . 217 ASN C . 26659 1 805 . 1 1 87 87 ASN CA C 13 53.113 . . 1 . . . . 217 ASN CA . 26659 1 806 . 1 1 87 87 ASN CB C 13 38.927 . . 1 . . . . 217 ASN CB . 26659 1 807 . 1 1 87 87 ASN N N 15 126.608 . . 1 . . . . 217 ASN N . 26659 1 808 . 1 1 87 87 ASN ND2 N 15 111.212 . . 1 . . . . 217 ASN ND2 . 26659 1 809 . 1 1 88 88 THR H H 1 8.053 . . 1 . . . . 218 THR H . 26659 1 810 . 1 1 88 88 THR HA H 1 5.152 . . 1 . . . . 218 THR HA . 26659 1 811 . 1 1 88 88 THR HB H 1 4.514 . . 1 . . . . 218 THR HB . 26659 1 812 . 1 1 88 88 THR HG21 H 1 1.466 . . 1 . . . . 218 THR HG2 . 26659 1 813 . 1 1 88 88 THR HG22 H 1 1.466 . . 1 . . . . 218 THR HG2 . 26659 1 814 . 1 1 88 88 THR HG23 H 1 1.466 . . 1 . . . . 218 THR HG2 . 26659 1 815 . 1 1 88 88 THR C C 13 172.415 . . 1 . . . . 218 THR C . 26659 1 816 . 1 1 88 88 THR CA C 13 59.994 . . 1 . . . . 218 THR CA . 26659 1 817 . 1 1 88 88 THR CB C 13 73.096 . . 1 . . . . 218 THR CB . 26659 1 818 . 1 1 88 88 THR N N 15 109.804 . . 1 . . . . 218 THR N . 26659 1 819 . 1 1 89 89 ILE H H 1 9.236 . . 1 . . . . 219 ILE H . 26659 1 820 . 1 1 89 89 ILE HA H 1 5.101 . . 1 . . . . 219 ILE HA . 26659 1 821 . 1 1 89 89 ILE HB H 1 1.653 . . 1 . . . . 219 ILE HB . 26659 1 822 . 1 1 89 89 ILE HG12 H 1 1.169 . . 1 . . . . 219 ILE HG1# . 26659 1 823 . 1 1 89 89 ILE HG13 H 1 1.169 . . 1 . . . . 219 ILE HG1# . 26659 1 824 . 1 1 89 89 ILE HG21 H 1 0.763 . . 1 . . . . 219 ILE HG2 . 26659 1 825 . 1 1 89 89 ILE HG22 H 1 0.763 . . 1 . . . . 219 ILE HG2 . 26659 1 826 . 1 1 89 89 ILE HG23 H 1 0.763 . . 1 . . . . 219 ILE HG2 . 26659 1 827 . 1 1 89 89 ILE HD11 H 1 0.559 . . 1 . . . . 219 ILE HD1 . 26659 1 828 . 1 1 89 89 ILE HD12 H 1 0.559 . . 1 . . . . 219 ILE HD1 . 26659 1 829 . 1 1 89 89 ILE HD13 H 1 0.559 . . 1 . . . . 219 ILE HD1 . 26659 1 830 . 1 1 89 89 ILE C C 13 174.632 . . 1 . . . . 219 ILE C . 26659 1 831 . 1 1 89 89 ILE CA C 13 58.670 . . 1 . . . . 219 ILE CA . 26659 1 832 . 1 1 89 89 ILE CB C 13 35.312 . . 1 . . . . 219 ILE CB . 26659 1 833 . 1 1 89 89 ILE CG1 C 13 26.612 . . 1 . . . . 219 ILE CG1 . 26659 1 834 . 1 1 89 89 ILE CG2 C 13 18.758 . . 1 . . . . 219 ILE CG2 . 26659 1 835 . 1 1 89 89 ILE CD1 C 13 10.126 . . 1 . . . . 219 ILE CD1 . 26659 1 836 . 1 1 89 89 ILE N N 15 123.502 . . 1 . . . . 219 ILE N . 26659 1 837 . 1 1 90 90 ALA H H 1 8.971 . . 1 . . . . 220 ALA H . 26659 1 838 . 1 1 90 90 ALA HA H 1 5.619 . . 1 . . . . 220 ALA HA . 26659 1 839 . 1 1 90 90 ALA HB1 H 1 1.428 . . 1 . . . . 220 ALA HB . 26659 1 840 . 1 1 90 90 ALA HB2 H 1 1.428 . . 1 . . . . 220 ALA HB . 26659 1 841 . 1 1 90 90 ALA HB3 H 1 1.428 . . 1 . . . . 220 ALA HB . 26659 1 842 . 1 1 90 90 ALA C C 13 175.122 . . 1 . . . . 220 ALA C . 26659 1 843 . 1 1 90 90 ALA CA C 13 50.308 . . 1 . . . . 220 ALA CA . 26659 1 844 . 1 1 90 90 ALA CB C 13 24.411 . . 1 . . . . 220 ALA CB . 26659 1 845 . 1 1 90 90 ALA N N 15 128.276 . . 1 . . . . 220 ALA N . 26659 1 846 . 1 1 91 91 GLN H H 1 8.162 . . 1 . . . . 221 GLN H . 26659 1 847 . 1 1 91 91 GLN HA H 1 3.014 . . 1 . . . . 221 GLN HA . 26659 1 848 . 1 1 91 91 GLN HG2 H 1 1.876 . . 1 . . . . 221 GLN HG2 . 26659 1 849 . 1 1 91 91 GLN HG3 H 1 1.521 . . 1 . . . . 221 GLN HG3 . 26659 1 850 . 1 1 91 91 GLN HE21 H 1 7.134 . . 1 . . . . 221 GLN HE21 . 26659 1 851 . 1 1 91 91 GLN HE22 H 1 6.532 . . 1 . . . . 221 GLN HE22 . 26659 1 852 . 1 1 91 91 GLN C C 13 178.012 . . 1 . . . . 221 GLN C . 26659 1 853 . 1 1 91 91 GLN CA C 13 55.743 . . 1 . . . . 221 GLN CA . 26659 1 854 . 1 1 91 91 GLN CB C 13 27.964 . . 1 . . . . 221 GLN CB . 26659 1 855 . 1 1 91 91 GLN CG C 13 33.859 . . 1 . . . . 221 GLN CG . 26659 1 856 . 1 1 91 91 GLN N N 15 125.394 . . 1 . . . . 221 GLN N . 26659 1 857 . 1 1 91 91 GLN NE2 N 15 110.166 . . 1 . . . . 221 GLN NE2 . 26659 1 858 . 1 1 92 92 LEU H H 1 8.444 . . 1 . . . . 222 LEU H . 26659 1 859 . 1 1 92 92 LEU HA H 1 3.726 . . 1 . . . . 222 LEU HA . 26659 1 860 . 1 1 92 92 LEU HB2 H 1 1.940 . . 1 . . . . 222 LEU HB2 . 26659 1 861 . 1 1 92 92 LEU HB3 H 1 1.231 . . 1 . . . . 222 LEU HB3 . 26659 1 862 . 1 1 92 92 LEU HG H 1 1.585 . . 1 . . . . 222 LEU HG . 26659 1 863 . 1 1 92 92 LEU HD11 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 864 . 1 1 92 92 LEU HD12 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 865 . 1 1 92 92 LEU HD13 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 866 . 1 1 92 92 LEU HD21 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 867 . 1 1 92 92 LEU HD22 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 868 . 1 1 92 92 LEU HD23 H 1 0.952 . . 2 . . . . 222 LEU HD# . 26659 1 869 . 1 1 92 92 LEU C C 13 178.861 . . 1 . . . . 222 LEU C . 26659 1 870 . 1 1 92 92 LEU CA C 13 59.660 . . 1 . . . . 222 LEU CA . 26659 1 871 . 1 1 92 92 LEU CB C 13 42.652 . . 1 . . . . 222 LEU CB . 26659 1 872 . 1 1 92 92 LEU CG C 13 27.382 . . 1 . . . . 222 LEU CG . 26659 1 873 . 1 1 92 92 LEU CD1 C 13 25.610 . . 1 . . . . 222 LEU CD1 . 26659 1 874 . 1 1 92 92 LEU CD2 C 13 24.410 . . 1 . . . . 222 LEU CD2 . 26659 1 875 . 1 1 92 92 LEU N N 15 130.200 . . 1 . . . . 222 LEU N . 26659 1 876 . 1 1 93 93 SER H H 1 8.338 . . 1 . . . . 223 SER H . 26659 1 877 . 1 1 93 93 SER HA H 1 4.402 . . 1 . . . . 223 SER HA . 26659 1 878 . 1 1 93 93 SER HB2 H 1 4.212 . . 1 . . . . 223 SER HB2 . 26659 1 879 . 1 1 93 93 SER HB3 H 1 3.821 . . 1 . . . . 223 SER HB3 . 26659 1 880 . 1 1 93 93 SER C C 13 174.259 . . 1 . . . . 223 SER C . 26659 1 881 . 1 1 93 93 SER CA C 13 58.651 . . 1 . . . . 223 SER CA . 26659 1 882 . 1 1 93 93 SER CB C 13 64.022 . . 1 . . . . 223 SER CB . 26659 1 883 . 1 1 93 93 SER N N 15 108.204 . . 1 . . . . 223 SER N . 26659 1 884 . 1 1 94 94 ASP H H 1 7.347 . . 1 . . . . 224 ASP H . 26659 1 885 . 1 1 94 94 ASP HA H 1 4.649 . . 1 . . . . 224 ASP HA . 26659 1 886 . 1 1 94 94 ASP HB2 H 1 2.613 . . 2 . . . . 224 ASP HB# . 26659 1 887 . 1 1 94 94 ASP HB3 H 1 2.613 . . 2 . . . . 224 ASP HB# . 26659 1 888 . 1 1 94 94 ASP C C 13 174.573 . . 1 . . . . 224 ASP C . 26659 1 889 . 1 1 94 94 ASP CA C 13 54.110 . . 1 . . . . 224 ASP CA . 26659 1 890 . 1 1 94 94 ASP CB C 13 40.391 . . 1 . . . . 224 ASP CB . 26659 1 891 . 1 1 94 94 ASP N N 15 120.703 . . 1 . . . . 224 ASP N . 26659 1 892 . 1 1 95 95 ARG H H 1 8.676 . . 1 . . . . 225 ARG H . 26659 1 893 . 1 1 95 95 ARG HA H 1 4.216 . . 1 . . . . 225 ARG HA . 26659 1 894 . 1 1 95 95 ARG HB2 H 1 1.944 . . 1 . . . . 225 ARG HB2 . 26659 1 895 . 1 1 95 95 ARG HB3 H 1 1.830 . . 1 . . . . 225 ARG HB3 . 26659 1 896 . 1 1 95 95 ARG HG2 H 1 1.655 . . 2 . . . . 225 ARG HG# . 26659 1 897 . 1 1 95 95 ARG HG3 H 1 1.655 . . 2 . . . . 225 ARG HG# . 26659 1 898 . 1 1 95 95 ARG HD2 H 1 3.319 . . 1 . . . . 225 ARG HD2 . 26659 1 899 . 1 1 95 95 ARG HD3 H 1 3.137 . . 1 . . . . 225 ARG HD3 . 26659 1 900 . 1 1 95 95 ARG HE H 1 7.409 . . 1 . . . . 225 ARG HE . 26659 1 901 . 1 1 95 95 ARG C C 13 175.451 . . 1 . . . . 225 ARG C . 26659 1 902 . 1 1 95 95 ARG CA C 13 57.317 . . 1 . . . . 225 ARG CA . 26659 1 903 . 1 1 95 95 ARG CB C 13 28.982 . . 1 . . . . 225 ARG CB . 26659 1 904 . 1 1 95 95 ARG CG C 13 27.273 . . 1 . . . . 225 ARG CG . 26659 1 905 . 1 1 95 95 ARG CD C 13 42.504 . . 1 . . . . 225 ARG CD . 26659 1 906 . 1 1 95 95 ARG N N 15 121.513 . . 1 . . . . 225 ARG N . 26659 1 907 . 1 1 95 95 ARG NE N 15 84.819 . . 1 . . . . 225 ARG NE . 26659 1 908 . 1 1 96 96 ASP H H 1 7.674 . . 1 . . . . 226 ASP H . 26659 1 909 . 1 1 96 96 ASP HA H 1 4.816 . . 1 . . . . 226 ASP HA . 26659 1 910 . 1 1 96 96 ASP HB2 H 1 2.920 . . 1 . . . . 226 ASP HB2 . 26659 1 911 . 1 1 96 96 ASP HB3 H 1 2.709 . . 1 . . . . 226 ASP HB3 . 26659 1 912 . 1 1 96 96 ASP C C 13 174.456 . . 1 . . . . 226 ASP C . 26659 1 913 . 1 1 96 96 ASP CA C 13 54.830 . . 1 . . . . 226 ASP CA . 26659 1 914 . 1 1 96 96 ASP CB C 13 42.035 . . 1 . . . . 226 ASP CB . 26659 1 915 . 1 1 96 96 ASP N N 15 115.043 . . 1 . . . . 226 ASP N . 26659 1 916 . 1 1 97 97 ASN H H 1 8.314 . . 1 . . . . 227 ASN H . 26659 1 917 . 1 1 97 97 ASN HA H 1 4.956 . . 1 . . . . 227 ASN HA . 26659 1 918 . 1 1 97 97 ASN HB2 H 1 3.275 . . 1 . . . . 227 ASN HB2 . 26659 1 919 . 1 1 97 97 ASN HB3 H 1 2.514 . . 1 . . . . 227 ASN HB3 . 26659 1 920 . 1 1 97 97 ASN HD21 H 1 7.656 . . 1 . . . . 227 ASN HD21 . 26659 1 921 . 1 1 97 97 ASN HD22 H 1 6.844 . . 1 . . . . 227 ASN HD22 . 26659 1 922 . 1 1 97 97 ASN C C 13 173.220 . . 1 . . . . 227 ASN C . 26659 1 923 . 1 1 97 97 ASN CA C 13 53.215 . . 1 . . . . 227 ASN CA . 26659 1 924 . 1 1 97 97 ASN CB C 13 39.770 . . 1 . . . . 227 ASN CB . 26659 1 925 . 1 1 97 97 ASN N N 15 122.993 . . 1 . . . . 227 ASN N . 26659 1 926 . 1 1 97 97 ASN ND2 N 15 110.797 . . 1 . . . . 227 ASN ND2 . 26659 1 927 . 1 1 98 98 VAL H H 1 8.408 . . 1 . . . . 228 VAL H . 26659 1 928 . 1 1 98 98 VAL HA H 1 6.027 . . 1 . . . . 228 VAL HA . 26659 1 929 . 1 1 98 98 VAL HB H 1 2.958 . . 1 . . . . 228 VAL HB . 26659 1 930 . 1 1 98 98 VAL HG11 H 1 1.031 . . 1 . . . . 228 VAL HG1 . 26659 1 931 . 1 1 98 98 VAL HG12 H 1 1.031 . . 1 . . . . 228 VAL HG1 . 26659 1 932 . 1 1 98 98 VAL HG13 H 1 1.031 . . 1 . . . . 228 VAL HG1 . 26659 1 933 . 1 1 98 98 VAL HG21 H 1 0.826 . . 1 . . . . 228 VAL HG2 . 26659 1 934 . 1 1 98 98 VAL HG22 H 1 0.826 . . 1 . . . . 228 VAL HG2 . 26659 1 935 . 1 1 98 98 VAL HG23 H 1 0.826 . . 1 . . . . 228 VAL HG2 . 26659 1 936 . 1 1 98 98 VAL C C 13 176.007 . . 1 . . . . 228 VAL C . 26659 1 937 . 1 1 98 98 VAL CA C 13 58.272 . . 1 . . . . 228 VAL CA . 26659 1 938 . 1 1 98 98 VAL CB C 13 34.996 . . 1 . . . . 228 VAL CB . 26659 1 939 . 1 1 98 98 VAL CG1 C 13 21.996 . . 1 . . . . 228 VAL CG1 . 26659 1 940 . 1 1 98 98 VAL CG2 C 13 20.005 . . 1 . . . . 228 VAL CG2 . 26659 1 941 . 1 1 98 98 VAL N N 15 115.614 . . 1 . . . . 228 VAL N . 26659 1 942 . 1 1 99 99 LEU H H 1 8.620 . . 1 . . . . 229 LEU H . 26659 1 943 . 1 1 99 99 LEU HA H 1 4.847 . . 1 . . . . 229 LEU HA . 26659 1 944 . 1 1 99 99 LEU HB2 H 1 1.543 . . 1 . . . . 229 LEU HB2 . 26659 1 945 . 1 1 99 99 LEU HB3 H 1 0.998 . . 1 . . . . 229 LEU HB3 . 26659 1 946 . 1 1 99 99 LEU HG H 1 1.331 . . 1 . . . . 229 LEU HG . 26659 1 947 . 1 1 99 99 LEU HD11 H 1 0.098 . . 1 . . . . 229 LEU HD1 . 26659 1 948 . 1 1 99 99 LEU HD12 H 1 0.098 . . 1 . . . . 229 LEU HD1 . 26659 1 949 . 1 1 99 99 LEU HD13 H 1 0.098 . . 1 . . . . 229 LEU HD1 . 26659 1 950 . 1 1 99 99 LEU HD21 H 1 -0.268 . . 1 . . . . 229 LEU HD2 . 26659 1 951 . 1 1 99 99 LEU HD22 H 1 -0.268 . . 1 . . . . 229 LEU HD2 . 26659 1 952 . 1 1 99 99 LEU HD23 H 1 -0.268 . . 1 . . . . 229 LEU HD2 . 26659 1 953 . 1 1 99 99 LEU C C 13 178.232 . . 1 . . . . 229 LEU C . 26659 1 954 . 1 1 99 99 LEU CA C 13 54.317 . . 1 . . . . 229 LEU CA . 26659 1 955 . 1 1 99 99 LEU CB C 13 42.650 . . 1 . . . . 229 LEU CB . 26659 1 956 . 1 1 99 99 LEU CG C 13 25.555 . . 1 . . . . 229 LEU CG . 26659 1 957 . 1 1 99 99 LEU CD1 C 13 21.478 . . 2 . . . . 229 LEU CD# . 26659 1 958 . 1 1 99 99 LEU CD2 C 13 21.478 . . 2 . . . . 229 LEU CD# . 26659 1 959 . 1 1 99 99 LEU N N 15 117.876 . . 1 . . . . 229 LEU N . 26659 1 960 . 1 1 100 100 GLY H H 1 8.995 . . 1 . . . . 230 GLY H . 26659 1 961 . 1 1 100 100 GLY HA2 H 1 4.982 . . 1 . . . . 230 GLY HA2 . 26659 1 962 . 1 1 100 100 GLY HA3 H 1 3.716 . . 1 . . . . 230 GLY HA3 . 26659 1 963 . 1 1 100 100 GLY C C 13 171.785 . . 1 . . . . 230 GLY C . 26659 1 964 . 1 1 100 100 GLY CA C 13 46.660 . . 1 . . . . 230 GLY CA . 26659 1 965 . 1 1 100 100 GLY N N 15 104.289 . . 1 . . . . 230 GLY N . 26659 1 966 . 1 1 101 101 VAL H H 1 8.372 . . 1 . . . . 231 VAL H . 26659 1 967 . 1 1 101 101 VAL HA H 1 4.695 . . 1 . . . . 231 VAL HA . 26659 1 968 . 1 1 101 101 VAL HB H 1 1.987 . . 1 . . . . 231 VAL HB . 26659 1 969 . 1 1 101 101 VAL HG11 H 1 1.085 . . 1 . . . . 231 VAL HG1 . 26659 1 970 . 1 1 101 101 VAL HG12 H 1 1.085 . . 1 . . . . 231 VAL HG1 . 26659 1 971 . 1 1 101 101 VAL HG13 H 1 1.085 . . 1 . . . . 231 VAL HG1 . 26659 1 972 . 1 1 101 101 VAL C C 13 175.488 . . 1 . . . . 231 VAL C . 26659 1 973 . 1 1 101 101 VAL CA C 13 62.095 . . 1 . . . . 231 VAL CA . 26659 1 974 . 1 1 101 101 VAL CB C 13 34.020 . . 1 . . . . 231 VAL CB . 26659 1 975 . 1 1 101 101 VAL CG1 C 13 22.099 . . 1 . . . . 231 VAL CG1 . 26659 1 976 . 1 1 101 101 VAL N N 15 120.105 . . 1 . . . . 231 VAL N . 26659 1 977 . 1 1 102 102 ILE H H 1 8.932 . . 1 . . . . 232 ILE H . 26659 1 978 . 1 1 102 102 ILE HA H 1 4.320 . . 1 . . . . 232 ILE HA . 26659 1 979 . 1 1 102 102 ILE HB H 1 1.554 . . 1 . . . . 232 ILE HB . 26659 1 980 . 1 1 102 102 ILE HG12 H 1 1.138 . . 1 . . . . 232 ILE HG1# . 26659 1 981 . 1 1 102 102 ILE HG13 H 1 1.138 . . 1 . . . . 232 ILE HG1# . 26659 1 982 . 1 1 102 102 ILE HG21 H 1 0.876 . . 1 . . . . 232 ILE HG2 . 26659 1 983 . 1 1 102 102 ILE HG22 H 1 0.876 . . 1 . . . . 232 ILE HG2 . 26659 1 984 . 1 1 102 102 ILE HG23 H 1 0.876 . . 1 . . . . 232 ILE HG2 . 26659 1 985 . 1 1 102 102 ILE HD11 H 1 0.634 . . 1 . . . . 232 ILE HD1 . 26659 1 986 . 1 1 102 102 ILE HD12 H 1 0.634 . . 1 . . . . 232 ILE HD1 . 26659 1 987 . 1 1 102 102 ILE HD13 H 1 0.634 . . 1 . . . . 232 ILE HD1 . 26659 1 988 . 1 1 102 102 ILE C C 13 175.056 . . 1 . . . . 232 ILE C . 26659 1 989 . 1 1 102 102 ILE CA C 13 60.019 . . 1 . . . . 232 ILE CA . 26659 1 990 . 1 1 102 102 ILE CB C 13 39.312 . . 1 . . . . 232 ILE CB . 26659 1 991 . 1 1 102 102 ILE CG1 C 13 27.396 . . 1 . . . . 232 ILE CG1 . 26659 1 992 . 1 1 102 102 ILE CG2 C 13 17.551 . . 1 . . . . 232 ILE CG2 . 26659 1 993 . 1 1 102 102 ILE CD1 C 13 12.465 . . 1 . . . . 232 ILE CD1 . 26659 1 994 . 1 1 102 102 ILE N N 15 127.502 . . 1 . . . . 232 ILE N . 26659 1 995 . 1 1 103 103 LYS H H 1 8.494 . . 1 . . . . 233 LYS H . 26659 1 996 . 1 1 103 103 LYS HA H 1 4.419 . . 1 . . . . 233 LYS HA . 26659 1 997 . 1 1 103 103 LYS HB2 H 1 1.865 . . 2 . . . . 233 LYS HB# . 26659 1 998 . 1 1 103 103 LYS HB3 H 1 1.865 . . 2 . . . . 233 LYS HB# . 26659 1 999 . 1 1 103 103 LYS HG2 H 1 1.524 . . 2 . . . . 233 LYS HG# . 26659 1 1000 . 1 1 103 103 LYS HG3 H 1 1.524 . . 2 . . . . 233 LYS HG# . 26659 1 1001 . 1 1 103 103 LYS HD2 H 1 1.773 . . 2 . . . . 233 LYS HD# . 26659 1 1002 . 1 1 103 103 LYS HD3 H 1 1.773 . . 2 . . . . 233 LYS HD# . 26659 1 1003 . 1 1 103 103 LYS C C 13 176.315 . . 1 . . . . 233 LYS C . 26659 1 1004 . 1 1 103 103 LYS CA C 13 56.873 . . 1 . . . . 233 LYS CA . 26659 1 1005 . 1 1 103 103 LYS CB C 13 33.464 . . 1 . . . . 233 LYS CB . 26659 1 1006 . 1 1 103 103 LYS CG C 13 24.873 . . 1 . . . . 233 LYS CG . 26659 1 1007 . 1 1 103 103 LYS CD C 13 28.719 . . 1 . . . . 233 LYS CD . 26659 1 1008 . 1 1 103 103 LYS CE C 13 42.109 . . 1 . . . . 233 LYS CE . 26659 1 1009 . 1 1 103 103 LYS N N 15 126.101 . . 1 . . . . 233 LYS N . 26659 1 1010 . 1 1 104 104 SER H H 1 8.650 . . 1 . . . . 234 SER H . 26659 1 1011 . 1 1 104 104 SER HA H 1 4.624 . . 1 . . . . 234 SER HA . 26659 1 1012 . 1 1 104 104 SER HB2 H 1 3.972 . . 1 . . . . 234 SER HB2 . 26659 1 1013 . 1 1 104 104 SER HB3 H 1 3.880 . . 1 . . . . 234 SER HB3 . 26659 1 1014 . 1 1 104 104 SER C C 13 174.610 . . 1 . . . . 234 SER C . 26659 1 1015 . 1 1 104 104 SER CA C 13 57.810 . . 1 . . . . 234 SER CA . 26659 1 1016 . 1 1 104 104 SER CB C 13 64.746 . . 1 . . . . 234 SER CB . 26659 1 1017 . 1 1 104 104 SER N N 15 118.396 . . 1 . . . . 234 SER N . 26659 1 1018 . 1 1 105 105 ASP H H 1 8.710 . . 1 . . . . 235 ASP H . 26659 1 1019 . 1 1 105 105 ASP HA H 1 4.719 . . 1 . . . . 235 ASP HA . 26659 1 1020 . 1 1 105 105 ASP HB2 H 1 2.816 . . 2 . . . . 235 ASP HB# . 26659 1 1021 . 1 1 105 105 ASP HB3 H 1 2.816 . . 2 . . . . 235 ASP HB# . 26659 1 1022 . 1 1 105 105 ASP C C 13 176.571 . . 1 . . . . 235 ASP C . 26659 1 1023 . 1 1 105 105 ASP CA C 13 55.132 . . 1 . . . . 235 ASP CA . 26659 1 1024 . 1 1 105 105 ASP CB C 13 41.391 . . 1 . . . . 235 ASP CB . 26659 1 1025 . 1 1 105 105 ASP N N 15 123.394 . . 1 . . . . 235 ASP N . 26659 1 1026 . 1 1 106 106 LYS H H 1 8.581 . . 1 . . . . 236 LYS H . 26659 1 1027 . 1 1 106 106 LYS HA H 1 4.402 . . 1 . . . . 236 LYS HA . 26659 1 1028 . 1 1 106 106 LYS HB2 H 1 2.045 . . 2 . . . . 236 LYS HB# . 26659 1 1029 . 1 1 106 106 LYS HB3 H 1 2.045 . . 2 . . . . 236 LYS HB# . 26659 1 1030 . 1 1 106 106 LYS HG2 H 1 1.534 . . 2 . . . . 236 LYS HG# . 26659 1 1031 . 1 1 106 106 LYS HG3 H 1 1.534 . . 2 . . . . 236 LYS HG# . 26659 1 1032 . 1 1 106 106 LYS HE2 H 1 3.120 . . 2 . . . . 236 LYS HE# . 26659 1 1033 . 1 1 106 106 LYS HE3 H 1 3.120 . . 2 . . . . 236 LYS HE# . 26659 1 1034 . 1 1 106 106 LYS C C 13 177.112 . . 1 . . . . 236 LYS C . 26659 1 1035 . 1 1 106 106 LYS CA C 13 56.744 . . 1 . . . . 236 LYS CA . 26659 1 1036 . 1 1 106 106 LYS CB C 13 32.594 . . 1 . . . . 236 LYS CB . 26659 1 1037 . 1 1 106 106 LYS CG C 13 24.819 . . 1 . . . . 236 LYS CG . 26659 1 1038 . 1 1 106 106 LYS CD C 13 29.100 . . 1 . . . . 236 LYS CD . 26659 1 1039 . 1 1 106 106 LYS CE C 13 42.232 . . 1 . . . . 236 LYS CE . 26659 1 1040 . 1 1 106 106 LYS N N 15 119.301 . . 1 . . . . 236 LYS N . 26659 1 1041 . 1 1 107 107 GLY H H 1 8.435 . . 1 . . . . 237 GLY H . 26659 1 1042 . 1 1 107 107 GLY HA2 H 1 4.163 . . 1 . . . . 237 GLY HA2 . 26659 1 1043 . 1 1 107 107 GLY HA3 H 1 3.989 . . 1 . . . . 237 GLY HA3 . 26659 1 1044 . 1 1 107 107 GLY C C 13 173.893 . . 1 . . . . 237 GLY C . 26659 1 1045 . 1 1 107 107 GLY CA C 13 45.576 . . 1 . . . . 237 GLY CA . 26659 1 1046 . 1 1 107 107 GLY N N 15 109.203 . . 1 . . . . 237 GLY N . 26659 1 1047 . 1 1 108 108 ALA H H 1 8.118 . . 1 . . . . 238 ALA H . 26659 1 1048 . 1 1 108 108 ALA HA H 1 4.583 . . 1 . . . . 238 ALA HA . 26659 1 1049 . 1 1 108 108 ALA HB1 H 1 1.585 . . 1 . . . . 238 ALA HB . 26659 1 1050 . 1 1 108 108 ALA HB2 H 1 1.585 . . 1 . . . . 238 ALA HB . 26659 1 1051 . 1 1 108 108 ALA HB3 H 1 1.585 . . 1 . . . . 238 ALA HB . 26659 1 1052 . 1 1 108 108 ALA C C 13 177.515 . . 1 . . . . 238 ALA C . 26659 1 1053 . 1 1 108 108 ALA CA C 13 52.273 . . 1 . . . . 238 ALA CA . 26659 1 1054 . 1 1 108 108 ALA CB C 13 20.082 . . 1 . . . . 238 ALA CB . 26659 1 1055 . 1 1 108 108 ALA N N 15 123.042 . . 1 . . . . 238 ALA N . 26659 1 1056 . 1 1 109 109 SER H H 1 8.388 . . 1 . . . . 239 SER H . 26659 1 1057 . 1 1 109 109 SER HA H 1 4.709 . . 1 . . . . 239 SER HA . 26659 1 1058 . 1 1 109 109 SER HB2 H 1 4.136 . . 2 . . . . 239 SER HB# . 26659 1 1059 . 1 1 109 109 SER HB3 H 1 4.136 . . 2 . . . . 239 SER HB# . 26659 1 1060 . 1 1 109 109 SER C C 13 173.761 . . 1 . . . . 239 SER C . 26659 1 1061 . 1 1 109 109 SER CA C 13 58.516 . . 1 . . . . 239 SER CA . 26659 1 1062 . 1 1 109 109 SER CB C 13 64.682 . . 1 . . . . 239 SER CB . 26659 1 1063 . 1 1 109 109 SER N N 15 114.742 . . 1 . . . . 239 SER N . 26659 1 1064 . 1 1 110 110 ALA H H 1 8.697 . . 1 . . . . 240 ALA H . 26659 1 1065 . 1 1 110 110 ALA HA H 1 4.746 . . 1 . . . . 240 ALA HA . 26659 1 1066 . 1 1 110 110 ALA HB1 H 1 1.524 . . 1 . . . . 240 ALA HB . 26659 1 1067 . 1 1 110 110 ALA HB2 H 1 1.524 . . 1 . . . . 240 ALA HB . 26659 1 1068 . 1 1 110 110 ALA HB3 H 1 1.524 . . 1 . . . . 240 ALA HB . 26659 1 1069 . 1 1 110 110 ALA C C 13 176.607 . . 1 . . . . 240 ALA C . 26659 1 1070 . 1 1 110 110 ALA CA C 13 52.613 . . 1 . . . . 240 ALA CA . 26659 1 1071 . 1 1 110 110 ALA CB C 13 20.649 . . 1 . . . . 240 ALA CB . 26659 1 1072 . 1 1 110 110 ALA N N 15 126.808 . . 1 . . . . 240 ALA N . 26659 1 1073 . 1 1 111 111 HIS H H 1 8.545 . . 1 . . . . 241 HIS H . 26659 1 1074 . 1 1 111 111 HIS HA H 1 5.271 . . 1 . . . . 241 HIS HA . 26659 1 1075 . 1 1 111 111 HIS HB2 H 1 3.399 . . 2 . . . . 241 HIS HB# . 26659 1 1076 . 1 1 111 111 HIS HB3 H 1 3.399 . . 2 . . . . 241 HIS HB# . 26659 1 1077 . 1 1 111 111 HIS HD2 H 1 7.204 . . 1 . . . . 241 HIS HD2 . 26659 1 1078 . 1 1 111 111 HIS HE1 H 1 8.202 . . 1 . . . . 241 HIS HE1 . 26659 1 1079 . 1 1 111 111 HIS C C 13 172.707 . . 1 . . . . 241 HIS C . 26659 1 1080 . 1 1 111 111 HIS CA C 13 55.228 . . 1 . . . . 241 HIS CA . 26659 1 1081 . 1 1 111 111 HIS CB C 13 32.106 . . 1 . . . . 241 HIS CB . 26659 1 1082 . 1 1 111 111 HIS CD2 C 13 120.226 . . 1 . . . . 241 HIS CD2 . 26659 1 1083 . 1 1 111 111 HIS CE1 C 13 137.640 . . 1 . . . . 241 HIS CE1 . 26659 1 1084 . 1 1 111 111 HIS N N 15 117.560 . . 1 . . . . 241 HIS N . 26659 1 1085 . 1 1 112 112 ILE H H 1 8.625 . . 1 . . . . 242 ILE H . 26659 1 1086 . 1 1 112 112 ILE HA H 1 5.439 . . 1 . . . . 242 ILE HA . 26659 1 1087 . 1 1 112 112 ILE HB H 1 1.880 . . 1 . . . . 242 ILE HB . 26659 1 1088 . 1 1 112 112 ILE HG12 H 1 1.536 . . 1 . . . . 242 ILE HG12 . 26659 1 1089 . 1 1 112 112 ILE HG13 H 1 1.331 . . 1 . . . . 242 ILE HG13 . 26659 1 1090 . 1 1 112 112 ILE HG21 H 1 0.947 . . 1 . . . . 242 ILE HG2 . 26659 1 1091 . 1 1 112 112 ILE HG22 H 1 0.947 . . 1 . . . . 242 ILE HG2 . 26659 1 1092 . 1 1 112 112 ILE HG23 H 1 0.947 . . 1 . . . . 242 ILE HG2 . 26659 1 1093 . 1 1 112 112 ILE HD11 H 1 0.907 . . 1 . . . . 242 ILE HD1 . 26659 1 1094 . 1 1 112 112 ILE HD12 H 1 0.907 . . 1 . . . . 242 ILE HD1 . 26659 1 1095 . 1 1 112 112 ILE HD13 H 1 0.907 . . 1 . . . . 242 ILE HD1 . 26659 1 1096 . 1 1 112 112 ILE C C 13 174.990 . . 1 . . . . 242 ILE C . 26659 1 1097 . 1 1 112 112 ILE CA C 13 59.503 . . 1 . . . . 242 ILE CA . 26659 1 1098 . 1 1 112 112 ILE CB C 13 39.576 . . 1 . . . . 242 ILE CB . 26659 1 1099 . 1 1 112 112 ILE CG1 C 13 28.282 . . 1 . . . . 242 ILE CG1 . 26659 1 1100 . 1 1 112 112 ILE CG2 C 13 19.855 . . 1 . . . . 242 ILE CG2 . 26659 1 1101 . 1 1 112 112 ILE CD1 C 13 14.387 . . 1 . . . . 242 ILE CD1 . 26659 1 1102 . 1 1 112 112 ILE N N 15 119.903 . . 1 . . . . 242 ILE N . 26659 1 1103 . 1 1 113 113 CYS H H 1 8.969 . . 1 . . . . 243 CYS H . 26659 1 1104 . 1 1 113 113 CYS HA H 1 5.160 . . 1 . . . . 243 CYS HA . 26659 1 1105 . 1 1 113 113 CYS HB2 H 1 3.378 . . 1 . . . . 243 CYS HB2 . 26659 1 1106 . 1 1 113 113 CYS HB3 H 1 2.943 . . 1 . . . . 243 CYS HB3 . 26659 1 1107 . 1 1 113 113 CYS C C 13 171.464 . . 1 . . . . 243 CYS C . 26659 1 1108 . 1 1 113 113 CYS CA C 13 56.384 . . 1 . . . . 243 CYS CA . 26659 1 1109 . 1 1 113 113 CYS CB C 13 32.671 . . 1 . . . . 243 CYS CB . 26659 1 1110 . 1 1 113 113 CYS N N 15 123.400 . . 1 . . . . 243 CYS N . 26659 1 1111 . 1 1 114 114 ALA H H 1 8.947 . . 1 . . . . 244 ALA H . 26659 1 1112 . 1 1 114 114 ALA HA H 1 5.508 . . 1 . . . . 244 ALA HA . 26659 1 1113 . 1 1 114 114 ALA HB1 H 1 1.403 . . 1 . . . . 244 ALA HB . 26659 1 1114 . 1 1 114 114 ALA HB2 H 1 1.403 . . 1 . . . . 244 ALA HB . 26659 1 1115 . 1 1 114 114 ALA HB3 H 1 1.403 . . 1 . . . . 244 ALA HB . 26659 1 1116 . 1 1 114 114 ALA C C 13 177.368 . . 1 . . . . 244 ALA C . 26659 1 1117 . 1 1 114 114 ALA CA C 13 51.206 . . 1 . . . . 244 ALA CA . 26659 1 1118 . 1 1 114 114 ALA CB C 13 22.093 . . 1 . . . . 244 ALA CB . 26659 1 1119 . 1 1 114 114 ALA N N 15 123.705 . . 1 . . . . 244 ALA N . 26659 1 1120 . 1 1 115 115 TRP H H 1 9.370 . . 1 . . . . 245 TRP H . 26659 1 1121 . 1 1 115 115 TRP HA H 1 4.988 . . 1 . . . . 245 TRP HA . 26659 1 1122 . 1 1 115 115 TRP HB2 H 1 3.660 . . 1 . . . . 245 TRP HB2 . 26659 1 1123 . 1 1 115 115 TRP HB3 H 1 3.513 . . 1 . . . . 245 TRP HB3 . 26659 1 1124 . 1 1 115 115 TRP HD1 H 1 7.513 . . 1 . . . . 245 TRP HD1 . 26659 1 1125 . 1 1 115 115 TRP HE1 H 1 9.994 . . 1 . . . . 245 TRP HE1 . 26659 1 1126 . 1 1 115 115 TRP HZ2 H 1 7.418 . . 1 . . . . 245 TRP HZ2 . 26659 1 1127 . 1 1 115 115 TRP HH2 H 1 6.970 . . 1 . . . . 245 TRP HH2 . 26659 1 1128 . 1 1 115 115 TRP C C 13 173.754 . . 1 . . . . 245 TRP C . 26659 1 1129 . 1 1 115 115 TRP CA C 13 57.334 . . 1 . . . . 245 TRP CA . 26659 1 1130 . 1 1 115 115 TRP CB C 13 31.052 . . 1 . . . . 245 TRP CB . 26659 1 1131 . 1 1 115 115 TRP CD1 C 13 129.826 . . 1 . . . . 245 TRP CD1 . 26659 1 1132 . 1 1 115 115 TRP CZ2 C 13 114.014 . . 1 . . . . 245 TRP CZ2 . 26659 1 1133 . 1 1 115 115 TRP CH2 C 13 123.914 . . 1 . . . . 245 TRP CH2 . 26659 1 1134 . 1 1 115 115 TRP N N 15 123.811 . . 1 . . . . 245 TRP N . 26659 1 1135 . 1 1 115 115 TRP NE1 N 15 129.072 . . 1 . . . . 245 TRP NE1 . 26659 1 1136 . 1 1 116 116 LYS H H 1 7.994 . . 1 . . . . 246 LYS H . 26659 1 1137 . 1 1 116 116 LYS HA H 1 4.864 . . 1 . . . . 246 LYS HA . 26659 1 1138 . 1 1 116 116 LYS HB2 H 1 1.918 . . 2 . . . . 246 LYS HB# . 26659 1 1139 . 1 1 116 116 LYS HB3 H 1 1.918 . . 2 . . . . 246 LYS HB# . 26659 1 1140 . 1 1 116 116 LYS HG2 H 1 1.638 . . 2 . . . . 246 LYS HG# . 26659 1 1141 . 1 1 116 116 LYS HG3 H 1 1.638 . . 2 . . . . 246 LYS HG# . 26659 1 1142 . 1 1 116 116 LYS HD2 H 1 1.832 . . 2 . . . . 246 LYS HD# . 26659 1 1143 . 1 1 116 116 LYS HD3 H 1 1.832 . . 2 . . . . 246 LYS HD# . 26659 1 1144 . 1 1 116 116 LYS HE2 H 1 3.104 . . 2 . . . . 246 LYS HE# . 26659 1 1145 . 1 1 116 116 LYS HE3 H 1 3.104 . . 2 . . . . 246 LYS HE# . 26659 1 1146 . 1 1 116 116 LYS C C 13 178.729 . . 1 . . . . 246 LYS C . 26659 1 1147 . 1 1 116 116 LYS CA C 13 56.484 . . 1 . . . . 246 LYS CA . 26659 1 1148 . 1 1 116 116 LYS CB C 13 33.001 . . 1 . . . . 246 LYS CB . 26659 1 1149 . 1 1 116 116 LYS CE C 13 42.252 . . 1 . . . . 246 LYS CE . 26659 1 1150 . 1 1 116 116 LYS N N 15 119.481 . . 1 . . . . 246 LYS N . 26659 1 1151 . 1 1 117 117 GLN H H 1 9.005 . . 1 . . . . 247 GLN H . 26659 1 1152 . 1 1 117 117 GLN HA H 1 4.084 . . 1 . . . . 247 GLN HA . 26659 1 1153 . 1 1 117 117 GLN HB2 H 1 2.171 . . 2 . . . . 247 GLN HB# . 26659 1 1154 . 1 1 117 117 GLN HB3 H 1 2.171 . . 2 . . . . 247 GLN HB# . 26659 1 1155 . 1 1 117 117 GLN HG2 H 1 2.563 . . 2 . . . . 247 GLN HG# . 26659 1 1156 . 1 1 117 117 GLN HG3 H 1 2.563 . . 2 . . . . 247 GLN HG# . 26659 1 1157 . 1 1 117 117 GLN HE21 H 1 7.991 . . 1 . . . . 247 GLN HE21 . 26659 1 1158 . 1 1 117 117 GLN HE22 H 1 6.791 . . 1 . . . . 247 GLN HE22 . 26659 1 1159 . 1 1 117 117 GLN C C 13 176.395 . . 1 . . . . 247 GLN C . 26659 1 1160 . 1 1 117 117 GLN CA C 13 57.373 . . 1 . . . . 247 GLN CA . 26659 1 1161 . 1 1 117 117 GLN CB C 13 30.243 . . 1 . . . . 247 GLN CB . 26659 1 1162 . 1 1 117 117 GLN CG C 13 34.057 . . 1 . . . . 247 GLN CG . 26659 1 1163 . 1 1 117 117 GLN N N 15 125.894 . . 1 . . . . 247 GLN N . 26659 1 1164 . 1 1 117 117 GLN NE2 N 15 110.870 . . 1 . . . . 247 GLN NE2 . 26659 1 1165 . 1 1 118 118 HIS H H 1 9.695 . . 1 . . . . 248 HIS H . 26659 1 1166 . 1 1 118 118 HIS HA H 1 5.021 . . 1 . . . . 248 HIS HA . 26659 1 1167 . 1 1 118 118 HIS HB2 H 1 3.363 . . 2 . . . . 248 HIS HB# . 26659 1 1168 . 1 1 118 118 HIS HB3 H 1 3.363 . . 2 . . . . 248 HIS HB# . 26659 1 1169 . 1 1 118 118 HIS HD2 H 1 7.462 . . 1 . . . . 248 HIS HD2 . 26659 1 1170 . 1 1 118 118 HIS HE1 H 1 8.402 . . 1 . . . . 248 HIS HE1 . 26659 1 1171 . 1 1 118 118 HIS C C 13 177.207 . . 1 . . . . 248 HIS C . 26659 1 1172 . 1 1 118 118 HIS CA C 13 55.854 . . 1 . . . . 248 HIS CA . 26659 1 1173 . 1 1 118 118 HIS CB C 13 31.557 . . 1 . . . . 248 HIS CB . 26659 1 1174 . 1 1 118 118 HIS CD2 C 13 121.595 . . 1 . . . . 248 HIS CD2 . 26659 1 1175 . 1 1 118 118 HIS CE1 C 13 137.655 . . 1 . . . . 248 HIS CE1 . 26659 1 1176 . 1 1 118 118 HIS N N 15 126.999 . . 1 . . . . 248 HIS N . 26659 1 1177 . 1 1 119 119 GLY H H 1 9.347 . . 1 . . . . 249 GLY H . 26659 1 1178 . 1 1 119 119 GLY HA2 H 1 4.226 . . 1 . . . . 249 GLY HA2 . 26659 1 1179 . 1 1 119 119 GLY HA3 H 1 3.872 . . 1 . . . . 249 GLY HA3 . 26659 1 1180 . 1 1 119 119 GLY C C 13 174.880 . . 1 . . . . 249 GLY C . 26659 1 1181 . 1 1 119 119 GLY CA C 13 46.685 . . 1 . . . . 249 GLY CA . 26659 1 1182 . 1 1 119 119 GLY N N 15 110.298 . . 1 . . . . 249 GLY N . 26659 1 1183 . 1 1 120 120 GLY H H 1 9.158 . . 1 . . . . 250 GLY H . 26659 1 1184 . 1 1 120 120 GLY HA2 H 1 4.661 . . 1 . . . . 250 GLY HA2 . 26659 1 1185 . 1 1 120 120 GLY HA3 H 1 4.044 . . 1 . . . . 250 GLY HA3 . 26659 1 1186 . 1 1 120 120 GLY CA C 13 44.579 . . 1 . . . . 250 GLY CA . 26659 1 1187 . 1 1 120 120 GLY N N 15 109.542 . . 1 . . . . 250 GLY N . 26659 1 1188 . 1 1 121 121 PRO HA H 1 4.218 . . 1 . . . . 251 PRO HA . 26659 1 1189 . 1 1 121 121 PRO HB2 H 1 2.469 . . 1 . . . . 251 PRO HB2 . 26659 1 1190 . 1 1 121 121 PRO HB3 H 1 1.862 . . 1 . . . . 251 PRO HB3 . 26659 1 1191 . 1 1 121 121 PRO HG2 H 1 2.180 . . 2 . . . . 251 PRO HG# . 26659 1 1192 . 1 1 121 121 PRO HG3 H 1 2.180 . . 2 . . . . 251 PRO HG# . 26659 1 1193 . 1 1 121 121 PRO HD2 H 1 3.910 . . 2 . . . . 251 PRO HD# . 26659 1 1194 . 1 1 121 121 PRO HD3 H 1 3.910 . . 2 . . . . 251 PRO HD# . 26659 1 1195 . 1 1 121 121 PRO C C 13 177.105 . . 1 . . . . 251 PRO C . 26659 1 1196 . 1 1 121 121 PRO CA C 13 65.262 . . 1 . . . . 251 PRO CA . 26659 1 1197 . 1 1 121 121 PRO CB C 13 32.075 . . 1 . . . . 251 PRO CB . 26659 1 1198 . 1 1 121 121 PRO CG C 13 27.607 . . 1 . . . . 251 PRO CG . 26659 1 1199 . 1 1 121 121 PRO CD C 13 50.284 . . 1 . . . . 251 PRO CD . 26659 1 1200 . 1 1 122 122 ASN H H 1 8.507 . . 1 . . . . 252 ASN H . 26659 1 1201 . 1 1 122 122 ASN HA H 1 4.276 . . 1 . . . . 252 ASN HA . 26659 1 1202 . 1 1 122 122 ASN HB2 H 1 3.713 . . 1 . . . . 252 ASN HB2 . 26659 1 1203 . 1 1 122 122 ASN HB3 H 1 3.138 . . 1 . . . . 252 ASN HB3 . 26659 1 1204 . 1 1 122 122 ASN HD21 H 1 8.021 . . 1 . . . . 252 ASN HD21 . 26659 1 1205 . 1 1 122 122 ASN HD22 H 1 7.425 . . 1 . . . . 252 ASN HD22 . 26659 1 1206 . 1 1 122 122 ASN C C 13 176.476 . . 1 . . . . 252 ASN C . 26659 1 1207 . 1 1 122 122 ASN CA C 13 55.716 . . 1 . . . . 252 ASN CA . 26659 1 1208 . 1 1 122 122 ASN CB C 13 36.550 . . 1 . . . . 252 ASN CB . 26659 1 1209 . 1 1 122 122 ASN N N 15 113.101 . . 1 . . . . 252 ASN N . 26659 1 1210 . 1 1 122 122 ASN ND2 N 15 111.885 . . 1 . . . . 252 ASN ND2 . 26659 1 1211 . 1 1 123 123 GLN H H 1 7.651 . . 1 . . . . 253 GLN H . 26659 1 1212 . 1 1 123 123 GLN HA H 1 5.087 . . 1 . . . . 253 GLN HA . 26659 1 1213 . 1 1 123 123 GLN HB2 H 1 2.537 . . 1 . . . . 253 GLN HB2 . 26659 1 1214 . 1 1 123 123 GLN HB3 H 1 1.916 . . 1 . . . . 253 GLN HB3 . 26659 1 1215 . 1 1 123 123 GLN C C 13 174.361 . . 1 . . . . 253 GLN C . 26659 1 1216 . 1 1 123 123 GLN CA C 13 55.095 . . 1 . . . . 253 GLN CA . 26659 1 1217 . 1 1 123 123 GLN CB C 13 30.242 . . 1 . . . . 253 GLN CB . 26659 1 1218 . 1 1 123 123 GLN CG C 13 35.182 . . 1 . . . . 253 GLN CG . 26659 1 1219 . 1 1 123 123 GLN N N 15 119.457 . . 1 . . . . 253 GLN N . 26659 1 1220 . 1 1 124 124 LYS H H 1 7.208 . . 1 . . . . 254 LYS H . 26659 1 1221 . 1 1 124 124 LYS HA H 1 5.275 . . 1 . . . . 254 LYS HA . 26659 1 1222 . 1 1 124 124 LYS HB2 H 1 1.851 . . 1 . . . . 254 LYS HB2 . 26659 1 1223 . 1 1 124 124 LYS HB3 H 1 1.749 . . 1 . . . . 254 LYS HB3 . 26659 1 1224 . 1 1 124 124 LYS HG2 H 1 1.275 . . 2 . . . . 254 LYS HG# . 26659 1 1225 . 1 1 124 124 LYS HG3 H 1 1.275 . . 2 . . . . 254 LYS HG# . 26659 1 1226 . 1 1 124 124 LYS HD2 H 1 1.595 . . 2 . . . . 254 LYS HD# . 26659 1 1227 . 1 1 124 124 LYS HD3 H 1 1.595 . . 2 . . . . 254 LYS HD# . 26659 1 1228 . 1 1 124 124 LYS HE2 H 1 2.898 . . 2 . . . . 254 LYS HE# . 26659 1 1229 . 1 1 124 124 LYS HE3 H 1 2.898 . . 2 . . . . 254 LYS HE# . 26659 1 1230 . 1 1 124 124 LYS C C 13 175.824 . . 1 . . . . 254 LYS C . 26659 1 1231 . 1 1 124 124 LYS CA C 13 55.459 . . 1 . . . . 254 LYS CA . 26659 1 1232 . 1 1 124 124 LYS CB C 13 35.137 . . 1 . . . . 254 LYS CB . 26659 1 1233 . 1 1 124 124 LYS CG C 13 25.501 . . 1 . . . . 254 LYS CG . 26659 1 1234 . 1 1 124 124 LYS CD C 13 29.319 . . 1 . . . . 254 LYS CD . 26659 1 1235 . 1 1 124 124 LYS CE C 13 42.245 . . 1 . . . . 254 LYS CE . 26659 1 1236 . 1 1 124 124 LYS N N 15 119.700 . . 1 . . . . 254 LYS N . 26659 1 1237 . 1 1 125 125 PHE H H 1 9.332 . . 1 . . . . 255 PHE H . 26659 1 1238 . 1 1 125 125 PHE HA H 1 5.391 . . 1 . . . . 255 PHE HA . 26659 1 1239 . 1 1 125 125 PHE HB2 H 1 2.878 . . 1 . . . . 255 PHE HB2 . 26659 1 1240 . 1 1 125 125 PHE HB3 H 1 2.342 . . 1 . . . . 255 PHE HB3 . 26659 1 1241 . 1 1 125 125 PHE HD1 H 1 7.070 . . 3 . . . . 255 PHE HD# . 26659 1 1242 . 1 1 125 125 PHE HD2 H 1 7.070 . . 3 . . . . 255 PHE HD# . 26659 1 1243 . 1 1 125 125 PHE HE1 H 1 7.121 . . 3 . . . . 255 PHE HE# . 26659 1 1244 . 1 1 125 125 PHE HE2 H 1 7.121 . . 3 . . . . 255 PHE HE# . 26659 1 1245 . 1 1 125 125 PHE HZ H 1 6.836 . . 1 . . . . 255 PHE HZ . 26659 1 1246 . 1 1 125 125 PHE C C 13 173.929 . . 1 . . . . 255 PHE C . 26659 1 1247 . 1 1 125 125 PHE CA C 13 57.026 . . 1 . . . . 255 PHE CA . 26659 1 1248 . 1 1 125 125 PHE CB C 13 44.232 . . 1 . . . . 255 PHE CB . 26659 1 1249 . 1 1 125 125 PHE CD1 C 13 132.489 . . 3 . . . . 255 PHE CD# . 26659 1 1250 . 1 1 125 125 PHE CD2 C 13 132.489 . . 3 . . . . 255 PHE CD# . 26659 1 1251 . 1 1 125 125 PHE CE1 C 13 130.397 . . 3 . . . . 255 PHE CE# . 26659 1 1252 . 1 1 125 125 PHE CE2 C 13 130.397 . . 3 . . . . 255 PHE CE# . 26659 1 1253 . 1 1 125 125 PHE CZ C 13 127.880 . . 1 . . . . 255 PHE CZ . 26659 1 1254 . 1 1 125 125 PHE N N 15 123.200 . . 1 . . . . 255 PHE N . 26659 1 1255 . 1 1 126 126 ILE H H 1 9.882 . . 1 . . . . 256 ILE H . 26659 1 1256 . 1 1 126 126 ILE HA H 1 4.450 . . 1 . . . . 256 ILE HA . 26659 1 1257 . 1 1 126 126 ILE HB H 1 1.790 . . 1 . . . . 256 ILE HB . 26659 1 1258 . 1 1 126 126 ILE HG13 H 1 1.375 . . 1 . . . . 256 ILE HG13 . 26659 1 1259 . 1 1 126 126 ILE HG21 H 1 1.019 . . 1 . . . . 256 ILE HG2 . 26659 1 1260 . 1 1 126 126 ILE HG22 H 1 1.019 . . 1 . . . . 256 ILE HG2 . 26659 1 1261 . 1 1 126 126 ILE HG23 H 1 1.019 . . 1 . . . . 256 ILE HG2 . 26659 1 1262 . 1 1 126 126 ILE HD11 H 1 0.930 . . 1 . . . . 256 ILE HD1 . 26659 1 1263 . 1 1 126 126 ILE HD12 H 1 0.930 . . 1 . . . . 256 ILE HD1 . 26659 1 1264 . 1 1 126 126 ILE HD13 H 1 0.930 . . 1 . . . . 256 ILE HD1 . 26659 1 1265 . 1 1 126 126 ILE C C 13 174.559 . . 1 . . . . 256 ILE C . 26659 1 1266 . 1 1 126 126 ILE CA C 13 59.947 . . 1 . . . . 256 ILE CA . 26659 1 1267 . 1 1 126 126 ILE CB C 13 41.909 . . 1 . . . . 256 ILE CB . 26659 1 1268 . 1 1 126 126 ILE CG1 C 13 28.064 . . 1 . . . . 256 ILE CG1 . 26659 1 1269 . 1 1 126 126 ILE CG2 C 13 18.001 . . 1 . . . . 256 ILE CG2 . 26659 1 1270 . 1 1 126 126 ILE CD1 C 13 14.387 . . 1 . . . . 256 ILE CD1 . 26659 1 1271 . 1 1 126 126 ILE N N 15 120.898 . . 1 . . . . 256 ILE N . 26659 1 1272 . 1 1 127 127 ILE H H 1 8.638 . . 1 . . . . 257 ILE H . 26659 1 1273 . 1 1 127 127 ILE HA H 1 5.046 . . 1 . . . . 257 ILE HA . 26659 1 1274 . 1 1 127 127 ILE HB H 1 2.032 . . 1 . . . . 257 ILE HB . 26659 1 1275 . 1 1 127 127 ILE HG12 H 1 1.217 . . 1 . . . . 257 ILE HG1# . 26659 1 1276 . 1 1 127 127 ILE HG13 H 1 1.217 . . 1 . . . . 257 ILE HG1# . 26659 1 1277 . 1 1 127 127 ILE HG21 H 1 0.494 . . 1 . . . . 257 ILE HG2 . 26659 1 1278 . 1 1 127 127 ILE HG22 H 1 0.494 . . 1 . . . . 257 ILE HG2 . 26659 1 1279 . 1 1 127 127 ILE HG23 H 1 0.494 . . 1 . . . . 257 ILE HG2 . 26659 1 1280 . 1 1 127 127 ILE HD11 H 1 0.518 . . 1 . . . . 257 ILE HD1 . 26659 1 1281 . 1 1 127 127 ILE HD12 H 1 0.518 . . 1 . . . . 257 ILE HD1 . 26659 1 1282 . 1 1 127 127 ILE HD13 H 1 0.518 . . 1 . . . . 257 ILE HD1 . 26659 1 1283 . 1 1 127 127 ILE C C 13 176.388 . . 1 . . . . 257 ILE C . 26659 1 1284 . 1 1 127 127 ILE CA C 13 58.439 . . 1 . . . . 257 ILE CA . 26659 1 1285 . 1 1 127 127 ILE CB C 13 35.985 . . 1 . . . . 257 ILE CB . 26659 1 1286 . 1 1 127 127 ILE CG1 C 13 26.919 . . 1 . . . . 257 ILE CG1 . 26659 1 1287 . 1 1 127 127 ILE CG2 C 13 17.660 . . 1 . . . . 257 ILE CG2 . 26659 1 1288 . 1 1 127 127 ILE CD1 C 13 10.747 . . 1 . . . . 257 ILE CD1 . 26659 1 1289 . 1 1 127 127 ILE N N 15 126.346 . . 1 . . . . 257 ILE N . 26659 1 1290 . 1 1 128 128 GLU H H 1 8.611 . . 1 . . . . 258 GLU H . 26659 1 1291 . 1 1 128 128 GLU HA H 1 5.029 . . 1 . . . . 258 GLU HA . 26659 1 1292 . 1 1 128 128 GLU HB2 H 1 2.175 . . 1 . . . . 258 GLU HB2 . 26659 1 1293 . 1 1 128 128 GLU HB3 H 1 2.080 . . 1 . . . . 258 GLU HB3 . 26659 1 1294 . 1 1 128 128 GLU HG2 H 1 2.390 . . 2 . . . . 258 GLU HG# . 26659 1 1295 . 1 1 128 128 GLU HG3 H 1 2.390 . . 2 . . . . 258 GLU HG# . 26659 1 1296 . 1 1 128 128 GLU C C 13 175.254 . . 1 . . . . 258 GLU C . 26659 1 1297 . 1 1 128 128 GLU CA C 13 54.406 . . 1 . . . . 258 GLU CA . 26659 1 1298 . 1 1 128 128 GLU CB C 13 34.264 . . 1 . . . . 258 GLU CB . 26659 1 1299 . 1 1 128 128 GLU CG C 13 36.491 . . 1 . . . . 258 GLU CG . 26659 1 1300 . 1 1 128 128 GLU N N 15 128.514 . . 1 . . . . 258 GLU N . 26659 1 1301 . 1 1 129 129 SER H H 1 9.221 . . 1 . . . . 259 SER H . 26659 1 1302 . 1 1 129 129 SER HA H 1 4.733 . . 1 . . . . 259 SER HA . 26659 1 1303 . 1 1 129 129 SER HB2 H 1 4.211 . . 2 . . . . 259 SER HB# . 26659 1 1304 . 1 1 129 129 SER HB3 H 1 4.211 . . 2 . . . . 259 SER HB# . 26659 1 1305 . 1 1 129 129 SER C C 13 174.293 . . 1 . . . . 259 SER C . 26659 1 1306 . 1 1 129 129 SER CA C 13 60.355 . . 1 . . . . 259 SER CA . 26659 1 1307 . 1 1 129 129 SER CB C 13 64.207 . . 1 . . . . 259 SER CB . 26659 1 1308 . 1 1 129 129 SER N N 15 122.101 . . 1 . . . . 259 SER N . 26659 1 1309 . 1 1 130 130 GLU H H 1 8.348 . . 1 . . . . 260 GLU H . 26659 1 1310 . 1 1 130 130 GLU HA H 1 4.272 . . 1 . . . . 260 GLU HA . 26659 1 1311 . 1 1 130 130 GLU HB2 H 1 2.059 . . 2 . . . . 260 GLU HB# . 26659 1 1312 . 1 1 130 130 GLU HB3 H 1 2.059 . . 2 . . . . 260 GLU HB# . 26659 1 1313 . 1 1 130 130 GLU HG2 H 1 2.547 . . 1 . . . . 260 GLU HG2 . 26659 1 1314 . 1 1 130 130 GLU HG3 H 1 2.380 . . 1 . . . . 260 GLU HG3 . 26659 1 1315 . 1 1 130 130 GLU CA C 13 60.169 . . 1 . . . . 260 GLU CA . 26659 1 1316 . 1 1 130 130 GLU CB C 13 30.501 . . 1 . . . . 260 GLU CB . 26659 1 1317 . 1 1 130 130 GLU N N 15 129.300 . . 1 . . . . 260 GLU N . 26659 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 26659 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26659 2 2 '2D 1H-13C HSQC aromatic' . . . 26659 2 3 '3D CBCA(CO)NH' . . . 26659 2 4 '3D C(CO)NH' . . . 26659 2 5 '3D HNCO' . . . 26659 2 6 '3D HNCA' . . . 26659 2 7 '3D HNCACB' . . . 26659 2 9 '3D H(CCO)NH' . . . 26659 2 10 '3D HCCH-TOCSY' . . . 26659 2 12 '3D 1H-15N TOCSY' . . . 26659 2 13 '3D 1H-13C NOESY aromatic' . . . 26659 2 14 '3D HCCH-COSY' . . . 26659 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 129 129 SER C C 13 174.204 . . 1 . . . . 259 SER C . 26659 2 2 . 1 1 130 130 GLU H H 1 8.290 . . 1 . . . . 260 GLU H . 26659 2 3 . 1 1 130 130 GLU HA H 1 4.271 . . 1 . . . . 260 GLU HA . 26659 2 4 . 1 1 130 130 GLU CA C 13 60.176 . . 1 . . . . 260 GLU CA . 26659 2 5 . 1 1 130 130 GLU CB C 13 30.499 . . 1 . . . . 260 GLU CB . 26659 2 6 . 1 1 130 130 GLU N N 15 129.623 . . 1 . . . . 260 GLU N . 26659 2 stop_ save_