data_34715 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34715 _Entry.Title ; Solution structure of RBM39 RRM1 bound to U1 snRNA stem loop 3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-03-22 _Entry.Accession_date 2022-03-22 _Entry.Last_release_date 2022-04-13 _Entry.Original_release_date 2022-04-13 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _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 S. Campagne S. . . . 34715 2 F. Allain F. H. . . 34715 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID RBM39 . 34715 'RNA BINDING PROTEIN' . 34715 RRM . 34715 'stem loop recognition' . 34715 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34715 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 539 34715 '15N chemical shifts' 1 34715 '1H chemical shifts' 708 34715 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2023-09-08 2022-03-22 update BMRB 'update entry citation' 34715 1 . . 2023-03-23 2022-03-22 original author 'original release' 34715 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7ZAP 'BMRB Entry Tracking System' 34715 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34715 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37666821 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Molecular basis of RNA-binding and autoregulation by the cancer-associated splicing factor RBM39 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 5366 _Citation.Page_last 5366 _Citation.Year 2023 _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 Sebastien Campagne S. . . . 34715 1 2 Daniel Jutzi D. . . . 34715 1 3 Florian Malard F. . . . 34715 1 4 Maja Matoga M. . . . 34715 1 5 Ksenija Romane K. . . . 34715 1 6 Miki Feldmuller M. . . . 34715 1 7 Martino Colombo M. . . . 34715 1 8 Marc-David Ruepp M. D. . . 34715 1 9 'Frederic H-T' Allain F. H. . . 34715 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34715 _Assembly.ID 1 _Assembly.Name 'RNA-binding protein 39/RNA Complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 34715 1 2 unit_2 2 $entity_2 B B yes . . . . . . 34715 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34715 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MIDNLTPEERDARTVFCMQL AARIRPRDLEEFFSTVGKVR DVRMISDRNSRRSKGIAYVE FVDVSSVPLAIGLTGQRVLG VPIIVQASQAEKNRAAA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 97 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10820.457 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RNA-binding region (RNP1' common 34715 1 'RRM) containing 2' common 34715 1 'isoform CRA_f' common 34715 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 1 141 MET . 34715 1 2 142 ILE . 34715 1 3 143 ASP . 34715 1 4 144 ASN . 34715 1 5 145 LEU . 34715 1 6 146 THR . 34715 1 7 147 PRO . 34715 1 8 148 GLU . 34715 1 9 149 GLU . 34715 1 10 150 ARG . 34715 1 11 151 ASP . 34715 1 12 152 ALA . 34715 1 13 153 ARG . 34715 1 14 154 THR . 34715 1 15 155 VAL . 34715 1 16 156 PHE . 34715 1 17 157 CYS . 34715 1 18 158 MET . 34715 1 19 159 GLN . 34715 1 20 160 LEU . 34715 1 21 161 ALA . 34715 1 22 162 ALA . 34715 1 23 163 ARG . 34715 1 24 164 ILE . 34715 1 25 165 ARG . 34715 1 26 166 PRO . 34715 1 27 167 ARG . 34715 1 28 168 ASP . 34715 1 29 169 LEU . 34715 1 30 170 GLU . 34715 1 31 171 GLU . 34715 1 32 172 PHE . 34715 1 33 173 PHE . 34715 1 34 174 SER . 34715 1 35 175 THR . 34715 1 36 176 VAL . 34715 1 37 177 GLY . 34715 1 38 178 LYS . 34715 1 39 179 VAL . 34715 1 40 180 ARG . 34715 1 41 181 ASP . 34715 1 42 182 VAL . 34715 1 43 183 ARG . 34715 1 44 184 MET . 34715 1 45 185 ILE . 34715 1 46 186 SER . 34715 1 47 187 ASP . 34715 1 48 188 ARG . 34715 1 49 189 ASN . 34715 1 50 190 SER . 34715 1 51 191 ARG . 34715 1 52 192 ARG . 34715 1 53 193 SER . 34715 1 54 194 LYS . 34715 1 55 195 GLY . 34715 1 56 196 ILE . 34715 1 57 197 ALA . 34715 1 58 198 TYR . 34715 1 59 199 VAL . 34715 1 60 200 GLU . 34715 1 61 201 PHE . 34715 1 62 202 VAL . 34715 1 63 203 ASP . 34715 1 64 204 VAL . 34715 1 65 205 SER . 34715 1 66 206 SER . 34715 1 67 207 VAL . 34715 1 68 208 PRO . 34715 1 69 209 LEU . 34715 1 70 210 ALA . 34715 1 71 211 ILE . 34715 1 72 212 GLY . 34715 1 73 213 LEU . 34715 1 74 214 THR . 34715 1 75 215 GLY . 34715 1 76 216 GLN . 34715 1 77 217 ARG . 34715 1 78 218 VAL . 34715 1 79 219 LEU . 34715 1 80 220 GLY . 34715 1 81 221 VAL . 34715 1 82 222 PRO . 34715 1 83 223 ILE . 34715 1 84 224 ILE . 34715 1 85 225 VAL . 34715 1 86 226 GLN . 34715 1 87 227 ALA . 34715 1 88 228 SER . 34715 1 89 229 GLN . 34715 1 90 230 ALA . 34715 1 91 231 GLU . 34715 1 92 232 LYS . 34715 1 93 233 ASN . 34715 1 94 234 ARG . 34715 1 95 235 ALA . 34715 1 96 236 ALA . 34715 1 97 237 ALA . 34715 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 34715 1 . ILE 2 2 34715 1 . ASP 3 3 34715 1 . ASN 4 4 34715 1 . LEU 5 5 34715 1 . THR 6 6 34715 1 . PRO 7 7 34715 1 . GLU 8 8 34715 1 . GLU 9 9 34715 1 . ARG 10 10 34715 1 . ASP 11 11 34715 1 . ALA 12 12 34715 1 . ARG 13 13 34715 1 . THR 14 14 34715 1 . VAL 15 15 34715 1 . PHE 16 16 34715 1 . CYS 17 17 34715 1 . MET 18 18 34715 1 . GLN 19 19 34715 1 . LEU 20 20 34715 1 . ALA 21 21 34715 1 . ALA 22 22 34715 1 . ARG 23 23 34715 1 . ILE 24 24 34715 1 . ARG 25 25 34715 1 . PRO 26 26 34715 1 . ARG 27 27 34715 1 . ASP 28 28 34715 1 . LEU 29 29 34715 1 . GLU 30 30 34715 1 . GLU 31 31 34715 1 . PHE 32 32 34715 1 . PHE 33 33 34715 1 . SER 34 34 34715 1 . THR 35 35 34715 1 . VAL 36 36 34715 1 . GLY 37 37 34715 1 . LYS 38 38 34715 1 . VAL 39 39 34715 1 . ARG 40 40 34715 1 . ASP 41 41 34715 1 . VAL 42 42 34715 1 . ARG 43 43 34715 1 . MET 44 44 34715 1 . ILE 45 45 34715 1 . SER 46 46 34715 1 . ASP 47 47 34715 1 . ARG 48 48 34715 1 . ASN 49 49 34715 1 . SER 50 50 34715 1 . ARG 51 51 34715 1 . ARG 52 52 34715 1 . SER 53 53 34715 1 . LYS 54 54 34715 1 . GLY 55 55 34715 1 . ILE 56 56 34715 1 . ALA 57 57 34715 1 . TYR 58 58 34715 1 . VAL 59 59 34715 1 . GLU 60 60 34715 1 . PHE 61 61 34715 1 . VAL 62 62 34715 1 . ASP 63 63 34715 1 . VAL 64 64 34715 1 . SER 65 65 34715 1 . SER 66 66 34715 1 . VAL 67 67 34715 1 . PRO 68 68 34715 1 . LEU 69 69 34715 1 . ALA 70 70 34715 1 . ILE 71 71 34715 1 . GLY 72 72 34715 1 . LEU 73 73 34715 1 . THR 74 74 34715 1 . GLY 75 75 34715 1 . GLN 76 76 34715 1 . ARG 77 77 34715 1 . VAL 78 78 34715 1 . LEU 79 79 34715 1 . GLY 80 80 34715 1 . VAL 81 81 34715 1 . PRO 82 82 34715 1 . ILE 83 83 34715 1 . ILE 84 84 34715 1 . VAL 85 85 34715 1 . GLN 86 86 34715 1 . ALA 87 87 34715 1 . SER 88 88 34715 1 . GLN 89 89 34715 1 . ALA 90 90 34715 1 . GLU 91 91 34715 1 . LYS 92 92 34715 1 . ASN 93 93 34715 1 . ARG 94 94 34715 1 . ALA 95 95 34715 1 . ALA 96 96 34715 1 . ALA 97 97 34715 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34715 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGGAUUUCCCCAAAUGUGGG AAACUCCC ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 28 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8954.375 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 91 G . 34715 2 2 92 G . 34715 2 3 93 G . 34715 2 4 94 A . 34715 2 5 95 U . 34715 2 6 96 U . 34715 2 7 97 U . 34715 2 8 98 C . 34715 2 9 99 C . 34715 2 10 100 C . 34715 2 11 101 C . 34715 2 12 102 A . 34715 2 13 103 A . 34715 2 14 104 A . 34715 2 15 105 U . 34715 2 16 106 G . 34715 2 17 107 U . 34715 2 18 108 G . 34715 2 19 109 G . 34715 2 20 110 G . 34715 2 21 111 A . 34715 2 22 112 A . 34715 2 23 113 A . 34715 2 24 114 C . 34715 2 25 115 U . 34715 2 26 116 C . 34715 2 27 117 C . 34715 2 28 118 C . 34715 2 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 . G 1 1 34715 2 . G 2 2 34715 2 . G 3 3 34715 2 . A 4 4 34715 2 . U 5 5 34715 2 . U 6 6 34715 2 . U 7 7 34715 2 . C 8 8 34715 2 . C 9 9 34715 2 . C 10 10 34715 2 . C 11 11 34715 2 . A 12 12 34715 2 . A 13 13 34715 2 . A 14 14 34715 2 . U 15 15 34715 2 . G 16 16 34715 2 . U 17 17 34715 2 . G 18 18 34715 2 . G 19 19 34715 2 . G 20 20 34715 2 . A 21 21 34715 2 . A 22 22 34715 2 . A 23 23 34715 2 . C 24 24 34715 2 . U 25 25 34715 2 . C 26 26 34715 2 . C 27 27 34715 2 . C 28 28 34715 2 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 34715 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'RBM39, RNPC2, hCG_38221' . 34715 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 34715 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 34715 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34715 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . 34715 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34715 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '10 mM sodium phosphate, 3 mM DTT, 1.2 mM [U-13C; U-15N] RBM39 RRM1, 1.5 mM U1 snRNA SL3, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 34715 1 2 DTT 'natural abundance' . . . . . . 3 . . mM . . . . 34715 1 3 'RBM39 RRM1' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . . 1.2 . . mM . . . . 34715 1 4 'U1 snRNA SL3' 'natural abundance' 1 $assembly 2 $entity_2 . . 1.5 . . mM . . . . 34715 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34715 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '10 mM sodium phosphate, 3 mM DTT, 1.2 mM [U-13C; U-15N] RBM39 RRM1, 1.5 mM U1 snRNA SL3, 100% D2O' _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' . . . . . . 10 . . mM . . . . 34715 2 2 DTT 'natural abundance' . . . . . . 3 . . mM . . . . 34715 2 3 'RBM39 RRM1' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . . 1.2 . . mM . . . . 34715 2 4 'U1 snRNA SL3' 'natural abundance' 1 $assembly 2 $entity_2 . . 1.5 . . mM . . . . 34715 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 34715 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '10 mM sodium phosphate, 3 mM DTT, 1.2 mM [U-13C; U-15N] RBM39 RRM1, 1.5 mM U1 snRNA SL3, 100% D2O' _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' . . . . . . 10 . . mM . . . . 34715 3 2 DTT 'natural abundance' . . . . . . 3 . . mM . . . . 34715 3 3 'RBM39 RRM1' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . . 1.2 . . mM . . . . 34715 3 4 'U1 snRNA SL3' 'natural abundance' 1 $assembly 2 $entity_2 . . 1.5 . . mM . . . . 34715 3 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 34715 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 10 . mM 34715 1 pH 5.5 0.1 pH 34715 1 pressure 1 . atm 34715 1 temperature 313 0 K 34715 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34715 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version 21 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 34715 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34715 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34715 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 3.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34715 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34715 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34715 _Software.ID 3 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 34715 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34715 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34715 _Software.ID 4 _Software.Type . _Software.Name ATNOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Thorsten Hermann' . . 34715 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 34715 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 34715 _Software.ID 5 _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' . . 34715 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 34715 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34715 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34715 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 34715 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34715 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III HD' . 900 . . . 34715 1 2 NMR_spectrometer_2 Bruker 'AVANCE NEO' . 700 . . . 34715 1 3 NMR_spectrometer_3 Bruker 'AVANCE NEO' . 600 . . . 34715 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 34715 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 5 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 6 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34715 1 7 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 8 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 10 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 11 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 13 '3D edited filtered 1H-13C NOESY HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 14 '2D 1H-1H F1f NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 15 '2D 1H-1H F2fF1F NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 16 '2D 1H-13C HSQC' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 17 '2D 1H-1H NOESY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 18 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 19 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34715 1 20 '3D 1H-13C edited-filtered NOESY HSQC' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 21 '3D HCCH-COSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 22 '3D HCCH-TOCSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34715 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34715 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 34715 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34715 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 34715 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34715 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 34715 1 2 '2D 1H-13C HSQC' . . . 34715 1 3 '3D HNCACB' . . . 34715 1 4 '3D CBCA(CO)NH' . . . 34715 1 5 '3D HNCO' . . . 34715 1 6 '3D HNCA' . . . 34715 1 7 '3D H(CCO)NH' . . . 34715 1 8 '3D C(CO)NH' . . . 34715 1 9 '3D 1H-15N NOESY' . . . 34715 1 10 '3D 1H-13C NOESY aliphatic' . . . 34715 1 11 '3D 1H-13C NOESY aromatic' . . . 34715 1 12 '3D HCCH-TOCSY' . . . 34715 1 13 '3D edited filtered 1H-13C NOESY HSQC' . . . 34715 1 14 '2D 1H-1H F1f NOESY' . . . 34715 1 15 '2D 1H-1H F2fF1F NOESY' . . . 34715 1 16 '2D 1H-13C HSQC' . . . 34715 1 17 '2D 1H-1H NOESY' . . . 34715 1 18 '3D 1H-13C NOESY aliphatic' . . . 34715 1 19 '3D 1H-13C NOESY aromatic' . . . 34715 1 20 '3D 1H-13C edited-filtered NOESY HSQC' . . . 34715 1 21 '3D HCCH-COSY' . . . 34715 1 22 '3D HCCH-TOCSY' . . . 34715 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 ILE HA H 1 4.272 0.020 . 1 . . . . A 142 ILE HA . 34715 1 2 . 1 . 1 2 2 ILE HB H 1 1.957 0.020 . 1 . . . . A 142 ILE HB . 34715 1 3 . 1 . 1 2 2 ILE HG12 H 1 1.543 0.020 . 2 . . . . A 142 ILE HG12 . 34715 1 4 . 1 . 1 2 2 ILE HG13 H 1 1.282 0.020 . 2 . . . . A 142 ILE HG13 . 34715 1 5 . 1 . 1 2 2 ILE HG21 H 1 1.010 0.020 . 1 . . . . A 142 ILE HG21 . 34715 1 6 . 1 . 1 2 2 ILE HG22 H 1 1.010 0.020 . 1 . . . . A 142 ILE HG22 . 34715 1 7 . 1 . 1 2 2 ILE HG23 H 1 1.010 0.020 . 1 . . . . A 142 ILE HG23 . 34715 1 8 . 1 . 1 2 2 ILE HD11 H 1 0.964 0.020 . 1 . . . . A 142 ILE HD11 . 34715 1 9 . 1 . 1 2 2 ILE HD12 H 1 0.964 0.020 . 1 . . . . A 142 ILE HD12 . 34715 1 10 . 1 . 1 2 2 ILE HD13 H 1 0.964 0.020 . 1 . . . . A 142 ILE HD13 . 34715 1 11 . 1 . 1 2 2 ILE C C 13 175.326 0.3 . 1 . . . . A 142 ILE C . 34715 1 12 . 1 . 1 2 2 ILE CA C 13 61.322 0.3 . 1 . . . . A 142 ILE CA . 34715 1 13 . 1 . 1 2 2 ILE CB C 13 38.719 0.3 . 1 . . . . A 142 ILE CB . 34715 1 14 . 1 . 1 2 2 ILE CG1 C 13 27.243 0.3 . 1 . . . . A 142 ILE CG1 . 34715 1 15 . 1 . 1 2 2 ILE CG2 C 13 17.471 0.3 . 1 . . . . A 142 ILE CG2 . 34715 1 16 . 1 . 1 2 2 ILE CD1 C 13 12.974 0.3 . 1 . . . . A 142 ILE CD1 . 34715 1 17 . 1 . 1 3 3 ASP HA H 1 4.655 0.020 . 1 . . . . A 143 ASP HA . 34715 1 18 . 1 . 1 3 3 ASP HB2 H 1 2.778 0.020 . 2 . . . . A 143 ASP HB2 . 34715 1 19 . 1 . 1 3 3 ASP HB3 H 1 2.703 0.020 . 2 . . . . A 143 ASP HB3 . 34715 1 20 . 1 . 1 3 3 ASP C C 13 175.624 0.3 . 1 . . . . A 143 ASP C . 34715 1 21 . 1 . 1 3 3 ASP CA C 13 54.254 0.3 . 1 . . . . A 143 ASP CA . 34715 1 22 . 1 . 1 3 3 ASP CB C 13 41.403 0.3 . 1 . . . . A 143 ASP CB . 34715 1 23 . 1 . 1 4 4 ASN HA H 1 4.811 0.020 . 1 . . . . A 144 ASN HA . 34715 1 24 . 1 . 1 4 4 ASN HB2 H 1 2.911 0.020 . 2 . . . . A 144 ASN HB2 . 34715 1 25 . 1 . 1 4 4 ASN HB3 H 1 2.835 0.020 . 2 . . . . A 144 ASN HB3 . 34715 1 26 . 1 . 1 4 4 ASN C C 13 174.858 0.3 . 1 . . . . A 144 ASN C . 34715 1 27 . 1 . 1 4 4 ASN CA C 13 53.049 0.3 . 1 . . . . A 144 ASN CA . 34715 1 28 . 1 . 1 4 4 ASN CB C 13 38.670 0.3 . 1 . . . . A 144 ASN CB . 34715 1 29 . 1 . 1 5 5 LEU HA H 1 4.655 0.020 . 1 . . . . A 145 LEU HA . 34715 1 30 . 1 . 1 5 5 LEU HB2 H 1 1.695 0.020 . 2 . . . . A 145 LEU HB2 . 34715 1 31 . 1 . 1 5 5 LEU HB3 H 1 1.611 0.020 . 2 . . . . A 145 LEU HB3 . 34715 1 32 . 1 . 1 5 5 LEU HG H 1 0.933 0.020 . 1 . . . . A 145 LEU HG . 34715 1 33 . 1 . 1 5 5 LEU HD11 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD11 . 34715 1 34 . 1 . 1 5 5 LEU HD12 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD12 . 34715 1 35 . 1 . 1 5 5 LEU HD13 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD13 . 34715 1 36 . 1 . 1 5 5 LEU HD21 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD21 . 34715 1 37 . 1 . 1 5 5 LEU HD22 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD22 . 34715 1 38 . 1 . 1 5 5 LEU HD23 H 1 0.909 0.020 . 1 . . . . A 145 LEU HD23 . 34715 1 39 . 1 . 1 5 5 LEU C C 13 177.709 0.3 . 1 . . . . A 145 LEU C . 34715 1 40 . 1 . 1 5 5 LEU CA C 13 54.655 0.3 . 1 . . . . A 145 LEU CA . 34715 1 41 . 1 . 1 5 5 LEU CB C 13 43.295 0.3 . 1 . . . . A 145 LEU CB . 34715 1 42 . 1 . 1 5 5 LEU CG C 13 25.796 0.3 . 1 . . . . A 145 LEU CG . 34715 1 43 . 1 . 1 5 5 LEU CD2 C 13 23.243 0.3 . 1 . . . . A 145 LEU CD2 . 34715 1 44 . 1 . 1 6 6 THR HA H 1 4.696 0.020 . 1 . . . . A 146 THR HA . 34715 1 45 . 1 . 1 6 6 THR HB H 1 4.737 0.020 . 1 . . . . A 146 THR HB . 34715 1 46 . 1 . 1 6 6 THR HG21 H 1 1.452 0.020 . 1 . . . . A 146 THR HG21 . 34715 1 47 . 1 . 1 6 6 THR HG22 H 1 1.452 0.020 . 1 . . . . A 146 THR HG22 . 34715 1 48 . 1 . 1 6 6 THR HG23 H 1 1.452 0.020 . 1 . . . . A 146 THR HG23 . 34715 1 49 . 1 . 1 6 6 THR CA C 13 60.451 0.3 . 1 . . . . A 146 THR CA . 34715 1 50 . 1 . 1 6 6 THR CB C 13 68.579 0.3 . 1 . . . . A 146 THR CB . 34715 1 51 . 1 . 1 6 6 THR CG2 C 13 21.974 0.3 . 1 . . . . A 146 THR CG2 . 34715 1 52 . 1 . 1 7 7 PRO HA H 1 4.251 0.020 . 1 . . . . A 147 PRO HA . 34715 1 53 . 1 . 1 7 7 PRO HB2 H 1 2.392 0.020 . 1 . . . . A 147 PRO HB2 . 34715 1 54 . 1 . 1 7 7 PRO HB3 H 1 2.392 0.020 . 1 . . . . A 147 PRO HB3 . 34715 1 55 . 1 . 1 7 7 PRO HG2 H 1 2.247 0.020 . 2 . . . . A 147 PRO HG2 . 34715 1 56 . 1 . 1 7 7 PRO HG3 H 1 2.091 0.020 . 2 . . . . A 147 PRO HG3 . 34715 1 57 . 1 . 1 7 7 PRO HD2 H 1 3.960 0.020 . 1 . . . . A 147 PRO HD2 . 34715 1 58 . 1 . 1 7 7 PRO HD3 H 1 3.960 0.020 . 1 . . . . A 147 PRO HD3 . 34715 1 59 . 1 . 1 7 7 PRO C C 13 178.611 0.3 . 1 . . . . A 147 PRO C . 34715 1 60 . 1 . 1 7 7 PRO CA C 13 65.735 0.3 . 1 . . . . A 147 PRO CA . 34715 1 61 . 1 . 1 7 7 PRO CB C 13 31.700 0.3 . 1 . . . . A 147 PRO CB . 34715 1 62 . 1 . 1 7 7 PRO CG C 13 27.791 0.3 . 1 . . . . A 147 PRO CG . 34715 1 63 . 1 . 1 7 7 PRO CD C 13 50.345 0.3 . 1 . . . . A 147 PRO CD . 34715 1 64 . 1 . 1 8 8 GLU HA H 1 4.206 0.020 . 1 . . . . A 148 GLU HA . 34715 1 65 . 1 . 1 8 8 GLU HB2 H 1 2.110 0.020 . 2 . . . . A 148 GLU HB2 . 34715 1 66 . 1 . 1 8 8 GLU HB3 H 1 2.031 0.020 . 2 . . . . A 148 GLU HB3 . 34715 1 67 . 1 . 1 8 8 GLU HG2 H 1 2.392 0.020 . 2 . . . . A 148 GLU HG2 . 34715 1 68 . 1 . 1 8 8 GLU HG3 H 1 2.506 0.020 . 2 . . . . A 148 GLU HG3 . 34715 1 69 . 1 . 1 8 8 GLU C C 13 179.596 0.3 . 1 . . . . A 148 GLU C . 34715 1 70 . 1 . 1 8 8 GLU CA C 13 59.622 0.3 . 1 . . . . A 148 GLU CA . 34715 1 71 . 1 . 1 8 8 GLU CB C 13 29.049 0.3 . 1 . . . . A 148 GLU CB . 34715 1 72 . 1 . 1 8 8 GLU CG C 13 36.775 0.3 . 1 . . . . A 148 GLU CG . 34715 1 73 . 1 . 1 9 9 GLU HA H 1 4.156 0.020 . 1 . . . . A 149 GLU HA . 34715 1 74 . 1 . 1 9 9 GLU HB2 H 1 2.050 0.020 . 2 . . . . A 149 GLU HB2 . 34715 1 75 . 1 . 1 9 9 GLU HB3 H 1 2.390 0.020 . 2 . . . . A 149 GLU HB3 . 34715 1 76 . 1 . 1 9 9 GLU HG2 H 1 2.498 0.020 . 2 . . . . A 149 GLU HG2 . 34715 1 77 . 1 . 1 9 9 GLU HG3 H 1 2.354 0.020 . 2 . . . . A 149 GLU HG3 . 34715 1 78 . 1 . 1 9 9 GLU C C 13 179.440 0.3 . 1 . . . . A 149 GLU C . 34715 1 79 . 1 . 1 9 9 GLU CA C 13 58.650 0.3 . 1 . . . . A 149 GLU CA . 34715 1 80 . 1 . 1 9 9 GLU CB C 13 30.461 0.3 . 1 . . . . A 149 GLU CB . 34715 1 81 . 1 . 1 9 9 GLU CG C 13 37.229 0.3 . 1 . . . . A 149 GLU CG . 34715 1 82 . 1 . 1 10 10 ARG HA H 1 3.980 0.020 . 1 . . . . A 150 ARG HA . 34715 1 83 . 1 . 1 10 10 ARG HB2 H 1 1.802 0.020 . 2 . . . . A 150 ARG HB2 . 34715 1 84 . 1 . 1 10 10 ARG HB3 H 1 1.907 0.020 . 2 . . . . A 150 ARG HB3 . 34715 1 85 . 1 . 1 10 10 ARG HG2 H 1 1.725 0.020 . 2 . . . . A 150 ARG HG2 . 34715 1 86 . 1 . 1 10 10 ARG HG3 H 1 1.499 0.020 . 2 . . . . A 150 ARG HG3 . 34715 1 87 . 1 . 1 10 10 ARG HD2 H 1 3.185 0.020 . 2 . . . . A 150 ARG HD2 . 34715 1 88 . 1 . 1 10 10 ARG HD3 H 1 3.150 0.020 . 2 . . . . A 150 ARG HD3 . 34715 1 89 . 1 . 1 10 10 ARG C C 13 180.220 0.3 . 1 . . . . A 150 ARG C . 34715 1 90 . 1 . 1 10 10 ARG CA C 13 59.899 0.3 . 1 . . . . A 150 ARG CA . 34715 1 91 . 1 . 1 10 10 ARG CB C 13 29.654 0.3 . 1 . . . . A 150 ARG CB . 34715 1 92 . 1 . 1 10 10 ARG CG C 13 27.694 0.3 . 1 . . . . A 150 ARG CG . 34715 1 93 . 1 . 1 10 10 ARG CD C 13 43.319 0.3 . 1 . . . . A 150 ARG CD . 34715 1 94 . 1 . 1 11 11 ASP HA H 1 4.406 0.020 . 1 . . . . A 151 ASP HA . 34715 1 95 . 1 . 1 11 11 ASP HB2 H 1 2.841 0.020 . 2 . . . . A 151 ASP HB2 . 34715 1 96 . 1 . 1 11 11 ASP HB3 H 1 2.758 0.020 . 2 . . . . A 151 ASP HB3 . 34715 1 97 . 1 . 1 11 11 ASP C C 13 178.731 0.3 . 1 . . . . A 151 ASP C . 34715 1 98 . 1 . 1 11 11 ASP CA C 13 57.797 0.3 . 1 . . . . A 151 ASP CA . 34715 1 99 . 1 . 1 11 11 ASP CB C 13 40.338 0.3 . 1 . . . . A 151 ASP CB . 34715 1 100 . 1 . 1 12 12 ALA HA H 1 4.326 0.020 . 1 . . . . A 152 ALA HA . 34715 1 101 . 1 . 1 12 12 ALA HB1 H 1 1.658 0.020 . 1 . . . . A 152 ALA HB1 . 34715 1 102 . 1 . 1 12 12 ALA HB2 H 1 1.658 0.020 . 1 . . . . A 152 ALA HB2 . 34715 1 103 . 1 . 1 12 12 ALA HB3 H 1 1.658 0.020 . 1 . . . . A 152 ALA HB3 . 34715 1 104 . 1 . 1 12 12 ALA C C 13 177.243 0.3 . 1 . . . . A 152 ALA C . 34715 1 105 . 1 . 1 12 12 ALA CA C 13 53.959 0.3 . 1 . . . . A 152 ALA CA . 34715 1 106 . 1 . 1 12 12 ALA CB C 13 18.451 0.3 . 1 . . . . A 152 ALA CB . 34715 1 107 . 1 . 1 13 13 ARG HA H 1 4.502 0.020 . 1 . . . . A 153 ARG HA . 34715 1 108 . 1 . 1 13 13 ARG HB2 H 1 1.772 0.020 . 2 . . . . A 153 ARG HB2 . 34715 1 109 . 1 . 1 13 13 ARG HB3 H 1 2.663 0.020 . 2 . . . . A 153 ARG HB3 . 34715 1 110 . 1 . 1 13 13 ARG HG2 H 1 1.969 0.020 . 2 . . . . A 153 ARG HG2 . 34715 1 111 . 1 . 1 13 13 ARG HG3 H 1 1.356 0.020 . 2 . . . . A 153 ARG HG3 . 34715 1 112 . 1 . 1 13 13 ARG HD2 H 1 3.324 0.020 . 2 . . . . A 153 ARG HD2 . 34715 1 113 . 1 . 1 13 13 ARG HD3 H 1 3.179 0.020 . 2 . . . . A 153 ARG HD3 . 34715 1 114 . 1 . 1 13 13 ARG C C 13 174.543 0.3 . 1 . . . . A 153 ARG C . 34715 1 115 . 1 . 1 13 13 ARG CA C 13 55.867 0.3 . 1 . . . . A 153 ARG CA . 34715 1 116 . 1 . 1 13 13 ARG CB C 13 30.777 0.3 . 1 . . . . A 153 ARG CB . 34715 1 117 . 1 . 1 13 13 ARG CG C 13 28.799 0.3 . 1 . . . . A 153 ARG CG . 34715 1 118 . 1 . 1 13 13 ARG CD C 13 43.532 0.3 . 1 . . . . A 153 ARG CD . 34715 1 119 . 1 . 1 14 14 THR HA H 1 5.647 0.020 . 1 . . . . A 154 THR HA . 34715 1 120 . 1 . 1 14 14 THR HB H 1 4.295 0.020 . 1 . . . . A 154 THR HB . 34715 1 121 . 1 . 1 14 14 THR HG21 H 1 1.344 0.020 . 1 . . . . A 154 THR HG21 . 34715 1 122 . 1 . 1 14 14 THR HG22 H 1 1.344 0.020 . 1 . . . . A 154 THR HG22 . 34715 1 123 . 1 . 1 14 14 THR HG23 H 1 1.344 0.020 . 1 . . . . A 154 THR HG23 . 34715 1 124 . 1 . 1 14 14 THR C C 13 174.390 0.3 . 1 . . . . A 154 THR C . 34715 1 125 . 1 . 1 14 14 THR CA C 13 62.207 0.3 . 1 . . . . A 154 THR CA . 34715 1 126 . 1 . 1 14 14 THR CB C 13 70.413 0.3 . 1 . . . . A 154 THR CB . 34715 1 127 . 1 . 1 14 14 THR CG2 C 13 21.860 0.3 . 1 . . . . A 154 THR CG2 . 34715 1 128 . 1 . 1 15 15 VAL HA H 1 5.156 0.020 . 1 . . . . A 155 VAL HA . 34715 1 129 . 1 . 1 15 15 VAL HB H 1 2.295 0.020 . 1 . . . . A 155 VAL HB . 34715 1 130 . 1 . 1 15 15 VAL HG11 H 1 1.335 0.020 . 2 . . . . A 155 VAL HG11 . 34715 1 131 . 1 . 1 15 15 VAL HG12 H 1 1.335 0.020 . 2 . . . . A 155 VAL HG12 . 34715 1 132 . 1 . 1 15 15 VAL HG13 H 1 1.335 0.020 . 2 . . . . A 155 VAL HG13 . 34715 1 133 . 1 . 1 15 15 VAL HG21 H 1 0.659 0.020 . 2 . . . . A 155 VAL HG21 . 34715 1 134 . 1 . 1 15 15 VAL HG22 H 1 0.659 0.020 . 2 . . . . A 155 VAL HG22 . 34715 1 135 . 1 . 1 15 15 VAL HG23 H 1 0.659 0.020 . 2 . . . . A 155 VAL HG23 . 34715 1 136 . 1 . 1 15 15 VAL C C 13 173.460 0.3 . 1 . . . . A 155 VAL C . 34715 1 137 . 1 . 1 15 15 VAL CA C 13 58.839 0.3 . 1 . . . . A 155 VAL CA . 34715 1 138 . 1 . 1 15 15 VAL CB C 13 33.950 0.3 . 1 . . . . A 155 VAL CB . 34715 1 139 . 1 . 1 15 15 VAL CG1 C 13 21.719 0.3 . 1 . . . . A 155 VAL CG1 . 34715 1 140 . 1 . 1 15 15 VAL CG2 C 13 18.930 0.3 . 1 . . . . A 155 VAL CG2 . 34715 1 141 . 1 . 1 16 16 PHE HA H 1 5.287 0.020 . 1 . . . . A 156 PHE HA . 34715 1 142 . 1 . 1 16 16 PHE HB2 H 1 2.820 0.020 . 2 . . . . A 156 PHE HB2 . 34715 1 143 . 1 . 1 16 16 PHE HB3 H 1 2.747 0.020 . 2 . . . . A 156 PHE HB3 . 34715 1 144 . 1 . 1 16 16 PHE HD1 H 1 6.753 0.020 . 1 . . . . A 156 PHE HD1 . 34715 1 145 . 1 . 1 16 16 PHE HD2 H 1 6.753 0.020 . 1 . . . . A 156 PHE HD2 . 34715 1 146 . 1 . 1 16 16 PHE HE1 H 1 7.176 0.020 . 1 . . . . A 156 PHE HE1 . 34715 1 147 . 1 . 1 16 16 PHE HE2 H 1 7.176 0.020 . 1 . . . . A 156 PHE HE2 . 34715 1 148 . 1 . 1 16 16 PHE C C 13 174.248 0.3 . 1 . . . . A 156 PHE C . 34715 1 149 . 1 . 1 16 16 PHE CA C 13 55.217 0.3 . 1 . . . . A 156 PHE CA . 34715 1 150 . 1 . 1 16 16 PHE CB C 13 42.224 0.3 . 1 . . . . A 156 PHE CB . 34715 1 151 . 1 . 1 16 16 PHE CD1 C 13 131.430 0.3 . 1 . . . . A 156 PHE CD1 . 34715 1 152 . 1 . 1 16 16 PHE CE1 C 13 129.545 0.3 . 1 . . . . A 156 PHE CE1 . 34715 1 153 . 1 . 1 16 16 PHE CZ C 13 131.278 0.3 . 1 . . . . A 156 PHE CZ . 34715 1 154 . 1 . 1 17 17 CYS HA H 1 5.633 0.020 . 1 . . . . A 157 CYS HA . 34715 1 155 . 1 . 1 17 17 CYS HB2 H 1 2.820 0.020 . 2 . . . . A 157 CYS HB2 . 34715 1 156 . 1 . 1 17 17 CYS HB3 H 1 2.699 0.020 . 2 . . . . A 157 CYS HB3 . 34715 1 157 . 1 . 1 17 17 CYS C C 13 172.815 0.3 . 1 . . . . A 157 CYS C . 34715 1 158 . 1 . 1 17 17 CYS CA C 13 55.902 0.3 . 1 . . . . A 157 CYS CA . 34715 1 159 . 1 . 1 17 17 CYS CB C 13 30.720 0.3 . 1 . . . . A 157 CYS CB . 34715 1 160 . 1 . 1 18 18 MET HA H 1 4.916 0.020 . 1 . . . . A 158 MET HA . 34715 1 161 . 1 . 1 18 18 MET HB2 H 1 2.113 0.020 . 2 . . . . A 158 MET HB2 . 34715 1 162 . 1 . 1 18 18 MET HB3 H 1 1.956 0.020 . 2 . . . . A 158 MET HB3 . 34715 1 163 . 1 . 1 18 18 MET HG2 H 1 2.210 0.020 . 2 . . . . A 158 MET HG2 . 34715 1 164 . 1 . 1 18 18 MET HG3 H 1 2.376 0.020 . 2 . . . . A 158 MET HG3 . 34715 1 165 . 1 . 1 18 18 MET HE1 H 1 2.114 0.020 . 1 . . . . A 158 MET HE1 . 34715 1 166 . 1 . 1 18 18 MET HE2 H 1 2.114 0.020 . 1 . . . . A 158 MET HE2 . 34715 1 167 . 1 . 1 18 18 MET HE3 H 1 2.114 0.020 . 1 . . . . A 158 MET HE3 . 34715 1 168 . 1 . 1 18 18 MET C C 13 173.454 0.3 . 1 . . . . A 158 MET C . 34715 1 169 . 1 . 1 18 18 MET CA C 13 53.932 0.3 . 1 . . . . A 158 MET CA . 34715 1 170 . 1 . 1 18 18 MET CB C 13 36.926 0.3 . 1 . . . . A 158 MET CB . 34715 1 171 . 1 . 1 18 18 MET CG C 13 32.000 0.3 . 1 . . . . A 158 MET CG . 34715 1 172 . 1 . 1 18 18 MET CE C 13 17.439 0.3 . 1 . . . . A 158 MET CE . 34715 1 173 . 1 . 1 19 19 GLN HA H 1 3.743 0.020 . 1 . . . . A 159 GLN HA . 34715 1 174 . 1 . 1 19 19 GLN HB2 H 1 2.211 0.020 . 2 . . . . A 159 GLN HB2 . 34715 1 175 . 1 . 1 19 19 GLN HB3 H 1 2.815 0.020 . 2 . . . . A 159 GLN HB3 . 34715 1 176 . 1 . 1 19 19 GLN HG2 H 1 2.125 0.020 . 2 . . . . A 159 GLN HG2 . 34715 1 177 . 1 . 1 19 19 GLN HG3 H 1 2.519 0.020 . 2 . . . . A 159 GLN HG3 . 34715 1 178 . 1 . 1 19 19 GLN C C 13 173.105 0.3 . 1 . . . . A 159 GLN C . 34715 1 179 . 1 . 1 19 19 GLN CA C 13 57.217 0.3 . 1 . . . . A 159 GLN CA . 34715 1 180 . 1 . 1 19 19 GLN CB C 13 28.008 0.3 . 1 . . . . A 159 GLN CB . 34715 1 181 . 1 . 1 19 19 GLN CG C 13 36.404 0.3 . 1 . . . . A 159 GLN CG . 34715 1 182 . 1 . 1 20 20 LEU HA H 1 4.368 0.020 . 1 . . . . A 160 LEU HA . 34715 1 183 . 1 . 1 20 20 LEU HB2 H 1 1.470 0.020 . 2 . . . . A 160 LEU HB2 . 34715 1 184 . 1 . 1 20 20 LEU HB3 H 1 1.309 0.020 . 2 . . . . A 160 LEU HB3 . 34715 1 185 . 1 . 1 20 20 LEU HG H 1 1.376 0.020 . 1 . . . . A 160 LEU HG . 34715 1 186 . 1 . 1 20 20 LEU HD11 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD11 . 34715 1 187 . 1 . 1 20 20 LEU HD12 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD12 . 34715 1 188 . 1 . 1 20 20 LEU HD13 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD13 . 34715 1 189 . 1 . 1 20 20 LEU HD21 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD21 . 34715 1 190 . 1 . 1 20 20 LEU HD22 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD22 . 34715 1 191 . 1 . 1 20 20 LEU HD23 H 1 0.629 0.020 . 1 . . . . A 160 LEU HD23 . 34715 1 192 . 1 . 1 20 20 LEU C C 13 177.421 0.3 . 1 . . . . A 160 LEU C . 34715 1 193 . 1 . 1 20 20 LEU CA C 13 52.656 0.3 . 1 . . . . A 160 LEU CA . 34715 1 194 . 1 . 1 20 20 LEU CB C 13 43.289 0.3 . 1 . . . . A 160 LEU CB . 34715 1 195 . 1 . 1 20 20 LEU CG C 13 26.879 0.3 . 1 . . . . A 160 LEU CG . 34715 1 196 . 1 . 1 20 20 LEU CD1 C 13 26.641 0.3 . 1 . . . . A 160 LEU CD1 . 34715 1 197 . 1 . 1 20 20 LEU CD2 C 13 26.486 0.3 . 1 . . . . A 160 LEU CD2 . 34715 1 198 . 1 . 1 21 21 ALA HA H 1 4.147 0.020 . 1 . . . . A 161 ALA HA . 34715 1 199 . 1 . 1 21 21 ALA HB1 H 1 1.389 0.020 . 1 . . . . A 161 ALA HB1 . 34715 1 200 . 1 . 1 21 21 ALA HB2 H 1 1.389 0.020 . 1 . . . . A 161 ALA HB2 . 34715 1 201 . 1 . 1 21 21 ALA HB3 H 1 1.389 0.020 . 1 . . . . A 161 ALA HB3 . 34715 1 202 . 1 . 1 21 21 ALA C C 13 178.558 0.3 . 1 . . . . A 161 ALA C . 34715 1 203 . 1 . 1 21 21 ALA CA C 13 52.015 0.3 . 1 . . . . A 161 ALA CA . 34715 1 204 . 1 . 1 21 21 ALA CB C 13 19.284 0.3 . 1 . . . . A 161 ALA CB . 34715 1 205 . 1 . 1 22 22 ALA HA H 1 4.181 0.020 . 1 . . . . A 162 ALA HA . 34715 1 206 . 1 . 1 22 22 ALA HB1 H 1 1.565 0.020 . 1 . . . . A 162 ALA HB1 . 34715 1 207 . 1 . 1 22 22 ALA HB2 H 1 1.565 0.020 . 1 . . . . A 162 ALA HB2 . 34715 1 208 . 1 . 1 22 22 ALA HB3 H 1 1.565 0.020 . 1 . . . . A 162 ALA HB3 . 34715 1 209 . 1 . 1 22 22 ALA C C 13 179.227 0.3 . 1 . . . . A 162 ALA C . 34715 1 210 . 1 . 1 22 22 ALA CA C 13 54.796 0.3 . 1 . . . . A 162 ALA CA . 34715 1 211 . 1 . 1 22 22 ALA CB C 13 18.683 0.3 . 1 . . . . A 162 ALA CB . 34715 1 212 . 1 . 1 23 23 ARG HA H 1 4.448 0.020 . 1 . . . . A 163 ARG HA . 34715 1 213 . 1 . 1 23 23 ARG HB2 H 1 1.908 0.020 . 2 . . . . A 163 ARG HB2 . 34715 1 214 . 1 . 1 23 23 ARG HB3 H 1 1.881 0.020 . 2 . . . . A 163 ARG HB3 . 34715 1 215 . 1 . 1 23 23 ARG HG2 H 1 1.866 0.020 . 2 . . . . A 163 ARG HG2 . 34715 1 216 . 1 . 1 23 23 ARG HG3 H 1 1.976 0.020 . 2 . . . . A 163 ARG HG3 . 34715 1 217 . 1 . 1 23 23 ARG HD2 H 1 3.261 0.020 . 2 . . . . A 163 ARG HD2 . 34715 1 218 . 1 . 1 23 23 ARG HD3 H 1 3.084 0.020 . 2 . . . . A 163 ARG HD3 . 34715 1 219 . 1 . 1 23 23 ARG C C 13 175.805 0.3 . 1 . . . . A 163 ARG C . 34715 1 220 . 1 . 1 23 23 ARG CA C 13 55.073 0.3 . 1 . . . . A 163 ARG CA . 34715 1 221 . 1 . 1 23 23 ARG CB C 13 29.681 0.3 . 1 . . . . A 163 ARG CB . 34715 1 222 . 1 . 1 23 23 ARG CG C 13 29.554 0.3 . 1 . . . . A 163 ARG CG . 34715 1 223 . 1 . 1 23 23 ARG CD C 13 43.155 0.3 . 1 . . . . A 163 ARG CD . 34715 1 224 . 1 . 1 24 24 ILE HA H 1 3.929 0.020 . 1 . . . . A 164 ILE HA . 34715 1 225 . 1 . 1 24 24 ILE HB H 1 1.924 0.020 . 1 . . . . A 164 ILE HB . 34715 1 226 . 1 . 1 24 24 ILE HG12 H 1 1.670 0.020 . 2 . . . . A 164 ILE HG12 . 34715 1 227 . 1 . 1 24 24 ILE HG13 H 1 1.400 0.020 . 2 . . . . A 164 ILE HG13 . 34715 1 228 . 1 . 1 24 24 ILE HG21 H 1 0.877 0.020 . 1 . . . . A 164 ILE HG21 . 34715 1 229 . 1 . 1 24 24 ILE HG22 H 1 0.877 0.020 . 1 . . . . A 164 ILE HG22 . 34715 1 230 . 1 . 1 24 24 ILE HG23 H 1 0.877 0.020 . 1 . . . . A 164 ILE HG23 . 34715 1 231 . 1 . 1 24 24 ILE HD11 H 1 0.914 0.020 . 1 . . . . A 164 ILE HD11 . 34715 1 232 . 1 . 1 24 24 ILE HD12 H 1 0.914 0.020 . 1 . . . . A 164 ILE HD12 . 34715 1 233 . 1 . 1 24 24 ILE HD13 H 1 0.914 0.020 . 1 . . . . A 164 ILE HD13 . 34715 1 234 . 1 . 1 24 24 ILE C C 13 173.156 0.3 . 1 . . . . A 164 ILE C . 34715 1 235 . 1 . 1 24 24 ILE CA C 13 61.591 0.3 . 1 . . . . A 164 ILE CA . 34715 1 236 . 1 . 1 24 24 ILE CB C 13 38.682 0.3 . 1 . . . . A 164 ILE CB . 34715 1 237 . 1 . 1 24 24 ILE CG1 C 13 30.177 0.3 . 1 . . . . A 164 ILE CG1 . 34715 1 238 . 1 . 1 24 24 ILE CG2 C 13 17.997 0.3 . 1 . . . . A 164 ILE CG2 . 34715 1 239 . 1 . 1 24 24 ILE CD1 C 13 15.104 0.3 . 1 . . . . A 164 ILE CD1 . 34715 1 240 . 1 . 1 25 25 ARG HA H 1 5.025 0.020 . 1 . . . . A 165 ARG HA . 34715 1 241 . 1 . 1 25 25 ARG HB2 H 1 1.742 0.020 . 2 . . . . A 165 ARG HB2 . 34715 1 242 . 1 . 1 25 25 ARG HB3 H 1 2.146 0.020 . 2 . . . . A 165 ARG HB3 . 34715 1 243 . 1 . 1 25 25 ARG HG2 H 1 1.894 0.020 . 2 . . . . A 165 ARG HG2 . 34715 1 244 . 1 . 1 25 25 ARG HG3 H 1 1.915 0.020 . 2 . . . . A 165 ARG HG3 . 34715 1 245 . 1 . 1 25 25 ARG HD2 H 1 3.283 0.020 . 2 . . . . A 165 ARG HD2 . 34715 1 246 . 1 . 1 25 25 ARG HD3 H 1 3.451 0.020 . 2 . . . . A 165 ARG HD3 . 34715 1 247 . 1 . 1 25 25 ARG CA C 13 52.828 0.3 . 1 . . . . A 165 ARG CA . 34715 1 248 . 1 . 1 25 25 ARG CB C 13 30.927 0.3 . 1 . . . . A 165 ARG CB . 34715 1 249 . 1 . 1 25 25 ARG CG C 13 26.050 0.3 . 1 . . . . A 165 ARG CG . 34715 1 250 . 1 . 1 25 25 ARG CD C 13 42.885 0.3 . 1 . . . . A 165 ARG CD . 34715 1 251 . 1 . 1 26 26 PRO HA H 1 4.144 0.020 . 1 . . . . A 166 PRO HA . 34715 1 252 . 1 . 1 26 26 PRO HB2 H 1 2.165 0.020 . 2 . . . . A 166 PRO HB2 . 34715 1 253 . 1 . 1 26 26 PRO HB3 H 1 2.020 0.020 . 2 . . . . A 166 PRO HB3 . 34715 1 254 . 1 . 1 26 26 PRO HG2 H 1 1.804 0.020 . 2 . . . . A 166 PRO HG2 . 34715 1 255 . 1 . 1 26 26 PRO HG3 H 1 1.906 0.020 . 2 . . . . A 166 PRO HG3 . 34715 1 256 . 1 . 1 26 26 PRO HD2 H 1 4.005 0.020 . 2 . . . . A 166 PRO HD2 . 34715 1 257 . 1 . 1 26 26 PRO HD3 H 1 3.904 0.020 . 2 . . . . A 166 PRO HD3 . 34715 1 258 . 1 . 1 26 26 PRO C C 13 178.558 0.3 . 1 . . . . A 166 PRO C . 34715 1 259 . 1 . 1 26 26 PRO CA C 13 66.801 0.3 . 1 . . . . A 166 PRO CA . 34715 1 260 . 1 . 1 26 26 PRO CB C 13 31.344 0.3 . 1 . . . . A 166 PRO CB . 34715 1 261 . 1 . 1 26 26 PRO CG C 13 29.781 0.3 . 1 . . . . A 166 PRO CG . 34715 1 262 . 1 . 1 26 26 PRO CD C 13 50.124 0.3 . 1 . . . . A 166 PRO CD . 34715 1 263 . 1 . 1 27 27 ARG HA H 1 4.317 0.020 . 1 . . . . A 167 ARG HA . 34715 1 264 . 1 . 1 27 27 ARG HB2 H 1 2.252 0.020 . 2 . . . . A 167 ARG HB2 . 34715 1 265 . 1 . 1 27 27 ARG HB3 H 1 2.054 0.020 . 2 . . . . A 167 ARG HB3 . 34715 1 266 . 1 . 1 27 27 ARG HG2 H 1 1.752 0.020 . 2 . . . . A 167 ARG HG2 . 34715 1 267 . 1 . 1 27 27 ARG HG3 H 1 1.713 0.020 . 2 . . . . A 167 ARG HG3 . 34715 1 268 . 1 . 1 27 27 ARG HD2 H 1 3.235 0.020 . 2 . . . . A 167 ARG HD2 . 34715 1 269 . 1 . 1 27 27 ARG HD3 H 1 3.307 0.020 . 2 . . . . A 167 ARG HD3 . 34715 1 270 . 1 . 1 27 27 ARG C C 13 178.061 0.3 . 1 . . . . A 167 ARG C . 34715 1 271 . 1 . 1 27 27 ARG CA C 13 58.485 0.3 . 1 . . . . A 167 ARG CA . 34715 1 272 . 1 . 1 27 27 ARG CB C 13 29.635 0.3 . 1 . . . . A 167 ARG CB . 34715 1 273 . 1 . 1 27 27 ARG CG C 13 26.235 0.3 . 1 . . . . A 167 ARG CG . 34715 1 274 . 1 . 1 27 27 ARG CD C 13 43.094 0.3 . 1 . . . . A 167 ARG CD . 34715 1 275 . 1 . 1 28 28 ASP HA H 1 4.426 0.020 . 1 . . . . A 168 ASP HA . 34715 1 276 . 1 . 1 28 28 ASP HB2 H 1 2.984 0.020 . 2 . . . . A 168 ASP HB2 . 34715 1 277 . 1 . 1 28 28 ASP HB3 H 1 2.536 0.020 . 2 . . . . A 168 ASP HB3 . 34715 1 278 . 1 . 1 28 28 ASP C C 13 179.926 0.3 . 1 . . . . A 168 ASP C . 34715 1 279 . 1 . 1 28 28 ASP CA C 13 57.797 0.3 . 1 . . . . A 168 ASP CA . 34715 1 280 . 1 . 1 28 28 ASP CB C 13 41.650 0.3 . 1 . . . . A 168 ASP CB . 34715 1 281 . 1 . 1 29 29 LEU HA H 1 4.239 0.020 . 1 . . . . A 169 LEU HA . 34715 1 282 . 1 . 1 29 29 LEU HB2 H 1 1.597 0.020 . 1 . . . . A 169 LEU HB2 . 34715 1 283 . 1 . 1 29 29 LEU HB3 H 1 1.597 0.020 . 1 . . . . A 169 LEU HB3 . 34715 1 284 . 1 . 1 29 29 LEU HG H 1 1.678 0.020 . 1 . . . . A 169 LEU HG . 34715 1 285 . 1 . 1 29 29 LEU HD11 H 1 0.886 0.020 . 2 . . . . A 169 LEU HD11 . 34715 1 286 . 1 . 1 29 29 LEU HD12 H 1 0.886 0.020 . 2 . . . . A 169 LEU HD12 . 34715 1 287 . 1 . 1 29 29 LEU HD13 H 1 0.886 0.020 . 2 . . . . A 169 LEU HD13 . 34715 1 288 . 1 . 1 29 29 LEU HD21 H 1 0.813 0.020 . 2 . . . . A 169 LEU HD21 . 34715 1 289 . 1 . 1 29 29 LEU HD22 H 1 0.813 0.020 . 2 . . . . A 169 LEU HD22 . 34715 1 290 . 1 . 1 29 29 LEU HD23 H 1 0.813 0.020 . 2 . . . . A 169 LEU HD23 . 34715 1 291 . 1 . 1 29 29 LEU C C 13 178.254 0.3 . 1 . . . . A 169 LEU C . 34715 1 292 . 1 . 1 29 29 LEU CA C 13 57.086 0.3 . 1 . . . . A 169 LEU CA . 34715 1 293 . 1 . 1 29 29 LEU CB C 13 41.999 0.3 . 1 . . . . A 169 LEU CB . 34715 1 294 . 1 . 1 29 29 LEU CG C 13 26.937 0.3 . 1 . . . . A 169 LEU CG . 34715 1 295 . 1 . 1 29 29 LEU CD1 C 13 22.875 0.3 . 1 . . . . A 169 LEU CD1 . 34715 1 296 . 1 . 1 29 29 LEU CD2 C 13 25.968 0.3 . 1 . . . . A 169 LEU CD2 . 34715 1 297 . 1 . 1 30 30 GLU HA H 1 3.874 0.020 . 1 . . . . A 170 GLU HA . 34715 1 298 . 1 . 1 30 30 GLU HB2 H 1 2.297 0.020 . 2 . . . . A 170 GLU HB2 . 34715 1 299 . 1 . 1 30 30 GLU HB3 H 1 2.191 0.020 . 2 . . . . A 170 GLU HB3 . 34715 1 300 . 1 . 1 30 30 GLU HG2 H 1 2.319 0.020 . 2 . . . . A 170 GLU HG2 . 34715 1 301 . 1 . 1 30 30 GLU HG3 H 1 2.178 0.020 . 2 . . . . A 170 GLU HG3 . 34715 1 302 . 1 . 1 30 30 GLU C C 13 179.162 0.3 . 1 . . . . A 170 GLU C . 34715 1 303 . 1 . 1 30 30 GLU CA C 13 60.483 0.3 . 1 . . . . A 170 GLU CA . 34715 1 304 . 1 . 1 30 30 GLU CB C 13 29.654 0.3 . 1 . . . . A 170 GLU CB . 34715 1 305 . 1 . 1 30 30 GLU CG C 13 36.191 0.3 . 1 . . . . A 170 GLU CG . 34715 1 306 . 1 . 1 31 31 GLU HA H 1 4.153 0.020 . 1 . . . . A 171 GLU HA . 34715 1 307 . 1 . 1 31 31 GLU HB2 H 1 2.258 0.020 . 2 . . . . A 171 GLU HB2 . 34715 1 308 . 1 . 1 31 31 GLU HB3 H 1 2.200 0.020 . 2 . . . . A 171 GLU HB3 . 34715 1 309 . 1 . 1 31 31 GLU HG2 H 1 2.382 0.020 . 2 . . . . A 171 GLU HG2 . 34715 1 310 . 1 . 1 31 31 GLU HG3 H 1 2.584 0.020 . 2 . . . . A 171 GLU HG3 . 34715 1 311 . 1 . 1 31 31 GLU C C 13 179.290 0.3 . 1 . . . . A 171 GLU C . 34715 1 312 . 1 . 1 31 31 GLU CA C 13 59.598 0.3 . 1 . . . . A 171 GLU CA . 34715 1 313 . 1 . 1 31 31 GLU CB C 13 29.747 0.3 . 1 . . . . A 171 GLU CB . 34715 1 314 . 1 . 1 31 31 GLU CG C 13 36.225 0.3 . 1 . . . . A 171 GLU CG . 34715 1 315 . 1 . 1 32 32 PHE HA H 1 4.422 0.020 . 1 . . . . A 172 PHE HA . 34715 1 316 . 1 . 1 32 32 PHE HB2 H 1 3.339 0.020 . 2 . . . . A 172 PHE HB2 . 34715 1 317 . 1 . 1 32 32 PHE HB3 H 1 2.759 0.020 . 2 . . . . A 172 PHE HB3 . 34715 1 318 . 1 . 1 32 32 PHE HD1 H 1 6.347 0.020 . 1 . . . . A 172 PHE HD1 . 34715 1 319 . 1 . 1 32 32 PHE HD2 H 1 6.347 0.020 . 1 . . . . A 172 PHE HD2 . 34715 1 320 . 1 . 1 32 32 PHE HE1 H 1 6.843 0.020 . 1 . . . . A 172 PHE HE1 . 34715 1 321 . 1 . 1 32 32 PHE HE2 H 1 6.843 0.020 . 1 . . . . A 172 PHE HE2 . 34715 1 322 . 1 . 1 32 32 PHE HZ H 1 7.539 0.020 . 1 . . . . A 172 PHE HZ . 34715 1 323 . 1 . 1 32 32 PHE C C 13 176.872 0.3 . 1 . . . . A 172 PHE C . 34715 1 324 . 1 . 1 32 32 PHE CA C 13 61.186 0.3 . 1 . . . . A 172 PHE CA . 34715 1 325 . 1 . 1 32 32 PHE CB C 13 40.005 0.3 . 1 . . . . A 172 PHE CB . 34715 1 326 . 1 . 1 32 32 PHE CD1 C 13 131.238 0.3 . 1 . . . . A 172 PHE CD1 . 34715 1 327 . 1 . 1 32 32 PHE CE1 C 13 131.278 0.3 . 1 . . . . A 172 PHE CE1 . 34715 1 328 . 1 . 1 32 32 PHE CZ C 13 130.340 0.3 . 1 . . . . A 172 PHE CZ . 34715 1 329 . 1 . 1 33 33 PHE HA H 1 4.300 0.020 . 1 . . . . A 173 PHE HA . 34715 1 330 . 1 . 1 33 33 PHE HB2 H 1 3.556 0.020 . 2 . . . . A 173 PHE HB2 . 34715 1 331 . 1 . 1 33 33 PHE HB3 H 1 2.883 0.020 . 2 . . . . A 173 PHE HB3 . 34715 1 332 . 1 . 1 33 33 PHE HD1 H 1 7.488 0.020 . 1 . . . . A 173 PHE HD1 . 34715 1 333 . 1 . 1 33 33 PHE HD2 H 1 7.488 0.020 . 1 . . . . A 173 PHE HD2 . 34715 1 334 . 1 . 1 33 33 PHE HE1 H 1 6.705 0.020 . 1 . . . . A 173 PHE HE1 . 34715 1 335 . 1 . 1 33 33 PHE HE2 H 1 6.705 0.020 . 1 . . . . A 173 PHE HE2 . 34715 1 336 . 1 . 1 33 33 PHE HZ H 1 7.597 0.020 . 1 . . . . A 173 PHE HZ . 34715 1 337 . 1 . 1 33 33 PHE C C 13 176.977 0.3 . 1 . . . . A 173 PHE C . 34715 1 338 . 1 . 1 33 33 PHE CA C 13 61.410 0.3 . 1 . . . . A 173 PHE CA . 34715 1 339 . 1 . 1 33 33 PHE CB C 13 38.741 0.3 . 1 . . . . A 173 PHE CB . 34715 1 340 . 1 . 1 33 33 PHE CD1 C 13 131.803 0.3 . 1 . . . . A 173 PHE CD1 . 34715 1 341 . 1 . 1 33 33 PHE CE1 C 13 129.050 0.3 . 1 . . . . A 173 PHE CE1 . 34715 1 342 . 1 . 1 33 33 PHE CZ C 13 131.674 0.3 . 1 . . . . A 173 PHE CZ . 34715 1 343 . 1 . 1 34 34 SER HA H 1 5.189 0.020 . 1 . . . . A 174 SER HA . 34715 1 344 . 1 . 1 34 34 SER HB2 H 1 4.307 0.020 . 2 . . . . A 174 SER HB2 . 34715 1 345 . 1 . 1 34 34 SER HB3 H 1 4.237 0.020 . 2 . . . . A 174 SER HB3 . 34715 1 346 . 1 . 1 34 34 SER C C 13 175.094 0.3 . 1 . . . . A 174 SER C . 34715 1 347 . 1 . 1 34 34 SER CA C 13 61.482 0.3 . 1 . . . . A 174 SER CA . 34715 1 348 . 1 . 1 34 34 SER CB C 13 63.105 0.3 . 1 . . . . A 174 SER CB . 34715 1 349 . 1 . 1 35 35 THR HA H 1 4.219 0.020 . 1 . . . . A 175 THR HA . 34715 1 350 . 1 . 1 35 35 THR HB H 1 4.228 0.020 . 1 . . . . A 175 THR HB . 34715 1 351 . 1 . 1 35 35 THR HG21 H 1 1.369 0.020 . 1 . . . . A 175 THR HG21 . 34715 1 352 . 1 . 1 35 35 THR HG22 H 1 1.369 0.020 . 1 . . . . A 175 THR HG22 . 34715 1 353 . 1 . 1 35 35 THR HG23 H 1 1.369 0.020 . 1 . . . . A 175 THR HG23 . 34715 1 354 . 1 . 1 35 35 THR C C 13 176.071 0.3 . 1 . . . . A 175 THR C . 34715 1 355 . 1 . 1 35 35 THR CA C 13 64.053 0.3 . 1 . . . . A 175 THR CA . 34715 1 356 . 1 . 1 35 35 THR CB C 13 69.065 0.3 . 1 . . . . A 175 THR CB . 34715 1 357 . 1 . 1 35 35 THR CG2 C 13 21.477 0.3 . 1 . . . . A 175 THR CG2 . 34715 1 358 . 1 . 1 36 36 VAL HA H 1 4.675 0.020 . 1 . . . . A 176 VAL HA . 34715 1 359 . 1 . 1 36 36 VAL HB H 1 2.513 0.020 . 1 . . . . A 176 VAL HB . 34715 1 360 . 1 . 1 36 36 VAL HG11 H 1 0.871 0.020 . 2 . . . . A 176 VAL HG11 . 34715 1 361 . 1 . 1 36 36 VAL HG12 H 1 0.871 0.020 . 2 . . . . A 176 VAL HG12 . 34715 1 362 . 1 . 1 36 36 VAL HG13 H 1 0.871 0.020 . 2 . . . . A 176 VAL HG13 . 34715 1 363 . 1 . 1 36 36 VAL HG21 H 1 0.987 0.020 . 2 . . . . A 176 VAL HG21 . 34715 1 364 . 1 . 1 36 36 VAL HG22 H 1 0.987 0.020 . 2 . . . . A 176 VAL HG22 . 34715 1 365 . 1 . 1 36 36 VAL HG23 H 1 0.987 0.020 . 2 . . . . A 176 VAL HG23 . 34715 1 366 . 1 . 1 36 36 VAL C C 13 175.698 0.3 . 1 . . . . A 176 VAL C . 34715 1 367 . 1 . 1 36 36 VAL CA C 13 60.854 0.3 . 1 . . . . A 176 VAL CA . 34715 1 368 . 1 . 1 36 36 VAL CB C 13 32.436 0.3 . 1 . . . . A 176 VAL CB . 34715 1 369 . 1 . 1 36 36 VAL CG1 C 13 22.060 0.3 . 1 . . . . A 176 VAL CG1 . 34715 1 370 . 1 . 1 36 36 VAL CG2 C 13 19.219 0.3 . 1 . . . . A 176 VAL CG2 . 34715 1 371 . 1 . 1 37 37 GLY HA2 H 1 4.099 0.020 . 2 . . . . A 177 GLY HA2 . 34715 1 372 . 1 . 1 37 37 GLY HA3 H 1 4.262 0.020 . 2 . . . . A 177 GLY HA3 . 34715 1 373 . 1 . 1 37 37 GLY C C 13 170.262 0.3 . 1 . . . . A 177 GLY C . 34715 1 374 . 1 . 1 37 37 GLY CA C 13 45.330 0.3 . 1 . . . . A 177 GLY CA . 34715 1 375 . 1 . 1 38 38 LYS HA H 1 4.615 0.020 . 1 . . . . A 178 LYS HA . 34715 1 376 . 1 . 1 38 38 LYS HB2 H 1 1.906 0.020 . 2 . . . . A 178 LYS HB2 . 34715 1 377 . 1 . 1 38 38 LYS HB3 H 1 1.814 0.020 . 2 . . . . A 178 LYS HB3 . 34715 1 378 . 1 . 1 38 38 LYS C C 13 176.702 0.3 . 1 . . . . A 178 LYS C . 34715 1 379 . 1 . 1 38 38 LYS CA C 13 55.733 0.3 . 1 . . . . A 178 LYS CA . 34715 1 380 . 1 . 1 38 38 LYS CB C 13 32.707 0.3 . 1 . . . . A 178 LYS CB . 34715 1 381 . 1 . 1 38 38 LYS CG C 13 24.936 0.3 . 1 . . . . A 178 LYS CG . 34715 1 382 . 1 . 1 38 38 LYS CD C 13 29.488 0.3 . 1 . . . . A 178 LYS CD . 34715 1 383 . 1 . 1 38 38 LYS CE C 13 42.000 0.3 . 1 . . . . A 178 LYS CE . 34715 1 384 . 1 . 1 39 39 VAL HA H 1 3.801 0.020 . 1 . . . . A 179 VAL HA . 34715 1 385 . 1 . 1 39 39 VAL HB H 1 2.010 0.020 . 1 . . . . A 179 VAL HB . 34715 1 386 . 1 . 1 39 39 VAL HG11 H 1 0.878 0.020 . 2 . . . . A 179 VAL HG11 . 34715 1 387 . 1 . 1 39 39 VAL HG12 H 1 0.878 0.020 . 2 . . . . A 179 VAL HG12 . 34715 1 388 . 1 . 1 39 39 VAL HG13 H 1 0.878 0.020 . 2 . . . . A 179 VAL HG13 . 34715 1 389 . 1 . 1 39 39 VAL HG21 H 1 0.678 0.020 . 2 . . . . A 179 VAL HG21 . 34715 1 390 . 1 . 1 39 39 VAL HG22 H 1 0.678 0.020 . 2 . . . . A 179 VAL HG22 . 34715 1 391 . 1 . 1 39 39 VAL HG23 H 1 0.678 0.020 . 2 . . . . A 179 VAL HG23 . 34715 1 392 . 1 . 1 39 39 VAL C C 13 175.596 0.3 . 1 . . . . A 179 VAL C . 34715 1 393 . 1 . 1 39 39 VAL CA C 13 62.947 0.3 . 1 . . . . A 179 VAL CA . 34715 1 394 . 1 . 1 39 39 VAL CB C 13 33.018 0.3 . 1 . . . . A 179 VAL CB . 34715 1 395 . 1 . 1 39 39 VAL CG1 C 13 22.336 0.3 . 1 . . . . A 179 VAL CG1 . 34715 1 396 . 1 . 1 39 39 VAL CG2 C 13 22.388 0.3 . 1 . . . . A 179 VAL CG2 . 34715 1 397 . 1 . 1 40 40 ARG HA H 1 4.367 0.020 . 1 . . . . A 180 ARG HA . 34715 1 398 . 1 . 1 40 40 ARG HB2 H 1 1.528 0.020 . 2 . . . . A 180 ARG HB2 . 34715 1 399 . 1 . 1 40 40 ARG HB3 H 1 1.488 0.020 . 2 . . . . A 180 ARG HB3 . 34715 1 400 . 1 . 1 40 40 ARG HG2 H 1 1.583 0.020 . 2 . . . . A 180 ARG HG2 . 34715 1 401 . 1 . 1 40 40 ARG HG3 H 1 1.566 0.020 . 2 . . . . A 180 ARG HG3 . 34715 1 402 . 1 . 1 40 40 ARG HD2 H 1 3.222 0.020 . 2 . . . . A 180 ARG HD2 . 34715 1 403 . 1 . 1 40 40 ARG HD3 H 1 3.205 0.020 . 2 . . . . A 180 ARG HD3 . 34715 1 404 . 1 . 1 40 40 ARG C C 13 175.289 0.3 . 1 . . . . A 180 ARG C . 34715 1 405 . 1 . 1 40 40 ARG CA C 13 56.636 0.3 . 1 . . . . A 180 ARG CA . 34715 1 406 . 1 . 1 40 40 ARG CB C 13 31.833 0.3 . 1 . . . . A 180 ARG CB . 34715 1 407 . 1 . 1 40 40 ARG CG C 13 26.843 0.3 . 1 . . . . A 180 ARG CG . 34715 1 408 . 1 . 1 40 40 ARG CD C 13 42.848 0.3 . 1 . . . . A 180 ARG CD . 34715 1 409 . 1 . 1 41 41 ASP HA H 1 4.898 0.020 . 1 . . . . A 181 ASP HA . 34715 1 410 . 1 . 1 41 41 ASP HB2 H 1 2.564 0.020 . 2 . . . . A 181 ASP HB2 . 34715 1 411 . 1 . 1 41 41 ASP HB3 H 1 2.442 0.020 . 2 . . . . A 181 ASP HB3 . 34715 1 412 . 1 . 1 41 41 ASP C C 13 173.468 0.3 . 1 . . . . A 181 ASP C . 34715 1 413 . 1 . 1 41 41 ASP CA C 13 54.033 0.3 . 1 . . . . A 181 ASP CA . 34715 1 414 . 1 . 1 41 41 ASP CB C 13 44.917 0.3 . 1 . . . . A 181 ASP CB . 34715 1 415 . 1 . 1 42 42 VAL HA H 1 4.453 0.020 . 1 . . . . A 182 VAL HA . 34715 1 416 . 1 . 1 42 42 VAL HB H 1 2.061 0.020 . 1 . . . . A 182 VAL HB . 34715 1 417 . 1 . 1 42 42 VAL HG11 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG11 . 34715 1 418 . 1 . 1 42 42 VAL HG12 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG12 . 34715 1 419 . 1 . 1 42 42 VAL HG13 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG13 . 34715 1 420 . 1 . 1 42 42 VAL HG21 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG21 . 34715 1 421 . 1 . 1 42 42 VAL HG22 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG22 . 34715 1 422 . 1 . 1 42 42 VAL HG23 H 1 0.980 0.020 . 1 . . . . A 182 VAL HG23 . 34715 1 423 . 1 . 1 42 42 VAL C C 13 174.277 0.3 . 1 . . . . A 182 VAL C . 34715 1 424 . 1 . 1 42 42 VAL CA C 13 61.375 0.3 . 1 . . . . A 182 VAL CA . 34715 1 425 . 1 . 1 42 42 VAL CB C 13 34.843 0.3 . 1 . . . . A 182 VAL CB . 34715 1 426 . 1 . 1 42 42 VAL CG1 C 13 21.548 0.3 . 1 . . . . A 182 VAL CG1 . 34715 1 427 . 1 . 1 42 42 VAL CG2 C 13 21.718 0.3 . 1 . . . . A 182 VAL CG2 . 34715 1 428 . 1 . 1 43 43 ARG HA H 1 4.840 0.020 . 1 . . . . A 183 ARG HA . 34715 1 429 . 1 . 1 43 43 ARG HB2 H 1 1.850 0.020 . 2 . . . . A 183 ARG HB2 . 34715 1 430 . 1 . 1 43 43 ARG HB3 H 1 1.824 0.020 . 2 . . . . A 183 ARG HB3 . 34715 1 431 . 1 . 1 43 43 ARG HG2 H 1 1.568 0.020 . 2 . . . . A 183 ARG HG2 . 34715 1 432 . 1 . 1 43 43 ARG HG3 H 1 1.739 0.020 . 2 . . . . A 183 ARG HG3 . 34715 1 433 . 1 . 1 43 43 ARG HD2 H 1 3.267 0.020 . 2 . . . . A 183 ARG HD2 . 34715 1 434 . 1 . 1 43 43 ARG HD3 H 1 3.077 0.020 . 2 . . . . A 183 ARG HD3 . 34715 1 435 . 1 . 1 43 43 ARG C C 13 174.957 0.3 . 1 . . . . A 183 ARG C . 34715 1 436 . 1 . 1 43 43 ARG CA C 13 54.293 0.3 . 1 . . . . A 183 ARG CA . 34715 1 437 . 1 . 1 43 43 ARG CB C 13 32.629 0.3 . 1 . . . . A 183 ARG CB . 34715 1 438 . 1 . 1 43 43 ARG CG C 13 27.470 0.3 . 1 . . . . A 183 ARG CG . 34715 1 439 . 1 . 1 43 43 ARG CD C 13 43.062 0.3 . 1 . . . . A 183 ARG CD . 34715 1 440 . 1 . 1 44 44 MET HA H 1 4.963 0.020 . 1 . . . . A 184 MET HA . 34715 1 441 . 1 . 1 44 44 MET HB2 H 1 1.935 0.020 . 1 . . . . A 184 MET HB2 . 34715 1 442 . 1 . 1 44 44 MET HB3 H 1 1.935 0.020 . 1 . . . . A 184 MET HB3 . 34715 1 443 . 1 . 1 44 44 MET HG2 H 1 2.465 0.020 . 2 . . . . A 184 MET HG2 . 34715 1 444 . 1 . 1 44 44 MET HG3 H 1 2.262 0.020 . 2 . . . . A 184 MET HG3 . 34715 1 445 . 1 . 1 44 44 MET HE1 H 1 1.921 0.020 . 1 . . . . A 184 MET HE1 . 34715 1 446 . 1 . 1 44 44 MET HE2 H 1 1.921 0.020 . 1 . . . . A 184 MET HE2 . 34715 1 447 . 1 . 1 44 44 MET HE3 H 1 1.921 0.020 . 1 . . . . A 184 MET HE3 . 34715 1 448 . 1 . 1 44 44 MET C C 13 175.947 0.3 . 1 . . . . A 184 MET C . 34715 1 449 . 1 . 1 44 44 MET CA C 13 54.518 0.3 . 1 . . . . A 184 MET CA . 34715 1 450 . 1 . 1 44 44 MET CB C 13 33.272 0.3 . 1 . . . . A 184 MET CB . 34715 1 451 . 1 . 1 44 44 MET CG C 13 34.225 0.3 . 1 . . . . A 184 MET CG . 34715 1 452 . 1 . 1 44 44 MET CE C 13 17.015 0.3 . 1 . . . . A 184 MET CE . 34715 1 453 . 1 . 1 45 45 ILE HA H 1 4.515 0.020 . 1 . . . . A 185 ILE HA . 34715 1 454 . 1 . 1 45 45 ILE HB H 1 2.015 0.020 . 1 . . . . A 185 ILE HB . 34715 1 455 . 1 . 1 45 45 ILE HG12 H 1 1.536 0.020 . 2 . . . . A 185 ILE HG12 . 34715 1 456 . 1 . 1 45 45 ILE HG13 H 1 1.383 0.020 . 2 . . . . A 185 ILE HG13 . 34715 1 457 . 1 . 1 45 45 ILE HG21 H 1 1.000 0.020 . 1 . . . . A 185 ILE HG21 . 34715 1 458 . 1 . 1 45 45 ILE HG22 H 1 1.000 0.020 . 1 . . . . A 185 ILE HG22 . 34715 1 459 . 1 . 1 45 45 ILE HG23 H 1 1.000 0.020 . 1 . . . . A 185 ILE HG23 . 34715 1 460 . 1 . 1 45 45 ILE HD11 H 1 0.907 0.020 . 1 . . . . A 185 ILE HD11 . 34715 1 461 . 1 . 1 45 45 ILE HD12 H 1 0.907 0.020 . 1 . . . . A 185 ILE HD12 . 34715 1 462 . 1 . 1 45 45 ILE HD13 H 1 0.907 0.020 . 1 . . . . A 185 ILE HD13 . 34715 1 463 . 1 . 1 45 45 ILE C C 13 175.574 0.3 . 1 . . . . A 185 ILE C . 34715 1 464 . 1 . 1 45 45 ILE CA C 13 59.740 0.3 . 1 . . . . A 185 ILE CA . 34715 1 465 . 1 . 1 45 45 ILE CB C 13 38.645 0.3 . 1 . . . . A 185 ILE CB . 34715 1 466 . 1 . 1 45 45 ILE CG1 C 13 27.163 0.3 . 1 . . . . A 185 ILE CG1 . 34715 1 467 . 1 . 1 45 45 ILE CG2 C 13 17.512 0.3 . 1 . . . . A 185 ILE CG2 . 34715 1 468 . 1 . 1 45 45 ILE CD1 C 13 12.929 0.3 . 1 . . . . A 185 ILE CD1 . 34715 1 469 . 1 . 1 46 46 SER HA H 1 4.790 0.020 . 1 . . . . A 186 SER HA . 34715 1 470 . 1 . 1 46 46 SER HB2 H 1 3.909 0.020 . 1 . . . . A 186 SER HB2 . 34715 1 471 . 1 . 1 46 46 SER HB3 H 1 3.909 0.020 . 1 . . . . A 186 SER HB3 . 34715 1 472 . 1 . 1 46 46 SER C C 13 173.717 0.3 . 1 . . . . A 186 SER C . 34715 1 473 . 1 . 1 46 46 SER CA C 13 57.561 0.3 . 1 . . . . A 186 SER CA . 34715 1 474 . 1 . 1 46 46 SER CB C 13 64.507 0.3 . 1 . . . . A 186 SER CB . 34715 1 475 . 1 . 1 47 47 ASP HA H 1 4.692 0.020 . 1 . . . . A 187 ASP HA . 34715 1 476 . 1 . 1 47 47 ASP HB2 H 1 2.874 0.020 . 2 . . . . A 187 ASP HB2 . 34715 1 477 . 1 . 1 47 47 ASP HB3 H 1 2.713 0.020 . 2 . . . . A 187 ASP HB3 . 34715 1 478 . 1 . 1 47 47 ASP C C 13 176.856 0.3 . 1 . . . . A 187 ASP C . 34715 1 479 . 1 . 1 47 47 ASP CA C 13 54.035 0.3 . 1 . . . . A 187 ASP CA . 34715 1 480 . 1 . 1 47 47 ASP CB C 13 41.933 0.3 . 1 . . . . A 187 ASP CB . 34715 1 481 . 1 . 1 48 48 ARG HB2 H 1 1.944 0.020 . 2 . . . . A 188 ARG HB2 . 34715 1 482 . 1 . 1 48 48 ARG HB3 H 1 1.885 0.020 . 2 . . . . A 188 ARG HB3 . 34715 1 483 . 1 . 1 48 48 ARG HG2 H 1 1.718 0.020 . 1 . . . . A 188 ARG HG2 . 34715 1 484 . 1 . 1 48 48 ARG HG3 H 1 1.718 0.020 . 1 . . . . A 188 ARG HG3 . 34715 1 485 . 1 . 1 48 48 ARG HD2 H 1 3.267 0.020 . 1 . . . . A 188 ARG HD2 . 34715 1 486 . 1 . 1 48 48 ARG HD3 H 1 3.267 0.020 . 1 . . . . A 188 ARG HD3 . 34715 1 487 . 1 . 1 48 48 ARG C C 13 176.674 0.3 . 1 . . . . A 188 ARG C . 34715 1 488 . 1 . 1 48 48 ARG CA C 13 57.676 0.3 . 1 . . . . A 188 ARG CA . 34715 1 489 . 1 . 1 48 48 ARG CB C 13 29.997 0.3 . 1 . . . . A 188 ARG CB . 34715 1 490 . 1 . 1 48 48 ARG CG C 13 27.000 0.3 . 1 . . . . A 188 ARG CG . 34715 1 491 . 1 . 1 49 49 ASN HA H 1 4.699 0.020 . 1 . . . . A 189 ASN HA . 34715 1 492 . 1 . 1 49 49 ASN HB2 H 1 2.905 0.020 . 1 . . . . A 189 ASN HB2 . 34715 1 493 . 1 . 1 49 49 ASN HB3 H 1 2.905 0.020 . 1 . . . . A 189 ASN HB3 . 34715 1 494 . 1 . 1 49 49 ASN C C 13 175.432 0.3 . 1 . . . . A 189 ASN C . 34715 1 495 . 1 . 1 49 49 ASN CA C 13 53.982 0.3 . 1 . . . . A 189 ASN CA . 34715 1 496 . 1 . 1 49 49 ASN CB C 13 38.843 0.3 . 1 . . . . A 189 ASN CB . 34715 1 497 . 1 . 1 50 50 SER HA H 1 4.528 0.020 . 1 . . . . A 190 SER HA . 34715 1 498 . 1 . 1 50 50 SER HB2 H 1 3.946 0.020 . 2 . . . . A 190 SER HB2 . 34715 1 499 . 1 . 1 50 50 SER HB3 H 1 4.055 0.020 . 2 . . . . A 190 SER HB3 . 34715 1 500 . 1 . 1 50 50 SER CA C 13 57.774 0.3 . 1 . . . . A 190 SER CA . 34715 1 501 . 1 . 1 50 50 SER CB C 13 63.996 0.3 . 1 . . . . A 190 SER CB . 34715 1 502 . 1 . 1 51 51 ARG HG2 H 1 1.703 0.020 . 1 . . . . A 191 ARG HG2 . 34715 1 503 . 1 . 1 51 51 ARG HG3 H 1 1.703 0.020 . 1 . . . . A 191 ARG HG3 . 34715 1 504 . 1 . 1 51 51 ARG HD2 H 1 3.249 0.020 . 1 . . . . A 191 ARG HD2 . 34715 1 505 . 1 . 1 51 51 ARG HD3 H 1 3.249 0.020 . 1 . . . . A 191 ARG HD3 . 34715 1 506 . 1 . 1 51 51 ARG C C 13 176.418 0.3 . 1 . . . . A 191 ARG C . 34715 1 507 . 1 . 1 51 51 ARG CG C 13 27.166 0.3 . 1 . . . . A 191 ARG CG . 34715 1 508 . 1 . 1 51 51 ARG CD C 13 43.140 0.3 . 1 . . . . A 191 ARG CD . 34715 1 509 . 1 . 1 52 52 ARG HG2 H 1 1.724 0.020 . 1 . . . . A 192 ARG HG2 . 34715 1 510 . 1 . 1 52 52 ARG HG3 H 1 1.724 0.020 . 1 . . . . A 192 ARG HG3 . 34715 1 511 . 1 . 1 52 52 ARG HD2 H 1 3.279 0.020 . 1 . . . . A 192 ARG HD2 . 34715 1 512 . 1 . 1 52 52 ARG HD3 H 1 3.279 0.020 . 1 . . . . A 192 ARG HD3 . 34715 1 513 . 1 . 1 52 52 ARG C C 13 176.231 0.3 . 1 . . . . A 192 ARG C . 34715 1 514 . 1 . 1 52 52 ARG CA C 13 56.058 0.3 . 1 . . . . A 192 ARG CA . 34715 1 515 . 1 . 1 52 52 ARG CB C 13 31.123 0.3 . 1 . . . . A 192 ARG CB . 34715 1 516 . 1 . 1 52 52 ARG CG C 13 27.224 0.3 . 1 . . . . A 192 ARG CG . 34715 1 517 . 1 . 1 52 52 ARG CD C 13 43.141 0.3 . 1 . . . . A 192 ARG CD . 34715 1 518 . 1 . 1 53 53 SER HA H 1 4.598 0.020 . 1 . . . . A 193 SER HA . 34715 1 519 . 1 . 1 53 53 SER HB2 H 1 3.903 0.020 . 2 . . . . A 193 SER HB2 . 34715 1 520 . 1 . 1 53 53 SER HB3 H 1 3.975 0.020 . 2 . . . . A 193 SER HB3 . 34715 1 521 . 1 . 1 53 53 SER C C 13 174.744 0.3 . 1 . . . . A 193 SER C . 34715 1 522 . 1 . 1 53 53 SER CA C 13 58.224 0.3 . 1 . . . . A 193 SER CA . 34715 1 523 . 1 . 1 53 53 SER CB C 13 63.900 0.3 . 1 . . . . A 193 SER CB . 34715 1 524 . 1 . 1 54 54 LYS HA H 1 4.544 0.020 . 1 . . . . A 194 LYS HA . 34715 1 525 . 1 . 1 54 54 LYS C C 13 176.688 0.3 . 1 . . . . A 194 LYS C . 34715 1 526 . 1 . 1 54 54 LYS CA C 13 55.870 0.3 . 1 . . . . A 194 LYS CA . 34715 1 527 . 1 . 1 54 54 LYS CB C 13 33.255 0.3 . 1 . . . . A 194 LYS CB . 34715 1 528 . 1 . 1 54 54 LYS CG C 13 27.198 0.3 . 1 . . . . A 194 LYS CG . 34715 1 529 . 1 . 1 54 54 LYS CD C 13 28.960 0.3 . 1 . . . . A 194 LYS CD . 34715 1 530 . 1 . 1 55 55 GLY HA2 H 1 3.963 0.020 . 2 . . . . A 195 GLY HA2 . 34715 1 531 . 1 . 1 55 55 GLY HA3 H 1 4.099 0.020 . 2 . . . . A 195 GLY HA3 . 34715 1 532 . 1 . 1 55 55 GLY C C 13 172.607 0.3 . 1 . . . . A 195 GLY C . 34715 1 533 . 1 . 1 55 55 GLY CA C 13 45.240 0.3 . 1 . . . . A 195 GLY CA . 34715 1 534 . 1 . 1 56 56 ILE HA H 1 5.054 0.020 . 1 . . . . A 196 ILE HA . 34715 1 535 . 1 . 1 56 56 ILE HB H 1 1.731 0.020 . 1 . . . . A 196 ILE HB . 34715 1 536 . 1 . 1 56 56 ILE HG12 H 1 1.181 0.020 . 2 . . . . A 196 ILE HG12 . 34715 1 537 . 1 . 1 56 56 ILE HG13 H 1 1.517 0.020 . 2 . . . . A 196 ILE HG13 . 34715 1 538 . 1 . 1 56 56 ILE HG21 H 1 0.957 0.020 . 1 . . . . A 196 ILE HG21 . 34715 1 539 . 1 . 1 56 56 ILE HG22 H 1 0.957 0.020 . 1 . . . . A 196 ILE HG22 . 34715 1 540 . 1 . 1 56 56 ILE HG23 H 1 0.957 0.020 . 1 . . . . A 196 ILE HG23 . 34715 1 541 . 1 . 1 56 56 ILE HD11 H 1 1.005 0.020 . 1 . . . . A 196 ILE HD11 . 34715 1 542 . 1 . 1 56 56 ILE HD12 H 1 1.005 0.020 . 1 . . . . A 196 ILE HD12 . 34715 1 543 . 1 . 1 56 56 ILE HD13 H 1 1.005 0.020 . 1 . . . . A 196 ILE HD13 . 34715 1 544 . 1 . 1 56 56 ILE C C 13 174.813 0.3 . 1 . . . . A 196 ILE C . 34715 1 545 . 1 . 1 56 56 ILE CA C 13 59.055 0.3 . 1 . . . . A 196 ILE CA . 34715 1 546 . 1 . 1 56 56 ILE CB C 13 42.175 0.3 . 1 . . . . A 196 ILE CB . 34715 1 547 . 1 . 1 56 56 ILE CG1 C 13 26.682 0.3 . 1 . . . . A 196 ILE CG1 . 34715 1 548 . 1 . 1 56 56 ILE CG2 C 13 18.772 0.3 . 1 . . . . A 196 ILE CG2 . 34715 1 549 . 1 . 1 56 56 ILE CD1 C 13 13.920 0.3 . 1 . . . . A 196 ILE CD1 . 34715 1 550 . 1 . 1 57 57 ALA HA H 1 5.236 0.020 . 1 . . . . A 197 ALA HA . 34715 1 551 . 1 . 1 57 57 ALA HB1 H 1 1.175 0.020 . 1 . . . . A 197 ALA HB1 . 34715 1 552 . 1 . 1 57 57 ALA HB2 H 1 1.175 0.020 . 1 . . . . A 197 ALA HB2 . 34715 1 553 . 1 . 1 57 57 ALA HB3 H 1 1.175 0.020 . 1 . . . . A 197 ALA HB3 . 34715 1 554 . 1 . 1 57 57 ALA C C 13 174.901 0.3 . 1 . . . . A 197 ALA C . 34715 1 555 . 1 . 1 57 57 ALA CA C 13 50.890 0.3 . 1 . . . . A 197 ALA CA . 34715 1 556 . 1 . 1 57 57 ALA CB C 13 24.220 0.3 . 1 . . . . A 197 ALA CB . 34715 1 557 . 1 . 1 58 58 TYR HA H 1 5.528 0.020 . 1 . . . . A 198 TYR HA . 34715 1 558 . 1 . 1 58 58 TYR HB2 H 1 2.838 0.020 . 1 . . . . A 198 TYR HB2 . 34715 1 559 . 1 . 1 58 58 TYR HB3 H 1 2.838 0.020 . 1 . . . . A 198 TYR HB3 . 34715 1 560 . 1 . 1 58 58 TYR HD1 H 1 7.073 0.020 . 1 . . . . A 198 TYR HD1 . 34715 1 561 . 1 . 1 58 58 TYR HD2 H 1 7.073 0.020 . 1 . . . . A 198 TYR HD2 . 34715 1 562 . 1 . 1 58 58 TYR HE1 H 1 6.797 0.020 . 1 . . . . A 198 TYR HE1 . 34715 1 563 . 1 . 1 58 58 TYR HE2 H 1 6.797 0.020 . 1 . . . . A 198 TYR HE2 . 34715 1 564 . 1 . 1 58 58 TYR C C 13 175.156 0.3 . 1 . . . . A 198 TYR C . 34715 1 565 . 1 . 1 58 58 TYR CA C 13 56.705 0.3 . 1 . . . . A 198 TYR CA . 34715 1 566 . 1 . 1 58 58 TYR CB C 13 40.654 0.3 . 1 . . . . A 198 TYR CB . 34715 1 567 . 1 . 1 58 58 TYR CD1 C 13 132.900 0.3 . 1 . . . . A 198 TYR CD1 . 34715 1 568 . 1 . 1 58 58 TYR CE1 C 13 118.294 0.3 . 1 . . . . A 198 TYR CE1 . 34715 1 569 . 1 . 1 59 59 VAL HA H 1 4.967 0.020 . 1 . . . . A 199 VAL HA . 34715 1 570 . 1 . 1 59 59 VAL HB H 1 1.411 0.020 . 1 . . . . A 199 VAL HB . 34715 1 571 . 1 . 1 59 59 VAL HG11 H 1 0.802 0.020 . 2 . . . . A 199 VAL HG11 . 34715 1 572 . 1 . 1 59 59 VAL HG12 H 1 0.802 0.020 . 2 . . . . A 199 VAL HG12 . 34715 1 573 . 1 . 1 59 59 VAL HG13 H 1 0.802 0.020 . 2 . . . . A 199 VAL HG13 . 34715 1 574 . 1 . 1 59 59 VAL HG21 H 1 0.073 0.020 . 2 . . . . A 199 VAL HG21 . 34715 1 575 . 1 . 1 59 59 VAL HG22 H 1 0.073 0.020 . 2 . . . . A 199 VAL HG22 . 34715 1 576 . 1 . 1 59 59 VAL HG23 H 1 0.073 0.020 . 2 . . . . A 199 VAL HG23 . 34715 1 577 . 1 . 1 59 59 VAL C C 13 172.418 0.3 . 1 . . . . A 199 VAL C . 34715 1 578 . 1 . 1 59 59 VAL CA C 13 61.013 0.3 . 1 . . . . A 199 VAL CA . 34715 1 579 . 1 . 1 59 59 VAL CB C 13 33.731 0.3 . 1 . . . . A 199 VAL CB . 34715 1 580 . 1 . 1 59 59 VAL CG1 C 13 21.455 0.3 . 1 . . . . A 199 VAL CG1 . 34715 1 581 . 1 . 1 59 59 VAL CG2 C 13 20.652 0.3 . 1 . . . . A 199 VAL CG2 . 34715 1 582 . 1 . 1 60 60 GLU HA H 1 4.925 0.020 . 1 . . . . A 200 GLU HA . 34715 1 583 . 1 . 1 60 60 GLU HB2 H 1 1.912 0.020 . 2 . . . . A 200 GLU HB2 . 34715 1 584 . 1 . 1 60 60 GLU HB3 H 1 1.831 0.020 . 2 . . . . A 200 GLU HB3 . 34715 1 585 . 1 . 1 60 60 GLU HG2 H 1 1.961 0.020 . 2 . . . . A 200 GLU HG2 . 34715 1 586 . 1 . 1 60 60 GLU HG3 H 1 2.116 0.020 . 2 . . . . A 200 GLU HG3 . 34715 1 587 . 1 . 1 60 60 GLU C C 13 175.929 0.3 . 1 . . . . A 200 GLU C . 34715 1 588 . 1 . 1 60 60 GLU CA C 13 54.039 0.3 . 1 . . . . A 200 GLU CA . 34715 1 589 . 1 . 1 60 60 GLU CB C 13 33.170 0.3 . 1 . . . . A 200 GLU CB . 34715 1 590 . 1 . 1 60 60 GLU CG C 13 37.070 0.3 . 1 . . . . A 200 GLU CG . 34715 1 591 . 1 . 1 61 61 PHE HA H 1 5.010 0.020 . 1 . . . . A 201 PHE HA . 34715 1 592 . 1 . 1 61 61 PHE HB2 H 1 3.655 0.020 . 2 . . . . A 201 PHE HB2 . 34715 1 593 . 1 . 1 61 61 PHE HB3 H 1 2.972 0.020 . 2 . . . . A 201 PHE HB3 . 34715 1 594 . 1 . 1 61 61 PHE HD1 H 1 7.179 0.020 . 1 . . . . A 201 PHE HD1 . 34715 1 595 . 1 . 1 61 61 PHE HD2 H 1 7.179 0.020 . 1 . . . . A 201 PHE HD2 . 34715 1 596 . 1 . 1 61 61 PHE HE1 H 1 6.973 0.020 . 1 . . . . A 201 PHE HE1 . 34715 1 597 . 1 . 1 61 61 PHE HE2 H 1 6.973 0.020 . 1 . . . . A 201 PHE HE2 . 34715 1 598 . 1 . 1 61 61 PHE HZ H 1 6.972 0.020 . 1 . . . . A 201 PHE HZ . 34715 1 599 . 1 . 1 61 61 PHE C C 13 175.680 0.3 . 1 . . . . A 201 PHE C . 34715 1 600 . 1 . 1 61 61 PHE CA C 13 58.800 0.3 . 1 . . . . A 201 PHE CA . 34715 1 601 . 1 . 1 61 61 PHE CB C 13 41.124 0.3 . 1 . . . . A 201 PHE CB . 34715 1 602 . 1 . 1 61 61 PHE CD1 C 13 131.471 0.3 . 1 . . . . A 201 PHE CD1 . 34715 1 603 . 1 . 1 61 61 PHE CE1 C 13 131.029 0.3 . 1 . . . . A 201 PHE CE1 . 34715 1 604 . 1 . 1 61 61 PHE CZ C 13 129.846 0.3 . 1 . . . . A 201 PHE CZ . 34715 1 605 . 1 . 1 62 62 VAL HA H 1 3.851 0.020 . 1 . . . . A 202 VAL HA . 34715 1 606 . 1 . 1 62 62 VAL HB H 1 2.063 0.020 . 1 . . . . A 202 VAL HB . 34715 1 607 . 1 . 1 62 62 VAL HG11 H 1 1.020 0.020 . 2 . . . . A 202 VAL HG11 . 34715 1 608 . 1 . 1 62 62 VAL HG12 H 1 1.020 0.020 . 2 . . . . A 202 VAL HG12 . 34715 1 609 . 1 . 1 62 62 VAL HG13 H 1 1.020 0.020 . 2 . . . . A 202 VAL HG13 . 34715 1 610 . 1 . 1 62 62 VAL HG21 H 1 1.072 0.020 . 2 . . . . A 202 VAL HG21 . 34715 1 611 . 1 . 1 62 62 VAL HG22 H 1 1.072 0.020 . 2 . . . . A 202 VAL HG22 . 34715 1 612 . 1 . 1 62 62 VAL HG23 H 1 1.072 0.020 . 2 . . . . A 202 VAL HG23 . 34715 1 613 . 1 . 1 62 62 VAL C C 13 175.627 0.3 . 1 . . . . A 202 VAL C . 34715 1 614 . 1 . 1 62 62 VAL CA C 13 65.877 0.3 . 1 . . . . A 202 VAL CA . 34715 1 615 . 1 . 1 62 62 VAL CB C 13 32.904 0.3 . 1 . . . . A 202 VAL CB . 34715 1 616 . 1 . 1 62 62 VAL CG1 C 13 23.308 0.3 . 1 . . . . A 202 VAL CG1 . 34715 1 617 . 1 . 1 62 62 VAL CG2 C 13 21.113 0.3 . 1 . . . . A 202 VAL CG2 . 34715 1 618 . 1 . 1 63 63 ASP HA H 1 5.253 0.020 . 1 . . . . A 203 ASP HA . 34715 1 619 . 1 . 1 63 63 ASP HB2 H 1 2.951 0.020 . 2 . . . . A 203 ASP HB2 . 34715 1 620 . 1 . 1 63 63 ASP HB3 H 1 2.627 0.020 . 2 . . . . A 203 ASP HB3 . 34715 1 621 . 1 . 1 63 63 ASP C C 13 176.433 0.3 . 1 . . . . A 203 ASP C . 34715 1 622 . 1 . 1 63 63 ASP CA C 13 52.828 0.3 . 1 . . . . A 203 ASP CA . 34715 1 623 . 1 . 1 63 63 ASP CB C 13 44.931 0.3 . 1 . . . . A 203 ASP CB . 34715 1 624 . 1 . 1 64 64 VAL HA H 1 3.934 0.020 . 1 . . . . A 204 VAL HA . 34715 1 625 . 1 . 1 64 64 VAL HB H 1 2.156 0.020 . 1 . . . . A 204 VAL HB . 34715 1 626 . 1 . 1 64 64 VAL HG11 H 1 1.133 0.020 . 2 . . . . A 204 VAL HG11 . 34715 1 627 . 1 . 1 64 64 VAL HG12 H 1 1.133 0.020 . 2 . . . . A 204 VAL HG12 . 34715 1 628 . 1 . 1 64 64 VAL HG13 H 1 1.133 0.020 . 2 . . . . A 204 VAL HG13 . 34715 1 629 . 1 . 1 64 64 VAL HG21 H 1 1.162 0.020 . 2 . . . . A 204 VAL HG21 . 34715 1 630 . 1 . 1 64 64 VAL HG22 H 1 1.162 0.020 . 2 . . . . A 204 VAL HG22 . 34715 1 631 . 1 . 1 64 64 VAL HG23 H 1 1.162 0.020 . 2 . . . . A 204 VAL HG23 . 34715 1 632 . 1 . 1 64 64 VAL C C 13 178.061 0.3 . 1 . . . . A 204 VAL C . 34715 1 633 . 1 . 1 64 64 VAL CA C 13 64.915 0.3 . 1 . . . . A 204 VAL CA . 34715 1 634 . 1 . 1 64 64 VAL CB C 13 32.038 0.3 . 1 . . . . A 204 VAL CB . 34715 1 635 . 1 . 1 64 64 VAL CG1 C 13 20.903 0.3 . 1 . . . . A 204 VAL CG1 . 34715 1 636 . 1 . 1 64 64 VAL CG2 C 13 21.415 0.3 . 1 . . . . A 204 VAL CG2 . 34715 1 637 . 1 . 1 65 65 SER HA H 1 4.228 0.020 . 1 . . . . A 205 SER HA . 34715 1 638 . 1 . 1 65 65 SER HB2 H 1 4.026 0.020 . 1 . . . . A 205 SER HB2 . 34715 1 639 . 1 . 1 65 65 SER HB3 H 1 4.026 0.020 . 1 . . . . A 205 SER HB3 . 34715 1 640 . 1 . 1 65 65 SER C C 13 175.911 0.3 . 1 . . . . A 205 SER C . 34715 1 641 . 1 . 1 65 65 SER CA C 13 60.428 0.3 . 1 . . . . A 205 SER CA . 34715 1 642 . 1 . 1 65 65 SER CB C 13 62.436 0.3 . 1 . . . . A 205 SER CB . 34715 1 643 . 1 . 1 66 66 SER HA H 1 4.119 0.020 . 1 . . . . A 206 SER HA . 34715 1 644 . 1 . 1 66 66 SER HB2 H 1 3.151 0.020 . 2 . . . . A 206 SER HB2 . 34715 1 645 . 1 . 1 66 66 SER HB3 H 1 2.566 0.020 . 2 . . . . A 206 SER HB3 . 34715 1 646 . 1 . 1 66 66 SER C C 13 174.252 0.3 . 1 . . . . A 206 SER C . 34715 1 647 . 1 . 1 66 66 SER CA C 13 61.020 0.3 . 1 . . . . A 206 SER CA . 34715 1 648 . 1 . 1 66 66 SER CB C 13 63.362 0.3 . 1 . . . . A 206 SER CB . 34715 1 649 . 1 . 1 67 67 VAL HA H 1 3.406 0.020 . 1 . . . . A 207 VAL HA . 34715 1 650 . 1 . 1 67 67 VAL HB H 1 2.597 0.020 . 1 . . . . A 207 VAL HB . 34715 1 651 . 1 . 1 67 67 VAL HG11 H 1 1.254 0.020 . 2 . . . . A 207 VAL HG11 . 34715 1 652 . 1 . 1 67 67 VAL HG12 H 1 1.254 0.020 . 2 . . . . A 207 VAL HG12 . 34715 1 653 . 1 . 1 67 67 VAL HG13 H 1 1.254 0.020 . 2 . . . . A 207 VAL HG13 . 34715 1 654 . 1 . 1 67 67 VAL HG21 H 1 1.040 0.020 . 2 . . . . A 207 VAL HG21 . 34715 1 655 . 1 . 1 67 67 VAL HG22 H 1 1.040 0.020 . 2 . . . . A 207 VAL HG22 . 34715 1 656 . 1 . 1 67 67 VAL HG23 H 1 1.040 0.020 . 2 . . . . A 207 VAL HG23 . 34715 1 657 . 1 . 1 67 67 VAL CA C 13 69.260 0.3 . 1 . . . . A 207 VAL CA . 34715 1 658 . 1 . 1 67 67 VAL CB C 13 29.333 0.3 . 1 . . . . A 207 VAL CB . 34715 1 659 . 1 . 1 67 67 VAL CG1 C 13 23.633 0.3 . 1 . . . . A 207 VAL CG1 . 34715 1 660 . 1 . 1 67 67 VAL CG2 C 13 20.377 0.3 . 1 . . . . A 207 VAL CG2 . 34715 1 661 . 1 . 1 68 68 PRO HA H 1 4.346 0.020 . 1 . . . . A 208 PRO HA . 34715 1 662 . 1 . 1 68 68 PRO HB2 H 1 1.881 0.020 . 2 . . . . A 208 PRO HB2 . 34715 1 663 . 1 . 1 68 68 PRO HB3 H 1 2.432 0.020 . 2 . . . . A 208 PRO HB3 . 34715 1 664 . 1 . 1 68 68 PRO HG2 H 1 2.088 0.020 . 1 . . . . A 208 PRO HG2 . 34715 1 665 . 1 . 1 68 68 PRO HG3 H 1 2.088 0.020 . 1 . . . . A 208 PRO HG3 . 34715 1 666 . 1 . 1 68 68 PRO HD2 H 1 3.964 0.020 . 2 . . . . A 208 PRO HD2 . 34715 1 667 . 1 . 1 68 68 PRO HD3 H 1 3.757 0.020 . 2 . . . . A 208 PRO HD3 . 34715 1 668 . 1 . 1 68 68 PRO C C 13 179.951 0.3 . 1 . . . . A 208 PRO C . 34715 1 669 . 1 . 1 68 68 PRO CA C 13 65.498 0.3 . 1 . . . . A 208 PRO CA . 34715 1 670 . 1 . 1 68 68 PRO CB C 13 30.761 0.3 . 1 . . . . A 208 PRO CB . 34715 1 671 . 1 . 1 68 68 PRO CG C 13 28.366 0.3 . 1 . . . . A 208 PRO CG . 34715 1 672 . 1 . 1 68 68 PRO CD C 13 49.020 0.3 . 1 . . . . A 208 PRO CD . 34715 1 673 . 1 . 1 69 69 LEU HA H 1 4.185 0.020 . 1 . . . . A 209 LEU HA . 34715 1 674 . 1 . 1 69 69 LEU HB2 H 1 1.509 0.020 . 2 . . . . A 209 LEU HB2 . 34715 1 675 . 1 . 1 69 69 LEU HB3 H 1 1.939 0.020 . 2 . . . . A 209 LEU HB3 . 34715 1 676 . 1 . 1 69 69 LEU HG H 1 1.827 0.020 . 1 . . . . A 209 LEU HG . 34715 1 677 . 1 . 1 69 69 LEU HD11 H 1 1.074 0.020 . 2 . . . . A 209 LEU HD11 . 34715 1 678 . 1 . 1 69 69 LEU HD12 H 1 1.074 0.020 . 2 . . . . A 209 LEU HD12 . 34715 1 679 . 1 . 1 69 69 LEU HD13 H 1 1.074 0.020 . 2 . . . . A 209 LEU HD13 . 34715 1 680 . 1 . 1 69 69 LEU HD21 H 1 0.960 0.020 . 2 . . . . A 209 LEU HD21 . 34715 1 681 . 1 . 1 69 69 LEU HD22 H 1 0.960 0.020 . 2 . . . . A 209 LEU HD22 . 34715 1 682 . 1 . 1 69 69 LEU HD23 H 1 0.960 0.020 . 2 . . . . A 209 LEU HD23 . 34715 1 683 . 1 . 1 69 69 LEU C C 13 179.128 0.3 . 1 . . . . A 209 LEU C . 34715 1 684 . 1 . 1 69 69 LEU CA C 13 56.693 0.3 . 1 . . . . A 209 LEU CA . 34715 1 685 . 1 . 1 69 69 LEU CB C 13 41.137 0.3 . 1 . . . . A 209 LEU CB . 34715 1 686 . 1 . 1 69 69 LEU CG C 13 26.867 0.3 . 1 . . . . A 209 LEU CG . 34715 1 687 . 1 . 1 69 69 LEU CD1 C 13 25.675 0.3 . 1 . . . . A 209 LEU CD1 . 34715 1 688 . 1 . 1 69 69 LEU CD2 C 13 22.033 0.3 . 1 . . . . A 209 LEU CD2 . 34715 1 689 . 1 . 1 70 70 ALA HA H 1 4.227 0.020 . 1 . . . . A 210 ALA HA . 34715 1 690 . 1 . 1 70 70 ALA HB1 H 1 1.636 0.020 . 1 . . . . A 210 ALA HB1 . 34715 1 691 . 1 . 1 70 70 ALA HB2 H 1 1.636 0.020 . 1 . . . . A 210 ALA HB2 . 34715 1 692 . 1 . 1 70 70 ALA HB3 H 1 1.636 0.020 . 1 . . . . A 210 ALA HB3 . 34715 1 693 . 1 . 1 70 70 ALA C C 13 180.235 0.3 . 1 . . . . A 210 ALA C . 34715 1 694 . 1 . 1 70 70 ALA CA C 13 55.144 0.3 . 1 . . . . A 210 ALA CA . 34715 1 695 . 1 . 1 70 70 ALA CB C 13 19.534 0.3 . 1 . . . . A 210 ALA CB . 34715 1 696 . 1 . 1 71 71 ILE HA H 1 3.734 0.020 . 1 . . . . A 211 ILE HA . 34715 1 697 . 1 . 1 71 71 ILE HB H 1 1.896 0.020 . 1 . . . . A 211 ILE HB . 34715 1 698 . 1 . 1 71 71 ILE HG12 H 1 1.819 0.020 . 2 . . . . A 211 ILE HG12 . 34715 1 699 . 1 . 1 71 71 ILE HG13 H 1 0.959 0.020 . 2 . . . . A 211 ILE HG13 . 34715 1 700 . 1 . 1 71 71 ILE HG21 H 1 1.151 0.020 . 1 . . . . A 211 ILE HG21 . 34715 1 701 . 1 . 1 71 71 ILE HG22 H 1 1.151 0.020 . 1 . . . . A 211 ILE HG22 . 34715 1 702 . 1 . 1 71 71 ILE HG23 H 1 1.151 0.020 . 1 . . . . A 211 ILE HG23 . 34715 1 703 . 1 . 1 71 71 ILE HD11 H 1 0.958 0.020 . 1 . . . . A 211 ILE HD11 . 34715 1 704 . 1 . 1 71 71 ILE HD12 H 1 0.958 0.020 . 1 . . . . A 211 ILE HD12 . 34715 1 705 . 1 . 1 71 71 ILE HD13 H 1 0.958 0.020 . 1 . . . . A 211 ILE HD13 . 34715 1 706 . 1 . 1 71 71 ILE C C 13 179.568 0.3 . 1 . . . . A 211 ILE C . 34715 1 707 . 1 . 1 71 71 ILE CA C 13 65.178 0.3 . 1 . . . . A 211 ILE CA . 34715 1 708 . 1 . 1 71 71 ILE CB C 13 38.649 0.3 . 1 . . . . A 211 ILE CB . 34715 1 709 . 1 . 1 71 71 ILE CG1 C 13 29.629 0.3 . 1 . . . . A 211 ILE CG1 . 34715 1 710 . 1 . 1 71 71 ILE CG2 C 13 16.747 0.3 . 1 . . . . A 211 ILE CG2 . 34715 1 711 . 1 . 1 71 71 ILE CD1 C 13 14.473 0.3 . 1 . . . . A 211 ILE CD1 . 34715 1 712 . 1 . 1 72 72 GLY HA2 H 1 4.285 0.020 . 2 . . . . A 212 GLY HA2 . 34715 1 713 . 1 . 1 72 72 GLY HA3 H 1 3.967 0.020 . 2 . . . . A 212 GLY HA3 . 34715 1 714 . 1 . 1 72 72 GLY C C 13 174.241 0.3 . 1 . . . . A 212 GLY C . 34715 1 715 . 1 . 1 72 72 GLY CA C 13 45.741 0.3 . 1 . . . . A 212 GLY CA . 34715 1 716 . 1 . 1 73 73 LEU HA H 1 4.246 0.020 . 1 . . . . A 213 LEU HA . 34715 1 717 . 1 . 1 73 73 LEU HB2 H 1 2.287 0.020 . 2 . . . . A 213 LEU HB2 . 34715 1 718 . 1 . 1 73 73 LEU HB3 H 1 1.807 0.020 . 2 . . . . A 213 LEU HB3 . 34715 1 719 . 1 . 1 73 73 LEU HG H 1 2.042 0.020 . 1 . . . . A 213 LEU HG . 34715 1 720 . 1 . 1 73 73 LEU HD11 H 1 0.729 0.020 . 2 . . . . A 213 LEU HD11 . 34715 1 721 . 1 . 1 73 73 LEU HD12 H 1 0.729 0.020 . 2 . . . . A 213 LEU HD12 . 34715 1 722 . 1 . 1 73 73 LEU HD13 H 1 0.729 0.020 . 2 . . . . A 213 LEU HD13 . 34715 1 723 . 1 . 1 73 73 LEU HD21 H 1 0.604 0.020 . 2 . . . . A 213 LEU HD21 . 34715 1 724 . 1 . 1 73 73 LEU HD22 H 1 0.604 0.020 . 2 . . . . A 213 LEU HD22 . 34715 1 725 . 1 . 1 73 73 LEU HD23 H 1 0.604 0.020 . 2 . . . . A 213 LEU HD23 . 34715 1 726 . 1 . 1 73 73 LEU C C 13 176.035 0.3 . 1 . . . . A 213 LEU C . 34715 1 727 . 1 . 1 73 73 LEU CA C 13 55.212 0.3 . 1 . . . . A 213 LEU CA . 34715 1 728 . 1 . 1 73 73 LEU CB C 13 40.754 0.3 . 1 . . . . A 213 LEU CB . 34715 1 729 . 1 . 1 73 73 LEU CG C 13 26.053 0.3 . 1 . . . . A 213 LEU CG . 34715 1 730 . 1 . 1 73 73 LEU CD1 C 13 21.784 0.3 . 1 . . . . A 213 LEU CD1 . 34715 1 731 . 1 . 1 73 73 LEU CD2 C 13 25.790 0.3 . 1 . . . . A 213 LEU CD2 . 34715 1 732 . 1 . 1 74 74 THR HA H 1 4.144 0.020 . 1 . . . . A 214 THR HA . 34715 1 733 . 1 . 1 74 74 THR HB H 1 4.454 0.020 . 1 . . . . A 214 THR HB . 34715 1 734 . 1 . 1 74 74 THR HG21 H 1 1.605 0.020 . 1 . . . . A 214 THR HG21 . 34715 1 735 . 1 . 1 74 74 THR HG22 H 1 1.605 0.020 . 1 . . . . A 214 THR HG22 . 34715 1 736 . 1 . 1 74 74 THR HG23 H 1 1.605 0.020 . 1 . . . . A 214 THR HG23 . 34715 1 737 . 1 . 1 74 74 THR C C 13 175.307 0.3 . 1 . . . . A 214 THR C . 34715 1 738 . 1 . 1 74 74 THR CA C 13 66.162 0.3 . 1 . . . . A 214 THR CA . 34715 1 739 . 1 . 1 74 74 THR CB C 13 69.964 0.3 . 1 . . . . A 214 THR CB . 34715 1 740 . 1 . 1 74 74 THR CG2 C 13 21.699 0.3 . 1 . . . . A 214 THR CG2 . 34715 1 741 . 1 . 1 75 75 GLY HA2 H 1 4.657 0.020 . 2 . . . . A 215 GLY HA2 . 34715 1 742 . 1 . 1 75 75 GLY HA3 H 1 3.698 0.020 . 2 . . . . A 215 GLY HA3 . 34715 1 743 . 1 . 1 75 75 GLY C C 13 175.340 0.3 . 1 . . . . A 215 GLY C . 34715 1 744 . 1 . 1 75 75 GLY CA C 13 44.664 0.3 . 1 . . . . A 215 GLY CA . 34715 1 745 . 1 . 1 76 76 GLN HA H 1 4.381 0.020 . 1 . . . . A 216 GLN HA . 34715 1 746 . 1 . 1 76 76 GLN HB2 H 1 2.393 0.020 . 1 . . . . A 216 GLN HB2 . 34715 1 747 . 1 . 1 76 76 GLN HB3 H 1 2.393 0.020 . 1 . . . . A 216 GLN HB3 . 34715 1 748 . 1 . 1 76 76 GLN HG2 H 1 2.634 0.020 . 2 . . . . A 216 GLN HG2 . 34715 1 749 . 1 . 1 76 76 GLN HG3 H 1 2.685 0.020 . 2 . . . . A 216 GLN HG3 . 34715 1 750 . 1 . 1 76 76 GLN C C 13 175.241 0.3 . 1 . . . . A 216 GLN C . 34715 1 751 . 1 . 1 76 76 GLN CA C 13 55.475 0.3 . 1 . . . . A 216 GLN CA . 34715 1 752 . 1 . 1 76 76 GLN CB C 13 28.184 0.3 . 1 . . . . A 216 GLN CB . 34715 1 753 . 1 . 1 76 76 GLN CG C 13 34.307 0.3 . 1 . . . . A 216 GLN CG . 34715 1 754 . 1 . 1 77 77 ARG HA H 1 4.247 0.020 . 1 . . . . A 217 ARG HA . 34715 1 755 . 1 . 1 77 77 ARG HB2 H 1 1.770 0.020 . 2 . . . . A 217 ARG HB2 . 34715 1 756 . 1 . 1 77 77 ARG HB3 H 1 1.143 0.020 . 2 . . . . A 217 ARG HB3 . 34715 1 757 . 1 . 1 77 77 ARG HG2 H 1 1.095 0.020 . 1 . . . . A 217 ARG HG2 . 34715 1 758 . 1 . 1 77 77 ARG HG3 H 1 1.095 0.020 . 1 . . . . A 217 ARG HG3 . 34715 1 759 . 1 . 1 77 77 ARG HD2 H 1 3.140 0.020 . 2 . . . . A 217 ARG HD2 . 34715 1 760 . 1 . 1 77 77 ARG HD3 H 1 3.070 0.020 . 2 . . . . A 217 ARG HD3 . 34715 1 761 . 1 . 1 77 77 ARG C C 13 175.805 0.3 . 1 . . . . A 217 ARG C . 34715 1 762 . 1 . 1 77 77 ARG CA C 13 56.271 0.3 . 1 . . . . A 217 ARG CA . 34715 1 763 . 1 . 1 77 77 ARG CB C 13 31.542 0.3 . 1 . . . . A 217 ARG CB . 34715 1 764 . 1 . 1 77 77 ARG CG C 13 28.812 0.3 . 1 . . . . A 217 ARG CG . 34715 1 765 . 1 . 1 77 77 ARG CD C 13 43.230 0.3 . 1 . . . . A 217 ARG CD . 34715 1 766 . 1 . 1 78 78 VAL HA H 1 3.877 0.020 . 1 . . . . A 218 VAL HA . 34715 1 767 . 1 . 1 78 78 VAL HB H 1 1.685 0.020 . 1 . . . . A 218 VAL HB . 34715 1 768 . 1 . 1 78 78 VAL HG11 H 1 0.529 0.020 . 2 . . . . A 218 VAL HG11 . 34715 1 769 . 1 . 1 78 78 VAL HG12 H 1 0.529 0.020 . 2 . . . . A 218 VAL HG12 . 34715 1 770 . 1 . 1 78 78 VAL HG13 H 1 0.529 0.020 . 2 . . . . A 218 VAL HG13 . 34715 1 771 . 1 . 1 78 78 VAL HG21 H 1 -0.208 0.020 . 2 . . . . A 218 VAL HG21 . 34715 1 772 . 1 . 1 78 78 VAL HG22 H 1 -0.208 0.020 . 2 . . . . A 218 VAL HG22 . 34715 1 773 . 1 . 1 78 78 VAL HG23 H 1 -0.208 0.020 . 2 . . . . A 218 VAL HG23 . 34715 1 774 . 1 . 1 78 78 VAL C C 13 176.191 0.3 . 1 . . . . A 218 VAL C . 34715 1 775 . 1 . 1 78 78 VAL CA C 13 61.634 0.3 . 1 . . . . A 218 VAL CA . 34715 1 776 . 1 . 1 78 78 VAL CB C 13 32.272 0.3 . 1 . . . . A 218 VAL CB . 34715 1 777 . 1 . 1 78 78 VAL CG1 C 13 20.753 0.3 . 1 . . . . A 218 VAL CG1 . 34715 1 778 . 1 . 1 78 78 VAL CG2 C 13 20.045 0.3 . 1 . . . . A 218 VAL CG2 . 34715 1 779 . 1 . 1 79 79 LEU HA H 1 3.786 0.020 . 1 . . . . A 219 LEU HA . 34715 1 780 . 1 . 1 79 79 LEU HB2 H 1 1.608 0.020 . 2 . . . . A 219 LEU HB2 . 34715 1 781 . 1 . 1 79 79 LEU HB3 H 1 1.770 0.020 . 2 . . . . A 219 LEU HB3 . 34715 1 782 . 1 . 1 79 79 LEU HG H 1 1.549 0.020 . 1 . . . . A 219 LEU HG . 34715 1 783 . 1 . 1 79 79 LEU HD11 H 1 0.783 0.020 . 2 . . . . A 219 LEU HD11 . 34715 1 784 . 1 . 1 79 79 LEU HD12 H 1 0.783 0.020 . 2 . . . . A 219 LEU HD12 . 34715 1 785 . 1 . 1 79 79 LEU HD13 H 1 0.783 0.020 . 2 . . . . A 219 LEU HD13 . 34715 1 786 . 1 . 1 79 79 LEU HD21 H 1 0.730 0.020 . 2 . . . . A 219 LEU HD21 . 34715 1 787 . 1 . 1 79 79 LEU HD22 H 1 0.730 0.020 . 2 . . . . A 219 LEU HD22 . 34715 1 788 . 1 . 1 79 79 LEU HD23 H 1 0.730 0.020 . 2 . . . . A 219 LEU HD23 . 34715 1 789 . 1 . 1 79 79 LEU C C 13 176.639 0.3 . 1 . . . . A 219 LEU C . 34715 1 790 . 1 . 1 79 79 LEU CA C 13 55.861 0.3 . 1 . . . . A 219 LEU CA . 34715 1 791 . 1 . 1 79 79 LEU CB C 13 39.589 0.3 . 1 . . . . A 219 LEU CB . 34715 1 792 . 1 . 1 79 79 LEU CG C 13 27.742 0.3 . 1 . . . . A 219 LEU CG . 34715 1 793 . 1 . 1 79 79 LEU CD1 C 13 25.829 0.3 . 1 . . . . A 219 LEU CD1 . 34715 1 794 . 1 . 1 79 79 LEU CD2 C 13 23.116 0.3 . 1 . . . . A 219 LEU CD2 . 34715 1 795 . 1 . 1 80 80 GLY HA2 H 1 4.255 0.020 . 2 . . . . A 220 GLY HA2 . 34715 1 796 . 1 . 1 80 80 GLY HA3 H 1 3.539 0.020 . 2 . . . . A 220 GLY HA3 . 34715 1 797 . 1 . 1 80 80 GLY C C 13 174.259 0.3 . 1 . . . . A 220 GLY C . 34715 1 798 . 1 . 1 80 80 GLY CA C 13 45.199 0.3 . 1 . . . . A 220 GLY CA . 34715 1 799 . 1 . 1 81 81 VAL HA H 1 4.707 0.020 . 1 . . . . A 221 VAL HA . 34715 1 800 . 1 . 1 81 81 VAL HB H 1 2.137 0.020 . 1 . . . . A 221 VAL HB . 34715 1 801 . 1 . 1 81 81 VAL HG11 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG11 . 34715 1 802 . 1 . 1 81 81 VAL HG12 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG12 . 34715 1 803 . 1 . 1 81 81 VAL HG13 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG13 . 34715 1 804 . 1 . 1 81 81 VAL HG21 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG21 . 34715 1 805 . 1 . 1 81 81 VAL HG22 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG22 . 34715 1 806 . 1 . 1 81 81 VAL HG23 H 1 0.866 0.020 . 1 . . . . A 221 VAL HG23 . 34715 1 807 . 1 . 1 81 81 VAL CA C 13 60.025 0.3 . 1 . . . . A 221 VAL CA . 34715 1 808 . 1 . 1 81 81 VAL CB C 13 34.802 0.3 . 1 . . . . A 221 VAL CB . 34715 1 809 . 1 . 1 81 81 VAL CG1 C 13 21.126 0.3 . 1 . . . . A 221 VAL CG1 . 34715 1 810 . 1 . 1 81 81 VAL CG2 C 13 21.167 0.3 . 1 . . . . A 221 VAL CG2 . 34715 1 811 . 1 . 1 82 82 PRO HA H 1 4.424 0.020 . 1 . . . . A 222 PRO HA . 34715 1 812 . 1 . 1 82 82 PRO HB2 H 1 2.116 0.020 . 2 . . . . A 222 PRO HB2 . 34715 1 813 . 1 . 1 82 82 PRO HB3 H 1 1.956 0.020 . 2 . . . . A 222 PRO HB3 . 34715 1 814 . 1 . 1 82 82 PRO HD2 H 1 3.954 0.020 . 2 . . . . A 222 PRO HD2 . 34715 1 815 . 1 . 1 82 82 PRO HD3 H 1 3.786 0.020 . 2 . . . . A 222 PRO HD3 . 34715 1 816 . 1 . 1 82 82 PRO C C 13 174.773 0.3 . 1 . . . . A 222 PRO C . 34715 1 817 . 1 . 1 82 82 PRO CA C 13 62.678 0.3 . 1 . . . . A 222 PRO CA . 34715 1 818 . 1 . 1 82 82 PRO CB C 13 31.400 0.3 . 1 . . . . A 222 PRO CB . 34715 1 819 . 1 . 1 82 82 PRO CG C 13 27.190 0.3 . 1 . . . . A 222 PRO CG . 34715 1 820 . 1 . 1 82 82 PRO CD C 13 50.952 0.3 . 1 . . . . A 222 PRO CD . 34715 1 821 . 1 . 1 83 83 ILE HA H 1 4.724 0.020 . 1 . . . . A 223 ILE HA . 34715 1 822 . 1 . 1 83 83 ILE HB H 1 1.775 0.020 . 1 . . . . A 223 ILE HB . 34715 1 823 . 1 . 1 83 83 ILE HG12 H 1 1.238 0.020 . 2 . . . . A 223 ILE HG12 . 34715 1 824 . 1 . 1 83 83 ILE HG13 H 1 1.634 0.020 . 2 . . . . A 223 ILE HG13 . 34715 1 825 . 1 . 1 83 83 ILE HG21 H 1 0.966 0.020 . 1 . . . . A 223 ILE HG21 . 34715 1 826 . 1 . 1 83 83 ILE HG22 H 1 0.966 0.020 . 1 . . . . A 223 ILE HG22 . 34715 1 827 . 1 . 1 83 83 ILE HG23 H 1 0.966 0.020 . 1 . . . . A 223 ILE HG23 . 34715 1 828 . 1 . 1 83 83 ILE HD11 H 1 0.690 0.020 . 1 . . . . A 223 ILE HD11 . 34715 1 829 . 1 . 1 83 83 ILE HD12 H 1 0.690 0.020 . 1 . . . . A 223 ILE HD12 . 34715 1 830 . 1 . 1 83 83 ILE HD13 H 1 0.690 0.020 . 1 . . . . A 223 ILE HD13 . 34715 1 831 . 1 . 1 83 83 ILE C C 13 175.307 0.3 . 1 . . . . A 223 ILE C . 34715 1 832 . 1 . 1 83 83 ILE CA C 13 61.328 0.3 . 1 . . . . A 223 ILE CA . 34715 1 833 . 1 . 1 83 83 ILE CB C 13 40.976 0.3 . 1 . . . . A 223 ILE CB . 34715 1 834 . 1 . 1 83 83 ILE CG1 C 13 29.105 0.3 . 1 . . . . A 223 ILE CG1 . 34715 1 835 . 1 . 1 83 83 ILE CG2 C 13 16.011 0.3 . 1 . . . . A 223 ILE CG2 . 34715 1 836 . 1 . 1 83 83 ILE CD1 C 13 14.815 0.3 . 1 . . . . A 223 ILE CD1 . 34715 1 837 . 1 . 1 84 84 ILE HA H 1 4.505 0.020 . 1 . . . . A 224 ILE HA . 34715 1 838 . 1 . 1 84 84 ILE HB H 1 1.660 0.020 . 1 . . . . A 224 ILE HB . 34715 1 839 . 1 . 1 84 84 ILE HG12 H 1 1.566 0.020 . 2 . . . . A 224 ILE HG12 . 34715 1 840 . 1 . 1 84 84 ILE HG13 H 1 1.164 0.020 . 2 . . . . A 224 ILE HG13 . 34715 1 841 . 1 . 1 84 84 ILE HG21 H 1 0.965 0.020 . 1 . . . . A 224 ILE HG21 . 34715 1 842 . 1 . 1 84 84 ILE HG22 H 1 0.965 0.020 . 1 . . . . A 224 ILE HG22 . 34715 1 843 . 1 . 1 84 84 ILE HG23 H 1 0.965 0.020 . 1 . . . . A 224 ILE HG23 . 34715 1 844 . 1 . 1 84 84 ILE HD11 H 1 0.883 0.020 . 1 . . . . A 224 ILE HD11 . 34715 1 845 . 1 . 1 84 84 ILE HD12 H 1 0.883 0.020 . 1 . . . . A 224 ILE HD12 . 34715 1 846 . 1 . 1 84 84 ILE HD13 H 1 0.883 0.020 . 1 . . . . A 224 ILE HD13 . 34715 1 847 . 1 . 1 84 84 ILE C C 13 174.191 0.3 . 1 . . . . A 224 ILE C . 34715 1 848 . 1 . 1 84 84 ILE CA C 13 61.328 0.3 . 1 . . . . A 224 ILE CA . 34715 1 849 . 1 . 1 84 84 ILE CB C 13 39.768 0.3 . 1 . . . . A 224 ILE CB . 34715 1 850 . 1 . 1 84 84 ILE CG1 C 13 27.256 0.3 . 1 . . . . A 224 ILE CG1 . 34715 1 851 . 1 . 1 84 84 ILE CG2 C 13 17.208 0.3 . 1 . . . . A 224 ILE CG2 . 34715 1 852 . 1 . 1 84 84 ILE CD1 C 13 13.053 0.3 . 1 . . . . A 224 ILE CD1 . 34715 1 853 . 1 . 1 85 85 VAL HA H 1 4.974 0.020 . 1 . . . . A 225 VAL HA . 34715 1 854 . 1 . 1 85 85 VAL HB H 1 2.316 0.020 . 1 . . . . A 225 VAL HB . 34715 1 855 . 1 . 1 85 85 VAL HG11 H 1 1.300 0.020 . 2 . . . . A 225 VAL HG11 . 34715 1 856 . 1 . 1 85 85 VAL HG12 H 1 1.300 0.020 . 2 . . . . A 225 VAL HG12 . 34715 1 857 . 1 . 1 85 85 VAL HG13 H 1 1.300 0.020 . 2 . . . . A 225 VAL HG13 . 34715 1 858 . 1 . 1 85 85 VAL HG21 H 1 1.040 0.020 . 2 . . . . A 225 VAL HG21 . 34715 1 859 . 1 . 1 85 85 VAL HG22 H 1 1.040 0.020 . 2 . . . . A 225 VAL HG22 . 34715 1 860 . 1 . 1 85 85 VAL HG23 H 1 1.040 0.020 . 2 . . . . A 225 VAL HG23 . 34715 1 861 . 1 . 1 85 85 VAL C C 13 174.401 0.3 . 1 . . . . A 225 VAL C . 34715 1 862 . 1 . 1 85 85 VAL CA C 13 61.013 0.3 . 1 . . . . A 225 VAL CA . 34715 1 863 . 1 . 1 85 85 VAL CB C 13 34.039 0.3 . 1 . . . . A 225 VAL CB . 34715 1 864 . 1 . 1 85 85 VAL CG1 C 13 21.502 0.3 . 1 . . . . A 225 VAL CG1 . 34715 1 865 . 1 . 1 85 85 VAL CG2 C 13 23.493 0.3 . 1 . . . . A 225 VAL CG2 . 34715 1 866 . 1 . 1 86 86 GLN HA H 1 4.974 0.020 . 1 . . . . A 226 GLN HA . 34715 1 867 . 1 . 1 86 86 GLN HB2 H 1 1.968 0.020 . 2 . . . . A 226 GLN HB2 . 34715 1 868 . 1 . 1 86 86 GLN HB3 H 1 2.252 0.020 . 2 . . . . A 226 GLN HB3 . 34715 1 869 . 1 . 1 86 86 GLN HG2 H 1 2.457 0.020 . 2 . . . . A 226 GLN HG2 . 34715 1 870 . 1 . 1 86 86 GLN HG3 H 1 2.343 0.020 . 2 . . . . A 226 GLN HG3 . 34715 1 871 . 1 . 1 86 86 GLN C C 13 174.810 0.3 . 1 . . . . A 226 GLN C . 34715 1 872 . 1 . 1 86 86 GLN CA C 13 53.552 0.3 . 1 . . . . A 226 GLN CA . 34715 1 873 . 1 . 1 86 86 GLN CB C 13 34.073 0.3 . 1 . . . . A 226 GLN CB . 34715 1 874 . 1 . 1 86 86 GLN CG C 13 33.977 0.3 . 1 . . . . A 226 GLN CG . 34715 1 875 . 1 . 1 87 87 ALA HA H 1 4.469 0.020 . 1 . . . . A 227 ALA HA . 34715 1 876 . 1 . 1 87 87 ALA HB1 H 1 1.593 0.020 . 1 . . . . A 227 ALA HB1 . 34715 1 877 . 1 . 1 87 87 ALA HB2 H 1 1.593 0.020 . 1 . . . . A 227 ALA HB2 . 34715 1 878 . 1 . 1 87 87 ALA HB3 H 1 1.593 0.020 . 1 . . . . A 227 ALA HB3 . 34715 1 879 . 1 . 1 87 87 ALA C C 13 177.794 0.3 . 1 . . . . A 227 ALA C . 34715 1 880 . 1 . 1 87 87 ALA CA C 13 52.869 0.3 . 1 . . . . A 227 ALA CA . 34715 1 881 . 1 . 1 87 87 ALA CB C 13 18.705 0.3 . 1 . . . . A 227 ALA CB . 34715 1 882 . 1 . 1 88 88 SER HA H 1 4.429 0.020 . 1 . . . . A 228 SER HA . 34715 1 883 . 1 . 1 88 88 SER HB2 H 1 3.931 0.020 . 2 . . . . A 228 SER HB2 . 34715 1 884 . 1 . 1 88 88 SER HB3 H 1 4.019 0.020 . 2 . . . . A 228 SER HB3 . 34715 1 885 . 1 . 1 88 88 SER C C 13 175.503 0.3 . 1 . . . . A 228 SER C . 34715 1 886 . 1 . 1 88 88 SER CA C 13 59.693 0.3 . 1 . . . . A 228 SER CA . 34715 1 887 . 1 . 1 88 88 SER CB C 13 63.676 0.3 . 1 . . . . A 228 SER CB . 34715 1 888 . 1 . 1 89 89 GLN HA H 1 4.425 0.020 . 1 . . . . A 229 GLN HA . 34715 1 889 . 1 . 1 89 89 GLN HB2 H 1 1.940 0.020 . 2 . . . . A 229 GLN HB2 . 34715 1 890 . 1 . 1 89 89 GLN HB3 H 1 2.151 0.020 . 2 . . . . A 229 GLN HB3 . 34715 1 891 . 1 . 1 89 89 GLN HG2 H 1 2.390 0.020 . 1 . . . . A 229 GLN HG2 . 34715 1 892 . 1 . 1 89 89 GLN HE21 H 1 7.586 0.020 . 1 . . . . A 229 GLN HE21 . 34715 1 893 . 1 . 1 89 89 GLN HE22 H 1 6.825 0.020 . 1 . . . . A 229 GLN HE22 . 34715 1 894 . 1 . 1 89 89 GLN C C 13 175.766 0.3 . 1 . . . . A 229 GLN C . 34715 1 895 . 1 . 1 89 89 GLN CA C 13 55.712 0.3 . 1 . . . . A 229 GLN CA . 34715 1 896 . 1 . 1 89 89 GLN CB C 13 29.387 0.3 . 1 . . . . A 229 GLN CB . 34715 1 897 . 1 . 1 89 89 GLN CG C 13 33.757 0.3 . 1 . . . . A 229 GLN CG . 34715 1 898 . 1 . 1 89 89 GLN NE2 N 15 112.003 0.3 . 1 . . . . A 229 GLN NE2 . 34715 1 899 . 1 . 1 90 90 ALA HA H 1 4.257 0.020 . 1 . . . . A 230 ALA HA . 34715 1 900 . 1 . 1 90 90 ALA HB1 H 1 1.506 0.020 . 1 . . . . A 230 ALA HB1 . 34715 1 901 . 1 . 1 90 90 ALA HB2 H 1 1.506 0.020 . 1 . . . . A 230 ALA HB2 . 34715 1 902 . 1 . 1 90 90 ALA HB3 H 1 1.506 0.020 . 1 . . . . A 230 ALA HB3 . 34715 1 903 . 1 . 1 90 90 ALA C C 13 178.575 0.3 . 1 . . . . A 230 ALA C . 34715 1 904 . 1 . 1 90 90 ALA CA C 13 53.644 0.3 . 1 . . . . A 230 ALA CA . 34715 1 905 . 1 . 1 90 90 ALA CB C 13 18.981 0.3 . 1 . . . . A 230 ALA CB . 34715 1 906 . 1 . 1 91 91 GLU HA H 1 4.245 0.020 . 1 . . . . A 231 GLU HA . 34715 1 907 . 1 . 1 91 91 GLU HB2 H 1 2.046 0.020 . 2 . . . . A 231 GLU HB2 . 34715 1 908 . 1 . 1 91 91 GLU HB3 H 1 1.952 0.020 . 2 . . . . A 231 GLU HB3 . 34715 1 909 . 1 . 1 91 91 GLU HG2 H 1 2.269 0.020 . 1 . . . . A 231 GLU HG2 . 34715 1 910 . 1 . 1 91 91 GLU HG3 H 1 2.269 0.020 . 1 . . . . A 231 GLU HG3 . 34715 1 911 . 1 . 1 91 91 GLU C C 13 177.482 0.3 . 1 . . . . A 231 GLU C . 34715 1 912 . 1 . 1 91 91 GLU CA C 13 57.437 0.3 . 1 . . . . A 231 GLU CA . 34715 1 913 . 1 . 1 91 91 GLU CB C 13 29.681 0.3 . 1 . . . . A 231 GLU CB . 34715 1 914 . 1 . 1 91 91 GLU CG C 13 35.991 0.3 . 1 . . . . A 231 GLU CG . 34715 1 915 . 1 . 1 92 92 LYS HA H 1 4.283 0.020 . 1 . . . . A 232 LYS HA . 34715 1 916 . 1 . 1 92 92 LYS HB2 H 1 1.874 0.020 . 2 . . . . A 232 LYS HB2 . 34715 1 917 . 1 . 1 92 92 LYS HB3 H 1 1.814 0.020 . 2 . . . . A 232 LYS HB3 . 34715 1 918 . 1 . 1 92 92 LYS C C 13 177.227 0.3 . 1 . . . . A 232 LYS C . 34715 1 919 . 1 . 1 92 92 LYS CA C 13 57.240 0.3 . 1 . . . . A 232 LYS CA . 34715 1 920 . 1 . 1 92 92 LYS CB C 13 32.622 0.3 . 1 . . . . A 232 LYS CB . 34715 1 921 . 1 . 1 92 92 LYS CG C 13 24.889 0.3 . 1 . . . . A 232 LYS CG . 34715 1 922 . 1 . 1 92 92 LYS CD C 13 29.427 0.3 . 1 . . . . A 232 LYS CD . 34715 1 923 . 1 . 1 93 93 ASN HA H 1 4.691 0.020 . 1 . . . . A 233 ASN HA . 34715 1 924 . 1 . 1 93 93 ASN HB2 H 1 2.838 0.020 . 1 . . . . A 233 ASN HB2 . 34715 1 925 . 1 . 1 93 93 ASN HB3 H 1 2.838 0.020 . 1 . . . . A 233 ASN HB3 . 34715 1 926 . 1 . 1 93 93 ASN C C 13 175.738 0.3 . 1 . . . . A 233 ASN C . 34715 1 927 . 1 . 1 93 93 ASN CA C 13 54.236 0.3 . 1 . . . . A 233 ASN CA . 34715 1 928 . 1 . 1 93 93 ASN CB C 13 38.502 0.3 . 1 . . . . A 233 ASN CB . 34715 1 929 . 1 . 1 94 94 ARG HA H 1 4.298 0.020 . 1 . . . . A 234 ARG HA . 34715 1 930 . 1 . 1 94 94 ARG HB2 H 1 1.856 0.020 . 2 . . . . A 234 ARG HB2 . 34715 1 931 . 1 . 1 94 94 ARG HB3 H 1 1.927 0.020 . 2 . . . . A 234 ARG HB3 . 34715 1 932 . 1 . 1 94 94 ARG HG2 H 1 1.672 0.020 . 1 . . . . A 234 ARG HG2 . 34715 1 933 . 1 . 1 94 94 ARG HG3 H 1 1.672 0.020 . 1 . . . . A 234 ARG HG3 . 34715 1 934 . 1 . 1 94 94 ARG HD2 H 1 3.235 0.020 . 1 . . . . A 234 ARG HD2 . 34715 1 935 . 1 . 1 94 94 ARG HD3 H 1 3.235 0.020 . 1 . . . . A 234 ARG HD3 . 34715 1 936 . 1 . 1 94 94 ARG C C 13 176.645 0.3 . 1 . . . . A 234 ARG C . 34715 1 937 . 1 . 1 94 94 ARG CA C 13 56.981 0.3 . 1 . . . . A 234 ARG CA . 34715 1 938 . 1 . 1 94 94 ARG CB C 13 30.537 0.3 . 1 . . . . A 234 ARG CB . 34715 1 939 . 1 . 1 94 94 ARG CG C 13 26.949 0.3 . 1 . . . . A 234 ARG CG . 34715 1 940 . 1 . 1 94 94 ARG CD C 13 43.186 0.3 . 1 . . . . A 234 ARG CD . 34715 1 941 . 1 . 1 95 95 ALA HA H 1 4.320 0.020 . 1 . . . . A 235 ALA HA . 34715 1 942 . 1 . 1 95 95 ALA HB1 H 1 1.504 0.020 . 1 . . . . A 235 ALA HB1 . 34715 1 943 . 1 . 1 95 95 ALA HB2 H 1 1.504 0.020 . 1 . . . . A 235 ALA HB2 . 34715 1 944 . 1 . 1 95 95 ALA HB3 H 1 1.504 0.020 . 1 . . . . A 235 ALA HB3 . 34715 1 945 . 1 . 1 95 95 ALA C C 13 178.007 0.3 . 1 . . . . A 235 ALA C . 34715 1 946 . 1 . 1 95 95 ALA CA C 13 53.035 0.3 . 1 . . . . A 235 ALA CA . 34715 1 947 . 1 . 1 95 95 ALA CB C 13 18.760 0.3 . 1 . . . . A 235 ALA CB . 34715 1 948 . 1 . 1 96 96 ALA HA H 1 4.348 0.020 . 1 . . . . A 236 ALA HA . 34715 1 949 . 1 . 1 96 96 ALA HB1 H 1 1.499 0.020 . 1 . . . . A 236 ALA HB1 . 34715 1 950 . 1 . 1 96 96 ALA HB2 H 1 1.499 0.020 . 1 . . . . A 236 ALA HB2 . 34715 1 951 . 1 . 1 96 96 ALA HB3 H 1 1.499 0.020 . 1 . . . . A 236 ALA HB3 . 34715 1 952 . 1 . 1 96 96 ALA C C 13 178.107 0.3 . 1 . . . . A 236 ALA C . 34715 1 953 . 1 . 1 96 96 ALA CA C 13 52.845 0.3 . 1 . . . . A 236 ALA CA . 34715 1 954 . 1 . 1 96 96 ALA CB C 13 18.948 0.3 . 1 . . . . A 236 ALA CB . 34715 1 955 . 1 . 1 97 97 ALA HA H 1 4.334 0.020 . 1 . . . . A 237 ALA HA . 34715 1 956 . 1 . 1 97 97 ALA HB1 H 1 1.500 0.020 . 1 . . . . A 237 ALA HB1 . 34715 1 957 . 1 . 1 97 97 ALA HB2 H 1 1.500 0.020 . 1 . . . . A 237 ALA HB2 . 34715 1 958 . 1 . 1 97 97 ALA HB3 H 1 1.500 0.020 . 1 . . . . A 237 ALA HB3 . 34715 1 959 . 1 . 1 97 97 ALA CA C 13 52.869 0.3 . 1 . . . . A 237 ALA CA . 34715 1 960 . 1 . 1 97 97 ALA CB C 13 18.838 0.3 . 1 . . . . A 237 ALA CB . 34715 1 961 . 2 . 2 1 1 G H1' H 1 5.862 0.020 . 1 . . . . B 91 G H1' . 34715 1 962 . 2 . 2 1 1 G H2' H 1 4.956 0.020 . 1 . . . . B 91 G H2' . 34715 1 963 . 2 . 2 1 1 G H3' H 1 4.771 0.020 . 1 . . . . B 91 G H3' . 34715 1 964 . 2 . 2 1 1 G H8 H 1 8.175 0.020 . 1 . . . . B 91 G H8 . 34715 1 965 . 2 . 2 1 1 G C8 C 13 136.133 0.3 . 1 . . . . B 91 G C8 . 34715 1 966 . 2 . 2 2 2 G H1' H 1 5.948 0.020 . 1 . . . . B 92 G H1' . 34715 1 967 . 2 . 2 2 2 G H4' H 1 4.491 0.020 . 1 . . . . B 92 G H4' . 34715 1 968 . 2 . 2 2 2 G H5' H 1 4.292 0.020 . 2 . . . . B 92 G H5' . 34715 1 969 . 2 . 2 2 2 G H5'' H 1 4.200 0.020 . 2 . . . . B 92 G H5'' . 34715 1 970 . 2 . 2 2 2 G H8 H 1 7.480 0.020 . 1 . . . . B 92 G H8 . 34715 1 971 . 2 . 2 2 2 G C1' C 13 89.199 0.3 . 1 . . . . B 92 G C1' . 34715 1 972 . 2 . 2 2 2 G C4' C 13 72.958 0.3 . 1 . . . . B 92 G C4' . 34715 1 973 . 2 . 2 2 2 G C8 C 13 134.595 0.3 . 1 . . . . B 92 G C8 . 34715 1 974 . 2 . 2 3 3 G H1' H 1 5.876 0.020 . 1 . . . . B 93 G H1' . 34715 1 975 . 2 . 2 3 3 G H8 H 1 7.249 0.020 . 1 . . . . B 93 G H8 . 34715 1 976 . 2 . 2 3 3 G C1' C 13 90.307 0.3 . 1 . . . . B 93 G C1' . 34715 1 977 . 2 . 2 3 3 G C8 C 13 133.660 0.3 . 1 . . . . B 93 G C8 . 34715 1 978 . 2 . 2 4 4 A H1' H 1 5.870 0.020 . 1 . . . . B 94 A H1' . 34715 1 979 . 2 . 2 4 4 A H2 H 1 7.888 0.020 . 1 . . . . B 94 A H2 . 34715 1 980 . 2 . 2 4 4 A H8 H 1 7.579 0.020 . 1 . . . . B 94 A H8 . 34715 1 981 . 2 . 2 4 4 A C2 C 13 151.461 0.3 . 1 . . . . B 94 A C2 . 34715 1 982 . 2 . 2 5 5 U H1' H 1 6.081 0.020 . 1 . . . . B 95 U H1' . 34715 1 983 . 2 . 2 5 5 U H4' H 1 4.483 0.020 . 1 . . . . B 95 U H4' . 34715 1 984 . 2 . 2 5 5 U H5 H 1 5.313 0.020 . 1 . . . . B 95 U H5 . 34715 1 985 . 2 . 2 5 5 U H6 H 1 7.621 0.020 . 1 . . . . B 95 U H6 . 34715 1 986 . 2 . 2 5 5 U C1' C 13 90.465 0.3 . 1 . . . . B 95 U C1' . 34715 1 987 . 2 . 2 5 5 U C4' C 13 82.028 0.3 . 1 . . . . B 95 U C4' . 34715 1 988 . 2 . 2 5 5 U C5 C 13 100.698 0.3 . 1 . . . . B 95 U C5 . 34715 1 989 . 2 . 2 5 5 U C6 C 13 138.461 0.3 . 1 . . . . B 95 U C6 . 34715 1 990 . 2 . 2 6 6 U H1' H 1 5.881 0.020 . 1 . . . . B 96 U H1' . 34715 1 991 . 2 . 2 6 6 U H2' H 1 4.540 0.020 . 1 . . . . B 96 U H2' . 34715 1 992 . 2 . 2 6 6 U H3' H 1 4.272 0.020 . 1 . . . . B 96 U H3' . 34715 1 993 . 2 . 2 6 6 U H5 H 1 5.664 0.020 . 1 . . . . B 96 U H5 . 34715 1 994 . 2 . 2 6 6 U H6 H 1 8.089 0.020 . 1 . . . . B 96 U H6 . 34715 1 995 . 2 . 2 6 6 U C1' C 13 91.119 0.3 . 1 . . . . B 96 U C1' . 34715 1 996 . 2 . 2 6 6 U C3' C 13 75.381 0.3 . 1 . . . . B 96 U C3' . 34715 1 997 . 2 . 2 6 6 U C5 C 13 100.856 0.3 . 1 . . . . B 96 U C5 . 34715 1 998 . 2 . 2 6 6 U C6 C 13 140.103 0.3 . 1 . . . . B 96 U C6 . 34715 1 999 . 2 . 2 7 7 U H1' H 1 5.692 0.020 . 1 . . . . B 97 U H1' . 34715 1 1000 . 2 . 2 7 7 U H2' H 1 4.513 0.020 . 1 . . . . B 97 U H2' . 34715 1 1001 . 2 . 2 7 7 U H3' H 1 4.498 0.020 . 1 . . . . B 97 U H3' . 34715 1 1002 . 2 . 2 7 7 U H4' H 1 4.353 0.020 . 1 . . . . B 97 U H4' . 34715 1 1003 . 2 . 2 7 7 U H5 H 1 5.647 0.020 . 1 . . . . B 97 U H5 . 34715 1 1004 . 2 . 2 7 7 U H5' H 1 4.104 0.020 . 1 . . . . B 97 U H5' . 34715 1 1005 . 2 . 2 7 7 U H5'' H 1 4.104 0.020 . 1 . . . . B 97 U H5'' . 34715 1 1006 . 2 . 2 7 7 U H6 H 1 8.065 0.020 . 1 . . . . B 97 U H6 . 34715 1 1007 . 2 . 2 7 7 U C1' C 13 91.712 0.3 . 1 . . . . B 97 U C1' . 34715 1 1008 . 2 . 2 7 7 U C2' C 13 72.404 0.3 . 1 . . . . B 97 U C2' . 34715 1 1009 . 2 . 2 7 7 U C4' C 13 81.912 0.3 . 1 . . . . B 97 U C4' . 34715 1 1010 . 2 . 2 7 7 U C5 C 13 100.816 0.3 . 1 . . . . B 97 U C5 . 34715 1 1011 . 2 . 2 7 7 U C5' C 13 64.569 0.3 . 1 . . . . B 97 U C5' . 34715 1 1012 . 2 . 2 7 7 U C6 C 13 139.979 0.3 . 1 . . . . B 97 U C6 . 34715 1 1013 . 2 . 2 8 8 C H1' H 1 5.613 0.020 . 1 . . . . B 98 C H1' . 34715 1 1014 . 2 . 2 8 8 C H2' H 1 4.439 0.020 . 1 . . . . B 98 C H2' . 34715 1 1015 . 2 . 2 8 8 C H3' H 1 4.372 0.020 . 1 . . . . B 98 C H3' . 34715 1 1016 . 2 . 2 8 8 C H4' H 1 4.401 0.020 . 1 . . . . B 98 C H4' . 34715 1 1017 . 2 . 2 8 8 C H5 H 1 5.712 0.020 . 1 . . . . B 98 C H5 . 34715 1 1018 . 2 . 2 8 8 C H6 H 1 7.969 0.020 . 1 . . . . B 98 C H6 . 34715 1 1019 . 2 . 2 8 8 C C1' C 13 91.455 0.3 . 1 . . . . B 98 C C1' . 34715 1 1020 . 2 . 2 8 8 C C2' C 13 72.382 0.3 . 1 . . . . B 98 C C2' . 34715 1 1021 . 2 . 2 8 8 C C3' C 13 75.391 0.3 . 1 . . . . B 98 C C3' . 34715 1 1022 . 2 . 2 8 8 C C4' C 13 83.742 0.3 . 1 . . . . B 98 C C4' . 34715 1 1023 . 2 . 2 8 8 C C5 C 13 94.998 0.3 . 1 . . . . B 98 C C5 . 34715 1 1024 . 2 . 2 8 8 C C6 C 13 139.480 0.3 . 1 . . . . B 98 C C6 . 34715 1 1025 . 2 . 2 9 9 C H1' H 1 5.618 0.020 . 1 . . . . B 99 C H1' . 34715 1 1026 . 2 . 2 9 9 C H2' H 1 4.425 0.020 . 1 . . . . B 99 C H2' . 34715 1 1027 . 2 . 2 9 9 C H3' H 1 4.419 0.020 . 1 . . . . B 99 C H3' . 34715 1 1028 . 2 . 2 9 9 C H5 H 1 5.524 0.020 . 1 . . . . B 99 C H5 . 34715 1 1029 . 2 . 2 9 9 C H6 H 1 7.866 0.020 . 1 . . . . B 99 C H6 . 34715 1 1030 . 2 . 2 9 9 C C1' C 13 91.138 0.3 . 1 . . . . B 99 C C1' . 34715 1 1031 . 2 . 2 9 9 C C2' C 13 72.220 0.3 . 1 . . . . B 99 C C2' . 34715 1 1032 . 2 . 2 9 9 C C3' C 13 75.317 0.3 . 1 . . . . B 99 C C3' . 34715 1 1033 . 2 . 2 9 9 C C4' C 13 81.787 0.3 . 1 . . . . B 99 C C4' . 34715 1 1034 . 2 . 2 9 9 C C5 C 13 95.077 0.3 . 1 . . . . B 99 C C5 . 34715 1 1035 . 2 . 2 9 9 C C6 C 13 139.023 0.3 . 1 . . . . B 99 C C6 . 34715 1 1036 . 2 . 2 10 10 C H1' H 1 5.512 0.020 . 1 . . . . B 100 C H1' . 34715 1 1037 . 2 . 2 10 10 C H2' H 1 4.310 0.020 . 1 . . . . B 100 C H2' . 34715 1 1038 . 2 . 2 10 10 C H3' H 1 4.410 0.020 . 1 . . . . B 100 C H3' . 34715 1 1039 . 2 . 2 10 10 C H4' H 1 4.371 0.020 . 1 . . . . B 100 C H4' . 34715 1 1040 . 2 . 2 10 10 C H5 H 1 5.500 0.020 . 1 . . . . B 100 C H5 . 34715 1 1041 . 2 . 2 10 10 C H5' H 1 4.509 0.020 . 2 . . . . B 100 C H5' . 34715 1 1042 . 2 . 2 10 10 C H5'' H 1 4.034 0.020 . 2 . . . . B 100 C H5'' . 34715 1 1043 . 2 . 2 10 10 C H6 H 1 7.790 0.020 . 1 . . . . B 100 C H6 . 34715 1 1044 . 2 . 2 10 10 C C1' C 13 91.594 0.3 . 1 . . . . B 100 C C1' . 34715 1 1045 . 2 . 2 10 10 C C2' C 13 75.317 0.3 . 1 . . . . B 100 C C2' . 34715 1 1046 . 2 . 2 10 10 C C3' C 13 72.079 0.3 . 1 . . . . B 100 C C3' . 34715 1 1047 . 2 . 2 10 10 C C4' C 13 81.839 0.3 . 1 . . . . B 100 C C4' . 34715 1 1048 . 2 . 2 10 10 C C5 C 13 94.978 0.3 . 1 . . . . B 100 C C5 . 34715 1 1049 . 2 . 2 10 10 C C5' C 13 64.277 0.3 . 1 . . . . B 100 C C5' . 34715 1 1050 . 2 . 2 10 10 C C6 C 13 138.835 0.3 . 1 . . . . B 100 C C6 . 34715 1 1051 . 2 . 2 11 11 C H1' H 1 5.609 0.020 . 1 . . . . B 101 C H1' . 34715 1 1052 . 2 . 2 11 11 C H2' H 1 4.446 0.020 . 1 . . . . B 101 C H2' . 34715 1 1053 . 2 . 2 11 11 C H3' H 1 4.370 0.020 . 1 . . . . B 101 C H3' . 34715 1 1054 . 2 . 2 11 11 C H4' H 1 4.320 0.020 . 1 . . . . B 101 C H4' . 34715 1 1055 . 2 . 2 11 11 C H5 H 1 5.524 0.020 . 1 . . . . B 101 C H5 . 34715 1 1056 . 2 . 2 11 11 C H5' H 1 4.516 0.020 . 2 . . . . B 101 C H5' . 34715 1 1057 . 2 . 2 11 11 C H5'' H 1 4.039 0.020 . 2 . . . . B 101 C H5'' . 34715 1 1058 . 2 . 2 11 11 C H6 H 1 7.716 0.020 . 1 . . . . B 101 C H6 . 34715 1 1059 . 2 . 2 11 11 C C1' C 13 91.435 0.3 . 1 . . . . B 101 C C1' . 34715 1 1060 . 2 . 2 11 11 C C2' C 13 72.377 0.3 . 1 . . . . B 101 C C2' . 34715 1 1061 . 2 . 2 11 11 C C3' C 13 75.505 0.3 . 1 . . . . B 101 C C3' . 34715 1 1062 . 2 . 2 11 11 C C4' C 13 82.415 0.3 . 1 . . . . B 101 C C4' . 34715 1 1063 . 2 . 2 11 11 C C5 C 13 95.374 0.3 . 1 . . . . B 101 C C5 . 34715 1 1064 . 2 . 2 11 11 C C5' C 13 64.476 0.3 . 1 . . . . B 101 C C5' . 34715 1 1065 . 2 . 2 11 11 C C6 C 13 138.732 0.3 . 1 . . . . B 101 C C6 . 34715 1 1066 . 2 . 2 12 12 A H1' H 1 5.953 0.020 . 1 . . . . B 102 A H1' . 34715 1 1067 . 2 . 2 12 12 A H2 H 1 7.810 0.020 . 1 . . . . B 102 A H2 . 34715 1 1068 . 2 . 2 12 12 A H2' H 1 4.808 0.020 . 1 . . . . B 102 A H2' . 34715 1 1069 . 2 . 2 12 12 A H3' H 1 4.621 0.020 . 1 . . . . B 102 A H3' . 34715 1 1070 . 2 . 2 12 12 A H4' H 1 4.377 0.020 . 1 . . . . B 102 A H4' . 34715 1 1071 . 2 . 2 12 12 A H5' H 1 4.141 0.020 . 2 . . . . B 102 A H5' . 34715 1 1072 . 2 . 2 12 12 A H5'' H 1 4.089 0.020 . 2 . . . . B 102 A H5'' . 34715 1 1073 . 2 . 2 12 12 A H8 H 1 8.113 0.020 . 1 . . . . B 102 A H8 . 34715 1 1074 . 2 . 2 12 12 A C1' C 13 90.070 0.3 . 1 . . . . B 102 A C1' . 34715 1 1075 . 2 . 2 12 12 A C2 C 13 151.937 0.3 . 1 . . . . B 102 A C2 . 34715 1 1076 . 2 . 2 12 12 A C2' C 13 74.471 0.3 . 1 . . . . B 102 A C2' . 34715 1 1077 . 2 . 2 12 12 A C3' C 13 75.840 0.3 . 1 . . . . B 102 A C3' . 34715 1 1078 . 2 . 2 12 12 A C4' C 13 83.460 0.3 . 1 . . . . B 102 A C4' . 34715 1 1079 . 2 . 2 12 12 A C5' C 13 67.819 0.3 . 1 . . . . B 102 A C5' . 34715 1 1080 . 2 . 2 12 12 A C8 C 13 138.253 0.3 . 1 . . . . B 102 A C8 . 34715 1 1081 . 2 . 2 13 13 A H1' H 1 5.839 0.020 . 1 . . . . B 103 A H1' . 34715 1 1082 . 2 . 2 13 13 A H2 H 1 8.131 0.020 . 1 . . . . B 103 A H2 . 34715 1 1083 . 2 . 2 13 13 A H2' H 1 4.691 0.020 . 1 . . . . B 103 A H2' . 34715 1 1084 . 2 . 2 13 13 A H3' H 1 4.622 0.020 . 1 . . . . B 103 A H3' . 34715 1 1085 . 2 . 2 13 13 A H4' H 1 4.299 0.020 . 1 . . . . B 103 A H4' . 34715 1 1086 . 2 . 2 13 13 A H5' H 1 4.210 0.020 . 2 . . . . B 103 A H5' . 34715 1 1087 . 2 . 2 13 13 A H5'' H 1 4.077 0.020 . 2 . . . . B 103 A H5'' . 34715 1 1088 . 2 . 2 13 13 A H8 H 1 8.227 0.020 . 1 . . . . B 103 A H8 . 34715 1 1089 . 2 . 2 13 13 A C1' C 13 87.378 0.3 . 1 . . . . B 103 A C1' . 34715 1 1090 . 2 . 2 13 13 A C2 C 13 152.008 0.3 . 1 . . . . B 103 A C2 . 34715 1 1091 . 2 . 2 13 13 A C2' C 13 76.956 0.3 . 1 . . . . B 103 A C2' . 34715 1 1092 . 2 . 2 13 13 A C3' C 13 76.507 0.3 . 1 . . . . B 103 A C3' . 34715 1 1093 . 2 . 2 13 13 A C4' C 13 84.847 0.3 . 1 . . . . B 103 A C4' . 34715 1 1094 . 2 . 2 13 13 A C5' C 13 66.928 0.3 . 1 . . . . B 103 A C5' . 34715 1 1095 . 2 . 2 13 13 A C8 C 13 139.459 0.3 . 1 . . . . B 103 A C8 . 34715 1 1096 . 2 . 2 14 14 A H1' H 1 6.060 0.020 . 1 . . . . B 104 A H1' . 34715 1 1097 . 2 . 2 14 14 A H2 H 1 8.176 0.020 . 1 . . . . B 104 A H2 . 34715 1 1098 . 2 . 2 14 14 A H2' H 1 4.890 0.020 . 1 . . . . B 104 A H2' . 34715 1 1099 . 2 . 2 14 14 A H3' H 1 4.807 0.020 . 1 . . . . B 104 A H3' . 34715 1 1100 . 2 . 2 14 14 A H4' H 1 4.482 0.020 . 1 . . . . B 104 A H4' . 34715 1 1101 . 2 . 2 14 14 A H5' H 1 4.272 0.020 . 2 . . . . B 104 A H5' . 34715 1 1102 . 2 . 2 14 14 A H5'' H 1 4.146 0.020 . 2 . . . . B 104 A H5'' . 34715 1 1103 . 2 . 2 14 14 A H8 H 1 8.325 0.020 . 1 . . . . B 104 A H8 . 34715 1 1104 . 2 . 2 14 14 A C1' C 13 87.437 0.3 . 1 . . . . B 104 A C1' . 34715 1 1105 . 2 . 2 14 14 A C2 C 13 152.001 0.3 . 1 . . . . B 104 A C2 . 34715 1 1106 . 2 . 2 14 14 A C2' C 13 77.545 0.3 . 1 . . . . B 104 A C2' . 34715 1 1107 . 2 . 2 14 14 A C3' C 13 76.511 0.3 . 1 . . . . B 104 A C3' . 34715 1 1108 . 2 . 2 14 14 A C4' C 13 85.519 0.3 . 1 . . . . B 104 A C4' . 34715 1 1109 . 2 . 2 14 14 A C5' C 13 67.687 0.3 . 1 . . . . B 104 A C5' . 34715 1 1110 . 2 . 2 14 14 A C8 C 13 139.864 0.3 . 1 . . . . B 104 A C8 . 34715 1 1111 . 2 . 2 15 15 U H1' H 1 5.956 0.020 . 1 . . . . B 105 U H1' . 34715 1 1112 . 2 . 2 15 15 U H2' H 1 4.715 0.020 . 1 . . . . B 105 U H2' . 34715 1 1113 . 2 . 2 15 15 U H3' H 1 4.445 0.020 . 1 . . . . B 105 U H3' . 34715 1 1114 . 2 . 2 15 15 U H4' H 1 4.405 0.020 . 1 . . . . B 105 U H4' . 34715 1 1115 . 2 . 2 15 15 U H5 H 1 5.886 0.020 . 1 . . . . B 105 U H5 . 34715 1 1116 . 2 . 2 15 15 U H5' H 1 4.150 0.020 . 2 . . . . B 105 U H5' . 34715 1 1117 . 2 . 2 15 15 U H5'' H 1 4.113 0.020 . 2 . . . . B 105 U H5'' . 34715 1 1118 . 2 . 2 15 15 U H6 H 1 7.842 0.020 . 1 . . . . B 105 U H6 . 34715 1 1119 . 2 . 2 15 15 U C1' C 13 88.189 0.3 . 1 . . . . B 105 U C1' . 34715 1 1120 . 2 . 2 15 15 U C2' C 13 77.012 0.3 . 1 . . . . B 105 U C2' . 34715 1 1121 . 2 . 2 15 15 U C3' C 13 75.614 0.3 . 1 . . . . B 105 U C3' . 34715 1 1122 . 2 . 2 15 15 U C4' C 13 85.196 0.3 . 1 . . . . B 105 U C4' . 34715 1 1123 . 2 . 2 15 15 U C5 C 13 102.795 0.3 . 1 . . . . B 105 U C5 . 34715 1 1124 . 2 . 2 15 15 U C5' C 13 67.884 0.3 . 1 . . . . B 105 U C5' . 34715 1 1125 . 2 . 2 15 15 U C6 C 13 141.413 0.3 . 1 . . . . B 105 U C6 . 34715 1 1126 . 2 . 2 16 16 G H1' H 1 5.845 0.020 . 1 . . . . B 106 G H1' . 34715 1 1127 . 2 . 2 16 16 G H2' H 1 4.889 0.020 . 1 . . . . B 106 G H2' . 34715 1 1128 . 2 . 2 16 16 G H3' H 1 4.807 0.020 . 1 . . . . B 106 G H3' . 34715 1 1129 . 2 . 2 16 16 G H4' H 1 4.368 0.020 . 1 . . . . B 106 G H4' . 34715 1 1130 . 2 . 2 16 16 G H5' H 1 4.134 0.020 . 2 . . . . B 106 G H5' . 34715 1 1131 . 2 . 2 16 16 G H5'' H 1 4.067 0.020 . 2 . . . . B 106 G H5'' . 34715 1 1132 . 2 . 2 16 16 G H8 H 1 8.016 0.020 . 1 . . . . B 106 G H8 . 34715 1 1133 . 2 . 2 16 16 G C1' C 13 85.799 0.3 . 1 . . . . B 106 G C1' . 34715 1 1134 . 2 . 2 16 16 G C2' C 13 77.321 0.3 . 1 . . . . B 106 G C2' . 34715 1 1135 . 2 . 2 16 16 G C3' C 13 75.863 0.3 . 1 . . . . B 106 G C3' . 34715 1 1136 . 2 . 2 16 16 G C4' C 13 85.411 0.3 . 1 . . . . B 106 G C4' . 34715 1 1137 . 2 . 2 16 16 G C5' C 13 67.882 0.3 . 1 . . . . B 106 G C5' . 34715 1 1138 . 2 . 2 16 16 G C8 C 13 136.383 0.3 . 1 . . . . B 106 G C8 . 34715 1 1139 . 2 . 2 17 17 U H1' H 1 6.077 0.020 . 1 . . . . B 107 U H1' . 34715 1 1140 . 2 . 2 17 17 U H2' H 1 4.836 0.020 . 1 . . . . B 107 U H2' . 34715 1 1141 . 2 . 2 17 17 U H3' H 1 4.602 0.020 . 1 . . . . B 107 U H3' . 34715 1 1142 . 2 . 2 17 17 U H4' H 1 4.467 0.020 . 1 . . . . B 107 U H4' . 34715 1 1143 . 2 . 2 17 17 U H5 H 1 5.980 0.020 . 1 . . . . B 107 U H5 . 34715 1 1144 . 2 . 2 17 17 U H5' H 1 4.328 0.020 . 2 . . . . B 107 U H5' . 34715 1 1145 . 2 . 2 17 17 U H5'' H 1 4.200 0.020 . 2 . . . . B 107 U H5'' . 34715 1 1146 . 2 . 2 17 17 U H6 H 1 7.959 0.020 . 1 . . . . B 107 U H6 . 34715 1 1147 . 2 . 2 17 17 U C1' C 13 89.060 0.3 . 1 . . . . B 107 U C1' . 34715 1 1148 . 2 . 2 17 17 U C2' C 13 76.310 0.3 . 1 . . . . B 107 U C2' . 34715 1 1149 . 2 . 2 17 17 U C3' C 13 75.732 0.3 . 1 . . . . B 107 U C3' . 34715 1 1150 . 2 . 2 17 17 U C4' C 13 85.279 0.3 . 1 . . . . B 107 U C4' . 34715 1 1151 . 2 . 2 17 17 U C5 C 13 102.756 0.3 . 1 . . . . B 107 U C5 . 34715 1 1152 . 2 . 2 17 17 U C5' C 13 67.816 0.3 . 1 . . . . B 107 U C5' . 34715 1 1153 . 2 . 2 17 17 U C6 C 13 141.559 0.3 . 1 . . . . B 107 U C6 . 34715 1 1154 . 2 . 2 18 18 G H1' H 1 5.735 0.020 . 1 . . . . B 108 G H1' . 34715 1 1155 . 2 . 2 18 18 G H2' H 1 4.804 0.020 . 1 . . . . B 108 G H2' . 34715 1 1156 . 2 . 2 18 18 G H3' H 1 4.469 0.020 . 1 . . . . B 108 G H3' . 34715 1 1157 . 2 . 2 18 18 G H8 H 1 7.558 0.020 . 1 . . . . B 108 G H8 . 34715 1 1158 . 2 . 2 18 18 G C1' C 13 90.861 0.3 . 1 . . . . B 108 G C1' . 34715 1 1159 . 2 . 2 18 18 G C2' C 13 74.997 0.3 . 1 . . . . B 108 G C2' . 34715 1 1160 . 2 . 2 18 18 G C8 C 13 133.909 0.3 . 1 . . . . B 108 G C8 . 34715 1 1161 . 2 . 2 19 19 G H1' H 1 5.902 0.020 . 1 . . . . B 109 G H1' . 34715 1 1162 . 2 . 2 19 19 G H2' H 1 4.713 0.020 . 1 . . . . B 109 G H2' . 34715 1 1163 . 2 . 2 19 19 G H3' H 1 4.608 0.020 . 1 . . . . B 109 G H3' . 34715 1 1164 . 2 . 2 19 19 G H4' H 1 4.556 0.020 . 1 . . . . B 109 G H4' . 34715 1 1165 . 2 . 2 19 19 G H8 H 1 7.366 0.020 . 1 . . . . B 109 G H8 . 34715 1 1166 . 2 . 2 19 19 G C1' C 13 90.188 0.3 . 1 . . . . B 109 G C1' . 34715 1 1167 . 2 . 2 19 19 G C2' C 13 72.512 0.3 . 1 . . . . B 109 G C2' . 34715 1 1168 . 2 . 2 19 19 G C3' C 13 64.864 0.3 . 1 . . . . B 109 G C3' . 34715 1 1169 . 2 . 2 19 19 G C4' C 13 82.011 0.3 . 1 . . . . B 109 G C4' . 34715 1 1170 . 2 . 2 19 19 G C8 C 13 133.764 0.3 . 1 . . . . B 109 G C8 . 34715 1 1171 . 2 . 2 20 20 G H1' H 1 5.816 0.020 . 1 . . . . B 110 G H1' . 34715 1 1172 . 2 . 2 20 20 G H2' H 1 4.715 0.020 . 1 . . . . B 110 G H2' . 34715 1 1173 . 2 . 2 20 20 G H3' H 1 4.526 0.020 . 1 . . . . B 110 G H3' . 34715 1 1174 . 2 . 2 20 20 G H8 H 1 7.161 0.020 . 1 . . . . B 110 G H8 . 34715 1 1175 . 2 . 2 20 20 G C1' C 13 90.267 0.3 . 1 . . . . B 110 G C1' . 34715 1 1176 . 2 . 2 20 20 G C2' C 13 75.556 0.3 . 1 . . . . B 110 G C2' . 34715 1 1177 . 2 . 2 20 20 G C3' C 13 72.645 0.3 . 1 . . . . B 110 G C3' . 34715 1 1178 . 2 . 2 20 20 G C8 C 13 133.618 0.3 . 1 . . . . B 110 G C8 . 34715 1 1179 . 2 . 2 21 21 A H1' H 1 6.000 0.020 . 1 . . . . B 111 A H1' . 34715 1 1180 . 2 . 2 21 21 A H2 H 1 7.258 0.020 . 1 . . . . B 111 A H2 . 34715 1 1181 . 2 . 2 21 21 A H2' H 1 4.756 0.020 . 1 . . . . B 111 A H2' . 34715 1 1182 . 2 . 2 21 21 A H3' H 1 4.686 0.020 . 1 . . . . B 111 A H3' . 34715 1 1183 . 2 . 2 21 21 A H8 H 1 7.720 0.020 . 1 . . . . B 111 A H8 . 34715 1 1184 . 2 . 2 21 21 A C1' C 13 89.753 0.3 . 1 . . . . B 111 A C1' . 34715 1 1185 . 2 . 2 21 21 A C2 C 13 150.459 0.3 . 1 . . . . B 111 A C2 . 34715 1 1186 . 2 . 2 21 21 A C2' C 13 75.642 0.3 . 1 . . . . B 111 A C2' . 34715 1 1187 . 2 . 2 21 21 A C3' C 13 72.900 0.3 . 1 . . . . B 111 A C3' . 34715 1 1188 . 2 . 2 21 21 A C8 C 13 136.798 0.3 . 1 . . . . B 111 A C8 . 34715 1 1189 . 2 . 2 22 22 A H1' H 1 5.816 0.020 . 1 . . . . B 112 A H1' . 34715 1 1190 . 2 . 2 22 22 A H2 H 1 7.348 0.020 . 1 . . . . B 112 A H2 . 34715 1 1191 . 2 . 2 22 22 A H2' H 1 4.546 0.020 . 1 . . . . B 112 A H2' . 34715 1 1192 . 2 . 2 22 22 A H3' H 1 4.629 0.020 . 1 . . . . B 112 A H3' . 34715 1 1193 . 2 . 2 22 22 A H8 H 1 7.660 0.020 . 1 . . . . B 112 A H8 . 34715 1 1194 . 2 . 2 22 22 A C1' C 13 90.386 0.3 . 1 . . . . B 112 A C1' . 34715 1 1195 . 2 . 2 22 22 A C2 C 13 150.360 0.3 . 1 . . . . B 112 A C2 . 34715 1 1196 . 2 . 2 22 22 A C2' C 13 73.162 0.3 . 1 . . . . B 112 A C2' . 34715 1 1197 . 2 . 2 22 22 A C3' C 13 75.539 0.3 . 1 . . . . B 112 A C3' . 34715 1 1198 . 2 . 2 22 22 A C4' C 13 73.154 0.3 . 1 . . . . B 112 A C4' . 34715 1 1199 . 2 . 2 22 22 A C8 C 13 136.611 0.3 . 1 . . . . B 112 A C8 . 34715 1 1200 . 2 . 2 23 23 A H1' H 1 5.963 0.020 . 1 . . . . B 113 A H1' . 34715 1 1201 . 2 . 2 23 23 A H2 H 1 7.449 0.020 . 1 . . . . B 113 A H2 . 34715 1 1202 . 2 . 2 23 23 A H2' H 1 4.718 0.020 . 1 . . . . B 113 A H2' . 34715 1 1203 . 2 . 2 23 23 A H8 H 1 7.834 0.020 . 1 . . . . B 113 A H8 . 34715 1 1204 . 2 . 2 23 23 A C1' C 13 87.991 0.3 . 1 . . . . B 113 A C1' . 34715 1 1205 . 2 . 2 23 23 A C2 C 13 150.878 0.3 . 1 . . . . B 113 A C2 . 34715 1 1206 . 2 . 2 23 23 A C8 C 13 137.360 0.3 . 1 . . . . B 113 A C8 . 34715 1 1207 . 2 . 2 24 24 C H1' H 1 5.739 0.020 . 1 . . . . B 114 C H1' . 34715 1 1208 . 2 . 2 24 24 C H2' H 1 3.969 0.020 . 1 . . . . B 114 C H2' . 34715 1 1209 . 2 . 2 24 24 C H3' H 1 4.260 0.020 . 1 . . . . B 114 C H3' . 34715 1 1210 . 2 . 2 24 24 C H4' H 1 4.144 0.020 . 1 . . . . B 114 C H4' . 34715 1 1211 . 2 . 2 24 24 C H5 H 1 5.549 0.020 . 1 . . . . B 114 C H5 . 34715 1 1212 . 2 . 2 24 24 C H5' H 1 4.153 0.020 . 1 . . . . B 114 C H5' . 34715 1 1213 . 2 . 2 24 24 C H5'' H 1 4.153 0.020 . 1 . . . . B 114 C H5'' . 34715 1 1214 . 2 . 2 24 24 C H6 H 1 7.801 0.020 . 1 . . . . B 114 C H6 . 34715 1 1215 . 2 . 2 24 24 C C1' C 13 90.683 0.3 . 1 . . . . B 114 C C1' . 34715 1 1216 . 2 . 2 24 24 C C2' C 13 77.467 0.3 . 1 . . . . B 114 C C2' . 34715 1 1217 . 2 . 2 24 24 C C3' C 13 75.537 0.3 . 1 . . . . B 114 C C3' . 34715 1 1218 . 2 . 2 24 24 C C4' C 13 83.523 0.3 . 1 . . . . B 114 C C4' . 34715 1 1219 . 2 . 2 24 24 C C5 C 13 95.690 0.3 . 1 . . . . B 114 C C5 . 34715 1 1220 . 2 . 2 24 24 C C5' C 13 69.723 0.3 . 1 . . . . B 114 C C5' . 34715 1 1221 . 2 . 2 24 24 C C6 C 13 140.665 0.3 . 1 . . . . B 114 C C6 . 34715 1 1222 . 2 . 2 25 25 U H1' H 1 5.641 0.020 . 1 . . . . B 115 U H1' . 34715 1 1223 . 2 . 2 25 25 U H2' H 1 4.510 0.020 . 1 . . . . B 115 U H2' . 34715 1 1224 . 2 . 2 25 25 U H3' H 1 4.484 0.020 . 1 . . . . B 115 U H3' . 34715 1 1225 . 2 . 2 25 25 U H4' H 1 4.456 0.020 . 1 . . . . B 115 U H4' . 34715 1 1226 . 2 . 2 25 25 U H5 H 1 5.442 0.020 . 1 . . . . B 115 U H5 . 34715 1 1227 . 2 . 2 25 25 U H5' H 1 4.088 0.020 . 1 . . . . B 115 U H5' . 34715 1 1228 . 2 . 2 25 25 U H5'' H 1 4.088 0.020 . 1 . . . . B 115 U H5'' . 34715 1 1229 . 2 . 2 25 25 U H6 H 1 7.941 0.020 . 1 . . . . B 115 U H6 . 34715 1 1230 . 2 . 2 25 25 U C1' C 13 91.297 0.3 . 1 . . . . B 115 U C1' . 34715 1 1231 . 2 . 2 25 25 U C2' C 13 75.166 0.3 . 1 . . . . B 115 U C2' . 34715 1 1232 . 2 . 2 25 25 U C3' C 13 73.284 0.3 . 1 . . . . B 115 U C3' . 34715 1 1233 . 2 . 2 25 25 U C4' C 13 82.941 0.3 . 1 . . . . B 115 U C4' . 34715 1 1234 . 2 . 2 25 25 U C5 C 13 101.430 0.3 . 1 . . . . B 115 U C5 . 34715 1 1235 . 2 . 2 25 25 U C5' C 13 64.563 0.3 . 1 . . . . B 115 U C5' . 34715 1 1236 . 2 . 2 25 25 U C6 C 13 140.561 0.3 . 1 . . . . B 115 U C6 . 34715 1 1237 . 2 . 2 26 26 C H5 H 1 5.775 0.020 . 1 . . . . B 116 C H5 . 34715 1 1238 . 2 . 2 26 26 C H6 H 1 8.026 0.020 . 1 . . . . B 116 C H6 . 34715 1 1239 . 2 . 2 26 26 C C5 C 13 95.116 0.3 . 1 . . . . B 116 C C5 . 34715 1 1240 . 2 . 2 26 26 C C6 C 13 139.792 0.3 . 1 . . . . B 116 C C6 . 34715 1 1241 . 2 . 2 27 27 C H5 H 1 5.571 0.020 . 1 . . . . B 117 C H5 . 34715 1 1242 . 2 . 2 27 27 C H6 H 1 7.919 0.020 . 1 . . . . B 117 C H6 . 34715 1 1243 . 2 . 2 27 27 C C5 C 13 95.136 0.3 . 1 . . . . B 117 C C5 . 34715 1 1244 . 2 . 2 27 27 C C6 C 13 140.976 0.3 . 1 . . . . B 117 C C6 . 34715 1 1245 . 2 . 2 28 28 C H5 H 1 5.957 0.020 . 1 . . . . B 118 C H5 . 34715 1 1246 . 2 . 2 28 28 C H6 H 1 7.874 0.020 . 1 . . . . B 118 C H6 . 34715 1 1247 . 2 . 2 28 28 C C5 C 13 95.967 0.3 . 1 . . . . B 118 C C5 . 34715 1 1248 . 2 . 2 28 28 C C6 C 13 139.979 0.3 . 1 . . . . B 118 C C6 . 34715 1 stop_ save_