data_27498 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27498 _Entry.Title ; 1H, 15N and 13C resonance assignments of the C-terminal domain of the P protein of the Nishigahara strain of rabies virus ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-05-30 _Entry.Accession_date 2018-05-30 _Entry.Last_release_date 2018-06-01 _Entry.Original_release_date 2018-06-01 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jingyu Zhan . . . . 27498 2 Paul Gooley . R. . . 27498 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27498 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 477 27498 '15N chemical shifts' 121 27498 '1H chemical shifts' 760 27498 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 . . 2018-10-03 . original BMRB . 27498 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27498 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27498 _Citation.Full_citation . _Citation.Title ; 1H, 15N and 13C resonance assignments of the C-terminal domain of the P protein of the Nishigahara strain of rabies virus ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2018 _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 Jingyu Zhan . . . . 27498 1 2 Hossain 'Md. Alamgir' . . . . 27498 1 3 Ashish Sethi . . . . 27498 1 4 Gregory Moseley . W. . . 27498 1 5 Paul Gooley . R. . . 27498 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Chemical shift assignments' 27498 1 Lyssavirus 27498 1 'P protein' 27498 1 Phosphoprotein 27498 1 Rabies 27498 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27498 _Assembly.ID 1 _Assembly.Name 'C-terminal domain of the P protein of the Nishigahara strain of rabies virus' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 13001 _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 'RABV P-protein CTD' 1 $RABV_P-protein_CTD A . yes native no no . . . 27498 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1vyi . . X-ray 1.5 . . 27498 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Innate immune evasion' 27498 1 'Nucleo-cytoplasmic trafficking' 27498 1 'Viral replication' 27498 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RABV_P-protein_CTD _Entity.Sf_category entity _Entity.Sf_framecode RABV_P-protein_CTD _Entity.Entry_ID 27498 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RABV_P-protein_CTD _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 ; GHMWSATNEEDDLSVEAEIA HQIAESFSKKYKFPSRSSGI FLYNFEQLKMNLDDIVKEAK NVPGVTRLAHDGSKLPLRCV LGWVALANSKKFQLLVEANK LNKIMQDDLNRYASS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq '1, 183' _Entity.Polymer_author_seq_details 'The first 3 residues GHM represent a non-native part introduced from cloning.' _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 115 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'C-terminal domain encompassing residues 186 to 297 of the phosphoprotein of the Nishigahara strain of rabies virus.' _Entity.Mutation 'C115S (C297S in author sequence)' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13000.82 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes UNP Q9IPJ8 . PHOSP_RABVN . . . . . . . . . . . . . . 27498 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Innate immune system evasion' 27498 1 'Viral replication and transcription' 27498 1 'nucleo-cytoplasmic trafficking' 27498 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 183 GLY . 27498 1 2 184 HIS . 27498 1 3 185 MET . 27498 1 4 186 TRP . 27498 1 5 187 SER . 27498 1 6 188 ALA . 27498 1 7 189 THR . 27498 1 8 190 ASN . 27498 1 9 191 GLU . 27498 1 10 192 GLU . 27498 1 11 193 ASP . 27498 1 12 194 ASP . 27498 1 13 195 LEU . 27498 1 14 196 SER . 27498 1 15 197 VAL . 27498 1 16 198 GLU . 27498 1 17 199 ALA . 27498 1 18 200 GLU . 27498 1 19 201 ILE . 27498 1 20 202 ALA . 27498 1 21 203 HIS . 27498 1 22 204 GLN . 27498 1 23 205 ILE . 27498 1 24 206 ALA . 27498 1 25 207 GLU . 27498 1 26 208 SER . 27498 1 27 209 PHE . 27498 1 28 210 SER . 27498 1 29 211 LYS . 27498 1 30 212 LYS . 27498 1 31 213 TYR . 27498 1 32 214 LYS . 27498 1 33 215 PHE . 27498 1 34 216 PRO . 27498 1 35 217 SER . 27498 1 36 218 ARG . 27498 1 37 219 SER . 27498 1 38 220 SER . 27498 1 39 221 GLY . 27498 1 40 222 ILE . 27498 1 41 223 PHE . 27498 1 42 224 LEU . 27498 1 43 225 TYR . 27498 1 44 226 ASN . 27498 1 45 227 PHE . 27498 1 46 228 GLU . 27498 1 47 229 GLN . 27498 1 48 230 LEU . 27498 1 49 231 LYS . 27498 1 50 232 MET . 27498 1 51 233 ASN . 27498 1 52 234 LEU . 27498 1 53 235 ASP . 27498 1 54 236 ASP . 27498 1 55 237 ILE . 27498 1 56 238 VAL . 27498 1 57 239 LYS . 27498 1 58 240 GLU . 27498 1 59 241 ALA . 27498 1 60 242 LYS . 27498 1 61 243 ASN . 27498 1 62 244 VAL . 27498 1 63 245 PRO . 27498 1 64 246 GLY . 27498 1 65 247 VAL . 27498 1 66 248 THR . 27498 1 67 249 ARG . 27498 1 68 250 LEU . 27498 1 69 251 ALA . 27498 1 70 252 HIS . 27498 1 71 253 ASP . 27498 1 72 254 GLY . 27498 1 73 255 SER . 27498 1 74 256 LYS . 27498 1 75 257 LEU . 27498 1 76 258 PRO . 27498 1 77 259 LEU . 27498 1 78 260 ARG . 27498 1 79 261 CYS . 27498 1 80 262 VAL . 27498 1 81 263 LEU . 27498 1 82 264 GLY . 27498 1 83 265 TRP . 27498 1 84 266 VAL . 27498 1 85 267 ALA . 27498 1 86 268 LEU . 27498 1 87 269 ALA . 27498 1 88 270 ASN . 27498 1 89 271 SER . 27498 1 90 272 LYS . 27498 1 91 273 LYS . 27498 1 92 274 PHE . 27498 1 93 275 GLN . 27498 1 94 276 LEU . 27498 1 95 277 LEU . 27498 1 96 278 VAL . 27498 1 97 279 GLU . 27498 1 98 280 ALA . 27498 1 99 281 ASN . 27498 1 100 282 LYS . 27498 1 101 283 LEU . 27498 1 102 284 ASN . 27498 1 103 285 LYS . 27498 1 104 286 ILE . 27498 1 105 287 MET . 27498 1 106 288 GLN . 27498 1 107 289 ASP . 27498 1 108 290 ASP . 27498 1 109 291 LEU . 27498 1 110 292 ASN . 27498 1 111 293 ARG . 27498 1 112 294 TYR . 27498 1 113 295 ALA . 27498 1 114 296 SER . 27498 1 115 297 SER . 27498 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27498 1 . HIS 2 2 27498 1 . MET 3 3 27498 1 . TRP 4 4 27498 1 . SER 5 5 27498 1 . ALA 6 6 27498 1 . THR 7 7 27498 1 . ASN 8 8 27498 1 . GLU 9 9 27498 1 . GLU 10 10 27498 1 . ASP 11 11 27498 1 . ASP 12 12 27498 1 . LEU 13 13 27498 1 . SER 14 14 27498 1 . VAL 15 15 27498 1 . GLU 16 16 27498 1 . ALA 17 17 27498 1 . GLU 18 18 27498 1 . ILE 19 19 27498 1 . ALA 20 20 27498 1 . HIS 21 21 27498 1 . GLN 22 22 27498 1 . ILE 23 23 27498 1 . ALA 24 24 27498 1 . GLU 25 25 27498 1 . SER 26 26 27498 1 . PHE 27 27 27498 1 . SER 28 28 27498 1 . LYS 29 29 27498 1 . LYS 30 30 27498 1 . TYR 31 31 27498 1 . LYS 32 32 27498 1 . PHE 33 33 27498 1 . PRO 34 34 27498 1 . SER 35 35 27498 1 . ARG 36 36 27498 1 . SER 37 37 27498 1 . SER 38 38 27498 1 . GLY 39 39 27498 1 . ILE 40 40 27498 1 . PHE 41 41 27498 1 . LEU 42 42 27498 1 . TYR 43 43 27498 1 . ASN 44 44 27498 1 . PHE 45 45 27498 1 . GLU 46 46 27498 1 . GLN 47 47 27498 1 . LEU 48 48 27498 1 . LYS 49 49 27498 1 . MET 50 50 27498 1 . ASN 51 51 27498 1 . LEU 52 52 27498 1 . ASP 53 53 27498 1 . ASP 54 54 27498 1 . ILE 55 55 27498 1 . VAL 56 56 27498 1 . LYS 57 57 27498 1 . GLU 58 58 27498 1 . ALA 59 59 27498 1 . LYS 60 60 27498 1 . ASN 61 61 27498 1 . VAL 62 62 27498 1 . PRO 63 63 27498 1 . GLY 64 64 27498 1 . VAL 65 65 27498 1 . THR 66 66 27498 1 . ARG 67 67 27498 1 . LEU 68 68 27498 1 . ALA 69 69 27498 1 . HIS 70 70 27498 1 . ASP 71 71 27498 1 . GLY 72 72 27498 1 . SER 73 73 27498 1 . LYS 74 74 27498 1 . LEU 75 75 27498 1 . PRO 76 76 27498 1 . LEU 77 77 27498 1 . ARG 78 78 27498 1 . CYS 79 79 27498 1 . VAL 80 80 27498 1 . LEU 81 81 27498 1 . GLY 82 82 27498 1 . TRP 83 83 27498 1 . VAL 84 84 27498 1 . ALA 85 85 27498 1 . LEU 86 86 27498 1 . ALA 87 87 27498 1 . ASN 88 88 27498 1 . SER 89 89 27498 1 . LYS 90 90 27498 1 . LYS 91 91 27498 1 . PHE 92 92 27498 1 . GLN 93 93 27498 1 . LEU 94 94 27498 1 . LEU 95 95 27498 1 . VAL 96 96 27498 1 . GLU 97 97 27498 1 . ALA 98 98 27498 1 . ASN 99 99 27498 1 . LYS 100 100 27498 1 . LEU 101 101 27498 1 . ASN 102 102 27498 1 . LYS 103 103 27498 1 . ILE 104 104 27498 1 . MET 105 105 27498 1 . GLN 106 106 27498 1 . ASP 107 107 27498 1 . ASP 108 108 27498 1 . LEU 109 109 27498 1 . ASN 110 110 27498 1 . ARG 111 111 27498 1 . TYR 112 112 27498 1 . ALA 113 113 27498 1 . SER 114 114 27498 1 . SER 115 115 27498 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 27498 _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 $RABV_P-protein_CTD . 11286 virus . 'Lyssavirus genus' 'Lyssavirus genus' . . viruses ssRNA2 Lyssavirus genus . . . . . . . . . . . P 'The C-terminal domain of the P protein of the Nishigahara strain of rabies virus' 27498 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 27498 _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 $RABV_P-protein_CTD . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . pET28a . . . 27498 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N _Sample.Sf_category sample _Sample.Sf_framecode 15N _Sample.Entry_ID 27498 _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 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27498 1 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27498 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27498 1 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 27498 1 5 NIP-CTD '[U-99% 15N]' . . 1 $RABV_P-protein_CTD . . 0.6 . . mM . . . . 27498 1 stop_ save_ save_unlabelled _Sample.Sf_category sample _Sample.Sf_framecode unlabelled _Sample.Entry_ID 27498 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27498 2 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27498 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27498 2 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 27498 2 5 NIP-CTD 'natural abundance' . . 1 $RABV_P-protein_CTD . . 0.6 . . mM . . . . 27498 2 6 DSS 'natural abundance' . . . . . . 50 . . uM . . . . 27498 2 stop_ save_ save_13C-D2O _Sample.Sf_category sample _Sample.Sf_framecode 13C-D2O _Sample.Entry_ID 27498 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27498 3 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27498 3 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27498 3 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 27498 3 5 NIP-CTD '[U-98% 13C; U-98% 15N]' . . 1 $RABV_P-protein_CTD . . 0.3 . . mM . . . . 27498 3 stop_ save_ save_13C-H2O _Sample.Sf_category sample _Sample.Sf_framecode 13C-H2O _Sample.Entry_ID 27498 _Sample.ID 4 _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 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27498 4 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27498 4 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27498 4 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 27498 4 5 NIP-CTD '[U-98% 13C; U-98% 15N]' . . 1 $RABV_P-protein_CTD . . 0.3 . . mM . . . . 27498 4 stop_ save_ save_10_13C _Sample.Sf_category sample _Sample.Sf_framecode 10_13C _Sample.Entry_ID 27498 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27498 5 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27498 5 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27498 5 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 27498 5 5 NIP-CTD '[U-10% 13C; U-99% 15N]' . . 1 $RABV_P-protein_CTD . . 0.32 . . mM . . . . 27498 5 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 27498 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.2 . M 27498 1 pH 6.8 . pH 27498 1 pressure 1 . atm 27498 1 temperature 298 . K 27498 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRFAM-SPARKY _Software.Sf_category software _Software.Sf_framecode NMRFAM-SPARKY _Software.Entry_ID 27498 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 'v 1.3' _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Lee W, Tonelli M, Markley JL' . whlee@nmrfam.wisc.edu 27498 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27498 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27498 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27498 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27498 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 27498 _Software.ID 3 _Software.Type . _Software.Name NMRDraw _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27498 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27498 3 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 27498 _Software.ID 4 _Software.Type . _Software.Name CYANA _Software.Version 'v 2.1' _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 27498 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 27498 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 27498 _Software.ID 5 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 27498 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 27498 5 stop_ save_ save_MddNMR _Software.Sf_category software _Software.Sf_framecode MddNMR _Software.Entry_ID 27498 _Software.ID 6 _Software.Type . _Software.Name MddNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'V. Orekhov, V. Jaravine, M. Mayzel, K. Kazimierczuk' 'Swedish NMR Center, University of Gothenburg' orov@nmr.gu.se 27498 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27498 6 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27498 _Software.ID 7 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27498 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 27498 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_700 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 700 _NMR_spectrometer.Entry_ID 27498 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800 _NMR_spectrometer.Entry_ID 27498 _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 27498 _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 1 700 Bruker Avance . 700 'Avance II' . . 27498 1 2 800 Bruker Avance . 800 'Avance IIIHD' . . 27498 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 27498 _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 $15N isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 3 $13C-D2O isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 3 $13C-D2O isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 4 '2D 1H-1H TOCSY' no . . . . . . . . . . 2 $unlabelled isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 5 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $unlabelled isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 7 '3D HNCACB' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 8 '3D C(CO)NH' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 9 '3D HNCO' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 10 '3D HN(CA)CO' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 11 '3D H(CCO)NH' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 12 '3D HBHA(CO)NH' no . . . . . . . . . . 4 $13C-H2O isotropic . . 1 $sample_conditions_1 . . . 2 $800 . . . . . . . . . . . . . . . . 27498 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $13C-D2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 3 $13C-D2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 15 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 3 $13C-D2O isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 16 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $15N isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 1 17 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 5 $10_13C isotropic . . 1 $sample_conditions_1 . . . 1 $700 . . . . . . . . . . . . . . . . 27498 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 27498 _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 . . . . . 27498 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27498 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27498 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 27498 _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' . . . 27498 1 2 '2D 1H-13C HSQC aliphatic' . . . 27498 1 3 '2D 1H-13C HSQC aromatic' . . . 27498 1 4 '2D 1H-1H TOCSY' . . . 27498 1 5 '2D 1H-1H NOESY' . . . 27498 1 6 '3D CBCA(CO)NH' . . . 27498 1 7 '3D HNCACB' . . . 27498 1 8 '3D C(CO)NH' . . . 27498 1 9 '3D HNCO' . . . 27498 1 10 '3D HN(CA)CO' . . . 27498 1 11 '3D H(CCO)NH' . . . 27498 1 12 '3D HBHA(CO)NH' . . . 27498 1 13 '3D HCCH-TOCSY' . . . 27498 1 14 '3D 1H-13C NOESY aromatic' . . . 27498 1 15 '3D 1H-13C NOESY aliphatic' . . . 27498 1 16 '3D 1H-15N NOESY' . . . 27498 1 17 '2D 1H-13C HSQC aliphatic' . . . 27498 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRFAM-SPARKY . . 27498 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 HIS HD2 H 1 6.901 0.006 . . . . . . . 184 HIS HD2 . 27498 1 2 . 1 1 2 2 HIS HE1 H 1 7.843 0.007 . . . . . . . 184 HIS HE1 . 27498 1 3 . 1 1 2 2 HIS CD2 C 13 119.592 0 . . . . . . . 184 HIS CD2 . 27498 1 4 . 1 1 2 2 HIS CE1 C 13 138.119 0 . . . . . . . 184 HIS CE1 . 27498 1 5 . 1 1 3 3 MET HA H 1 4.433 0.01 . . . . . . . 185 MET HA . 27498 1 6 . 1 1 3 3 MET HB2 H 1 1.942 0.011 . . . . . . . 185 MET HB2 . 27498 1 7 . 1 1 3 3 MET HB3 H 1 1.91 0.011 . . . . . . . 185 MET HB3 . 27498 1 8 . 1 1 3 3 MET HG2 H 1 2.451 0.002 . . . . . . . 185 MET HG2 . 27498 1 9 . 1 1 3 3 MET HG3 H 1 2.4 0.011 . . . . . . . 185 MET HG3 . 27498 1 10 . 1 1 3 3 MET HE1 H 1 2.049 0 . . . . . . . 185 MET HE . 27498 1 11 . 1 1 3 3 MET HE2 H 1 2.049 0 . . . . . . . 185 MET HE . 27498 1 12 . 1 1 3 3 MET HE3 H 1 2.049 0 . . . . . . . 185 MET HE . 27498 1 13 . 1 1 3 3 MET C C 13 175.582 0.001 . . . . . . . 185 MET C . 27498 1 14 . 1 1 3 3 MET CA C 13 55.521 0.075 . . . . . . . 185 MET CA . 27498 1 15 . 1 1 3 3 MET CB C 13 32.826 0.041 . . . . . . . 185 MET CB . 27498 1 16 . 1 1 3 3 MET CG C 13 31.783 0.025 . . . . . . . 185 MET CG . 27498 1 17 . 1 1 3 3 MET CE C 13 16.858 0 . . . . . . . 185 MET CE . 27498 1 18 . 1 1 4 4 TRP H H 1 8.264 0.002 . . . . . . . 186 TRP H . 27498 1 19 . 1 1 4 4 TRP HA H 1 4.592 0.006 . . . . . . . 186 TRP HA . 27498 1 20 . 1 1 4 4 TRP HB2 H 1 3.235 0.006 . . . . . . . 186 TRP HB2 . 27498 1 21 . 1 1 4 4 TRP HB3 H 1 3.235 0.006 . . . . . . . 186 TRP HB3 . 27498 1 22 . 1 1 4 4 TRP HD1 H 1 7.231 0.007 . . . . . . . 186 TRP HD1 . 27498 1 23 . 1 1 4 4 TRP HE1 H 1 10.117 0.001 . . . . . . . 186 TRP HE1 . 27498 1 24 . 1 1 4 4 TRP HE3 H 1 7.484 0.007 . . . . . . . 186 TRP HE3 . 27498 1 25 . 1 1 4 4 TRP HZ2 H 1 7.326 0.005 . . . . . . . 186 TRP HZ2 . 27498 1 26 . 1 1 4 4 TRP HZ3 H 1 7.057 0.004 . . . . . . . 186 TRP HZ3 . 27498 1 27 . 1 1 4 4 TRP HH2 H 1 7.11 0 . . . . . . . 186 TRP HH2 . 27498 1 28 . 1 1 4 4 TRP C C 13 175.797 0.002 . . . . . . . 186 TRP C . 27498 1 29 . 1 1 4 4 TRP CA C 13 57.781 0.047 . . . . . . . 186 TRP CA . 27498 1 30 . 1 1 4 4 TRP CB C 13 29.627 0.059 . . . . . . . 186 TRP CB . 27498 1 31 . 1 1 4 4 TRP CD1 C 13 127.08 0.006 . . . . . . . 186 TRP CD1 . 27498 1 32 . 1 1 4 4 TRP CE3 C 13 120.631 0.017 . . . . . . . 186 TRP CE3 . 27498 1 33 . 1 1 4 4 TRP CZ2 C 13 114.378 0.033 . . . . . . . 186 TRP CZ2 . 27498 1 34 . 1 1 4 4 TRP CZ3 C 13 121.874 0 . . . . . . . 186 TRP CZ3 . 27498 1 35 . 1 1 4 4 TRP CH2 C 13 124.394 0.06 . . . . . . . 186 TRP CH2 . 27498 1 36 . 1 1 4 4 TRP N N 15 122.776 0.054 . . . . . . . 186 TRP N . 27498 1 37 . 1 1 4 4 TRP NE1 N 15 129.635 0.017 . . . . . . . 186 TRP NE1 . 27498 1 38 . 1 1 5 5 SER H H 1 7.804 0.002 . . . . . . . 187 SER H . 27498 1 39 . 1 1 5 5 SER HA H 1 4.265 0.006 . . . . . . . 187 SER HA . 27498 1 40 . 1 1 5 5 SER HB2 H 1 3.65 0.012 . . . . . . . 187 SER HB2 . 27498 1 41 . 1 1 5 5 SER HB3 H 1 3.696 0.004 . . . . . . . 187 SER HB3 . 27498 1 42 . 1 1 5 5 SER C C 13 173.33 0.01 . . . . . . . 187 SER C . 27498 1 43 . 1 1 5 5 SER CA C 13 57.715 0.091 . . . . . . . 187 SER CA . 27498 1 44 . 1 1 5 5 SER CB C 13 64.215 0.059 . . . . . . . 187 SER CB . 27498 1 45 . 1 1 5 5 SER N N 15 118.019 0.039 . . . . . . . 187 SER N . 27498 1 46 . 1 1 6 6 ALA H H 1 8.196 0.003 . . . . . . . 188 ALA H . 27498 1 47 . 1 1 6 6 ALA HA H 1 4.176 0.004 . . . . . . . 188 ALA HA . 27498 1 48 . 1 1 6 6 ALA HB1 H 1 1.379 0.012 . . . . . . . 188 ALA HB . 27498 1 49 . 1 1 6 6 ALA HB2 H 1 1.379 0.012 . . . . . . . 188 ALA HB . 27498 1 50 . 1 1 6 6 ALA HB3 H 1 1.379 0.012 . . . . . . . 188 ALA HB . 27498 1 51 . 1 1 6 6 ALA C C 13 177.992 0.001 . . . . . . . 188 ALA C . 27498 1 52 . 1 1 6 6 ALA CA C 13 52.665 0.088 . . . . . . . 188 ALA CA . 27498 1 53 . 1 1 6 6 ALA CB C 13 19.243 0.036 . . . . . . . 188 ALA CB . 27498 1 54 . 1 1 6 6 ALA N N 15 125.867 0.033 . . . . . . . 188 ALA N . 27498 1 55 . 1 1 7 7 THR H H 1 8.197 0.002 . . . . . . . 189 THR H . 27498 1 56 . 1 1 7 7 THR HA H 1 4.313 0.008 . . . . . . . 189 THR HA . 27498 1 57 . 1 1 7 7 THR HB H 1 4.252 0.005 . . . . . . . 189 THR HB . 27498 1 58 . 1 1 7 7 THR HG21 H 1 1.168 0.004 . . . . . . . 189 THR HG2 . 27498 1 59 . 1 1 7 7 THR HG22 H 1 1.168 0.004 . . . . . . . 189 THR HG2 . 27498 1 60 . 1 1 7 7 THR HG23 H 1 1.168 0.004 . . . . . . . 189 THR HG2 . 27498 1 61 . 1 1 7 7 THR C C 13 174.328 0.002 . . . . . . . 189 THR C . 27498 1 62 . 1 1 7 7 THR CA C 13 61.811 0.084 . . . . . . . 189 THR CA . 27498 1 63 . 1 1 7 7 THR CB C 13 69.771 0.053 . . . . . . . 189 THR CB . 27498 1 64 . 1 1 7 7 THR CG2 C 13 21.599 0.048 . . . . . . . 189 THR CG2 . 27498 1 65 . 1 1 7 7 THR N N 15 112.442 0.039 . . . . . . . 189 THR N . 27498 1 66 . 1 1 8 8 ASN H H 1 8.295 0.004 . . . . . . . 190 ASN H . 27498 1 67 . 1 1 8 8 ASN HA H 1 4.724 0.009 . . . . . . . 190 ASN HA . 27498 1 68 . 1 1 8 8 ASN HB2 H 1 2.881 0.01 . . . . . . . 190 ASN HB2 . 27498 1 69 . 1 1 8 8 ASN HB3 H 1 2.79 0.014 . . . . . . . 190 ASN HB3 . 27498 1 70 . 1 1 8 8 ASN HD21 H 1 7.571 0.001 . . . . . . . 190 ASN HD21 . 27498 1 71 . 1 1 8 8 ASN HD22 H 1 6.901 0.002 . . . . . . . 190 ASN HD22 . 27498 1 72 . 1 1 8 8 ASN C C 13 175.284 0.004 . . . . . . . 190 ASN C . 27498 1 73 . 1 1 8 8 ASN CA C 13 53.26 0.062 . . . . . . . 190 ASN CA . 27498 1 74 . 1 1 8 8 ASN CB C 13 39.106 0.033 . . . . . . . 190 ASN CB . 27498 1 75 . 1 1 8 8 ASN N N 15 120.16 0.041 . . . . . . . 190 ASN N . 27498 1 76 . 1 1 8 8 ASN ND2 N 15 113.023 0.069 . . . . . . . 190 ASN ND2 . 27498 1 77 . 1 1 9 9 GLU H H 1 8.552 0.006 . . . . . . . 191 GLU H . 27498 1 78 . 1 1 9 9 GLU HA H 1 4.215 0.01 . . . . . . . 191 GLU HA . 27498 1 79 . 1 1 9 9 GLU HB2 H 1 2.073 0.01 . . . . . . . 191 GLU HB2 . 27498 1 80 . 1 1 9 9 GLU HB3 H 1 1.977 0.015 . . . . . . . 191 GLU HB3 . 27498 1 81 . 1 1 9 9 GLU HG2 H 1 2.268 0 . . . . . . . 191 GLU HG2 . 27498 1 82 . 1 1 9 9 GLU HG3 H 1 2.268 0 . . . . . . . 191 GLU HG3 . 27498 1 83 . 1 1 9 9 GLU C C 13 177.077 0.002 . . . . . . . 191 GLU C . 27498 1 84 . 1 1 9 9 GLU CA C 13 57.792 0.054 . . . . . . . 191 GLU CA . 27498 1 85 . 1 1 9 9 GLU CB C 13 30.05 0.053 . . . . . . . 191 GLU CB . 27498 1 86 . 1 1 9 9 GLU CG C 13 36.414 0 . . . . . . . 191 GLU CG . 27498 1 87 . 1 1 9 9 GLU N N 15 121.442 0.05 . . . . . . . 191 GLU N . 27498 1 88 . 1 1 10 10 GLU H H 1 8.432 0.002 . . . . . . . 192 GLU H . 27498 1 89 . 1 1 10 10 GLU HA H 1 4.17 0.01 . . . . . . . 192 GLU HA . 27498 1 90 . 1 1 10 10 GLU HB2 H 1 2.056 0.012 . . . . . . . 192 GLU HB2 . 27498 1 91 . 1 1 10 10 GLU HB3 H 1 1.99 0.013 . . . . . . . 192 GLU HB3 . 27498 1 92 . 1 1 10 10 GLU HG2 H 1 2.266 0.005 . . . . . . . 192 GLU HG2 . 27498 1 93 . 1 1 10 10 GLU HG3 H 1 2.266 0.005 . . . . . . . 192 GLU HG3 . 27498 1 94 . 1 1 10 10 GLU C C 13 177.197 0.009 . . . . . . . 192 GLU C . 27498 1 95 . 1 1 10 10 GLU CA C 13 57.777 0.054 . . . . . . . 192 GLU CA . 27498 1 96 . 1 1 10 10 GLU CB C 13 29.884 0.041 . . . . . . . 192 GLU CB . 27498 1 97 . 1 1 10 10 GLU CG C 13 36.457 0.047 . . . . . . . 192 GLU CG . 27498 1 98 . 1 1 10 10 GLU N N 15 120.413 0.043 . . . . . . . 192 GLU N . 27498 1 99 . 1 1 11 11 ASP H H 1 8.286 0.002 . . . . . . . 193 ASP H . 27498 1 100 . 1 1 11 11 ASP HA H 1 4.625 0.009 . . . . . . . 193 ASP HA . 27498 1 101 . 1 1 11 11 ASP HB2 H 1 2.722 0.01 . . . . . . . 193 ASP HB2 . 27498 1 102 . 1 1 11 11 ASP HB3 H 1 2.722 0.01 . . . . . . . 193 ASP HB3 . 27498 1 103 . 1 1 11 11 ASP C C 13 176.676 0.006 . . . . . . . 193 ASP C . 27498 1 104 . 1 1 11 11 ASP CA C 13 55.2 0.05 . . . . . . . 193 ASP CA . 27498 1 105 . 1 1 11 11 ASP CB C 13 41.236 0.027 . . . . . . . 193 ASP CB . 27498 1 106 . 1 1 11 11 ASP N N 15 120.932 0.062 . . . . . . . 193 ASP N . 27498 1 107 . 1 1 12 12 ASP H H 1 8.126 0.003 . . . . . . . 194 ASP H . 27498 1 108 . 1 1 12 12 ASP HA H 1 4.562 0.01 . . . . . . . 194 ASP HA . 27498 1 109 . 1 1 12 12 ASP HB2 H 1 2.712 0.011 . . . . . . . 194 ASP HB2 . 27498 1 110 . 1 1 12 12 ASP HB3 H 1 2.712 0.011 . . . . . . . 194 ASP HB3 . 27498 1 111 . 1 1 12 12 ASP C C 13 177.483 0.001 . . . . . . . 194 ASP C . 27498 1 112 . 1 1 12 12 ASP CA C 13 55.804 0.084 . . . . . . . 194 ASP CA . 27498 1 113 . 1 1 12 12 ASP CB C 13 41.255 0.007 . . . . . . . 194 ASP CB . 27498 1 114 . 1 1 12 12 ASP N N 15 120.863 0.043 . . . . . . . 194 ASP N . 27498 1 115 . 1 1 13 13 LEU H H 1 8.287 0.004 . . . . . . . 195 LEU H . 27498 1 116 . 1 1 13 13 LEU HA H 1 4.192 0.011 . . . . . . . 195 LEU HA . 27498 1 117 . 1 1 13 13 LEU HB2 H 1 1.803 0.008 . . . . . . . 195 LEU HB2 . 27498 1 118 . 1 1 13 13 LEU HB3 H 1 1.609 0.007 . . . . . . . 195 LEU HB3 . 27498 1 119 . 1 1 13 13 LEU HG H 1 1.73 0.008 . . . . . . . 195 LEU HG . 27498 1 120 . 1 1 13 13 LEU HD11 H 1 0.914 0.006 . . . . . . . 195 LEU HD1 . 27498 1 121 . 1 1 13 13 LEU HD12 H 1 0.914 0.006 . . . . . . . 195 LEU HD1 . 27498 1 122 . 1 1 13 13 LEU HD13 H 1 0.914 0.006 . . . . . . . 195 LEU HD1 . 27498 1 123 . 1 1 13 13 LEU HD21 H 1 0.855 0.005 . . . . . . . 195 LEU HD2 . 27498 1 124 . 1 1 13 13 LEU HD22 H 1 0.855 0.005 . . . . . . . 195 LEU HD2 . 27498 1 125 . 1 1 13 13 LEU HD23 H 1 0.855 0.005 . . . . . . . 195 LEU HD2 . 27498 1 126 . 1 1 13 13 LEU C C 13 179.542 0.011 . . . . . . . 195 LEU C . 27498 1 127 . 1 1 13 13 LEU CA C 13 57.291 0.101 . . . . . . . 195 LEU CA . 27498 1 128 . 1 1 13 13 LEU CB C 13 41.504 0.078 . . . . . . . 195 LEU CB . 27498 1 129 . 1 1 13 13 LEU CG C 13 27.196 0.105 . . . . . . . 195 LEU CG . 27498 1 130 . 1 1 13 13 LEU CD1 C 13 25.111 0.064 . . . . . . . 195 LEU CD1 . 27498 1 131 . 1 1 13 13 LEU CD2 C 13 23.302 0.086 . . . . . . . 195 LEU CD2 . 27498 1 132 . 1 1 13 13 LEU N N 15 121.588 0.072 . . . . . . . 195 LEU N . 27498 1 133 . 1 1 14 14 SER H H 1 8.289 0.009 . . . . . . . 196 SER H . 27498 1 134 . 1 1 14 14 SER HA H 1 4.3 0.006 . . . . . . . 196 SER HA . 27498 1 135 . 1 1 14 14 SER HB2 H 1 4.041 0.006 . . . . . . . 196 SER HB2 . 27498 1 136 . 1 1 14 14 SER HB3 H 1 4.017 0.005 . . . . . . . 196 SER HB3 . 27498 1 137 . 1 1 14 14 SER C C 13 177.19 0 . . . . . . . 196 SER C . 27498 1 138 . 1 1 14 14 SER CA C 13 61.126 0.036 . . . . . . . 196 SER CA . 27498 1 139 . 1 1 14 14 SER CB C 13 62.718 0.026 . . . . . . . 196 SER CB . 27498 1 140 . 1 1 14 14 SER N N 15 116.535 0.051 . . . . . . . 196 SER N . 27498 1 141 . 1 1 15 15 VAL H H 1 7.994 0.007 . . . . . . . 197 VAL H . 27498 1 142 . 1 1 15 15 VAL HA H 1 3.655 0.009 . . . . . . . 197 VAL HA . 27498 1 143 . 1 1 15 15 VAL HB H 1 2.285 0.01 . . . . . . . 197 VAL HB . 27498 1 144 . 1 1 15 15 VAL HG11 H 1 0.969 0.012 . . . . . . . 197 VAL HG1 . 27498 1 145 . 1 1 15 15 VAL HG12 H 1 0.969 0.012 . . . . . . . 197 VAL HG1 . 27498 1 146 . 1 1 15 15 VAL HG13 H 1 0.969 0.012 . . . . . . . 197 VAL HG1 . 27498 1 147 . 1 1 15 15 VAL HG21 H 1 1.094 0.009 . . . . . . . 197 VAL HG2 . 27498 1 148 . 1 1 15 15 VAL HG22 H 1 1.094 0.009 . . . . . . . 197 VAL HG2 . 27498 1 149 . 1 1 15 15 VAL HG23 H 1 1.094 0.009 . . . . . . . 197 VAL HG2 . 27498 1 150 . 1 1 15 15 VAL C C 13 177.456 0.013 . . . . . . . 197 VAL C . 27498 1 151 . 1 1 15 15 VAL CA C 13 66.288 0.041 . . . . . . . 197 VAL CA . 27498 1 152 . 1 1 15 15 VAL CB C 13 31.843 0.044 . . . . . . . 197 VAL CB . 27498 1 153 . 1 1 15 15 VAL CG1 C 13 21.739 0.082 . . . . . . . 197 VAL CG1 . 27498 1 154 . 1 1 15 15 VAL CG2 C 13 23.02 0.053 . . . . . . . 197 VAL CG2 . 27498 1 155 . 1 1 15 15 VAL N N 15 123.4 0.032 . . . . . . . 197 VAL N . 27498 1 156 . 1 1 16 16 GLU H H 1 8.242 0.007 . . . . . . . 198 GLU H . 27498 1 157 . 1 1 16 16 GLU HA H 1 3.578 0.01 . . . . . . . 198 GLU HA . 27498 1 158 . 1 1 16 16 GLU HB2 H 1 2.075 0.016 . . . . . . . 198 GLU HB2 . 27498 1 159 . 1 1 16 16 GLU HB3 H 1 2.005 0.02 . . . . . . . 198 GLU HB3 . 27498 1 160 . 1 1 16 16 GLU HG2 H 1 2.384 0.004 . . . . . . . 198 GLU HG2 . 27498 1 161 . 1 1 16 16 GLU HG3 H 1 2.035 0.011 . . . . . . . 198 GLU HG3 . 27498 1 162 . 1 1 16 16 GLU C C 13 178.011 0.003 . . . . . . . 198 GLU C . 27498 1 163 . 1 1 16 16 GLU CA C 13 60.895 0.068 . . . . . . . 198 GLU CA . 27498 1 164 . 1 1 16 16 GLU CB C 13 28.835 0.051 . . . . . . . 198 GLU CB . 27498 1 165 . 1 1 16 16 GLU CG C 13 38.079 0.062 . . . . . . . 198 GLU CG . 27498 1 166 . 1 1 16 16 GLU N N 15 118.948 0.054 . . . . . . . 198 GLU N . 27498 1 167 . 1 1 17 17 ALA H H 1 8.026 0.005 . . . . . . . 199 ALA H . 27498 1 168 . 1 1 17 17 ALA HA H 1 4.095 0.013 . . . . . . . 199 ALA HA . 27498 1 169 . 1 1 17 17 ALA HB1 H 1 1.473 0.006 . . . . . . . 199 ALA HB . 27498 1 170 . 1 1 17 17 ALA HB2 H 1 1.473 0.006 . . . . . . . 199 ALA HB . 27498 1 171 . 1 1 17 17 ALA HB3 H 1 1.473 0.006 . . . . . . . 199 ALA HB . 27498 1 172 . 1 1 17 17 ALA C C 13 180.137 0.004 . . . . . . . 199 ALA C . 27498 1 173 . 1 1 17 17 ALA CA C 13 54.88 0.028 . . . . . . . 199 ALA CA . 27498 1 174 . 1 1 17 17 ALA CB C 13 17.981 0.038 . . . . . . . 199 ALA CB . 27498 1 175 . 1 1 17 17 ALA N N 15 120.186 0.082 . . . . . . . 199 ALA N . 27498 1 176 . 1 1 18 18 GLU H H 1 7.713 0.002 . . . . . . . 200 GLU H . 27498 1 177 . 1 1 18 18 GLU HA H 1 4.247 0.013 . . . . . . . 200 GLU HA . 27498 1 178 . 1 1 18 18 GLU HB2 H 1 2.298 0.016 . . . . . . . 200 GLU HB2 . 27498 1 179 . 1 1 18 18 GLU HB3 H 1 2.047 0.01 . . . . . . . 200 GLU HB3 . 27498 1 180 . 1 1 18 18 GLU C C 13 178.326 0.004 . . . . . . . 200 GLU C . 27498 1 181 . 1 1 18 18 GLU CA C 13 58.795 0.062 . . . . . . . 200 GLU CA . 27498 1 182 . 1 1 18 18 GLU CB C 13 29.624 0.036 . . . . . . . 200 GLU CB . 27498 1 183 . 1 1 18 18 GLU CG C 13 35.097 0 . . . . . . . 200 GLU CG . 27498 1 184 . 1 1 18 18 GLU N N 15 120.356 0.042 . . . . . . . 200 GLU N . 27498 1 185 . 1 1 19 19 ILE H H 1 8.032 0.003 . . . . . . . 201 ILE H . 27498 1 186 . 1 1 19 19 ILE HA H 1 3.38 0.012 . . . . . . . 201 ILE HA . 27498 1 187 . 1 1 19 19 ILE HB H 1 1.807 0.014 . . . . . . . 201 ILE HB . 27498 1 188 . 1 1 19 19 ILE HG21 H 1 0.73 0.015 . . . . . . . 201 ILE HG2 . 27498 1 189 . 1 1 19 19 ILE HG22 H 1 0.73 0.015 . . . . . . . 201 ILE HG2 . 27498 1 190 . 1 1 19 19 ILE HG23 H 1 0.73 0.015 . . . . . . . 201 ILE HG2 . 27498 1 191 . 1 1 19 19 ILE HD11 H 1 0.578 0.013 . . . . . . . 201 ILE HD1 . 27498 1 192 . 1 1 19 19 ILE HD12 H 1 0.578 0.013 . . . . . . . 201 ILE HD1 . 27498 1 193 . 1 1 19 19 ILE HD13 H 1 0.578 0.013 . . . . . . . 201 ILE HD1 . 27498 1 194 . 1 1 19 19 ILE C C 13 177.41 0 . . . . . . . 201 ILE C . 27498 1 195 . 1 1 19 19 ILE CA C 13 66.086 0.047 . . . . . . . 201 ILE CA . 27498 1 196 . 1 1 19 19 ILE CB C 13 37.911 0.02 . . . . . . . 201 ILE CB . 27498 1 197 . 1 1 19 19 ILE CG2 C 13 18.773 0.037 . . . . . . . 201 ILE CG2 . 27498 1 198 . 1 1 19 19 ILE CD1 C 13 14.971 0.017 . . . . . . . 201 ILE CD1 . 27498 1 199 . 1 1 19 19 ILE N N 15 118.448 0.061 . . . . . . . 201 ILE N . 27498 1 200 . 1 1 20 20 ALA H H 1 8.541 0.004 . . . . . . . 202 ALA H . 27498 1 201 . 1 1 20 20 ALA HA H 1 3.598 0.012 . . . . . . . 202 ALA HA . 27498 1 202 . 1 1 20 20 ALA HB1 H 1 1.441 0.014 . . . . . . . 202 ALA HB . 27498 1 203 . 1 1 20 20 ALA HB2 H 1 1.441 0.014 . . . . . . . 202 ALA HB . 27498 1 204 . 1 1 20 20 ALA HB3 H 1 1.441 0.014 . . . . . . . 202 ALA HB . 27498 1 205 . 1 1 20 20 ALA C C 13 179.178 0.019 . . . . . . . 202 ALA C . 27498 1 206 . 1 1 20 20 ALA CA C 13 55.66 0.068 . . . . . . . 202 ALA CA . 27498 1 207 . 1 1 20 20 ALA CB C 13 18.32 0.063 . . . . . . . 202 ALA CB . 27498 1 208 . 1 1 20 20 ALA N N 15 119.522 0.13 . . . . . . . 202 ALA N . 27498 1 209 . 1 1 21 21 HIS H H 1 8.215 0.003 . . . . . . . 203 HIS H . 27498 1 210 . 1 1 21 21 HIS HA H 1 4.308 0.013 . . . . . . . 203 HIS HA . 27498 1 211 . 1 1 21 21 HIS HB2 H 1 3.341 0.008 . . . . . . . 203 HIS HB2 . 27498 1 212 . 1 1 21 21 HIS HB3 H 1 3.341 0.008 . . . . . . . 203 HIS HB3 . 27498 1 213 . 1 1 21 21 HIS HD2 H 1 7.159 0.012 . . . . . . . 203 HIS HD2 . 27498 1 214 . 1 1 21 21 HIS HE1 H 1 8.185 0.016 . . . . . . . 203 HIS HE1 . 27498 1 215 . 1 1 21 21 HIS C C 13 177.407 0.005 . . . . . . . 203 HIS C . 27498 1 216 . 1 1 21 21 HIS CA C 13 59.13 0.14 . . . . . . . 203 HIS CA . 27498 1 217 . 1 1 21 21 HIS CB C 13 29.194 0.067 . . . . . . . 203 HIS CB . 27498 1 218 . 1 1 21 21 HIS CD2 C 13 119.987 0.053 . . . . . . . 203 HIS CD2 . 27498 1 219 . 1 1 21 21 HIS CE1 C 13 137.215 0 . . . . . . . 203 HIS CE1 . 27498 1 220 . 1 1 21 21 HIS N N 15 116.09 0.046 . . . . . . . 203 HIS N . 27498 1 221 . 1 1 22 22 GLN H H 1 8.002 0.005 . . . . . . . 204 GLN H . 27498 1 222 . 1 1 22 22 GLN HA H 1 3.957 0.007 . . . . . . . 204 GLN HA . 27498 1 223 . 1 1 22 22 GLN HB2 H 1 1.86 0.017 . . . . . . . 204 GLN HB2 . 27498 1 224 . 1 1 22 22 GLN HB3 H 1 1.86 0.017 . . . . . . . 204 GLN HB3 . 27498 1 225 . 1 1 22 22 GLN HG2 H 1 2.985 0.009 . . . . . . . 204 GLN HG2 . 27498 1 226 . 1 1 22 22 GLN HG3 H 1 2.28 0.007 . . . . . . . 204 GLN HG3 . 27498 1 227 . 1 1 22 22 GLN HE21 H 1 9.423 0.004 . . . . . . . 204 GLN HE21 . 27498 1 228 . 1 1 22 22 GLN HE22 H 1 7.428 0.002 . . . . . . . 204 GLN HE22 . 27498 1 229 . 1 1 22 22 GLN C C 13 179.646 0.008 . . . . . . . 204 GLN C . 27498 1 230 . 1 1 22 22 GLN CA C 13 60.759 0.083 . . . . . . . 204 GLN CA . 27498 1 231 . 1 1 22 22 GLN CB C 13 28.973 0 . . . . . . . 204 GLN CB . 27498 1 232 . 1 1 22 22 GLN CG C 13 35.292 0.073 . . . . . . . 204 GLN CG . 27498 1 233 . 1 1 22 22 GLN N N 15 116.767 0.053 . . . . . . . 204 GLN N . 27498 1 234 . 1 1 22 22 GLN NE2 N 15 115.861 0.082 . . . . . . . 204 GLN NE2 . 27498 1 235 . 1 1 23 23 ILE H H 1 8.321 0.003 . . . . . . . 205 ILE H . 27498 1 236 . 1 1 23 23 ILE HA H 1 3.261 0.011 . . . . . . . 205 ILE HA . 27498 1 237 . 1 1 23 23 ILE HB H 1 1.467 0.016 . . . . . . . 205 ILE HB . 27498 1 238 . 1 1 23 23 ILE HG12 H 1 1.652 0.008 . . . . . . . 205 ILE HG12 . 27498 1 239 . 1 1 23 23 ILE HG13 H 1 0.287 0.019 . . . . . . . 205 ILE HG13 . 27498 1 240 . 1 1 23 23 ILE HG21 H 1 -0.063 0.007 . . . . . . . 205 ILE HG2 . 27498 1 241 . 1 1 23 23 ILE HG22 H 1 -0.063 0.007 . . . . . . . 205 ILE HG2 . 27498 1 242 . 1 1 23 23 ILE HG23 H 1 -0.063 0.007 . . . . . . . 205 ILE HG2 . 27498 1 243 . 1 1 23 23 ILE HD11 H 1 0.353 0.006 . . . . . . . 205 ILE HD1 . 27498 1 244 . 1 1 23 23 ILE HD12 H 1 0.353 0.006 . . . . . . . 205 ILE HD1 . 27498 1 245 . 1 1 23 23 ILE HD13 H 1 0.353 0.006 . . . . . . . 205 ILE HD1 . 27498 1 246 . 1 1 23 23 ILE C C 13 177.251 0.008 . . . . . . . 205 ILE C . 27498 1 247 . 1 1 23 23 ILE CA C 13 66.202 0.05 . . . . . . . 205 ILE CA . 27498 1 248 . 1 1 23 23 ILE CB C 13 37.42 0.049 . . . . . . . 205 ILE CB . 27498 1 249 . 1 1 23 23 ILE CG1 C 13 29.087 0.052 . . . . . . . 205 ILE CG1 . 27498 1 250 . 1 1 23 23 ILE CG2 C 13 15.661 0.095 . . . . . . . 205 ILE CG2 . 27498 1 251 . 1 1 23 23 ILE CD1 C 13 14.476 0.023 . . . . . . . 205 ILE CD1 . 27498 1 252 . 1 1 23 23 ILE N N 15 119.767 0.082 . . . . . . . 205 ILE N . 27498 1 253 . 1 1 24 24 ALA H H 1 8.639 0.008 . . . . . . . 206 ALA H . 27498 1 254 . 1 1 24 24 ALA HA H 1 3.862 0.009 . . . . . . . 206 ALA HA . 27498 1 255 . 1 1 24 24 ALA HB1 H 1 1.396 0.014 . . . . . . . 206 ALA HB . 27498 1 256 . 1 1 24 24 ALA HB2 H 1 1.396 0.014 . . . . . . . 206 ALA HB . 27498 1 257 . 1 1 24 24 ALA HB3 H 1 1.396 0.014 . . . . . . . 206 ALA HB . 27498 1 258 . 1 1 24 24 ALA C C 13 173.771 0 . . . . . . . 206 ALA C . 27498 1 259 . 1 1 24 24 ALA CA C 13 55.916 0.068 . . . . . . . 206 ALA CA . 27498 1 260 . 1 1 24 24 ALA CB C 13 18.04 0.088 . . . . . . . 206 ALA CB . 27498 1 261 . 1 1 24 24 ALA N N 15 120.849 0.072 . . . . . . . 206 ALA N . 27498 1 262 . 1 1 25 25 GLU H H 1 7.892 0.003 . . . . . . . 207 GLU H . 27498 1 263 . 1 1 25 25 GLU HA H 1 4.123 0.01 . . . . . . . 207 GLU HA . 27498 1 264 . 1 1 25 25 GLU HB2 H 1 2.081 0.016 . . . . . . . 207 GLU HB2 . 27498 1 265 . 1 1 25 25 GLU HB3 H 1 2.036 0.014 . . . . . . . 207 GLU HB3 . 27498 1 266 . 1 1 25 25 GLU HG2 H 1 2.24 0.006 . . . . . . . 207 GLU HG2 . 27498 1 267 . 1 1 25 25 GLU HG3 H 1 2.24 0.006 . . . . . . . 207 GLU HG3 . 27498 1 268 . 1 1 25 25 GLU C C 13 177.524 0.009 . . . . . . . 207 GLU C . 27498 1 269 . 1 1 25 25 GLU CA C 13 58.803 0.062 . . . . . . . 207 GLU CA . 27498 1 270 . 1 1 25 25 GLU CB C 13 29.969 0.036 . . . . . . . 207 GLU CB . 27498 1 271 . 1 1 25 25 GLU CG C 13 36.611 0.012 . . . . . . . 207 GLU CG . 27498 1 272 . 1 1 25 25 GLU N N 15 116.512 0.028 . . . . . . . 207 GLU N . 27498 1 273 . 1 1 26 26 SER H H 1 7.33 0.003 . . . . . . . 208 SER H . 27498 1 274 . 1 1 26 26 SER HA H 1 5.017 0.008 . . . . . . . 208 SER HA . 27498 1 275 . 1 1 26 26 SER HB2 H 1 4.621 0.01 . . . . . . . 208 SER HB2 . 27498 1 276 . 1 1 26 26 SER HB3 H 1 3.947 0.008 . . . . . . . 208 SER HB3 . 27498 1 277 . 1 1 26 26 SER C C 13 176.375 0.005 . . . . . . . 208 SER C . 27498 1 278 . 1 1 26 26 SER CA C 13 57.338 0.104 . . . . . . . 208 SER CA . 27498 1 279 . 1 1 26 26 SER CB C 13 64.42 0.058 . . . . . . . 208 SER CB . 27498 1 280 . 1 1 26 26 SER N N 15 113.715 0.038 . . . . . . . 208 SER N . 27498 1 281 . 1 1 27 27 PHE H H 1 7.37 0.002 . . . . . . . 209 PHE H . 27498 1 282 . 1 1 27 27 PHE HA H 1 4.349 0.009 . . . . . . . 209 PHE HA . 27498 1 283 . 1 1 27 27 PHE HB2 H 1 3.751 0.013 . . . . . . . 209 PHE HB2 . 27498 1 284 . 1 1 27 27 PHE HB3 H 1 3.079 0.009 . . . . . . . 209 PHE HB3 . 27498 1 285 . 1 1 27 27 PHE HD1 H 1 7.21 0.007 . . . . . . . 209 PHE HD1 . 27498 1 286 . 1 1 27 27 PHE HD2 H 1 7.21 0.007 . . . . . . . 209 PHE HD2 . 27498 1 287 . 1 1 27 27 PHE HE1 H 1 7.318 0.005 . . . . . . . 209 PHE HE1 . 27498 1 288 . 1 1 27 27 PHE HE2 H 1 7.318 0.005 . . . . . . . 209 PHE HE2 . 27498 1 289 . 1 1 27 27 PHE HZ H 1 7.104 0.004 . . . . . . . 209 PHE HZ . 27498 1 290 . 1 1 27 27 PHE C C 13 175.263 0.012 . . . . . . . 209 PHE C . 27498 1 291 . 1 1 27 27 PHE CA C 13 63.011 0.069 . . . . . . . 209 PHE CA . 27498 1 292 . 1 1 27 27 PHE CB C 13 40.862 0.042 . . . . . . . 209 PHE CB . 27498 1 293 . 1 1 27 27 PHE CD1 C 13 132.045 0.133 . . . . . . . 209 PHE CD1 . 27498 1 294 . 1 1 27 27 PHE CE1 C 13 129.333 0 . . . . . . . 209 PHE CE1 . 27498 1 295 . 1 1 27 27 PHE N N 15 125.661 0.059 . . . . . . . 209 PHE N . 27498 1 296 . 1 1 28 28 SER H H 1 8.531 0.003 . . . . . . . 210 SER H . 27498 1 297 . 1 1 28 28 SER HA H 1 4.709 0.003 . . . . . . . 210 SER HA . 27498 1 298 . 1 1 28 28 SER HB2 H 1 3.924 0.008 . . . . . . . 210 SER HB2 . 27498 1 299 . 1 1 28 28 SER HB3 H 1 3.963 0.009 . . . . . . . 210 SER HB3 . 27498 1 300 . 1 1 28 28 SER C C 13 175.537 0.003 . . . . . . . 210 SER C . 27498 1 301 . 1 1 28 28 SER CA C 13 57.173 0.071 . . . . . . . 210 SER CA . 27498 1 302 . 1 1 28 28 SER CB C 13 64.132 0.062 . . . . . . . 210 SER CB . 27498 1 303 . 1 1 28 28 SER N N 15 106.035 0.05 . . . . . . . 210 SER N . 27498 1 304 . 1 1 29 29 LYS H H 1 7.37 0.003 . . . . . . . 211 LYS H . 27498 1 305 . 1 1 29 29 LYS HA H 1 3.93 0.007 . . . . . . . 211 LYS HA . 27498 1 306 . 1 1 29 29 LYS HB2 H 1 1.781 0.008 . . . . . . . 211 LYS HB2 . 27498 1 307 . 1 1 29 29 LYS HB3 H 1 1.781 0.008 . . . . . . . 211 LYS HB3 . 27498 1 308 . 1 1 29 29 LYS HG2 H 1 1.122 0.009 . . . . . . . 211 LYS HG2 . 27498 1 309 . 1 1 29 29 LYS HG3 H 1 0.679 0.007 . . . . . . . 211 LYS HG3 . 27498 1 310 . 1 1 29 29 LYS C C 13 174.795 0.003 . . . . . . . 211 LYS C . 27498 1 311 . 1 1 29 29 LYS CA C 13 57.101 0.112 . . . . . . . 211 LYS CA . 27498 1 312 . 1 1 29 29 LYS CB C 13 32.569 0.14 . . . . . . . 211 LYS CB . 27498 1 313 . 1 1 29 29 LYS CG C 13 24.591 0.02 . . . . . . . 211 LYS CG . 27498 1 314 . 1 1 29 29 LYS N N 15 127.193 0.054 . . . . . . . 211 LYS N . 27498 1 315 . 1 1 30 30 LYS H H 1 8.503 0.002 . . . . . . . 212 LYS H . 27498 1 316 . 1 1 30 30 LYS HA H 1 4.255 0.007 . . . . . . . 212 LYS HA . 27498 1 317 . 1 1 30 30 LYS HB2 H 1 1.815 0.007 . . . . . . . 212 LYS HB2 . 27498 1 318 . 1 1 30 30 LYS HB3 H 1 1.581 0.014 . . . . . . . 212 LYS HB3 . 27498 1 319 . 1 1 30 30 LYS C C 13 175.625 0.011 . . . . . . . 212 LYS C . 27498 1 320 . 1 1 30 30 LYS CA C 13 56.379 0.069 . . . . . . . 212 LYS CA . 27498 1 321 . 1 1 30 30 LYS CB C 13 32.727 0.023 . . . . . . . 212 LYS CB . 27498 1 322 . 1 1 30 30 LYS CG C 13 26.295 0 . . . . . . . 212 LYS CG . 27498 1 323 . 1 1 30 30 LYS CD C 13 29.063 0 . . . . . . . 212 LYS CD . 27498 1 324 . 1 1 30 30 LYS N N 15 124.776 0.052 . . . . . . . 212 LYS N . 27498 1 325 . 1 1 31 31 TYR H H 1 8.792 0.003 . . . . . . . 213 TYR H . 27498 1 326 . 1 1 31 31 TYR HA H 1 4.531 0.008 . . . . . . . 213 TYR HA . 27498 1 327 . 1 1 31 31 TYR HB2 H 1 2.662 0.016 . . . . . . . 213 TYR HB2 . 27498 1 328 . 1 1 31 31 TYR HB3 H 1 2.559 0.016 . . . . . . . 213 TYR HB3 . 27498 1 329 . 1 1 31 31 TYR HD1 H 1 7.186 0.015 . . . . . . . 213 TYR HD1 . 27498 1 330 . 1 1 31 31 TYR HD2 H 1 7.186 0.015 . . . . . . . 213 TYR HD2 . 27498 1 331 . 1 1 31 31 TYR HE1 H 1 6.919 0.007 . . . . . . . 213 TYR HE1 . 27498 1 332 . 1 1 31 31 TYR HE2 H 1 6.919 0.007 . . . . . . . 213 TYR HE2 . 27498 1 333 . 1 1 31 31 TYR C C 13 181.549 0.013 . . . . . . . 213 TYR C . 27498 1 334 . 1 1 31 31 TYR CA C 13 57.484 0.087 . . . . . . . 213 TYR CA . 27498 1 335 . 1 1 31 31 TYR CB C 13 41.404 0.148 . . . . . . . 213 TYR CB . 27498 1 336 . 1 1 31 31 TYR CD1 C 13 133.764 0.061 . . . . . . . 213 TYR CD1 . 27498 1 337 . 1 1 31 31 TYR CE1 C 13 117.524 0.146 . . . . . . . 213 TYR CE1 . 27498 1 338 . 1 1 31 31 TYR N N 15 124.759 0.074 . . . . . . . 213 TYR N . 27498 1 339 . 1 1 32 32 LYS H H 1 8.189 0.003 . . . . . . . 214 LYS H . 27498 1 340 . 1 1 32 32 LYS HA H 1 4.432 0.009 . . . . . . . 214 LYS HA . 27498 1 341 . 1 1 32 32 LYS HB2 H 1 1.556 0.015 . . . . . . . 214 LYS HB2 . 27498 1 342 . 1 1 32 32 LYS HB3 H 1 1.381 0.009 . . . . . . . 214 LYS HB3 . 27498 1 343 . 1 1 32 32 LYS C C 13 175.192 0.005 . . . . . . . 214 LYS C . 27498 1 344 . 1 1 32 32 LYS CA C 13 56.119 0.137 . . . . . . . 214 LYS CA . 27498 1 345 . 1 1 32 32 LYS CB C 13 34.459 0.031 . . . . . . . 214 LYS CB . 27498 1 346 . 1 1 32 32 LYS CG C 13 25.456 0 . . . . . . . 214 LYS CG . 27498 1 347 . 1 1 32 32 LYS CD C 13 29.832 0 . . . . . . . 214 LYS CD . 27498 1 348 . 1 1 32 32 LYS N N 15 118.238 0.054 . . . . . . . 214 LYS N . 27498 1 349 . 1 1 33 33 PHE H H 1 8.622 0.006 . . . . . . . 215 PHE H . 27498 1 350 . 1 1 33 33 PHE HA H 1 4.603 0.008 . . . . . . . 215 PHE HA . 27498 1 351 . 1 1 33 33 PHE HB2 H 1 1.094 0.013 . . . . . . . 215 PHE HB2 . 27498 1 352 . 1 1 33 33 PHE HB3 H 1 2.323 0.011 . . . . . . . 215 PHE HB3 . 27498 1 353 . 1 1 33 33 PHE HD1 H 1 6.927 0.016 . . . . . . . 215 PHE HD1 . 27498 1 354 . 1 1 33 33 PHE HD2 H 1 6.927 0.016 . . . . . . . 215 PHE HD2 . 27498 1 355 . 1 1 33 33 PHE HE1 H 1 7.212 0 . . . . . . . 215 PHE HE1 . 27498 1 356 . 1 1 33 33 PHE HE2 H 1 7.212 0 . . . . . . . 215 PHE HE2 . 27498 1 357 . 1 1 33 33 PHE HZ H 1 7.178 0 . . . . . . . 215 PHE HZ . 27498 1 358 . 1 1 33 33 PHE C C 13 180.266 0 . . . . . . . 215 PHE C . 27498 1 359 . 1 1 33 33 PHE CA C 13 55.444 0.042 . . . . . . . 215 PHE CA . 27498 1 360 . 1 1 33 33 PHE CB C 13 42.207 0.07 . . . . . . . 215 PHE CB . 27498 1 361 . 1 1 33 33 PHE CD1 C 13 132.189 0.065 . . . . . . . 215 PHE CD1 . 27498 1 362 . 1 1 33 33 PHE CE1 C 13 130.886 0 . . . . . . . 215 PHE CE1 . 27498 1 363 . 1 1 33 33 PHE CZ C 13 131.102 0 . . . . . . . 215 PHE CZ . 27498 1 364 . 1 1 33 33 PHE N N 15 118.702 0.043 . . . . . . . 215 PHE N . 27498 1 365 . 1 1 34 34 PRO HA H 1 4.783 0.01 . . . . . . . 216 PRO HA . 27498 1 366 . 1 1 34 34 PRO HB2 H 1 2.287 0.005 . . . . . . . 216 PRO HB2 . 27498 1 367 . 1 1 34 34 PRO HB3 H 1 2.098 0.009 . . . . . . . 216 PRO HB3 . 27498 1 368 . 1 1 34 34 PRO HD2 H 1 3.672 0.009 . . . . . . . 216 PRO HD2 . 27498 1 369 . 1 1 34 34 PRO HD3 H 1 3.672 0.009 . . . . . . . 216 PRO HD3 . 27498 1 370 . 1 1 34 34 PRO C C 13 176.604 0 . . . . . . . 216 PRO C . 27498 1 371 . 1 1 34 34 PRO CA C 13 62.346 0.089 . . . . . . . 216 PRO CA . 27498 1 372 . 1 1 34 34 PRO CB C 13 31.881 0.043 . . . . . . . 216 PRO CB . 27498 1 373 . 1 1 34 34 PRO CD C 13 49.61 0.066 . . . . . . . 216 PRO CD . 27498 1 374 . 1 1 35 35 SER H H 1 8.557 0.006 . . . . . . . 217 SER H . 27498 1 375 . 1 1 35 35 SER HA H 1 5.06 0.012 . . . . . . . 217 SER HA . 27498 1 376 . 1 1 35 35 SER HB2 H 1 4.007 0.007 . . . . . . . 217 SER HB2 . 27498 1 377 . 1 1 35 35 SER HB3 H 1 3.638 0.009 . . . . . . . 217 SER HB3 . 27498 1 378 . 1 1 35 35 SER C C 13 176.314 0.01 . . . . . . . 217 SER C . 27498 1 379 . 1 1 35 35 SER CA C 13 56.43 0.069 . . . . . . . 217 SER CA . 27498 1 380 . 1 1 35 35 SER CB C 13 64.891 0.08 . . . . . . . 217 SER CB . 27498 1 381 . 1 1 35 35 SER N N 15 119.522 0.056 . . . . . . . 217 SER N . 27498 1 382 . 1 1 36 36 ARG H H 1 8.436 0.003 . . . . . . . 218 ARG H . 27498 1 383 . 1 1 36 36 ARG C C 13 176.318 0 . . . . . . . 218 ARG C . 27498 1 384 . 1 1 36 36 ARG CA C 13 58.901 0 . . . . . . . 218 ARG CA . 27498 1 385 . 1 1 36 36 ARG CB C 13 29.947 0 . . . . . . . 218 ARG CB . 27498 1 386 . 1 1 36 36 ARG N N 15 123.469 0.055 . . . . . . . 218 ARG N . 27498 1 387 . 1 1 37 37 SER HA H 1 4.584 0.007 . . . . . . . 219 SER HA . 27498 1 388 . 1 1 37 37 SER HB2 H 1 3.952 0.007 . . . . . . . 219 SER HB2 . 27498 1 389 . 1 1 37 37 SER HB3 H 1 3.865 0.005 . . . . . . . 219 SER HB3 . 27498 1 390 . 1 1 37 37 SER C C 13 174.267 0 . . . . . . . 219 SER C . 27498 1 391 . 1 1 37 37 SER CA C 13 58.035 0.089 . . . . . . . 219 SER CA . 27498 1 392 . 1 1 37 37 SER CB C 13 62.849 0.07 . . . . . . . 219 SER CB . 27498 1 393 . 1 1 38 38 SER H H 1 7.772 0.003 . . . . . . . 220 SER H . 27498 1 394 . 1 1 38 38 SER HA H 1 4.38 0.009 . . . . . . . 220 SER HA . 27498 1 395 . 1 1 38 38 SER HB2 H 1 4.06 0.003 . . . . . . . 220 SER HB2 . 27498 1 396 . 1 1 38 38 SER HB3 H 1 4.06 0.003 . . . . . . . 220 SER HB3 . 27498 1 397 . 1 1 38 38 SER C C 13 173.949 0 . . . . . . . 220 SER C . 27498 1 398 . 1 1 38 38 SER CA C 13 59.646 0.053 . . . . . . . 220 SER CA . 27498 1 399 . 1 1 38 38 SER CB C 13 62.735 0.061 . . . . . . . 220 SER CB . 27498 1 400 . 1 1 38 38 SER N N 15 113.401 0.072 . . . . . . . 220 SER N . 27498 1 401 . 1 1 39 39 GLY H H 1 8.102 0.005 . . . . . . . 221 GLY H . 27498 1 402 . 1 1 39 39 GLY HA2 H 1 4.186 0.012 . . . . . . . 221 GLY HA2 . 27498 1 403 . 1 1 39 39 GLY HA3 H 1 4.075 0.01 . . . . . . . 221 GLY HA3 . 27498 1 404 . 1 1 39 39 GLY C C 13 174.581 0.004 . . . . . . . 221 GLY C . 27498 1 405 . 1 1 39 39 GLY CA C 13 44.848 0.106 . . . . . . . 221 GLY CA . 27498 1 406 . 1 1 39 39 GLY N N 15 109.501 0.042 . . . . . . . 221 GLY N . 27498 1 407 . 1 1 40 40 ILE H H 1 8.577 0.004 . . . . . . . 222 ILE H . 27498 1 408 . 1 1 40 40 ILE HA H 1 5.391 0.01 . . . . . . . 222 ILE HA . 27498 1 409 . 1 1 40 40 ILE HB H 1 1.817 0.009 . . . . . . . 222 ILE HB . 27498 1 410 . 1 1 40 40 ILE HG12 H 1 1.41 0.015 . . . . . . . 222 ILE HG12 . 27498 1 411 . 1 1 40 40 ILE HG13 H 1 1.126 0.013 . . . . . . . 222 ILE HG13 . 27498 1 412 . 1 1 40 40 ILE HG21 H 1 0.797 0.009 . . . . . . . 222 ILE HG2 . 27498 1 413 . 1 1 40 40 ILE HG22 H 1 0.797 0.009 . . . . . . . 222 ILE HG2 . 27498 1 414 . 1 1 40 40 ILE HG23 H 1 0.797 0.009 . . . . . . . 222 ILE HG2 . 27498 1 415 . 1 1 40 40 ILE HD11 H 1 0.751 0.009 . . . . . . . 222 ILE HD1 . 27498 1 416 . 1 1 40 40 ILE HD12 H 1 0.751 0.009 . . . . . . . 222 ILE HD1 . 27498 1 417 . 1 1 40 40 ILE HD13 H 1 0.751 0.009 . . . . . . . 222 ILE HD1 . 27498 1 418 . 1 1 40 40 ILE C C 13 176.137 0.002 . . . . . . . 222 ILE C . 27498 1 419 . 1 1 40 40 ILE CA C 13 58.811 0.067 . . . . . . . 222 ILE CA . 27498 1 420 . 1 1 40 40 ILE CB C 13 42.898 0.048 . . . . . . . 222 ILE CB . 27498 1 421 . 1 1 40 40 ILE CG1 C 13 26.558 0.099 . . . . . . . 222 ILE CG1 . 27498 1 422 . 1 1 40 40 ILE CG2 C 13 19.3 0.055 . . . . . . . 222 ILE CG2 . 27498 1 423 . 1 1 40 40 ILE CD1 C 13 13.647 0.034 . . . . . . . 222 ILE CD1 . 27498 1 424 . 1 1 40 40 ILE N N 15 120.191 0.059 . . . . . . . 222 ILE N . 27498 1 425 . 1 1 41 41 PHE H H 1 9.263 0.005 . . . . . . . 223 PHE H . 27498 1 426 . 1 1 41 41 PHE HA H 1 5.082 0.012 . . . . . . . 223 PHE HA . 27498 1 427 . 1 1 41 41 PHE HB2 H 1 3.246 0.004 . . . . . . . 223 PHE HB2 . 27498 1 428 . 1 1 41 41 PHE HB3 H 1 3.017 0.012 . . . . . . . 223 PHE HB3 . 27498 1 429 . 1 1 41 41 PHE HD1 H 1 7.019 0.01 . . . . . . . 223 PHE HD1 . 27498 1 430 . 1 1 41 41 PHE HD2 H 1 7.019 0.01 . . . . . . . 223 PHE HD2 . 27498 1 431 . 1 1 41 41 PHE HE1 H 1 6.658 0.01 . . . . . . . 223 PHE HE1 . 27498 1 432 . 1 1 41 41 PHE HE2 H 1 6.658 0.01 . . . . . . . 223 PHE HE2 . 27498 1 433 . 1 1 41 41 PHE HZ H 1 5.574 0.013 . . . . . . . 223 PHE HZ . 27498 1 434 . 1 1 41 41 PHE C C 13 179.798 0.007 . . . . . . . 223 PHE C . 27498 1 435 . 1 1 41 41 PHE CA C 13 55.779 0.081 . . . . . . . 223 PHE CA . 27498 1 436 . 1 1 41 41 PHE CB C 13 41.774 0.099 . . . . . . . 223 PHE CB . 27498 1 437 . 1 1 41 41 PHE CD1 C 13 132.545 0.115 . . . . . . . 223 PHE CD1 . 27498 1 438 . 1 1 41 41 PHE CE1 C 13 130.35 0.079 . . . . . . . 223 PHE CE1 . 27498 1 439 . 1 1 41 41 PHE CZ C 13 129.358 0.071 . . . . . . . 223 PHE CZ . 27498 1 440 . 1 1 41 41 PHE N N 15 121.734 0.046 . . . . . . . 223 PHE N . 27498 1 441 . 1 1 42 42 LEU H H 1 8.572 0.006 . . . . . . . 224 LEU H . 27498 1 442 . 1 1 42 42 LEU HA H 1 5.646 0.012 . . . . . . . 224 LEU HA . 27498 1 443 . 1 1 42 42 LEU HB2 H 1 1.888 0.013 . . . . . . . 224 LEU HB2 . 27498 1 444 . 1 1 42 42 LEU HB3 H 1 1.276 0.016 . . . . . . . 224 LEU HB3 . 27498 1 445 . 1 1 42 42 LEU HG H 1 1.683 0.012 . . . . . . . 224 LEU HG . 27498 1 446 . 1 1 42 42 LEU HD11 H 1 0.893 0.008 . . . . . . . 224 LEU HD1 . 27498 1 447 . 1 1 42 42 LEU HD12 H 1 0.893 0.008 . . . . . . . 224 LEU HD1 . 27498 1 448 . 1 1 42 42 LEU HD13 H 1 0.893 0.008 . . . . . . . 224 LEU HD1 . 27498 1 449 . 1 1 42 42 LEU HD21 H 1 0.679 0.01 . . . . . . . 224 LEU HD2 . 27498 1 450 . 1 1 42 42 LEU HD22 H 1 0.679 0.01 . . . . . . . 224 LEU HD2 . 27498 1 451 . 1 1 42 42 LEU HD23 H 1 0.679 0.01 . . . . . . . 224 LEU HD2 . 27498 1 452 . 1 1 42 42 LEU C C 13 177.192 0.001 . . . . . . . 224 LEU C . 27498 1 453 . 1 1 42 42 LEU CA C 13 52.91 0.086 . . . . . . . 224 LEU CA . 27498 1 454 . 1 1 42 42 LEU CB C 13 44.359 0.086 . . . . . . . 224 LEU CB . 27498 1 455 . 1 1 42 42 LEU CG C 13 27.33 0.06 . . . . . . . 224 LEU CG . 27498 1 456 . 1 1 42 42 LEU CD1 C 13 25.501 0.064 . . . . . . . 224 LEU CD1 . 27498 1 457 . 1 1 42 42 LEU CD2 C 13 24.12 0.084 . . . . . . . 224 LEU CD2 . 27498 1 458 . 1 1 42 42 LEU N N 15 120.219 0.062 . . . . . . . 224 LEU N . 27498 1 459 . 1 1 43 43 TYR H H 1 9.243 0.006 . . . . . . . 225 TYR H . 27498 1 460 . 1 1 43 43 TYR HA H 1 4.917 0.014 . . . . . . . 225 TYR HA . 27498 1 461 . 1 1 43 43 TYR HB2 H 1 3.042 0.014 . . . . . . . 225 TYR HB2 . 27498 1 462 . 1 1 43 43 TYR HB3 H 1 2.939 0.017 . . . . . . . 225 TYR HB3 . 27498 1 463 . 1 1 43 43 TYR HD1 H 1 7.113 0.007 . . . . . . . 225 TYR HD1 . 27498 1 464 . 1 1 43 43 TYR HD2 H 1 7.113 0.007 . . . . . . . 225 TYR HD2 . 27498 1 465 . 1 1 43 43 TYR HE1 H 1 6.537 0.007 . . . . . . . 225 TYR HE1 . 27498 1 466 . 1 1 43 43 TYR HE2 H 1 6.537 0.007 . . . . . . . 225 TYR HE2 . 27498 1 467 . 1 1 43 43 TYR C C 13 180.754 0.015 . . . . . . . 225 TYR C . 27498 1 468 . 1 1 43 43 TYR CA C 13 58.694 0.094 . . . . . . . 225 TYR CA . 27498 1 469 . 1 1 43 43 TYR CB C 13 45.681 0.059 . . . . . . . 225 TYR CB . 27498 1 470 . 1 1 43 43 TYR CD1 C 13 133.822 0.022 . . . . . . . 225 TYR CD1 . 27498 1 471 . 1 1 43 43 TYR CE1 C 13 118.321 0.109 . . . . . . . 225 TYR CE1 . 27498 1 472 . 1 1 43 43 TYR N N 15 124.342 0.062 . . . . . . . 225 TYR N . 27498 1 473 . 1 1 44 44 ASN H H 1 6.933 0.007 . . . . . . . 226 ASN H . 27498 1 474 . 1 1 44 44 ASN HA H 1 5.058 0.011 . . . . . . . 226 ASN HA . 27498 1 475 . 1 1 44 44 ASN HB2 H 1 3.201 0.01 . . . . . . . 226 ASN HB2 . 27498 1 476 . 1 1 44 44 ASN HB3 H 1 2.632 0.008 . . . . . . . 226 ASN HB3 . 27498 1 477 . 1 1 44 44 ASN HD21 H 1 7.162 0.006 . . . . . . . 226 ASN HD21 . 27498 1 478 . 1 1 44 44 ASN HD22 H 1 6.777 0.001 . . . . . . . 226 ASN HD22 . 27498 1 479 . 1 1 44 44 ASN C C 13 173.844 0 . . . . . . . 226 ASN C . 27498 1 480 . 1 1 44 44 ASN CA C 13 51.115 0.08 . . . . . . . 226 ASN CA . 27498 1 481 . 1 1 44 44 ASN CB C 13 41.816 0.084 . . . . . . . 226 ASN CB . 27498 1 482 . 1 1 44 44 ASN N N 15 118.446 0.047 . . . . . . . 226 ASN N . 27498 1 483 . 1 1 44 44 ASN ND2 N 15 108.081 0.05 . . . . . . . 226 ASN ND2 . 27498 1 484 . 1 1 45 45 PHE H H 1 9.249 0.002 . . . . . . . 227 PHE H . 27498 1 485 . 1 1 45 45 PHE HA H 1 3.932 0.01 . . . . . . . 227 PHE HA . 27498 1 486 . 1 1 45 45 PHE HB2 H 1 2.919 0.014 . . . . . . . 227 PHE HB2 . 27498 1 487 . 1 1 45 45 PHE HB3 H 1 2.344 0.015 . . . . . . . 227 PHE HB3 . 27498 1 488 . 1 1 45 45 PHE HD1 H 1 7.505 0.007 . . . . . . . 227 PHE HD1 . 27498 1 489 . 1 1 45 45 PHE HD2 H 1 7.505 0.007 . . . . . . . 227 PHE HD2 . 27498 1 490 . 1 1 45 45 PHE HE1 H 1 7.107 0.01 . . . . . . . 227 PHE HE1 . 27498 1 491 . 1 1 45 45 PHE HE2 H 1 7.107 0.01 . . . . . . . 227 PHE HE2 . 27498 1 492 . 1 1 45 45 PHE HZ H 1 6.529 0 . . . . . . . 227 PHE HZ . 27498 1 493 . 1 1 45 45 PHE C C 13 179.608 0.005 . . . . . . . 227 PHE C . 27498 1 494 . 1 1 45 45 PHE CA C 13 62.04 0.143 . . . . . . . 227 PHE CA . 27498 1 495 . 1 1 45 45 PHE CB C 13 39.072 0.139 . . . . . . . 227 PHE CB . 27498 1 496 . 1 1 45 45 PHE CD1 C 13 133.687 0 . . . . . . . 227 PHE CD1 . 27498 1 497 . 1 1 45 45 PHE N N 15 115.878 0.076 . . . . . . . 227 PHE N . 27498 1 498 . 1 1 46 46 GLU H H 1 7.175 0.007 . . . . . . . 228 GLU H . 27498 1 499 . 1 1 46 46 GLU HA H 1 3.501 0.007 . . . . . . . 228 GLU HA . 27498 1 500 . 1 1 46 46 GLU HB2 H 1 1.675 0.008 . . . . . . . 228 GLU HB2 . 27498 1 501 . 1 1 46 46 GLU HB3 H 1 1.873 0.013 . . . . . . . 228 GLU HB3 . 27498 1 502 . 1 1 46 46 GLU HG2 H 1 2.185 0.012 . . . . . . . 228 GLU HG2 . 27498 1 503 . 1 1 46 46 GLU HG3 H 1 2.313 0.012 . . . . . . . 228 GLU HG3 . 27498 1 504 . 1 1 46 46 GLU C C 13 178.234 0.014 . . . . . . . 228 GLU C . 27498 1 505 . 1 1 46 46 GLU CA C 13 59.331 0.063 . . . . . . . 228 GLU CA . 27498 1 506 . 1 1 46 46 GLU CB C 13 29.246 0.041 . . . . . . . 228 GLU CB . 27498 1 507 . 1 1 46 46 GLU CG C 13 36.241 0.079 . . . . . . . 228 GLU CG . 27498 1 508 . 1 1 46 46 GLU N N 15 120.78 0.044 . . . . . . . 228 GLU N . 27498 1 509 . 1 1 47 47 GLN H H 1 7.599 0.004 . . . . . . . 229 GLN H . 27498 1 510 . 1 1 47 47 GLN HA H 1 3.863 0.009 . . . . . . . 229 GLN HA . 27498 1 511 . 1 1 47 47 GLN HB2 H 1 1.378 0.014 . . . . . . . 229 GLN HB2 . 27498 1 512 . 1 1 47 47 GLN HB3 H 1 1.784 0.009 . . . . . . . 229 GLN HB3 . 27498 1 513 . 1 1 47 47 GLN HG2 H 1 2.438 0.013 . . . . . . . 229 GLN HG2 . 27498 1 514 . 1 1 47 47 GLN HG3 H 1 2.23 0.008 . . . . . . . 229 GLN HG3 . 27498 1 515 . 1 1 47 47 GLN HE21 H 1 7.099 0.004 . . . . . . . 229 GLN HE21 . 27498 1 516 . 1 1 47 47 GLN HE22 H 1 6.872 0.002 . . . . . . . 229 GLN HE22 . 27498 1 517 . 1 1 47 47 GLN C C 13 177.091 0.003 . . . . . . . 229 GLN C . 27498 1 518 . 1 1 47 47 GLN CA C 13 57.917 0.06 . . . . . . . 229 GLN CA . 27498 1 519 . 1 1 47 47 GLN CB C 13 29.678 0.073 . . . . . . . 229 GLN CB . 27498 1 520 . 1 1 47 47 GLN CG C 13 35.778 0.058 . . . . . . . 229 GLN CG . 27498 1 521 . 1 1 47 47 GLN N N 15 116.252 0.064 . . . . . . . 229 GLN N . 27498 1 522 . 1 1 47 47 GLN NE2 N 15 110.534 0.07 . . . . . . . 229 GLN NE2 . 27498 1 523 . 1 1 48 48 LEU H H 1 7.545 0.004 . . . . . . . 230 LEU H . 27498 1 524 . 1 1 48 48 LEU HA H 1 4.091 0.013 . . . . . . . 230 LEU HA . 27498 1 525 . 1 1 48 48 LEU HB2 H 1 1.377 0.009 . . . . . . . 230 LEU HB2 . 27498 1 526 . 1 1 48 48 LEU HB3 H 1 1.377 0.009 . . . . . . . 230 LEU HB3 . 27498 1 527 . 1 1 48 48 LEU HG H 1 1.74 0.008 . . . . . . . 230 LEU HG . 27498 1 528 . 1 1 48 48 LEU HD11 H 1 0.939 0.014 . . . . . . . 230 LEU HD1 . 27498 1 529 . 1 1 48 48 LEU HD12 H 1 0.939 0.014 . . . . . . . 230 LEU HD1 . 27498 1 530 . 1 1 48 48 LEU HD13 H 1 0.939 0.014 . . . . . . . 230 LEU HD1 . 27498 1 531 . 1 1 48 48 LEU HD21 H 1 0.839 0.01 . . . . . . . 230 LEU HD2 . 27498 1 532 . 1 1 48 48 LEU HD22 H 1 0.839 0.01 . . . . . . . 230 LEU HD2 . 27498 1 533 . 1 1 48 48 LEU HD23 H 1 0.839 0.01 . . . . . . . 230 LEU HD2 . 27498 1 534 . 1 1 48 48 LEU C C 13 176.906 0 . . . . . . . 230 LEU C . 27498 1 535 . 1 1 48 48 LEU CA C 13 56.648 0.082 . . . . . . . 230 LEU CA . 27498 1 536 . 1 1 48 48 LEU CB C 13 41.909 0.052 . . . . . . . 230 LEU CB . 27498 1 537 . 1 1 48 48 LEU CG C 13 26.771 0.018 . . . . . . . 230 LEU CG . 27498 1 538 . 1 1 48 48 LEU CD1 C 13 23.231 0.076 . . . . . . . 230 LEU CD1 . 27498 1 539 . 1 1 48 48 LEU CD2 C 13 24.706 0.073 . . . . . . . 230 LEU CD2 . 27498 1 540 . 1 1 48 48 LEU N N 15 117.637 0.045 . . . . . . . 230 LEU N . 27498 1 541 . 1 1 49 49 LYS HA H 1 3.976 0.015 . . . . . . . 231 LYS HA . 27498 1 542 . 1 1 49 49 LYS HB2 H 1 2.07 0.015 . . . . . . . 231 LYS HB2 . 27498 1 543 . 1 1 49 49 LYS HB3 H 1 1.939 0.007 . . . . . . . 231 LYS HB3 . 27498 1 544 . 1 1 49 49 LYS HG2 H 1 1.403 0.016 . . . . . . . 231 LYS HG2 . 27498 1 545 . 1 1 49 49 LYS HG3 H 1 1.403 0.016 . . . . . . . 231 LYS HG3 . 27498 1 546 . 1 1 49 49 LYS C C 13 175.504 0 . . . . . . . 231 LYS C . 27498 1 547 . 1 1 49 49 LYS CA C 13 56.705 0.07 . . . . . . . 231 LYS CA . 27498 1 548 . 1 1 49 49 LYS CB C 13 28.994 0.063 . . . . . . . 231 LYS CB . 27498 1 549 . 1 1 49 49 LYS CG C 13 24.608 0.025 . . . . . . . 231 LYS CG . 27498 1 550 . 1 1 50 50 MET H H 1 8.251 0.01 . . . . . . . 232 MET H . 27498 1 551 . 1 1 50 50 MET HA H 1 4.646 0.01 . . . . . . . 232 MET HA . 27498 1 552 . 1 1 50 50 MET HB2 H 1 1.442 0.014 . . . . . . . 232 MET HB2 . 27498 1 553 . 1 1 50 50 MET HB3 H 1 2.302 0.016 . . . . . . . 232 MET HB3 . 27498 1 554 . 1 1 50 50 MET HG2 H 1 2.434 0.01 . . . . . . . 232 MET HG2 . 27498 1 555 . 1 1 50 50 MET HG3 H 1 2.622 0.015 . . . . . . . 232 MET HG3 . 27498 1 556 . 1 1 50 50 MET HE1 H 1 1.887 0.005 . . . . . . . 232 MET HE . 27498 1 557 . 1 1 50 50 MET HE2 H 1 1.887 0.005 . . . . . . . 232 MET HE . 27498 1 558 . 1 1 50 50 MET HE3 H 1 1.887 0.005 . . . . . . . 232 MET HE . 27498 1 559 . 1 1 50 50 MET C C 13 176.004 0.006 . . . . . . . 232 MET C . 27498 1 560 . 1 1 50 50 MET CA C 13 54.209 0.077 . . . . . . . 232 MET CA . 27498 1 561 . 1 1 50 50 MET CB C 13 38.987 0.027 . . . . . . . 232 MET CB . 27498 1 562 . 1 1 50 50 MET CG C 13 31.415 0.066 . . . . . . . 232 MET CG . 27498 1 563 . 1 1 50 50 MET CE C 13 15.825 0.028 . . . . . . . 232 MET CE . 27498 1 564 . 1 1 50 50 MET N N 15 116.492 0.097 . . . . . . . 232 MET N . 27498 1 565 . 1 1 51 51 ASN H H 1 9.156 0.003 . . . . . . . 233 ASN H . 27498 1 566 . 1 1 51 51 ASN HA H 1 4.656 0.012 . . . . . . . 233 ASN HA . 27498 1 567 . 1 1 51 51 ASN HB2 H 1 2.939 0.006 . . . . . . . 233 ASN HB2 . 27498 1 568 . 1 1 51 51 ASN HB3 H 1 2.939 0.006 . . . . . . . 233 ASN HB3 . 27498 1 569 . 1 1 51 51 ASN HD21 H 1 6.965 0.003 . . . . . . . 233 ASN HD21 . 27498 1 570 . 1 1 51 51 ASN HD22 H 1 7.748 0.006 . . . . . . . 233 ASN HD22 . 27498 1 571 . 1 1 51 51 ASN C C 13 176.638 0.005 . . . . . . . 233 ASN C . 27498 1 572 . 1 1 51 51 ASN CA C 13 52.922 0.1 . . . . . . . 233 ASN CA . 27498 1 573 . 1 1 51 51 ASN CB C 13 38.667 0.073 . . . . . . . 233 ASN CB . 27498 1 574 . 1 1 51 51 ASN N N 15 120.886 0.057 . . . . . . . 233 ASN N . 27498 1 575 . 1 1 51 51 ASN ND2 N 15 113.756 0.055 . . . . . . . 233 ASN ND2 . 27498 1 576 . 1 1 52 52 LEU H H 1 8.949 0.003 . . . . . . . 234 LEU H . 27498 1 577 . 1 1 52 52 LEU HA H 1 3.996 0.011 . . . . . . . 234 LEU HA . 27498 1 578 . 1 1 52 52 LEU HB2 H 1 1.76 0.012 . . . . . . . 234 LEU HB2 . 27498 1 579 . 1 1 52 52 LEU HB3 H 1 1.432 0.012 . . . . . . . 234 LEU HB3 . 27498 1 580 . 1 1 52 52 LEU HG H 1 1.563 0.013 . . . . . . . 234 LEU HG . 27498 1 581 . 1 1 52 52 LEU HD11 H 1 0.854 0.007 . . . . . . . 234 LEU HD1 . 27498 1 582 . 1 1 52 52 LEU HD12 H 1 0.854 0.007 . . . . . . . 234 LEU HD1 . 27498 1 583 . 1 1 52 52 LEU HD13 H 1 0.854 0.007 . . . . . . . 234 LEU HD1 . 27498 1 584 . 1 1 52 52 LEU HD21 H 1 0.83 0.01 . . . . . . . 234 LEU HD2 . 27498 1 585 . 1 1 52 52 LEU HD22 H 1 0.83 0.01 . . . . . . . 234 LEU HD2 . 27498 1 586 . 1 1 52 52 LEU HD23 H 1 0.83 0.01 . . . . . . . 234 LEU HD2 . 27498 1 587 . 1 1 52 52 LEU C C 13 177.726 0.007 . . . . . . . 234 LEU C . 27498 1 588 . 1 1 52 52 LEU CA C 13 58.828 0.089 . . . . . . . 234 LEU CA . 27498 1 589 . 1 1 52 52 LEU CB C 13 41.816 0.077 . . . . . . . 234 LEU CB . 27498 1 590 . 1 1 52 52 LEU CG C 13 26.837 0.082 . . . . . . . 234 LEU CG . 27498 1 591 . 1 1 52 52 LEU CD1 C 13 23.658 0.066 . . . . . . . 234 LEU CD1 . 27498 1 592 . 1 1 52 52 LEU CD2 C 13 25.834 0.062 . . . . . . . 234 LEU CD2 . 27498 1 593 . 1 1 52 52 LEU N N 15 124.914 0.042 . . . . . . . 234 LEU N . 27498 1 594 . 1 1 53 53 ASP H H 1 8.547 0.003 . . . . . . . 235 ASP H . 27498 1 595 . 1 1 53 53 ASP HA H 1 4.196 0.007 . . . . . . . 235 ASP HA . 27498 1 596 . 1 1 53 53 ASP HB2 H 1 2.626 0.008 . . . . . . . 235 ASP HB2 . 27498 1 597 . 1 1 53 53 ASP HB3 H 1 2.55 0.013 . . . . . . . 235 ASP HB3 . 27498 1 598 . 1 1 53 53 ASP C C 13 178.738 0.007 . . . . . . . 235 ASP C . 27498 1 599 . 1 1 53 53 ASP CA C 13 57.578 0.087 . . . . . . . 235 ASP CA . 27498 1 600 . 1 1 53 53 ASP CB C 13 40.019 0.054 . . . . . . . 235 ASP CB . 27498 1 601 . 1 1 53 53 ASP N N 15 115.794 0.073 . . . . . . . 235 ASP N . 27498 1 602 . 1 1 54 54 ASP H H 1 7.51 0.005 . . . . . . . 236 ASP H . 27498 1 603 . 1 1 54 54 ASP HA H 1 4.524 0.012 . . . . . . . 236 ASP HA . 27498 1 604 . 1 1 54 54 ASP HB2 H 1 2.806 0.014 . . . . . . . 236 ASP HB2 . 27498 1 605 . 1 1 54 54 ASP HB3 H 1 2.673 0.014 . . . . . . . 236 ASP HB3 . 27498 1 606 . 1 1 54 54 ASP C C 13 178.88 0.006 . . . . . . . 236 ASP C . 27498 1 607 . 1 1 54 54 ASP CA C 13 57.237 0.098 . . . . . . . 236 ASP CA . 27498 1 608 . 1 1 54 54 ASP CB C 13 40.532 0.03 . . . . . . . 236 ASP CB . 27498 1 609 . 1 1 54 54 ASP N N 15 119.125 0.057 . . . . . . . 236 ASP N . 27498 1 610 . 1 1 55 55 ILE H H 1 7.946 0.004 . . . . . . . 237 ILE H . 27498 1 611 . 1 1 55 55 ILE HA H 1 3.49 0.013 . . . . . . . 237 ILE HA . 27498 1 612 . 1 1 55 55 ILE HB H 1 2.115 0.007 . . . . . . . 237 ILE HB . 27498 1 613 . 1 1 55 55 ILE HG12 H 1 2.06 0.014 . . . . . . . 237 ILE HG12 . 27498 1 614 . 1 1 55 55 ILE HG13 H 1 2.06 0.014 . . . . . . . 237 ILE HG13 . 27498 1 615 . 1 1 55 55 ILE HG21 H 1 0.978 0.009 . . . . . . . 237 ILE HG2 . 27498 1 616 . 1 1 55 55 ILE HG22 H 1 0.978 0.009 . . . . . . . 237 ILE HG2 . 27498 1 617 . 1 1 55 55 ILE HG23 H 1 0.978 0.009 . . . . . . . 237 ILE HG2 . 27498 1 618 . 1 1 55 55 ILE HD11 H 1 1.105 0.005 . . . . . . . 237 ILE HD1 . 27498 1 619 . 1 1 55 55 ILE HD12 H 1 1.105 0.005 . . . . . . . 237 ILE HD1 . 27498 1 620 . 1 1 55 55 ILE HD13 H 1 1.105 0.005 . . . . . . . 237 ILE HD1 . 27498 1 621 . 1 1 55 55 ILE C C 13 177.512 0.008 . . . . . . . 237 ILE C . 27498 1 622 . 1 1 55 55 ILE CA C 13 66.32 0.025 . . . . . . . 237 ILE CA . 27498 1 623 . 1 1 55 55 ILE CB C 13 38.111 0.053 . . . . . . . 237 ILE CB . 27498 1 624 . 1 1 55 55 ILE CG2 C 13 18.833 0.049 . . . . . . . 237 ILE CG2 . 27498 1 625 . 1 1 55 55 ILE CD1 C 13 14.882 0.03 . . . . . . . 237 ILE CD1 . 27498 1 626 . 1 1 55 55 ILE N N 15 121.481 0.051 . . . . . . . 237 ILE N . 27498 1 627 . 1 1 56 56 VAL H H 1 8.544 0.005 . . . . . . . 238 VAL H . 27498 1 628 . 1 1 56 56 VAL HA H 1 3.197 0.006 . . . . . . . 238 VAL HA . 27498 1 629 . 1 1 56 56 VAL HB H 1 2.22 0.01 . . . . . . . 238 VAL HB . 27498 1 630 . 1 1 56 56 VAL HG11 H 1 0.887 0.011 . . . . . . . 238 VAL HG1 . 27498 1 631 . 1 1 56 56 VAL HG12 H 1 0.887 0.011 . . . . . . . 238 VAL HG1 . 27498 1 632 . 1 1 56 56 VAL HG13 H 1 0.887 0.011 . . . . . . . 238 VAL HG1 . 27498 1 633 . 1 1 56 56 VAL HG21 H 1 0.941 0.017 . . . . . . . 238 VAL HG2 . 27498 1 634 . 1 1 56 56 VAL HG22 H 1 0.941 0.017 . . . . . . . 238 VAL HG2 . 27498 1 635 . 1 1 56 56 VAL HG23 H 1 0.941 0.017 . . . . . . . 238 VAL HG2 . 27498 1 636 . 1 1 56 56 VAL C C 13 176.611 0.019 . . . . . . . 238 VAL C . 27498 1 637 . 1 1 56 56 VAL CA C 13 67.029 0.074 . . . . . . . 238 VAL CA . 27498 1 638 . 1 1 56 56 VAL CB C 13 31.393 0.06 . . . . . . . 238 VAL CB . 27498 1 639 . 1 1 56 56 VAL CG1 C 13 20.944 0.033 . . . . . . . 238 VAL CG1 . 27498 1 640 . 1 1 56 56 VAL CG2 C 13 22.943 0.053 . . . . . . . 238 VAL CG2 . 27498 1 641 . 1 1 56 56 VAL N N 15 119.955 0.092 . . . . . . . 238 VAL N . 27498 1 642 . 1 1 57 57 LYS H H 1 7.521 0.003 . . . . . . . 239 LYS H . 27498 1 643 . 1 1 57 57 LYS HA H 1 3.795 0.007 . . . . . . . 239 LYS HA . 27498 1 644 . 1 1 57 57 LYS HB2 H 1 1.934 0.007 . . . . . . . 239 LYS HB2 . 27498 1 645 . 1 1 57 57 LYS HB3 H 1 1.934 0.007 . . . . . . . 239 LYS HB3 . 27498 1 646 . 1 1 57 57 LYS HG2 H 1 1.497 0 . . . . . . . 239 LYS HG2 . 27498 1 647 . 1 1 57 57 LYS HG3 H 1 1.497 0 . . . . . . . 239 LYS HG3 . 27498 1 648 . 1 1 57 57 LYS C C 13 179.214 0 . . . . . . . 239 LYS C . 27498 1 649 . 1 1 57 57 LYS CA C 13 59.82 0.022 . . . . . . . 239 LYS CA . 27498 1 650 . 1 1 57 57 LYS CB C 13 32.495 0.091 . . . . . . . 239 LYS CB . 27498 1 651 . 1 1 57 57 LYS CG C 13 25.223 0 . . . . . . . 239 LYS CG . 27498 1 652 . 1 1 57 57 LYS N N 15 116.126 0.05 . . . . . . . 239 LYS N . 27498 1 653 . 1 1 58 58 GLU H H 1 7.386 0.005 . . . . . . . 240 GLU H . 27498 1 654 . 1 1 58 58 GLU HA H 1 4.197 0.006 . . . . . . . 240 GLU HA . 27498 1 655 . 1 1 58 58 GLU HB2 H 1 2.168 0.01 . . . . . . . 240 GLU HB2 . 27498 1 656 . 1 1 58 58 GLU HB3 H 1 2.168 0.01 . . . . . . . 240 GLU HB3 . 27498 1 657 . 1 1 58 58 GLU HG2 H 1 2.359 0.007 . . . . . . . 240 GLU HG2 . 27498 1 658 . 1 1 58 58 GLU HG3 H 1 2.359 0.007 . . . . . . . 240 GLU HG3 . 27498 1 659 . 1 1 58 58 GLU C C 13 179.044 0.018 . . . . . . . 240 GLU C . 27498 1 660 . 1 1 58 58 GLU CA C 13 57.948 0.083 . . . . . . . 240 GLU CA . 27498 1 661 . 1 1 58 58 GLU CB C 13 30.226 0.016 . . . . . . . 240 GLU CB . 27498 1 662 . 1 1 58 58 GLU CG C 13 37.084 0.062 . . . . . . . 240 GLU CG . 27498 1 663 . 1 1 58 58 GLU N N 15 117.179 0.065 . . . . . . . 240 GLU N . 27498 1 664 . 1 1 59 59 ALA H H 1 8.899 0.004 . . . . . . . 241 ALA H . 27498 1 665 . 1 1 59 59 ALA HA H 1 3.79 0.013 . . . . . . . 241 ALA HA . 27498 1 666 . 1 1 59 59 ALA HB1 H 1 1.321 0.009 . . . . . . . 241 ALA HB . 27498 1 667 . 1 1 59 59 ALA HB2 H 1 1.321 0.009 . . . . . . . 241 ALA HB . 27498 1 668 . 1 1 59 59 ALA HB3 H 1 1.321 0.009 . . . . . . . 241 ALA HB . 27498 1 669 . 1 1 59 59 ALA C C 13 178.288 0.001 . . . . . . . 241 ALA C . 27498 1 670 . 1 1 59 59 ALA CA C 13 54.467 0.096 . . . . . . . 241 ALA CA . 27498 1 671 . 1 1 59 59 ALA CB C 13 19.094 0.035 . . . . . . . 241 ALA CB . 27498 1 672 . 1 1 59 59 ALA N N 15 122.639 0.029 . . . . . . . 241 ALA N . 27498 1 673 . 1 1 60 60 LYS H H 1 7.357 0.005 . . . . . . . 242 LYS H . 27498 1 674 . 1 1 60 60 LYS HA H 1 3.635 0.015 . . . . . . . 242 LYS HA . 27498 1 675 . 1 1 60 60 LYS HB2 H 1 1.811 0.013 . . . . . . . 242 LYS HB2 . 27498 1 676 . 1 1 60 60 LYS HB3 H 1 1.724 0.009 . . . . . . . 242 LYS HB3 . 27498 1 677 . 1 1 60 60 LYS HG2 H 1 1.898 0 . . . . . . . 242 LYS HG2 . 27498 1 678 . 1 1 60 60 LYS HG3 H 1 1.005 0.006 . . . . . . . 242 LYS HG3 . 27498 1 679 . 1 1 60 60 LYS C C 13 176.963 0.009 . . . . . . . 242 LYS C . 27498 1 680 . 1 1 60 60 LYS CA C 13 58.836 0.098 . . . . . . . 242 LYS CA . 27498 1 681 . 1 1 60 60 LYS CB C 13 32.276 0.068 . . . . . . . 242 LYS CB . 27498 1 682 . 1 1 60 60 LYS CG C 13 25.325 0.019 . . . . . . . 242 LYS CG . 27498 1 683 . 1 1 60 60 LYS N N 15 111.729 0.053 . . . . . . . 242 LYS N . 27498 1 684 . 1 1 61 61 ASN H H 1 7.616 0.006 . . . . . . . 243 ASN H . 27498 1 685 . 1 1 61 61 ASN HA H 1 4.59 0.012 . . . . . . . 243 ASN HA . 27498 1 686 . 1 1 61 61 ASN HB2 H 1 3.031 0.013 . . . . . . . 243 ASN HB2 . 27498 1 687 . 1 1 61 61 ASN HB3 H 1 2.952 0.015 . . . . . . . 243 ASN HB3 . 27498 1 688 . 1 1 61 61 ASN HD21 H 1 7.728 0.001 . . . . . . . 243 ASN HD21 . 27498 1 689 . 1 1 61 61 ASN HD22 H 1 7.047 0.001 . . . . . . . 243 ASN HD22 . 27498 1 690 . 1 1 61 61 ASN C C 13 174.948 0.001 . . . . . . . 243 ASN C . 27498 1 691 . 1 1 61 61 ASN CA C 13 53.311 0.056 . . . . . . . 243 ASN CA . 27498 1 692 . 1 1 61 61 ASN CB C 13 38.84 0.114 . . . . . . . 243 ASN CB . 27498 1 693 . 1 1 61 61 ASN N N 15 115.22 0.064 . . . . . . . 243 ASN N . 27498 1 694 . 1 1 61 61 ASN ND2 N 15 114.73 0.083 . . . . . . . 243 ASN ND2 . 27498 1 695 . 1 1 62 62 VAL H H 1 7.249 0.003 . . . . . . . 244 VAL H . 27498 1 696 . 1 1 62 62 VAL HA H 1 2.705 0.012 . . . . . . . 244 VAL HA . 27498 1 697 . 1 1 62 62 VAL HB H 1 1.968 0.007 . . . . . . . 244 VAL HB . 27498 1 698 . 1 1 62 62 VAL HG11 H 1 0.463 0.007 . . . . . . . 244 VAL HG1 . 27498 1 699 . 1 1 62 62 VAL HG12 H 1 0.463 0.007 . . . . . . . 244 VAL HG1 . 27498 1 700 . 1 1 62 62 VAL HG13 H 1 0.463 0.007 . . . . . . . 244 VAL HG1 . 27498 1 701 . 1 1 62 62 VAL HG21 H 1 0.298 0.009 . . . . . . . 244 VAL HG2 . 27498 1 702 . 1 1 62 62 VAL HG22 H 1 0.298 0.009 . . . . . . . 244 VAL HG2 . 27498 1 703 . 1 1 62 62 VAL HG23 H 1 0.298 0.009 . . . . . . . 244 VAL HG2 . 27498 1 704 . 1 1 62 62 VAL C C 13 174.324 0 . . . . . . . 244 VAL C . 27498 1 705 . 1 1 62 62 VAL CA C 13 60.484 0.096 . . . . . . . 244 VAL CA . 27498 1 706 . 1 1 62 62 VAL CB C 13 30.692 0.045 . . . . . . . 244 VAL CB . 27498 1 707 . 1 1 62 62 VAL CG1 C 13 21.027 0.054 . . . . . . . 244 VAL CG1 . 27498 1 708 . 1 1 62 62 VAL CG2 C 13 21.313 0.032 . . . . . . . 244 VAL CG2 . 27498 1 709 . 1 1 62 62 VAL N N 15 124.123 0.049 . . . . . . . 244 VAL N . 27498 1 710 . 1 1 63 63 PRO HA H 1 4.115 0.009 . . . . . . . 245 PRO HA . 27498 1 711 . 1 1 63 63 PRO HB2 H 1 2.208 0.014 . . . . . . . 245 PRO HB2 . 27498 1 712 . 1 1 63 63 PRO HB3 H 1 1.885 0.013 . . . . . . . 245 PRO HB3 . 27498 1 713 . 1 1 63 63 PRO HD2 H 1 3.578 0.013 . . . . . . . 245 PRO HD2 . 27498 1 714 . 1 1 63 63 PRO HD3 H 1 2.882 0.009 . . . . . . . 245 PRO HD3 . 27498 1 715 . 1 1 63 63 PRO C C 13 176.106 0.002 . . . . . . . 245 PRO C . 27498 1 716 . 1 1 63 63 PRO CA C 13 64.69 0.057 . . . . . . . 245 PRO CA . 27498 1 717 . 1 1 63 63 PRO CB C 13 31.854 0.027 . . . . . . . 245 PRO CB . 27498 1 718 . 1 1 63 63 PRO CG C 13 27.55 0 . . . . . . . 245 PRO CG . 27498 1 719 . 1 1 63 63 PRO CD C 13 51.352 0.063 . . . . . . . 245 PRO CD . 27498 1 720 . 1 1 64 64 GLY H H 1 8.169 0.002 . . . . . . . 246 GLY H . 27498 1 721 . 1 1 64 64 GLY HA2 H 1 4.239 0.01 . . . . . . . 246 GLY HA2 . 27498 1 722 . 1 1 64 64 GLY HA3 H 1 3.635 0.007 . . . . . . . 246 GLY HA3 . 27498 1 723 . 1 1 64 64 GLY C C 13 175.591 0 . . . . . . . 246 GLY C . 27498 1 724 . 1 1 64 64 GLY CA C 13 45.743 0.063 . . . . . . . 246 GLY CA . 27498 1 725 . 1 1 64 64 GLY N N 15 110.328 0.089 . . . . . . . 246 GLY N . 27498 1 726 . 1 1 65 65 VAL H H 1 7.526 0.005 . . . . . . . 247 VAL H . 27498 1 727 . 1 1 65 65 VAL HA H 1 3.43 0.012 . . . . . . . 247 VAL HA . 27498 1 728 . 1 1 65 65 VAL HB H 1 2.245 0.016 . . . . . . . 247 VAL HB . 27498 1 729 . 1 1 65 65 VAL HG11 H 1 0.697 0.01 . . . . . . . 247 VAL HG1 . 27498 1 730 . 1 1 65 65 VAL HG12 H 1 0.697 0.01 . . . . . . . 247 VAL HG1 . 27498 1 731 . 1 1 65 65 VAL HG13 H 1 0.697 0.01 . . . . . . . 247 VAL HG1 . 27498 1 732 . 1 1 65 65 VAL HG21 H 1 0.729 0.008 . . . . . . . 247 VAL HG2 . 27498 1 733 . 1 1 65 65 VAL HG22 H 1 0.729 0.008 . . . . . . . 247 VAL HG2 . 27498 1 734 . 1 1 65 65 VAL HG23 H 1 0.729 0.008 . . . . . . . 247 VAL HG2 . 27498 1 735 . 1 1 65 65 VAL C C 13 177.344 0.001 . . . . . . . 247 VAL C . 27498 1 736 . 1 1 65 65 VAL CA C 13 67.754 0.028 . . . . . . . 247 VAL CA . 27498 1 737 . 1 1 65 65 VAL CB C 13 30.688 0.038 . . . . . . . 247 VAL CB . 27498 1 738 . 1 1 65 65 VAL CG1 C 13 21.128 0.057 . . . . . . . 247 VAL CG1 . 27498 1 739 . 1 1 65 65 VAL CG2 C 13 25.341 0.029 . . . . . . . 247 VAL CG2 . 27498 1 740 . 1 1 65 65 VAL N N 15 120.836 0.051 . . . . . . . 247 VAL N . 27498 1 741 . 1 1 66 66 THR H H 1 8.932 0.002 . . . . . . . 248 THR H . 27498 1 742 . 1 1 66 66 THR HA H 1 3.742 0.01 . . . . . . . 248 THR HA . 27498 1 743 . 1 1 66 66 THR HB H 1 4.267 0.006 . . . . . . . 248 THR HB . 27498 1 744 . 1 1 66 66 THR HG21 H 1 1.282 0.01 . . . . . . . 248 THR HG2 . 27498 1 745 . 1 1 66 66 THR HG22 H 1 1.282 0.01 . . . . . . . 248 THR HG2 . 27498 1 746 . 1 1 66 66 THR HG23 H 1 1.282 0.01 . . . . . . . 248 THR HG2 . 27498 1 747 . 1 1 66 66 THR C C 13 176.312 0 . . . . . . . 248 THR C . 27498 1 748 . 1 1 66 66 THR CA C 13 66.579 0.096 . . . . . . . 248 THR CA . 27498 1 749 . 1 1 66 66 THR CB C 13 67.451 0.074 . . . . . . . 248 THR CB . 27498 1 750 . 1 1 66 66 THR CG2 C 13 23.011 0.055 . . . . . . . 248 THR CG2 . 27498 1 751 . 1 1 66 66 THR N N 15 112.642 0.057 . . . . . . . 248 THR N . 27498 1 752 . 1 1 67 67 ARG H H 1 7.566 0.005 . . . . . . . 249 ARG H . 27498 1 753 . 1 1 67 67 ARG HA H 1 3.958 0.009 . . . . . . . 249 ARG HA . 27498 1 754 . 1 1 67 67 ARG HB2 H 1 1.827 0.015 . . . . . . . 249 ARG HB2 . 27498 1 755 . 1 1 67 67 ARG HB3 H 1 1.827 0.015 . . . . . . . 249 ARG HB3 . 27498 1 756 . 1 1 67 67 ARG HG2 H 1 1.605 0.011 . . . . . . . 249 ARG HG2 . 27498 1 757 . 1 1 67 67 ARG HG3 H 1 1.605 0.011 . . . . . . . 249 ARG HG3 . 27498 1 758 . 1 1 67 67 ARG HD2 H 1 3.117 0.003 . . . . . . . 249 ARG HD2 . 27498 1 759 . 1 1 67 67 ARG HD3 H 1 3.207 0.007 . . . . . . . 249 ARG HD3 . 27498 1 760 . 1 1 67 67 ARG C C 13 178.448 0.005 . . . . . . . 249 ARG C . 27498 1 761 . 1 1 67 67 ARG CA C 13 59.22 0.081 . . . . . . . 249 ARG CA . 27498 1 762 . 1 1 67 67 ARG CB C 13 29.441 0.075 . . . . . . . 249 ARG CB . 27498 1 763 . 1 1 67 67 ARG CG C 13 26.978 0.005 . . . . . . . 249 ARG CG . 27498 1 764 . 1 1 67 67 ARG CD C 13 42.934 0.052 . . . . . . . 249 ARG CD . 27498 1 765 . 1 1 67 67 ARG N N 15 122.608 0.034 . . . . . . . 249 ARG N . 27498 1 766 . 1 1 68 68 LEU H H 1 7.878 0.004 . . . . . . . 250 LEU H . 27498 1 767 . 1 1 68 68 LEU HA H 1 4.07 0.009 . . . . . . . 250 LEU HA . 27498 1 768 . 1 1 68 68 LEU HB2 H 1 1.118 0.015 . . . . . . . 250 LEU HB2 . 27498 1 769 . 1 1 68 68 LEU HB3 H 1 1.118 0.015 . . . . . . . 250 LEU HB3 . 27498 1 770 . 1 1 68 68 LEU HG H 1 1.813 0.013 . . . . . . . 250 LEU HG . 27498 1 771 . 1 1 68 68 LEU HD11 H 1 0.789 0.014 . . . . . . . 250 LEU HD1 . 27498 1 772 . 1 1 68 68 LEU HD12 H 1 0.789 0.014 . . . . . . . 250 LEU HD1 . 27498 1 773 . 1 1 68 68 LEU HD13 H 1 0.789 0.014 . . . . . . . 250 LEU HD1 . 27498 1 774 . 1 1 68 68 LEU HD21 H 1 0.953 0.008 . . . . . . . 250 LEU HD2 . 27498 1 775 . 1 1 68 68 LEU HD22 H 1 0.953 0.008 . . . . . . . 250 LEU HD2 . 27498 1 776 . 1 1 68 68 LEU HD23 H 1 0.953 0.008 . . . . . . . 250 LEU HD2 . 27498 1 777 . 1 1 68 68 LEU C C 13 179.118 0.004 . . . . . . . 250 LEU C . 27498 1 778 . 1 1 68 68 LEU CA C 13 57.77 0.074 . . . . . . . 250 LEU CA . 27498 1 779 . 1 1 68 68 LEU CB C 13 42.841 0.027 . . . . . . . 250 LEU CB . 27498 1 780 . 1 1 68 68 LEU CG C 13 27.252 0.029 . . . . . . . 250 LEU CG . 27498 1 781 . 1 1 68 68 LEU CD1 C 13 25.835 0.075 . . . . . . . 250 LEU CD1 . 27498 1 782 . 1 1 68 68 LEU CD2 C 13 22.931 0.093 . . . . . . . 250 LEU CD2 . 27498 1 783 . 1 1 68 68 LEU N N 15 119.033 0.055 . . . . . . . 250 LEU N . 27498 1 784 . 1 1 69 69 ALA H H 1 8.542 0.004 . . . . . . . 251 ALA H . 27498 1 785 . 1 1 69 69 ALA HA H 1 4.015 0.013 . . . . . . . 251 ALA HA . 27498 1 786 . 1 1 69 69 ALA HB1 H 1 1.51 0.009 . . . . . . . 251 ALA HB . 27498 1 787 . 1 1 69 69 ALA HB2 H 1 1.51 0.009 . . . . . . . 251 ALA HB . 27498 1 788 . 1 1 69 69 ALA HB3 H 1 1.51 0.009 . . . . . . . 251 ALA HB . 27498 1 789 . 1 1 69 69 ALA C C 13 180.471 0.007 . . . . . . . 251 ALA C . 27498 1 790 . 1 1 69 69 ALA CA C 13 54.782 0.034 . . . . . . . 251 ALA CA . 27498 1 791 . 1 1 69 69 ALA CB C 13 19.245 0.024 . . . . . . . 251 ALA CB . 27498 1 792 . 1 1 69 69 ALA N N 15 119.447 0.045 . . . . . . . 251 ALA N . 27498 1 793 . 1 1 70 70 HIS H H 1 8.367 0.003 . . . . . . . 252 HIS H . 27498 1 794 . 1 1 70 70 HIS HA H 1 4.104 0.008 . . . . . . . 252 HIS HA . 27498 1 795 . 1 1 70 70 HIS HB2 H 1 3.332 0.006 . . . . . . . 252 HIS HB2 . 27498 1 796 . 1 1 70 70 HIS HB3 H 1 3.192 0.004 . . . . . . . 252 HIS HB3 . 27498 1 797 . 1 1 70 70 HIS HD2 H 1 7.146 0.005 . . . . . . . 252 HIS HD2 . 27498 1 798 . 1 1 70 70 HIS HE1 H 1 8.186 0.014 . . . . . . . 252 HIS HE1 . 27498 1 799 . 1 1 70 70 HIS C C 13 175.939 0.007 . . . . . . . 252 HIS C . 27498 1 800 . 1 1 70 70 HIS CA C 13 59.357 0.079 . . . . . . . 252 HIS CA . 27498 1 801 . 1 1 70 70 HIS CB C 13 28.851 0.056 . . . . . . . 252 HIS CB . 27498 1 802 . 1 1 70 70 HIS CD2 C 13 120.813 0 . . . . . . . 252 HIS CD2 . 27498 1 803 . 1 1 70 70 HIS CE1 C 13 137.215 0 . . . . . . . 252 HIS CE1 . 27498 1 804 . 1 1 70 70 HIS N N 15 118.878 0.049 . . . . . . . 252 HIS N . 27498 1 805 . 1 1 71 71 ASP H H 1 7.663 0.003 . . . . . . . 253 ASP H . 27498 1 806 . 1 1 71 71 ASP HA H 1 4.576 0.004 . . . . . . . 253 ASP HA . 27498 1 807 . 1 1 71 71 ASP HB2 H 1 2.807 0.007 . . . . . . . 253 ASP HB2 . 27498 1 808 . 1 1 71 71 ASP HB3 H 1 2.807 0.007 . . . . . . . 253 ASP HB3 . 27498 1 809 . 1 1 71 71 ASP C C 13 176.64 0.009 . . . . . . . 253 ASP C . 27498 1 810 . 1 1 71 71 ASP CA C 13 54.562 0.082 . . . . . . . 253 ASP CA . 27498 1 811 . 1 1 71 71 ASP CB C 13 41.051 0.027 . . . . . . . 253 ASP CB . 27498 1 812 . 1 1 71 71 ASP N N 15 116.429 0.047 . . . . . . . 253 ASP N . 27498 1 813 . 1 1 72 72 GLY H H 1 7.891 0.003 . . . . . . . 254 GLY H . 27498 1 814 . 1 1 72 72 GLY HA2 H 1 4.03 0.01 . . . . . . . 254 GLY HA2 . 27498 1 815 . 1 1 72 72 GLY HA3 H 1 3.504 0.011 . . . . . . . 254 GLY HA3 . 27498 1 816 . 1 1 72 72 GLY C C 13 174.728 0.003 . . . . . . . 254 GLY C . 27498 1 817 . 1 1 72 72 GLY CA C 13 45.768 0.051 . . . . . . . 254 GLY CA . 27498 1 818 . 1 1 72 72 GLY N N 15 109.053 0.047 . . . . . . . 254 GLY N . 27498 1 819 . 1 1 73 73 SER H H 1 8.066 0.003 . . . . . . . 255 SER H . 27498 1 820 . 1 1 73 73 SER HA H 1 4.429 0.008 . . . . . . . 255 SER HA . 27498 1 821 . 1 1 73 73 SER HB2 H 1 3.99 0.012 . . . . . . . 255 SER HB2 . 27498 1 822 . 1 1 73 73 SER HB3 H 1 3.684 0.018 . . . . . . . 255 SER HB3 . 27498 1 823 . 1 1 73 73 SER C C 13 172.95 0.006 . . . . . . . 255 SER C . 27498 1 824 . 1 1 73 73 SER CA C 13 58.314 0.062 . . . . . . . 255 SER CA . 27498 1 825 . 1 1 73 73 SER CB C 13 64.398 0.08 . . . . . . . 255 SER CB . 27498 1 826 . 1 1 73 73 SER N N 15 117.239 0.07 . . . . . . . 255 SER N . 27498 1 827 . 1 1 74 74 LYS H H 1 8.298 0.004 . . . . . . . 256 LYS H . 27498 1 828 . 1 1 74 74 LYS HA H 1 4.232 0.011 . . . . . . . 256 LYS HA . 27498 1 829 . 1 1 74 74 LYS HB2 H 1 1.884 0.011 . . . . . . . 256 LYS HB2 . 27498 1 830 . 1 1 74 74 LYS HB3 H 1 1.884 0.011 . . . . . . . 256 LYS HB3 . 27498 1 831 . 1 1 74 74 LYS HG2 H 1 1.569 0 . . . . . . . 256 LYS HG2 . 27498 1 832 . 1 1 74 74 LYS HG3 H 1 1.569 0 . . . . . . . 256 LYS HG3 . 27498 1 833 . 1 1 74 74 LYS C C 13 177.254 0.01 . . . . . . . 256 LYS C . 27498 1 834 . 1 1 74 74 LYS CA C 13 56.828 0.088 . . . . . . . 256 LYS CA . 27498 1 835 . 1 1 74 74 LYS CB C 13 32.436 0.037 . . . . . . . 256 LYS CB . 27498 1 836 . 1 1 74 74 LYS CG C 13 24.8 0 . . . . . . . 256 LYS CG . 27498 1 837 . 1 1 74 74 LYS N N 15 121.406 0.065 . . . . . . . 256 LYS N . 27498 1 838 . 1 1 75 75 LEU H H 1 9.131 0.004 . . . . . . . 257 LEU H . 27498 1 839 . 1 1 75 75 LEU HA H 1 4.385 0.01 . . . . . . . 257 LEU HA . 27498 1 840 . 1 1 75 75 LEU HB2 H 1 1.621 0.009 . . . . . . . 257 LEU HB2 . 27498 1 841 . 1 1 75 75 LEU HB3 H 1 0.814 0.017 . . . . . . . 257 LEU HB3 . 27498 1 842 . 1 1 75 75 LEU HG H 1 1.898 0.013 . . . . . . . 257 LEU HG . 27498 1 843 . 1 1 75 75 LEU HD11 H 1 0.784 0.013 . . . . . . . 257 LEU HD1 . 27498 1 844 . 1 1 75 75 LEU HD12 H 1 0.784 0.013 . . . . . . . 257 LEU HD1 . 27498 1 845 . 1 1 75 75 LEU HD13 H 1 0.784 0.013 . . . . . . . 257 LEU HD1 . 27498 1 846 . 1 1 75 75 LEU C C 13 175.917 0 . . . . . . . 257 LEU C . 27498 1 847 . 1 1 75 75 LEU CA C 13 52.428 0.06 . . . . . . . 257 LEU CA . 27498 1 848 . 1 1 75 75 LEU CB C 13 42.59 0.099 . . . . . . . 257 LEU CB . 27498 1 849 . 1 1 75 75 LEU CG C 13 26.729 0.074 . . . . . . . 257 LEU CG . 27498 1 850 . 1 1 75 75 LEU CD1 C 13 26.236 0.09 . . . . . . . 257 LEU CD1 . 27498 1 851 . 1 1 75 75 LEU N N 15 123.042 0.034 . . . . . . . 257 LEU N . 27498 1 852 . 1 1 76 76 PRO HA H 1 4.354 0.013 . . . . . . . 258 PRO HA . 27498 1 853 . 1 1 76 76 PRO HB2 H 1 1.269 0.009 . . . . . . . 258 PRO HB2 . 27498 1 854 . 1 1 76 76 PRO HB3 H 1 1.269 0.009 . . . . . . . 258 PRO HB3 . 27498 1 855 . 1 1 76 76 PRO HG2 H 1 1.744 0.013 . . . . . . . 258 PRO HG2 . 27498 1 856 . 1 1 76 76 PRO HG3 H 1 1.744 0.013 . . . . . . . 258 PRO HG3 . 27498 1 857 . 1 1 76 76 PRO HD2 H 1 3.346 0.01 . . . . . . . 258 PRO HD2 . 27498 1 858 . 1 1 76 76 PRO HD3 H 1 3.088 0.013 . . . . . . . 258 PRO HD3 . 27498 1 859 . 1 1 76 76 PRO C C 13 175.712 0.002 . . . . . . . 258 PRO C . 27498 1 860 . 1 1 76 76 PRO CA C 13 61.192 0.018 . . . . . . . 258 PRO CA . 27498 1 861 . 1 1 76 76 PRO CB C 13 27.811 0.02 . . . . . . . 258 PRO CB . 27498 1 862 . 1 1 76 76 PRO CG C 13 27.18 0.134 . . . . . . . 258 PRO CG . 27498 1 863 . 1 1 76 76 PRO CD C 13 49.519 0.093 . . . . . . . 258 PRO CD . 27498 1 864 . 1 1 77 77 LEU H H 1 7.672 0.003 . . . . . . . 259 LEU H . 27498 1 865 . 1 1 77 77 LEU HA H 1 3.754 0.009 . . . . . . . 259 LEU HA . 27498 1 866 . 1 1 77 77 LEU HB2 H 1 2.076 0.011 . . . . . . . 259 LEU HB2 . 27498 1 867 . 1 1 77 77 LEU HB3 H 1 1.463 0.008 . . . . . . . 259 LEU HB3 . 27498 1 868 . 1 1 77 77 LEU HG H 1 1.165 0.009 . . . . . . . 259 LEU HG . 27498 1 869 . 1 1 77 77 LEU HD11 H 1 1.148 0.014 . . . . . . . 259 LEU HD1 . 27498 1 870 . 1 1 77 77 LEU HD12 H 1 1.148 0.014 . . . . . . . 259 LEU HD1 . 27498 1 871 . 1 1 77 77 LEU HD13 H 1 1.148 0.014 . . . . . . . 259 LEU HD1 . 27498 1 872 . 1 1 77 77 LEU HD21 H 1 0.744 0.011 . . . . . . . 259 LEU HD2 . 27498 1 873 . 1 1 77 77 LEU HD22 H 1 0.744 0.011 . . . . . . . 259 LEU HD2 . 27498 1 874 . 1 1 77 77 LEU HD23 H 1 0.744 0.011 . . . . . . . 259 LEU HD2 . 27498 1 875 . 1 1 77 77 LEU C C 13 177.104 0.005 . . . . . . . 259 LEU C . 27498 1 876 . 1 1 77 77 LEU CA C 13 59.026 0.211 . . . . . . . 259 LEU CA . 27498 1 877 . 1 1 77 77 LEU CB C 13 41.755 0.066 . . . . . . . 259 LEU CB . 27498 1 878 . 1 1 77 77 LEU CG C 13 26.785 0.032 . . . . . . . 259 LEU CG . 27498 1 879 . 1 1 77 77 LEU CD1 C 13 26.835 0.073 . . . . . . . 259 LEU CD1 . 27498 1 880 . 1 1 77 77 LEU CD2 C 13 23.553 0.044 . . . . . . . 259 LEU CD2 . 27498 1 881 . 1 1 77 77 LEU N N 15 125.513 0.029 . . . . . . . 259 LEU N . 27498 1 882 . 1 1 78 78 ARG H H 1 8.236 0.007 . . . . . . . 260 ARG H . 27498 1 883 . 1 1 78 78 ARG HA H 1 3.07 0.009 . . . . . . . 260 ARG HA . 27498 1 884 . 1 1 78 78 ARG HB2 H 1 1.528 0.01 . . . . . . . 260 ARG HB2 . 27498 1 885 . 1 1 78 78 ARG HB3 H 1 1.528 0.01 . . . . . . . 260 ARG HB3 . 27498 1 886 . 1 1 78 78 ARG C C 13 178.195 0.005 . . . . . . . 260 ARG C . 27498 1 887 . 1 1 78 78 ARG CA C 13 60.488 0.096 . . . . . . . 260 ARG CA . 27498 1 888 . 1 1 78 78 ARG CB C 13 28.155 0.043 . . . . . . . 260 ARG CB . 27498 1 889 . 1 1 78 78 ARG CG C 13 27.247 0 . . . . . . . 260 ARG CG . 27498 1 890 . 1 1 78 78 ARG N N 15 120.371 0.075 . . . . . . . 260 ARG N . 27498 1 891 . 1 1 79 79 CYS H H 1 7.865 0.006 . . . . . . . 261 CYS H . 27498 1 892 . 1 1 79 79 CYS HA H 1 4.084 0.01 . . . . . . . 261 CYS HA . 27498 1 893 . 1 1 79 79 CYS HB2 H 1 3.305 0.007 . . . . . . . 261 CYS HB2 . 27498 1 894 . 1 1 79 79 CYS HB3 H 1 3.162 0.013 . . . . . . . 261 CYS HB3 . 27498 1 895 . 1 1 79 79 CYS C C 13 175.639 0.008 . . . . . . . 261 CYS C . 27498 1 896 . 1 1 79 79 CYS CA C 13 62.283 0.095 . . . . . . . 261 CYS CA . 27498 1 897 . 1 1 79 79 CYS CB C 13 25.732 0.084 . . . . . . . 261 CYS CB . 27498 1 898 . 1 1 79 79 CYS N N 15 117.946 0.058 . . . . . . . 261 CYS N . 27498 1 899 . 1 1 80 80 VAL H H 1 8.178 0.007 . . . . . . . 262 VAL H . 27498 1 900 . 1 1 80 80 VAL HA H 1 3.601 0.013 . . . . . . . 262 VAL HA . 27498 1 901 . 1 1 80 80 VAL HB H 1 2.238 0.019 . . . . . . . 262 VAL HB . 27498 1 902 . 1 1 80 80 VAL HG11 H 1 0.994 0.013 . . . . . . . 262 VAL HG1 . 27498 1 903 . 1 1 80 80 VAL HG12 H 1 0.994 0.013 . . . . . . . 262 VAL HG1 . 27498 1 904 . 1 1 80 80 VAL HG13 H 1 0.994 0.013 . . . . . . . 262 VAL HG1 . 27498 1 905 . 1 1 80 80 VAL HG21 H 1 0.92 0.015 . . . . . . . 262 VAL HG2 . 27498 1 906 . 1 1 80 80 VAL HG22 H 1 0.92 0.015 . . . . . . . 262 VAL HG2 . 27498 1 907 . 1 1 80 80 VAL HG23 H 1 0.92 0.015 . . . . . . . 262 VAL HG2 . 27498 1 908 . 1 1 80 80 VAL C C 13 176.471 0.002 . . . . . . . 262 VAL C . 27498 1 909 . 1 1 80 80 VAL CA C 13 67.064 0.092 . . . . . . . 262 VAL CA . 27498 1 910 . 1 1 80 80 VAL CB C 13 31.855 0.038 . . . . . . . 262 VAL CB . 27498 1 911 . 1 1 80 80 VAL CG1 C 13 22.073 0.005 . . . . . . . 262 VAL CG1 . 27498 1 912 . 1 1 80 80 VAL CG2 C 13 23.078 0.064 . . . . . . . 262 VAL CG2 . 27498 1 913 . 1 1 80 80 VAL N N 15 117.954 0.044 . . . . . . . 262 VAL N . 27498 1 914 . 1 1 81 81 LEU H H 1 8.737 0.004 . . . . . . . 263 LEU H . 27498 1 915 . 1 1 81 81 LEU HA H 1 3.586 0.011 . . . . . . . 263 LEU HA . 27498 1 916 . 1 1 81 81 LEU HB2 H 1 1.689 0.014 . . . . . . . 263 LEU HB2 . 27498 1 917 . 1 1 81 81 LEU HB3 H 1 0.593 0.01 . . . . . . . 263 LEU HB3 . 27498 1 918 . 1 1 81 81 LEU HG H 1 0.995 0.012 . . . . . . . 263 LEU HG . 27498 1 919 . 1 1 81 81 LEU HD11 H 1 0.209 0.011 . . . . . . . 263 LEU HD1 . 27498 1 920 . 1 1 81 81 LEU HD12 H 1 0.209 0.011 . . . . . . . 263 LEU HD1 . 27498 1 921 . 1 1 81 81 LEU HD13 H 1 0.209 0.011 . . . . . . . 263 LEU HD1 . 27498 1 922 . 1 1 81 81 LEU HD21 H 1 0.798 0.011 . . . . . . . 263 LEU HD2 . 27498 1 923 . 1 1 81 81 LEU HD22 H 1 0.798 0.011 . . . . . . . 263 LEU HD2 . 27498 1 924 . 1 1 81 81 LEU HD23 H 1 0.798 0.011 . . . . . . . 263 LEU HD2 . 27498 1 925 . 1 1 81 81 LEU C C 13 177.368 0.004 . . . . . . . 263 LEU C . 27498 1 926 . 1 1 81 81 LEU CA C 13 57.958 0.107 . . . . . . . 263 LEU CA . 27498 1 927 . 1 1 81 81 LEU CB C 13 39.709 0.075 . . . . . . . 263 LEU CB . 27498 1 928 . 1 1 81 81 LEU CG C 13 26.235 0.052 . . . . . . . 263 LEU CG . 27498 1 929 . 1 1 81 81 LEU CD1 C 13 21.667 0.04 . . . . . . . 263 LEU CD1 . 27498 1 930 . 1 1 81 81 LEU CD2 C 13 27.644 0.084 . . . . . . . 263 LEU CD2 . 27498 1 931 . 1 1 81 81 LEU N N 15 119.046 0.045 . . . . . . . 263 LEU N . 27498 1 932 . 1 1 82 82 GLY H H 1 8.488 0.004 . . . . . . . 264 GLY H . 27498 1 933 . 1 1 82 82 GLY HA2 H 1 3.598 0.011 . . . . . . . 264 GLY HA2 . 27498 1 934 . 1 1 82 82 GLY HA3 H 1 3.105 0.011 . . . . . . . 264 GLY HA3 . 27498 1 935 . 1 1 82 82 GLY C C 13 173.41 0.001 . . . . . . . 264 GLY C . 27498 1 936 . 1 1 82 82 GLY CA C 13 47.866 0.062 . . . . . . . 264 GLY CA . 27498 1 937 . 1 1 82 82 GLY N N 15 104.879 0.068 . . . . . . . 264 GLY N . 27498 1 938 . 1 1 83 83 TRP H H 1 8.693 0.009 . . . . . . . 265 TRP H . 27498 1 939 . 1 1 83 83 TRP HA H 1 3.838 0.006 . . . . . . . 265 TRP HA . 27498 1 940 . 1 1 83 83 TRP HB2 H 1 3.528 0.014 . . . . . . . 265 TRP HB2 . 27498 1 941 . 1 1 83 83 TRP HB3 H 1 3.398 0.007 . . . . . . . 265 TRP HB3 . 27498 1 942 . 1 1 83 83 TRP HD1 H 1 6.848 0.006 . . . . . . . 265 TRP HD1 . 27498 1 943 . 1 1 83 83 TRP HE1 H 1 10.528 0.003 . . . . . . . 265 TRP HE1 . 27498 1 944 . 1 1 83 83 TRP HE3 H 1 7.666 0.007 . . . . . . . 265 TRP HE3 . 27498 1 945 . 1 1 83 83 TRP HZ2 H 1 7.475 0.007 . . . . . . . 265 TRP HZ2 . 27498 1 946 . 1 1 83 83 TRP HZ3 H 1 7.099 0.011 . . . . . . . 265 TRP HZ3 . 27498 1 947 . 1 1 83 83 TRP HH2 H 1 7.234 0.009 . . . . . . . 265 TRP HH2 . 27498 1 948 . 1 1 83 83 TRP C C 13 179.52 0.005 . . . . . . . 265 TRP C . 27498 1 949 . 1 1 83 83 TRP CA C 13 61.034 0.042 . . . . . . . 265 TRP CA . 27498 1 950 . 1 1 83 83 TRP CB C 13 29.055 0.066 . . . . . . . 265 TRP CB . 27498 1 951 . 1 1 83 83 TRP CD1 C 13 126.803 0.067 . . . . . . . 265 TRP CD1 . 27498 1 952 . 1 1 83 83 TRP CE3 C 13 120.166 0.064 . . . . . . . 265 TRP CE3 . 27498 1 953 . 1 1 83 83 TRP CZ2 C 13 114.875 0.039 . . . . . . . 265 TRP CZ2 . 27498 1 954 . 1 1 83 83 TRP CZ3 C 13 121.693 0 . . . . . . . 265 TRP CZ3 . 27498 1 955 . 1 1 83 83 TRP CH2 C 13 124.679 0.053 . . . . . . . 265 TRP CH2 . 27498 1 956 . 1 1 83 83 TRP N N 15 121.944 0.054 . . . . . . . 265 TRP N . 27498 1 957 . 1 1 83 83 TRP NE1 N 15 131.176 0.027 . . . . . . . 265 TRP NE1 . 27498 1 958 . 1 1 84 84 VAL H H 1 8.733 0.003 . . . . . . . 266 VAL H . 27498 1 959 . 1 1 84 84 VAL HA H 1 3.633 0.013 . . . . . . . 266 VAL HA . 27498 1 960 . 1 1 84 84 VAL HB H 1 2.15 0.014 . . . . . . . 266 VAL HB . 27498 1 961 . 1 1 84 84 VAL HG11 H 1 1.028 0.014 . . . . . . . 266 VAL HG1 . 27498 1 962 . 1 1 84 84 VAL HG12 H 1 1.028 0.014 . . . . . . . 266 VAL HG1 . 27498 1 963 . 1 1 84 84 VAL HG13 H 1 1.028 0.014 . . . . . . . 266 VAL HG1 . 27498 1 964 . 1 1 84 84 VAL HG21 H 1 1.207 0.01 . . . . . . . 266 VAL HG2 . 27498 1 965 . 1 1 84 84 VAL HG22 H 1 1.207 0.01 . . . . . . . 266 VAL HG2 . 27498 1 966 . 1 1 84 84 VAL HG23 H 1 1.207 0.01 . . . . . . . 266 VAL HG2 . 27498 1 967 . 1 1 84 84 VAL C C 13 178.973 0 . . . . . . . 266 VAL C . 27498 1 968 . 1 1 84 84 VAL CA C 13 66.513 0.097 . . . . . . . 266 VAL CA . 27498 1 969 . 1 1 84 84 VAL CB C 13 32.368 0.037 . . . . . . . 266 VAL CB . 27498 1 970 . 1 1 84 84 VAL CG1 C 13 23.398 0.034 . . . . . . . 266 VAL CG1 . 27498 1 971 . 1 1 84 84 VAL CG2 C 13 22.623 0.051 . . . . . . . 266 VAL CG2 . 27498 1 972 . 1 1 84 84 VAL N N 15 117.832 0.053 . . . . . . . 266 VAL N . 27498 1 973 . 1 1 85 85 ALA H H 1 9.235 0.003 . . . . . . . 267 ALA H . 27498 1 974 . 1 1 85 85 ALA HA H 1 3.581 0.012 . . . . . . . 267 ALA HA . 27498 1 975 . 1 1 85 85 ALA HB1 H 1 -0.06 0.009 . . . . . . . 267 ALA HB . 27498 1 976 . 1 1 85 85 ALA HB2 H 1 -0.06 0.009 . . . . . . . 267 ALA HB . 27498 1 977 . 1 1 85 85 ALA HB3 H 1 -0.06 0.009 . . . . . . . 267 ALA HB . 27498 1 978 . 1 1 85 85 ALA C C 13 179.201 0.006 . . . . . . . 267 ALA C . 27498 1 979 . 1 1 85 85 ALA CA C 13 55.161 0.087 . . . . . . . 267 ALA CA . 27498 1 980 . 1 1 85 85 ALA CB C 13 16.717 0.037 . . . . . . . 267 ALA CB . 27498 1 981 . 1 1 85 85 ALA N N 15 124.245 0.041 . . . . . . . 267 ALA N . 27498 1 982 . 1 1 86 86 LEU H H 1 8.111 0.005 . . . . . . . 268 LEU H . 27498 1 983 . 1 1 86 86 LEU HA H 1 3.88 0.015 . . . . . . . 268 LEU HA . 27498 1 984 . 1 1 86 86 LEU HB2 H 1 1.65 0.008 . . . . . . . 268 LEU HB2 . 27498 1 985 . 1 1 86 86 LEU HB3 H 1 1.618 0.007 . . . . . . . 268 LEU HB3 . 27498 1 986 . 1 1 86 86 LEU HG H 1 1.662 0.007 . . . . . . . 268 LEU HG . 27498 1 987 . 1 1 86 86 LEU HD11 H 1 0.875 0.013 . . . . . . . 268 LEU HD1 . 27498 1 988 . 1 1 86 86 LEU HD12 H 1 0.875 0.013 . . . . . . . 268 LEU HD1 . 27498 1 989 . 1 1 86 86 LEU HD13 H 1 0.875 0.013 . . . . . . . 268 LEU HD1 . 27498 1 990 . 1 1 86 86 LEU HD21 H 1 0.835 0.018 . . . . . . . 268 LEU HD2 . 27498 1 991 . 1 1 86 86 LEU HD22 H 1 0.835 0.018 . . . . . . . 268 LEU HD2 . 27498 1 992 . 1 1 86 86 LEU HD23 H 1 0.835 0.018 . . . . . . . 268 LEU HD2 . 27498 1 993 . 1 1 86 86 LEU C C 13 178.388 0.003 . . . . . . . 268 LEU C . 27498 1 994 . 1 1 86 86 LEU CA C 13 57.858 0.063 . . . . . . . 268 LEU CA . 27498 1 995 . 1 1 86 86 LEU CB C 13 41.856 0.097 . . . . . . . 268 LEU CB . 27498 1 996 . 1 1 86 86 LEU CG C 13 26.492 0.027 . . . . . . . 268 LEU CG . 27498 1 997 . 1 1 86 86 LEU CD1 C 13 24.043 0.041 . . . . . . . 268 LEU CD1 . 27498 1 998 . 1 1 86 86 LEU CD2 C 13 24.755 0.035 . . . . . . . 268 LEU CD2 . 27498 1 999 . 1 1 86 86 LEU N N 15 118.907 0.029 . . . . . . . 268 LEU N . 27498 1 1000 . 1 1 87 87 ALA H H 1 6.922 0.005 . . . . . . . 269 ALA H . 27498 1 1001 . 1 1 87 87 ALA HA H 1 4.169 0.005 . . . . . . . 269 ALA HA . 27498 1 1002 . 1 1 87 87 ALA HB1 H 1 1.326 0.009 . . . . . . . 269 ALA HB . 27498 1 1003 . 1 1 87 87 ALA HB2 H 1 1.326 0.009 . . . . . . . 269 ALA HB . 27498 1 1004 . 1 1 87 87 ALA HB3 H 1 1.326 0.009 . . . . . . . 269 ALA HB . 27498 1 1005 . 1 1 87 87 ALA C C 13 179.246 0.004 . . . . . . . 269 ALA C . 27498 1 1006 . 1 1 87 87 ALA CA C 13 53.347 0.04 . . . . . . . 269 ALA CA . 27498 1 1007 . 1 1 87 87 ALA CB C 13 19.535 0.035 . . . . . . . 269 ALA CB . 27498 1 1008 . 1 1 87 87 ALA N N 15 115.797 0.053 . . . . . . . 269 ALA N . 27498 1 1009 . 1 1 88 88 ASN H H 1 7.447 0.004 . . . . . . . 270 ASN H . 27498 1 1010 . 1 1 88 88 ASN HA H 1 4.916 0.012 . . . . . . . 270 ASN HA . 27498 1 1011 . 1 1 88 88 ASN HB2 H 1 2.777 0.007 . . . . . . . 270 ASN HB2 . 27498 1 1012 . 1 1 88 88 ASN HB3 H 1 2.47 0.015 . . . . . . . 270 ASN HB3 . 27498 1 1013 . 1 1 88 88 ASN HD21 H 1 7.79 0.008 . . . . . . . 270 ASN HD21 . 27498 1 1014 . 1 1 88 88 ASN HD22 H 1 8.139 0.003 . . . . . . . 270 ASN HD22 . 27498 1 1015 . 1 1 88 88 ASN C C 13 174.608 0 . . . . . . . 270 ASN C . 27498 1 1016 . 1 1 88 88 ASN CA C 13 55.439 0.071 . . . . . . . 270 ASN CA . 27498 1 1017 . 1 1 88 88 ASN CB C 13 44.28 0.034 . . . . . . . 270 ASN CB . 27498 1 1018 . 1 1 88 88 ASN N N 15 112.295 0.055 . . . . . . . 270 ASN N . 27498 1 1019 . 1 1 88 88 ASN ND2 N 15 117.776 0.071 . . . . . . . 270 ASN ND2 . 27498 1 1020 . 1 1 89 89 SER H H 1 8.915 0.003 . . . . . . . 271 SER H . 27498 1 1021 . 1 1 89 89 SER HA H 1 4.967 0.014 . . . . . . . 271 SER HA . 27498 1 1022 . 1 1 89 89 SER HB2 H 1 4.03 0.013 . . . . . . . 271 SER HB2 . 27498 1 1023 . 1 1 89 89 SER HB3 H 1 3.839 0.01 . . . . . . . 271 SER HB3 . 27498 1 1024 . 1 1 89 89 SER C C 13 174.432 0.035 . . . . . . . 271 SER C . 27498 1 1025 . 1 1 89 89 SER CA C 13 55.967 0.094 . . . . . . . 271 SER CA . 27498 1 1026 . 1 1 89 89 SER CB C 13 62.688 0.029 . . . . . . . 271 SER CB . 27498 1 1027 . 1 1 89 89 SER N N 15 115.055 0.046 . . . . . . . 271 SER N . 27498 1 1028 . 1 1 90 90 LYS H H 1 9 0.005 . . . . . . . 272 LYS H . 27498 1 1029 . 1 1 90 90 LYS HA H 1 3.999 0.013 . . . . . . . 272 LYS HA . 27498 1 1030 . 1 1 90 90 LYS HB2 H 1 1.859 0.016 . . . . . . . 272 LYS HB2 . 27498 1 1031 . 1 1 90 90 LYS HB3 H 1 1.835 0.011 . . . . . . . 272 LYS HB3 . 27498 1 1032 . 1 1 90 90 LYS HG2 H 1 1.512 0.008 . . . . . . . 272 LYS HG2 . 27498 1 1033 . 1 1 90 90 LYS HG3 H 1 1.512 0.008 . . . . . . . 272 LYS HG3 . 27498 1 1034 . 1 1 90 90 LYS C C 13 178.617 0.011 . . . . . . . 272 LYS C . 27498 1 1035 . 1 1 90 90 LYS CA C 13 59.036 0.175 . . . . . . . 272 LYS CA . 27498 1 1036 . 1 1 90 90 LYS CB C 13 31.738 0.025 . . . . . . . 272 LYS CB . 27498 1 1037 . 1 1 90 90 LYS CG C 13 25.012 0.074 . . . . . . . 272 LYS CG . 27498 1 1038 . 1 1 90 90 LYS CD C 13 28.632 0 . . . . . . . 272 LYS CD . 27498 1 1039 . 1 1 90 90 LYS N N 15 132.231 0.027 . . . . . . . 272 LYS N . 27498 1 1040 . 1 1 91 91 LYS H H 1 8.247 0.004 . . . . . . . 273 LYS H . 27498 1 1041 . 1 1 91 91 LYS HA H 1 3.919 0.014 . . . . . . . 273 LYS HA . 27498 1 1042 . 1 1 91 91 LYS HB2 H 1 1.892 0.011 . . . . . . . 273 LYS HB2 . 27498 1 1043 . 1 1 91 91 LYS HB3 H 1 1.767 0.01 . . . . . . . 273 LYS HB3 . 27498 1 1044 . 1 1 91 91 LYS HG2 H 1 1.485 0.008 . . . . . . . 273 LYS HG2 . 27498 1 1045 . 1 1 91 91 LYS HG3 H 1 1.485 0.008 . . . . . . . 273 LYS HG3 . 27498 1 1046 . 1 1 91 91 LYS HD2 H 1 1.38 0.008 . . . . . . . 273 LYS HD2 . 27498 1 1047 . 1 1 91 91 LYS HD3 H 1 1.38 0.008 . . . . . . . 273 LYS HD3 . 27498 1 1048 . 1 1 91 91 LYS HE2 H 1 3.244 0 . . . . . . . 273 LYS HE2 . 27498 1 1049 . 1 1 91 91 LYS HE3 H 1 3.244 0 . . . . . . . 273 LYS HE3 . 27498 1 1050 . 1 1 91 91 LYS C C 13 178.142 0.001 . . . . . . . 273 LYS C . 27498 1 1051 . 1 1 91 91 LYS CA C 13 59.352 0.069 . . . . . . . 273 LYS CA . 27498 1 1052 . 1 1 91 91 LYS CB C 13 32.365 0.074 . . . . . . . 273 LYS CB . 27498 1 1053 . 1 1 91 91 LYS CG C 13 25.201 0 . . . . . . . 273 LYS CG . 27498 1 1054 . 1 1 91 91 LYS CD C 13 29.248 0 . . . . . . . 273 LYS CD . 27498 1 1055 . 1 1 91 91 LYS N N 15 118.083 0.041 . . . . . . . 273 LYS N . 27498 1 1056 . 1 1 92 92 PHE H H 1 7.787 0.004 . . . . . . . 274 PHE H . 27498 1 1057 . 1 1 92 92 PHE HA H 1 3.416 0.013 . . . . . . . 274 PHE HA . 27498 1 1058 . 1 1 92 92 PHE HB2 H 1 2.305 0.019 . . . . . . . 274 PHE HB2 . 27498 1 1059 . 1 1 92 92 PHE HB3 H 1 2.917 0.009 . . . . . . . 274 PHE HB3 . 27498 1 1060 . 1 1 92 92 PHE HD1 H 1 6.15 0 . . . . . . . 274 PHE HD1 . 27498 1 1061 . 1 1 92 92 PHE HD2 H 1 6.15 0 . . . . . . . 274 PHE HD2 . 27498 1 1062 . 1 1 92 92 PHE C C 13 176.707 0.004 . . . . . . . 274 PHE C . 27498 1 1063 . 1 1 92 92 PHE CA C 13 61.535 0.097 . . . . . . . 274 PHE CA . 27498 1 1064 . 1 1 92 92 PHE CB C 13 39.56 0.07 . . . . . . . 274 PHE CB . 27498 1 1065 . 1 1 92 92 PHE N N 15 119.369 0.052 . . . . . . . 274 PHE N . 27498 1 1066 . 1 1 93 93 GLN H H 1 8.111 0.003 . . . . . . . 275 GLN H . 27498 1 1067 . 1 1 93 93 GLN HA H 1 3.671 0.008 . . . . . . . 275 GLN HA . 27498 1 1068 . 1 1 93 93 GLN HB2 H 1 2.347 0.012 . . . . . . . 275 GLN HB2 . 27498 1 1069 . 1 1 93 93 GLN HB3 H 1 1.986 0.009 . . . . . . . 275 GLN HB3 . 27498 1 1070 . 1 1 93 93 GLN HG2 H 1 2.797 0.011 . . . . . . . 275 GLN HG2 . 27498 1 1071 . 1 1 93 93 GLN HG3 H 1 2.542 0.007 . . . . . . . 275 GLN HG3 . 27498 1 1072 . 1 1 93 93 GLN HE21 H 1 6.947 0.003 . . . . . . . 275 GLN HE21 . 27498 1 1073 . 1 1 93 93 GLN HE22 H 1 6.62 0.004 . . . . . . . 275 GLN HE22 . 27498 1 1074 . 1 1 93 93 GLN C C 13 178.011 0.003 . . . . . . . 275 GLN C . 27498 1 1075 . 1 1 93 93 GLN CA C 13 59.126 0.186 . . . . . . . 275 GLN CA . 27498 1 1076 . 1 1 93 93 GLN CB C 13 28.061 0.062 . . . . . . . 275 GLN CB . 27498 1 1077 . 1 1 93 93 GLN CG C 13 33.919 0.078 . . . . . . . 275 GLN CG . 27498 1 1078 . 1 1 93 93 GLN N N 15 115.18 0.056 . . . . . . . 275 GLN N . 27498 1 1079 . 1 1 93 93 GLN NE2 N 15 108.556 0.076 . . . . . . . 275 GLN NE2 . 27498 1 1080 . 1 1 94 94 LEU H H 1 7.535 0.005 . . . . . . . 276 LEU H . 27498 1 1081 . 1 1 94 94 LEU HA H 1 4.093 0.013 . . . . . . . 276 LEU HA . 27498 1 1082 . 1 1 94 94 LEU HB2 H 1 1.747 0.01 . . . . . . . 276 LEU HB2 . 27498 1 1083 . 1 1 94 94 LEU HB3 H 1 1.531 0.009 . . . . . . . 276 LEU HB3 . 27498 1 1084 . 1 1 94 94 LEU HG H 1 1.927 0 . . . . . . . 276 LEU HG . 27498 1 1085 . 1 1 94 94 LEU HD11 H 1 0.846 0.004 . . . . . . . 276 LEU HD1 . 27498 1 1086 . 1 1 94 94 LEU HD12 H 1 0.846 0.004 . . . . . . . 276 LEU HD1 . 27498 1 1087 . 1 1 94 94 LEU HD13 H 1 0.846 0.004 . . . . . . . 276 LEU HD1 . 27498 1 1088 . 1 1 94 94 LEU HD21 H 1 0.847 0.006 . . . . . . . 276 LEU HD2 . 27498 1 1089 . 1 1 94 94 LEU HD22 H 1 0.847 0.006 . . . . . . . 276 LEU HD2 . 27498 1 1090 . 1 1 94 94 LEU HD23 H 1 0.847 0.006 . . . . . . . 276 LEU HD2 . 27498 1 1091 . 1 1 94 94 LEU C C 13 178.363 0.014 . . . . . . . 276 LEU C . 27498 1 1092 . 1 1 94 94 LEU CA C 13 56.693 0.043 . . . . . . . 276 LEU CA . 27498 1 1093 . 1 1 94 94 LEU CB C 13 42.404 0.047 . . . . . . . 276 LEU CB . 27498 1 1094 . 1 1 94 94 LEU CG C 13 26.809 0 . . . . . . . 276 LEU CG . 27498 1 1095 . 1 1 94 94 LEU CD1 C 13 24.739 0.11 . . . . . . . 276 LEU CD1 . 27498 1 1096 . 1 1 94 94 LEU CD2 C 13 23.406 0.036 . . . . . . . 276 LEU CD2 . 27498 1 1097 . 1 1 94 94 LEU N N 15 116.457 0.072 . . . . . . . 276 LEU N . 27498 1 1098 . 1 1 95 95 LEU H H 1 7.201 0.003 . . . . . . . 277 LEU H . 27498 1 1099 . 1 1 95 95 LEU HA H 1 3.846 0.009 . . . . . . . 277 LEU HA . 27498 1 1100 . 1 1 95 95 LEU HB2 H 1 0.695 0.012 . . . . . . . 277 LEU HB2 . 27498 1 1101 . 1 1 95 95 LEU HB3 H 1 -0.163 0.009 . . . . . . . 277 LEU HB3 . 27498 1 1102 . 1 1 95 95 LEU HG H 1 1.378 0.013 . . . . . . . 277 LEU HG . 27498 1 1103 . 1 1 95 95 LEU HD11 H 1 0.391 0.01 . . . . . . . 277 LEU HD1 . 27498 1 1104 . 1 1 95 95 LEU HD12 H 1 0.391 0.01 . . . . . . . 277 LEU HD1 . 27498 1 1105 . 1 1 95 95 LEU HD13 H 1 0.391 0.01 . . . . . . . 277 LEU HD1 . 27498 1 1106 . 1 1 95 95 LEU HD21 H 1 0.469 0.01 . . . . . . . 277 LEU HD2 . 27498 1 1107 . 1 1 95 95 LEU HD22 H 1 0.469 0.01 . . . . . . . 277 LEU HD2 . 27498 1 1108 . 1 1 95 95 LEU HD23 H 1 0.469 0.01 . . . . . . . 277 LEU HD2 . 27498 1 1109 . 1 1 95 95 LEU C C 13 177.929 0.002 . . . . . . . 277 LEU C . 27498 1 1110 . 1 1 95 95 LEU CA C 13 55.935 0.087 . . . . . . . 277 LEU CA . 27498 1 1111 . 1 1 95 95 LEU CB C 13 43.003 0.071 . . . . . . . 277 LEU CB . 27498 1 1112 . 1 1 95 95 LEU CG C 13 26.029 0.046 . . . . . . . 277 LEU CG . 27498 1 1113 . 1 1 95 95 LEU CD1 C 13 25.406 0.094 . . . . . . . 277 LEU CD1 . 27498 1 1114 . 1 1 95 95 LEU CD2 C 13 22.306 0.04 . . . . . . . 277 LEU CD2 . 27498 1 1115 . 1 1 95 95 LEU N N 15 118.659 0.048 . . . . . . . 277 LEU N . 27498 1 1116 . 1 1 96 96 VAL H H 1 7.413 0.003 . . . . . . . 278 VAL H . 27498 1 1117 . 1 1 96 96 VAL HA H 1 4.475 0.012 . . . . . . . 278 VAL HA . 27498 1 1118 . 1 1 96 96 VAL HB H 1 1.232 0.009 . . . . . . . 278 VAL HB . 27498 1 1119 . 1 1 96 96 VAL HG11 H 1 0.651 0.013 . . . . . . . 278 VAL HG1 . 27498 1 1120 . 1 1 96 96 VAL HG12 H 1 0.651 0.013 . . . . . . . 278 VAL HG1 . 27498 1 1121 . 1 1 96 96 VAL HG13 H 1 0.651 0.013 . . . . . . . 278 VAL HG1 . 27498 1 1122 . 1 1 96 96 VAL HG21 H 1 0.968 0.007 . . . . . . . 278 VAL HG2 . 27498 1 1123 . 1 1 96 96 VAL HG22 H 1 0.968 0.007 . . . . . . . 278 VAL HG2 . 27498 1 1124 . 1 1 96 96 VAL HG23 H 1 0.968 0.007 . . . . . . . 278 VAL HG2 . 27498 1 1125 . 1 1 96 96 VAL C C 13 180.638 0.006 . . . . . . . 278 VAL C . 27498 1 1126 . 1 1 96 96 VAL CA C 13 60.965 0.082 . . . . . . . 278 VAL CA . 27498 1 1127 . 1 1 96 96 VAL CB C 13 33.006 0.11 . . . . . . . 278 VAL CB . 27498 1 1128 . 1 1 96 96 VAL CG1 C 13 20.609 0.053 . . . . . . . 278 VAL CG1 . 27498 1 1129 . 1 1 96 96 VAL CG2 C 13 23.69 0.081 . . . . . . . 278 VAL CG2 . 27498 1 1130 . 1 1 96 96 VAL N N 15 119.221 0.072 . . . . . . . 278 VAL N . 27498 1 1131 . 1 1 97 97 GLU H H 1 7.571 0.005 . . . . . . . 279 GLU H . 27498 1 1132 . 1 1 97 97 GLU HA H 1 4.411 0.006 . . . . . . . 279 GLU HA . 27498 1 1133 . 1 1 97 97 GLU HB2 H 1 2.326 0.006 . . . . . . . 279 GLU HB2 . 27498 1 1134 . 1 1 97 97 GLU HB3 H 1 1.339 0.007 . . . . . . . 279 GLU HB3 . 27498 1 1135 . 1 1 97 97 GLU HG2 H 1 2.468 0.008 . . . . . . . 279 GLU HG2 . 27498 1 1136 . 1 1 97 97 GLU HG3 H 1 2.397 0.006 . . . . . . . 279 GLU HG3 . 27498 1 1137 . 1 1 97 97 GLU C C 13 176.527 0.007 . . . . . . . 279 GLU C . 27498 1 1138 . 1 1 97 97 GLU CA C 13 55.695 0.066 . . . . . . . 279 GLU CA . 27498 1 1139 . 1 1 97 97 GLU CB C 13 29.136 0.116 . . . . . . . 279 GLU CB . 27498 1 1140 . 1 1 97 97 GLU CG C 13 38.619 0.092 . . . . . . . 279 GLU CG . 27498 1 1141 . 1 1 97 97 GLU N N 15 128.804 0.052 . . . . . . . 279 GLU N . 27498 1 1142 . 1 1 98 98 ALA H H 1 8.708 0.003 . . . . . . . 280 ALA H . 27498 1 1143 . 1 1 98 98 ALA HA H 1 3.856 0.01 . . . . . . . 280 ALA HA . 27498 1 1144 . 1 1 98 98 ALA HB1 H 1 1.437 0.011 . . . . . . . 280 ALA HB . 27498 1 1145 . 1 1 98 98 ALA HB2 H 1 1.437 0.011 . . . . . . . 280 ALA HB . 27498 1 1146 . 1 1 98 98 ALA HB3 H 1 1.437 0.011 . . . . . . . 280 ALA HB . 27498 1 1147 . 1 1 98 98 ALA C C 13 179.444 0.001 . . . . . . . 280 ALA C . 27498 1 1148 . 1 1 98 98 ALA CA C 13 56.038 0.087 . . . . . . . 280 ALA CA . 27498 1 1149 . 1 1 98 98 ALA CB C 13 18.536 0.036 . . . . . . . 280 ALA CB . 27498 1 1150 . 1 1 98 98 ALA N N 15 127.944 0.033 . . . . . . . 280 ALA N . 27498 1 1151 . 1 1 99 99 ASN H H 1 8.786 0.003 . . . . . . . 281 ASN H . 27498 1 1152 . 1 1 99 99 ASN HA H 1 4.548 0.014 . . . . . . . 281 ASN HA . 27498 1 1153 . 1 1 99 99 ASN HB2 H 1 3.181 0.008 . . . . . . . 281 ASN HB2 . 27498 1 1154 . 1 1 99 99 ASN HB3 H 1 2.885 0.009 . . . . . . . 281 ASN HB3 . 27498 1 1155 . 1 1 99 99 ASN HD21 H 1 7.999 0.002 . . . . . . . 281 ASN HD21 . 27498 1 1156 . 1 1 99 99 ASN HD22 H 1 7.045 0.001 . . . . . . . 281 ASN HD22 . 27498 1 1157 . 1 1 99 99 ASN C C 13 178.883 0.011 . . . . . . . 281 ASN C . 27498 1 1158 . 1 1 99 99 ASN CA C 13 56.637 0.063 . . . . . . . 281 ASN CA . 27498 1 1159 . 1 1 99 99 ASN CB C 13 37.968 0.048 . . . . . . . 281 ASN CB . 27498 1 1160 . 1 1 99 99 ASN N N 15 118.263 0.068 . . . . . . . 281 ASN N . 27498 1 1161 . 1 1 99 99 ASN ND2 N 15 114.717 0.08 . . . . . . . 281 ASN ND2 . 27498 1 1162 . 1 1 100 100 LYS H H 1 8.532 0.003 . . . . . . . 282 LYS H . 27498 1 1163 . 1 1 100 100 LYS HA H 1 4.132 0.013 . . . . . . . 282 LYS HA . 27498 1 1164 . 1 1 100 100 LYS HB2 H 1 1.879 0.009 . . . . . . . 282 LYS HB2 . 27498 1 1165 . 1 1 100 100 LYS HB3 H 1 1.879 0.009 . . . . . . . 282 LYS HB3 . 27498 1 1166 . 1 1 100 100 LYS HG2 H 1 1.581 0.014 . . . . . . . 282 LYS HG2 . 27498 1 1167 . 1 1 100 100 LYS HG3 H 1 1.53 0 . . . . . . . 282 LYS HG3 . 27498 1 1168 . 1 1 100 100 LYS C C 13 179.733 0.01 . . . . . . . 282 LYS C . 27498 1 1169 . 1 1 100 100 LYS CA C 13 59.312 0.048 . . . . . . . 282 LYS CA . 27498 1 1170 . 1 1 100 100 LYS CB C 13 32.928 0.037 . . . . . . . 282 LYS CB . 27498 1 1171 . 1 1 100 100 LYS CG C 13 26.139 0.013 . . . . . . . 282 LYS CG . 27498 1 1172 . 1 1 100 100 LYS N N 15 121.616 0.054 . . . . . . . 282 LYS N . 27498 1 1173 . 1 1 101 101 LEU H H 1 8.615 0.002 . . . . . . . 283 LEU H . 27498 1 1174 . 1 1 101 101 LEU HA H 1 4.158 0.013 . . . . . . . 283 LEU HA . 27498 1 1175 . 1 1 101 101 LEU HB2 H 1 2.13 0.009 . . . . . . . 283 LEU HB2 . 27498 1 1176 . 1 1 101 101 LEU HB3 H 1 1.5 0.017 . . . . . . . 283 LEU HB3 . 27498 1 1177 . 1 1 101 101 LEU HG H 1 1.864 0.008 . . . . . . . 283 LEU HG . 27498 1 1178 . 1 1 101 101 LEU HD11 H 1 1.299 0.011 . . . . . . . 283 LEU HD1 . 27498 1 1179 . 1 1 101 101 LEU HD12 H 1 1.299 0.011 . . . . . . . 283 LEU HD1 . 27498 1 1180 . 1 1 101 101 LEU HD13 H 1 1.299 0.011 . . . . . . . 283 LEU HD1 . 27498 1 1181 . 1 1 101 101 LEU HD21 H 1 1.185 0.009 . . . . . . . 283 LEU HD2 . 27498 1 1182 . 1 1 101 101 LEU HD22 H 1 1.185 0.009 . . . . . . . 283 LEU HD2 . 27498 1 1183 . 1 1 101 101 LEU HD23 H 1 1.185 0.009 . . . . . . . 283 LEU HD2 . 27498 1 1184 . 1 1 101 101 LEU C C 13 177.531 0.001 . . . . . . . 283 LEU C . 27498 1 1185 . 1 1 101 101 LEU CA C 13 57.852 0.107 . . . . . . . 283 LEU CA . 27498 1 1186 . 1 1 101 101 LEU CB C 13 41.487 0.105 . . . . . . . 283 LEU CB . 27498 1 1187 . 1 1 101 101 LEU CG C 13 26.796 0.066 . . . . . . . 283 LEU CG . 27498 1 1188 . 1 1 101 101 LEU CD1 C 13 24.036 0.07 . . . . . . . 283 LEU CD1 . 27498 1 1189 . 1 1 101 101 LEU CD2 C 13 27.34 0.083 . . . . . . . 283 LEU CD2 . 27498 1 1190 . 1 1 101 101 LEU N N 15 119.768 0.046 . . . . . . . 283 LEU N . 27498 1 1191 . 1 1 102 102 ASN H H 1 8.305 0.007 . . . . . . . 284 ASN H . 27498 1 1192 . 1 1 102 102 ASN HA H 1 4.447 0.008 . . . . . . . 284 ASN HA . 27498 1 1193 . 1 1 102 102 ASN HB2 H 1 2.966 0.012 . . . . . . . 284 ASN HB2 . 27498 1 1194 . 1 1 102 102 ASN HB3 H 1 2.858 0.007 . . . . . . . 284 ASN HB3 . 27498 1 1195 . 1 1 102 102 ASN HD21 H 1 7.566 0.001 . . . . . . . 284 ASN HD21 . 27498 1 1196 . 1 1 102 102 ASN HD22 H 1 6.756 0.002 . . . . . . . 284 ASN HD22 . 27498 1 1197 . 1 1 102 102 ASN C C 13 177.391 0.008 . . . . . . . 284 ASN C . 27498 1 1198 . 1 1 102 102 ASN CA C 13 57.203 0.108 . . . . . . . 284 ASN CA . 27498 1 1199 . 1 1 102 102 ASN CB C 13 38.425 0.058 . . . . . . . 284 ASN CB . 27498 1 1200 . 1 1 102 102 ASN N N 15 118.035 0.096 . . . . . . . 284 ASN N . 27498 1 1201 . 1 1 102 102 ASN ND2 N 15 111.684 0.034 . . . . . . . 284 ASN ND2 . 27498 1 1202 . 1 1 103 103 LYS H H 1 7.315 0.003 . . . . . . . 285 LYS H . 27498 1 1203 . 1 1 103 103 LYS HA H 1 4.136 0.006 . . . . . . . 285 LYS HA . 27498 1 1204 . 1 1 103 103 LYS HB2 H 1 2.009 0.013 . . . . . . . 285 LYS HB2 . 27498 1 1205 . 1 1 103 103 LYS HB3 H 1 2.009 0.013 . . . . . . . 285 LYS HB3 . 27498 1 1206 . 1 1 103 103 LYS HG2 H 1 1.544 0.012 . . . . . . . 285 LYS HG2 . 27498 1 1207 . 1 1 103 103 LYS HG3 H 1 1.544 0.012 . . . . . . . 285 LYS HG3 . 27498 1 1208 . 1 1 103 103 LYS C C 13 178.304 0.006 . . . . . . . 285 LYS C . 27498 1 1209 . 1 1 103 103 LYS CA C 13 59.378 0.094 . . . . . . . 285 LYS CA . 27498 1 1210 . 1 1 103 103 LYS CB C 13 32.258 0.04 . . . . . . . 285 LYS CB . 27498 1 1211 . 1 1 103 103 LYS CG C 13 24.96 0.035 . . . . . . . 285 LYS CG . 27498 1 1212 . 1 1 103 103 LYS CD C 13 28.706 0 . . . . . . . 285 LYS CD . 27498 1 1213 . 1 1 103 103 LYS N N 15 119.326 0.025 . . . . . . . 285 LYS N . 27498 1 1214 . 1 1 104 104 ILE H H 1 7.908 0.003 . . . . . . . 286 ILE H . 27498 1 1215 . 1 1 104 104 ILE HA H 1 3.918 0.012 . . . . . . . 286 ILE HA . 27498 1 1216 . 1 1 104 104 ILE HB H 1 2.042 0.01 . . . . . . . 286 ILE HB . 27498 1 1217 . 1 1 104 104 ILE HG12 H 1 1.813 0.01 . . . . . . . 286 ILE HG12 . 27498 1 1218 . 1 1 104 104 ILE HG13 H 1 1.281 0.008 . . . . . . . 286 ILE HG13 . 27498 1 1219 . 1 1 104 104 ILE HG21 H 1 0.909 0.009 . . . . . . . 286 ILE HG2 . 27498 1 1220 . 1 1 104 104 ILE HG22 H 1 0.909 0.009 . . . . . . . 286 ILE HG2 . 27498 1 1221 . 1 1 104 104 ILE HG23 H 1 0.909 0.009 . . . . . . . 286 ILE HG2 . 27498 1 1222 . 1 1 104 104 ILE HD11 H 1 0.888 0.011 . . . . . . . 286 ILE HD1 . 27498 1 1223 . 1 1 104 104 ILE HD12 H 1 0.888 0.011 . . . . . . . 286 ILE HD1 . 27498 1 1224 . 1 1 104 104 ILE HD13 H 1 0.888 0.011 . . . . . . . 286 ILE HD1 . 27498 1 1225 . 1 1 104 104 ILE C C 13 178.239 0.022 . . . . . . . 286 ILE C . 27498 1 1226 . 1 1 104 104 ILE CA C 13 64.872 0.066 . . . . . . . 286 ILE CA . 27498 1 1227 . 1 1 104 104 ILE CB C 13 38.74 0.072 . . . . . . . 286 ILE CB . 27498 1 1228 . 1 1 104 104 ILE CG1 C 13 29.232 0.066 . . . . . . . 286 ILE CG1 . 27498 1 1229 . 1 1 104 104 ILE CG2 C 13 16.379 0.033 . . . . . . . 286 ILE CG2 . 27498 1 1230 . 1 1 104 104 ILE CD1 C 13 14.193 0.056 . . . . . . . 286 ILE CD1 . 27498 1 1231 . 1 1 104 104 ILE N N 15 119.743 0.037 . . . . . . . 286 ILE N . 27498 1 1232 . 1 1 105 105 MET H H 1 8.795 0.004 . . . . . . . 287 MET H . 27498 1 1233 . 1 1 105 105 MET HA H 1 4.182 0.013 . . . . . . . 287 MET HA . 27498 1 1234 . 1 1 105 105 MET HB2 H 1 2.5 0.017 . . . . . . . 287 MET HB2 . 27498 1 1235 . 1 1 105 105 MET HB3 H 1 2.292 0.018 . . . . . . . 287 MET HB3 . 27498 1 1236 . 1 1 105 105 MET HG2 H 1 2.593 0.012 . . . . . . . 287 MET HG2 . 27498 1 1237 . 1 1 105 105 MET HG3 H 1 3.101 0.008 . . . . . . . 287 MET HG3 . 27498 1 1238 . 1 1 105 105 MET HE1 H 1 2.14 0.005 . . . . . . . 287 MET HE . 27498 1 1239 . 1 1 105 105 MET HE2 H 1 2.14 0.005 . . . . . . . 287 MET HE . 27498 1 1240 . 1 1 105 105 MET HE3 H 1 2.14 0.005 . . . . . . . 287 MET HE . 27498 1 1241 . 1 1 105 105 MET C C 13 177.888 0.015 . . . . . . . 287 MET C . 27498 1 1242 . 1 1 105 105 MET CA C 13 60.43 0.092 . . . . . . . 287 MET CA . 27498 1 1243 . 1 1 105 105 MET CB C 13 33.224 0.042 . . . . . . . 287 MET CB . 27498 1 1244 . 1 1 105 105 MET CG C 13 31.816 0.107 . . . . . . . 287 MET CG . 27498 1 1245 . 1 1 105 105 MET CE C 13 16.032 0.021 . . . . . . . 287 MET CE . 27498 1 1246 . 1 1 105 105 MET N N 15 117.919 0.097 . . . . . . . 287 MET N . 27498 1 1247 . 1 1 106 106 GLN H H 1 8.027 0.009 . . . . . . . 288 GLN H . 27498 1 1248 . 1 1 106 106 GLN HA H 1 4.065 0.011 . . . . . . . 288 GLN HA . 27498 1 1249 . 1 1 106 106 GLN HB2 H 1 2.251 0.004 . . . . . . . 288 GLN HB2 . 27498 1 1250 . 1 1 106 106 GLN HB3 H 1 2.293 0.001 . . . . . . . 288 GLN HB3 . 27498 1 1251 . 1 1 106 106 GLN HG2 H 1 2.536 0.005 . . . . . . . 288 GLN HG2 . 27498 1 1252 . 1 1 106 106 GLN HG3 H 1 2.558 0.004 . . . . . . . 288 GLN HG3 . 27498 1 1253 . 1 1 106 106 GLN HE21 H 1 7.499 0.001 . . . . . . . 288 GLN HE21 . 27498 1 1254 . 1 1 106 106 GLN HE22 H 1 6.905 0 . . . . . . . 288 GLN HE22 . 27498 1 1255 . 1 1 106 106 GLN C C 13 178.565 0.004 . . . . . . . 288 GLN C . 27498 1 1256 . 1 1 106 106 GLN CA C 13 59.132 0.17 . . . . . . . 288 GLN CA . 27498 1 1257 . 1 1 106 106 GLN CB C 13 28.527 0.065 . . . . . . . 288 GLN CB . 27498 1 1258 . 1 1 106 106 GLN CG C 13 34.027 0.009 . . . . . . . 288 GLN CG . 27498 1 1259 . 1 1 106 106 GLN N N 15 117.269 0.098 . . . . . . . 288 GLN N . 27498 1 1260 . 1 1 106 106 GLN NE2 N 15 112.481 0.027 . . . . . . . 288 GLN NE2 . 27498 1 1261 . 1 1 107 107 ASP H H 1 8.336 0.005 . . . . . . . 289 ASP H . 27498 1 1262 . 1 1 107 107 ASP HA H 1 4.49 0.011 . . . . . . . 289 ASP HA . 27498 1 1263 . 1 1 107 107 ASP HB2 H 1 2.918 0.011 . . . . . . . 289 ASP HB2 . 27498 1 1264 . 1 1 107 107 ASP HB3 H 1 2.752 0.012 . . . . . . . 289 ASP HB3 . 27498 1 1265 . 1 1 107 107 ASP C C 13 179.226 0.009 . . . . . . . 289 ASP C . 27498 1 1266 . 1 1 107 107 ASP CA C 13 57.573 0.112 . . . . . . . 289 ASP CA . 27498 1 1267 . 1 1 107 107 ASP CB C 13 40.377 0.083 . . . . . . . 289 ASP CB . 27498 1 1268 . 1 1 107 107 ASP N N 15 120.127 0.097 . . . . . . . 289 ASP N . 27498 1 1269 . 1 1 108 108 ASP H H 1 8.707 0.006 . . . . . . . 290 ASP H . 27498 1 1270 . 1 1 108 108 ASP HA H 1 4.524 0.01 . . . . . . . 290 ASP HA . 27498 1 1271 . 1 1 108 108 ASP HB2 H 1 3.039 0.01 . . . . . . . 290 ASP HB2 . 27498 1 1272 . 1 1 108 108 ASP HB3 H 1 2.576 0.011 . . . . . . . 290 ASP HB3 . 27498 1 1273 . 1 1 108 108 ASP C C 13 178.939 0.008 . . . . . . . 290 ASP C . 27498 1 1274 . 1 1 108 108 ASP CA C 13 57.552 0.091 . . . . . . . 290 ASP CA . 27498 1 1275 . 1 1 108 108 ASP CB C 13 40.869 0.092 . . . . . . . 290 ASP CB . 27498 1 1276 . 1 1 108 108 ASP N N 15 121.218 0.057 . . . . . . . 290 ASP N . 27498 1 1277 . 1 1 109 109 LEU H H 1 8.432 0.005 . . . . . . . 291 LEU H . 27498 1 1278 . 1 1 109 109 LEU HA H 1 4.18 0.013 . . . . . . . 291 LEU HA . 27498 1 1279 . 1 1 109 109 LEU HB2 H 1 1.566 0.008 . . . . . . . 291 LEU HB2 . 27498 1 1280 . 1 1 109 109 LEU HB3 H 1 1.999 0.013 . . . . . . . 291 LEU HB3 . 27498 1 1281 . 1 1 109 109 LEU HG H 1 2.131 0.008 . . . . . . . 291 LEU HG . 27498 1 1282 . 1 1 109 109 LEU HD11 H 1 0.902 0.01 . . . . . . . 291 LEU HD1 . 27498 1 1283 . 1 1 109 109 LEU HD12 H 1 0.902 0.01 . . . . . . . 291 LEU HD1 . 27498 1 1284 . 1 1 109 109 LEU HD13 H 1 0.902 0.01 . . . . . . . 291 LEU HD1 . 27498 1 1285 . 1 1 109 109 LEU HD21 H 1 0.869 0.006 . . . . . . . 291 LEU HD2 . 27498 1 1286 . 1 1 109 109 LEU HD22 H 1 0.869 0.006 . . . . . . . 291 LEU HD2 . 27498 1 1287 . 1 1 109 109 LEU HD23 H 1 0.869 0.006 . . . . . . . 291 LEU HD2 . 27498 1 1288 . 1 1 109 109 LEU C C 13 179.875 0.003 . . . . . . . 291 LEU C . 27498 1 1289 . 1 1 109 109 LEU CA C 13 57.827 0.085 . . . . . . . 291 LEU CA . 27498 1 1290 . 1 1 109 109 LEU CB C 13 40.986 0.072 . . . . . . . 291 LEU CB . 27498 1 1291 . 1 1 109 109 LEU CG C 13 26.752 0.013 . . . . . . . 291 LEU CG . 27498 1 1292 . 1 1 109 109 LEU CD1 C 13 25.208 0.087 . . . . . . . 291 LEU CD1 . 27498 1 1293 . 1 1 109 109 LEU CD2 C 13 22.395 0.058 . . . . . . . 291 LEU CD2 . 27498 1 1294 . 1 1 109 109 LEU N N 15 118.926 0.022 . . . . . . . 291 LEU N . 27498 1 1295 . 1 1 110 110 ASN H H 1 8.193 0.004 . . . . . . . 292 ASN H . 27498 1 1296 . 1 1 110 110 ASN HA H 1 4.585 0.011 . . . . . . . 292 ASN HA . 27498 1 1297 . 1 1 110 110 ASN HB2 H 1 3.027 0.006 . . . . . . . 292 ASN HB2 . 27498 1 1298 . 1 1 110 110 ASN HB3 H 1 2.928 0.02 . . . . . . . 292 ASN HB3 . 27498 1 1299 . 1 1 110 110 ASN HD21 H 1 7.804 0.001 . . . . . . . 292 ASN HD21 . 27498 1 1300 . 1 1 110 110 ASN HD22 H 1 6.958 0 . . . . . . . 292 ASN HD22 . 27498 1 1301 . 1 1 110 110 ASN C C 13 177.418 0.014 . . . . . . . 292 ASN C . 27498 1 1302 . 1 1 110 110 ASN CA C 13 55.623 0.093 . . . . . . . 292 ASN CA . 27498 1 1303 . 1 1 110 110 ASN CB C 13 38.451 0.08 . . . . . . . 292 ASN CB . 27498 1 1304 . 1 1 110 110 ASN N N 15 117.836 0.096 . . . . . . . 292 ASN N . 27498 1 1305 . 1 1 110 110 ASN ND2 N 15 112.4 0.052 . . . . . . . 292 ASN ND2 . 27498 1 1306 . 1 1 111 111 ARG H H 1 8.007 0.006 . . . . . . . 293 ARG H . 27498 1 1307 . 1 1 111 111 ARG HA H 1 4.147 0.009 . . . . . . . 293 ARG HA . 27498 1 1308 . 1 1 111 111 ARG HB2 H 1 1.907 0.014 . . . . . . . 293 ARG HB2 . 27498 1 1309 . 1 1 111 111 ARG HB3 H 1 1.847 0.014 . . . . . . . 293 ARG HB3 . 27498 1 1310 . 1 1 111 111 ARG HG2 H 1 1.623 0.011 . . . . . . . 293 ARG HG2 . 27498 1 1311 . 1 1 111 111 ARG HG3 H 1 1.468 0.007 . . . . . . . 293 ARG HG3 . 27498 1 1312 . 1 1 111 111 ARG HD2 H 1 3.177 0.01 . . . . . . . 293 ARG HD2 . 27498 1 1313 . 1 1 111 111 ARG HD3 H 1 3.177 0.01 . . . . . . . 293 ARG HD3 . 27498 1 1314 . 1 1 111 111 ARG C C 13 177.774 0.011 . . . . . . . 293 ARG C . 27498 1 1315 . 1 1 111 111 ARG CA C 13 58.495 0.039 . . . . . . . 293 ARG CA . 27498 1 1316 . 1 1 111 111 ARG CB C 13 30.18 0.034 . . . . . . . 293 ARG CB . 27498 1 1317 . 1 1 111 111 ARG CG C 13 27.372 0.067 . . . . . . . 293 ARG CG . 27498 1 1318 . 1 1 111 111 ARG CD C 13 43.338 0.044 . . . . . . . 293 ARG CD . 27498 1 1319 . 1 1 111 111 ARG N N 15 119.665 0.053 . . . . . . . 293 ARG N . 27498 1 1320 . 1 1 112 112 TYR H H 1 8.083 0.006 . . . . . . . 294 TYR H . 27498 1 1321 . 1 1 112 112 TYR HA H 1 4.42 0.006 . . . . . . . 294 TYR HA . 27498 1 1322 . 1 1 112 112 TYR HB2 H 1 3.143 0.006 . . . . . . . 294 TYR HB2 . 27498 1 1323 . 1 1 112 112 TYR HB3 H 1 2.883 0.01 . . . . . . . 294 TYR HB3 . 27498 1 1324 . 1 1 112 112 TYR HD1 H 1 7.394 0.009 . . . . . . . 294 TYR HD1 . 27498 1 1325 . 1 1 112 112 TYR HD2 H 1 7.394 0.009 . . . . . . . 294 TYR HD2 . 27498 1 1326 . 1 1 112 112 TYR HE1 H 1 6.756 0.005 . . . . . . . 294 TYR HE1 . 27498 1 1327 . 1 1 112 112 TYR HE2 H 1 6.756 0.005 . . . . . . . 294 TYR HE2 . 27498 1 1328 . 1 1 112 112 TYR C C 13 175.955 0.004 . . . . . . . 294 TYR C . 27498 1 1329 . 1 1 112 112 TYR CA C 13 59.314 0.073 . . . . . . . 294 TYR CA . 27498 1 1330 . 1 1 112 112 TYR CB C 13 38.442 0.069 . . . . . . . 294 TYR CB . 27498 1 1331 . 1 1 112 112 TYR CD1 C 13 133.439 0.031 . . . . . . . 294 TYR CD1 . 27498 1 1332 . 1 1 112 112 TYR CE1 C 13 118.251 0.056 . . . . . . . 294 TYR CE1 . 27498 1 1333 . 1 1 112 112 TYR N N 15 117.508 0.068 . . . . . . . 294 TYR N . 27498 1 1334 . 1 1 113 113 ALA H H 1 7.836 0.003 . . . . . . . 295 ALA H . 27498 1 1335 . 1 1 113 113 ALA HA H 1 4.443 0.009 . . . . . . . 295 ALA HA . 27498 1 1336 . 1 1 113 113 ALA HB1 H 1 1.506 0.008 . . . . . . . 295 ALA HB . 27498 1 1337 . 1 1 113 113 ALA HB2 H 1 1.506 0.008 . . . . . . . 295 ALA HB . 27498 1 1338 . 1 1 113 113 ALA HB3 H 1 1.506 0.008 . . . . . . . 295 ALA HB . 27498 1 1339 . 1 1 113 113 ALA C C 13 177.483 0.008 . . . . . . . 295 ALA C . 27498 1 1340 . 1 1 113 113 ALA CA C 13 52.877 0.08 . . . . . . . 295 ALA CA . 27498 1 1341 . 1 1 113 113 ALA CB C 13 19.31 0.034 . . . . . . . 295 ALA CB . 27498 1 1342 . 1 1 113 113 ALA N N 15 122.607 0.017 . . . . . . . 295 ALA N . 27498 1 1343 . 1 1 114 114 SER H H 1 8.006 0.004 . . . . . . . 296 SER H . 27498 1 1344 . 1 1 114 114 SER HA H 1 4.542 0.015 . . . . . . . 296 SER HA . 27498 1 1345 . 1 1 114 114 SER HB2 H 1 3.932 0.006 . . . . . . . 296 SER HB2 . 27498 1 1346 . 1 1 114 114 SER HB3 H 1 3.932 0.006 . . . . . . . 296 SER HB3 . 27498 1 1347 . 1 1 114 114 SER C C 13 173.74 0 . . . . . . . 296 SER C . 27498 1 1348 . 1 1 114 114 SER CA C 13 58.326 0.063 . . . . . . . 296 SER CA . 27498 1 1349 . 1 1 114 114 SER CB C 13 64.114 0.084 . . . . . . . 296 SER CB . 27498 1 1350 . 1 1 114 114 SER N N 15 114.598 0.047 . . . . . . . 296 SER N . 27498 1 1351 . 1 1 115 115 SER H H 1 7.929 0.003 . . . . . . . 297 SER H . 27498 1 1352 . 1 1 115 115 SER HA H 1 4.293 0.006 . . . . . . . 297 SER HA . 27498 1 1353 . 1 1 115 115 SER HB2 H 1 3.877 0.007 . . . . . . . 297 SER HB2 . 27498 1 1354 . 1 1 115 115 SER HB3 H 1 3.877 0.007 . . . . . . . 297 SER HB3 . 27498 1 1355 . 1 1 115 115 SER C C 13 178.644 0 . . . . . . . 297 SER C . 27498 1 1356 . 1 1 115 115 SER CA C 13 60.078 0.057 . . . . . . . 297 SER CA . 27498 1 1357 . 1 1 115 115 SER CB C 13 64.854 0.051 . . . . . . . 297 SER CB . 27498 1 1358 . 1 1 115 115 SER N N 15 123.054 0.037 . . . . . . . 297 SER N . 27498 1 stop_ save_