data_25473 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25473 _Entry.Title ; Pcf11 second N-terminal domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-02-06 _Entry.Accession_date 2015-02-06 _Entry.Last_release_date 2016-11-02 _Entry.Original_release_date 2016-11-02 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.1.61 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Helical domain located C-terminal to the CID in Pcf11' _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 Xiaoqian Xu . . . . 25473 2 Cameron Mackereth . D . . 25473 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25473 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 454 25473 '15N chemical shifts' 107 25473 '1H chemical shifts' 765 25473 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-11-02 . original BMRB . 25473 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID SGD PCF11 'Protein 1 of Cleavage and polyadenylation Factor I' 25473 SP P39081 'PCF11 YEAST' 25473 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25473 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26133941 _Citation.Full_citation . _Citation.Title ; Chemical shift assignments of a new folded domain from yeast Pcf11 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 9 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 421 _Citation.Page_last 425 _Citation.Year 2015 _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 Xiaoqian Xu . . . . 25473 1 2 Natacha Perebaskine . . . . 25473 1 3 Lionel Minvielle-Sebastia . . . . 25473 1 4 Sebastien Fribourg . . . . 25473 1 5 Cameron Mackereth . D. . . 25473 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25473 _Assembly.ID 1 _Assembly.Name Pcf11 _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 Pcf11 1 $Pcf11 A . yes native no no . . . 25473 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pcf11 _Entity.Sf_category entity _Entity.Sf_framecode Pcf11 _Entity.Entry_ID 25473 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Pcf11 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMLHQKNLQAMLPTPTVPL LLRDIDKLTCLTSERLKNQP NDEKLKMKLLVLSQLKQELK REKLTLNALKQVQMQLRQVF SQDQQVLQERMRYHEL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Contains N-terminal Gly-His-Met residues following cleavage of the His6-tag by TEV protease' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 96 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes UNP P39081 . PCF11 . . . . . . . . . . . . . . 25473 1 . yes NCBI NP_010514.3 . Pcf11p . . . . . . . . . . . . . . 25473 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 1 138 GLY . 25473 1 2 139 HIS . 25473 1 3 140 MET . 25473 1 4 141 LEU . 25473 1 5 142 HIS . 25473 1 6 143 GLN . 25473 1 7 144 LYS . 25473 1 8 145 ASN . 25473 1 9 146 LEU . 25473 1 10 147 GLN . 25473 1 11 148 ALA . 25473 1 12 149 MET . 25473 1 13 150 LEU . 25473 1 14 151 PRO . 25473 1 15 152 THR . 25473 1 16 153 PRO . 25473 1 17 154 THR . 25473 1 18 155 VAL . 25473 1 19 156 PRO . 25473 1 20 157 LEU . 25473 1 21 158 LEU . 25473 1 22 159 LEU . 25473 1 23 160 ARG . 25473 1 24 161 ASP . 25473 1 25 162 ILE . 25473 1 26 163 ASP . 25473 1 27 164 LYS . 25473 1 28 165 LEU . 25473 1 29 166 THR . 25473 1 30 167 CYS . 25473 1 31 168 LEU . 25473 1 32 169 THR . 25473 1 33 170 SER . 25473 1 34 171 GLU . 25473 1 35 172 ARG . 25473 1 36 173 LEU . 25473 1 37 174 LYS . 25473 1 38 175 ASN . 25473 1 39 176 GLN . 25473 1 40 177 PRO . 25473 1 41 178 ASN . 25473 1 42 179 ASP . 25473 1 43 180 GLU . 25473 1 44 181 LYS . 25473 1 45 182 LEU . 25473 1 46 183 LYS . 25473 1 47 184 MET . 25473 1 48 185 LYS . 25473 1 49 186 LEU . 25473 1 50 187 LEU . 25473 1 51 188 VAL . 25473 1 52 189 LEU . 25473 1 53 190 SER . 25473 1 54 191 GLN . 25473 1 55 192 LEU . 25473 1 56 193 LYS . 25473 1 57 194 GLN . 25473 1 58 195 GLU . 25473 1 59 196 LEU . 25473 1 60 197 LYS . 25473 1 61 198 ARG . 25473 1 62 199 GLU . 25473 1 63 200 LYS . 25473 1 64 201 LEU . 25473 1 65 202 THR . 25473 1 66 203 LEU . 25473 1 67 204 ASN . 25473 1 68 205 ALA . 25473 1 69 206 LEU . 25473 1 70 207 LYS . 25473 1 71 208 GLN . 25473 1 72 209 VAL . 25473 1 73 210 GLN . 25473 1 74 211 MET . 25473 1 75 212 GLN . 25473 1 76 213 LEU . 25473 1 77 214 ARG . 25473 1 78 215 GLN . 25473 1 79 216 VAL . 25473 1 80 217 PHE . 25473 1 81 218 SER . 25473 1 82 219 GLN . 25473 1 83 220 ASP . 25473 1 84 221 GLN . 25473 1 85 222 GLN . 25473 1 86 223 VAL . 25473 1 87 224 LEU . 25473 1 88 225 GLN . 25473 1 89 226 GLU . 25473 1 90 227 ARG . 25473 1 91 228 MET . 25473 1 92 229 ARG . 25473 1 93 230 TYR . 25473 1 94 231 HIS . 25473 1 95 232 GLU . 25473 1 96 233 LEU . 25473 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 25473 1 . HIS 2 2 25473 1 . MET 3 3 25473 1 . LEU 4 4 25473 1 . HIS 5 5 25473 1 . GLN 6 6 25473 1 . LYS 7 7 25473 1 . ASN 8 8 25473 1 . LEU 9 9 25473 1 . GLN 10 10 25473 1 . ALA 11 11 25473 1 . MET 12 12 25473 1 . LEU 13 13 25473 1 . PRO 14 14 25473 1 . THR 15 15 25473 1 . PRO 16 16 25473 1 . THR 17 17 25473 1 . VAL 18 18 25473 1 . PRO 19 19 25473 1 . LEU 20 20 25473 1 . LEU 21 21 25473 1 . LEU 22 22 25473 1 . ARG 23 23 25473 1 . ASP 24 24 25473 1 . ILE 25 25 25473 1 . ASP 26 26 25473 1 . LYS 27 27 25473 1 . LEU 28 28 25473 1 . THR 29 29 25473 1 . CYS 30 30 25473 1 . LEU 31 31 25473 1 . THR 32 32 25473 1 . SER 33 33 25473 1 . GLU 34 34 25473 1 . ARG 35 35 25473 1 . LEU 36 36 25473 1 . LYS 37 37 25473 1 . ASN 38 38 25473 1 . GLN 39 39 25473 1 . PRO 40 40 25473 1 . ASN 41 41 25473 1 . ASP 42 42 25473 1 . GLU 43 43 25473 1 . LYS 44 44 25473 1 . LEU 45 45 25473 1 . LYS 46 46 25473 1 . MET 47 47 25473 1 . LYS 48 48 25473 1 . LEU 49 49 25473 1 . LEU 50 50 25473 1 . VAL 51 51 25473 1 . LEU 52 52 25473 1 . SER 53 53 25473 1 . GLN 54 54 25473 1 . LEU 55 55 25473 1 . LYS 56 56 25473 1 . GLN 57 57 25473 1 . GLU 58 58 25473 1 . LEU 59 59 25473 1 . LYS 60 60 25473 1 . ARG 61 61 25473 1 . GLU 62 62 25473 1 . LYS 63 63 25473 1 . LEU 64 64 25473 1 . THR 65 65 25473 1 . LEU 66 66 25473 1 . ASN 67 67 25473 1 . ALA 68 68 25473 1 . LEU 69 69 25473 1 . LYS 70 70 25473 1 . GLN 71 71 25473 1 . VAL 72 72 25473 1 . GLN 73 73 25473 1 . MET 74 74 25473 1 . GLN 75 75 25473 1 . LEU 76 76 25473 1 . ARG 77 77 25473 1 . GLN 78 78 25473 1 . VAL 79 79 25473 1 . PHE 80 80 25473 1 . SER 81 81 25473 1 . GLN 82 82 25473 1 . ASP 83 83 25473 1 . GLN 84 84 25473 1 . GLN 85 85 25473 1 . VAL 86 86 25473 1 . LEU 87 87 25473 1 . GLN 88 88 25473 1 . GLU 89 89 25473 1 . ARG 90 90 25473 1 . MET 91 91 25473 1 . ARG 92 92 25473 1 . TYR 93 93 25473 1 . HIS 94 94 25473 1 . GLU 95 95 25473 1 . LEU 96 96 25473 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25473 _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 $Pcf11 . 4932 organism . 'Saccharomyces cerevisiae' "baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . PCF11 . 25473 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 25473 _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 $Pcf11 . 'recombinant technology' 'Escherichia coli' . . 511693 Escherichia coli BL21 LysY . . . . pET15b . . . 25473 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25473 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pcf11 '[U-99% 15N]' . . 1 $Pcf11 . protein 450 . . uM . . . . 25473 1 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25473 1 3 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 25473 1 4 D2O '[U-100% 2H]' . . . . . solvent 10 . . % . . . . 25473 1 5 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25473 1 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25473 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25473 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pcf11 '[U-99% 13C; U-99% 15N]' . . 1 $Pcf11 . protein 200 . . uM . . . . 25473 2 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25473 2 3 'sodium chloride' 'natural abundance' . . . . . salt 150 . . mM . . . . 25473 2 4 D2O '[U-100% 2H]' . . . . . solvent 10 . . % . . . . 25473 2 5 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25473 2 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25473 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25473 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pcf11 '[U-99% 13C; U-99% 15N]' . . 1 $Pcf11 . protein 200 . . uM . . . . 25473 3 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25473 3 3 'sodium chloride' 'natural abundance' . . . . . salt 150 . . mM . . . . 25473 3 4 D2O '[U-100% 2H]' . . . . . solvent 100 . . % . . . . 25473 3 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25473 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 25473 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pcf11 '[U-10% 13C]' . . 1 $Pcf11 . protein 100 . . uM . . . . 25473 4 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25473 4 3 'sodium chloride' 'natural abundance' . . . . . salt 150 . . mM . . . . 25473 4 4 D2O '[U-100% 2H]' . . . . . solvent 10 . . % . . . . 25473 4 5 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25473 4 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25473 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 25473 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pcf11 '[U-13C; U-15N]-Leu' . . 1 $Pcf11 . protein 200 . . uM . . . . 25473 5 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25473 5 3 'sodium chloride' 'natural abundance' . . . . . salt 150 . . mM . . . . 25473 5 4 D2O '[U-100% 2H]' . . . . . solvent 100 . . % . . . . 25473 5 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 25473 5 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25473 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 170 . mM 25473 1 pH 6.5 . pH 25473 1 pressure 1 . atm 25473 1 temperature 300 . K 25473 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 25473 _Sample_condition_list.ID 2 _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' 70 . mM 25473 2 pH 6.5 . pH 25473 2 pressure 1 . atm 25473 2 temperature 300 . K 25473 2 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25473 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25473 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25473 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25473 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25473 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25473 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25473 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25473 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25473 3 'data analysis' 25473 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25473 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25473 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 25473 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 '5 mm CPTXI 1H-13C/15N/D Z-GRD' . . 25473 1 2 spectrometer_2 Bruker Avance . 700 '5 mm PATXI 1H-13C/15N/D Z-GRD' . . 25473 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 25473 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 2 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 3 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 4 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 6 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 7 '3D HCACO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 8 '3D (H)CCONH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25473 1 9 '3D (H)CCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 10 '3D H(C)CH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 11 '2D 1H-13C HSQC (CT)' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 12 '3D 1H-15N TOCSY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 13 '3D HCACO' no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 14 '3D (H)CCH-TOCSY' no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 15 '3D H(C)CH-TOCSY' no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 16 '3D HNHA' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 17 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 18 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25473 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25473 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 external indirect 0.251449530 . . . . . 25473 1 H 1 water protons . . . . ppm 4.755 internal direct 1 . . . . . 25473 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 external indirect 0.101329118 . . . . . 25473 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25473 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 2 $sample_2 isotropic 25473 1 2 '3D HNCO' 2 $sample_2 isotropic 25473 1 3 '3D HNCA' 2 $sample_2 isotropic 25473 1 4 '3D HNCACB' 2 $sample_2 isotropic 25473 1 5 '3D CBCA(CO)NH' 2 $sample_2 isotropic 25473 1 6 '3D HN(CA)CO' 2 $sample_2 isotropic 25473 1 7 '3D HCACO' 2 $sample_2 isotropic 25473 1 8 '3D (H)CCONH-TOCSY' 2 $sample_2 isotropic 25473 1 9 '3D (H)CCH-TOCSY' 3 $sample_3 isotropic 25473 1 10 '3D H(C)CH-TOCSY' 3 $sample_3 isotropic 25473 1 11 '2D 1H-13C HSQC (CT)' 4 $sample_4 isotropic 25473 1 12 '3D 1H-15N TOCSY' 4 $sample_4 isotropic 25473 1 13 '3D HCACO' 5 $sample_5 isotropic 25473 1 14 '3D (H)CCH-TOCSY' 5 $sample_5 isotropic 25473 1 15 '3D H(C)CH-TOCSY' 5 $sample_5 isotropic 25473 1 16 '3D HNHA' 4 $sample_4 isotropic 25473 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $TOPSPIN . . 25473 1 2 $NMRPipe . . 25473 1 3 $SPARKY . . 25473 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 HIS C C 13 174.987 0.2 . 1 . . . . 139 HIS C . 25473 1 2 . 1 1 2 2 HIS CA C 13 56.062 0.2 . 1 . . . . 139 HIS CA . 25473 1 3 . 1 1 2 2 HIS CB C 13 30.669 0.2 . 1 . . . . 139 HIS CB . 25473 1 4 . 1 1 3 3 MET H H 1 8.505 0.02 . 1 . . . . 140 MET HN . 25473 1 5 . 1 1 3 3 MET HA H 1 4.41 0.02 . 1 . . . . 140 MET HA . 25473 1 6 . 1 1 3 3 MET C C 13 175.883 0.2 . 1 . . . . 140 MET C . 25473 1 7 . 1 1 3 3 MET CA C 13 55.578 0.2 . 1 . . . . 140 MET CA . 25473 1 8 . 1 1 3 3 MET CB C 13 32.953 0.2 . 1 . . . . 140 MET CB . 25473 1 9 . 1 1 3 3 MET CG C 13 31.952 0.2 . 1 . . . . 140 MET CG . 25473 1 10 . 1 1 3 3 MET N N 15 122.362 0.2 . 1 . . . . 140 MET N . 25473 1 11 . 1 1 4 4 LEU H H 1 8.364 0.02 . 1 . . . . 141 LEU HN . 25473 1 12 . 1 1 4 4 LEU HA H 1 4.284 0.02 . 1 . . . . 141 LEU HA . 25473 1 13 . 1 1 4 4 LEU HB2 H 1 1.868 0.02 . 2 . . . . 141 LEU HB2 . 25473 1 14 . 1 1 4 4 LEU HB3 H 1 1.547 0.02 . 2 . . . . 141 LEU HB3 . 25473 1 15 . 1 1 4 4 LEU HD11 H 1 0.894 0.02 . 1 . . . . 141 LEU MD1 . 25473 1 16 . 1 1 4 4 LEU HD12 H 1 0.894 0.02 . 1 . . . . 141 LEU MD1 . 25473 1 17 . 1 1 4 4 LEU HD13 H 1 0.894 0.02 . 1 . . . . 141 LEU MD1 . 25473 1 18 . 1 1 4 4 LEU HD21 H 1 0.847 0.02 . 1 . . . . 141 LEU MD2 . 25473 1 19 . 1 1 4 4 LEU HD22 H 1 0.847 0.02 . 1 . . . . 141 LEU MD2 . 25473 1 20 . 1 1 4 4 LEU HD23 H 1 0.847 0.02 . 1 . . . . 141 LEU MD2 . 25473 1 21 . 1 1 4 4 LEU HG H 1 1.868 0.02 . 1 . . . . 141 LEU HG . 25473 1 22 . 1 1 4 4 LEU C C 13 176.993 0.2 . 1 . . . . 141 LEU C . 25473 1 23 . 1 1 4 4 LEU CA C 13 55.254 0.2 . 1 . . . . 141 LEU CA . 25473 1 24 . 1 1 4 4 LEU CB C 13 42.361 0.2 . 1 . . . . 141 LEU CB . 25473 1 25 . 1 1 4 4 LEU CD1 C 13 24.892 0.2 . 1 . . . . 141 LEU CD1 . 25473 1 26 . 1 1 4 4 LEU CD2 C 13 23.489 0.2 . 1 . . . . 141 LEU CD2 . 25473 1 27 . 1 1 4 4 LEU CG C 13 26.895 0.02 . 1 . . . . 141 LEU CG . 25473 1 28 . 1 1 4 4 LEU N N 15 123.762 0.2 . 1 . . . . 141 LEU N . 25473 1 29 . 1 1 5 5 HIS H H 1 8.358 0.02 . 1 . . . . 142 HIS HN . 25473 1 30 . 1 1 5 5 HIS HA H 1 4.004 0.02 . 1 . . . . 142 HIS HA . 25473 1 31 . 1 1 5 5 HIS HB2 H 1 1.977 0.02 . 2 . . . . 142 HIS HB2 . 25473 1 32 . 1 1 5 5 HIS HB3 H 1 1.977 0.02 . 2 . . . . 142 HIS HB3 . 25473 1 33 . 1 1 5 5 HIS C C 13 175.029 0.2 . 1 . . . . 142 HIS C . 25473 1 34 . 1 1 5 5 HIS CA C 13 55.902 0.2 . 1 . . . . 142 HIS CA . 25473 1 35 . 1 1 5 5 HIS CB C 13 29.858 0.2 . 1 . . . . 142 HIS CB . 25473 1 36 . 1 1 5 5 HIS N N 15 119.729 0.2 . 1 . . . . 142 HIS N . 25473 1 37 . 1 1 6 6 GLN H H 1 8.314 0.02 . 1 . . . . 143 GLN HN . 25473 1 38 . 1 1 6 6 GLN HA H 1 4.258 0.02 . 1 . . . . 143 GLN HA . 25473 1 39 . 1 1 6 6 GLN HB2 H 1 1.972 0.02 . 2 . . . . 143 GLN HB2 . 25473 1 40 . 1 1 6 6 GLN HB3 H 1 1.972 0.02 . 2 . . . . 143 GLN HB3 . 25473 1 41 . 1 1 6 6 GLN HE21 H 1 7.57 0.02 . 2 . . . . 143 GLN HE21 . 25473 1 42 . 1 1 6 6 GLN HE22 H 1 6.865 0.02 . 2 . . . . 143 GLN HE22 . 25473 1 43 . 1 1 6 6 GLN HG2 H 1 2.368 0.02 . 1 . . . . 143 GLN HG2 . 25473 1 44 . 1 1 6 6 GLN HG3 H 1 2.368 0.02 . 1 . . . . 143 GLN HG3 . 25473 1 45 . 1 1 6 6 GLN C C 13 175.945 0.2 . 1 . . . . 143 GLN C . 25473 1 46 . 1 1 6 6 GLN CA C 13 56.025 0.2 . 1 . . . . 143 GLN CA . 25473 1 47 . 1 1 6 6 GLN CB C 13 29.544 0.2 . 1 . . . . 143 GLN CB . 25473 1 48 . 1 1 6 6 GLN CG C 13 33.974 0.2 . 1 . . . . 143 GLN CG . 25473 1 49 . 1 1 6 6 GLN N N 15 121.612 0.2 . 1 . . . . 143 GLN N . 25473 1 50 . 1 1 6 6 GLN NE2 N 15 112.18 0.2 . 1 . . . . 143 GLN NE2 . 25473 1 51 . 1 1 7 7 LYS H H 1 8.445 0.02 . 1 . . . . 144 LYS HN . 25473 1 52 . 1 1 7 7 LYS HA H 1 4.228 0.02 . 1 . . . . 144 LYS HA . 25473 1 53 . 1 1 7 7 LYS HB2 H 1 2.184 0.02 . 1 . . . . 144 LYS HB2 . 25473 1 54 . 1 1 7 7 LYS HB3 H 1 2.184 0.02 . 1 . . . . 144 LYS HB3 . 25473 1 55 . 1 1 7 7 LYS HD2 H 1 1.9 0.02 . 1 . . . . 144 LYS HD2 . 25473 1 56 . 1 1 7 7 LYS HD3 H 1 1.9 0.02 . 1 . . . . 144 LYS HD3 . 25473 1 57 . 1 1 7 7 LYS HE2 H 1 3.147 0.02 . 1 . . . . 144 LYS HE2 . 25473 1 58 . 1 1 7 7 LYS HE3 H 1 3.147 0.02 . 1 . . . . 144 LYS HE3 . 25473 1 59 . 1 1 7 7 LYS HG2 H 1 1.633 0.02 . 1 . . . . 144 LYS HG2 . 25473 1 60 . 1 1 7 7 LYS HG3 H 1 1.633 0.02 . 1 . . . . 144 LYS HG3 . 25473 1 61 . 1 1 7 7 LYS C C 13 176.208 0.2 . 1 . . . . 144 LYS C . 25473 1 62 . 1 1 7 7 LYS CA C 13 56.695 0.2 . 1 . . . . 144 LYS CA . 25473 1 63 . 1 1 7 7 LYS CB C 13 33.078 0.2 . 1 . . . . 144 LYS CB . 25473 1 64 . 1 1 7 7 LYS CD C 13 29.3 0.2 . 1 . . . . 144 LYS CD . 25473 1 65 . 1 1 7 7 LYS CE C 13 43.284 0.2 . 1 . . . . 144 LYS CE . 25473 1 66 . 1 1 7 7 LYS CG C 13 24.965 0.2 . 1 . . . . 144 LYS CG . 25473 1 67 . 1 1 7 7 LYS N N 15 122.553 0.2 . 1 . . . . 144 LYS N . 25473 1 68 . 1 1 8 8 ASN H H 1 8.432 0.02 . 1 . . . . 145 ASN HN . 25473 1 69 . 1 1 8 8 ASN HA H 1 4.703 0.02 . 1 . . . . 145 ASN HA . 25473 1 70 . 1 1 8 8 ASN HB2 H 1 2.853 0.02 . 2 . . . . 145 ASN HB2 . 25473 1 71 . 1 1 8 8 ASN HB3 H 1 2.791 0.02 . 2 . . . . 145 ASN HB3 . 25473 1 72 . 1 1 8 8 ASN HD21 H 1 7.584 0.02 . 2 . . . . 145 ASN HD21 . 25473 1 73 . 1 1 8 8 ASN HD22 H 1 6.89 0.02 . 2 . . . . 145 ASN HD22 . 25473 1 74 . 1 1 8 8 ASN C C 13 175.331 0.2 . 1 . . . . 145 ASN C . 25473 1 75 . 1 1 8 8 ASN CA C 13 53.398 0.2 . 1 . . . . 145 ASN CA . 25473 1 76 . 1 1 8 8 ASN CB C 13 38.596 0.2 . 1 . . . . 145 ASN CB . 25473 1 77 . 1 1 8 8 ASN CG C 13 176.978 0.2 . 1 . . . . 145 ASN CG . 25473 1 78 . 1 1 8 8 ASN N N 15 119.311 0.2 . 1 . . . . 145 ASN N . 25473 1 79 . 1 1 8 8 ASN ND2 N 15 112.571 0.2 . 1 . . . . 145 ASN ND2 . 25473 1 80 . 1 1 9 9 LEU H H 1 8.195 0.02 . 1 . . . . 146 LEU HN . 25473 1 81 . 1 1 9 9 LEU HA H 1 4.274 0.02 . 1 . . . . 146 LEU HA . 25473 1 82 . 1 1 9 9 LEU HB2 H 1 1.618 0.02 . 1 . . . . 146 LEU HB2 . 25473 1 83 . 1 1 9 9 LEU HB3 H 1 1.618 0.02 . 1 . . . . 146 LEU HB3 . 25473 1 84 . 1 1 9 9 LEU HD11 H 1 0.852 0.02 . 1 . . . . 146 LEU MD1 . 25473 1 85 . 1 1 9 9 LEU HD12 H 1 0.852 0.02 . 1 . . . . 146 LEU MD1 . 25473 1 86 . 1 1 9 9 LEU HD13 H 1 0.852 0.02 . 1 . . . . 146 LEU MD1 . 25473 1 87 . 1 1 9 9 LEU HD21 H 1 0.852 0.02 . 1 . . . . 146 LEU MD2 . 25473 1 88 . 1 1 9 9 LEU HD22 H 1 0.852 0.02 . 1 . . . . 146 LEU MD2 . 25473 1 89 . 1 1 9 9 LEU HD23 H 1 0.852 0.02 . 1 . . . . 146 LEU MD2 . 25473 1 90 . 1 1 9 9 LEU HG H 1 1.96 0.02 . 1 . . . . 146 LEU HG . 25473 1 91 . 1 1 9 9 LEU C C 13 177.571 0.2 . 1 . . . . 146 LEU C . 25473 1 92 . 1 1 9 9 LEU CA C 13 55.707 0.2 . 1 . . . . 146 LEU CA . 25473 1 93 . 1 1 9 9 LEU CB C 13 42.27 0.2 . 1 . . . . 146 LEU CB . 25473 1 94 . 1 1 9 9 LEU CD1 C 13 24.9 0.2 . 1 . . . . 146 LEU CD1 . 25473 1 95 . 1 1 9 9 LEU CD2 C 13 23.586 0.2 . 1 . . . . 146 LEU CD2 . 25473 1 96 . 1 1 9 9 LEU CG C 13 26.813 0.02 . 1 . . . . 146 LEU CG . 25473 1 97 . 1 1 9 9 LEU N N 15 122.819 0.2 . 1 . . . . 146 LEU N . 25473 1 98 . 1 1 10 10 GLN H H 1 8.27 0.02 . 1 . . . . 147 GLN HN . 25473 1 99 . 1 1 10 10 GLN HA H 1 4.224 0.02 . 1 . . . . 147 GLN HA . 25473 1 100 . 1 1 10 10 GLN HB2 H 1 2.039 0.02 . 1 . . . . 147 GLN HB2 . 25473 1 101 . 1 1 10 10 GLN HB3 H 1 2.039 0.02 . 1 . . . . 147 GLN HB3 . 25473 1 102 . 1 1 10 10 GLN HE21 H 1 7.316 0.02 . 2 . . . . 147 GLN HE21 . 25473 1 103 . 1 1 10 10 GLN HE22 H 1 6.645 0.02 . 2 . . . . 147 GLN HE22 . 25473 1 104 . 1 1 10 10 GLN HG2 H 1 2.355 0.02 . 1 . . . . 147 GLN HG2 . 25473 1 105 . 1 1 10 10 GLN HG3 H 1 2.355 0.02 . 1 . . . . 147 GLN HG3 . 25473 1 106 . 1 1 10 10 GLN C C 13 175.836 0.2 . 1 . . . . 147 GLN C . 25473 1 107 . 1 1 10 10 GLN CA C 13 56.219 0.2 . 1 . . . . 147 GLN CA . 25473 1 108 . 1 1 10 10 GLN CB C 13 29.146 0.2 . 1 . . . . 147 GLN CB . 25473 1 109 . 1 1 10 10 GLN CG C 13 34.621 0.2 . 1 . . . . 147 GLN CG . 25473 1 110 . 1 1 10 10 GLN N N 15 120.308 0.2 . 1 . . . . 147 GLN N . 25473 1 111 . 1 1 10 10 GLN NE2 N 15 111.024 0.2 . 1 . . . . 147 GLN NE2 . 25473 1 112 . 1 1 11 11 ALA H H 1 8.078 0.02 . 1 . . . . 148 ALA HN . 25473 1 113 . 1 1 11 11 ALA HA H 1 4.269 0.02 . 1 . . . . 148 ALA HA . 25473 1 114 . 1 1 11 11 ALA HB1 H 1 1.356 0.02 . 1 . . . . 148 ALA MB . 25473 1 115 . 1 1 11 11 ALA HB2 H 1 1.356 0.02 . 1 . . . . 148 ALA MB . 25473 1 116 . 1 1 11 11 ALA HB3 H 1 1.356 0.02 . 1 . . . . 148 ALA MB . 25473 1 117 . 1 1 11 11 ALA C C 13 177.432 0.2 . 1 . . . . 148 ALA C . 25473 1 118 . 1 1 11 11 ALA CA C 13 52.624 0.2 . 1 . . . . 148 ALA CA . 25473 1 119 . 1 1 11 11 ALA CB C 13 19.06 0.2 . 1 . . . . 148 ALA CB . 25473 1 120 . 1 1 11 11 ALA N N 15 124.219 0.2 . 1 . . . . 148 ALA N . 25473 1 121 . 1 1 12 12 MET H H 1 8.141 0.02 . 1 . . . . 149 MET HN . 25473 1 122 . 1 1 12 12 MET HA H 1 4.426 0.02 . 1 . . . . 149 MET HA . 25473 1 123 . 1 1 12 12 MET HB2 H 1 1.986 0.02 . 1 . . . . 149 MET HB2 . 25473 1 124 . 1 1 12 12 MET HB3 H 1 1.986 0.02 . 1 . . . . 149 MET HB3 . 25473 1 125 . 1 1 12 12 MET HE1 H 1 2.081 0.02 . 1 . . . . 149 MET ME . 25473 1 126 . 1 1 12 12 MET HE2 H 1 2.081 0.02 . 1 . . . . 149 MET ME . 25473 1 127 . 1 1 12 12 MET HE3 H 1 2.081 0.02 . 1 . . . . 149 MET ME . 25473 1 128 . 1 1 12 12 MET HG2 H 1 2.506 0.02 . 1 . . . . 149 MET HG2 . 25473 1 129 . 1 1 12 12 MET HG3 H 1 2.506 0.02 . 1 . . . . 149 MET HG3 . 25473 1 130 . 1 1 12 12 MET C C 13 175.801 0.2 . 1 . . . . 149 MET C . 25473 1 131 . 1 1 12 12 MET CA C 13 55.204 0.2 . 1 . . . . 149 MET CA . 25473 1 132 . 1 1 12 12 MET CB C 13 32.971 0.2 . 1 . . . . 149 MET CB . 25473 1 133 . 1 1 12 12 MET CE C 13 17.08 0.2 . 1 . . . . 149 MET CE . 25473 1 134 . 1 1 12 12 MET CG C 13 32.217 0.2 . 1 . . . . 149 MET CG . 25473 1 135 . 1 1 12 12 MET N N 15 119.375 0.2 . 1 . . . . 149 MET N . 25473 1 136 . 1 1 13 13 LEU H H 1 8.162 0.02 . 1 . . . . 150 LEU HN . 25473 1 137 . 1 1 13 13 LEU HA H 1 4.606 0.02 . 1 . . . . 150 LEU HA . 25473 1 138 . 1 1 13 13 LEU HB2 H 1 1.476 0.02 . 2 . . . . 150 LEU HB2 . 25473 1 139 . 1 1 13 13 LEU HB3 H 1 1.605 0.02 . 2 . . . . 150 LEU HB3 . 25473 1 140 . 1 1 13 13 LEU HD11 H 1 0.877 0.02 . 1 . . . . 150 LEU MD1 . 25473 1 141 . 1 1 13 13 LEU HD12 H 1 0.877 0.02 . 1 . . . . 150 LEU MD1 . 25473 1 142 . 1 1 13 13 LEU HD13 H 1 0.877 0.02 . 1 . . . . 150 LEU MD1 . 25473 1 143 . 1 1 13 13 LEU HD21 H 1 0.842 0.02 . 1 . . . . 150 LEU MD2 . 25473 1 144 . 1 1 13 13 LEU HD22 H 1 0.842 0.02 . 1 . . . . 150 LEU MD2 . 25473 1 145 . 1 1 13 13 LEU HD23 H 1 0.842 0.02 . 1 . . . . 150 LEU MD2 . 25473 1 146 . 1 1 13 13 LEU HG H 1 1.67 0.02 . 1 . . . . 150 LEU HG . 25473 1 147 . 1 1 13 13 LEU C C 13 174.963 0.2 . 1 . . . . 150 LEU C . 25473 1 148 . 1 1 13 13 LEU CA C 13 52.813 0.2 . 1 . . . . 150 LEU CA . 25473 1 149 . 1 1 13 13 LEU CB C 13 41.66 0.2 . 1 . . . . 150 LEU CB . 25473 1 150 . 1 1 13 13 LEU CD1 C 13 25.3 0.2 . 1 . . . . 150 LEU CD1 . 25473 1 151 . 1 1 13 13 LEU CD2 C 13 23.27 0.2 . 1 . . . . 150 LEU CD2 . 25473 1 152 . 1 1 13 13 LEU CG C 13 27.049 0.2 . 1 . . . . 150 LEU CG . 25473 1 153 . 1 1 13 13 LEU N N 15 124.611 0.2 . 1 . . . . 150 LEU N . 25473 1 154 . 1 1 14 14 PRO HA H 1 4.475 0.02 . 1 . . . . 151 PRO HA . 25473 1 155 . 1 1 14 14 PRO HB2 H 1 1.826 0.02 . 2 . . . . 151 PRO HB2 . 25473 1 156 . 1 1 14 14 PRO HB3 H 1 2.236 0.02 . 2 . . . . 151 PRO HB3 . 25473 1 157 . 1 1 14 14 PRO HD2 H 1 3.596 0.02 . 2 . . . . 151 PRO HD2 . 25473 1 158 . 1 1 14 14 PRO HD3 H 1 3.811 0.02 . 2 . . . . 151 PRO HD3 . 25473 1 159 . 1 1 14 14 PRO HG2 H 1 1.886 0.02 . 2 . . . . 151 PRO HG2 . 25473 1 160 . 1 1 14 14 PRO HG3 H 1 2.003 0.02 . 2 . . . . 151 PRO HG3 . 25473 1 161 . 1 1 14 14 PRO C C 13 176.47 0.2 . 1 . . . . 151 PRO C . 25473 1 162 . 1 1 14 14 PRO CA C 13 62.477 0.2 . 1 . . . . 151 PRO CA . 25473 1 163 . 1 1 14 14 PRO CB C 13 31.974 0.2 . 1 . . . . 151 PRO CB . 25473 1 164 . 1 1 14 14 PRO CD C 13 51.118 0.2 . 1 . . . . 151 PRO CD . 25473 1 165 . 1 1 14 14 PRO CG C 13 27.335 0.2 . 1 . . . . 151 PRO CG . 25473 1 166 . 1 1 15 15 THR H H 1 8.381 0.02 . 1 . . . . 152 THR HN . 25473 1 167 . 1 1 15 15 THR HA H 1 4.373 0.02 . 1 . . . . 152 THR HA . 25473 1 168 . 1 1 15 15 THR HB H 1 4.006 0.02 . 1 . . . . 152 THR HB . 25473 1 169 . 1 1 15 15 THR HG21 H 1 1.263 0.02 . 1 . . . . 152 THR MG . 25473 1 170 . 1 1 15 15 THR HG22 H 1 1.263 0.02 . 1 . . . . 152 THR MG . 25473 1 171 . 1 1 15 15 THR HG23 H 1 1.263 0.02 . 1 . . . . 152 THR MG . 25473 1 172 . 1 1 15 15 THR C C 13 172.712 0.2 . 1 . . . . 152 THR C . 25473 1 173 . 1 1 15 15 THR CA C 13 60.899 0.2 . 1 . . . . 152 THR CA . 25473 1 174 . 1 1 15 15 THR CB C 13 69.713 0.2 . 1 . . . . 152 THR CB . 25473 1 175 . 1 1 15 15 THR CG2 C 13 21.758 0.2 . 1 . . . . 152 THR CG2 . 25473 1 176 . 1 1 15 15 THR N N 15 119.471 0.2 . 1 . . . . 152 THR N . 25473 1 177 . 1 1 16 16 PRO HA H 1 4.476 0.02 . 1 . . . . 153 PRO HA . 25473 1 178 . 1 1 16 16 PRO HB2 H 1 1.769 0.02 . 1 . . . . 153 PRO HB2 . 25473 1 179 . 1 1 16 16 PRO HB3 H 1 1.769 0.02 . 1 . . . . 153 PRO HB3 . 25473 1 180 . 1 1 16 16 PRO HD2 H 1 3.707 0.02 . 2 . . . . 153 PRO HD2 . 25473 1 181 . 1 1 16 16 PRO HD3 H 1 3.976 0.02 . 2 . . . . 153 PRO HD3 . 25473 1 182 . 1 1 16 16 PRO HG2 H 1 1.983 0.02 . 1 . . . . 153 PRO HG2 . 25473 1 183 . 1 1 16 16 PRO HG3 H 1 1.983 0.02 . 1 . . . . 153 PRO HG3 . 25473 1 184 . 1 1 16 16 PRO C C 13 174.471 0.2 . 1 . . . . 153 PRO C . 25473 1 185 . 1 1 16 16 PRO CA C 13 62.806 0.2 . 1 . . . . 153 PRO CA . 25473 1 186 . 1 1 16 16 PRO CB C 13 32.293 0.2 . 1 . . . . 153 PRO CB . 25473 1 187 . 1 1 16 16 PRO CD C 13 50.187 0.2 . 1 . . . . 153 PRO CD . 25473 1 188 . 1 1 16 16 PRO CG C 13 27.169 0.2 . 1 . . . . 153 PRO CG . 25473 1 189 . 1 1 17 17 THR H H 1 6.887 0.02 . 1 . . . . 154 THR HN . 25473 1 190 . 1 1 17 17 THR HA H 1 4.547 0.02 . 1 . . . . 154 THR HA . 25473 1 191 . 1 1 17 17 THR HB H 1 4.41 0.02 . 1 . . . . 154 THR HB . 25473 1 192 . 1 1 17 17 THR HG21 H 1 1.19 0.02 . 1 . . . . 154 THR MG . 25473 1 193 . 1 1 17 17 THR HG22 H 1 1.19 0.02 . 1 . . . . 154 THR MG . 25473 1 194 . 1 1 17 17 THR HG23 H 1 1.19 0.02 . 1 . . . . 154 THR MG . 25473 1 195 . 1 1 17 17 THR C C 13 173.939 0.2 . 1 . . . . 154 THR C . 25473 1 196 . 1 1 17 17 THR CA C 13 58.996 0.2 . 1 . . . . 154 THR CA . 25473 1 197 . 1 1 17 17 THR CB C 13 71.955 0.2 . 1 . . . . 154 THR CB . 25473 1 198 . 1 1 17 17 THR CG2 C 13 21.93 0.2 . 1 . . . . 154 THR CG2 . 25473 1 199 . 1 1 17 17 THR N N 15 107.525 0.2 . 1 . . . . 154 THR N . 25473 1 200 . 1 1 18 18 VAL H H 1 9.265 0.02 . 1 . . . . 155 VAL HN . 25473 1 201 . 1 1 18 18 VAL HA H 1 3.764 0.02 . 1 . . . . 155 VAL HA . 25473 1 202 . 1 1 18 18 VAL HB H 1 2.34 0.02 . 1 . . . . 155 VAL HB . 25473 1 203 . 1 1 18 18 VAL HG11 H 1 0.999 0.02 . 1 . . . . 155 VAL MG1 . 25473 1 204 . 1 1 18 18 VAL HG12 H 1 0.999 0.02 . 1 . . . . 155 VAL MG1 . 25473 1 205 . 1 1 18 18 VAL HG13 H 1 0.999 0.02 . 1 . . . . 155 VAL MG1 . 25473 1 206 . 1 1 18 18 VAL HG21 H 1 1.189 0.02 . 1 . . . . 155 VAL MG2 . 25473 1 207 . 1 1 18 18 VAL HG22 H 1 1.189 0.02 . 1 . . . . 155 VAL MG2 . 25473 1 208 . 1 1 18 18 VAL HG23 H 1 1.189 0.02 . 1 . . . . 155 VAL MG2 . 25473 1 209 . 1 1 18 18 VAL C C 13 174.735 0.2 . 1 . . . . 155 VAL C . 25473 1 210 . 1 1 18 18 VAL CA C 13 69.413 0.2 . 1 . . . . 155 VAL CA . 25473 1 211 . 1 1 18 18 VAL CB C 13 29.764 0.2 . 1 . . . . 155 VAL CB . 25473 1 212 . 1 1 18 18 VAL CG1 C 13 21.944 0.2 . 1 . . . . 155 VAL CG1 . 25473 1 213 . 1 1 18 18 VAL CG2 C 13 25.014 0.2 . 1 . . . . 155 VAL CG2 . 25473 1 214 . 1 1 18 18 VAL N N 15 121.444 0.2 . 1 . . . . 155 VAL N . 25473 1 215 . 1 1 19 19 PRO HA H 1 4.23 0.02 . 1 . . . . 156 PRO HA . 25473 1 216 . 1 1 19 19 PRO HB2 H 1 1.754 0.02 . 2 . . . . 156 PRO HB2 . 25473 1 217 . 1 1 19 19 PRO HB3 H 1 2.325 0.02 . 2 . . . . 156 PRO HB3 . 25473 1 218 . 1 1 19 19 PRO HD2 H 1 3.802 0.02 . 1 . . . . 156 PRO HD2 . 25473 1 219 . 1 1 19 19 PRO HD3 H 1 3.802 0.02 . 1 . . . . 156 PRO HD3 . 25473 1 220 . 1 1 19 19 PRO HG2 H 1 1.998 0.02 . 2 . . . . 156 PRO HG2 . 25473 1 221 . 1 1 19 19 PRO HG3 H 1 2.097 0.02 . 2 . . . . 156 PRO HG3 . 25473 1 222 . 1 1 19 19 PRO C C 13 179.893 0.2 . 1 . . . . 156 PRO C . 25473 1 223 . 1 1 19 19 PRO CA C 13 66.223 0.2 . 1 . . . . 156 PRO CA . 25473 1 224 . 1 1 19 19 PRO CB C 13 31.346 0.2 . 1 . . . . 156 PRO CB . 25473 1 225 . 1 1 19 19 PRO CD C 13 49.719 0.2 . 1 . . . . 156 PRO CD . 25473 1 226 . 1 1 19 19 PRO CG C 13 28.555 0.2 . 1 . . . . 156 PRO CG . 25473 1 227 . 1 1 20 20 LEU H H 1 7.237 0.02 . 1 . . . . 157 LEU HN . 25473 1 228 . 1 1 20 20 LEU HA H 1 4.053 0.02 . 1 . . . . 157 LEU HA . 25473 1 229 . 1 1 20 20 LEU HB2 H 1 1.579 0.02 . 2 . . . . 157 LEU HB2 . 25473 1 230 . 1 1 20 20 LEU HB3 H 1 1.809 0.02 . 2 . . . . 157 LEU HB3 . 25473 1 231 . 1 1 20 20 LEU HD11 H 1 0.939 0.02 . 1 . . . . 157 LEU MD1 . 25473 1 232 . 1 1 20 20 LEU HD12 H 1 0.939 0.02 . 1 . . . . 157 LEU MD1 . 25473 1 233 . 1 1 20 20 LEU HD13 H 1 0.939 0.02 . 1 . . . . 157 LEU MD1 . 25473 1 234 . 1 1 20 20 LEU HD21 H 1 0.859 0.02 . 1 . . . . 157 LEU MD2 . 25473 1 235 . 1 1 20 20 LEU HD22 H 1 0.859 0.02 . 1 . . . . 157 LEU MD2 . 25473 1 236 . 1 1 20 20 LEU HD23 H 1 0.859 0.02 . 1 . . . . 157 LEU MD2 . 25473 1 237 . 1 1 20 20 LEU HG H 1 1.96 0.02 . 1 . . . . 157 LEU HG . 25473 1 238 . 1 1 20 20 LEU C C 13 179.272 0.2 . 1 . . . . 157 LEU C . 25473 1 239 . 1 1 20 20 LEU CA C 13 58.141 0.2 . 1 . . . . 157 LEU CA . 25473 1 240 . 1 1 20 20 LEU CB C 13 42.247 0.2 . 1 . . . . 157 LEU CB . 25473 1 241 . 1 1 20 20 LEU CD1 C 13 25.142 0.2 . 1 . . . . 157 LEU CD1 . 25473 1 242 . 1 1 20 20 LEU CD2 C 13 24.044 0.2 . 1 . . . . 157 LEU CD2 . 25473 1 243 . 1 1 20 20 LEU CG C 13 26.895 0.02 . 1 . . . . 157 LEU CG . 25473 1 244 . 1 1 20 20 LEU N N 15 117.518 0.2 . 1 . . . . 157 LEU N . 25473 1 245 . 1 1 21 21 LEU H H 1 8.079 0.02 . 1 . . . . 158 LEU HN . 25473 1 246 . 1 1 21 21 LEU HA H 1 4.158 0.02 . 1 . . . . 158 LEU HA . 25473 1 247 . 1 1 21 21 LEU HB2 H 1 1.217 0.02 . 2 . . . . 158 LEU HB2 . 25473 1 248 . 1 1 21 21 LEU HB3 H 1 2.03 0.02 . 2 . . . . 158 LEU HB3 . 25473 1 249 . 1 1 21 21 LEU HD11 H 1 0.899 0.02 . 1 . . . . 158 LEU MD1 . 25473 1 250 . 1 1 21 21 LEU HD12 H 1 0.899 0.02 . 1 . . . . 158 LEU MD1 . 25473 1 251 . 1 1 21 21 LEU HD13 H 1 0.899 0.02 . 1 . . . . 158 LEU MD1 . 25473 1 252 . 1 1 21 21 LEU HD21 H 1 0.885 0.02 . 1 . . . . 158 LEU MD2 . 25473 1 253 . 1 1 21 21 LEU HD22 H 1 0.885 0.02 . 1 . . . . 158 LEU MD2 . 25473 1 254 . 1 1 21 21 LEU HD23 H 1 0.885 0.02 . 1 . . . . 158 LEU MD2 . 25473 1 255 . 1 1 21 21 LEU HG H 1 1.94 0.02 . 1 . . . . 158 LEU HG . 25473 1 256 . 1 1 21 21 LEU C C 13 179.53 0.2 . 1 . . . . 158 LEU C . 25473 1 257 . 1 1 21 21 LEU CA C 13 57.669 0.2 . 1 . . . . 158 LEU CA . 25473 1 258 . 1 1 21 21 LEU CB C 13 42.421 0.2 . 1 . . . . 158 LEU CB . 25473 1 259 . 1 1 21 21 LEU CD1 C 13 27.128 0.2 . 1 . . . . 158 LEU CD1 . 25473 1 260 . 1 1 21 21 LEU CD2 C 13 22.878 0.2 . 1 . . . . 158 LEU CD2 . 25473 1 261 . 1 1 21 21 LEU CG C 13 27.145 0.2 . 1 . . . . 158 LEU CG . 25473 1 262 . 1 1 21 21 LEU N N 15 119.797 0.2 . 1 . . . . 158 LEU N . 25473 1 263 . 1 1 22 22 LEU H H 1 8.719 0.02 . 1 . . . . 159 LEU HN . 25473 1 264 . 1 1 22 22 LEU HA H 1 3.899 0.02 . 1 . . . . 159 LEU HA . 25473 1 265 . 1 1 22 22 LEU HB2 H 1 1.453 0.02 . 1 . . . . 159 LEU HB2 . 25473 1 266 . 1 1 22 22 LEU HB3 H 1 1.861 0.02 . 1 . . . . 159 LEU HB3 . 25473 1 267 . 1 1 22 22 LEU HD11 H 1 0.817 0.02 . 1 . . . . 159 LEU MD1 . 25473 1 268 . 1 1 22 22 LEU HD12 H 1 0.817 0.02 . 1 . . . . 159 LEU MD1 . 25473 1 269 . 1 1 22 22 LEU HD13 H 1 0.817 0.02 . 1 . . . . 159 LEU MD1 . 25473 1 270 . 1 1 22 22 LEU HD21 H 1 0.872 0.02 . 1 . . . . 159 LEU MD2 . 25473 1 271 . 1 1 22 22 LEU HD22 H 1 0.872 0.02 . 1 . . . . 159 LEU MD2 . 25473 1 272 . 1 1 22 22 LEU HD23 H 1 0.872 0.02 . 1 . . . . 159 LEU MD2 . 25473 1 273 . 1 1 22 22 LEU HG H 1 1.752 0.02 . 1 . . . . 159 LEU HG . 25473 1 274 . 1 1 22 22 LEU C C 13 179.168 0.2 . 1 . . . . 159 LEU C . 25473 1 275 . 1 1 22 22 LEU CA C 13 58.194 0.2 . 1 . . . . 159 LEU CA . 25473 1 276 . 1 1 22 22 LEU CB C 13 41.411 0.2 . 1 . . . . 159 LEU CB . 25473 1 277 . 1 1 22 22 LEU CD1 C 13 25.928 0.2 . 1 . . . . 159 LEU CD1 . 25473 1 278 . 1 1 22 22 LEU CD2 C 13 24 0.2 . 1 . . . . 159 LEU CD2 . 25473 1 279 . 1 1 22 22 LEU CG C 13 26.769 0.2 . 1 . . . . 159 LEU CG . 25473 1 280 . 1 1 22 22 LEU N N 15 118.72 0.2 . 1 . . . . 159 LEU N . 25473 1 281 . 1 1 23 23 ARG H H 1 7.672 0.02 . 1 . . . . 160 ARG HN . 25473 1 282 . 1 1 23 23 ARG HA H 1 4.138 0.02 . 1 . . . . 160 ARG HA . 25473 1 283 . 1 1 23 23 ARG HB2 H 1 1.992 0.02 . 2 . . . . 160 ARG HB2 . 25473 1 284 . 1 1 23 23 ARG HB3 H 1 2.093 0.02 . 2 . . . . 160 ARG HB3 . 25473 1 285 . 1 1 23 23 ARG HD2 H 1 3.207 0.02 . 1 . . . . 160 ARG HD2 . 25473 1 286 . 1 1 23 23 ARG HD3 H 1 3.207 0.02 . 1 . . . . 160 ARG HD3 . 25473 1 287 . 1 1 23 23 ARG HG2 H 1 1.584 0.02 . 2 . . . . 160 ARG HG2 . 25473 1 288 . 1 1 23 23 ARG HG3 H 1 1.648 0.02 . 2 . . . . 160 ARG HG3 . 25473 1 289 . 1 1 23 23 ARG C C 13 179.218 0.2 . 1 . . . . 160 ARG C . 25473 1 290 . 1 1 23 23 ARG CA C 13 59.546 0.2 . 1 . . . . 160 ARG CA . 25473 1 291 . 1 1 23 23 ARG CB C 13 29.703 0.2 . 1 . . . . 160 ARG CB . 25473 1 292 . 1 1 23 23 ARG CD C 13 43.75 0.2 . 1 . . . . 160 ARG CD . 25473 1 293 . 1 1 23 23 ARG CG C 13 27.324 0.2 . 1 . . . . 160 ARG CG . 25473 1 294 . 1 1 23 23 ARG N N 15 119.951 0.2 . 1 . . . . 160 ARG N . 25473 1 295 . 1 1 24 24 ASP H H 1 7.761 0.02 . 1 . . . . 161 ASP HN . 25473 1 296 . 1 1 24 24 ASP HA H 1 4.407 0.02 . 1 . . . . 161 ASP HA . 25473 1 297 . 1 1 24 24 ASP HB2 H 1 2.434 0.02 . 2 . . . . 161 ASP HB2 . 25473 1 298 . 1 1 24 24 ASP HB3 H 1 2.859 0.02 . 2 . . . . 161 ASP HB3 . 25473 1 299 . 1 1 24 24 ASP C C 13 178.867 0.2 . 1 . . . . 161 ASP C . 25473 1 300 . 1 1 24 24 ASP CA C 13 57.863 0.2 . 1 . . . . 161 ASP CA . 25473 1 301 . 1 1 24 24 ASP CB C 13 40.116 0.2 . 1 . . . . 161 ASP CB . 25473 1 302 . 1 1 24 24 ASP N N 15 121.624 0.2 . 1 . . . . 161 ASP N . 25473 1 303 . 1 1 25 25 ILE H H 1 8.645 0.02 . 1 . . . . 162 ILE HN . 25473 1 304 . 1 1 25 25 ILE HA H 1 3.459 0.02 . 1 . . . . 162 ILE HA . 25473 1 305 . 1 1 25 25 ILE HB H 1 1.931 0.02 . 1 . . . . 162 ILE HB . 25473 1 306 . 1 1 25 25 ILE HD11 H 1 0.708 0.02 . 1 . . . . 162 ILE MD . 25473 1 307 . 1 1 25 25 ILE HD12 H 1 0.708 0.02 . 1 . . . . 162 ILE MD . 25473 1 308 . 1 1 25 25 ILE HD13 H 1 0.708 0.02 . 1 . . . . 162 ILE MD . 25473 1 309 . 1 1 25 25 ILE HG12 H 1 0.865 0.02 . 2 . . . . 162 ILE HG12 . 25473 1 310 . 1 1 25 25 ILE HG13 H 1 1.831 0.02 . 2 . . . . 162 ILE HG13 . 25473 1 311 . 1 1 25 25 ILE HG21 H 1 0.874 0.02 . 1 . . . . 162 ILE MG . 25473 1 312 . 1 1 25 25 ILE HG22 H 1 0.874 0.02 . 1 . . . . 162 ILE MG . 25473 1 313 . 1 1 25 25 ILE HG23 H 1 0.874 0.02 . 1 . . . . 162 ILE MG . 25473 1 314 . 1 1 25 25 ILE C C 13 179.442 0.2 . 1 . . . . 162 ILE C . 25473 1 315 . 1 1 25 25 ILE CA C 13 65.892 0.2 . 1 . . . . 162 ILE CA . 25473 1 316 . 1 1 25 25 ILE CB C 13 38.137 0.2 . 1 . . . . 162 ILE CB . 25473 1 317 . 1 1 25 25 ILE CD1 C 13 14.747 0.2 . 1 . . . . 162 ILE CD1 . 25473 1 318 . 1 1 25 25 ILE CG1 C 13 31.415 0.2 . 1 . . . . 162 ILE CG1 . 25473 1 319 . 1 1 25 25 ILE CG2 C 13 17.582 0.2 . 1 . . . . 162 ILE CG2 . 25473 1 320 . 1 1 25 25 ILE N N 15 120.584 0.2 . 1 . . . . 162 ILE N . 25473 1 321 . 1 1 26 26 ASP H H 1 8.714 0.02 . 1 . . . . 163 ASP HN . 25473 1 322 . 1 1 26 26 ASP HA H 1 4.454 0.02 . 1 . . . . 163 ASP HA . 25473 1 323 . 1 1 26 26 ASP HB2 H 1 2.727 0.02 . 2 . . . . 163 ASP HB2 . 25473 1 324 . 1 1 26 26 ASP HB3 H 1 2.847 0.02 . 2 . . . . 163 ASP HB3 . 25473 1 325 . 1 1 26 26 ASP C C 13 179.012 0.2 . 1 . . . . 163 ASP C . 25473 1 326 . 1 1 26 26 ASP CA C 13 58.257 0.2 . 1 . . . . 163 ASP CA . 25473 1 327 . 1 1 26 26 ASP CB C 13 40.258 0.2 . 1 . . . . 163 ASP CB . 25473 1 328 . 1 1 26 26 ASP N N 15 125.243 0.2 . 1 . . . . 163 ASP N . 25473 1 329 . 1 1 27 27 LYS H H 1 8.061 0.02 . 1 . . . . 164 LYS HN . 25473 1 330 . 1 1 27 27 LYS HA H 1 4.088 0.02 . 1 . . . . 164 LYS HA . 25473 1 331 . 1 1 27 27 LYS HB2 H 1 1.885 0.02 . 2 . . . . 164 LYS HB2 . 25473 1 332 . 1 1 27 27 LYS HB3 H 1 1.992 0.02 . 2 . . . . 164 LYS HB3 . 25473 1 333 . 1 1 27 27 LYS HD2 H 1 1.753 0.02 . 1 . . . . 164 LYS HD2 . 25473 1 334 . 1 1 27 27 LYS HD3 H 1 1.753 0.02 . 1 . . . . 164 LYS HD3 . 25473 1 335 . 1 1 27 27 LYS HE2 H 1 2.924 0.02 . 1 . . . . 164 LYS HE2 . 25473 1 336 . 1 1 27 27 LYS HE3 H 1 2.924 0.02 . 1 . . . . 164 LYS HE3 . 25473 1 337 . 1 1 27 27 LYS HG2 H 1 1.475 0.02 . 2 . . . . 164 LYS HG2 . 25473 1 338 . 1 1 27 27 LYS HG3 H 1 1.623 0.02 . 2 . . . . 164 LYS HG3 . 25473 1 339 . 1 1 27 27 LYS C C 13 179.926 0.2 . 1 . . . . 164 LYS C . 25473 1 340 . 1 1 27 27 LYS CA C 13 60.029 0.2 . 1 . . . . 164 LYS CA . 25473 1 341 . 1 1 27 27 LYS CB C 13 32.463 0.2 . 1 . . . . 164 LYS CB . 25473 1 342 . 1 1 27 27 LYS CD C 13 29.379 0.2 . 1 . . . . 164 LYS CD . 25473 1 343 . 1 1 27 27 LYS CE C 13 42.045 0.2 . 1 . . . . 164 LYS CE . 25473 1 344 . 1 1 27 27 LYS CG C 13 25.386 0.2 . 1 . . . . 164 LYS CG . 25473 1 345 . 1 1 27 27 LYS N N 15 121.235 0.2 . 1 . . . . 164 LYS N . 25473 1 346 . 1 1 28 28 LEU H H 1 8.529 0.02 . 1 . . . . 165 LEU HN . 25473 1 347 . 1 1 28 28 LEU HA H 1 3.966 0.02 . 1 . . . . 165 LEU HA . 25473 1 348 . 1 1 28 28 LEU HB2 H 1 0.826 0.02 . 2 . . . . 165 LEU HB2 . 25473 1 349 . 1 1 28 28 LEU HB3 H 1 1.678 0.02 . 2 . . . . 165 LEU HB3 . 25473 1 350 . 1 1 28 28 LEU HD11 H 1 0.354 0.02 . 1 . . . . 165 LEU MD1 . 25473 1 351 . 1 1 28 28 LEU HD12 H 1 0.354 0.02 . 1 . . . . 165 LEU MD1 . 25473 1 352 . 1 1 28 28 LEU HD13 H 1 0.354 0.02 . 1 . . . . 165 LEU MD1 . 25473 1 353 . 1 1 28 28 LEU HD21 H 1 0.669 0.02 . 1 . . . . 165 LEU MD2 . 25473 1 354 . 1 1 28 28 LEU HD22 H 1 0.669 0.02 . 1 . . . . 165 LEU MD2 . 25473 1 355 . 1 1 28 28 LEU HD23 H 1 0.669 0.02 . 1 . . . . 165 LEU MD2 . 25473 1 356 . 1 1 28 28 LEU HG H 1 1.657 0.02 . 1 . . . . 165 LEU HG . 25473 1 357 . 1 1 28 28 LEU C C 13 180.468 0.2 . 1 . . . . 165 LEU C . 25473 1 358 . 1 1 28 28 LEU CA C 13 57.512 0.2 . 1 . . . . 165 LEU CA . 25473 1 359 . 1 1 28 28 LEU CB C 13 42.116 0.2 . 1 . . . . 165 LEU CB . 25473 1 360 . 1 1 28 28 LEU CD1 C 13 25.091 0.2 . 1 . . . . 165 LEU CD1 . 25473 1 361 . 1 1 28 28 LEU CD2 C 13 22.72 0.2 . 1 . . . . 165 LEU CD2 . 25473 1 362 . 1 1 28 28 LEU CG C 13 26.854 0.02 . 1 . . . . 165 LEU CG . 25473 1 363 . 1 1 28 28 LEU N N 15 119.671 0.2 . 1 . . . . 165 LEU N . 25473 1 364 . 1 1 29 29 THR H H 1 8.968 0.02 . 1 . . . . 166 THR HN . 25473 1 365 . 1 1 29 29 THR HA H 1 3.742 0.02 . 1 . . . . 166 THR HA . 25473 1 366 . 1 1 29 29 THR HB H 1 4.513 0.02 . 1 . . . . 166 THR HB . 25473 1 367 . 1 1 29 29 THR HG1 H 1 4.912 0.02 . 1 . . . . 166 THR HG1 . 25473 1 368 . 1 1 29 29 THR HG21 H 1 1.196 0.02 . 1 . . . . 166 THR MG . 25473 1 369 . 1 1 29 29 THR HG22 H 1 1.196 0.02 . 1 . . . . 166 THR MG . 25473 1 370 . 1 1 29 29 THR HG23 H 1 1.196 0.02 . 1 . . . . 166 THR MG . 25473 1 371 . 1 1 29 29 THR C C 13 176.184 0.2 . 1 . . . . 166 THR C . 25473 1 372 . 1 1 29 29 THR CA C 13 67.907 0.2 . 1 . . . . 166 THR CA . 25473 1 373 . 1 1 29 29 THR CB C 13 68.389 0.2 . 1 . . . . 166 THR CB . 25473 1 374 . 1 1 29 29 THR CG2 C 13 20.723 0.2 . 1 . . . . 166 THR CG2 . 25473 1 375 . 1 1 29 29 THR N N 15 123.061 0.2 . 1 . . . . 166 THR N . 25473 1 376 . 1 1 30 30 CYS H H 1 8.03 0.02 . 1 . . . . 167 CYS HN . 25473 1 377 . 1 1 30 30 CYS HA H 1 4.165 0.02 . 1 . . . . 167 CYS HA . 25473 1 378 . 1 1 30 30 CYS HB2 H 1 3.087 0.02 . 2 . . . . 167 CYS HB2 . 25473 1 379 . 1 1 30 30 CYS HB3 H 1 3.016 0.02 . 2 . . . . 167 CYS HB3 . 25473 1 380 . 1 1 30 30 CYS C C 13 177.025 0.2 . 1 . . . . 167 CYS C . 25473 1 381 . 1 1 30 30 CYS CA C 13 63.623 0.2 . 1 . . . . 167 CYS CA . 25473 1 382 . 1 1 30 30 CYS CB C 13 26.21 0.2 . 1 . . . . 167 CYS CB . 25473 1 383 . 1 1 30 30 CYS N N 15 123.359 0.2 . 1 . . . . 167 CYS N . 25473 1 384 . 1 1 31 31 LEU H H 1 7.926 0.02 . 1 . . . . 168 LEU HN . 25473 1 385 . 1 1 31 31 LEU HA H 1 4.155 0.02 . 1 . . . . 168 LEU HA . 25473 1 386 . 1 1 31 31 LEU HB2 H 1 1.726 0.02 . 1 . . . . 168 LEU HB2 . 25473 1 387 . 1 1 31 31 LEU HB3 H 1 1.726 0.02 . 1 . . . . 168 LEU HB3 . 25473 1 388 . 1 1 31 31 LEU HD11 H 1 0.952 0.02 . 1 . . . . 168 LEU MD1 . 25473 1 389 . 1 1 31 31 LEU HD12 H 1 0.952 0.02 . 1 . . . . 168 LEU MD1 . 25473 1 390 . 1 1 31 31 LEU HD13 H 1 0.952 0.02 . 1 . . . . 168 LEU MD1 . 25473 1 391 . 1 1 31 31 LEU HD21 H 1 0.92 0.02 . 1 . . . . 168 LEU MD2 . 25473 1 392 . 1 1 31 31 LEU HD22 H 1 0.92 0.02 . 1 . . . . 168 LEU MD2 . 25473 1 393 . 1 1 31 31 LEU HD23 H 1 0.92 0.02 . 1 . . . . 168 LEU MD2 . 25473 1 394 . 1 1 31 31 LEU HG H 1 1.624 0.02 . 1 . . . . 168 LEU HG . 25473 1 395 . 1 1 31 31 LEU C C 13 179.038 0.2 . 1 . . . . 168 LEU C . 25473 1 396 . 1 1 31 31 LEU CA C 13 58.148 0.2 . 1 . . . . 168 LEU CA . 25473 1 397 . 1 1 31 31 LEU CB C 13 42.793 0.2 . 1 . . . . 168 LEU CB . 25473 1 398 . 1 1 31 31 LEU CD1 C 13 24.587 0.2 . 1 . . . . 168 LEU CD1 . 25473 1 399 . 1 1 31 31 LEU CD2 C 13 24.245 0.2 . 1 . . . . 168 LEU CD2 . 25473 1 400 . 1 1 31 31 LEU CG C 13 26.973 0.02 . 1 . . . . 168 LEU CG . 25473 1 401 . 1 1 31 31 LEU N N 15 119.773 0.2 . 1 . . . . 168 LEU N . 25473 1 402 . 1 1 32 32 THR H H 1 8.26 0.02 . 1 . . . . 169 THR HN . 25473 1 403 . 1 1 32 32 THR HA H 1 3.827 0.02 . 1 . . . . 169 THR HA . 25473 1 404 . 1 1 32 32 THR HB H 1 4.181 0.02 . 1 . . . . 169 THR HB . 25473 1 405 . 1 1 32 32 THR HG1 H 1 4.97 0.02 . 1 . . . . 169 THR HG1 . 25473 1 406 . 1 1 32 32 THR HG21 H 1 1.333 0.02 . 1 . . . . 169 THR MG . 25473 1 407 . 1 1 32 32 THR HG22 H 1 1.333 0.02 . 1 . . . . 169 THR MG . 25473 1 408 . 1 1 32 32 THR HG23 H 1 1.333 0.02 . 1 . . . . 169 THR MG . 25473 1 409 . 1 1 32 32 THR C C 13 175.913 0.2 . 1 . . . . 169 THR C . 25473 1 410 . 1 1 32 32 THR CA C 13 67.765 0.2 . 1 . . . . 169 THR CA . 25473 1 411 . 1 1 32 32 THR CB C 13 68.725 0.2 . 1 . . . . 169 THR CB . 25473 1 412 . 1 1 32 32 THR CG2 C 13 23.256 0.2 . 1 . . . . 169 THR CG2 . 25473 1 413 . 1 1 32 32 THR N N 15 115.861 0.2 . 1 . . . . 169 THR N . 25473 1 414 . 1 1 33 33 SER H H 1 8.693 0.02 . 1 . . . . 170 SER HN . 25473 1 415 . 1 1 33 33 SER HA H 1 4.119 0.02 . 1 . . . . 170 SER HA . 25473 1 416 . 1 1 33 33 SER HB2 H 1 3.931 0.02 . 1 . . . . 170 SER HB2 . 25473 1 417 . 1 1 33 33 SER HB3 H 1 3.931 0.02 . 1 . . . . 170 SER HB3 . 25473 1 418 . 1 1 33 33 SER C C 13 176.734 0.2 . 1 . . . . 170 SER C . 25473 1 419 . 1 1 33 33 SER CA C 13 62.76 0.2 . 1 . . . . 170 SER CA . 25473 1 420 . 1 1 33 33 SER CB C 13 62.529 0.2 . 1 . . . . 170 SER CB . 25473 1 421 . 1 1 33 33 SER N N 15 117.686 0.2 . 1 . . . . 170 SER N . 25473 1 422 . 1 1 34 34 GLU H H 1 8.043 0.02 . 1 . . . . 171 GLU HN . 25473 1 423 . 1 1 34 34 GLU HA H 1 4.025 0.02 . 1 . . . . 171 GLU HA . 25473 1 424 . 1 1 34 34 GLU HB2 H 1 2.203 0.02 . 1 . . . . 171 GLU HB2 . 25473 1 425 . 1 1 34 34 GLU HB3 H 1 2.203 0.02 . 1 . . . . 171 GLU HB3 . 25473 1 426 . 1 1 34 34 GLU HG2 H 1 2.352 0.02 . 1 . . . . 171 GLU HG2 . 25473 1 427 . 1 1 34 34 GLU HG3 H 1 2.352 0.02 . 1 . . . . 171 GLU HG3 . 25473 1 428 . 1 1 34 34 GLU C C 13 179.293 0.2 . 1 . . . . 171 GLU C . 25473 1 429 . 1 1 34 34 GLU CA C 13 59.543 0.2 . 1 . . . . 171 GLU CA . 25473 1 430 . 1 1 34 34 GLU CB C 13 29.192 0.2 . 1 . . . . 171 GLU CB . 25473 1 431 . 1 1 34 34 GLU CG C 13 36.2 0.2 . 1 . . . . 171 GLU CG . 25473 1 432 . 1 1 34 34 GLU N N 15 122.917 0.2 . 1 . . . . 171 GLU N . 25473 1 433 . 1 1 35 35 ARG H H 1 7.788 0.02 . 1 . . . . 172 ARG HN . 25473 1 434 . 1 1 35 35 ARG HA H 1 4.141 0.02 . 1 . . . . 172 ARG HA . 25473 1 435 . 1 1 35 35 ARG HB2 H 1 2.012 0.02 . 1 . . . . 172 ARG HB2 . 25473 1 436 . 1 1 35 35 ARG HB3 H 1 2.012 0.02 . 1 . . . . 172 ARG HB3 . 25473 1 437 . 1 1 35 35 ARG HD2 H 1 3.157 0.02 . 1 . . . . 172 ARG HD2 . 25473 1 438 . 1 1 35 35 ARG HD3 H 1 3.157 0.02 . 1 . . . . 172 ARG HD3 . 25473 1 439 . 1 1 35 35 ARG HG2 H 1 1.7 0.02 . 1 . . . . 172 ARG HG2 . 25473 1 440 . 1 1 35 35 ARG HG3 H 1 1.7 0.02 . 1 . . . . 172 ARG HG3 . 25473 1 441 . 1 1 35 35 ARG C C 13 179.522 0.2 . 1 . . . . 172 ARG C . 25473 1 442 . 1 1 35 35 ARG CA C 13 59.346 0.2 . 1 . . . . 172 ARG CA . 25473 1 443 . 1 1 35 35 ARG CB C 13 30.584 0.2 . 1 . . . . 172 ARG CB . 25473 1 444 . 1 1 35 35 ARG CD C 13 43.777 0.2 . 1 . . . . 172 ARG CD . 25473 1 445 . 1 1 35 35 ARG CG C 13 27.66 0.2 . 1 . . . . 172 ARG CG . 25473 1 446 . 1 1 35 35 ARG N N 15 119.534 0.2 . 1 . . . . 172 ARG N . 25473 1 447 . 1 1 36 36 LEU H H 1 8.342 0.02 . 1 . . . . 173 LEU HN . 25473 1 448 . 1 1 36 36 LEU HA H 1 3.998 0.02 . 1 . . . . 173 LEU HA . 25473 1 449 . 1 1 36 36 LEU HB2 H 1 1.784 0.02 . 1 . . . . 173 LEU HB2 . 25473 1 450 . 1 1 36 36 LEU HB3 H 1 1.614 0.02 . 1 . . . . 173 LEU HB3 . 25473 1 451 . 1 1 36 36 LEU HD11 H 1 0.978 0.02 . 1 . . . . 173 LEU MD1 . 25473 1 452 . 1 1 36 36 LEU HD12 H 1 0.978 0.02 . 1 . . . . 173 LEU MD1 . 25473 1 453 . 1 1 36 36 LEU HD13 H 1 0.978 0.02 . 1 . . . . 173 LEU MD1 . 25473 1 454 . 1 1 36 36 LEU HD21 H 1 0.937 0.02 . 1 . . . . 173 LEU MD2 . 25473 1 455 . 1 1 36 36 LEU HD22 H 1 0.937 0.02 . 1 . . . . 173 LEU MD2 . 25473 1 456 . 1 1 36 36 LEU HD23 H 1 0.937 0.02 . 1 . . . . 173 LEU MD2 . 25473 1 457 . 1 1 36 36 LEU HG H 1 1.664 0.02 . 1 . . . . 173 LEU HG . 25473 1 458 . 1 1 36 36 LEU C C 13 178.276 0.2 . 1 . . . . 173 LEU C . 25473 1 459 . 1 1 36 36 LEU CA C 13 57.04 0.2 . 1 . . . . 173 LEU CA . 25473 1 460 . 1 1 36 36 LEU CB C 13 42.457 0.2 . 1 . . . . 173 LEU CB . 25473 1 461 . 1 1 36 36 LEU CD1 C 13 25.467 0.2 . 1 . . . . 173 LEU CD1 . 25473 1 462 . 1 1 36 36 LEU CD2 C 13 25.869 0.2 . 1 . . . . 173 LEU CD2 . 25473 1 463 . 1 1 36 36 LEU CG C 13 27.437 0.02 . 1 . . . . 173 LEU CG . 25473 1 464 . 1 1 36 36 LEU N N 15 121.933 0.2 . 1 . . . . 173 LEU N . 25473 1 465 . 1 1 37 37 LYS H H 1 7.508 0.02 . 1 . . . . 174 LYS HN . 25473 1 466 . 1 1 37 37 LYS HA H 1 3.952 0.02 . 1 . . . . 174 LYS HA . 25473 1 467 . 1 1 37 37 LYS HB2 H 1 1.914 0.02 . 1 . . . . 174 LYS HB2 . 25473 1 468 . 1 1 37 37 LYS HB3 H 1 1.914 0.02 . 1 . . . . 174 LYS HB3 . 25473 1 469 . 1 1 37 37 LYS HD2 H 1 1.692 0.02 . 1 . . . . 174 LYS HD2 . 25473 1 470 . 1 1 37 37 LYS HD3 H 1 1.692 0.02 . 1 . . . . 174 LYS HD3 . 25473 1 471 . 1 1 37 37 LYS HE2 H 1 2.974 0.02 . 1 . . . . 174 LYS HE2 . 25473 1 472 . 1 1 37 37 LYS HE3 H 1 2.927 0.02 . 1 . . . . 174 LYS HE3 . 25473 1 473 . 1 1 37 37 LYS HG2 H 1 1.424 0.02 . 2 . . . . 174 LYS HG2 . 25473 1 474 . 1 1 37 37 LYS HG3 H 1 1.641 0.02 . 2 . . . . 174 LYS HG3 . 25473 1 475 . 1 1 37 37 LYS C C 13 178.177 0.2 . 1 . . . . 174 LYS C . 25473 1 476 . 1 1 37 37 LYS CA C 13 59.463 0.2 . 1 . . . . 174 LYS CA . 25473 1 477 . 1 1 37 37 LYS CB C 13 32.255 0.2 . 1 . . . . 174 LYS CB . 25473 1 478 . 1 1 37 37 LYS CD C 13 29.434 0.2 . 1 . . . . 174 LYS CD . 25473 1 479 . 1 1 37 37 LYS CE C 13 42.186 0.2 . 1 . . . . 174 LYS CE . 25473 1 480 . 1 1 37 37 LYS CG C 13 25.403 0.2 . 1 . . . . 174 LYS CG . 25473 1 481 . 1 1 37 37 LYS N N 15 117.741 0.2 . 1 . . . . 174 LYS N . 25473 1 482 . 1 1 38 38 ASN H H 1 7.091 0.02 . 1 . . . . 175 ASN HN . 25473 1 483 . 1 1 38 38 ASN HA H 1 4.777 0.02 . 1 . . . . 175 ASN HA . 25473 1 484 . 1 1 38 38 ASN HB2 H 1 2.809 0.02 . 2 . . . . 175 ASN HB2 . 25473 1 485 . 1 1 38 38 ASN HB3 H 1 2.951 0.02 . 2 . . . . 175 ASN HB3 . 25473 1 486 . 1 1 38 38 ASN HD21 H 1 7.585 0.02 . 2 . . . . 175 ASN HD21 . 25473 1 487 . 1 1 38 38 ASN HD22 H 1 7.002 0.02 . 2 . . . . 175 ASN HD22 . 25473 1 488 . 1 1 38 38 ASN C C 13 175.159 0.2 . 1 . . . . 175 ASN C . 25473 1 489 . 1 1 38 38 ASN CA C 13 53.997 0.2 . 1 . . . . 175 ASN CA . 25473 1 490 . 1 1 38 38 ASN CB C 13 40.163 0.2 . 1 . . . . 175 ASN CB . 25473 1 491 . 1 1 38 38 ASN N N 15 113.233 0.2 . 1 . . . . 175 ASN N . 25473 1 492 . 1 1 38 38 ASN ND2 N 15 113.667 0.2 . 1 . . . . 175 ASN ND2 . 25473 1 493 . 1 1 39 39 GLN H H 1 7.619 0.02 . 1 . . . . 176 GLN HN . 25473 1 494 . 1 1 39 39 GLN HA H 1 4.793 0.02 . 1 . . . . 176 GLN HA . 25473 1 495 . 1 1 39 39 GLN HB2 H 1 2.185 0.02 . 2 . . . . 176 GLN HB2 . 25473 1 496 . 1 1 39 39 GLN HB3 H 1 1.956 0.02 . 2 . . . . 176 GLN HB3 . 25473 1 497 . 1 1 39 39 GLN HE21 H 1 7.401 0.02 . 2 . . . . 176 GLN HE21 . 25473 1 498 . 1 1 39 39 GLN HE22 H 1 6.818 0.02 . 2 . . . . 176 GLN HE22 . 25473 1 499 . 1 1 39 39 GLN HG2 H 1 2.36 0.02 . 1 . . . . 176 GLN HG2 . 25473 1 500 . 1 1 39 39 GLN HG3 H 1 2.36 0.02 . 1 . . . . 176 GLN HG3 . 25473 1 501 . 1 1 39 39 GLN C C 13 172.261 0.2 . 1 . . . . 176 GLN C . 25473 1 502 . 1 1 39 39 GLN CA C 13 53.904 0.2 . 1 . . . . 176 GLN CA . 25473 1 503 . 1 1 39 39 GLN CB C 13 29.857 0.2 . 1 . . . . 176 GLN CB . 25473 1 504 . 1 1 39 39 GLN CG C 13 34.352 0.2 . 1 . . . . 176 GLN CG . 25473 1 505 . 1 1 39 39 GLN N N 15 119.684 0.2 . 1 . . . . 176 GLN N . 25473 1 506 . 1 1 39 39 GLN NE2 N 15 112.168 0.2 . 1 . . . . 176 GLN NE2 . 25473 1 507 . 1 1 40 40 PRO HA H 1 4.576 0.02 . 1 . . . . 177 PRO HA . 25473 1 508 . 1 1 40 40 PRO HB2 H 1 2.284 0.02 . 2 . . . . 177 PRO HB2 . 25473 1 509 . 1 1 40 40 PRO HB3 H 1 1.868 0.02 . 2 . . . . 177 PRO HB3 . 25473 1 510 . 1 1 40 40 PRO HD2 H 1 3.298 0.02 . 2 . . . . 177 PRO HD2 . 25473 1 511 . 1 1 40 40 PRO HD3 H 1 3.554 0.02 . 2 . . . . 177 PRO HD3 . 25473 1 512 . 1 1 40 40 PRO HG2 H 1 1.865 0.02 . 2 . . . . 177 PRO HG2 . 25473 1 513 . 1 1 40 40 PRO HG3 H 1 1.995 0.02 . 2 . . . . 177 PRO HG3 . 25473 1 514 . 1 1 40 40 PRO C C 13 177.642 0.2 . 1 . . . . 177 PRO C . 25473 1 515 . 1 1 40 40 PRO CA C 13 64.615 0.2 . 1 . . . . 177 PRO CA . 25473 1 516 . 1 1 40 40 PRO CB C 13 32.226 0.2 . 1 . . . . 177 PRO CB . 25473 1 517 . 1 1 40 40 PRO CD C 13 50.188 0.2 . 1 . . . . 177 PRO CD . 25473 1 518 . 1 1 40 40 PRO CG C 13 27.309 0.2 . 1 . . . . 177 PRO CG . 25473 1 519 . 1 1 41 41 ASN H H 1 8.465 0.02 . 1 . . . . 178 ASN HN . 25473 1 520 . 1 1 41 41 ASN HA H 1 4.756 0.02 . 1 . . . . 178 ASN HA . 25473 1 521 . 1 1 41 41 ASN HB2 H 1 2.749 0.02 . 2 . . . . 178 ASN HB2 . 25473 1 522 . 1 1 41 41 ASN HB3 H 1 2.982 0.02 . 2 . . . . 178 ASN HB3 . 25473 1 523 . 1 1 41 41 ASN HD21 H 1 7.581 0.02 . 2 . . . . 178 ASN HD21 . 25473 1 524 . 1 1 41 41 ASN HD22 H 1 6.976 0.02 . 2 . . . . 178 ASN HD22 . 25473 1 525 . 1 1 41 41 ASN C C 13 175.024 0.2 . 1 . . . . 178 ASN C . 25473 1 526 . 1 1 41 41 ASN CA C 13 52.394 0.2 . 1 . . . . 178 ASN CA . 25473 1 527 . 1 1 41 41 ASN CB C 13 38.736 0.2 . 1 . . . . 178 ASN CB . 25473 1 528 . 1 1 41 41 ASN N N 15 114.478 0.2 . 1 . . . . 178 ASN N . 25473 1 529 . 1 1 41 41 ASN ND2 N 15 113.955 0.2 . 1 . . . . 178 ASN ND2 . 25473 1 530 . 1 1 42 42 ASP H H 1 7.452 0.02 . 1 . . . . 179 ASP HN . 25473 1 531 . 1 1 42 42 ASP HA H 1 4.468 0.02 . 1 . . . . 179 ASP HA . 25473 1 532 . 1 1 42 42 ASP HB2 H 1 2.616 0.02 . 2 . . . . 179 ASP HB2 . 25473 1 533 . 1 1 42 42 ASP HB3 H 1 3.049 0.02 . 2 . . . . 179 ASP HB3 . 25473 1 534 . 1 1 42 42 ASP C C 13 176.276 0.2 . 1 . . . . 179 ASP C . 25473 1 535 . 1 1 42 42 ASP CA C 13 55.317 0.2 . 1 . . . . 179 ASP CA . 25473 1 536 . 1 1 42 42 ASP CB C 13 42.629 0.2 . 1 . . . . 179 ASP CB . 25473 1 537 . 1 1 42 42 ASP N N 15 121.127 0.2 . 1 . . . . 179 ASP N . 25473 1 538 . 1 1 43 43 GLU H H 1 8.875 0.02 . 1 . . . . 180 GLU HN . 25473 1 539 . 1 1 43 43 GLU HA H 1 3.933 0.02 . 1 . . . . 180 GLU HA . 25473 1 540 . 1 1 43 43 GLU HB2 H 1 2.056 0.02 . 1 . . . . 180 GLU HB2 . 25473 1 541 . 1 1 43 43 GLU HB3 H 1 2.056 0.02 . 1 . . . . 180 GLU HB3 . 25473 1 542 . 1 1 43 43 GLU HG2 H 1 2.368 0.02 . 1 . . . . 180 GLU HG2 . 25473 1 543 . 1 1 43 43 GLU HG3 H 1 2.368 0.02 . 1 . . . . 180 GLU HG3 . 25473 1 544 . 1 1 43 43 GLU C C 13 179.024 0.2 . 1 . . . . 180 GLU C . 25473 1 545 . 1 1 43 43 GLU CA C 13 59.272 0.2 . 1 . . . . 180 GLU CA . 25473 1 546 . 1 1 43 43 GLU CB C 13 29.841 0.2 . 1 . . . . 180 GLU CB . 25473 1 547 . 1 1 43 43 GLU CG C 13 36.3 0.2 . 1 . . . . 180 GLU CG . 25473 1 548 . 1 1 43 43 GLU N N 15 128.009 0.2 . 1 . . . . 180 GLU N . 25473 1 549 . 1 1 44 44 LYS H H 1 8.3 0.02 . 1 . . . . 181 LYS HN . 25473 1 550 . 1 1 44 44 LYS HA H 1 4.127 0.02 . 1 . . . . 181 LYS HA . 25473 1 551 . 1 1 44 44 LYS HB2 H 1 1.832 0.02 . 2 . . . . 181 LYS HB2 . 25473 1 552 . 1 1 44 44 LYS HB3 H 1 2.108 0.02 . 2 . . . . 181 LYS HB3 . 25473 1 553 . 1 1 44 44 LYS HD2 H 1 1.719 0.02 . 1 . . . . 181 LYS HD2 . 25473 1 554 . 1 1 44 44 LYS HD3 H 1 1.719 0.02 . 1 . . . . 181 LYS HD3 . 25473 1 555 . 1 1 44 44 LYS HE2 H 1 3.02 0.02 . 1 . . . . 181 LYS HE2 . 25473 1 556 . 1 1 44 44 LYS HE3 H 1 3.02 0.02 . 1 . . . . 181 LYS HE3 . 25473 1 557 . 1 1 44 44 LYS HG2 H 1 1.432 0.02 . 2 . . . . 181 LYS HG2 . 25473 1 558 . 1 1 44 44 LYS HG3 H 1 1.589 0.02 . 2 . . . . 181 LYS HG3 . 25473 1 559 . 1 1 44 44 LYS C C 13 180.148 0.2 . 1 . . . . 181 LYS C . 25473 1 560 . 1 1 44 44 LYS CA C 13 59.623 0.2 . 1 . . . . 181 LYS CA . 25473 1 561 . 1 1 44 44 LYS CB C 13 31.565 0.2 . 1 . . . . 181 LYS CB . 25473 1 562 . 1 1 44 44 LYS CD C 13 29.21 0.2 . 1 . . . . 181 LYS CD . 25473 1 563 . 1 1 44 44 LYS CE C 13 41.992 0.2 . 1 . . . . 181 LYS CE . 25473 1 564 . 1 1 44 44 LYS CG C 13 25.586 0.2 . 1 . . . . 181 LYS CG . 25473 1 565 . 1 1 44 44 LYS N N 15 120.351 0.2 . 1 . . . . 181 LYS N . 25473 1 566 . 1 1 45 45 LEU H H 1 8.169 0.02 . 1 . . . . 182 LEU HN . 25473 1 567 . 1 1 45 45 LEU HA H 1 4.043 0.02 . 1 . . . . 182 LEU HA . 25473 1 568 . 1 1 45 45 LEU HB2 H 1 1.323 0.02 . 2 . . . . 182 LEU HB2 . 25473 1 569 . 1 1 45 45 LEU HB3 H 1 2.091 0.02 . 2 . . . . 182 LEU HB3 . 25473 1 570 . 1 1 45 45 LEU HD11 H 1 0.946 0.02 . 1 . . . . 182 LEU MD1 . 25473 1 571 . 1 1 45 45 LEU HD12 H 1 0.946 0.02 . 1 . . . . 182 LEU MD1 . 25473 1 572 . 1 1 45 45 LEU HD13 H 1 0.946 0.02 . 1 . . . . 182 LEU MD1 . 25473 1 573 . 1 1 45 45 LEU HD21 H 1 0.981 0.02 . 1 . . . . 182 LEU MD2 . 25473 1 574 . 1 1 45 45 LEU HD22 H 1 0.981 0.02 . 1 . . . . 182 LEU MD2 . 25473 1 575 . 1 1 45 45 LEU HD23 H 1 0.981 0.02 . 1 . . . . 182 LEU MD2 . 25473 1 576 . 1 1 45 45 LEU HG H 1 1.836 0.02 . 1 . . . . 182 LEU HG . 25473 1 577 . 1 1 45 45 LEU C C 13 179.009 0.2 . 1 . . . . 182 LEU C . 25473 1 578 . 1 1 45 45 LEU CA C 13 57.775 0.2 . 1 . . . . 182 LEU CA . 25473 1 579 . 1 1 45 45 LEU CB C 13 42.328 0.2 . 1 . . . . 182 LEU CB . 25473 1 580 . 1 1 45 45 LEU CD1 C 13 26.253 0.2 . 1 . . . . 182 LEU CD1 . 25473 1 581 . 1 1 45 45 LEU CD2 C 13 23.378 0.2 . 1 . . . . 182 LEU CD2 . 25473 1 582 . 1 1 45 45 LEU CG C 13 27.05 0.02 . 1 . . . . 182 LEU CG . 25473 1 583 . 1 1 45 45 LEU N N 15 120.344 0.2 . 1 . . . . 182 LEU N . 25473 1 584 . 1 1 46 46 LYS H H 1 7.743 0.02 . 1 . . . . 183 LYS HN . 25473 1 585 . 1 1 46 46 LYS HA H 1 3.887 0.02 . 1 . . . . 183 LYS HA . 25473 1 586 . 1 1 46 46 LYS HB2 H 1 1.869 0.02 . 1 . . . . 183 LYS HB2 . 25473 1 587 . 1 1 46 46 LYS HB3 H 1 1.869 0.02 . 1 . . . . 183 LYS HB3 . 25473 1 588 . 1 1 46 46 LYS HD2 H 1 1.667 0.02 . 1 . . . . 183 LYS HD2 . 25473 1 589 . 1 1 46 46 LYS HD3 H 1 1.667 0.02 . 1 . . . . 183 LYS HD3 . 25473 1 590 . 1 1 46 46 LYS HE2 H 1 2.932 0.02 . 1 . . . . 183 LYS HE2 . 25473 1 591 . 1 1 46 46 LYS HE3 H 1 2.932 0.02 . 1 . . . . 183 LYS HE3 . 25473 1 592 . 1 1 46 46 LYS HG2 H 1 1.377 0.02 . 2 . . . . 183 LYS HG2 . 25473 1 593 . 1 1 46 46 LYS HG3 H 1 1.687 0.02 . 2 . . . . 183 LYS HG3 . 25473 1 594 . 1 1 46 46 LYS C C 13 179.938 0.2 . 1 . . . . 183 LYS C . 25473 1 595 . 1 1 46 46 LYS CA C 13 60.652 0.2 . 1 . . . . 183 LYS CA . 25473 1 596 . 1 1 46 46 LYS CB C 13 32.316 0.2 . 1 . . . . 183 LYS CB . 25473 1 597 . 1 1 46 46 LYS CD C 13 29.669 0.2 . 1 . . . . 183 LYS CD . 25473 1 598 . 1 1 46 46 LYS CE C 13 42.201 0.2 . 1 . . . . 183 LYS CE . 25473 1 599 . 1 1 46 46 LYS CG C 13 26.244 0.2 . 1 . . . . 183 LYS CG . 25473 1 600 . 1 1 46 46 LYS N N 15 117.803 0.2 . 1 . . . . 183 LYS N . 25473 1 601 . 1 1 47 47 MET H H 1 7.997 0.02 . 1 . . . . 184 MET HN . 25473 1 602 . 1 1 47 47 MET HA H 1 4.275 0.02 . 1 . . . . 184 MET HA . 25473 1 603 . 1 1 47 47 MET HB2 H 1 2.229 0.02 . 1 . . . . 184 MET HB2 . 25473 1 604 . 1 1 47 47 MET HB3 H 1 2.229 0.02 . 1 . . . . 184 MET HB3 . 25473 1 605 . 1 1 47 47 MET HE1 H 1 2.081 0.02 . 1 . . . . 184 MET ME . 25473 1 606 . 1 1 47 47 MET HE2 H 1 2.081 0.02 . 1 . . . . 184 MET ME . 25473 1 607 . 1 1 47 47 MET HE3 H 1 2.081 0.02 . 1 . . . . 184 MET ME . 25473 1 608 . 1 1 47 47 MET HG2 H 1 2.68 0.02 . 1 . . . . 184 MET HG2 . 25473 1 609 . 1 1 47 47 MET HG3 H 1 2.68 0.02 . 1 . . . . 184 MET HG3 . 25473 1 610 . 1 1 47 47 MET C C 13 178.463 0.2 . 1 . . . . 184 MET C . 25473 1 611 . 1 1 47 47 MET CA C 13 58.274 0.2 . 1 . . . . 184 MET CA . 25473 1 612 . 1 1 47 47 MET CB C 13 31.593 0.2 . 1 . . . . 184 MET CB . 25473 1 613 . 1 1 47 47 MET CE C 13 17.08 0.2 . 1 . . . . 184 MET CE . 25473 1 614 . 1 1 47 47 MET CG C 13 32.348 0.2 . 1 . . . . 184 MET CG . 25473 1 615 . 1 1 47 47 MET N N 15 119.353 0.2 . 1 . . . . 184 MET N . 25473 1 616 . 1 1 48 48 LYS H H 1 7.967 0.02 . 1 . . . . 185 LYS HN . 25473 1 617 . 1 1 48 48 LYS HA H 1 3.841 0.02 . 1 . . . . 185 LYS HA . 25473 1 618 . 1 1 48 48 LYS HB2 H 1 1.944 0.02 . 2 . . . . 185 LYS HB2 . 25473 1 619 . 1 1 48 48 LYS HB3 H 1 2.217 0.02 . 2 . . . . 185 LYS HB3 . 25473 1 620 . 1 1 48 48 LYS HD2 H 1 1.517 0.02 . 1 . . . . 185 LYS HD2 . 25473 1 621 . 1 1 48 48 LYS HD3 H 1 1.517 0.02 . 1 . . . . 185 LYS HD3 . 25473 1 622 . 1 1 48 48 LYS HE2 H 1 3.152 0.02 . 1 . . . . 185 LYS HE2 . 25473 1 623 . 1 1 48 48 LYS HE3 H 1 3.152 0.02 . 1 . . . . 185 LYS HE3 . 25473 1 624 . 1 1 48 48 LYS HG2 H 1 1.732 0.02 . 1 . . . . 185 LYS HG2 . 25473 1 625 . 1 1 48 48 LYS HG3 H 1 1.732 0.02 . 1 . . . . 185 LYS HG3 . 25473 1 626 . 1 1 48 48 LYS C C 13 178.556 0.2 . 1 . . . . 185 LYS C . 25473 1 627 . 1 1 48 48 LYS CA C 13 60.946 0.2 . 1 . . . . 185 LYS CA . 25473 1 628 . 1 1 48 48 LYS CB C 13 32.976 0.2 . 1 . . . . 185 LYS CB . 25473 1 629 . 1 1 48 48 LYS CD C 13 29.825 0.2 . 1 . . . . 185 LYS CD . 25473 1 630 . 1 1 48 48 LYS CE C 13 42.532 0.2 . 1 . . . . 185 LYS CE . 25473 1 631 . 1 1 48 48 LYS CG C 13 27.346 0.2 . 1 . . . . 185 LYS CG . 25473 1 632 . 1 1 48 48 LYS N N 15 120.667 0.2 . 1 . . . . 185 LYS N . 25473 1 633 . 1 1 49 49 LEU H H 1 7.877 0.02 . 1 . . . . 186 LEU HN . 25473 1 634 . 1 1 49 49 LEU HA H 1 4.165 0.02 . 1 . . . . 186 LEU HA . 25473 1 635 . 1 1 49 49 LEU HB2 H 1 1.74 0.02 . 1 . . . . 186 LEU HB2 . 25473 1 636 . 1 1 49 49 LEU HB3 H 1 1.74 0.02 . 1 . . . . 186 LEU HB3 . 25473 1 637 . 1 1 49 49 LEU HD11 H 1 0.962 0.02 . 1 . . . . 186 LEU MD1 . 25473 1 638 . 1 1 49 49 LEU HD12 H 1 0.962 0.02 . 1 . . . . 186 LEU MD1 . 25473 1 639 . 1 1 49 49 LEU HD13 H 1 0.962 0.02 . 1 . . . . 186 LEU MD1 . 25473 1 640 . 1 1 49 49 LEU HD21 H 1 0.926 0.02 . 1 . . . . 186 LEU MD2 . 25473 1 641 . 1 1 49 49 LEU HD22 H 1 0.926 0.02 . 1 . . . . 186 LEU MD2 . 25473 1 642 . 1 1 49 49 LEU HD23 H 1 0.926 0.02 . 1 . . . . 186 LEU MD2 . 25473 1 643 . 1 1 49 49 LEU HG H 1 1.945 0.02 . 1 . . . . 186 LEU HG . 25473 1 644 . 1 1 49 49 LEU C C 13 179.723 0.2 . 1 . . . . 186 LEU C . 25473 1 645 . 1 1 49 49 LEU CA C 13 58.236 0.2 . 1 . . . . 186 LEU CA . 25473 1 646 . 1 1 49 49 LEU CB C 13 41.734 0.2 . 1 . . . . 186 LEU CB . 25473 1 647 . 1 1 49 49 LEU CD1 C 13 24.432 0.2 . 1 . . . . 186 LEU CD1 . 25473 1 648 . 1 1 49 49 LEU CD2 C 13 25.537 0.2 . 1 . . . . 186 LEU CD2 . 25473 1 649 . 1 1 49 49 LEU CG C 13 27.1 0.2 . 1 . . . . 186 LEU CG . 25473 1 650 . 1 1 49 49 LEU N N 15 117.994 0.2 . 1 . . . . 186 LEU N . 25473 1 651 . 1 1 50 50 LEU H H 1 7.703 0.02 . 1 . . . . 187 LEU HN . 25473 1 652 . 1 1 50 50 LEU HA H 1 4.211 0.02 . 1 . . . . 187 LEU HA . 25473 1 653 . 1 1 50 50 LEU HB2 H 1 1.884 0.02 . 1 . . . . 187 LEU HB2 . 25473 1 654 . 1 1 50 50 LEU HB3 H 1 1.884 0.02 . 1 . . . . 187 LEU HB3 . 25473 1 655 . 1 1 50 50 LEU HD11 H 1 0.917 0.02 . 1 . . . . 187 LEU MD1 . 25473 1 656 . 1 1 50 50 LEU HD12 H 1 0.917 0.02 . 1 . . . . 187 LEU MD1 . 25473 1 657 . 1 1 50 50 LEU HD13 H 1 0.917 0.02 . 1 . . . . 187 LEU MD1 . 25473 1 658 . 1 1 50 50 LEU HD21 H 1 0.917 0.02 . 1 . . . . 187 LEU MD2 . 25473 1 659 . 1 1 50 50 LEU HD22 H 1 0.917 0.02 . 1 . . . . 187 LEU MD2 . 25473 1 660 . 1 1 50 50 LEU HD23 H 1 0.917 0.02 . 1 . . . . 187 LEU MD2 . 25473 1 661 . 1 1 50 50 LEU HG H 1 1.69 0.02 . 1 . . . . 187 LEU HG . 25473 1 662 . 1 1 50 50 LEU C C 13 179.82 0.2 . 1 . . . . 187 LEU C . 25473 1 663 . 1 1 50 50 LEU CA C 13 58.273 0.2 . 1 . . . . 187 LEU CA . 25473 1 664 . 1 1 50 50 LEU CB C 13 41.614 0.2 . 1 . . . . 187 LEU CB . 25473 1 665 . 1 1 50 50 LEU CD1 C 13 24.339 0.2 . 1 . . . . 187 LEU CD1 . 25473 1 666 . 1 1 50 50 LEU CD2 C 13 24.726 0.2 . 1 . . . . 187 LEU CD2 . 25473 1 667 . 1 1 50 50 LEU CG C 13 27 0.2 . 1 . . . . 187 LEU CG . 25473 1 668 . 1 1 50 50 LEU N N 15 121.791 0.2 . 1 . . . . 187 LEU N . 25473 1 669 . 1 1 51 51 VAL H H 1 8.366 0.02 . 1 . . . . 188 VAL HN . 25473 1 670 . 1 1 51 51 VAL HA H 1 3.777 0.02 . 1 . . . . 188 VAL HA . 25473 1 671 . 1 1 51 51 VAL HB H 1 2.348 0.02 . 1 . . . . 188 VAL HB . 25473 1 672 . 1 1 51 51 VAL HG11 H 1 1.054 0.02 . 1 . . . . 188 VAL MG1 . 25473 1 673 . 1 1 51 51 VAL HG12 H 1 1.054 0.02 . 1 . . . . 188 VAL MG1 . 25473 1 674 . 1 1 51 51 VAL HG13 H 1 1.054 0.02 . 1 . . . . 188 VAL MG1 . 25473 1 675 . 1 1 51 51 VAL HG21 H 1 1.126 0.02 . 1 . . . . 188 VAL MG2 . 25473 1 676 . 1 1 51 51 VAL HG22 H 1 1.126 0.02 . 1 . . . . 188 VAL MG2 . 25473 1 677 . 1 1 51 51 VAL HG23 H 1 1.126 0.02 . 1 . . . . 188 VAL MG2 . 25473 1 678 . 1 1 51 51 VAL C C 13 178.487 0.2 . 1 . . . . 188 VAL C . 25473 1 679 . 1 1 51 51 VAL CA C 13 66.784 0.2 . 1 . . . . 188 VAL CA . 25473 1 680 . 1 1 51 51 VAL CB C 13 31.864 0.2 . 1 . . . . 188 VAL CB . 25473 1 681 . 1 1 51 51 VAL CG1 C 13 21.244 0.2 . 1 . . . . 188 VAL CG1 . 25473 1 682 . 1 1 51 51 VAL CG2 C 13 23.023 0.2 . 1 . . . . 188 VAL CG2 . 25473 1 683 . 1 1 51 51 VAL N N 15 121.478 0.2 . 1 . . . . 188 VAL N . 25473 1 684 . 1 1 52 52 LEU H H 1 8.255 0.02 . 1 . . . . 189 LEU HN . 25473 1 685 . 1 1 52 52 LEU HA H 1 3.893 0.02 . 1 . . . . 189 LEU HA . 25473 1 686 . 1 1 52 52 LEU HB2 H 1 1.419 0.02 . 2 . . . . 189 LEU HB2 . 25473 1 687 . 1 1 52 52 LEU HB3 H 1 2.024 0.02 . 2 . . . . 189 LEU HB3 . 25473 1 688 . 1 1 52 52 LEU HD11 H 1 0.744 0.02 . 1 . . . . 189 LEU MD1 . 25473 1 689 . 1 1 52 52 LEU HD12 H 1 0.744 0.02 . 1 . . . . 189 LEU MD1 . 25473 1 690 . 1 1 52 52 LEU HD13 H 1 0.744 0.02 . 1 . . . . 189 LEU MD1 . 25473 1 691 . 1 1 52 52 LEU HD21 H 1 0.562 0.02 . 1 . . . . 189 LEU MD2 . 25473 1 692 . 1 1 52 52 LEU HD22 H 1 0.562 0.02 . 1 . . . . 189 LEU MD2 . 25473 1 693 . 1 1 52 52 LEU HD23 H 1 0.562 0.02 . 1 . . . . 189 LEU MD2 . 25473 1 694 . 1 1 52 52 LEU HG H 1 2.02 0.02 . 1 . . . . 189 LEU HG . 25473 1 695 . 1 1 52 52 LEU C C 13 178.461 0.2 . 1 . . . . 189 LEU C . 25473 1 696 . 1 1 52 52 LEU CA C 13 58.616 0.2 . 1 . . . . 189 LEU CA . 25473 1 697 . 1 1 52 52 LEU CB C 13 41.418 0.2 . 1 . . . . 189 LEU CB . 25473 1 698 . 1 1 52 52 LEU CD1 C 13 25.037 0.02 . 1 . . . . 189 LEU CD1 . 25473 1 699 . 1 1 52 52 LEU CD2 C 13 23.776 0.2 . 1 . . . . 189 LEU CD2 . 25473 1 700 . 1 1 52 52 LEU CG C 13 27.335 0.02 . 1 . . . . 189 LEU CG . 25473 1 701 . 1 1 52 52 LEU N N 15 119.283 0.2 . 1 . . . . 189 LEU N . 25473 1 702 . 1 1 53 53 SER H H 1 7.987 0.02 . 1 . . . . 190 SER HN . 25473 1 703 . 1 1 53 53 SER HA H 1 4.148 0.02 . 1 . . . . 190 SER HA . 25473 1 704 . 1 1 53 53 SER HB2 H 1 4.076 0.02 . 1 . . . . 190 SER HB2 . 25473 1 705 . 1 1 53 53 SER HB3 H 1 4.076 0.02 . 1 . . . . 190 SER HB3 . 25473 1 706 . 1 1 53 53 SER C C 13 177.369 0.2 . 1 . . . . 190 SER C . 25473 1 707 . 1 1 53 53 SER CA C 13 61.734 0.2 . 1 . . . . 190 SER CA . 25473 1 708 . 1 1 53 53 SER CB C 13 62.958 0.2 . 1 . . . . 190 SER CB . 25473 1 709 . 1 1 53 53 SER N N 15 113.762 0.2 . 1 . . . . 190 SER N . 25473 1 710 . 1 1 54 54 GLN H H 1 8.21 0.02 . 1 . . . . 191 GLN HN . 25473 1 711 . 1 1 54 54 GLN HA H 1 4.087 0.02 . 1 . . . . 191 GLN HA . 25473 1 712 . 1 1 54 54 GLN HB2 H 1 2.146 0.02 . 2 . . . . 191 GLN HB2 . 25473 1 713 . 1 1 54 54 GLN HB3 H 1 2.146 0.02 . 2 . . . . 191 GLN HB3 . 25473 1 714 . 1 1 54 54 GLN HE21 H 1 7.05 0.02 . 2 . . . . 191 GLN HE21 . 25473 1 715 . 1 1 54 54 GLN HE22 H 1 6.755 0.02 . 2 . . . . 191 GLN HE22 . 25473 1 716 . 1 1 54 54 GLN HG2 H 1 2.308 0.02 . 2 . . . . 191 GLN HG2 . 25473 1 717 . 1 1 54 54 GLN HG3 H 1 2.505 0.02 . 2 . . . . 191 GLN HG3 . 25473 1 718 . 1 1 54 54 GLN C C 13 179.439 0.2 . 1 . . . . 191 GLN C . 25473 1 719 . 1 1 54 54 GLN CA C 13 59.182 0.2 . 1 . . . . 191 GLN CA . 25473 1 720 . 1 1 54 54 GLN CB C 13 28.034 0.2 . 1 . . . . 191 GLN CB . 25473 1 721 . 1 1 54 54 GLN CG C 13 34.2 0.2 . 1 . . . . 191 GLN CG . 25473 1 722 . 1 1 54 54 GLN N N 15 123.031 0.2 . 1 . . . . 191 GLN N . 25473 1 723 . 1 1 54 54 GLN NE2 N 15 109.554 0.2 . 1 . . . . 191 GLN NE2 . 25473 1 724 . 1 1 55 55 LEU H H 1 8.665 0.02 . 1 . . . . 192 LEU HN . 25473 1 725 . 1 1 55 55 LEU HA H 1 4.116 0.02 . 1 . . . . 192 LEU HA . 25473 1 726 . 1 1 55 55 LEU HB2 H 1 1.31 0.02 . 2 . . . . 192 LEU HB2 . 25473 1 727 . 1 1 55 55 LEU HB3 H 1 1.962 0.02 . 2 . . . . 192 LEU HB3 . 25473 1 728 . 1 1 55 55 LEU HD11 H 1 0.858 0.02 . 1 . . . . 192 LEU MD1 . 25473 1 729 . 1 1 55 55 LEU HD12 H 1 0.858 0.02 . 1 . . . . 192 LEU MD1 . 25473 1 730 . 1 1 55 55 LEU HD13 H 1 0.858 0.02 . 1 . . . . 192 LEU MD1 . 25473 1 731 . 1 1 55 55 LEU HD21 H 1 0.948 0.02 . 1 . . . . 192 LEU MD2 . 25473 1 732 . 1 1 55 55 LEU HD22 H 1 0.948 0.02 . 1 . . . . 192 LEU MD2 . 25473 1 733 . 1 1 55 55 LEU HD23 H 1 0.948 0.02 . 1 . . . . 192 LEU MD2 . 25473 1 734 . 1 1 55 55 LEU HG H 1 2.14 0.02 . 1 . . . . 192 LEU HG . 25473 1 735 . 1 1 55 55 LEU C C 13 178.501 0.2 . 1 . . . . 192 LEU C . 25473 1 736 . 1 1 55 55 LEU CA C 13 57.831 0.2 . 1 . . . . 192 LEU CA . 25473 1 737 . 1 1 55 55 LEU CB C 13 41.663 0.2 . 1 . . . . 192 LEU CB . 25473 1 738 . 1 1 55 55 LEU CD1 C 13 26.203 0.02 . 1 . . . . 192 LEU CD1 . 25473 1 739 . 1 1 55 55 LEU CD2 C 13 22.373 0.2 . 1 . . . . 192 LEU CD2 . 25473 1 740 . 1 1 55 55 LEU CG C 13 26.347 0.2 . 1 . . . . 192 LEU CG . 25473 1 741 . 1 1 55 55 LEU N N 15 120.749 0.2 . 1 . . . . 192 LEU N . 25473 1 742 . 1 1 56 56 LYS H H 1 8.176 0.02 . 1 . . . . 193 LYS HN . 25473 1 743 . 1 1 56 56 LYS HA H 1 3.71 0.02 . 1 . . . . 193 LYS HA . 25473 1 744 . 1 1 56 56 LYS HB2 H 1 1.96 0.02 . 1 . . . . 193 LYS HB2 . 25473 1 745 . 1 1 56 56 LYS HB3 H 1 1.96 0.02 . 1 . . . . 193 LYS HB3 . 25473 1 746 . 1 1 56 56 LYS HD2 H 1 1.659 0.02 . 1 . . . . 193 LYS HD2 . 25473 1 747 . 1 1 56 56 LYS HD3 H 1 1.659 0.02 . 1 . . . . 193 LYS HD3 . 25473 1 748 . 1 1 56 56 LYS HE2 H 1 2.892 0.02 . 1 . . . . 193 LYS HE2 . 25473 1 749 . 1 1 56 56 LYS HE3 H 1 2.892 0.02 . 1 . . . . 193 LYS HE3 . 25473 1 750 . 1 1 56 56 LYS HG2 H 1 1.357 0.02 . 1 . . . . 193 LYS HG2 . 25473 1 751 . 1 1 56 56 LYS HG3 H 1 1.357 0.02 . 1 . . . . 193 LYS HG3 . 25473 1 752 . 1 1 56 56 LYS C C 13 178.049 0.2 . 1 . . . . 193 LYS C . 25473 1 753 . 1 1 56 56 LYS CA C 13 60.551 0.2 . 1 . . . . 193 LYS CA . 25473 1 754 . 1 1 56 56 LYS CB C 13 32.522 0.2 . 1 . . . . 193 LYS CB . 25473 1 755 . 1 1 56 56 LYS CD C 13 27.581 0.2 . 1 . . . . 193 LYS CD . 25473 1 756 . 1 1 56 56 LYS CE C 13 41.705 0.2 . 1 . . . . 193 LYS CE . 25473 1 757 . 1 1 56 56 LYS N N 15 118.482 0.2 . 1 . . . . 193 LYS N . 25473 1 758 . 1 1 57 57 GLN H H 1 7.507 0.02 . 1 . . . . 194 GLN HN . 25473 1 759 . 1 1 57 57 GLN HA H 1 3.963 0.02 . 1 . . . . 194 GLN HA . 25473 1 760 . 1 1 57 57 GLN HB2 H 1 2.214 0.02 . 1 . . . . 194 GLN HB2 . 25473 1 761 . 1 1 57 57 GLN HB3 H 1 2.214 0.02 . 1 . . . . 194 GLN HB3 . 25473 1 762 . 1 1 57 57 GLN HE21 H 1 7.557 0.02 . 2 . . . . 194 GLN HE21 . 25473 1 763 . 1 1 57 57 GLN HE22 H 1 6.872 0.02 . 2 . . . . 194 GLN HE22 . 25473 1 764 . 1 1 57 57 GLN HG2 H 1 2.457 0.02 . 1 . . . . 194 GLN HG2 . 25473 1 765 . 1 1 57 57 GLN HG3 H 1 2.457 0.02 . 1 . . . . 194 GLN HG3 . 25473 1 766 . 1 1 57 57 GLN C C 13 179.479 0.2 . 1 . . . . 194 GLN C . 25473 1 767 . 1 1 57 57 GLN CA C 13 58.68 0.2 . 1 . . . . 194 GLN CA . 25473 1 768 . 1 1 57 57 GLN CB C 13 28.399 0.2 . 1 . . . . 194 GLN CB . 25473 1 769 . 1 1 57 57 GLN CG C 13 34 0.2 . 1 . . . . 194 GLN CG . 25473 1 770 . 1 1 57 57 GLN N N 15 115.339 0.2 . 1 . . . . 194 GLN N . 25473 1 771 . 1 1 57 57 GLN NE2 N 15 112.158 0.2 . 1 . . . . 194 GLN NE2 . 25473 1 772 . 1 1 58 58 GLU H H 1 7.949 0.02 . 1 . . . . 195 GLU HN . 25473 1 773 . 1 1 58 58 GLU HA H 1 4.033 0.02 . 1 . . . . 195 GLU HA . 25473 1 774 . 1 1 58 58 GLU HB2 H 1 2.188 0.02 . 1 . . . . 195 GLU HB2 . 25473 1 775 . 1 1 58 58 GLU HB3 H 1 2.188 0.02 . 1 . . . . 195 GLU HB3 . 25473 1 776 . 1 1 58 58 GLU HG2 H 1 2.32 0.02 . 1 . . . . 195 GLU HG2 . 25473 1 777 . 1 1 58 58 GLU HG3 H 1 2.32 0.02 . 1 . . . . 195 GLU HG3 . 25473 1 778 . 1 1 58 58 GLU C C 13 178.309 0.2 . 1 . . . . 195 GLU C . 25473 1 779 . 1 1 58 58 GLU CA C 13 59.265 0.2 . 1 . . . . 195 GLU CA . 25473 1 780 . 1 1 58 58 GLU CB C 13 29.013 0.2 . 1 . . . . 195 GLU CB . 25473 1 781 . 1 1 58 58 GLU CG C 13 35.4 0.2 . 1 . . . . 195 GLU CG . 25473 1 782 . 1 1 58 58 GLU N N 15 120.919 0.2 . 1 . . . . 195 GLU N . 25473 1 783 . 1 1 59 59 LEU H H 1 7.61 0.02 . 1 . . . . 196 LEU HN . 25473 1 784 . 1 1 59 59 LEU HA H 1 4.168 0.02 . 1 . . . . 196 LEU HA . 25473 1 785 . 1 1 59 59 LEU HB2 H 1 1.554 0.02 . 2 . . . . 196 LEU HB2 . 25473 1 786 . 1 1 59 59 LEU HB3 H 1 1.967 0.02 . 2 . . . . 196 LEU HB3 . 25473 1 787 . 1 1 59 59 LEU HD11 H 1 0.846 0.02 . 1 . . . . 196 LEU MD1 . 25473 1 788 . 1 1 59 59 LEU HD12 H 1 0.846 0.02 . 1 . . . . 196 LEU MD1 . 25473 1 789 . 1 1 59 59 LEU HD13 H 1 0.846 0.02 . 1 . . . . 196 LEU MD1 . 25473 1 790 . 1 1 59 59 LEU HD21 H 1 0.882 0.02 . 1 . . . . 196 LEU MD2 . 25473 1 791 . 1 1 59 59 LEU HD22 H 1 0.882 0.02 . 1 . . . . 196 LEU MD2 . 25473 1 792 . 1 1 59 59 LEU HD23 H 1 0.882 0.02 . 1 . . . . 196 LEU MD2 . 25473 1 793 . 1 1 59 59 LEU HG H 1 1.946 0.02 . 1 . . . . 196 LEU HG . 25473 1 794 . 1 1 59 59 LEU C C 13 177.246 0.2 . 1 . . . . 196 LEU C . 25473 1 795 . 1 1 59 59 LEU CA C 13 56.084 0.2 . 1 . . . . 196 LEU CA . 25473 1 796 . 1 1 59 59 LEU CB C 13 41.834 0.2 . 1 . . . . 196 LEU CB . 25473 1 797 . 1 1 59 59 LEU CD1 C 13 27.438 0.2 . 1 . . . . 196 LEU CD1 . 25473 1 798 . 1 1 59 59 LEU CD2 C 13 24.131 0.02 . 1 . . . . 196 LEU CD2 . 25473 1 799 . 1 1 59 59 LEU CG C 13 27.111 0.02 . 1 . . . . 196 LEU CG . 25473 1 800 . 1 1 59 59 LEU N N 15 115.006 0.2 . 1 . . . . 196 LEU N . 25473 1 801 . 1 1 60 60 LYS H H 1 7.415 0.02 . 1 . . . . 197 LYS HN . 25473 1 802 . 1 1 60 60 LYS HA H 1 4.278 0.02 . 1 . . . . 197 LYS HA . 25473 1 803 . 1 1 60 60 LYS HB2 H 1 1.993 0.02 . 2 . . . . 197 LYS HB2 . 25473 1 804 . 1 1 60 60 LYS HB3 H 1 1.777 0.02 . 2 . . . . 197 LYS HB3 . 25473 1 805 . 1 1 60 60 LYS HD2 H 1 1.64 0.02 . 1 . . . . 197 LYS HD2 . 25473 1 806 . 1 1 60 60 LYS HD3 H 1 1.64 0.02 . 1 . . . . 197 LYS HD3 . 25473 1 807 . 1 1 60 60 LYS HE2 H 1 2.926 0.02 . 1 . . . . 197 LYS HE2 . 25473 1 808 . 1 1 60 60 LYS HE3 H 1 2.926 0.02 . 1 . . . . 197 LYS HE3 . 25473 1 809 . 1 1 60 60 LYS HG2 H 1 1.446 0.02 . 2 . . . . 197 LYS HG2 . 25473 1 810 . 1 1 60 60 LYS HG3 H 1 1.671 0.02 . 2 . . . . 197 LYS HG3 . 25473 1 811 . 1 1 60 60 LYS C C 13 177.303 0.2 . 1 . . . . 197 LYS C . 25473 1 812 . 1 1 60 60 LYS CA C 13 56.447 0.2 . 1 . . . . 197 LYS CA . 25473 1 813 . 1 1 60 60 LYS CB C 13 32.662 0.2 . 1 . . . . 197 LYS CB . 25473 1 814 . 1 1 60 60 LYS CD C 13 29.124 0.2 . 1 . . . . 197 LYS CD . 25473 1 815 . 1 1 60 60 LYS CE C 13 42.031 0.2 . 1 . . . . 197 LYS CE . 25473 1 816 . 1 1 60 60 LYS CG C 13 25.315 0.2 . 1 . . . . 197 LYS CG . 25473 1 817 . 1 1 60 60 LYS N N 15 116.526 0.2 . 1 . . . . 197 LYS N . 25473 1 818 . 1 1 61 61 ARG H H 1 7.399 0.02 . 1 . . . . 198 ARG HN . 25473 1 819 . 1 1 61 61 ARG HA H 1 4.183 0.02 . 1 . . . . 198 ARG HA . 25473 1 820 . 1 1 61 61 ARG HB2 H 1 1.862 0.02 . 1 . . . . 198 ARG HB2 . 25473 1 821 . 1 1 61 61 ARG HB3 H 1 1.862 0.02 . 1 . . . . 198 ARG HB3 . 25473 1 822 . 1 1 61 61 ARG HD2 H 1 3.247 0.02 . 1 . . . . 198 ARG HD2 . 25473 1 823 . 1 1 61 61 ARG HD3 H 1 3.247 0.02 . 1 . . . . 198 ARG HD3 . 25473 1 824 . 1 1 61 61 ARG HG2 H 1 1.709 0.02 . 1 . . . . 198 ARG HG2 . 25473 1 825 . 1 1 61 61 ARG HG3 H 1 1.709 0.02 . 1 . . . . 198 ARG HG3 . 25473 1 826 . 1 1 61 61 ARG C C 13 176.169 0.2 . 1 . . . . 198 ARG C . 25473 1 827 . 1 1 61 61 ARG CA C 13 57.3 0.2 . 1 . . . . 198 ARG CA . 25473 1 828 . 1 1 61 61 ARG CB C 13 31.36 0.2 . 1 . . . . 198 ARG CB . 25473 1 829 . 1 1 61 61 ARG CD C 13 43.6 0.2 . 1 . . . . 198 ARG CD . 25473 1 830 . 1 1 61 61 ARG CG C 13 28 0.2 . 1 . . . . 198 ARG CG . 25473 1 831 . 1 1 61 61 ARG N N 15 119.858 0.2 . 1 . . . . 198 ARG N . 25473 1 832 . 1 1 62 62 GLU H H 1 8.312 0.02 . 1 . . . . 199 GLU HN . 25473 1 833 . 1 1 62 62 GLU HA H 1 4.202 0.02 . 1 . . . . 199 GLU HA . 25473 1 834 . 1 1 62 62 GLU HB2 H 1 2.01 0.02 . 1 . . . . 199 GLU HB2 . 25473 1 835 . 1 1 62 62 GLU HB3 H 1 2.01 0.02 . 1 . . . . 199 GLU HB3 . 25473 1 836 . 1 1 62 62 GLU HG2 H 1 2.304 0.02 . 1 . . . . 199 GLU HG2 . 25473 1 837 . 1 1 62 62 GLU HG3 H 1 2.304 0.02 . 1 . . . . 199 GLU HG3 . 25473 1 838 . 1 1 62 62 GLU C C 13 176.276 0.2 . 1 . . . . 199 GLU C . 25473 1 839 . 1 1 62 62 GLU CA C 13 57.188 0.2 . 1 . . . . 199 GLU CA . 25473 1 840 . 1 1 62 62 GLU CB C 13 30.584 0.2 . 1 . . . . 199 GLU CB . 25473 1 841 . 1 1 62 62 GLU CG C 13 36.3 0.2 . 1 . . . . 199 GLU CG . 25473 1 842 . 1 1 62 62 GLU N N 15 119.525 0.2 . 1 . . . . 199 GLU N . 25473 1 843 . 1 1 63 63 LYS H H 1 8.434 0.02 . 1 . . . . 200 LYS HN . 25473 1 844 . 1 1 63 63 LYS HA H 1 4.237 0.02 . 1 . . . . 200 LYS HA . 25473 1 845 . 1 1 63 63 LYS HB2 H 1 1.811 0.02 . 1 . . . . 200 LYS HB2 . 25473 1 846 . 1 1 63 63 LYS HB3 H 1 1.811 0.02 . 1 . . . . 200 LYS HB3 . 25473 1 847 . 1 1 63 63 LYS HD2 H 1 1.697 0.02 . 1 . . . . 200 LYS HD2 . 25473 1 848 . 1 1 63 63 LYS HD3 H 1 1.697 0.02 . 1 . . . . 200 LYS HD3 . 25473 1 849 . 1 1 63 63 LYS HE2 H 1 3.003 0.02 . 1 . . . . 200 LYS HE2 . 25473 1 850 . 1 1 63 63 LYS HE3 H 1 3.003 0.02 . 1 . . . . 200 LYS HE3 . 25473 1 851 . 1 1 63 63 LYS HG2 H 1 1.354 0.02 . 2 . . . . 200 LYS HG2 . 25473 1 852 . 1 1 63 63 LYS HG3 H 1 1.404 0.02 . 2 . . . . 200 LYS HG3 . 25473 1 853 . 1 1 63 63 LYS C C 13 175.629 0.2 . 1 . . . . 200 LYS C . 25473 1 854 . 1 1 63 63 LYS CA C 13 55.951 0.2 . 1 . . . . 200 LYS CA . 25473 1 855 . 1 1 63 63 LYS CB C 13 31.344 0.2 . 1 . . . . 200 LYS CB . 25473 1 856 . 1 1 63 63 LYS CD C 13 29.193 0.2 . 1 . . . . 200 LYS CD . 25473 1 857 . 1 1 63 63 LYS CE C 13 42.204 0.2 . 1 . . . . 200 LYS CE . 25473 1 858 . 1 1 63 63 LYS CG C 13 25.187 0.2 . 1 . . . . 200 LYS CG . 25473 1 859 . 1 1 63 63 LYS N N 15 118.467 0.2 . 1 . . . . 200 LYS N . 25473 1 860 . 1 1 64 64 LEU H H 1 8.001 0.02 . 1 . . . . 201 LEU HN . 25473 1 861 . 1 1 64 64 LEU HA H 1 4.46 0.02 . 1 . . . . 201 LEU HA . 25473 1 862 . 1 1 64 64 LEU HB2 H 1 1.45 0.02 . 2 . . . . 201 LEU HB2 . 25473 1 863 . 1 1 64 64 LEU HB3 H 1 1.647 0.02 . 2 . . . . 201 LEU HB3 . 25473 1 864 . 1 1 64 64 LEU HD11 H 1 0.93 0.02 . 1 . . . . 201 LEU MD1 . 25473 1 865 . 1 1 64 64 LEU HD12 H 1 0.93 0.02 . 1 . . . . 201 LEU MD1 . 25473 1 866 . 1 1 64 64 LEU HD13 H 1 0.93 0.02 . 1 . . . . 201 LEU MD1 . 25473 1 867 . 1 1 64 64 LEU HD21 H 1 0.864 0.02 . 1 . . . . 201 LEU MD2 . 25473 1 868 . 1 1 64 64 LEU HD22 H 1 0.864 0.02 . 1 . . . . 201 LEU MD2 . 25473 1 869 . 1 1 64 64 LEU HD23 H 1 0.864 0.02 . 1 . . . . 201 LEU MD2 . 25473 1 870 . 1 1 64 64 LEU HG H 1 1.671 0.02 . 1 . . . . 201 LEU HG . 25473 1 871 . 1 1 64 64 LEU C C 13 177.515 0.2 . 1 . . . . 201 LEU C . 25473 1 872 . 1 1 64 64 LEU CA C 13 54.901 0.2 . 1 . . . . 201 LEU CA . 25473 1 873 . 1 1 64 64 LEU CB C 13 43.504 0.2 . 1 . . . . 201 LEU CB . 25473 1 874 . 1 1 64 64 LEU CD1 C 13 25.917 0.2 . 1 . . . . 201 LEU CD1 . 25473 1 875 . 1 1 64 64 LEU CD2 C 13 24.545 0.02 . 1 . . . . 201 LEU CD2 . 25473 1 876 . 1 1 64 64 LEU CG C 13 27.172 0.02 . 1 . . . . 201 LEU CG . 25473 1 877 . 1 1 64 64 LEU N N 15 123.829 0.2 . 1 . . . . 201 LEU N . 25473 1 878 . 1 1 65 65 THR H H 1 7.744 0.02 . 1 . . . . 202 THR HN . 25473 1 879 . 1 1 65 65 THR HA H 1 4.433 0.02 . 1 . . . . 202 THR HA . 25473 1 880 . 1 1 65 65 THR HB H 1 4.707 0.02 . 1 . . . . 202 THR HB . 25473 1 881 . 1 1 65 65 THR HG21 H 1 1.367 0.02 . 1 . . . . 202 THR MG . 25473 1 882 . 1 1 65 65 THR HG22 H 1 1.367 0.02 . 1 . . . . 202 THR MG . 25473 1 883 . 1 1 65 65 THR HG23 H 1 1.367 0.02 . 1 . . . . 202 THR MG . 25473 1 884 . 1 1 65 65 THR C C 13 174.959 0.2 . 1 . . . . 202 THR C . 25473 1 885 . 1 1 65 65 THR CA C 13 60.14 0.2 . 1 . . . . 202 THR CA . 25473 1 886 . 1 1 65 65 THR CB C 13 71.503 0.2 . 1 . . . . 202 THR CB . 25473 1 887 . 1 1 65 65 THR CG2 C 13 22.033 0.2 . 1 . . . . 202 THR CG2 . 25473 1 888 . 1 1 65 65 THR N N 15 113.276 0.2 . 1 . . . . 202 THR N . 25473 1 889 . 1 1 66 66 LEU H H 1 8.715 0.02 . 1 . . . . 203 LEU HN . 25473 1 890 . 1 1 66 66 LEU HA H 1 4.133 0.02 . 1 . . . . 203 LEU HA . 25473 1 891 . 1 1 66 66 LEU HB2 H 1 1.747 0.02 . 1 . . . . 203 LEU HB2 . 25473 1 892 . 1 1 66 66 LEU HB3 H 1 1.747 0.02 . 1 . . . . 203 LEU HB3 . 25473 1 893 . 1 1 66 66 LEU HD11 H 1 1.048 0.02 . 1 . . . . 203 LEU MD1 . 25473 1 894 . 1 1 66 66 LEU HD12 H 1 1.048 0.02 . 1 . . . . 203 LEU MD1 . 25473 1 895 . 1 1 66 66 LEU HD13 H 1 1.048 0.02 . 1 . . . . 203 LEU MD1 . 25473 1 896 . 1 1 66 66 LEU HD21 H 1 0.99 0.02 . 1 . . . . 203 LEU MD2 . 25473 1 897 . 1 1 66 66 LEU HD22 H 1 0.99 0.02 . 1 . . . . 203 LEU MD2 . 25473 1 898 . 1 1 66 66 LEU HD23 H 1 0.99 0.02 . 1 . . . . 203 LEU MD2 . 25473 1 899 . 1 1 66 66 LEU HG H 1 1.638 0.02 . 1 . . . . 203 LEU HG . 25473 1 900 . 1 1 66 66 LEU C C 13 179.189 0.2 . 1 . . . . 203 LEU C . 25473 1 901 . 1 1 66 66 LEU CA C 13 58.303 0.2 . 1 . . . . 203 LEU CA . 25473 1 902 . 1 1 66 66 LEU CB C 13 40.968 0.2 . 1 . . . . 203 LEU CB . 25473 1 903 . 1 1 66 66 LEU CD1 C 13 23.442 0.2 . 1 . . . . 203 LEU CD1 . 25473 1 904 . 1 1 66 66 LEU CD2 C 13 25.035 0.02 . 1 . . . . 203 LEU CD2 . 25473 1 905 . 1 1 66 66 LEU CG C 13 27.25 0.02 . 1 . . . . 203 LEU CG . 25473 1 906 . 1 1 66 66 LEU N N 15 121.933 0.2 . 1 . . . . 203 LEU N . 25473 1 907 . 1 1 67 67 ASN H H 1 8.468 0.02 . 1 . . . . 204 ASN HN . 25473 1 908 . 1 1 67 67 ASN HA H 1 4.357 0.02 . 1 . . . . 204 ASN HA . 25473 1 909 . 1 1 67 67 ASN HB2 H 1 2.764 0.02 . 2 . . . . 204 ASN HB2 . 25473 1 910 . 1 1 67 67 ASN HB3 H 1 2.73 0.02 . 2 . . . . 204 ASN HB3 . 25473 1 911 . 1 1 67 67 ASN HD21 H 1 7.63 0.02 . 2 . . . . 204 ASN HD21 . 25473 1 912 . 1 1 67 67 ASN HD22 H 1 6.967 0.02 . 2 . . . . 204 ASN HD22 . 25473 1 913 . 1 1 67 67 ASN C C 13 177.736 0.2 . 1 . . . . 204 ASN C . 25473 1 914 . 1 1 67 67 ASN CA C 13 56.552 0.2 . 1 . . . . 204 ASN CA . 25473 1 915 . 1 1 67 67 ASN CB C 13 38.084 0.2 . 1 . . . . 204 ASN CB . 25473 1 916 . 1 1 67 67 ASN N N 15 115.863 0.2 . 1 . . . . 204 ASN N . 25473 1 917 . 1 1 67 67 ASN ND2 N 15 113.007 0.2 . 1 . . . . 204 ASN ND2 . 25473 1 918 . 1 1 68 68 ALA H H 1 7.832 0.02 . 1 . . . . 205 ALA HN . 25473 1 919 . 1 1 68 68 ALA HA H 1 4.175 0.02 . 1 . . . . 205 ALA HA . 25473 1 920 . 1 1 68 68 ALA HB1 H 1 1.565 0.02 . 1 . . . . 205 ALA MB . 25473 1 921 . 1 1 68 68 ALA HB2 H 1 1.565 0.02 . 1 . . . . 205 ALA MB . 25473 1 922 . 1 1 68 68 ALA HB3 H 1 1.565 0.02 . 1 . . . . 205 ALA MB . 25473 1 923 . 1 1 68 68 ALA C C 13 180.825 0.2 . 1 . . . . 205 ALA C . 25473 1 924 . 1 1 68 68 ALA CA C 13 55.224 0.2 . 1 . . . . 205 ALA CA . 25473 1 925 . 1 1 68 68 ALA CB C 13 18.741 0.2 . 1 . . . . 205 ALA CB . 25473 1 926 . 1 1 68 68 ALA N N 15 123.664 0.2 . 1 . . . . 205 ALA N . 25473 1 927 . 1 1 69 69 LEU H H 1 8.185 0.02 . 1 . . . . 206 LEU HN . 25473 1 928 . 1 1 69 69 LEU HA H 1 3.877 0.02 . 1 . . . . 206 LEU HA . 25473 1 929 . 1 1 69 69 LEU HB2 H 1 1.312 0.02 . 2 . . . . 206 LEU HB2 . 25473 1 930 . 1 1 69 69 LEU HB3 H 1 2.015 0.02 . 2 . . . . 206 LEU HB3 . 25473 1 931 . 1 1 69 69 LEU HD11 H 1 0.83 0.02 . 1 . . . . 206 LEU MD1 . 25473 1 932 . 1 1 69 69 LEU HD12 H 1 0.83 0.02 . 1 . . . . 206 LEU MD1 . 25473 1 933 . 1 1 69 69 LEU HD13 H 1 0.83 0.02 . 1 . . . . 206 LEU MD1 . 25473 1 934 . 1 1 69 69 LEU HD21 H 1 0.738 0.02 . 1 . . . . 206 LEU MD2 . 25473 1 935 . 1 1 69 69 LEU HD22 H 1 0.738 0.02 . 1 . . . . 206 LEU MD2 . 25473 1 936 . 1 1 69 69 LEU HD23 H 1 0.738 0.02 . 1 . . . . 206 LEU MD2 . 25473 1 937 . 1 1 69 69 LEU HG H 1 1.728 0.02 . 1 . . . . 206 LEU HG . 25473 1 938 . 1 1 69 69 LEU C C 13 179.233 0.2 . 1 . . . . 206 LEU C . 25473 1 939 . 1 1 69 69 LEU CA C 13 58.228 0.2 . 1 . . . . 206 LEU CA . 25473 1 940 . 1 1 69 69 LEU CB C 13 41.544 0.2 . 1 . . . . 206 LEU CB . 25473 1 941 . 1 1 69 69 LEU CD1 C 13 25.719 0.02 . 1 . . . . 206 LEU CD1 . 25473 1 942 . 1 1 69 69 LEU CD2 C 13 24.556 0.2 . 1 . . . . 206 LEU CD2 . 25473 1 943 . 1 1 69 69 LEU CG C 13 26.395 0.02 . 1 . . . . 206 LEU CG . 25473 1 944 . 1 1 69 69 LEU N N 15 119.641 0.2 . 1 . . . . 206 LEU N . 25473 1 945 . 1 1 70 70 LYS H H 1 8.56 0.02 . 1 . . . . 207 LYS HN . 25473 1 946 . 1 1 70 70 LYS HA H 1 4.003 0.02 . 1 . . . . 207 LYS HA . 25473 1 947 . 1 1 70 70 LYS HB2 H 1 1.981 0.02 . 1 . . . . 207 LYS HB2 . 25473 1 948 . 1 1 70 70 LYS HB3 H 1 1.981 0.02 . 1 . . . . 207 LYS HB3 . 25473 1 949 . 1 1 70 70 LYS HD2 H 1 1.729 0.02 . 1 . . . . 207 LYS HD2 . 25473 1 950 . 1 1 70 70 LYS HD3 H 1 1.729 0.02 . 1 . . . . 207 LYS HD3 . 25473 1 951 . 1 1 70 70 LYS HE2 H 1 3.175 0.02 . 1 . . . . 207 LYS HE2 . 25473 1 952 . 1 1 70 70 LYS HE3 H 1 3.175 0.02 . 1 . . . . 207 LYS HE3 . 25473 1 953 . 1 1 70 70 LYS HG2 H 1 1.446 0.02 . 2 . . . . 207 LYS HG2 . 25473 1 954 . 1 1 70 70 LYS HG3 H 1 1.675 0.02 . 2 . . . . 207 LYS HG3 . 25473 1 955 . 1 1 70 70 LYS C C 13 179.339 0.2 . 1 . . . . 207 LYS C . 25473 1 956 . 1 1 70 70 LYS CA C 13 59.881 0.2 . 1 . . . . 207 LYS CA . 25473 1 957 . 1 1 70 70 LYS CB C 13 32.095 0.2 . 1 . . . . 207 LYS CB . 25473 1 958 . 1 1 70 70 LYS CD C 13 29.427 0.2 . 1 . . . . 207 LYS CD . 25473 1 959 . 1 1 70 70 LYS CE C 13 43.209 0.2 . 1 . . . . 207 LYS CE . 25473 1 960 . 1 1 70 70 LYS CG C 13 26.259 0.2 . 1 . . . . 207 LYS CG . 25473 1 961 . 1 1 70 70 LYS N N 15 118.971 0.2 . 1 . . . . 207 LYS N . 25473 1 962 . 1 1 71 71 GLN H H 1 7.879 0.02 . 1 . . . . 208 GLN HN . 25473 1 963 . 1 1 71 71 GLN HA H 1 4.139 0.02 . 1 . . . . 208 GLN HA . 25473 1 964 . 1 1 71 71 GLN HB2 H 1 2.246 0.02 . 1 . . . . 208 GLN HB2 . 25473 1 965 . 1 1 71 71 GLN HB3 H 1 2.246 0.02 . 1 . . . . 208 GLN HB3 . 25473 1 966 . 1 1 71 71 GLN HE21 H 1 7.378 0.02 . 2 . . . . 208 GLN HE21 . 25473 1 967 . 1 1 71 71 GLN HE22 H 1 6.783 0.02 . 2 . . . . 208 GLN HE22 . 25473 1 968 . 1 1 71 71 GLN HG2 H 1 2.475 0.02 . 1 . . . . 208 GLN HG2 . 25473 1 969 . 1 1 71 71 GLN HG3 H 1 2.475 0.02 . 1 . . . . 208 GLN HG3 . 25473 1 970 . 1 1 71 71 GLN C C 13 179.034 0.2 . 1 . . . . 208 GLN C . 25473 1 971 . 1 1 71 71 GLN CA C 13 59.2 0.2 . 1 . . . . 208 GLN CA . 25473 1 972 . 1 1 71 71 GLN CB C 13 28.078 0.2 . 1 . . . . 208 GLN CB . 25473 1 973 . 1 1 71 71 GLN CG C 13 34.197 0.2 . 1 . . . . 208 GLN CG . 25473 1 974 . 1 1 71 71 GLN N N 15 119.825 0.2 . 1 . . . . 208 GLN N . 25473 1 975 . 1 1 71 71 GLN NE2 N 15 111.846 0.2 . 1 . . . . 208 GLN NE2 . 25473 1 976 . 1 1 72 72 VAL H H 1 7.867 0.02 . 1 . . . . 209 VAL HN . 25473 1 977 . 1 1 72 72 VAL HA H 1 3.7 0.02 . 1 . . . . 209 VAL HA . 25473 1 978 . 1 1 72 72 VAL HB H 1 2.303 0.02 . 1 . . . . 209 VAL HB . 25473 1 979 . 1 1 72 72 VAL HG11 H 1 1.005 0.02 . 1 . . . . 209 VAL MG1 . 25473 1 980 . 1 1 72 72 VAL HG12 H 1 1.005 0.02 . 1 . . . . 209 VAL MG1 . 25473 1 981 . 1 1 72 72 VAL HG13 H 1 1.005 0.02 . 1 . . . . 209 VAL MG1 . 25473 1 982 . 1 1 72 72 VAL HG21 H 1 1.088 0.02 . 1 . . . . 209 VAL MG2 . 25473 1 983 . 1 1 72 72 VAL HG22 H 1 1.088 0.02 . 1 . . . . 209 VAL MG2 . 25473 1 984 . 1 1 72 72 VAL HG23 H 1 1.088 0.02 . 1 . . . . 209 VAL MG2 . 25473 1 985 . 1 1 72 72 VAL C C 13 177.375 0.2 . 1 . . . . 209 VAL C . 25473 1 986 . 1 1 72 72 VAL CA C 13 67.123 0.2 . 1 . . . . 209 VAL CA . 25473 1 987 . 1 1 72 72 VAL CB C 13 31.276 0.2 . 1 . . . . 209 VAL CB . 25473 1 988 . 1 1 72 72 VAL CG1 C 13 22.436 0.2 . 1 . . . . 209 VAL CG1 . 25473 1 989 . 1 1 72 72 VAL CG2 C 13 22.396 0.2 . 1 . . . . 209 VAL CG2 . 25473 1 990 . 1 1 72 72 VAL N N 15 121.324 0.2 . 1 . . . . 209 VAL N . 25473 1 991 . 1 1 73 73 GLN H H 1 8.28 0.02 . 1 . . . . 210 GLN HN . 25473 1 992 . 1 1 73 73 GLN HA H 1 3.816 0.02 . 1 . . . . 210 GLN HA . 25473 1 993 . 1 1 73 73 GLN HB2 H 1 1.961 0.02 . 1 . . . . 210 GLN HB2 . 25473 1 994 . 1 1 73 73 GLN HB3 H 1 1.961 0.02 . 1 . . . . 210 GLN HB3 . 25473 1 995 . 1 1 73 73 GLN HE21 H 1 7.847 0.02 . 2 . . . . 210 GLN HE21 . 25473 1 996 . 1 1 73 73 GLN HE22 H 1 7.239 0.02 . 2 . . . . 210 GLN HE22 . 25473 1 997 . 1 1 73 73 GLN HG2 H 1 2.392 0.02 . 1 . . . . 210 GLN HG2 . 25473 1 998 . 1 1 73 73 GLN HG3 H 1 2.392 0.02 . 1 . . . . 210 GLN HG3 . 25473 1 999 . 1 1 73 73 GLN C C 13 178.184 0.2 . 1 . . . . 210 GLN C . 25473 1 1000 . 1 1 73 73 GLN CA C 13 59.772 0.2 . 1 . . . . 210 GLN CA . 25473 1 1001 . 1 1 73 73 GLN CB C 13 29.854 0.2 . 1 . . . . 210 GLN CB . 25473 1 1002 . 1 1 73 73 GLN CG C 13 33.945 0.2 . 1 . . . . 210 GLN CG . 25473 1 1003 . 1 1 73 73 GLN N N 15 119 0.2 . 1 . . . . 210 GLN N . 25473 1 1004 . 1 1 73 73 GLN NE2 N 15 112.117 0.2 . 1 . . . . 210 GLN NE2 . 25473 1 1005 . 1 1 74 74 MET H H 1 8.375 0.02 . 1 . . . . 211 MET HN . 25473 1 1006 . 1 1 74 74 MET HA H 1 4.189 0.02 . 1 . . . . 211 MET HA . 25473 1 1007 . 1 1 74 74 MET HB2 H 1 2.247 0.02 . 1 . . . . 211 MET HB2 . 25473 1 1008 . 1 1 74 74 MET HB3 H 1 2.247 0.02 . 1 . . . . 211 MET HB3 . 25473 1 1009 . 1 1 74 74 MET HE1 H 1 2.081 0.02 . 1 . . . . 211 MET ME . 25473 1 1010 . 1 1 74 74 MET HE2 H 1 2.081 0.02 . 1 . . . . 211 MET ME . 25473 1 1011 . 1 1 74 74 MET HE3 H 1 2.081 0.02 . 1 . . . . 211 MET ME . 25473 1 1012 . 1 1 74 74 MET HG2 H 1 2.736 0.02 . 2 . . . . 211 MET HG2 . 25473 1 1013 . 1 1 74 74 MET HG3 H 1 2.649 0.02 . 2 . . . . 211 MET HG3 . 25473 1 1014 . 1 1 74 74 MET C C 13 178.614 0.2 . 1 . . . . 211 MET C . 25473 1 1015 . 1 1 74 74 MET CA C 13 58.333 0.2 . 1 . . . . 211 MET CA . 25473 1 1016 . 1 1 74 74 MET CB C 13 31.89 0.2 . 1 . . . . 211 MET CB . 25473 1 1017 . 1 1 74 74 MET CE C 13 17.08 0.2 . 1 . . . . 211 MET CE . 25473 1 1018 . 1 1 74 74 MET CG C 13 32.342 0.2 . 1 . . . . 211 MET CG . 25473 1 1019 . 1 1 74 74 MET N N 15 118.176 0.2 . 1 . . . . 211 MET N . 25473 1 1020 . 1 1 75 75 GLN H H 1 8.259 0.02 . 1 . . . . 212 GLN HN . 25473 1 1021 . 1 1 75 75 GLN HA H 1 4.193 0.02 . 1 . . . . 212 GLN HA . 25473 1 1022 . 1 1 75 75 GLN HB2 H 1 2.12 0.02 . 1 . . . . 212 GLN HB2 . 25473 1 1023 . 1 1 75 75 GLN HB3 H 1 2.12 0.02 . 1 . . . . 212 GLN HB3 . 25473 1 1024 . 1 1 75 75 GLN HE21 H 1 7.451 0.02 . 2 . . . . 212 GLN HE21 . 25473 1 1025 . 1 1 75 75 GLN HE22 H 1 6.674 0.02 . 2 . . . . 212 GLN HE22 . 25473 1 1026 . 1 1 75 75 GLN HG2 H 1 2.52 0.02 . 2 . . . . 212 GLN HG2 . 25473 1 1027 . 1 1 75 75 GLN HG3 H 1 2.346 0.02 . 2 . . . . 212 GLN HG3 . 25473 1 1028 . 1 1 75 75 GLN C C 13 178.851 0.2 . 1 . . . . 212 GLN C . 25473 1 1029 . 1 1 75 75 GLN CA C 13 59.468 0.2 . 1 . . . . 212 GLN CA . 25473 1 1030 . 1 1 75 75 GLN CB C 13 28.881 0.2 . 1 . . . . 212 GLN CB . 25473 1 1031 . 1 1 75 75 GLN CG C 13 34.6 0.2 . 1 . . . . 212 GLN CG . 25473 1 1032 . 1 1 75 75 GLN N N 15 121.363 0.2 . 1 . . . . 212 GLN N . 25473 1 1033 . 1 1 75 75 GLN NE2 N 15 110.551 0.2 . 1 . . . . 212 GLN NE2 . 25473 1 1034 . 1 1 76 76 LEU H H 1 8.433 0.02 . 1 . . . . 213 LEU HN . 25473 1 1035 . 1 1 76 76 LEU HA H 1 4.088 0.02 . 1 . . . . 213 LEU HA . 25473 1 1036 . 1 1 76 76 LEU HB2 H 1 1.53 0.02 . 2 . . . . 213 LEU HB2 . 25473 1 1037 . 1 1 76 76 LEU HB3 H 1 1.93 0.02 . 2 . . . . 213 LEU HB3 . 25473 1 1038 . 1 1 76 76 LEU HD11 H 1 0.834 0.02 . 1 . . . . 213 LEU MD1 . 25473 1 1039 . 1 1 76 76 LEU HD12 H 1 0.834 0.02 . 1 . . . . 213 LEU MD1 . 25473 1 1040 . 1 1 76 76 LEU HD13 H 1 0.834 0.02 . 1 . . . . 213 LEU MD1 . 25473 1 1041 . 1 1 76 76 LEU HD21 H 1 0.731 0.02 . 1 . . . . 213 LEU MD2 . 25473 1 1042 . 1 1 76 76 LEU HD22 H 1 0.731 0.02 . 1 . . . . 213 LEU MD2 . 25473 1 1043 . 1 1 76 76 LEU HD23 H 1 0.731 0.02 . 1 . . . . 213 LEU MD2 . 25473 1 1044 . 1 1 76 76 LEU HG H 1 1.77 0.02 . 1 . . . . 213 LEU HG . 25473 1 1045 . 1 1 76 76 LEU C C 13 179.079 0.2 . 1 . . . . 213 LEU C . 25473 1 1046 . 1 1 76 76 LEU CA C 13 58.338 0.2 . 1 . . . . 213 LEU CA . 25473 1 1047 . 1 1 76 76 LEU CB C 13 42.241 0.2 . 1 . . . . 213 LEU CB . 25473 1 1048 . 1 1 76 76 LEU CD1 C 13 26.128 0.2 . 1 . . . . 213 LEU CD1 . 25473 1 1049 . 1 1 76 76 LEU CD2 C 13 24.464 0.02 . 1 . . . . 213 LEU CD2 . 25473 1 1050 . 1 1 76 76 LEU CG C 13 26.885 0.2 . 1 . . . . 213 LEU CG . 25473 1 1051 . 1 1 76 76 LEU N N 15 118.821 0.2 . 1 . . . . 213 LEU N . 25473 1 1052 . 1 1 77 77 ARG H H 1 7.802 0.02 . 1 . . . . 214 ARG HN . 25473 1 1053 . 1 1 77 77 ARG HA H 1 4.005 0.02 . 1 . . . . 214 ARG HA . 25473 1 1054 . 1 1 77 77 ARG HB2 H 1 1.988 0.02 . 1 . . . . 214 ARG HB2 . 25473 1 1055 . 1 1 77 77 ARG HB3 H 1 1.988 0.02 . 1 . . . . 214 ARG HB3 . 25473 1 1056 . 1 1 77 77 ARG HD2 H 1 3.163 0.02 . 1 . . . . 214 ARG HD2 . 25473 1 1057 . 1 1 77 77 ARG HD3 H 1 3.163 0.02 . 1 . . . . 214 ARG HD3 . 25473 1 1058 . 1 1 77 77 ARG HG2 H 1 1.708 0.02 . 1 . . . . 214 ARG HG2 . 25473 1 1059 . 1 1 77 77 ARG HG3 H 1 1.708 0.02 . 1 . . . . 214 ARG HG3 . 25473 1 1060 . 1 1 77 77 ARG C C 13 178.169 0.2 . 1 . . . . 214 ARG C . 25473 1 1061 . 1 1 77 77 ARG CA C 13 58.749 0.2 . 1 . . . . 214 ARG CA . 25473 1 1062 . 1 1 77 77 ARG CB C 13 29.956 0.2 . 1 . . . . 214 ARG CB . 25473 1 1063 . 1 1 77 77 ARG CD C 13 43.687 0.2 . 1 . . . . 214 ARG CD . 25473 1 1064 . 1 1 77 77 ARG CG C 13 27.769 0.2 . 1 . . . . 214 ARG CG . 25473 1 1065 . 1 1 77 77 ARG N N 15 117.581 0.2 . 1 . . . . 214 ARG N . 25473 1 1066 . 1 1 78 78 GLN H H 1 8.113 0.02 . 1 . . . . 215 GLN HN . 25473 1 1067 . 1 1 78 78 GLN HA H 1 4.121 0.02 . 1 . . . . 215 GLN HA . 25473 1 1068 . 1 1 78 78 GLN HB2 H 1 2.229 0.02 . 1 . . . . 215 GLN HB2 . 25473 1 1069 . 1 1 78 78 GLN HB3 H 1 2.229 0.02 . 1 . . . . 215 GLN HB3 . 25473 1 1070 . 1 1 78 78 GLN HE21 H 1 7.344 0.02 . 2 . . . . 215 GLN HE21 . 25473 1 1071 . 1 1 78 78 GLN HE22 H 1 6.78 0.02 . 2 . . . . 215 GLN HE22 . 25473 1 1072 . 1 1 78 78 GLN HG2 H 1 2.547 0.02 . 2 . . . . 215 GLN HG2 . 25473 1 1073 . 1 1 78 78 GLN HG3 H 1 2.392 0.02 . 2 . . . . 215 GLN HG3 . 25473 1 1074 . 1 1 78 78 GLN C C 13 178.499 0.2 . 1 . . . . 215 GLN C . 25473 1 1075 . 1 1 78 78 GLN CA C 13 58.508 0.2 . 1 . . . . 215 GLN CA . 25473 1 1076 . 1 1 78 78 GLN CB C 13 29.006 0.2 . 1 . . . . 215 GLN CB . 25473 1 1077 . 1 1 78 78 GLN CG C 13 34.237 0.2 . 1 . . . . 215 GLN CG . 25473 1 1078 . 1 1 78 78 GLN N N 15 117.637 0.2 . 1 . . . . 215 GLN N . 25473 1 1079 . 1 1 78 78 GLN NE2 N 15 111.195 0.2 . 1 . . . . 215 GLN NE2 . 25473 1 1080 . 1 1 79 79 VAL H H 1 8.207 0.02 . 1 . . . . 216 VAL HN . 25473 1 1081 . 1 1 79 79 VAL HA H 1 3.717 0.02 . 1 . . . . 216 VAL HA . 25473 1 1082 . 1 1 79 79 VAL HB H 1 1.924 0.02 . 1 . . . . 216 VAL HB . 25473 1 1083 . 1 1 79 79 VAL HG11 H 1 0.286 0.02 . 1 . . . . 216 VAL MG1 . 25473 1 1084 . 1 1 79 79 VAL HG12 H 1 0.286 0.02 . 1 . . . . 216 VAL MG1 . 25473 1 1085 . 1 1 79 79 VAL HG13 H 1 0.286 0.02 . 1 . . . . 216 VAL MG1 . 25473 1 1086 . 1 1 79 79 VAL HG21 H 1 1.064 0.02 . 1 . . . . 216 VAL MG2 . 25473 1 1087 . 1 1 79 79 VAL HG22 H 1 1.064 0.02 . 1 . . . . 216 VAL MG2 . 25473 1 1088 . 1 1 79 79 VAL HG23 H 1 1.064 0.02 . 1 . . . . 216 VAL MG2 . 25473 1 1089 . 1 1 79 79 VAL C C 13 177.228 0.2 . 1 . . . . 216 VAL C . 25473 1 1090 . 1 1 79 79 VAL CA C 13 65.093 0.2 . 1 . . . . 216 VAL CA . 25473 1 1091 . 1 1 79 79 VAL CB C 13 32.654 0.2 . 1 . . . . 216 VAL CB . 25473 1 1092 . 1 1 79 79 VAL CG1 C 13 22.198 0.2 . 1 . . . . 216 VAL CG1 . 25473 1 1093 . 1 1 79 79 VAL CG2 C 13 23.091 0.2 . 1 . . . . 216 VAL CG2 . 25473 1 1094 . 1 1 79 79 VAL N N 15 118.145 0.2 . 1 . . . . 216 VAL N . 25473 1 1095 . 1 1 80 80 PHE H H 1 7.955 0.02 . 1 . . . . 217 PHE HN . 25473 1 1096 . 1 1 80 80 PHE HA H 1 4.782 0.02 . 1 . . . . 217 PHE HA . 25473 1 1097 . 1 1 80 80 PHE HB2 H 1 3.438 0.02 . 2 . . . . 217 PHE HB2 . 25473 1 1098 . 1 1 80 80 PHE HB3 H 1 3.049 0.02 . 2 . . . . 217 PHE HB3 . 25473 1 1099 . 1 1 80 80 PHE HD1 H 1 7.605 0.02 . 1 . . . . 217 PHE HD1 . 25473 1 1100 . 1 1 80 80 PHE HD2 H 1 7.605 0.02 . 1 . . . . 217 PHE HD2 . 25473 1 1101 . 1 1 80 80 PHE HE1 H 1 7.158 0.02 . 1 . . . . 217 PHE HE1 . 25473 1 1102 . 1 1 80 80 PHE HE2 H 1 7.158 0.02 . 1 . . . . 217 PHE HE2 . 25473 1 1103 . 1 1 80 80 PHE HZ H 1 7.322 0.02 . 1 . . . . 217 PHE HZ . 25473 1 1104 . 1 1 80 80 PHE C C 13 176.977 0.2 . 1 . . . . 217 PHE C . 25473 1 1105 . 1 1 80 80 PHE CA C 13 58.458 0.2 . 1 . . . . 217 PHE CA . 25473 1 1106 . 1 1 80 80 PHE CB C 13 38.611 0.2 . 1 . . . . 217 PHE CB . 25473 1 1107 . 1 1 80 80 PHE CD1 C 13 132.714 0.2 . 1 . . . . 217 PHE CD1 . 25473 1 1108 . 1 1 80 80 PHE CD2 C 13 132.714 0.2 . 1 . . . . 217 PHE CD2 . 25473 1 1109 . 1 1 80 80 PHE CE1 C 13 130.522 0.2 . 1 . . . . 217 PHE CE1 . 25473 1 1110 . 1 1 80 80 PHE CE2 C 13 130.522 0.2 . 1 . . . . 217 PHE CE2 . 25473 1 1111 . 1 1 80 80 PHE CZ C 13 129.456 0.2 . 1 . . . . 217 PHE CZ . 25473 1 1112 . 1 1 80 80 PHE N N 15 115.67 0.2 . 1 . . . . 217 PHE N . 25473 1 1113 . 1 1 81 81 SER H H 1 7.556 0.02 . 1 . . . . 218 SER HN . 25473 1 1114 . 1 1 81 81 SER HA H 1 4.327 0.02 . 1 . . . . 218 SER HA . 25473 1 1115 . 1 1 81 81 SER HB2 H 1 4.08 0.02 . 1 . . . . 218 SER HB2 . 25473 1 1116 . 1 1 81 81 SER HB3 H 1 4.08 0.02 . 1 . . . . 218 SER HB3 . 25473 1 1117 . 1 1 81 81 SER C C 13 176.624 0.2 . 1 . . . . 218 SER C . 25473 1 1118 . 1 1 81 81 SER CA C 13 61.779 0.2 . 1 . . . . 218 SER CA . 25473 1 1119 . 1 1 81 81 SER CB C 13 63 0.2 . 1 . . . . 218 SER CB . 25473 1 1120 . 1 1 81 81 SER N N 15 116.398 0.2 . 1 . . . . 218 SER N . 25473 1 1121 . 1 1 82 82 GLN H H 1 8.453 0.02 . 1 . . . . 219 GLN HN . 25473 1 1122 . 1 1 82 82 GLN HA H 1 4.294 0.02 . 1 . . . . 219 GLN HA . 25473 1 1123 . 1 1 82 82 GLN HB2 H 1 2.02 0.02 . 2 . . . . 219 GLN HB2 . 25473 1 1124 . 1 1 82 82 GLN HB3 H 1 2.136 0.02 . 2 . . . . 219 GLN HB3 . 25473 1 1125 . 1 1 82 82 GLN HE21 H 1 7.455 0.02 . 2 . . . . 219 GLN HE21 . 25473 1 1126 . 1 1 82 82 GLN HE22 H 1 6.807 0.02 . 2 . . . . 219 GLN HE22 . 25473 1 1127 . 1 1 82 82 GLN HG2 H 1 2.418 0.02 . 1 . . . . 219 GLN HG2 . 25473 1 1128 . 1 1 82 82 GLN HG3 H 1 2.418 0.02 . 1 . . . . 219 GLN HG3 . 25473 1 1129 . 1 1 82 82 GLN C C 13 177.055 0.2 . 1 . . . . 219 GLN C . 25473 1 1130 . 1 1 82 82 GLN CA C 13 57.801 0.2 . 1 . . . . 219 GLN CA . 25473 1 1131 . 1 1 82 82 GLN CB C 13 28.517 0.2 . 1 . . . . 219 GLN CB . 25473 1 1132 . 1 1 82 82 GLN CG C 13 34.4 0.2 . 1 . . . . 219 GLN CG . 25473 1 1133 . 1 1 82 82 GLN N N 15 120.348 0.2 . 1 . . . . 219 GLN N . 25473 1 1134 . 1 1 82 82 GLN NE2 N 15 111.948 0.2 . 1 . . . . 219 GLN NE2 . 25473 1 1135 . 1 1 83 83 ASP H H 1 7.915 0.02 . 1 . . . . 220 ASP HN . 25473 1 1136 . 1 1 83 83 ASP HA H 1 4.645 0.02 . 1 . . . . 220 ASP HA . 25473 1 1137 . 1 1 83 83 ASP HB2 H 1 2.698 0.02 . 1 . . . . 220 ASP HB2 . 25473 1 1138 . 1 1 83 83 ASP HB3 H 1 2.698 0.02 . 1 . . . . 220 ASP HB3 . 25473 1 1139 . 1 1 83 83 ASP C C 13 176.995 0.2 . 1 . . . . 220 ASP C . 25473 1 1140 . 1 1 83 83 ASP CA C 13 56.021 0.2 . 1 . . . . 220 ASP CA . 25473 1 1141 . 1 1 83 83 ASP CB C 13 42.022 0.2 . 1 . . . . 220 ASP CB . 25473 1 1142 . 1 1 83 83 ASP N N 15 120.156 0.2 . 1 . . . . 220 ASP N . 25473 1 1143 . 1 1 84 84 GLN H H 1 8.225 0.02 . 1 . . . . 221 GLN HN . 25473 1 1144 . 1 1 84 84 GLN HA H 1 4.065 0.02 . 1 . . . . 221 GLN HA . 25473 1 1145 . 1 1 84 84 GLN HB2 H 1 2.13 0.02 . 1 . . . . 221 GLN HB2 . 25473 1 1146 . 1 1 84 84 GLN HB3 H 1 2.13 0.02 . 1 . . . . 221 GLN HB3 . 25473 1 1147 . 1 1 84 84 GLN HE21 H 1 7.526 0.02 . 2 . . . . 221 GLN HE21 . 25473 1 1148 . 1 1 84 84 GLN HE22 H 1 6.847 0.02 . 2 . . . . 221 GLN HE22 . 25473 1 1149 . 1 1 84 84 GLN HG2 H 1 2.405 0.02 . 1 . . . . 221 GLN HG2 . 25473 1 1150 . 1 1 84 84 GLN HG3 H 1 2.405 0.02 . 1 . . . . 221 GLN HG3 . 25473 1 1151 . 1 1 84 84 GLN C C 13 177.601 0.2 . 1 . . . . 221 GLN C . 25473 1 1152 . 1 1 84 84 GLN CA C 13 58.19 0.2 . 1 . . . . 221 GLN CA . 25473 1 1153 . 1 1 84 84 GLN CB C 13 28.861 0.2 . 1 . . . . 221 GLN CB . 25473 1 1154 . 1 1 84 84 GLN CG C 13 34.76 0.2 . 1 . . . . 221 GLN CG . 25473 1 1155 . 1 1 84 84 GLN N N 15 118.477 0.2 . 1 . . . . 221 GLN N . 25473 1 1156 . 1 1 84 84 GLN NE2 N 15 112.474 0.2 . 1 . . . . 221 GLN NE2 . 25473 1 1157 . 1 1 85 85 GLN H H 1 8.17 0.02 . 1 . . . . 222 GLN HN . 25473 1 1158 . 1 1 85 85 GLN HA H 1 4.151 0.02 . 1 . . . . 222 GLN HA . 25473 1 1159 . 1 1 85 85 GLN HB2 H 1 2.139 0.02 . 1 . . . . 222 GLN HB2 . 25473 1 1160 . 1 1 85 85 GLN HB3 H 1 2.139 0.02 . 1 . . . . 222 GLN HB3 . 25473 1 1161 . 1 1 85 85 GLN HE21 H 1 7.492 0.02 . 2 . . . . 222 GLN HE21 . 25473 1 1162 . 1 1 85 85 GLN HE22 H 1 6.82 0.02 . 2 . . . . 222 GLN HE22 . 25473 1 1163 . 1 1 85 85 GLN HG2 H 1 2.396 0.02 . 1 . . . . 222 GLN HG2 . 25473 1 1164 . 1 1 85 85 GLN HG3 H 1 2.396 0.02 . 1 . . . . 222 GLN HG3 . 25473 1 1165 . 1 1 85 85 GLN C C 13 177.68 0.2 . 1 . . . . 222 GLN C . 25473 1 1166 . 1 1 85 85 GLN CA C 13 58.268 0.2 . 1 . . . . 222 GLN CA . 25473 1 1167 . 1 1 85 85 GLN CB C 13 28.528 0.2 . 1 . . . . 222 GLN CB . 25473 1 1168 . 1 1 85 85 GLN CG C 13 34.1 0.2 . 1 . . . . 222 GLN CG . 25473 1 1169 . 1 1 85 85 GLN N N 15 119.493 0.2 . 1 . . . . 222 GLN N . 25473 1 1170 . 1 1 85 85 GLN NE2 N 15 112.348 0.2 . 1 . . . . 222 GLN NE2 . 25473 1 1171 . 1 1 86 86 VAL H H 1 7.739 0.02 . 1 . . . . 223 VAL HN . 25473 1 1172 . 1 1 86 86 VAL HA H 1 3.927 0.02 . 1 . . . . 223 VAL HA . 25473 1 1173 . 1 1 86 86 VAL HB H 1 2.228 0.02 . 1 . . . . 223 VAL HB . 25473 1 1174 . 1 1 86 86 VAL HG11 H 1 0.937 0.02 . 1 . . . . 223 VAL MG1 . 25473 1 1175 . 1 1 86 86 VAL HG12 H 1 0.937 0.02 . 1 . . . . 223 VAL MG1 . 25473 1 1176 . 1 1 86 86 VAL HG13 H 1 0.937 0.02 . 1 . . . . 223 VAL MG1 . 25473 1 1177 . 1 1 86 86 VAL HG21 H 1 1.023 0.02 . 1 . . . . 223 VAL MG2 . 25473 1 1178 . 1 1 86 86 VAL HG22 H 1 1.023 0.02 . 1 . . . . 223 VAL MG2 . 25473 1 1179 . 1 1 86 86 VAL HG23 H 1 1.023 0.02 . 1 . . . . 223 VAL MG2 . 25473 1 1180 . 1 1 86 86 VAL C C 13 177.532 0.2 . 1 . . . . 223 VAL C . 25473 1 1181 . 1 1 86 86 VAL CA C 13 64.479 0.2 . 1 . . . . 223 VAL CA . 25473 1 1182 . 1 1 86 86 VAL CB C 13 31.972 0.2 . 1 . . . . 223 VAL CB . 25473 1 1183 . 1 1 86 86 VAL CG1 C 13 21.303 0.2 . 1 . . . . 223 VAL CG1 . 25473 1 1184 . 1 1 86 86 VAL CG2 C 13 21.878 0.2 . 1 . . . . 223 VAL CG2 . 25473 1 1185 . 1 1 86 86 VAL N N 15 119.555 0.2 . 1 . . . . 223 VAL N . 25473 1 1186 . 1 1 87 87 LEU H H 1 7.857 0.02 . 1 . . . . 224 LEU HN . 25473 1 1187 . 1 1 87 87 LEU HA H 1 4.128 0.02 . 1 . . . . 224 LEU HA . 25473 1 1188 . 1 1 87 87 LEU HB2 H 1 1.81 0.02 . 2 . . . . 224 LEU HB2 . 25473 1 1189 . 1 1 87 87 LEU HB3 H 1 1.545 0.02 . 2 . . . . 224 LEU HB3 . 25473 1 1190 . 1 1 87 87 LEU HD11 H 1 0.792 0.02 . 1 . . . . 224 LEU MD1 . 25473 1 1191 . 1 1 87 87 LEU HD12 H 1 0.792 0.02 . 1 . . . . 224 LEU MD1 . 25473 1 1192 . 1 1 87 87 LEU HD13 H 1 0.792 0.02 . 1 . . . . 224 LEU MD1 . 25473 1 1193 . 1 1 87 87 LEU HD21 H 1 0.831 0.02 . 1 . . . . 224 LEU MD2 . 25473 1 1194 . 1 1 87 87 LEU HD22 H 1 0.831 0.02 . 1 . . . . 224 LEU MD2 . 25473 1 1195 . 1 1 87 87 LEU HD23 H 1 0.831 0.02 . 1 . . . . 224 LEU MD2 . 25473 1 1196 . 1 1 87 87 LEU HG H 1 1.729 0.02 . 1 . . . . 224 LEU HG . 25473 1 1197 . 1 1 87 87 LEU C C 13 178.362 0.2 . 1 . . . . 224 LEU C . 25473 1 1198 . 1 1 87 87 LEU CA C 13 56.497 0.2 . 1 . . . . 224 LEU CA . 25473 1 1199 . 1 1 87 87 LEU CB C 13 41.824 0.2 . 1 . . . . 224 LEU CB . 25473 1 1200 . 1 1 87 87 LEU CD1 C 13 25.519 0.2 . 1 . . . . 224 LEU CD1 . 25473 1 1201 . 1 1 87 87 LEU CD2 C 13 23.301 0.2 . 1 . . . . 224 LEU CD2 . 25473 1 1202 . 1 1 87 87 LEU CG C 13 26.78 0.02 . 1 . . . . 224 LEU CG . 25473 1 1203 . 1 1 87 87 LEU N N 15 120.926 0.2 . 1 . . . . 224 LEU N . 25473 1 1204 . 1 1 88 88 GLN H H 1 8.001 0.02 . 1 . . . . 225 GLN HN . 25473 1 1205 . 1 1 88 88 GLN HA H 1 4.157 0.02 . 1 . . . . 225 GLN HA . 25473 1 1206 . 1 1 88 88 GLN HB2 H 1 2.098 0.02 . 1 . . . . 225 GLN HB2 . 25473 1 1207 . 1 1 88 88 GLN HB3 H 1 2.098 0.02 . 1 . . . . 225 GLN HB3 . 25473 1 1208 . 1 1 88 88 GLN HE21 H 1 7.507 0.02 . 2 . . . . 225 GLN HE21 . 25473 1 1209 . 1 1 88 88 GLN HE22 H 1 6.833 0.02 . 2 . . . . 225 GLN HE22 . 25473 1 1210 . 1 1 88 88 GLN HG2 H 1 2.401 0.02 . 1 . . . . 225 GLN HG2 . 25473 1 1211 . 1 1 88 88 GLN HG3 H 1 2.401 0.02 . 1 . . . . 225 GLN HG3 . 25473 1 1212 . 1 1 88 88 GLN C C 13 177.274 0.2 . 1 . . . . 225 GLN C . 25473 1 1213 . 1 1 88 88 GLN CA C 13 57.218 0.2 . 1 . . . . 225 GLN CA . 25473 1 1214 . 1 1 88 88 GLN CB C 13 28.951 0.2 . 1 . . . . 225 GLN CB . 25473 1 1215 . 1 1 88 88 GLN CG C 13 34.3 0.2 . 1 . . . . 225 GLN CG . 25473 1 1216 . 1 1 88 88 GLN N N 15 118.809 0.2 . 1 . . . . 225 GLN N . 25473 1 1217 . 1 1 88 88 GLN NE2 N 15 112.451 0.2 . 1 . . . . 225 GLN NE2 . 25473 1 1218 . 1 1 89 89 GLU H H 1 8.143 0.02 . 1 . . . . 226 GLU HN . 25473 1 1219 . 1 1 89 89 GLU HA H 1 4.159 0.02 . 1 . . . . 226 GLU HA . 25473 1 1220 . 1 1 89 89 GLU HB2 H 1 2.073 0.02 . 1 . . . . 226 GLU HB2 . 25473 1 1221 . 1 1 89 89 GLU HB3 H 1 2.073 0.02 . 1 . . . . 226 GLU HB3 . 25473 1 1222 . 1 1 89 89 GLU HG2 H 1 2.349 0.02 . 1 . . . . 226 GLU HG2 . 25473 1 1223 . 1 1 89 89 GLU HG3 H 1 2.349 0.02 . 1 . . . . 226 GLU HG3 . 25473 1 1224 . 1 1 89 89 GLU C C 13 177.509 0.2 . 1 . . . . 226 GLU C . 25473 1 1225 . 1 1 89 89 GLU CA C 13 57.944 0.2 . 1 . . . . 226 GLU CA . 25473 1 1226 . 1 1 89 89 GLU CB C 13 30.024 0.2 . 1 . . . . 226 GLU CB . 25473 1 1227 . 1 1 89 89 GLU CG C 13 36.593 0.2 . 1 . . . . 226 GLU CG . 25473 1 1228 . 1 1 89 89 GLU N N 15 120.836 0.2 . 1 . . . . 226 GLU N . 25473 1 1229 . 1 1 90 90 ARG H H 1 8.139 0.02 . 1 . . . . 227 ARG HN . 25473 1 1230 . 1 1 90 90 ARG HA H 1 4.246 0.02 . 1 . . . . 227 ARG HA . 25473 1 1231 . 1 1 90 90 ARG HB2 H 1 1.881 0.02 . 1 . . . . 227 ARG HB2 . 25473 1 1232 . 1 1 90 90 ARG HB3 H 1 1.881 0.02 . 1 . . . . 227 ARG HB3 . 25473 1 1233 . 1 1 90 90 ARG HD2 H 1 3.169 0.02 . 1 . . . . 227 ARG HD2 . 25473 1 1234 . 1 1 90 90 ARG HD3 H 1 3.169 0.02 . 1 . . . . 227 ARG HD3 . 25473 1 1235 . 1 1 90 90 ARG HG2 H 1 1.713 0.02 . 1 . . . . 227 ARG HG2 . 25473 1 1236 . 1 1 90 90 ARG HG3 H 1 1.713 0.02 . 1 . . . . 227 ARG HG3 . 25473 1 1237 . 1 1 90 90 ARG C C 13 177.032 0.2 . 1 . . . . 227 ARG C . 25473 1 1238 . 1 1 90 90 ARG CA C 13 57.239 0.2 . 1 . . . . 227 ARG CA . 25473 1 1239 . 1 1 90 90 ARG CB C 13 30.691 0.2 . 1 . . . . 227 ARG CB . 25473 1 1240 . 1 1 90 90 ARG CD C 13 43.713 0.2 . 1 . . . . 227 ARG CD . 25473 1 1241 . 1 1 90 90 ARG CG C 13 27.716 0.2 . 1 . . . . 227 ARG CG . 25473 1 1242 . 1 1 90 90 ARG N N 15 119.581 0.2 . 1 . . . . 227 ARG N . 25473 1 1243 . 1 1 91 91 MET H H 1 8.047 0.02 . 1 . . . . 228 MET H . 25473 1 1244 . 1 1 91 91 MET HA H 1 4.368 0.02 . 1 . . . . 228 MET HA . 25473 1 1245 . 1 1 91 91 MET HB2 H 1 2.015 0.02 . 1 . . . . 228 MET HB2 . 25473 1 1246 . 1 1 91 91 MET HB3 H 1 2.015 0.02 . 1 . . . . 228 MET HB3 . 25473 1 1247 . 1 1 91 91 MET HE1 H 1 2.081 0.02 . 1 . . . . 228 MET ME . 25473 1 1248 . 1 1 91 91 MET HE2 H 1 2.081 0.02 . 1 . . . . 228 MET ME . 25473 1 1249 . 1 1 91 91 MET HE3 H 1 2.081 0.02 . 1 . . . . 228 MET ME . 25473 1 1250 . 1 1 91 91 MET HG2 H 1 2.582 0.02 . 2 . . . . 228 MET HG2 . 25473 1 1251 . 1 1 91 91 MET HG3 H 1 2.518 0.02 . 2 . . . . 228 MET HG3 . 25473 1 1252 . 1 1 91 91 MET C C 13 176.351 0.2 . 1 . . . . 228 MET C . 25473 1 1253 . 1 1 91 91 MET CA C 13 56.131 0.2 . 1 . . . . 228 MET CA . 25473 1 1254 . 1 1 91 91 MET CB C 13 32.72 0.2 . 1 . . . . 228 MET CB . 25473 1 1255 . 1 1 91 91 MET CE C 13 17.08 0.2 . 1 . . . . 228 MET CE . 25473 1 1256 . 1 1 91 91 MET CG C 13 32.566 0.2 . 1 . . . . 228 MET CG . 25473 1 1257 . 1 1 91 91 MET N N 15 119.391 0.2 . 1 . . . . 228 MET N . 25473 1 1258 . 1 1 92 92 ARG H H 1 7.981 0.02 . 1 . . . . 229 ARG HN . 25473 1 1259 . 1 1 92 92 ARG HA H 1 4.21 0.02 . 1 . . . . 229 ARG HA . 25473 1 1260 . 1 1 92 92 ARG HB2 H 1 1.694 0.02 . 1 . . . . 229 ARG HB2 . 25473 1 1261 . 1 1 92 92 ARG HB3 H 1 1.694 0.02 . 1 . . . . 229 ARG HB3 . 25473 1 1262 . 1 1 92 92 ARG HD2 H 1 3.129 0.02 . 1 . . . . 229 ARG HD2 . 25473 1 1263 . 1 1 92 92 ARG HD3 H 1 3.129 0.02 . 1 . . . . 229 ARG HD3 . 25473 1 1264 . 1 1 92 92 ARG HG2 H 1 1.446 0.02 . 2 . . . . 229 ARG HG2 . 25473 1 1265 . 1 1 92 92 ARG HG3 H 1 1.517 0.02 . 2 . . . . 229 ARG HG3 . 25473 1 1266 . 1 1 92 92 ARG C C 13 176.066 0.2 . 1 . . . . 229 ARG C . 25473 1 1267 . 1 1 92 92 ARG CA C 13 56.646 0.2 . 1 . . . . 229 ARG CA . 25473 1 1268 . 1 1 92 92 ARG CB C 13 30.721 0.2 . 1 . . . . 229 ARG CB . 25473 1 1269 . 1 1 92 92 ARG CD C 13 43.505 0.2 . 1 . . . . 229 ARG CD . 25473 1 1270 . 1 1 92 92 ARG CG C 13 27.294 0.2 . 1 . . . . 229 ARG CG . 25473 1 1271 . 1 1 92 92 ARG N N 15 120.762 0.2 . 1 . . . . 229 ARG N . 25473 1 1272 . 1 1 93 93 TYR H H 1 8.039 0.02 . 1 . . . . 230 TYR HN . 25473 1 1273 . 1 1 93 93 TYR HA H 1 4.49 0.02 . 1 . . . . 230 TYR HA . 25473 1 1274 . 1 1 93 93 TYR HB2 H 1 3.007 0.02 . 2 . . . . 230 TYR HB2 . 25473 1 1275 . 1 1 93 93 TYR HB3 H 1 2.886 0.02 . 2 . . . . 230 TYR HB3 . 25473 1 1276 . 1 1 93 93 TYR HD1 H 1 7.063 0.02 . 1 . . . . 230 TYR HD1 . 25473 1 1277 . 1 1 93 93 TYR HD2 H 1 7.063 0.02 . 1 . . . . 230 TYR HD2 . 25473 1 1278 . 1 1 93 93 TYR HE1 H 1 6.779 0.02 . 1 . . . . 230 TYR HE1 . 25473 1 1279 . 1 1 93 93 TYR HE2 H 1 6.779 0.02 . 1 . . . . 230 TYR HE2 . 25473 1 1280 . 1 1 93 93 TYR C C 13 175.636 0.2 . 1 . . . . 230 TYR C . 25473 1 1281 . 1 1 93 93 TYR CA C 13 58.103 0.2 . 1 . . . . 230 TYR CA . 25473 1 1282 . 1 1 93 93 TYR CB C 13 38.79 0.2 . 1 . . . . 230 TYR CB . 25473 1 1283 . 1 1 93 93 TYR CD1 C 13 132.985 0.2 . 1 . . . . 230 TYR CD1 . 25473 1 1284 . 1 1 93 93 TYR CD2 C 13 132.985 0.2 . 1 . . . . 230 TYR CD2 . 25473 1 1285 . 1 1 93 93 TYR CE1 C 13 118.093 0.2 . 1 . . . . 230 TYR CE1 . 25473 1 1286 . 1 1 93 93 TYR CE2 C 13 118.093 0.2 . 1 . . . . 230 TYR CE2 . 25473 1 1287 . 1 1 93 93 TYR N N 15 120.111 0.2 . 1 . . . . 230 TYR N . 25473 1 1288 . 1 1 94 94 HIS H H 1 8.115 0.02 . 1 . . . . 231 HIS HN . 25473 1 1289 . 1 1 94 94 HIS HA H 1 4.57 0.02 . 1 . . . . 231 HIS HA . 25473 1 1290 . 1 1 94 94 HIS HB2 H 1 3.169 0.02 . 2 . . . . 231 HIS HB2 . 25473 1 1291 . 1 1 94 94 HIS HB3 H 1 3.066 0.02 . 2 . . . . 231 HIS HB3 . 25473 1 1292 . 1 1 94 94 HIS HD2 H 1 7.107 0.02 . 1 . . . . 231 HIS HD2 . 25473 1 1293 . 1 1 94 94 HIS C C 13 174.05 0.2 . 1 . . . . 231 HIS C . 25473 1 1294 . 1 1 94 94 HIS CA C 13 55.748 0.2 . 1 . . . . 231 HIS CA . 25473 1 1295 . 1 1 94 94 HIS CB C 13 30.075 0.2 . 1 . . . . 231 HIS CB . 25473 1 1296 . 1 1 94 94 HIS CD2 C 13 120.071 0.2 . 1 . . . . 231 HIS CD2 . 25473 1 1297 . 1 1 94 94 HIS N N 15 120.055 0.2 . 1 . . . . 231 HIS N . 25473 1 1298 . 1 1 95 95 GLU H H 1 8.284 0.02 . 1 . . . . 232 GLU HN . 25473 1 1299 . 1 1 95 95 GLU HA H 1 4.242 0.02 . 1 . . . . 232 GLU HA . 25473 1 1300 . 1 1 95 95 GLU HB2 H 1 2.054 0.02 . 2 . . . . 232 GLU HB2 . 25473 1 1301 . 1 1 95 95 GLU HB3 H 1 1.893 0.02 . 2 . . . . 232 GLU HB3 . 25473 1 1302 . 1 1 95 95 GLU HG2 H 1 2.218 0.02 . 1 . . . . 232 GLU HG2 . 25473 1 1303 . 1 1 95 95 GLU HG3 H 1 2.218 0.02 . 1 . . . . 232 GLU HG3 . 25473 1 1304 . 1 1 95 95 GLU C C 13 175.315 0.2 . 1 . . . . 232 GLU C . 25473 1 1305 . 1 1 95 95 GLU CA C 13 56.632 0.2 . 1 . . . . 232 GLU CA . 25473 1 1306 . 1 1 95 95 GLU CB C 13 30.545 0.2 . 1 . . . . 232 GLU CB . 25473 1 1307 . 1 1 95 95 GLU CG C 13 36.363 0.2 . 1 . . . . 232 GLU CG . 25473 1 1308 . 1 1 95 95 GLU N N 15 122.201 0.2 . 1 . . . . 232 GLU N . 25473 1 1309 . 1 1 96 96 LEU H H 1 7.847 0.02 . 1 . . . . 233 LEU HN . 25473 1 1310 . 1 1 96 96 LEU HA H 1 4.155 0.02 . 1 . . . . 233 LEU HA . 25473 1 1311 . 1 1 96 96 LEU HB2 H 1 1.577 0.02 . 1 . . . . 233 LEU HB2 . 25473 1 1312 . 1 1 96 96 LEU HB3 H 1 1.577 0.02 . 1 . . . . 233 LEU HB3 . 25473 1 1313 . 1 1 96 96 LEU HD11 H 1 0.906 0.02 . 1 . . . . 233 LEU MD1 . 25473 1 1314 . 1 1 96 96 LEU HD12 H 1 0.906 0.02 . 1 . . . . 233 LEU MD1 . 25473 1 1315 . 1 1 96 96 LEU HD13 H 1 0.906 0.02 . 1 . . . . 233 LEU MD1 . 25473 1 1316 . 1 1 96 96 LEU HD21 H 1 0.862 0.02 . 1 . . . . 233 LEU MD2 . 25473 1 1317 . 1 1 96 96 LEU HD22 H 1 0.862 0.02 . 1 . . . . 233 LEU MD2 . 25473 1 1318 . 1 1 96 96 LEU HD23 H 1 0.862 0.02 . 1 . . . . 233 LEU MD2 . 25473 1 1319 . 1 1 96 96 LEU HG H 1 1.6 0.02 . 1 . . . . 233 LEU HG . 25473 1 1320 . 1 1 96 96 LEU C C 13 182.372 0.2 . 1 . . . . 233 LEU C . 25473 1 1321 . 1 1 96 96 LEU CA C 13 56.745 0.2 . 1 . . . . 233 LEU CA . 25473 1 1322 . 1 1 96 96 LEU CB C 13 43.503 0.2 . 1 . . . . 233 LEU CB . 25473 1 1323 . 1 1 96 96 LEU CD1 C 13 25.22 0.2 . 1 . . . . 233 LEU CD1 . 25473 1 1324 . 1 1 96 96 LEU CD2 C 13 23.708 0.2 . 1 . . . . 233 LEU CD2 . 25473 1 1325 . 1 1 96 96 LEU CG C 13 27.099 0.2 . 1 . . . . 233 LEU CG . 25473 1 1326 . 1 1 96 96 LEU N N 15 128.664 0.2 . 1 . . . . 233 LEU N . 25473 1 stop_ save_