data_34007 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34007 _Entry.Title ; Solution structure of the complex between human ZNHIT3 and NUFIP1 proteins ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-06-07 _Entry.Accession_date 2016-06-07 _Entry.Last_release_date 2016-08-26 _Entry.Original_release_date 2016-08-26 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 M. Quinternet M. . . . 34007 2 M. Chagot E. . . . 34007 3 X. Manival X. . . . 34007 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Pac-Hit fold jaw helices' . 34007 'signaling protein' . 34007 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34007 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 488 34007 '15N chemical shifts' 125 34007 '1H chemical shifts' 805 34007 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2021-09-16 2016-06-07 update BMRB 'update entry citation' 34007 1 . . 2016-08-26 2016-06-07 original author 'original release' 34007 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5L85 'BMRB Entry Tracking System' 34007 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34007 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 27594683 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural Features of the Box C/D snoRNP Pre-assembly Process Are Conserved through Species ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 24 _Citation.Journal_issue 10 _Citation.Journal_ASTM STRUE6 _Citation.Journal_ISSN 0969-2126 _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 1693 _Citation.Page_last 1706 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 M. Quinternet M. . . . 34007 1 2 M. Chagot E. . . . 34007 1 3 B. Rothe B. . . . 34007 1 4 D. Tiotu D. . . . 34007 1 5 B. Charpentier B. . . . 34007 1 6 X. Manival X. . . . 34007 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34007 _Assembly.ID 1 _Assembly.Name 'Zinc finger HIT domain-containing protein 3, Nuclear fragile X mental retardation-interacting protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 34007 1 2 entity_2 2 $entity_2 B B yes . . . . . . 34007 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34007 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Zinc finger HIT domain-containing protein 3' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPHMDRVSLQNLKNLGESAT LRSLLLNPHLRQLMVNLDQG EDKAKLMRAYMQEPLFVEFA DCCLGIVEPSQNEES ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 75 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8492.720 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'HNF-4a coactivator' na 34007 1 TRIP-3 na 34007 1 'Thyroid hormone receptor interactor 3' na 34007 1 'Thyroid receptor-interacting protein 3' na 34007 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 81 GLY . 34007 1 2 82 PRO . 34007 1 3 83 HIS . 34007 1 4 84 MET . 34007 1 5 85 ASP . 34007 1 6 86 ARG . 34007 1 7 87 VAL . 34007 1 8 88 SER . 34007 1 9 89 LEU . 34007 1 10 90 GLN . 34007 1 11 91 ASN . 34007 1 12 92 LEU . 34007 1 13 93 LYS . 34007 1 14 94 ASN . 34007 1 15 95 LEU . 34007 1 16 96 GLY . 34007 1 17 97 GLU . 34007 1 18 98 SER . 34007 1 19 99 ALA . 34007 1 20 100 THR . 34007 1 21 101 LEU . 34007 1 22 102 ARG . 34007 1 23 103 SER . 34007 1 24 104 LEU . 34007 1 25 105 LEU . 34007 1 26 106 LEU . 34007 1 27 107 ASN . 34007 1 28 108 PRO . 34007 1 29 109 HIS . 34007 1 30 110 LEU . 34007 1 31 111 ARG . 34007 1 32 112 GLN . 34007 1 33 113 LEU . 34007 1 34 114 MET . 34007 1 35 115 VAL . 34007 1 36 116 ASN . 34007 1 37 117 LEU . 34007 1 38 118 ASP . 34007 1 39 119 GLN . 34007 1 40 120 GLY . 34007 1 41 121 GLU . 34007 1 42 122 ASP . 34007 1 43 123 LYS . 34007 1 44 124 ALA . 34007 1 45 125 LYS . 34007 1 46 126 LEU . 34007 1 47 127 MET . 34007 1 48 128 ARG . 34007 1 49 129 ALA . 34007 1 50 130 TYR . 34007 1 51 131 MET . 34007 1 52 132 GLN . 34007 1 53 133 GLU . 34007 1 54 134 PRO . 34007 1 55 135 LEU . 34007 1 56 136 PHE . 34007 1 57 137 VAL . 34007 1 58 138 GLU . 34007 1 59 139 PHE . 34007 1 60 140 ALA . 34007 1 61 141 ASP . 34007 1 62 142 CYS . 34007 1 63 143 CYS . 34007 1 64 144 LEU . 34007 1 65 145 GLY . 34007 1 66 146 ILE . 34007 1 67 147 VAL . 34007 1 68 148 GLU . 34007 1 69 149 PRO . 34007 1 70 150 SER . 34007 1 71 151 GLN . 34007 1 72 152 ASN . 34007 1 73 153 GLU . 34007 1 74 154 GLU . 34007 1 75 155 SER . 34007 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 34007 1 . PRO 2 2 34007 1 . HIS 3 3 34007 1 . MET 4 4 34007 1 . ASP 5 5 34007 1 . ARG 6 6 34007 1 . VAL 7 7 34007 1 . SER 8 8 34007 1 . LEU 9 9 34007 1 . GLN 10 10 34007 1 . ASN 11 11 34007 1 . LEU 12 12 34007 1 . LYS 13 13 34007 1 . ASN 14 14 34007 1 . LEU 15 15 34007 1 . GLY 16 16 34007 1 . GLU 17 17 34007 1 . SER 18 18 34007 1 . ALA 19 19 34007 1 . THR 20 20 34007 1 . LEU 21 21 34007 1 . ARG 22 22 34007 1 . SER 23 23 34007 1 . LEU 24 24 34007 1 . LEU 25 25 34007 1 . LEU 26 26 34007 1 . ASN 27 27 34007 1 . PRO 28 28 34007 1 . HIS 29 29 34007 1 . LEU 30 30 34007 1 . ARG 31 31 34007 1 . GLN 32 32 34007 1 . LEU 33 33 34007 1 . MET 34 34 34007 1 . VAL 35 35 34007 1 . ASN 36 36 34007 1 . LEU 37 37 34007 1 . ASP 38 38 34007 1 . GLN 39 39 34007 1 . GLY 40 40 34007 1 . GLU 41 41 34007 1 . ASP 42 42 34007 1 . LYS 43 43 34007 1 . ALA 44 44 34007 1 . LYS 45 45 34007 1 . LEU 46 46 34007 1 . MET 47 47 34007 1 . ARG 48 48 34007 1 . ALA 49 49 34007 1 . TYR 50 50 34007 1 . MET 51 51 34007 1 . GLN 52 52 34007 1 . GLU 53 53 34007 1 . PRO 54 54 34007 1 . LEU 55 55 34007 1 . PHE 56 56 34007 1 . VAL 57 57 34007 1 . GLU 58 58 34007 1 . PHE 59 59 34007 1 . ALA 60 60 34007 1 . ASP 61 61 34007 1 . CYS 62 62 34007 1 . CYS 63 63 34007 1 . LEU 64 64 34007 1 . GLY 65 65 34007 1 . ILE 66 66 34007 1 . VAL 67 67 34007 1 . GLU 68 68 34007 1 . PRO 69 69 34007 1 . SER 70 70 34007 1 . GLN 71 71 34007 1 . ASN 72 72 34007 1 . GLU 73 73 34007 1 . GLU 74 74 34007 1 . SER 75 75 34007 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34007 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'Nuclear fragile X mental retardation-interacting protein 1' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DIRHERNVILQCVRYIIKKD FFGLDTNSAKSKDV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 34 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4030.654 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Nuclear FMRP-interacting protein 1' na 34007 2 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 1 462 ASP . 34007 2 2 463 ILE . 34007 2 3 464 ARG . 34007 2 4 465 HIS . 34007 2 5 466 GLU . 34007 2 6 467 ARG . 34007 2 7 468 ASN . 34007 2 8 469 VAL . 34007 2 9 470 ILE . 34007 2 10 471 LEU . 34007 2 11 472 GLN . 34007 2 12 473 CYS . 34007 2 13 474 VAL . 34007 2 14 475 ARG . 34007 2 15 476 TYR . 34007 2 16 477 ILE . 34007 2 17 478 ILE . 34007 2 18 479 LYS . 34007 2 19 480 LYS . 34007 2 20 481 ASP . 34007 2 21 482 PHE . 34007 2 22 483 PHE . 34007 2 23 484 GLY . 34007 2 24 485 LEU . 34007 2 25 486 ASP . 34007 2 26 487 THR . 34007 2 27 488 ASN . 34007 2 28 489 SER . 34007 2 29 490 ALA . 34007 2 30 491 LYS . 34007 2 31 492 SER . 34007 2 32 493 LYS . 34007 2 33 494 ASP . 34007 2 34 495 VAL . 34007 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ASP 1 1 34007 2 . ILE 2 2 34007 2 . ARG 3 3 34007 2 . HIS 4 4 34007 2 . GLU 5 5 34007 2 . ARG 6 6 34007 2 . ASN 7 7 34007 2 . VAL 8 8 34007 2 . ILE 9 9 34007 2 . LEU 10 10 34007 2 . GLN 11 11 34007 2 . CYS 12 12 34007 2 . VAL 13 13 34007 2 . ARG 14 14 34007 2 . TYR 15 15 34007 2 . ILE 16 16 34007 2 . ILE 17 17 34007 2 . LYS 18 18 34007 2 . LYS 19 19 34007 2 . ASP 20 20 34007 2 . PHE 21 21 34007 2 . PHE 22 22 34007 2 . GLY 23 23 34007 2 . LEU 24 24 34007 2 . ASP 25 25 34007 2 . THR 26 26 34007 2 . ASN 27 27 34007 2 . SER 28 28 34007 2 . ALA 29 29 34007 2 . LYS 30 30 34007 2 . SER 31 31 34007 2 . LYS 32 32 34007 2 . ASP 33 33 34007 2 . VAL 34 34 34007 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34007 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'ZNHIT3, TRIP3' . 34007 1 2 2 $entity_2 . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . NUFIP1 . 34007 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 34007 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . . . . . . . . . . . 34007 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . . . . . . . . . . . 34007 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34007 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-13C; U-15N] ZNHIT3, 1 mM [U-13C; U-15N] NUFIP1, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 NUFIP1 '[U-13C; U-15N]' . . 2 $entity_2 . . 1 . . mM . . . . 34007 1 2 ZNHIT3 '[U-13C; U-15N]' . . 1 $entity_1 . . 1 . . mM . . . . 34007 1 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . 34007 1 4 D2O 'natural abundance' . . . . . . 5 . . % . . . . 34007 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34007 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 34007 1 pH 6.4 . pH 34007 1 pressure 1 . atm 34007 1 temperature 298 . K 34007 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34007 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 34007 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34007 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34007 _Software.ID 2 _Software.Type . _Software.Name CNS _Software.Version 1.21 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 34007 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34007 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34007 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version 3.0 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34007 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34007 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34007 _Software.ID 4 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34007 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 34007 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34007 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details cryoprobe _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34007 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AvanceIII . 600 . . . 34007 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 34007 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 2 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 5 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 7 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 8 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 9 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 10 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 11 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 12 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 13 '2D 1H-1H NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 14 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34007 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34007 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 34007 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34007 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 34007 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34007 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-13C NOESY aliphatic' . . . 34007 1 2 '3D 1H-13C NOESY aromatic' . . . 34007 1 3 '3D 1H-15N NOESY' . . . 34007 1 4 '3D CBCA(CO)NH' . . . 34007 1 5 '3D HNCO' . . . 34007 1 6 '3D HCCH-TOCSY' . . . 34007 1 7 '3D HN(CA)CO' . . . 34007 1 8 '3D HNCACB' . . . 34007 1 9 '3D HNCA' . . . 34007 1 10 '2D 1H-13C HSQC aliphatic' . . . 34007 1 11 '2D 1H-15N HSQC' . . . 34007 1 12 '2D 1H-13C HSQC aromatic' . . . 34007 1 13 '2D 1H-1H NOESY' . . . 34007 1 14 '3D HBHA(CO)NH' . . . 34007 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 $software_1 . . 34007 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY HA2 H 1 3.991 0.020 . 2 . . . . A 81 GLY HA2 . 34007 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.991 0.020 . 2 . . . . A 81 GLY HA3 . 34007 1 3 . 1 . 1 1 1 GLY CA C 13 43.326 0.300 . 1 . . . . A 81 GLY CA . 34007 1 4 . 1 . 1 2 2 PRO HA H 1 4.448 0.020 . 1 . . . . A 82 PRO HA . 34007 1 5 . 1 . 1 2 2 PRO HB2 H 1 1.840 0.020 . 1 . . . . A 82 PRO HB2 . 34007 1 6 . 1 . 1 2 2 PRO HB3 H 1 2.266 0.020 . 1 . . . . A 82 PRO HB3 . 34007 1 7 . 1 . 1 2 2 PRO HG2 H 1 1.932 0.020 . 1 . . . . A 82 PRO HG2 . 34007 1 8 . 1 . 1 2 2 PRO HG3 H 1 2.004 0.020 . 1 . . . . A 82 PRO HG3 . 34007 1 9 . 1 . 1 2 2 PRO HD2 H 1 3.567 0.020 . 2 . . . . A 82 PRO HD2 . 34007 1 10 . 1 . 1 2 2 PRO HD3 H 1 3.567 0.020 . 2 . . . . A 82 PRO HD3 . 34007 1 11 . 1 . 1 2 2 PRO C C 13 176.666 0.300 . 1 . . . . A 82 PRO C . 34007 1 12 . 1 . 1 2 2 PRO CA C 13 63.050 0.300 . 1 . . . . A 82 PRO CA . 34007 1 13 . 1 . 1 2 2 PRO CB C 13 32.315 0.300 . 1 . . . . A 82 PRO CB . 34007 1 14 . 1 . 1 2 2 PRO CG C 13 27.025 0.300 . 1 . . . . A 82 PRO CG . 34007 1 15 . 1 . 1 2 2 PRO CD C 13 49.622 0.300 . 1 . . . . A 82 PRO CD . 34007 1 16 . 1 . 1 3 3 HIS H H 1 8.644 0.020 . 1 . . . . A 83 HIS H . 34007 1 17 . 1 . 1 3 3 HIS HA H 1 4.646 0.020 . 1 . . . . A 83 HIS HA . 34007 1 18 . 1 . 1 3 3 HIS HB2 H 1 3.153 0.020 . 2 . . . . A 83 HIS HB2 . 34007 1 19 . 1 . 1 3 3 HIS HB3 H 1 3.153 0.020 . 2 . . . . A 83 HIS HB3 . 34007 1 20 . 1 . 1 3 3 HIS HD2 H 1 7.169 0.020 . 1 . . . . A 83 HIS HD2 . 34007 1 21 . 1 . 1 3 3 HIS HE1 H 1 8.225 0.020 . 1 . . . . A 83 HIS HE1 . 34007 1 22 . 1 . 1 3 3 HIS C C 13 175.066 0.300 . 1 . . . . A 83 HIS C . 34007 1 23 . 1 . 1 3 3 HIS CA C 13 55.978 0.300 . 1 . . . . A 83 HIS CA . 34007 1 24 . 1 . 1 3 3 HIS CB C 13 29.832 0.300 . 1 . . . . A 83 HIS CB . 34007 1 25 . 1 . 1 3 3 HIS CD2 C 13 120.082 0.300 . 1 . . . . A 83 HIS CD2 . 34007 1 26 . 1 . 1 3 3 HIS CE1 C 13 137.585 0.300 . 1 . . . . A 83 HIS CE1 . 34007 1 27 . 1 . 1 3 3 HIS N N 15 119.738 0.300 . 1 . . . . A 83 HIS N . 34007 1 28 . 1 . 1 3 3 HIS ND1 N 15 200.009 0.300 . 1 . . . . A 83 HIS ND1 . 34007 1 29 . 1 . 1 3 3 HIS NE2 N 15 177.011 0.300 . 1 . . . . A 83 HIS NE2 . 34007 1 30 . 1 . 1 4 4 MET H H 1 8.453 0.020 . 1 . . . . A 84 MET H . 34007 1 31 . 1 . 1 4 4 MET HA H 1 4.492 0.020 . 1 . . . . A 84 MET HA . 34007 1 32 . 1 . 1 4 4 MET HB2 H 1 1.989 0.020 . 1 . . . . A 84 MET HB2 . 34007 1 33 . 1 . 1 4 4 MET HB3 H 1 2.077 0.020 . 1 . . . . A 84 MET HB3 . 34007 1 34 . 1 . 1 4 4 MET HG2 H 1 2.499 0.020 . 1 . . . . A 84 MET HG2 . 34007 1 35 . 1 . 1 4 4 MET HG3 H 1 2.577 0.020 . 1 . . . . A 84 MET HG3 . 34007 1 36 . 1 . 1 4 4 MET HE1 H 1 2.087 0.020 . 1 . . . . A 84 MET HE1 . 34007 1 37 . 1 . 1 4 4 MET HE2 H 1 2.087 0.020 . 1 . . . . A 84 MET HE2 . 34007 1 38 . 1 . 1 4 4 MET HE3 H 1 2.087 0.020 . 1 . . . . A 84 MET HE3 . 34007 1 39 . 1 . 1 4 4 MET C C 13 175.670 0.300 . 1 . . . . A 84 MET C . 34007 1 40 . 1 . 1 4 4 MET CA C 13 55.483 0.300 . 1 . . . . A 84 MET CA . 34007 1 41 . 1 . 1 4 4 MET CB C 13 32.916 0.300 . 1 . . . . A 84 MET CB . 34007 1 42 . 1 . 1 4 4 MET CG C 13 31.984 0.300 . 1 . . . . A 84 MET CG . 34007 1 43 . 1 . 1 4 4 MET CE C 13 16.986 0.300 . 1 . . . . A 84 MET CE . 34007 1 44 . 1 . 1 4 4 MET N N 15 122.101 0.300 . 1 . . . . A 84 MET N . 34007 1 45 . 1 . 1 5 5 ASP H H 1 8.572 0.020 . 1 . . . . A 85 ASP H . 34007 1 46 . 1 . 1 5 5 ASP HA H 1 4.611 0.020 . 1 . . . . A 85 ASP HA . 34007 1 47 . 1 . 1 5 5 ASP HB2 H 1 2.662 0.020 . 1 . . . . A 85 ASP HB2 . 34007 1 48 . 1 . 1 5 5 ASP HB3 H 1 2.720 0.020 . 1 . . . . A 85 ASP HB3 . 34007 1 49 . 1 . 1 5 5 ASP C C 13 175.599 0.300 . 1 . . . . A 85 ASP C . 34007 1 50 . 1 . 1 5 5 ASP CA C 13 54.725 0.300 . 1 . . . . A 85 ASP CA . 34007 1 51 . 1 . 1 5 5 ASP CB C 13 41.093 0.300 . 1 . . . . A 85 ASP CB . 34007 1 52 . 1 . 1 5 5 ASP N N 15 121.392 0.300 . 1 . . . . A 85 ASP N . 34007 1 53 . 1 . 1 6 6 ARG H H 1 7.993 0.020 . 1 . . . . A 86 ARG H . 34007 1 54 . 1 . 1 6 6 ARG HA H 1 4.491 0.020 . 1 . . . . A 86 ARG HA . 34007 1 55 . 1 . 1 6 6 ARG HB2 H 1 1.750 0.020 . 1 . . . . A 86 ARG HB2 . 34007 1 56 . 1 . 1 6 6 ARG HB3 H 1 1.818 0.020 . 1 . . . . A 86 ARG HB3 . 34007 1 57 . 1 . 1 6 6 ARG HG2 H 1 1.559 0.020 . 1 . . . . A 86 ARG HG2 . 34007 1 58 . 1 . 1 6 6 ARG HG3 H 1 1.609 0.020 . 1 . . . . A 86 ARG HG3 . 34007 1 59 . 1 . 1 6 6 ARG HD2 H 1 3.180 0.020 . 2 . . . . A 86 ARG HD2 . 34007 1 60 . 1 . 1 6 6 ARG HD3 H 1 3.180 0.020 . 2 . . . . A 86 ARG HD3 . 34007 1 61 . 1 . 1 6 6 ARG C C 13 176.159 0.300 . 1 . . . . A 86 ARG C . 34007 1 62 . 1 . 1 6 6 ARG CA C 13 55.626 0.300 . 1 . . . . A 86 ARG CA . 34007 1 63 . 1 . 1 6 6 ARG CB C 13 31.430 0.300 . 1 . . . . A 86 ARG CB . 34007 1 64 . 1 . 1 6 6 ARG CG C 13 26.815 0.300 . 1 . . . . A 86 ARG CG . 34007 1 65 . 1 . 1 6 6 ARG CD C 13 43.220 0.300 . 1 . . . . A 86 ARG CD . 34007 1 66 . 1 . 1 6 6 ARG N N 15 120.026 0.300 . 1 . . . . A 86 ARG N . 34007 1 67 . 1 . 1 7 7 VAL H H 1 8.799 0.020 . 1 . . . . A 87 VAL H . 34007 1 68 . 1 . 1 7 7 VAL HA H 1 4.146 0.020 . 1 . . . . A 87 VAL HA . 34007 1 69 . 1 . 1 7 7 VAL HB H 1 1.865 0.020 . 1 . . . . A 87 VAL HB . 34007 1 70 . 1 . 1 7 7 VAL HG11 H 1 0.945 0.020 . 2 . . . . A 87 VAL HG11 . 34007 1 71 . 1 . 1 7 7 VAL HG12 H 1 0.945 0.020 . 2 . . . . A 87 VAL HG12 . 34007 1 72 . 1 . 1 7 7 VAL HG13 H 1 0.945 0.020 . 2 . . . . A 87 VAL HG13 . 34007 1 73 . 1 . 1 7 7 VAL HG21 H 1 1.021 0.020 . 2 . . . . A 87 VAL HG21 . 34007 1 74 . 1 . 1 7 7 VAL HG22 H 1 1.021 0.020 . 2 . . . . A 87 VAL HG22 . 34007 1 75 . 1 . 1 7 7 VAL HG23 H 1 1.021 0.020 . 2 . . . . A 87 VAL HG23 . 34007 1 76 . 1 . 1 7 7 VAL C C 13 175.937 0.300 . 1 . . . . A 87 VAL C . 34007 1 77 . 1 . 1 7 7 VAL CA C 13 61.889 0.300 . 1 . . . . A 87 VAL CA . 34007 1 78 . 1 . 1 7 7 VAL CB C 13 32.505 0.300 . 1 . . . . A 87 VAL CB . 34007 1 79 . 1 . 1 7 7 VAL CG1 C 13 21.943 0.300 . 1 . . . . A 87 VAL CG1 . 34007 1 80 . 1 . 1 7 7 VAL CG2 C 13 22.061 0.300 . 1 . . . . A 87 VAL CG2 . 34007 1 81 . 1 . 1 7 7 VAL N N 15 124.623 0.300 . 1 . . . . A 87 VAL N . 34007 1 82 . 1 . 1 8 8 SER H H 1 8.945 0.020 . 1 . . . . A 88 SER H . 34007 1 83 . 1 . 1 8 8 SER HA H 1 4.376 0.020 . 1 . . . . A 88 SER HA . 34007 1 84 . 1 . 1 8 8 SER HB2 H 1 4.009 0.020 . 1 . . . . A 88 SER HB2 . 34007 1 85 . 1 . 1 8 8 SER HB3 H 1 4.214 0.020 . 1 . . . . A 88 SER HB3 . 34007 1 86 . 1 . 1 8 8 SER C C 13 175.093 0.300 . 1 . . . . A 88 SER C . 34007 1 87 . 1 . 1 8 8 SER CA C 13 57.999 0.300 . 1 . . . . A 88 SER CA . 34007 1 88 . 1 . 1 8 8 SER CB C 13 64.392 0.300 . 1 . . . . A 88 SER CB . 34007 1 89 . 1 . 1 8 8 SER N N 15 122.645 0.300 . 1 . . . . A 88 SER N . 34007 1 90 . 1 . 1 9 9 LEU H H 1 8.733 0.020 . 1 . . . . A 89 LEU H . 34007 1 91 . 1 . 1 9 9 LEU HA H 1 4.042 0.020 . 1 . . . . A 89 LEU HA . 34007 1 92 . 1 . 1 9 9 LEU HB2 H 1 1.662 0.020 . 1 . . . . A 89 LEU HB2 . 34007 1 93 . 1 . 1 9 9 LEU HB3 H 1 1.722 0.020 . 1 . . . . A 89 LEU HB3 . 34007 1 94 . 1 . 1 9 9 LEU HG H 1 1.715 0.020 . 1 . . . . A 89 LEU HG . 34007 1 95 . 1 . 1 9 9 LEU HD11 H 1 1.035 0.020 . 2 . . . . A 89 LEU HD11 . 34007 1 96 . 1 . 1 9 9 LEU HD12 H 1 1.035 0.020 . 2 . . . . A 89 LEU HD12 . 34007 1 97 . 1 . 1 9 9 LEU HD13 H 1 1.035 0.020 . 2 . . . . A 89 LEU HD13 . 34007 1 98 . 1 . 1 9 9 LEU HD21 H 1 0.978 0.020 . 2 . . . . A 89 LEU HD21 . 34007 1 99 . 1 . 1 9 9 LEU HD22 H 1 0.978 0.020 . 2 . . . . A 89 LEU HD22 . 34007 1 100 . 1 . 1 9 9 LEU HD23 H 1 0.978 0.020 . 2 . . . . A 89 LEU HD23 . 34007 1 101 . 1 . 1 9 9 LEU C C 13 178.674 0.300 . 1 . . . . A 89 LEU C . 34007 1 102 . 1 . 1 9 9 LEU CA C 13 57.666 0.300 . 1 . . . . A 89 LEU CA . 34007 1 103 . 1 . 1 9 9 LEU CB C 13 41.479 0.300 . 1 . . . . A 89 LEU CB . 34007 1 104 . 1 . 1 9 9 LEU CG C 13 27.268 0.300 . 1 . . . . A 89 LEU CG . 34007 1 105 . 1 . 1 9 9 LEU CD1 C 13 24.385 0.300 . 1 . . . . A 89 LEU CD1 . 34007 1 106 . 1 . 1 9 9 LEU CD2 C 13 24.349 0.300 . 1 . . . . A 89 LEU CD2 . 34007 1 107 . 1 . 1 9 9 LEU N N 15 124.338 0.300 . 1 . . . . A 89 LEU N . 34007 1 108 . 1 . 1 10 10 GLN H H 1 8.393 0.020 . 1 . . . . A 90 GLN H . 34007 1 109 . 1 . 1 10 10 GLN HA H 1 3.932 0.020 . 1 . . . . A 90 GLN HA . 34007 1 110 . 1 . 1 10 10 GLN HB2 H 1 1.957 0.020 . 1 . . . . A 90 GLN HB2 . 34007 1 111 . 1 . 1 10 10 GLN HB3 H 1 2.066 0.020 . 1 . . . . A 90 GLN HB3 . 34007 1 112 . 1 . 1 10 10 GLN HG2 H 1 2.347 0.020 . 1 . . . . A 90 GLN HG2 . 34007 1 113 . 1 . 1 10 10 GLN HG3 H 1 2.401 0.020 . 1 . . . . A 90 GLN HG3 . 34007 1 114 . 1 . 1 10 10 GLN HE21 H 1 6.957 0.020 . 1 . . . . A 90 GLN HE21 . 34007 1 115 . 1 . 1 10 10 GLN HE22 H 1 7.550 0.020 . 1 . . . . A 90 GLN HE22 . 34007 1 116 . 1 . 1 10 10 GLN C C 13 177.083 0.300 . 1 . . . . A 90 GLN C . 34007 1 117 . 1 . 1 10 10 GLN CA C 13 58.650 0.300 . 1 . . . . A 90 GLN CA . 34007 1 118 . 1 . 1 10 10 GLN CB C 13 28.348 0.300 . 1 . . . . A 90 GLN CB . 34007 1 119 . 1 . 1 10 10 GLN CG C 13 33.873 0.300 . 1 . . . . A 90 GLN CG . 34007 1 120 . 1 . 1 10 10 GLN CD C 13 180.414 0.300 . 1 . . . . A 90 GLN CD . 34007 1 121 . 1 . 1 10 10 GLN N N 15 117.126 0.300 . 1 . . . . A 90 GLN N . 34007 1 122 . 1 . 1 10 10 GLN NE2 N 15 113.052 0.300 . 1 . . . . A 90 GLN NE2 . 34007 1 123 . 1 . 1 11 11 ASN H H 1 7.611 0.020 . 1 . . . . A 91 ASN H . 34007 1 124 . 1 . 1 11 11 ASN HA H 1 4.617 0.020 . 1 . . . . A 91 ASN HA . 34007 1 125 . 1 . 1 11 11 ASN HB2 H 1 2.653 0.020 . 1 . . . . A 91 ASN HB2 . 34007 1 126 . 1 . 1 11 11 ASN HB3 H 1 2.843 0.020 . 1 . . . . A 91 ASN HB3 . 34007 1 127 . 1 . 1 11 11 ASN HD21 H 1 7.086 0.020 . 1 . . . . A 91 ASN HD21 . 34007 1 128 . 1 . 1 11 11 ASN HD22 H 1 7.676 0.020 . 1 . . . . A 91 ASN HD22 . 34007 1 129 . 1 . 1 11 11 ASN C C 13 177.252 0.300 . 1 . . . . A 91 ASN C . 34007 1 130 . 1 . 1 11 11 ASN CA C 13 55.337 0.300 . 1 . . . . A 91 ASN CA . 34007 1 131 . 1 . 1 11 11 ASN CB C 13 38.448 0.300 . 1 . . . . A 91 ASN CB . 34007 1 132 . 1 . 1 11 11 ASN CG C 13 176.115 0.300 . 1 . . . . A 91 ASN CG . 34007 1 133 . 1 . 1 11 11 ASN N N 15 116.765 0.300 . 1 . . . . A 91 ASN N . 34007 1 134 . 1 . 1 11 11 ASN ND2 N 15 112.747 0.300 . 1 . . . . A 91 ASN ND2 . 34007 1 135 . 1 . 1 12 12 LEU H H 1 7.904 0.020 . 1 . . . . A 92 LEU H . 34007 1 136 . 1 . 1 12 12 LEU HA H 1 3.628 0.020 . 1 . . . . A 92 LEU HA . 34007 1 137 . 1 . 1 12 12 LEU HB2 H 1 0.059 0.020 . 1 . . . . A 92 LEU HB2 . 34007 1 138 . 1 . 1 12 12 LEU HB3 H 1 1.327 0.020 . 1 . . . . A 92 LEU HB3 . 34007 1 139 . 1 . 1 12 12 LEU HG H 1 1.467 0.020 . 1 . . . . A 92 LEU HG . 34007 1 140 . 1 . 1 12 12 LEU HD11 H 1 0.589 0.020 . 2 . . . . A 92 LEU HD11 . 34007 1 141 . 1 . 1 12 12 LEU HD12 H 1 0.589 0.020 . 2 . . . . A 92 LEU HD12 . 34007 1 142 . 1 . 1 12 12 LEU HD13 H 1 0.589 0.020 . 2 . . . . A 92 LEU HD13 . 34007 1 143 . 1 . 1 12 12 LEU HD21 H 1 0.702 0.020 . 2 . . . . A 92 LEU HD21 . 34007 1 144 . 1 . 1 12 12 LEU HD22 H 1 0.702 0.020 . 2 . . . . A 92 LEU HD22 . 34007 1 145 . 1 . 1 12 12 LEU HD23 H 1 0.702 0.020 . 2 . . . . A 92 LEU HD23 . 34007 1 146 . 1 . 1 12 12 LEU C C 13 178.790 0.300 . 1 . . . . A 92 LEU C . 34007 1 147 . 1 . 1 12 12 LEU CA C 13 57.664 0.300 . 1 . . . . A 92 LEU CA . 34007 1 148 . 1 . 1 12 12 LEU CB C 13 40.023 0.300 . 1 . . . . A 92 LEU CB . 34007 1 149 . 1 . 1 12 12 LEU CG C 13 26.221 0.300 . 1 . . . . A 92 LEU CG . 34007 1 150 . 1 . 1 12 12 LEU CD1 C 13 23.700 0.300 . 1 . . . . A 92 LEU CD1 . 34007 1 151 . 1 . 1 12 12 LEU CD2 C 13 25.925 0.300 . 1 . . . . A 92 LEU CD2 . 34007 1 152 . 1 . 1 12 12 LEU N N 15 120.387 0.300 . 1 . . . . A 92 LEU N . 34007 1 153 . 1 . 1 13 13 LYS H H 1 7.967 0.020 . 1 . . . . A 93 LYS H . 34007 1 154 . 1 . 1 13 13 LYS HA H 1 4.111 0.020 . 1 . . . . A 93 LYS HA . 34007 1 155 . 1 . 1 13 13 LYS HB2 H 1 1.871 0.020 . 2 . . . . A 93 LYS HB2 . 34007 1 156 . 1 . 1 13 13 LYS HB3 H 1 1.871 0.020 . 2 . . . . A 93 LYS HB3 . 34007 1 157 . 1 . 1 13 13 LYS HG2 H 1 1.459 0.020 . 2 . . . . A 93 LYS HG2 . 34007 1 158 . 1 . 1 13 13 LYS HG3 H 1 1.459 0.020 . 2 . . . . A 93 LYS HG3 . 34007 1 159 . 1 . 1 13 13 LYS HD2 H 1 1.655 0.020 . 2 . . . . A 93 LYS HD2 . 34007 1 160 . 1 . 1 13 13 LYS HD3 H 1 1.655 0.020 . 2 . . . . A 93 LYS HD3 . 34007 1 161 . 1 . 1 13 13 LYS HE2 H 1 2.985 0.020 . 2 . . . . A 93 LYS HE2 . 34007 1 162 . 1 . 1 13 13 LYS HE3 H 1 2.985 0.020 . 2 . . . . A 93 LYS HE3 . 34007 1 163 . 1 . 1 13 13 LYS C C 13 179.607 0.300 . 1 . . . . A 93 LYS C . 34007 1 164 . 1 . 1 13 13 LYS CA C 13 58.901 0.300 . 1 . . . . A 93 LYS CA . 34007 1 165 . 1 . 1 13 13 LYS CB C 13 31.701 0.300 . 1 . . . . A 93 LYS CB . 34007 1 166 . 1 . 1 13 13 LYS CG C 13 24.918 0.300 . 1 . . . . A 93 LYS CG . 34007 1 167 . 1 . 1 13 13 LYS CD C 13 29.719 0.300 . 1 . . . . A 93 LYS CD . 34007 1 168 . 1 . 1 13 13 LYS CE C 13 42.018 0.300 . 1 . . . . A 93 LYS CE . 34007 1 169 . 1 . 1 13 13 LYS N N 15 115.877 0.300 . 1 . . . . A 93 LYS N . 34007 1 170 . 1 . 1 14 14 ASN H H 1 7.474 0.020 . 1 . . . . A 94 ASN H . 34007 1 171 . 1 . 1 14 14 ASN HA H 1 4.402 0.020 . 1 . . . . A 94 ASN HA . 34007 1 172 . 1 . 1 14 14 ASN HB2 H 1 2.733 0.020 . 1 . . . . A 94 ASN HB2 . 34007 1 173 . 1 . 1 14 14 ASN HB3 H 1 2.878 0.020 . 1 . . . . A 94 ASN HB3 . 34007 1 174 . 1 . 1 14 14 ASN HD21 H 1 6.977 0.020 . 1 . . . . A 94 ASN HD21 . 34007 1 175 . 1 . 1 14 14 ASN HD22 H 1 7.802 0.020 . 1 . . . . A 94 ASN HD22 . 34007 1 176 . 1 . 1 14 14 ASN C C 13 178.550 0.300 . 1 . . . . A 94 ASN C . 34007 1 177 . 1 . 1 14 14 ASN CA C 13 55.113 0.300 . 1 . . . . A 94 ASN CA . 34007 1 178 . 1 . 1 14 14 ASN CB C 13 37.760 0.300 . 1 . . . . A 94 ASN CB . 34007 1 179 . 1 . 1 14 14 ASN CG C 13 175.479 0.300 . 1 . . . . A 94 ASN CG . 34007 1 180 . 1 . 1 14 14 ASN N N 15 116.913 0.300 . 1 . . . . A 94 ASN N . 34007 1 181 . 1 . 1 14 14 ASN ND2 N 15 112.593 0.300 . 1 . . . . A 94 ASN ND2 . 34007 1 182 . 1 . 1 15 15 LEU H H 1 8.300 0.020 . 1 . . . . A 95 LEU H . 34007 1 183 . 1 . 1 15 15 LEU HA H 1 4.041 0.020 . 1 . . . . A 95 LEU HA . 34007 1 184 . 1 . 1 15 15 LEU HB2 H 1 1.505 0.020 . 1 . . . . A 95 LEU HB2 . 34007 1 185 . 1 . 1 15 15 LEU HB3 H 1 2.320 0.020 . 1 . . . . A 95 LEU HB3 . 34007 1 186 . 1 . 1 15 15 LEU HG H 1 1.919 0.020 . 1 . . . . A 95 LEU HG . 34007 1 187 . 1 . 1 15 15 LEU HD11 H 1 1.012 0.020 . 2 . . . . A 95 LEU HD11 . 34007 1 188 . 1 . 1 15 15 LEU HD12 H 1 1.012 0.020 . 2 . . . . A 95 LEU HD12 . 34007 1 189 . 1 . 1 15 15 LEU HD13 H 1 1.012 0.020 . 2 . . . . A 95 LEU HD13 . 34007 1 190 . 1 . 1 15 15 LEU HD21 H 1 1.197 0.020 . 2 . . . . A 95 LEU HD21 . 34007 1 191 . 1 . 1 15 15 LEU HD22 H 1 1.197 0.020 . 2 . . . . A 95 LEU HD22 . 34007 1 192 . 1 . 1 15 15 LEU HD23 H 1 1.197 0.020 . 2 . . . . A 95 LEU HD23 . 34007 1 193 . 1 . 1 15 15 LEU C C 13 177.572 0.300 . 1 . . . . A 95 LEU C . 34007 1 194 . 1 . 1 15 15 LEU CA C 13 58.813 0.300 . 1 . . . . A 95 LEU CA . 34007 1 195 . 1 . 1 15 15 LEU CB C 13 41.911 0.300 . 1 . . . . A 95 LEU CB . 34007 1 196 . 1 . 1 15 15 LEU CG C 13 27.028 0.300 . 1 . . . . A 95 LEU CG . 34007 1 197 . 1 . 1 15 15 LEU CD1 C 13 23.490 0.300 . 1 . . . . A 95 LEU CD1 . 34007 1 198 . 1 . 1 15 15 LEU CD2 C 13 26.744 0.300 . 1 . . . . A 95 LEU CD2 . 34007 1 199 . 1 . 1 15 15 LEU N N 15 122.274 0.300 . 1 . . . . A 95 LEU N . 34007 1 200 . 1 . 1 16 16 GLY H H 1 7.169 0.020 . 1 . . . . A 96 GLY H . 34007 1 201 . 1 . 1 16 16 GLY HA2 H 1 2.420 0.020 . 1 . . . . A 96 GLY HA2 . 34007 1 202 . 1 . 1 16 16 GLY HA3 H 1 3.047 0.020 . 1 . . . . A 96 GLY HA3 . 34007 1 203 . 1 . 1 16 16 GLY C C 13 174.266 0.300 . 1 . . . . A 96 GLY C . 34007 1 204 . 1 . 1 16 16 GLY CA C 13 44.831 0.300 . 1 . . . . A 96 GLY CA . 34007 1 205 . 1 . 1 16 16 GLY N N 15 100.603 0.300 . 1 . . . . A 96 GLY N . 34007 1 206 . 1 . 1 17 17 GLU H H 1 6.841 0.020 . 1 . . . . A 97 GLU H . 34007 1 207 . 1 . 1 17 17 GLU HA H 1 4.331 0.020 . 1 . . . . A 97 GLU HA . 34007 1 208 . 1 . 1 17 17 GLU HB2 H 1 1.764 0.020 . 1 . . . . A 97 GLU HB2 . 34007 1 209 . 1 . 1 17 17 GLU HB3 H 1 2.310 0.020 . 1 . . . . A 97 GLU HB3 . 34007 1 210 . 1 . 1 17 17 GLU HG2 H 1 2.131 0.020 . 1 . . . . A 97 GLU HG2 . 34007 1 211 . 1 . 1 17 17 GLU HG3 H 1 2.314 0.020 . 1 . . . . A 97 GLU HG3 . 34007 1 212 . 1 . 1 17 17 GLU C C 13 175.839 0.300 . 1 . . . . A 97 GLU C . 34007 1 213 . 1 . 1 17 17 GLU CA C 13 54.889 0.300 . 1 . . . . A 97 GLU CA . 34007 1 214 . 1 . 1 17 17 GLU CB C 13 30.064 0.300 . 1 . . . . A 97 GLU CB . 34007 1 215 . 1 . 1 17 17 GLU CG C 13 35.671 0.300 . 1 . . . . A 97 GLU CG . 34007 1 216 . 1 . 1 17 17 GLU N N 15 116.393 0.300 . 1 . . . . A 97 GLU N . 34007 1 217 . 1 . 1 18 18 SER H H 1 6.728 0.020 . 1 . . . . A 98 SER H . 34007 1 218 . 1 . 1 18 18 SER HA H 1 4.551 0.020 . 1 . . . . A 98 SER HA . 34007 1 219 . 1 . 1 18 18 SER HB2 H 1 3.895 0.020 . 2 . . . . A 98 SER HB2 . 34007 1 220 . 1 . 1 18 18 SER HB3 H 1 3.895 0.020 . 2 . . . . A 98 SER HB3 . 34007 1 221 . 1 . 1 18 18 SER C C 13 175.439 0.300 . 1 . . . . A 98 SER C . 34007 1 222 . 1 . 1 18 18 SER CA C 13 56.456 0.300 . 1 . . . . A 98 SER CA . 34007 1 223 . 1 . 1 18 18 SER CB C 13 62.678 0.300 . 1 . . . . A 98 SER CB . 34007 1 224 . 1 . 1 18 18 SER N N 15 112.266 0.300 . 1 . . . . A 98 SER N . 34007 1 225 . 1 . 1 19 19 ALA H H 1 9.238 0.020 . 1 . . . . A 99 ALA H . 34007 1 226 . 1 . 1 19 19 ALA HA H 1 4.085 0.020 . 1 . . . . A 99 ALA HA . 34007 1 227 . 1 . 1 19 19 ALA HB1 H 1 1.511 0.020 . 1 . . . . A 99 ALA HB1 . 34007 1 228 . 1 . 1 19 19 ALA HB2 H 1 1.511 0.020 . 1 . . . . A 99 ALA HB2 . 34007 1 229 . 1 . 1 19 19 ALA HB3 H 1 1.511 0.020 . 1 . . . . A 99 ALA HB3 . 34007 1 230 . 1 . 1 19 19 ALA C C 13 180.683 0.300 . 1 . . . . A 99 ALA C . 34007 1 231 . 1 . 1 19 19 ALA CA C 13 55.205 0.300 . 1 . . . . A 99 ALA CA . 34007 1 232 . 1 . 1 19 19 ALA CB C 13 18.124 0.300 . 1 . . . . A 99 ALA CB . 34007 1 233 . 1 . 1 19 19 ALA N N 15 135.621 0.300 . 1 . . . . A 99 ALA N . 34007 1 234 . 1 . 1 20 20 THR H H 1 8.121 0.020 . 1 . . . . A 100 THR H . 34007 1 235 . 1 . 1 20 20 THR HA H 1 3.937 0.020 . 1 . . . . A 100 THR HA . 34007 1 236 . 1 . 1 20 20 THR HB H 1 3.815 0.020 . 1 . . . . A 100 THR HB . 34007 1 237 . 1 . 1 20 20 THR HG21 H 1 1.269 0.020 . 1 . . . . A 100 THR HG21 . 34007 1 238 . 1 . 1 20 20 THR HG22 H 1 1.269 0.020 . 1 . . . . A 100 THR HG22 . 34007 1 239 . 1 . 1 20 20 THR HG23 H 1 1.269 0.020 . 1 . . . . A 100 THR HG23 . 34007 1 240 . 1 . 1 20 20 THR C C 13 176.577 0.300 . 1 . . . . A 100 THR C . 34007 1 241 . 1 . 1 20 20 THR CA C 13 66.125 0.300 . 1 . . . . A 100 THR CA . 34007 1 242 . 1 . 1 20 20 THR CB C 13 68.767 0.300 . 1 . . . . A 100 THR CB . 34007 1 243 . 1 . 1 20 20 THR CG2 C 13 22.194 0.300 . 1 . . . . A 100 THR CG2 . 34007 1 244 . 1 . 1 20 20 THR N N 15 115.747 0.300 . 1 . . . . A 100 THR N . 34007 1 245 . 1 . 1 21 21 LEU H H 1 8.185 0.020 . 1 . . . . A 101 LEU H . 34007 1 246 . 1 . 1 21 21 LEU HA H 1 4.140 0.020 . 1 . . . . A 101 LEU HA . 34007 1 247 . 1 . 1 21 21 LEU HB2 H 1 1.715 0.020 . 1 . . . . A 101 LEU HB2 . 34007 1 248 . 1 . 1 21 21 LEU HB3 H 1 2.035 0.020 . 1 . . . . A 101 LEU HB3 . 34007 1 249 . 1 . 1 21 21 LEU HG H 1 1.842 0.020 . 1 . . . . A 101 LEU HG . 34007 1 250 . 1 . 1 21 21 LEU HD11 H 1 1.191 0.020 . 2 . . . . A 101 LEU HD11 . 34007 1 251 . 1 . 1 21 21 LEU HD12 H 1 1.191 0.020 . 2 . . . . A 101 LEU HD12 . 34007 1 252 . 1 . 1 21 21 LEU HD13 H 1 1.191 0.020 . 2 . . . . A 101 LEU HD13 . 34007 1 253 . 1 . 1 21 21 LEU HD21 H 1 1.258 0.020 . 2 . . . . A 101 LEU HD21 . 34007 1 254 . 1 . 1 21 21 LEU HD22 H 1 1.258 0.020 . 2 . . . . A 101 LEU HD22 . 34007 1 255 . 1 . 1 21 21 LEU HD23 H 1 1.258 0.020 . 2 . . . . A 101 LEU HD23 . 34007 1 256 . 1 . 1 21 21 LEU C C 13 178.772 0.300 . 1 . . . . A 101 LEU C . 34007 1 257 . 1 . 1 21 21 LEU CA C 13 57.869 0.300 . 1 . . . . A 101 LEU CA . 34007 1 258 . 1 . 1 21 21 LEU CB C 13 40.720 0.300 . 1 . . . . A 101 LEU CB . 34007 1 259 . 1 . 1 21 21 LEU CG C 13 27.797 0.300 . 1 . . . . A 101 LEU CG . 34007 1 260 . 1 . 1 21 21 LEU CD1 C 13 24.463 0.300 . 1 . . . . A 101 LEU CD1 . 34007 1 261 . 1 . 1 21 21 LEU CD2 C 13 27.403 0.300 . 1 . . . . A 101 LEU CD2 . 34007 1 262 . 1 . 1 21 21 LEU N N 15 123.736 0.300 . 1 . . . . A 101 LEU N . 34007 1 263 . 1 . 1 22 22 ARG H H 1 8.004 0.020 . 1 . . . . A 102 ARG H . 34007 1 264 . 1 . 1 22 22 ARG HA H 1 3.817 0.020 . 1 . . . . A 102 ARG HA . 34007 1 265 . 1 . 1 22 22 ARG HB2 H 1 1.962 0.020 . 2 . . . . A 102 ARG HB2 . 34007 1 266 . 1 . 1 22 22 ARG HB3 H 1 1.962 0.020 . 2 . . . . A 102 ARG HB3 . 34007 1 267 . 1 . 1 22 22 ARG HG2 H 1 1.481 0.020 . 1 . . . . A 102 ARG HG2 . 34007 1 268 . 1 . 1 22 22 ARG HG3 H 1 1.914 0.020 . 1 . . . . A 102 ARG HG3 . 34007 1 269 . 1 . 1 22 22 ARG HD2 H 1 3.160 0.020 . 1 . . . . A 102 ARG HD2 . 34007 1 270 . 1 . 1 22 22 ARG HD3 H 1 3.264 0.020 . 1 . . . . A 102 ARG HD3 . 34007 1 271 . 1 . 1 22 22 ARG HE H 1 7.379 0.020 . 1 . . . . A 102 ARG HE . 34007 1 272 . 1 . 1 22 22 ARG C C 13 177.856 0.300 . 1 . . . . A 102 ARG C . 34007 1 273 . 1 . 1 22 22 ARG CA C 13 60.461 0.300 . 1 . . . . A 102 ARG CA . 34007 1 274 . 1 . 1 22 22 ARG CB C 13 30.021 0.300 . 1 . . . . A 102 ARG CB . 34007 1 275 . 1 . 1 22 22 ARG CG C 13 28.643 0.300 . 1 . . . . A 102 ARG CG . 34007 1 276 . 1 . 1 22 22 ARG CD C 13 43.260 0.300 . 1 . . . . A 102 ARG CD . 34007 1 277 . 1 . 1 22 22 ARG N N 15 116.901 0.300 . 1 . . . . A 102 ARG N . 34007 1 278 . 1 . 1 22 22 ARG NE N 15 83.793 0.300 . 1 . . . . A 102 ARG NE . 34007 1 279 . 1 . 1 23 23 SER H H 1 7.595 0.020 . 1 . . . . A 103 SER H . 34007 1 280 . 1 . 1 23 23 SER HA H 1 4.288 0.020 . 1 . . . . A 103 SER HA . 34007 1 281 . 1 . 1 23 23 SER HB2 H 1 4.060 0.020 . 2 . . . . A 103 SER HB2 . 34007 1 282 . 1 . 1 23 23 SER HB3 H 1 4.060 0.020 . 2 . . . . A 103 SER HB3 . 34007 1 283 . 1 . 1 23 23 SER C C 13 177.794 0.300 . 1 . . . . A 103 SER C . 34007 1 284 . 1 . 1 23 23 SER CA C 13 61.772 0.300 . 1 . . . . A 103 SER CA . 34007 1 285 . 1 . 1 23 23 SER CB C 13 63.106 0.300 . 1 . . . . A 103 SER CB . 34007 1 286 . 1 . 1 23 23 SER N N 15 111.238 0.300 . 1 . . . . A 103 SER N . 34007 1 287 . 1 . 1 24 24 LEU H H 1 7.886 0.020 . 1 . . . . A 104 LEU H . 34007 1 288 . 1 . 1 24 24 LEU HA H 1 4.237 0.020 . 1 . . . . A 104 LEU HA . 34007 1 289 . 1 . 1 24 24 LEU HB2 H 1 1.539 0.020 . 1 . . . . A 104 LEU HB2 . 34007 1 290 . 1 . 1 24 24 LEU HB3 H 1 2.200 0.020 . 1 . . . . A 104 LEU HB3 . 34007 1 291 . 1 . 1 24 24 LEU HG H 1 2.177 0.020 . 1 . . . . A 104 LEU HG . 34007 1 292 . 1 . 1 24 24 LEU HD11 H 1 0.899 0.020 . 2 . . . . A 104 LEU HD11 . 34007 1 293 . 1 . 1 24 24 LEU HD12 H 1 0.899 0.020 . 2 . . . . A 104 LEU HD12 . 34007 1 294 . 1 . 1 24 24 LEU HD13 H 1 0.899 0.020 . 2 . . . . A 104 LEU HD13 . 34007 1 295 . 1 . 1 24 24 LEU HD21 H 1 0.976 0.020 . 2 . . . . A 104 LEU HD21 . 34007 1 296 . 1 . 1 24 24 LEU HD22 H 1 0.976 0.020 . 2 . . . . A 104 LEU HD22 . 34007 1 297 . 1 . 1 24 24 LEU HD23 H 1 0.976 0.020 . 2 . . . . A 104 LEU HD23 . 34007 1 298 . 1 . 1 24 24 LEU C C 13 179.918 0.300 . 1 . . . . A 104 LEU C . 34007 1 299 . 1 . 1 24 24 LEU CA C 13 57.902 0.300 . 1 . . . . A 104 LEU CA . 34007 1 300 . 1 . 1 24 24 LEU CB C 13 40.745 0.300 . 1 . . . . A 104 LEU CB . 34007 1 301 . 1 . 1 24 24 LEU CG C 13 26.009 0.300 . 1 . . . . A 104 LEU CG . 34007 1 302 . 1 . 1 24 24 LEU CD1 C 13 21.232 0.300 . 1 . . . . A 104 LEU CD1 . 34007 1 303 . 1 . 1 24 24 LEU CD2 C 13 26.006 0.300 . 1 . . . . A 104 LEU CD2 . 34007 1 304 . 1 . 1 24 24 LEU N N 15 122.029 0.300 . 1 . . . . A 104 LEU N . 34007 1 305 . 1 . 1 25 25 LEU H H 1 7.982 0.020 . 1 . . . . A 105 LEU H . 34007 1 306 . 1 . 1 25 25 LEU HA H 1 3.985 0.020 . 1 . . . . A 105 LEU HA . 34007 1 307 . 1 . 1 25 25 LEU HB2 H 1 1.555 0.020 . 1 . . . . A 105 LEU HB2 . 34007 1 308 . 1 . 1 25 25 LEU HB3 H 1 2.176 0.020 . 1 . . . . A 105 LEU HB3 . 34007 1 309 . 1 . 1 25 25 LEU HG H 1 2.298 0.020 . 1 . . . . A 105 LEU HG . 34007 1 310 . 1 . 1 25 25 LEU HD11 H 1 0.961 0.020 . 2 . . . . A 105 LEU HD11 . 34007 1 311 . 1 . 1 25 25 LEU HD12 H 1 0.961 0.020 . 2 . . . . A 105 LEU HD12 . 34007 1 312 . 1 . 1 25 25 LEU HD13 H 1 0.961 0.020 . 2 . . . . A 105 LEU HD13 . 34007 1 313 . 1 . 1 25 25 LEU HD21 H 1 1.109 0.020 . 2 . . . . A 105 LEU HD21 . 34007 1 314 . 1 . 1 25 25 LEU HD22 H 1 1.109 0.020 . 2 . . . . A 105 LEU HD22 . 34007 1 315 . 1 . 1 25 25 LEU HD23 H 1 1.109 0.020 . 2 . . . . A 105 LEU HD23 . 34007 1 316 . 1 . 1 25 25 LEU C C 13 175.803 0.300 . 1 . . . . A 105 LEU C . 34007 1 317 . 1 . 1 25 25 LEU CA C 13 55.748 0.300 . 1 . . . . A 105 LEU CA . 34007 1 318 . 1 . 1 25 25 LEU CB C 13 41.777 0.300 . 1 . . . . A 105 LEU CB . 34007 1 319 . 1 . 1 25 25 LEU CG C 13 26.130 0.300 . 1 . . . . A 105 LEU CG . 34007 1 320 . 1 . 1 25 25 LEU CD1 C 13 22.963 0.300 . 1 . . . . A 105 LEU CD1 . 34007 1 321 . 1 . 1 25 25 LEU CD2 C 13 27.445 0.300 . 1 . . . . A 105 LEU CD2 . 34007 1 322 . 1 . 1 25 25 LEU N N 15 114.782 0.300 . 1 . . . . A 105 LEU N . 34007 1 323 . 1 . 1 26 26 LEU H H 1 7.248 0.020 . 1 . . . . A 106 LEU H . 34007 1 324 . 1 . 1 26 26 LEU HA H 1 4.006 0.020 . 1 . . . . A 106 LEU HA . 34007 1 325 . 1 . 1 26 26 LEU HB2 H 1 1.604 0.020 . 1 . . . . A 106 LEU HB2 . 34007 1 326 . 1 . 1 26 26 LEU HB3 H 1 1.931 0.020 . 1 . . . . A 106 LEU HB3 . 34007 1 327 . 1 . 1 26 26 LEU HG H 1 2.079 0.020 . 1 . . . . A 106 LEU HG . 34007 1 328 . 1 . 1 26 26 LEU HD11 H 1 0.946 0.020 . 2 . . . . A 106 LEU HD11 . 34007 1 329 . 1 . 1 26 26 LEU HD12 H 1 0.946 0.020 . 2 . . . . A 106 LEU HD12 . 34007 1 330 . 1 . 1 26 26 LEU HD13 H 1 0.946 0.020 . 2 . . . . A 106 LEU HD13 . 34007 1 331 . 1 . 1 26 26 LEU HD21 H 1 1.042 0.020 . 2 . . . . A 106 LEU HD21 . 34007 1 332 . 1 . 1 26 26 LEU HD22 H 1 1.042 0.020 . 2 . . . . A 106 LEU HD22 . 34007 1 333 . 1 . 1 26 26 LEU HD23 H 1 1.042 0.020 . 2 . . . . A 106 LEU HD23 . 34007 1 334 . 1 . 1 26 26 LEU C C 13 177.225 0.300 . 1 . . . . A 106 LEU C . 34007 1 335 . 1 . 1 26 26 LEU CA C 13 56.133 0.300 . 1 . . . . A 106 LEU CA . 34007 1 336 . 1 . 1 26 26 LEU CB C 13 42.117 0.300 . 1 . . . . A 106 LEU CB . 34007 1 337 . 1 . 1 26 26 LEU CG C 13 26.240 0.300 . 1 . . . . A 106 LEU CG . 34007 1 338 . 1 . 1 26 26 LEU CD1 C 13 23.317 0.300 . 1 . . . . A 106 LEU CD1 . 34007 1 339 . 1 . 1 26 26 LEU CD2 C 13 25.656 0.300 . 1 . . . . A 106 LEU CD2 . 34007 1 340 . 1 . 1 26 26 LEU N N 15 116.907 0.300 . 1 . . . . A 106 LEU N . 34007 1 341 . 1 . 1 27 27 ASN H H 1 7.595 0.020 . 1 . . . . A 107 ASN H . 34007 1 342 . 1 . 1 27 27 ASN HA H 1 4.963 0.020 . 1 . . . . A 107 ASN HA . 34007 1 343 . 1 . 1 27 27 ASN HB2 H 1 2.853 0.020 . 1 . . . . A 107 ASN HB2 . 34007 1 344 . 1 . 1 27 27 ASN HB3 H 1 3.187 0.020 . 1 . . . . A 107 ASN HB3 . 34007 1 345 . 1 . 1 27 27 ASN HD21 H 1 7.410 0.020 . 1 . . . . A 107 ASN HD21 . 34007 1 346 . 1 . 1 27 27 ASN HD22 H 1 8.016 0.020 . 1 . . . . A 107 ASN HD22 . 34007 1 347 . 1 . 1 27 27 ASN CA C 13 51.414 0.300 . 1 . . . . A 107 ASN CA . 34007 1 348 . 1 . 1 27 27 ASN CB C 13 40.066 0.300 . 1 . . . . A 107 ASN CB . 34007 1 349 . 1 . 1 27 27 ASN CG C 13 176.792 0.300 . 1 . . . . A 107 ASN CG . 34007 1 350 . 1 . 1 27 27 ASN N N 15 119.760 0.300 . 1 . . . . A 107 ASN N . 34007 1 351 . 1 . 1 27 27 ASN ND2 N 15 115.947 0.300 . 1 . . . . A 107 ASN ND2 . 34007 1 352 . 1 . 1 28 28 PRO HA H 1 3.928 0.020 . 1 . . . . A 108 PRO HA . 34007 1 353 . 1 . 1 28 28 PRO HB2 H 1 1.982 0.020 . 1 . . . . A 108 PRO HB2 . 34007 1 354 . 1 . 1 28 28 PRO HB3 H 1 2.288 0.020 . 1 . . . . A 108 PRO HB3 . 34007 1 355 . 1 . 1 28 28 PRO HG2 H 1 2.042 0.020 . 2 . . . . A 108 PRO HG2 . 34007 1 356 . 1 . 1 28 28 PRO HG3 H 1 2.042 0.020 . 2 . . . . A 108 PRO HG3 . 34007 1 357 . 1 . 1 28 28 PRO HD2 H 1 3.936 0.020 . 1 . . . . A 108 PRO HD2 . 34007 1 358 . 1 . 1 28 28 PRO HD3 H 1 4.339 0.020 . 1 . . . . A 108 PRO HD3 . 34007 1 359 . 1 . 1 28 28 PRO C C 13 179.038 0.300 . 1 . . . . A 108 PRO C . 34007 1 360 . 1 . 1 28 28 PRO CA C 13 64.778 0.300 . 1 . . . . A 108 PRO CA . 34007 1 361 . 1 . 1 28 28 PRO CB C 13 31.983 0.300 . 1 . . . . A 108 PRO CB . 34007 1 362 . 1 . 1 28 28 PRO CG C 13 27.171 0.300 . 1 . . . . A 108 PRO CG . 34007 1 363 . 1 . 1 28 28 PRO CD C 13 51.243 0.300 . 1 . . . . A 108 PRO CD . 34007 1 364 . 1 . 1 29 29 HIS H H 1 8.243 0.020 . 1 . . . . A 109 HIS H . 34007 1 365 . 1 . 1 29 29 HIS HA H 1 4.488 0.020 . 1 . . . . A 109 HIS HA . 34007 1 366 . 1 . 1 29 29 HIS HB2 H 1 3.199 0.020 . 2 . . . . A 109 HIS HB2 . 34007 1 367 . 1 . 1 29 29 HIS HB3 H 1 3.199 0.020 . 2 . . . . A 109 HIS HB3 . 34007 1 368 . 1 . 1 29 29 HIS HD2 H 1 7.038 0.020 . 1 . . . . A 109 HIS HD2 . 34007 1 369 . 1 . 1 29 29 HIS HE1 H 1 8.267 0.020 . 1 . . . . A 109 HIS HE1 . 34007 1 370 . 1 . 1 29 29 HIS C C 13 177.474 0.300 . 1 . . . . A 109 HIS C . 34007 1 371 . 1 . 1 29 29 HIS CA C 13 58.297 0.300 . 1 . . . . A 109 HIS CA . 34007 1 372 . 1 . 1 29 29 HIS CB C 13 29.088 0.300 . 1 . . . . A 109 HIS CB . 34007 1 373 . 1 . 1 29 29 HIS CD2 C 13 119.288 0.300 . 1 . . . . A 109 HIS CD2 . 34007 1 374 . 1 . 1 29 29 HIS CE1 C 13 137.885 0.300 . 1 . . . . A 109 HIS CE1 . 34007 1 375 . 1 . 1 29 29 HIS N N 15 118.546 0.300 . 1 . . . . A 109 HIS N . 34007 1 376 . 1 . 1 29 29 HIS ND1 N 15 201.129 0.300 . 1 . . . . A 109 HIS ND1 . 34007 1 377 . 1 . 1 29 29 HIS NE2 N 15 175.332 0.300 . 1 . . . . A 109 HIS NE2 . 34007 1 378 . 1 . 1 30 30 LEU H H 1 7.445 0.020 . 1 . . . . A 110 LEU H . 34007 1 379 . 1 . 1 30 30 LEU HA H 1 3.873 0.020 . 1 . . . . A 110 LEU HA . 34007 1 380 . 1 . 1 30 30 LEU HB2 H 1 1.409 0.020 . 1 . . . . A 110 LEU HB2 . 34007 1 381 . 1 . 1 30 30 LEU HB3 H 1 2.022 0.020 . 1 . . . . A 110 LEU HB3 . 34007 1 382 . 1 . 1 30 30 LEU HG H 1 1.249 0.020 . 1 . . . . A 110 LEU HG . 34007 1 383 . 1 . 1 30 30 LEU HD11 H 1 0.598 0.020 . 2 . . . . A 110 LEU HD11 . 34007 1 384 . 1 . 1 30 30 LEU HD12 H 1 0.598 0.020 . 2 . . . . A 110 LEU HD12 . 34007 1 385 . 1 . 1 30 30 LEU HD13 H 1 0.598 0.020 . 2 . . . . A 110 LEU HD13 . 34007 1 386 . 1 . 1 30 30 LEU HD21 H 1 0.846 0.020 . 2 . . . . A 110 LEU HD21 . 34007 1 387 . 1 . 1 30 30 LEU HD22 H 1 0.846 0.020 . 2 . . . . A 110 LEU HD22 . 34007 1 388 . 1 . 1 30 30 LEU HD23 H 1 0.846 0.020 . 2 . . . . A 110 LEU HD23 . 34007 1 389 . 1 . 1 30 30 LEU C C 13 178.354 0.300 . 1 . . . . A 110 LEU C . 34007 1 390 . 1 . 1 30 30 LEU CA C 13 57.656 0.300 . 1 . . . . A 110 LEU CA . 34007 1 391 . 1 . 1 30 30 LEU CB C 13 40.724 0.300 . 1 . . . . A 110 LEU CB . 34007 1 392 . 1 . 1 30 30 LEU CG C 13 27.766 0.300 . 1 . . . . A 110 LEU CG . 34007 1 393 . 1 . 1 30 30 LEU CD1 C 13 21.673 0.300 . 1 . . . . A 110 LEU CD1 . 34007 1 394 . 1 . 1 30 30 LEU CD2 C 13 25.829 0.300 . 1 . . . . A 110 LEU CD2 . 34007 1 395 . 1 . 1 30 30 LEU N N 15 118.924 0.300 . 1 . . . . A 110 LEU N . 34007 1 396 . 1 . 1 31 31 ARG H H 1 7.295 0.020 . 1 . . . . A 111 ARG H . 34007 1 397 . 1 . 1 31 31 ARG HA H 1 3.952 0.020 . 1 . . . . A 111 ARG HA . 34007 1 398 . 1 . 1 31 31 ARG HB2 H 1 1.142 0.020 . 1 . . . . A 111 ARG HB2 . 34007 1 399 . 1 . 1 31 31 ARG HB3 H 1 1.644 0.020 . 1 . . . . A 111 ARG HB3 . 34007 1 400 . 1 . 1 31 31 ARG HG2 H 1 0.696 0.020 . 1 . . . . A 111 ARG HG2 . 34007 1 401 . 1 . 1 31 31 ARG HG3 H 1 1.811 0.020 . 1 . . . . A 111 ARG HG3 . 34007 1 402 . 1 . 1 31 31 ARG HD2 H 1 2.664 0.020 . 2 . . . . A 111 ARG HD2 . 34007 1 403 . 1 . 1 31 31 ARG HD3 H 1 2.664 0.020 . 2 . . . . A 111 ARG HD3 . 34007 1 404 . 1 . 1 31 31 ARG HE H 1 7.444 0.020 . 1 . . . . A 111 ARG HE . 34007 1 405 . 1 . 1 31 31 ARG C C 13 177.830 0.300 . 1 . . . . A 111 ARG C . 34007 1 406 . 1 . 1 31 31 ARG CA C 13 60.927 0.300 . 1 . . . . A 111 ARG CA . 34007 1 407 . 1 . 1 31 31 ARG CB C 13 29.319 0.300 . 1 . . . . A 111 ARG CB . 34007 1 408 . 1 . 1 31 31 ARG CG C 13 27.657 0.300 . 1 . . . . A 111 ARG CG . 34007 1 409 . 1 . 1 31 31 ARG CD C 13 42.873 0.300 . 1 . . . . A 111 ARG CD . 34007 1 410 . 1 . 1 31 31 ARG N N 15 114.989 0.300 . 1 . . . . A 111 ARG N . 34007 1 411 . 1 . 1 31 31 ARG NE N 15 82.190 0.300 . 1 . . . . A 111 ARG NE . 34007 1 412 . 1 . 1 32 32 GLN H H 1 7.607 0.020 . 1 . . . . A 112 GLN H . 34007 1 413 . 1 . 1 32 32 GLN HA H 1 3.930 0.020 . 1 . . . . A 112 GLN HA . 34007 1 414 . 1 . 1 32 32 GLN HB2 H 1 2.127 0.020 . 2 . . . . A 112 GLN HB2 . 34007 1 415 . 1 . 1 32 32 GLN HB3 H 1 2.127 0.020 . 2 . . . . A 112 GLN HB3 . 34007 1 416 . 1 . 1 32 32 GLN HG2 H 1 2.341 0.020 . 2 . . . . A 112 GLN HG2 . 34007 1 417 . 1 . 1 32 32 GLN HG3 H 1 2.341 0.020 . 2 . . . . A 112 GLN HG3 . 34007 1 418 . 1 . 1 32 32 GLN HE21 H 1 7.004 0.020 . 1 . . . . A 112 GLN HE21 . 34007 1 419 . 1 . 1 32 32 GLN HE22 H 1 7.428 0.020 . 1 . . . . A 112 GLN HE22 . 34007 1 420 . 1 . 1 32 32 GLN C C 13 178.114 0.300 . 1 . . . . A 112 GLN C . 34007 1 421 . 1 . 1 32 32 GLN CA C 13 58.652 0.300 . 1 . . . . A 112 GLN CA . 34007 1 422 . 1 . 1 32 32 GLN CB C 13 28.496 0.300 . 1 . . . . A 112 GLN CB . 34007 1 423 . 1 . 1 32 32 GLN CG C 13 33.972 0.300 . 1 . . . . A 112 GLN CG . 34007 1 424 . 1 . 1 32 32 GLN CD C 13 180.332 0.300 . 1 . . . . A 112 GLN CD . 34007 1 425 . 1 . 1 32 32 GLN N N 15 117.200 0.300 . 1 . . . . A 112 GLN N . 34007 1 426 . 1 . 1 32 32 GLN NE2 N 15 114.088 0.300 . 1 . . . . A 112 GLN NE2 . 34007 1 427 . 1 . 1 33 33 LEU H H 1 7.665 0.020 . 1 . . . . A 113 LEU H . 34007 1 428 . 1 . 1 33 33 LEU HA H 1 3.799 0.020 . 1 . . . . A 113 LEU HA . 34007 1 429 . 1 . 1 33 33 LEU HB2 H 1 0.801 0.020 . 1 . . . . A 113 LEU HB2 . 34007 1 430 . 1 . 1 33 33 LEU HB3 H 1 1.849 0.020 . 1 . . . . A 113 LEU HB3 . 34007 1 431 . 1 . 1 33 33 LEU HG H 1 1.398 0.020 . 1 . . . . A 113 LEU HG . 34007 1 432 . 1 . 1 33 33 LEU HD11 H 1 0.093 0.020 . 2 . . . . A 113 LEU HD11 . 34007 1 433 . 1 . 1 33 33 LEU HD12 H 1 0.093 0.020 . 2 . . . . A 113 LEU HD12 . 34007 1 434 . 1 . 1 33 33 LEU HD13 H 1 0.093 0.020 . 2 . . . . A 113 LEU HD13 . 34007 1 435 . 1 . 1 33 33 LEU HD21 H 1 0.424 0.020 . 2 . . . . A 113 LEU HD21 . 34007 1 436 . 1 . 1 33 33 LEU HD22 H 1 0.424 0.020 . 2 . . . . A 113 LEU HD22 . 34007 1 437 . 1 . 1 33 33 LEU HD23 H 1 0.424 0.020 . 2 . . . . A 113 LEU HD23 . 34007 1 438 . 1 . 1 33 33 LEU C C 13 179.981 0.300 . 1 . . . . A 113 LEU C . 34007 1 439 . 1 . 1 33 33 LEU CA C 13 57.866 0.300 . 1 . . . . A 113 LEU CA . 34007 1 440 . 1 . 1 33 33 LEU CB C 13 41.000 0.300 . 1 . . . . A 113 LEU CB . 34007 1 441 . 1 . 1 33 33 LEU CG C 13 25.340 0.300 . 1 . . . . A 113 LEU CG . 34007 1 442 . 1 . 1 33 33 LEU CD1 C 13 20.444 0.300 . 1 . . . . A 113 LEU CD1 . 34007 1 443 . 1 . 1 33 33 LEU CD2 C 13 25.866 0.300 . 1 . . . . A 113 LEU CD2 . 34007 1 444 . 1 . 1 33 33 LEU N N 15 118.432 0.300 . 1 . . . . A 113 LEU N . 34007 1 445 . 1 . 1 34 34 MET H H 1 8.177 0.020 . 1 . . . . A 114 MET H . 34007 1 446 . 1 . 1 34 34 MET HA H 1 3.772 0.020 . 1 . . . . A 114 MET HA . 34007 1 447 . 1 . 1 34 34 MET HB2 H 1 2.246 0.020 . 1 . . . . A 114 MET HB2 . 34007 1 448 . 1 . 1 34 34 MET HB3 H 1 2.492 0.020 . 1 . . . . A 114 MET HB3 . 34007 1 449 . 1 . 1 34 34 MET HG2 H 1 1.935 0.020 . 1 . . . . A 114 MET HG2 . 34007 1 450 . 1 . 1 34 34 MET HG3 H 1 2.530 0.020 . 1 . . . . A 114 MET HG3 . 34007 1 451 . 1 . 1 34 34 MET HE1 H 1 1.916 0.020 . 1 . . . . A 114 MET HE1 . 34007 1 452 . 1 . 1 34 34 MET HE2 H 1 1.916 0.020 . 1 . . . . A 114 MET HE2 . 34007 1 453 . 1 . 1 34 34 MET HE3 H 1 1.916 0.020 . 1 . . . . A 114 MET HE3 . 34007 1 454 . 1 . 1 34 34 MET C C 13 177.039 0.300 . 1 . . . . A 114 MET C . 34007 1 455 . 1 . 1 34 34 MET CA C 13 60.583 0.300 . 1 . . . . A 114 MET CA . 34007 1 456 . 1 . 1 34 34 MET CB C 13 33.715 0.300 . 1 . . . . A 114 MET CB . 34007 1 457 . 1 . 1 34 34 MET CG C 13 31.673 0.300 . 1 . . . . A 114 MET CG . 34007 1 458 . 1 . 1 34 34 MET CE C 13 17.637 0.300 . 1 . . . . A 114 MET CE . 34007 1 459 . 1 . 1 34 34 MET N N 15 117.214 0.300 . 1 . . . . A 114 MET N . 34007 1 460 . 1 . 1 35 35 VAL H H 1 8.314 0.020 . 1 . . . . A 115 VAL H . 34007 1 461 . 1 . 1 35 35 VAL HA H 1 3.624 0.020 . 1 . . . . A 115 VAL HA . 34007 1 462 . 1 . 1 35 35 VAL HB H 1 2.129 0.020 . 1 . . . . A 115 VAL HB . 34007 1 463 . 1 . 1 35 35 VAL HG11 H 1 0.993 0.020 . 2 . . . . A 115 VAL HG11 . 34007 1 464 . 1 . 1 35 35 VAL HG12 H 1 0.993 0.020 . 2 . . . . A 115 VAL HG12 . 34007 1 465 . 1 . 1 35 35 VAL HG13 H 1 0.993 0.020 . 2 . . . . A 115 VAL HG13 . 34007 1 466 . 1 . 1 35 35 VAL HG21 H 1 1.216 0.020 . 2 . . . . A 115 VAL HG21 . 34007 1 467 . 1 . 1 35 35 VAL HG22 H 1 1.216 0.020 . 2 . . . . A 115 VAL HG22 . 34007 1 468 . 1 . 1 35 35 VAL HG23 H 1 1.216 0.020 . 2 . . . . A 115 VAL HG23 . 34007 1 469 . 1 . 1 35 35 VAL C C 13 177.954 0.300 . 1 . . . . A 115 VAL C . 34007 1 470 . 1 . 1 35 35 VAL CA C 13 66.874 0.300 . 1 . . . . A 115 VAL CA . 34007 1 471 . 1 . 1 35 35 VAL CB C 13 31.879 0.300 . 1 . . . . A 115 VAL CB . 34007 1 472 . 1 . 1 35 35 VAL CG1 C 13 21.100 0.300 . 1 . . . . A 115 VAL CG1 . 34007 1 473 . 1 . 1 35 35 VAL CG2 C 13 22.786 0.300 . 1 . . . . A 115 VAL CG2 . 34007 1 474 . 1 . 1 35 35 VAL N N 15 119.717 0.300 . 1 . . . . A 115 VAL N . 34007 1 475 . 1 . 1 36 36 ASN H H 1 8.411 0.020 . 1 . . . . A 116 ASN H . 34007 1 476 . 1 . 1 36 36 ASN HA H 1 4.332 0.020 . 1 . . . . A 116 ASN HA . 34007 1 477 . 1 . 1 36 36 ASN HB2 H 1 2.893 0.020 . 1 . . . . A 116 ASN HB2 . 34007 1 478 . 1 . 1 36 36 ASN HB3 H 1 3.198 0.020 . 1 . . . . A 116 ASN HB3 . 34007 1 479 . 1 . 1 36 36 ASN HD21 H 1 7.024 0.020 . 1 . . . . A 116 ASN HD21 . 34007 1 480 . 1 . 1 36 36 ASN HD22 H 1 7.083 0.020 . 1 . . . . A 116 ASN HD22 . 34007 1 481 . 1 . 1 36 36 ASN C C 13 178.736 0.300 . 1 . . . . A 116 ASN C . 34007 1 482 . 1 . 1 36 36 ASN CA C 13 55.560 0.300 . 1 . . . . A 116 ASN CA . 34007 1 483 . 1 . 1 36 36 ASN CB C 13 37.968 0.300 . 1 . . . . A 116 ASN CB . 34007 1 484 . 1 . 1 36 36 ASN CG C 13 176.351 0.300 . 1 . . . . A 116 ASN CG . 34007 1 485 . 1 . 1 36 36 ASN N N 15 118.538 0.300 . 1 . . . . A 116 ASN N . 34007 1 486 . 1 . 1 36 36 ASN ND2 N 15 108.734 0.300 . 1 . . . . A 116 ASN ND2 . 34007 1 487 . 1 . 1 37 37 LEU H H 1 8.199 0.020 . 1 . . . . A 117 LEU H . 34007 1 488 . 1 . 1 37 37 LEU HA H 1 4.120 0.020 . 1 . . . . A 117 LEU HA . 34007 1 489 . 1 . 1 37 37 LEU HB2 H 1 1.738 0.020 . 1 . . . . A 117 LEU HB2 . 34007 1 490 . 1 . 1 37 37 LEU HB3 H 1 2.097 0.020 . 1 . . . . A 117 LEU HB3 . 34007 1 491 . 1 . 1 37 37 LEU HG H 1 1.651 0.020 . 1 . . . . A 117 LEU HG . 34007 1 492 . 1 . 1 37 37 LEU HD11 H 1 0.866 0.020 . 2 . . . . A 117 LEU HD11 . 34007 1 493 . 1 . 1 37 37 LEU HD12 H 1 0.866 0.020 . 2 . . . . A 117 LEU HD12 . 34007 1 494 . 1 . 1 37 37 LEU HD13 H 1 0.866 0.020 . 2 . . . . A 117 LEU HD13 . 34007 1 495 . 1 . 1 37 37 LEU HD21 H 1 1.091 0.020 . 2 . . . . A 117 LEU HD21 . 34007 1 496 . 1 . 1 37 37 LEU HD22 H 1 1.091 0.020 . 2 . . . . A 117 LEU HD22 . 34007 1 497 . 1 . 1 37 37 LEU HD23 H 1 1.091 0.020 . 2 . . . . A 117 LEU HD23 . 34007 1 498 . 1 . 1 37 37 LEU C C 13 177.394 0.300 . 1 . . . . A 117 LEU C . 34007 1 499 . 1 . 1 37 37 LEU CA C 13 57.526 0.300 . 1 . . . . A 117 LEU CA . 34007 1 500 . 1 . 1 37 37 LEU CB C 13 42.676 0.300 . 1 . . . . A 117 LEU CB . 34007 1 501 . 1 . 1 37 37 LEU CG C 13 27.065 0.300 . 1 . . . . A 117 LEU CG . 34007 1 502 . 1 . 1 37 37 LEU CD1 C 13 24.629 0.300 . 1 . . . . A 117 LEU CD1 . 34007 1 503 . 1 . 1 37 37 LEU CD2 C 13 26.991 0.300 . 1 . . . . A 117 LEU CD2 . 34007 1 504 . 1 . 1 37 37 LEU N N 15 120.479 0.300 . 1 . . . . A 117 LEU N . 34007 1 505 . 1 . 1 38 38 ASP H H 1 8.327 0.020 . 1 . . . . A 118 ASP H . 34007 1 506 . 1 . 1 38 38 ASP HA H 1 4.324 0.020 . 1 . . . . A 118 ASP HA . 34007 1 507 . 1 . 1 38 38 ASP HB2 H 1 2.642 0.020 . 1 . . . . A 118 ASP HB2 . 34007 1 508 . 1 . 1 38 38 ASP HB3 H 1 2.695 0.020 . 1 . . . . A 118 ASP HB3 . 34007 1 509 . 1 . 1 38 38 ASP C C 13 177.972 0.300 . 1 . . . . A 118 ASP C . 34007 1 510 . 1 . 1 38 38 ASP CA C 13 57.689 0.300 . 1 . . . . A 118 ASP CA . 34007 1 511 . 1 . 1 38 38 ASP CB C 13 44.284 0.300 . 1 . . . . A 118 ASP CB . 34007 1 512 . 1 . 1 38 38 ASP N N 15 118.454 0.300 . 1 . . . . A 118 ASP N . 34007 1 513 . 1 . 1 39 39 GLN H H 1 7.989 0.020 . 1 . . . . A 119 GLN H . 34007 1 514 . 1 . 1 39 39 GLN HA H 1 4.348 0.020 . 1 . . . . A 119 GLN HA . 34007 1 515 . 1 . 1 39 39 GLN HB2 H 1 1.995 0.020 . 1 . . . . A 119 GLN HB2 . 34007 1 516 . 1 . 1 39 39 GLN HB3 H 1 2.204 0.020 . 1 . . . . A 119 GLN HB3 . 34007 1 517 . 1 . 1 39 39 GLN HG2 H 1 2.498 0.020 . 1 . . . . A 119 GLN HG2 . 34007 1 518 . 1 . 1 39 39 GLN HG3 H 1 2.595 0.020 . 1 . . . . A 119 GLN HG3 . 34007 1 519 . 1 . 1 39 39 GLN HE21 H 1 6.801 0.020 . 1 . . . . A 119 GLN HE21 . 34007 1 520 . 1 . 1 39 39 GLN HE22 H 1 7.642 0.020 . 1 . . . . A 119 GLN HE22 . 34007 1 521 . 1 . 1 39 39 GLN C C 13 177.679 0.300 . 1 . . . . A 119 GLN C . 34007 1 522 . 1 . 1 39 39 GLN CA C 13 55.585 0.300 . 1 . . . . A 119 GLN CA . 34007 1 523 . 1 . 1 39 39 GLN CB C 13 29.399 0.300 . 1 . . . . A 119 GLN CB . 34007 1 524 . 1 . 1 39 39 GLN CG C 13 34.047 0.300 . 1 . . . . A 119 GLN CG . 34007 1 525 . 1 . 1 39 39 GLN CD C 13 180.558 0.300 . 1 . . . . A 119 GLN CD . 34007 1 526 . 1 . 1 39 39 GLN N N 15 111.892 0.300 . 1 . . . . A 119 GLN N . 34007 1 527 . 1 . 1 39 39 GLN NE2 N 15 112.221 0.300 . 1 . . . . A 119 GLN NE2 . 34007 1 528 . 1 . 1 40 40 GLY H H 1 7.718 0.020 . 1 . . . . A 120 GLY H . 34007 1 529 . 1 . 1 40 40 GLY HA2 H 1 3.482 0.020 . 1 . . . . A 120 GLY HA2 . 34007 1 530 . 1 . 1 40 40 GLY HA3 H 1 4.034 0.020 . 1 . . . . A 120 GLY HA3 . 34007 1 531 . 1 . 1 40 40 GLY C C 13 173.591 0.300 . 1 . . . . A 120 GLY C . 34007 1 532 . 1 . 1 40 40 GLY CA C 13 45.857 0.300 . 1 . . . . A 120 GLY CA . 34007 1 533 . 1 . 1 40 40 GLY N N 15 108.755 0.300 . 1 . . . . A 120 GLY N . 34007 1 534 . 1 . 1 41 41 GLU H H 1 8.626 0.020 . 1 . . . . A 121 GLU H . 34007 1 535 . 1 . 1 41 41 GLU HA H 1 4.240 0.020 . 1 . . . . A 121 GLU HA . 34007 1 536 . 1 . 1 41 41 GLU HB2 H 1 2.040 0.020 . 2 . . . . A 121 GLU HB2 . 34007 1 537 . 1 . 1 41 41 GLU HB3 H 1 2.040 0.020 . 2 . . . . A 121 GLU HB3 . 34007 1 538 . 1 . 1 41 41 GLU HG2 H 1 2.297 0.020 . 1 . . . . A 121 GLU HG2 . 34007 1 539 . 1 . 1 41 41 GLU HG3 H 1 2.354 0.020 . 1 . . . . A 121 GLU HG3 . 34007 1 540 . 1 . 1 41 41 GLU C C 13 176.852 0.300 . 1 . . . . A 121 GLU C . 34007 1 541 . 1 . 1 41 41 GLU CA C 13 58.299 0.300 . 1 . . . . A 121 GLU CA . 34007 1 542 . 1 . 1 41 41 GLU CB C 13 30.083 0.300 . 1 . . . . A 121 GLU CB . 34007 1 543 . 1 . 1 41 41 GLU CG C 13 36.363 0.300 . 1 . . . . A 121 GLU CG . 34007 1 544 . 1 . 1 41 41 GLU N N 15 122.093 0.300 . 1 . . . . A 121 GLU N . 34007 1 545 . 1 . 1 42 42 ASP H H 1 8.462 0.020 . 1 . . . . A 122 ASP H . 34007 1 546 . 1 . 1 42 42 ASP HA H 1 4.824 0.020 . 1 . . . . A 122 ASP HA . 34007 1 547 . 1 . 1 42 42 ASP HB2 H 1 2.408 0.020 . 1 . . . . A 122 ASP HB2 . 34007 1 548 . 1 . 1 42 42 ASP HB3 H 1 3.008 0.020 . 1 . . . . A 122 ASP HB3 . 34007 1 549 . 1 . 1 42 42 ASP C C 13 176.088 0.300 . 1 . . . . A 122 ASP C . 34007 1 550 . 1 . 1 42 42 ASP CA C 13 52.115 0.300 . 1 . . . . A 122 ASP CA . 34007 1 551 . 1 . 1 42 42 ASP CB C 13 39.787 0.300 . 1 . . . . A 122 ASP CB . 34007 1 552 . 1 . 1 42 42 ASP N N 15 119.725 0.300 . 1 . . . . A 122 ASP N . 34007 1 553 . 1 . 1 43 43 LYS H H 1 8.275 0.020 . 1 . . . . A 123 LYS H . 34007 1 554 . 1 . 1 43 43 LYS HA H 1 3.736 0.020 . 1 . . . . A 123 LYS HA . 34007 1 555 . 1 . 1 43 43 LYS HB2 H 1 1.742 0.020 . 1 . . . . A 123 LYS HB2 . 34007 1 556 . 1 . 1 43 43 LYS HB3 H 1 1.875 0.020 . 1 . . . . A 123 LYS HB3 . 34007 1 557 . 1 . 1 43 43 LYS HG2 H 1 1.618 0.020 . 2 . . . . A 123 LYS HG2 . 34007 1 558 . 1 . 1 43 43 LYS HG3 H 1 1.618 0.020 . 2 . . . . A 123 LYS HG3 . 34007 1 559 . 1 . 1 43 43 LYS HD2 H 1 1.636 0.020 . 2 . . . . A 123 LYS HD2 . 34007 1 560 . 1 . 1 43 43 LYS HD3 H 1 1.636 0.020 . 2 . . . . A 123 LYS HD3 . 34007 1 561 . 1 . 1 43 43 LYS HE2 H 1 3.144 0.020 . 1 . . . . A 123 LYS HE2 . 34007 1 562 . 1 . 1 43 43 LYS HE3 H 1 3.266 0.020 . 1 . . . . A 123 LYS HE3 . 34007 1 563 . 1 . 1 43 43 LYS C C 13 178.336 0.300 . 1 . . . . A 123 LYS C . 34007 1 564 . 1 . 1 43 43 LYS CA C 13 59.162 0.300 . 1 . . . . A 123 LYS CA . 34007 1 565 . 1 . 1 43 43 LYS CB C 13 32.509 0.300 . 1 . . . . A 123 LYS CB . 34007 1 566 . 1 . 1 43 43 LYS CG C 13 25.779 0.300 . 1 . . . . A 123 LYS CG . 34007 1 567 . 1 . 1 43 43 LYS CD C 13 28.918 0.300 . 1 . . . . A 123 LYS CD . 34007 1 568 . 1 . 1 43 43 LYS CE C 13 43.274 0.300 . 1 . . . . A 123 LYS CE . 34007 1 569 . 1 . 1 43 43 LYS N N 15 121.263 0.300 . 1 . . . . A 123 LYS N . 34007 1 570 . 1 . 1 44 44 ALA H H 1 8.319 0.020 . 1 . . . . A 124 ALA H . 34007 1 571 . 1 . 1 44 44 ALA HA H 1 3.948 0.020 . 1 . . . . A 124 ALA HA . 34007 1 572 . 1 . 1 44 44 ALA HB1 H 1 1.442 0.020 . 1 . . . . A 124 ALA HB1 . 34007 1 573 . 1 . 1 44 44 ALA HB2 H 1 1.442 0.020 . 1 . . . . A 124 ALA HB2 . 34007 1 574 . 1 . 1 44 44 ALA HB3 H 1 1.442 0.020 . 1 . . . . A 124 ALA HB3 . 34007 1 575 . 1 . 1 44 44 ALA C C 13 180.096 0.300 . 1 . . . . A 124 ALA C . 34007 1 576 . 1 . 1 44 44 ALA CA C 13 55.296 0.300 . 1 . . . . A 124 ALA CA . 34007 1 577 . 1 . 1 44 44 ALA CB C 13 17.961 0.300 . 1 . . . . A 124 ALA CB . 34007 1 578 . 1 . 1 44 44 ALA N N 15 120.398 0.300 . 1 . . . . A 124 ALA N . 34007 1 579 . 1 . 1 45 45 LYS H H 1 7.607 0.020 . 1 . . . . A 125 LYS H . 34007 1 580 . 1 . 1 45 45 LYS HA H 1 3.823 0.020 . 1 . . . . A 125 LYS HA . 34007 1 581 . 1 . 1 45 45 LYS HB2 H 1 1.649 0.020 . 1 . . . . A 125 LYS HB2 . 34007 1 582 . 1 . 1 45 45 LYS HB3 H 1 1.786 0.020 . 1 . . . . A 125 LYS HB3 . 34007 1 583 . 1 . 1 45 45 LYS HG2 H 1 1.219 0.020 . 1 . . . . A 125 LYS HG2 . 34007 1 584 . 1 . 1 45 45 LYS HG3 H 1 1.445 0.020 . 1 . . . . A 125 LYS HG3 . 34007 1 585 . 1 . 1 45 45 LYS HD2 H 1 1.659 0.020 . 2 . . . . A 125 LYS HD2 . 34007 1 586 . 1 . 1 45 45 LYS HD3 H 1 1.659 0.020 . 2 . . . . A 125 LYS HD3 . 34007 1 587 . 1 . 1 45 45 LYS HE2 H 1 2.974 0.020 . 2 . . . . A 125 LYS HE2 . 34007 1 588 . 1 . 1 45 45 LYS HE3 H 1 2.974 0.020 . 2 . . . . A 125 LYS HE3 . 34007 1 589 . 1 . 1 45 45 LYS C C 13 179.723 0.300 . 1 . . . . A 125 LYS C . 34007 1 590 . 1 . 1 45 45 LYS CA C 13 59.375 0.300 . 1 . . . . A 125 LYS CA . 34007 1 591 . 1 . 1 45 45 LYS CB C 13 32.758 0.300 . 1 . . . . A 125 LYS CB . 34007 1 592 . 1 . 1 45 45 LYS CG C 13 25.096 0.300 . 1 . . . . A 125 LYS CG . 34007 1 593 . 1 . 1 45 45 LYS CD C 13 29.581 0.300 . 1 . . . . A 125 LYS CD . 34007 1 594 . 1 . 1 45 45 LYS CE C 13 42.012 0.300 . 1 . . . . A 125 LYS CE . 34007 1 595 . 1 . 1 45 45 LYS N N 15 119.714 0.300 . 1 . . . . A 125 LYS N . 34007 1 596 . 1 . 1 46 46 LEU H H 1 7.531 0.020 . 1 . . . . A 126 LEU H . 34007 1 597 . 1 . 1 46 46 LEU HA H 1 3.672 0.020 . 1 . . . . A 126 LEU HA . 34007 1 598 . 1 . 1 46 46 LEU HB2 H 1 0.718 0.020 . 1 . . . . A 126 LEU HB2 . 34007 1 599 . 1 . 1 46 46 LEU HB3 H 1 1.465 0.020 . 1 . . . . A 126 LEU HB3 . 34007 1 600 . 1 . 1 46 46 LEU HG H 1 1.474 0.020 . 1 . . . . A 126 LEU HG . 34007 1 601 . 1 . 1 46 46 LEU HD11 H 1 0.680 0.020 . 2 . . . . A 126 LEU HD11 . 34007 1 602 . 1 . 1 46 46 LEU HD12 H 1 0.680 0.020 . 2 . . . . A 126 LEU HD12 . 34007 1 603 . 1 . 1 46 46 LEU HD13 H 1 0.680 0.020 . 2 . . . . A 126 LEU HD13 . 34007 1 604 . 1 . 1 46 46 LEU HD21 H 1 0.763 0.020 . 2 . . . . A 126 LEU HD21 . 34007 1 605 . 1 . 1 46 46 LEU HD22 H 1 0.763 0.020 . 2 . . . . A 126 LEU HD22 . 34007 1 606 . 1 . 1 46 46 LEU HD23 H 1 0.763 0.020 . 2 . . . . A 126 LEU HD23 . 34007 1 607 . 1 . 1 46 46 LEU C C 13 177.439 0.300 . 1 . . . . A 126 LEU C . 34007 1 608 . 1 . 1 46 46 LEU CA C 13 57.351 0.300 . 1 . . . . A 126 LEU CA . 34007 1 609 . 1 . 1 46 46 LEU CB C 13 42.212 0.300 . 1 . . . . A 126 LEU CB . 34007 1 610 . 1 . 1 46 46 LEU CG C 13 26.579 0.300 . 1 . . . . A 126 LEU CG . 34007 1 611 . 1 . 1 46 46 LEU CD1 C 13 22.479 0.300 . 1 . . . . A 126 LEU CD1 . 34007 1 612 . 1 . 1 46 46 LEU CD2 C 13 26.229 0.300 . 1 . . . . A 126 LEU CD2 . 34007 1 613 . 1 . 1 46 46 LEU N N 15 119.459 0.300 . 1 . . . . A 126 LEU N . 34007 1 614 . 1 . 1 47 47 MET H H 1 8.304 0.020 . 1 . . . . A 127 MET H . 34007 1 615 . 1 . 1 47 47 MET HA H 1 3.754 0.020 . 1 . . . . A 127 MET HA . 34007 1 616 . 1 . 1 47 47 MET HB2 H 1 2.082 0.020 . 2 . . . . A 127 MET HB2 . 34007 1 617 . 1 . 1 47 47 MET HB3 H 1 2.082 0.020 . 2 . . . . A 127 MET HB3 . 34007 1 618 . 1 . 1 47 47 MET HG2 H 1 2.536 0.020 . 1 . . . . A 127 MET HG2 . 34007 1 619 . 1 . 1 47 47 MET HG3 H 1 2.622 0.020 . 1 . . . . A 127 MET HG3 . 34007 1 620 . 1 . 1 47 47 MET HE1 H 1 2.240 0.020 . 1 . . . . A 127 MET HE1 . 34007 1 621 . 1 . 1 47 47 MET HE2 H 1 2.240 0.020 . 1 . . . . A 127 MET HE2 . 34007 1 622 . 1 . 1 47 47 MET HE3 H 1 2.240 0.020 . 1 . . . . A 127 MET HE3 . 34007 1 623 . 1 . 1 47 47 MET C C 13 177.812 0.300 . 1 . . . . A 127 MET C . 34007 1 624 . 1 . 1 47 47 MET CA C 13 58.526 0.300 . 1 . . . . A 127 MET CA . 34007 1 625 . 1 . 1 47 47 MET CB C 13 31.265 0.300 . 1 . . . . A 127 MET CB . 34007 1 626 . 1 . 1 47 47 MET CG C 13 33.602 0.300 . 1 . . . . A 127 MET CG . 34007 1 627 . 1 . 1 47 47 MET CE C 13 17.670 0.300 . 1 . . . . A 127 MET CE . 34007 1 628 . 1 . 1 47 47 MET N N 15 116.604 0.300 . 1 . . . . A 127 MET N . 34007 1 629 . 1 . 1 48 48 ARG H H 1 7.549 0.020 . 1 . . . . A 128 ARG H . 34007 1 630 . 1 . 1 48 48 ARG HA H 1 3.964 0.020 . 1 . . . . A 128 ARG HA . 34007 1 631 . 1 . 1 48 48 ARG HB2 H 1 1.831 0.020 . 1 . . . . A 128 ARG HB2 . 34007 1 632 . 1 . 1 48 48 ARG HB3 H 1 1.889 0.020 . 1 . . . . A 128 ARG HB3 . 34007 1 633 . 1 . 1 48 48 ARG HG2 H 1 1.572 0.020 . 1 . . . . A 128 ARG HG2 . 34007 1 634 . 1 . 1 48 48 ARG HG3 H 1 1.796 0.020 . 1 . . . . A 128 ARG HG3 . 34007 1 635 . 1 . 1 48 48 ARG HD2 H 1 3.172 0.020 . 1 . . . . A 128 ARG HD2 . 34007 1 636 . 1 . 1 48 48 ARG HD3 H 1 3.237 0.020 . 1 . . . . A 128 ARG HD3 . 34007 1 637 . 1 . 1 48 48 ARG C C 13 179.278 0.300 . 1 . . . . A 128 ARG C . 34007 1 638 . 1 . 1 48 48 ARG CA C 13 59.591 0.300 . 1 . . . . A 128 ARG CA . 34007 1 639 . 1 . 1 48 48 ARG CB C 13 29.772 0.300 . 1 . . . . A 128 ARG CB . 34007 1 640 . 1 . 1 48 48 ARG CG C 13 27.687 0.300 . 1 . . . . A 128 ARG CG . 34007 1 641 . 1 . 1 48 48 ARG CD C 13 43.562 0.300 . 1 . . . . A 128 ARG CD . 34007 1 642 . 1 . 1 48 48 ARG N N 15 116.675 0.300 . 1 . . . . A 128 ARG N . 34007 1 643 . 1 . 1 49 49 ALA H H 1 7.429 0.020 . 1 . . . . A 129 ALA H . 34007 1 644 . 1 . 1 49 49 ALA HA H 1 4.199 0.020 . 1 . . . . A 129 ALA HA . 34007 1 645 . 1 . 1 49 49 ALA HB1 H 1 1.476 0.020 . 1 . . . . A 129 ALA HB1 . 34007 1 646 . 1 . 1 49 49 ALA HB2 H 1 1.476 0.020 . 1 . . . . A 129 ALA HB2 . 34007 1 647 . 1 . 1 49 49 ALA HB3 H 1 1.476 0.020 . 1 . . . . A 129 ALA HB3 . 34007 1 648 . 1 . 1 49 49 ALA C C 13 181.598 0.300 . 1 . . . . A 129 ALA C . 34007 1 649 . 1 . 1 49 49 ALA CA C 13 54.837 0.300 . 1 . . . . A 129 ALA CA . 34007 1 650 . 1 . 1 49 49 ALA CB C 13 17.656 0.300 . 1 . . . . A 129 ALA CB . 34007 1 651 . 1 . 1 49 49 ALA N N 15 121.512 0.300 . 1 . . . . A 129 ALA N . 34007 1 652 . 1 . 1 50 50 TYR H H 1 8.927 0.020 . 1 . . . . A 130 TYR H . 34007 1 653 . 1 . 1 50 50 TYR HA H 1 4.414 0.020 . 1 . . . . A 130 TYR HA . 34007 1 654 . 1 . 1 50 50 TYR HB2 H 1 2.369 0.020 . 2 . . . . A 130 TYR HB2 . 34007 1 655 . 1 . 1 50 50 TYR HB3 H 1 2.369 0.020 . 2 . . . . A 130 TYR HB3 . 34007 1 656 . 1 . 1 50 50 TYR HD1 H 1 6.193 0.020 . 1 . . . . A 130 TYR HD1 . 34007 1 657 . 1 . 1 50 50 TYR HD2 H 1 6.193 0.020 . 1 . . . . A 130 TYR HD2 . 34007 1 658 . 1 . 1 50 50 TYR HE1 H 1 6.695 0.020 . 1 . . . . A 130 TYR HE1 . 34007 1 659 . 1 . 1 50 50 TYR HE2 H 1 6.695 0.020 . 1 . . . . A 130 TYR HE2 . 34007 1 660 . 1 . 1 50 50 TYR C C 13 178.203 0.300 . 1 . . . . A 130 TYR C . 34007 1 661 . 1 . 1 50 50 TYR CA C 13 57.280 0.300 . 1 . . . . A 130 TYR CA . 34007 1 662 . 1 . 1 50 50 TYR CB C 13 34.251 0.300 . 1 . . . . A 130 TYR CB . 34007 1 663 . 1 . 1 50 50 TYR CD1 C 13 129.956 0.300 . 1 . . . . A 130 TYR CD1 . 34007 1 664 . 1 . 1 50 50 TYR CE1 C 13 118.254 0.300 . 1 . . . . A 130 TYR CE1 . 34007 1 665 . 1 . 1 50 50 TYR N N 15 120.862 0.300 . 1 . . . . A 130 TYR N . 34007 1 666 . 1 . 1 51 51 MET H H 1 7.993 0.020 . 1 . . . . A 131 MET H . 34007 1 667 . 1 . 1 51 51 MET HA H 1 4.750 0.020 . 1 . . . . A 131 MET HA . 34007 1 668 . 1 . 1 51 51 MET HB2 H 1 2.182 0.020 . 1 . . . . A 131 MET HB2 . 34007 1 669 . 1 . 1 51 51 MET HB3 H 1 2.266 0.020 . 1 . . . . A 131 MET HB3 . 34007 1 670 . 1 . 1 51 51 MET HG2 H 1 2.876 0.020 . 1 . . . . A 131 MET HG2 . 34007 1 671 . 1 . 1 51 51 MET HG3 H 1 2.944 0.020 . 1 . . . . A 131 MET HG3 . 34007 1 672 . 1 . 1 51 51 MET HE1 H 1 2.169 0.020 . 1 . . . . A 131 MET HE1 . 34007 1 673 . 1 . 1 51 51 MET HE2 H 1 2.169 0.020 . 1 . . . . A 131 MET HE2 . 34007 1 674 . 1 . 1 51 51 MET HE3 H 1 2.169 0.020 . 1 . . . . A 131 MET HE3 . 34007 1 675 . 1 . 1 51 51 MET C C 13 176.594 0.300 . 1 . . . . A 131 MET C . 34007 1 676 . 1 . 1 51 51 MET CA C 13 55.930 0.300 . 1 . . . . A 131 MET CA . 34007 1 677 . 1 . 1 51 51 MET CB C 13 30.246 0.300 . 1 . . . . A 131 MET CB . 34007 1 678 . 1 . 1 51 51 MET CG C 13 33.067 0.300 . 1 . . . . A 131 MET CG . 34007 1 679 . 1 . 1 51 51 MET CE C 13 16.566 0.300 . 1 . . . . A 131 MET CE . 34007 1 680 . 1 . 1 51 51 MET N N 15 116.940 0.300 . 1 . . . . A 131 MET N . 34007 1 681 . 1 . 1 52 52 GLN H H 1 7.507 0.020 . 1 . . . . A 132 GLN H . 34007 1 682 . 1 . 1 52 52 GLN HA H 1 4.489 0.020 . 1 . . . . A 132 GLN HA . 34007 1 683 . 1 . 1 52 52 GLN HB2 H 1 2.115 0.020 . 1 . . . . A 132 GLN HB2 . 34007 1 684 . 1 . 1 52 52 GLN HB3 H 1 2.535 0.020 . 1 . . . . A 132 GLN HB3 . 34007 1 685 . 1 . 1 52 52 GLN HG2 H 1 2.449 0.020 . 1 . . . . A 132 GLN HG2 . 34007 1 686 . 1 . 1 52 52 GLN HG3 H 1 2.538 0.020 . 1 . . . . A 132 GLN HG3 . 34007 1 687 . 1 . 1 52 52 GLN HE21 H 1 6.881 0.020 . 1 . . . . A 132 GLN HE21 . 34007 1 688 . 1 . 1 52 52 GLN HE22 H 1 7.548 0.020 . 1 . . . . A 132 GLN HE22 . 34007 1 689 . 1 . 1 52 52 GLN C C 13 175.839 0.300 . 1 . . . . A 132 GLN C . 34007 1 690 . 1 . 1 52 52 GLN CA C 13 55.237 0.300 . 1 . . . . A 132 GLN CA . 34007 1 691 . 1 . 1 52 52 GLN CB C 13 29.213 0.300 . 1 . . . . A 132 GLN CB . 34007 1 692 . 1 . 1 52 52 GLN CG C 13 34.150 0.300 . 1 . . . . A 132 GLN CG . 34007 1 693 . 1 . 1 52 52 GLN CD C 13 180.588 0.300 . 1 . . . . A 132 GLN CD . 34007 1 694 . 1 . 1 52 52 GLN N N 15 114.682 0.300 . 1 . . . . A 132 GLN N . 34007 1 695 . 1 . 1 52 52 GLN NE2 N 15 112.452 0.300 . 1 . . . . A 132 GLN NE2 . 34007 1 696 . 1 . 1 53 53 GLU H H 1 7.985 0.020 . 1 . . . . A 133 GLU H . 34007 1 697 . 1 . 1 53 53 GLU HA H 1 4.944 0.020 . 1 . . . . A 133 GLU HA . 34007 1 698 . 1 . 1 53 53 GLU HB2 H 1 2.151 0.020 . 1 . . . . A 133 GLU HB2 . 34007 1 699 . 1 . 1 53 53 GLU HB3 H 1 2.433 0.020 . 1 . . . . A 133 GLU HB3 . 34007 1 700 . 1 . 1 53 53 GLU HG2 H 1 2.226 0.020 . 1 . . . . A 133 GLU HG2 . 34007 1 701 . 1 . 1 53 53 GLU HG3 H 1 2.310 0.020 . 1 . . . . A 133 GLU HG3 . 34007 1 702 . 1 . 1 53 53 GLU CA C 13 53.010 0.300 . 1 . . . . A 133 GLU CA . 34007 1 703 . 1 . 1 53 53 GLU CB C 13 29.524 0.300 . 1 . . . . A 133 GLU CB . 34007 1 704 . 1 . 1 53 53 GLU CG C 13 35.361 0.300 . 1 . . . . A 133 GLU CG . 34007 1 705 . 1 . 1 53 53 GLU N N 15 122.409 0.300 . 1 . . . . A 133 GLU N . 34007 1 706 . 1 . 1 54 54 PRO HA H 1 4.243 0.020 . 1 . . . . A 134 PRO HA . 34007 1 707 . 1 . 1 54 54 PRO HB2 H 1 2.040 0.020 . 1 . . . . A 134 PRO HB2 . 34007 1 708 . 1 . 1 54 54 PRO HB3 H 1 2.453 0.020 . 1 . . . . A 134 PRO HB3 . 34007 1 709 . 1 . 1 54 54 PRO HG2 H 1 2.071 0.020 . 1 . . . . A 134 PRO HG2 . 34007 1 710 . 1 . 1 54 54 PRO HG3 H 1 2.212 0.020 . 1 . . . . A 134 PRO HG3 . 34007 1 711 . 1 . 1 54 54 PRO HD2 H 1 4.064 0.020 . 1 . . . . A 134 PRO HD2 . 34007 1 712 . 1 . 1 54 54 PRO HD3 H 1 4.202 0.020 . 1 . . . . A 134 PRO HD3 . 34007 1 713 . 1 . 1 54 54 PRO C C 13 179.145 0.300 . 1 . . . . A 134 PRO C . 34007 1 714 . 1 . 1 54 54 PRO CA C 13 65.863 0.300 . 1 . . . . A 134 PRO CA . 34007 1 715 . 1 . 1 54 54 PRO CB C 13 32.463 0.300 . 1 . . . . A 134 PRO CB . 34007 1 716 . 1 . 1 54 54 PRO CG C 13 27.479 0.300 . 1 . . . . A 134 PRO CG . 34007 1 717 . 1 . 1 54 54 PRO CD C 13 51.418 0.300 . 1 . . . . A 134 PRO CD . 34007 1 718 . 1 . 1 55 55 LEU H H 1 9.016 0.020 . 1 . . . . A 135 LEU H . 34007 1 719 . 1 . 1 55 55 LEU HA H 1 4.339 0.020 . 1 . . . . A 135 LEU HA . 34007 1 720 . 1 . 1 55 55 LEU HB2 H 1 1.539 0.020 . 1 . . . . A 135 LEU HB2 . 34007 1 721 . 1 . 1 55 55 LEU HB3 H 1 1.818 0.020 . 1 . . . . A 135 LEU HB3 . 34007 1 722 . 1 . 1 55 55 LEU HG H 1 1.749 0.020 . 1 . . . . A 135 LEU HG . 34007 1 723 . 1 . 1 55 55 LEU HD11 H 1 0.971 0.020 . 2 . . . . A 135 LEU HD11 . 34007 1 724 . 1 . 1 55 55 LEU HD12 H 1 0.971 0.020 . 2 . . . . A 135 LEU HD12 . 34007 1 725 . 1 . 1 55 55 LEU HD13 H 1 0.971 0.020 . 2 . . . . A 135 LEU HD13 . 34007 1 726 . 1 . 1 55 55 LEU HD21 H 1 1.006 0.020 . 2 . . . . A 135 LEU HD21 . 34007 1 727 . 1 . 1 55 55 LEU HD22 H 1 1.006 0.020 . 2 . . . . A 135 LEU HD22 . 34007 1 728 . 1 . 1 55 55 LEU HD23 H 1 1.006 0.020 . 2 . . . . A 135 LEU HD23 . 34007 1 729 . 1 . 1 55 55 LEU C C 13 179.972 0.300 . 1 . . . . A 135 LEU C . 34007 1 730 . 1 . 1 55 55 LEU CA C 13 57.695 0.300 . 1 . . . . A 135 LEU CA . 34007 1 731 . 1 . 1 55 55 LEU CB C 13 42.880 0.300 . 1 . . . . A 135 LEU CB . 34007 1 732 . 1 . 1 55 55 LEU CG C 13 26.958 0.300 . 1 . . . . A 135 LEU CG . 34007 1 733 . 1 . 1 55 55 LEU CD1 C 13 24.245 0.300 . 1 . . . . A 135 LEU CD1 . 34007 1 734 . 1 . 1 55 55 LEU CD2 C 13 25.453 0.300 . 1 . . . . A 135 LEU CD2 . 34007 1 735 . 1 . 1 55 55 LEU N N 15 116.426 0.300 . 1 . . . . A 135 LEU N . 34007 1 736 . 1 . 1 56 56 PHE H H 1 7.772 0.020 . 1 . . . . A 136 PHE H . 34007 1 737 . 1 . 1 56 56 PHE HA H 1 4.108 0.020 . 1 . . . . A 136 PHE HA . 34007 1 738 . 1 . 1 56 56 PHE HB2 H 1 2.643 0.020 . 1 . . . . A 136 PHE HB2 . 34007 1 739 . 1 . 1 56 56 PHE HB3 H 1 3.833 0.020 . 1 . . . . A 136 PHE HB3 . 34007 1 740 . 1 . 1 56 56 PHE HD1 H 1 7.036 0.020 . 1 . . . . A 136 PHE HD1 . 34007 1 741 . 1 . 1 56 56 PHE HD2 H 1 7.036 0.020 . 1 . . . . A 136 PHE HD2 . 34007 1 742 . 1 . 1 56 56 PHE HE1 H 1 7.161 0.020 . 1 . . . . A 136 PHE HE1 . 34007 1 743 . 1 . 1 56 56 PHE HE2 H 1 7.161 0.020 . 1 . . . . A 136 PHE HE2 . 34007 1 744 . 1 . 1 56 56 PHE C C 13 176.692 0.300 . 1 . . . . A 136 PHE C . 34007 1 745 . 1 . 1 56 56 PHE CA C 13 61.888 0.300 . 1 . . . . A 136 PHE CA . 34007 1 746 . 1 . 1 56 56 PHE CB C 13 39.605 0.300 . 1 . . . . A 136 PHE CB . 34007 1 747 . 1 . 1 56 56 PHE CD1 C 13 132.800 0.300 . 1 . . . . A 136 PHE CD1 . 34007 1 748 . 1 . 1 56 56 PHE CE1 C 13 130.281 0.300 . 1 . . . . A 136 PHE CE1 . 34007 1 749 . 1 . 1 56 56 PHE N N 15 119.452 0.300 . 1 . . . . A 136 PHE N . 34007 1 750 . 1 . 1 57 57 VAL H H 1 8.222 0.020 . 1 . . . . A 137 VAL H . 34007 1 751 . 1 . 1 57 57 VAL HA H 1 3.556 0.020 . 1 . . . . A 137 VAL HA . 34007 1 752 . 1 . 1 57 57 VAL HB H 1 2.111 0.020 . 1 . . . . A 137 VAL HB . 34007 1 753 . 1 . 1 57 57 VAL HG11 H 1 1.004 0.020 . 2 . . . . A 137 VAL HG11 . 34007 1 754 . 1 . 1 57 57 VAL HG12 H 1 1.004 0.020 . 2 . . . . A 137 VAL HG12 . 34007 1 755 . 1 . 1 57 57 VAL HG13 H 1 1.004 0.020 . 2 . . . . A 137 VAL HG13 . 34007 1 756 . 1 . 1 57 57 VAL HG21 H 1 1.207 0.020 . 2 . . . . A 137 VAL HG21 . 34007 1 757 . 1 . 1 57 57 VAL HG22 H 1 1.207 0.020 . 2 . . . . A 137 VAL HG22 . 34007 1 758 . 1 . 1 57 57 VAL HG23 H 1 1.207 0.020 . 2 . . . . A 137 VAL HG23 . 34007 1 759 . 1 . 1 57 57 VAL C C 13 177.457 0.300 . 1 . . . . A 137 VAL C . 34007 1 760 . 1 . 1 57 57 VAL CA C 13 67.205 0.300 . 1 . . . . A 137 VAL CA . 34007 1 761 . 1 . 1 57 57 VAL CB C 13 31.887 0.300 . 1 . . . . A 137 VAL CB . 34007 1 762 . 1 . 1 57 57 VAL CG1 C 13 21.414 0.300 . 1 . . . . A 137 VAL CG1 . 34007 1 763 . 1 . 1 57 57 VAL CG2 C 13 23.731 0.300 . 1 . . . . A 137 VAL CG2 . 34007 1 764 . 1 . 1 57 57 VAL N N 15 120.768 0.300 . 1 . . . . A 137 VAL N . 34007 1 765 . 1 . 1 58 58 GLU H H 1 7.931 0.020 . 1 . . . . A 138 GLU H . 34007 1 766 . 1 . 1 58 58 GLU HA H 1 4.082 0.020 . 1 . . . . A 138 GLU HA . 34007 1 767 . 1 . 1 58 58 GLU HB2 H 1 2.137 0.020 . 2 . . . . A 138 GLU HB2 . 34007 1 768 . 1 . 1 58 58 GLU HB3 H 1 2.137 0.020 . 2 . . . . A 138 GLU HB3 . 34007 1 769 . 1 . 1 58 58 GLU HG2 H 1 2.201 0.020 . 1 . . . . A 138 GLU HG2 . 34007 1 770 . 1 . 1 58 58 GLU HG3 H 1 2.359 0.020 . 1 . . . . A 138 GLU HG3 . 34007 1 771 . 1 . 1 58 58 GLU C C 13 179.332 0.300 . 1 . . . . A 138 GLU C . 34007 1 772 . 1 . 1 58 58 GLU CA C 13 59.387 0.300 . 1 . . . . A 138 GLU CA . 34007 1 773 . 1 . 1 58 58 GLU CB C 13 30.021 0.300 . 1 . . . . A 138 GLU CB . 34007 1 774 . 1 . 1 58 58 GLU CG C 13 36.492 0.300 . 1 . . . . A 138 GLU CG . 34007 1 775 . 1 . 1 58 58 GLU N N 15 118.427 0.300 . 1 . . . . A 138 GLU N . 34007 1 776 . 1 . 1 59 59 PHE H H 1 7.405 0.020 . 1 . . . . A 139 PHE H . 34007 1 777 . 1 . 1 59 59 PHE HA H 1 4.008 0.020 . 1 . . . . A 139 PHE HA . 34007 1 778 . 1 . 1 59 59 PHE HB2 H 1 3.066 0.020 . 1 . . . . A 139 PHE HB2 . 34007 1 779 . 1 . 1 59 59 PHE HB3 H 1 3.201 0.020 . 1 . . . . A 139 PHE HB3 . 34007 1 780 . 1 . 1 59 59 PHE HD1 H 1 6.534 0.020 . 1 . . . . A 139 PHE HD1 . 34007 1 781 . 1 . 1 59 59 PHE HD2 H 1 6.534 0.020 . 1 . . . . A 139 PHE HD2 . 34007 1 782 . 1 . 1 59 59 PHE HE1 H 1 6.873 0.020 . 1 . . . . A 139 PHE HE1 . 34007 1 783 . 1 . 1 59 59 PHE HE2 H 1 6.873 0.020 . 1 . . . . A 139 PHE HE2 . 34007 1 784 . 1 . 1 59 59 PHE C C 13 175.519 0.300 . 1 . . . . A 139 PHE C . 34007 1 785 . 1 . 1 59 59 PHE CA C 13 60.534 0.300 . 1 . . . . A 139 PHE CA . 34007 1 786 . 1 . 1 59 59 PHE CB C 13 39.352 0.300 . 1 . . . . A 139 PHE CB . 34007 1 787 . 1 . 1 59 59 PHE CD1 C 13 132.481 0.300 . 1 . . . . A 139 PHE CD1 . 34007 1 788 . 1 . 1 59 59 PHE CE1 C 13 130.196 0.300 . 1 . . . . A 139 PHE CE1 . 34007 1 789 . 1 . 1 59 59 PHE N N 15 120.772 0.300 . 1 . . . . A 139 PHE N . 34007 1 790 . 1 . 1 60 60 ALA H H 1 9.041 0.020 . 1 . . . . A 140 ALA H . 34007 1 791 . 1 . 1 60 60 ALA HA H 1 3.215 0.020 . 1 . . . . A 140 ALA HA . 34007 1 792 . 1 . 1 60 60 ALA HB1 H 1 1.268 0.020 . 1 . . . . A 140 ALA HB1 . 34007 1 793 . 1 . 1 60 60 ALA HB2 H 1 1.268 0.020 . 1 . . . . A 140 ALA HB2 . 34007 1 794 . 1 . 1 60 60 ALA HB3 H 1 1.268 0.020 . 1 . . . . A 140 ALA HB3 . 34007 1 795 . 1 . 1 60 60 ALA C C 13 178.665 0.300 . 1 . . . . A 140 ALA C . 34007 1 796 . 1 . 1 60 60 ALA CA C 13 55.560 0.300 . 1 . . . . A 140 ALA CA . 34007 1 797 . 1 . 1 60 60 ALA CB C 13 17.825 0.300 . 1 . . . . A 140 ALA CB . 34007 1 798 . 1 . 1 60 60 ALA N N 15 126.246 0.300 . 1 . . . . A 140 ALA N . 34007 1 799 . 1 . 1 61 61 ASP H H 1 8.549 0.020 . 1 . . . . A 141 ASP H . 34007 1 800 . 1 . 1 61 61 ASP HA H 1 4.245 0.020 . 1 . . . . A 141 ASP HA . 34007 1 801 . 1 . 1 61 61 ASP HB2 H 1 2.537 0.020 . 1 . . . . A 141 ASP HB2 . 34007 1 802 . 1 . 1 61 61 ASP HB3 H 1 2.697 0.020 . 1 . . . . A 141 ASP HB3 . 34007 1 803 . 1 . 1 61 61 ASP C C 13 179.110 0.300 . 1 . . . . A 141 ASP C . 34007 1 804 . 1 . 1 61 61 ASP CA C 13 57.300 0.300 . 1 . . . . A 141 ASP CA . 34007 1 805 . 1 . 1 61 61 ASP CB C 13 40.215 0.300 . 1 . . . . A 141 ASP CB . 34007 1 806 . 1 . 1 61 61 ASP N N 15 117.186 0.300 . 1 . . . . A 141 ASP N . 34007 1 807 . 1 . 1 62 62 CYS H H 1 7.751 0.020 . 1 . . . . A 142 CYS H . 34007 1 808 . 1 . 1 62 62 CYS HA H 1 4.030 0.020 . 1 . . . . A 142 CYS HA . 34007 1 809 . 1 . 1 62 62 CYS HB2 H 1 2.848 0.020 . 1 . . . . A 142 CYS HB2 . 34007 1 810 . 1 . 1 62 62 CYS HB3 H 1 3.086 0.020 . 1 . . . . A 142 CYS HB3 . 34007 1 811 . 1 . 1 62 62 CYS HG H 1 1.824 0.020 . 1 . . . . A 142 CYS HG . 34007 1 812 . 1 . 1 62 62 CYS C C 13 177.785 0.300 . 1 . . . . A 142 CYS C . 34007 1 813 . 1 . 1 62 62 CYS CA C 13 62.111 0.300 . 1 . . . . A 142 CYS CA . 34007 1 814 . 1 . 1 62 62 CYS CB C 13 26.174 0.300 . 1 . . . . A 142 CYS CB . 34007 1 815 . 1 . 1 62 62 CYS N N 15 120.722 0.300 . 1 . . . . A 142 CYS N . 34007 1 816 . 1 . 1 63 63 CYS H H 1 8.101 0.020 . 1 . . . . A 143 CYS H . 34007 1 817 . 1 . 1 63 63 CYS HA H 1 3.725 0.020 . 1 . . . . A 143 CYS HA . 34007 1 818 . 1 . 1 63 63 CYS HB2 H 1 2.724 0.020 . 2 . . . . A 143 CYS HB2 . 34007 1 819 . 1 . 1 63 63 CYS HB3 H 1 2.724 0.020 . 2 . . . . A 143 CYS HB3 . 34007 1 820 . 1 . 1 63 63 CYS HG H 1 1.224 0.020 . 1 . . . . A 143 CYS HG . 34007 1 821 . 1 . 1 63 63 CYS C C 13 177.394 0.300 . 1 . . . . A 143 CYS C . 34007 1 822 . 1 . 1 63 63 CYS CA C 13 64.781 0.300 . 1 . . . . A 143 CYS CA . 34007 1 823 . 1 . 1 63 63 CYS CB C 13 27.184 0.300 . 1 . . . . A 143 CYS CB . 34007 1 824 . 1 . 1 63 63 CYS N N 15 116.208 0.300 . 1 . . . . A 143 CYS N . 34007 1 825 . 1 . 1 64 64 LEU H H 1 8.366 0.020 . 1 . . . . A 144 LEU H . 34007 1 826 . 1 . 1 64 64 LEU HA H 1 3.780 0.020 . 1 . . . . A 144 LEU HA . 34007 1 827 . 1 . 1 64 64 LEU HB2 H 1 1.483 0.020 . 1 . . . . A 144 LEU HB2 . 34007 1 828 . 1 . 1 64 64 LEU HB3 H 1 1.774 0.020 . 1 . . . . A 144 LEU HB3 . 34007 1 829 . 1 . 1 64 64 LEU HG H 1 1.720 0.020 . 1 . . . . A 144 LEU HG . 34007 1 830 . 1 . 1 64 64 LEU HD11 H 1 0.768 0.020 . 2 . . . . A 144 LEU HD11 . 34007 1 831 . 1 . 1 64 64 LEU HD12 H 1 0.768 0.020 . 2 . . . . A 144 LEU HD12 . 34007 1 832 . 1 . 1 64 64 LEU HD13 H 1 0.768 0.020 . 2 . . . . A 144 LEU HD13 . 34007 1 833 . 1 . 1 64 64 LEU HD21 H 1 0.835 0.020 . 2 . . . . A 144 LEU HD21 . 34007 1 834 . 1 . 1 64 64 LEU HD22 H 1 0.835 0.020 . 2 . . . . A 144 LEU HD22 . 34007 1 835 . 1 . 1 64 64 LEU HD23 H 1 0.835 0.020 . 2 . . . . A 144 LEU HD23 . 34007 1 836 . 1 . 1 64 64 LEU C C 13 178.594 0.300 . 1 . . . . A 144 LEU C . 34007 1 837 . 1 . 1 64 64 LEU CA C 13 58.243 0.300 . 1 . . . . A 144 LEU CA . 34007 1 838 . 1 . 1 64 64 LEU CB C 13 40.881 0.300 . 1 . . . . A 144 LEU CB . 34007 1 839 . 1 . 1 64 64 LEU CG C 13 27.066 0.300 . 1 . . . . A 144 LEU CG . 34007 1 840 . 1 . 1 64 64 LEU CD1 C 13 22.566 0.300 . 1 . . . . A 144 LEU CD1 . 34007 1 841 . 1 . 1 64 64 LEU CD2 C 13 25.283 0.300 . 1 . . . . A 144 LEU CD2 . 34007 1 842 . 1 . 1 64 64 LEU N N 15 119.301 0.300 . 1 . . . . A 144 LEU N . 34007 1 843 . 1 . 1 65 65 GLY H H 1 7.639 0.020 . 1 . . . . A 145 GLY H . 34007 1 844 . 1 . 1 65 65 GLY HA2 H 1 3.853 0.020 . 2 . . . . A 145 GLY HA2 . 34007 1 845 . 1 . 1 65 65 GLY HA3 H 1 3.853 0.020 . 2 . . . . A 145 GLY HA3 . 34007 1 846 . 1 . 1 65 65 GLY C C 13 175.164 0.300 . 1 . . . . A 145 GLY C . 34007 1 847 . 1 . 1 65 65 GLY CA C 13 46.361 0.300 . 1 . . . . A 145 GLY CA . 34007 1 848 . 1 . 1 65 65 GLY N N 15 103.551 0.300 . 1 . . . . A 145 GLY N . 34007 1 849 . 1 . 1 66 66 ILE H H 1 7.358 0.020 . 1 . . . . A 146 ILE H . 34007 1 850 . 1 . 1 66 66 ILE HA H 1 3.900 0.020 . 1 . . . . A 146 ILE HA . 34007 1 851 . 1 . 1 66 66 ILE HB H 1 1.843 0.020 . 1 . . . . A 146 ILE HB . 34007 1 852 . 1 . 1 66 66 ILE HG12 H 1 1.005 0.020 . 1 . . . . A 146 ILE HG12 . 34007 1 853 . 1 . 1 66 66 ILE HG13 H 1 1.890 0.020 . 1 . . . . A 146 ILE HG13 . 34007 1 854 . 1 . 1 66 66 ILE HG21 H 1 0.727 0.020 . 1 . . . . A 146 ILE HG21 . 34007 1 855 . 1 . 1 66 66 ILE HG22 H 1 0.727 0.020 . 1 . . . . A 146 ILE HG22 . 34007 1 856 . 1 . 1 66 66 ILE HG23 H 1 0.727 0.020 . 1 . . . . A 146 ILE HG23 . 34007 1 857 . 1 . 1 66 66 ILE HD11 H 1 1.003 0.020 . 1 . . . . A 146 ILE HD11 . 34007 1 858 . 1 . 1 66 66 ILE HD12 H 1 1.003 0.020 . 1 . . . . A 146 ILE HD12 . 34007 1 859 . 1 . 1 66 66 ILE HD13 H 1 1.003 0.020 . 1 . . . . A 146 ILE HD13 . 34007 1 860 . 1 . 1 66 66 ILE C C 13 177.892 0.300 . 1 . . . . A 146 ILE C . 34007 1 861 . 1 . 1 66 66 ILE CA C 13 63.912 0.300 . 1 . . . . A 146 ILE CA . 34007 1 862 . 1 . 1 66 66 ILE CB C 13 39.186 0.300 . 1 . . . . A 146 ILE CB . 34007 1 863 . 1 . 1 66 66 ILE CG1 C 13 28.756 0.300 . 1 . . . . A 146 ILE CG1 . 34007 1 864 . 1 . 1 66 66 ILE CG2 C 13 17.932 0.300 . 1 . . . . A 146 ILE CG2 . 34007 1 865 . 1 . 1 66 66 ILE CD1 C 13 16.086 0.300 . 1 . . . . A 146 ILE CD1 . 34007 1 866 . 1 . 1 66 66 ILE N N 15 118.997 0.300 . 1 . . . . A 146 ILE N . 34007 1 867 . 1 . 1 67 67 VAL H H 1 7.995 0.020 . 1 . . . . A 147 VAL H . 34007 1 868 . 1 . 1 67 67 VAL HA H 1 4.140 0.020 . 1 . . . . A 147 VAL HA . 34007 1 869 . 1 . 1 67 67 VAL HB H 1 2.172 0.020 . 1 . . . . A 147 VAL HB . 34007 1 870 . 1 . 1 67 67 VAL HG11 H 1 0.782 0.020 . 2 . . . . A 147 VAL HG11 . 34007 1 871 . 1 . 1 67 67 VAL HG12 H 1 0.782 0.020 . 2 . . . . A 147 VAL HG12 . 34007 1 872 . 1 . 1 67 67 VAL HG13 H 1 0.782 0.020 . 2 . . . . A 147 VAL HG13 . 34007 1 873 . 1 . 1 67 67 VAL HG21 H 1 0.885 0.020 . 2 . . . . A 147 VAL HG21 . 34007 1 874 . 1 . 1 67 67 VAL HG22 H 1 0.885 0.020 . 2 . . . . A 147 VAL HG22 . 34007 1 875 . 1 . 1 67 67 VAL HG23 H 1 0.885 0.020 . 2 . . . . A 147 VAL HG23 . 34007 1 876 . 1 . 1 67 67 VAL C C 13 175.466 0.300 . 1 . . . . A 147 VAL C . 34007 1 877 . 1 . 1 67 67 VAL CA C 13 63.105 0.300 . 1 . . . . A 147 VAL CA . 34007 1 878 . 1 . 1 67 67 VAL CB C 13 32.151 0.300 . 1 . . . . A 147 VAL CB . 34007 1 879 . 1 . 1 67 67 VAL CG1 C 13 19.651 0.300 . 1 . . . . A 147 VAL CG1 . 34007 1 880 . 1 . 1 67 67 VAL CG2 C 13 21.786 0.300 . 1 . . . . A 147 VAL CG2 . 34007 1 881 . 1 . 1 67 67 VAL N N 15 110.817 0.300 . 1 . . . . A 147 VAL N . 34007 1 882 . 1 . 1 68 68 GLU H H 1 7.995 0.020 . 1 . . . . A 148 GLU H . 34007 1 883 . 1 . 1 68 68 GLU HA H 1 4.704 0.020 . 1 . . . . A 148 GLU HA . 34007 1 884 . 1 . 1 68 68 GLU HB2 H 1 1.964 0.020 . 1 . . . . A 148 GLU HB2 . 34007 1 885 . 1 . 1 68 68 GLU HB3 H 1 2.055 0.020 . 1 . . . . A 148 GLU HB3 . 34007 1 886 . 1 . 1 68 68 GLU HG2 H 1 2.236 0.020 . 2 . . . . A 148 GLU HG2 . 34007 1 887 . 1 . 1 68 68 GLU HG3 H 1 2.236 0.020 . 2 . . . . A 148 GLU HG3 . 34007 1 888 . 1 . 1 68 68 GLU CA C 13 54.457 0.300 . 1 . . . . A 148 GLU CA . 34007 1 889 . 1 . 1 68 68 GLU CB C 13 29.710 0.300 . 1 . . . . A 148 GLU CB . 34007 1 890 . 1 . 1 68 68 GLU CG C 13 36.582 0.300 . 1 . . . . A 148 GLU CG . 34007 1 891 . 1 . 1 68 68 GLU N N 15 121.657 0.300 . 1 . . . . A 148 GLU N . 34007 1 892 . 1 . 1 69 69 PRO HA H 1 4.454 0.020 . 1 . . . . A 149 PRO HA . 34007 1 893 . 1 . 1 69 69 PRO HB2 H 1 1.960 0.020 . 1 . . . . A 149 PRO HB2 . 34007 1 894 . 1 . 1 69 69 PRO HB3 H 1 2.329 0.020 . 1 . . . . A 149 PRO HB3 . 34007 1 895 . 1 . 1 69 69 PRO HG2 H 1 1.967 0.020 . 2 . . . . A 149 PRO HG2 . 34007 1 896 . 1 . 1 69 69 PRO HG3 H 1 1.967 0.020 . 2 . . . . A 149 PRO HG3 . 34007 1 897 . 1 . 1 69 69 PRO HD2 H 1 3.448 0.020 . 1 . . . . A 149 PRO HD2 . 34007 1 898 . 1 . 1 69 69 PRO HD3 H 1 3.528 0.020 . 1 . . . . A 149 PRO HD3 . 34007 1 899 . 1 . 1 69 69 PRO C C 13 177.581 0.300 . 1 . . . . A 149 PRO C . 34007 1 900 . 1 . 1 69 69 PRO CA C 13 63.498 0.300 . 1 . . . . A 149 PRO CA . 34007 1 901 . 1 . 1 69 69 PRO CB C 13 32.144 0.300 . 1 . . . . A 149 PRO CB . 34007 1 902 . 1 . 1 69 69 PRO CG C 13 27.147 0.300 . 1 . . . . A 149 PRO CG . 34007 1 903 . 1 . 1 69 69 PRO CD C 13 50.262 0.300 . 1 . . . . A 149 PRO CD . 34007 1 904 . 1 . 1 70 70 SER H H 1 8.462 0.020 . 1 . . . . A 150 SER H . 34007 1 905 . 1 . 1 70 70 SER HA H 1 4.434 0.020 . 1 . . . . A 150 SER HA . 34007 1 906 . 1 . 1 70 70 SER HB2 H 1 3.894 0.020 . 2 . . . . A 150 SER HB2 . 34007 1 907 . 1 . 1 70 70 SER HB3 H 1 3.894 0.020 . 2 . . . . A 150 SER HB3 . 34007 1 908 . 1 . 1 70 70 SER C C 13 174.790 0.300 . 1 . . . . A 150 SER C . 34007 1 909 . 1 . 1 70 70 SER CA C 13 58.454 0.300 . 1 . . . . A 150 SER CA . 34007 1 910 . 1 . 1 70 70 SER CB C 13 63.984 0.300 . 1 . . . . A 150 SER CB . 34007 1 911 . 1 . 1 70 70 SER N N 15 116.021 0.300 . 1 . . . . A 150 SER N . 34007 1 912 . 1 . 1 71 71 GLN H H 1 8.480 0.020 . 1 . . . . A 151 GLN H . 34007 1 913 . 1 . 1 71 71 GLN HA H 1 4.392 0.020 . 1 . . . . A 151 GLN HA . 34007 1 914 . 1 . 1 71 71 GLN HB2 H 1 1.995 0.020 . 1 . . . . A 151 GLN HB2 . 34007 1 915 . 1 . 1 71 71 GLN HB3 H 1 2.151 0.020 . 1 . . . . A 151 GLN HB3 . 34007 1 916 . 1 . 1 71 71 GLN HG2 H 1 2.363 0.020 . 2 . . . . A 151 GLN HG2 . 34007 1 917 . 1 . 1 71 71 GLN HG3 H 1 2.363 0.020 . 2 . . . . A 151 GLN HG3 . 34007 1 918 . 1 . 1 71 71 GLN HE21 H 1 6.855 0.020 . 1 . . . . A 151 GLN HE21 . 34007 1 919 . 1 . 1 71 71 GLN HE22 H 1 7.569 0.020 . 1 . . . . A 151 GLN HE22 . 34007 1 920 . 1 . 1 71 71 GLN C C 13 175.590 0.300 . 1 . . . . A 151 GLN C . 34007 1 921 . 1 . 1 71 71 GLN CA C 13 55.711 0.300 . 1 . . . . A 151 GLN CA . 34007 1 922 . 1 . 1 71 71 GLN CB C 13 29.524 0.300 . 1 . . . . A 151 GLN CB . 34007 1 923 . 1 . 1 71 71 GLN CG C 13 33.800 0.300 . 1 . . . . A 151 GLN CG . 34007 1 924 . 1 . 1 71 71 GLN CD C 13 180.517 0.300 . 1 . . . . A 151 GLN CD . 34007 1 925 . 1 . 1 71 71 GLN N N 15 122.220 0.300 . 1 . . . . A 151 GLN N . 34007 1 926 . 1 . 1 71 71 GLN NE2 N 15 112.638 0.300 . 1 . . . . A 151 GLN NE2 . 34007 1 927 . 1 . 1 72 72 ASN H H 1 8.480 0.020 . 1 . . . . A 152 ASN H . 34007 1 928 . 1 . 1 72 72 ASN HA H 1 4.717 0.020 . 1 . . . . A 152 ASN HA . 34007 1 929 . 1 . 1 72 72 ASN HB2 H 1 2.734 0.020 . 1 . . . . A 152 ASN HB2 . 34007 1 930 . 1 . 1 72 72 ASN HB3 H 1 2.839 0.020 . 1 . . . . A 152 ASN HB3 . 34007 1 931 . 1 . 1 72 72 ASN HD21 H 1 6.951 0.020 . 1 . . . . A 152 ASN HD21 . 34007 1 932 . 1 . 1 72 72 ASN HD22 H 1 7.623 0.020 . 1 . . . . A 152 ASN HD22 . 34007 1 933 . 1 . 1 72 72 ASN C C 13 175.084 0.300 . 1 . . . . A 152 ASN C . 34007 1 934 . 1 . 1 72 72 ASN CA C 13 53.391 0.300 . 1 . . . . A 152 ASN CA . 34007 1 935 . 1 . 1 72 72 ASN CB C 13 39.358 0.300 . 1 . . . . A 152 ASN CB . 34007 1 936 . 1 . 1 72 72 ASN CG C 13 176.997 0.300 . 1 . . . . A 152 ASN CG . 34007 1 937 . 1 . 1 72 72 ASN N N 15 119.885 0.300 . 1 . . . . A 152 ASN N . 34007 1 938 . 1 . 1 72 72 ASN ND2 N 15 113.275 0.300 . 1 . . . . A 152 ASN ND2 . 34007 1 939 . 1 . 1 73 73 GLU H H 1 8.475 0.020 . 1 . . . . A 153 GLU H . 34007 1 940 . 1 . 1 73 73 GLU HA H 1 4.339 0.020 . 1 . . . . A 153 GLU HA . 34007 1 941 . 1 . 1 73 73 GLU HB2 H 1 1.955 0.020 . 1 . . . . A 153 GLU HB2 . 34007 1 942 . 1 . 1 73 73 GLU HB3 H 1 2.102 0.020 . 1 . . . . A 153 GLU HB3 . 34007 1 943 . 1 . 1 73 73 GLU HG2 H 1 2.287 0.020 . 2 . . . . A 153 GLU HG2 . 34007 1 944 . 1 . 1 73 73 GLU HG3 H 1 2.287 0.020 . 2 . . . . A 153 GLU HG3 . 34007 1 945 . 1 . 1 73 73 GLU C C 13 176.363 0.300 . 1 . . . . A 153 GLU C . 34007 1 946 . 1 . 1 73 73 GLU CA C 13 56.582 0.300 . 1 . . . . A 153 GLU CA . 34007 1 947 . 1 . 1 73 73 GLU CB C 13 30.332 0.300 . 1 . . . . A 153 GLU CB . 34007 1 948 . 1 . 1 73 73 GLU CG C 13 36.303 0.300 . 1 . . . . A 153 GLU CG . 34007 1 949 . 1 . 1 73 73 GLU N N 15 121.512 0.300 . 1 . . . . A 153 GLU N . 34007 1 950 . 1 . 1 74 74 GLU H H 1 8.457 0.020 . 1 . . . . A 154 GLU H . 34007 1 951 . 1 . 1 74 74 GLU HA H 1 4.366 0.020 . 1 . . . . A 154 GLU HA . 34007 1 952 . 1 . 1 74 74 GLU HB2 H 1 1.955 0.020 . 1 . . . . A 154 GLU HB2 . 34007 1 953 . 1 . 1 74 74 GLU HB3 H 1 2.116 0.020 . 1 . . . . A 154 GLU HB3 . 34007 1 954 . 1 . 1 74 74 GLU HG2 H 1 2.274 0.020 . 2 . . . . A 154 GLU HG2 . 34007 1 955 . 1 . 1 74 74 GLU HG3 H 1 2.274 0.020 . 2 . . . . A 154 GLU HG3 . 34007 1 956 . 1 . 1 74 74 GLU C C 13 175.706 0.300 . 1 . . . . A 154 GLU C . 34007 1 957 . 1 . 1 74 74 GLU CA C 13 56.514 0.300 . 1 . . . . A 154 GLU CA . 34007 1 958 . 1 . 1 74 74 GLU CB C 13 30.277 0.300 . 1 . . . . A 154 GLU CB . 34007 1 959 . 1 . 1 74 74 GLU CG C 13 36.303 0.300 . 1 . . . . A 154 GLU CG . 34007 1 960 . 1 . 1 74 74 GLU N N 15 122.278 0.300 . 1 . . . . A 154 GLU N . 34007 1 961 . 1 . 1 75 75 SER H H 1 8.014 0.020 . 1 . . . . A 155 SER H . 34007 1 962 . 1 . 1 75 75 SER HA H 1 4.269 0.020 . 1 . . . . A 155 SER HA . 34007 1 963 . 1 . 1 75 75 SER HB2 H 1 3.857 0.020 . 2 . . . . A 155 SER HB2 . 34007 1 964 . 1 . 1 75 75 SER HB3 H 1 3.857 0.020 . 2 . . . . A 155 SER HB3 . 34007 1 965 . 1 . 1 75 75 SER CA C 13 60.063 0.300 . 1 . . . . A 155 SER CA . 34007 1 966 . 1 . 1 75 75 SER CB C 13 64.911 0.300 . 1 . . . . A 155 SER CB . 34007 1 967 . 1 . 1 75 75 SER N N 15 122.682 0.300 . 1 . . . . A 155 SER N . 34007 1 968 . 2 . 2 1 1 ASP HA H 1 4.772 0.020 . 1 . . . . B 462 ASP HA . 34007 1 969 . 2 . 2 1 1 ASP HB2 H 1 2.733 0.020 . 1 . . . . B 462 ASP HB2 . 34007 1 970 . 2 . 2 1 1 ASP HB3 H 1 2.830 0.020 . 1 . . . . B 462 ASP HB3 . 34007 1 971 . 2 . 2 1 1 ASP C C 13 176.470 0.300 . 1 . . . . B 462 ASP C . 34007 1 972 . 2 . 2 1 1 ASP CA C 13 53.740 0.300 . 1 . . . . B 462 ASP CA . 34007 1 973 . 2 . 2 1 1 ASP CB C 13 41.949 0.300 . 1 . . . . B 462 ASP CB . 34007 1 974 . 2 . 2 2 2 ILE H H 1 8.582 0.020 . 1 . . . . B 463 ILE H . 34007 1 975 . 2 . 2 2 2 ILE HA H 1 4.067 0.020 . 1 . . . . B 463 ILE HA . 34007 1 976 . 2 . 2 2 2 ILE HB H 1 1.973 0.020 . 1 . . . . B 463 ILE HB . 34007 1 977 . 2 . 2 2 2 ILE HG12 H 1 1.312 0.020 . 1 . . . . B 463 ILE HG12 . 34007 1 978 . 2 . 2 2 2 ILE HG13 H 1 1.528 0.020 . 1 . . . . B 463 ILE HG13 . 34007 1 979 . 2 . 2 2 2 ILE HG21 H 1 0.982 0.020 . 1 . . . . B 463 ILE HG21 . 34007 1 980 . 2 . 2 2 2 ILE HG22 H 1 0.982 0.020 . 1 . . . . B 463 ILE HG22 . 34007 1 981 . 2 . 2 2 2 ILE HG23 H 1 0.982 0.020 . 1 . . . . B 463 ILE HG23 . 34007 1 982 . 2 . 2 2 2 ILE HD11 H 1 0.936 0.020 . 1 . . . . B 463 ILE HD11 . 34007 1 983 . 2 . 2 2 2 ILE HD12 H 1 0.936 0.020 . 1 . . . . B 463 ILE HD12 . 34007 1 984 . 2 . 2 2 2 ILE HD13 H 1 0.936 0.020 . 1 . . . . B 463 ILE HD13 . 34007 1 985 . 2 . 2 2 2 ILE C C 13 176.905 0.300 . 1 . . . . B 463 ILE C . 34007 1 986 . 2 . 2 2 2 ILE CA C 13 63.269 0.300 . 1 . . . . B 463 ILE CA . 34007 1 987 . 2 . 2 2 2 ILE CB C 13 38.369 0.300 . 1 . . . . B 463 ILE CB . 34007 1 988 . 2 . 2 2 2 ILE CG1 C 13 28.258 0.300 . 1 . . . . B 463 ILE CG1 . 34007 1 989 . 2 . 2 2 2 ILE CG2 C 13 17.870 0.300 . 1 . . . . B 463 ILE CG2 . 34007 1 990 . 2 . 2 2 2 ILE CD1 C 13 13.751 0.300 . 1 . . . . B 463 ILE CD1 . 34007 1 991 . 2 . 2 2 2 ILE N N 15 124.477 0.300 . 1 . . . . B 463 ILE N . 34007 1 992 . 2 . 2 3 3 ARG H H 1 8.284 0.020 . 1 . . . . B 464 ARG H . 34007 1 993 . 2 . 2 3 3 ARG HA H 1 4.003 0.020 . 1 . . . . B 464 ARG HA . 34007 1 994 . 2 . 2 3 3 ARG HB2 H 1 1.893 0.020 . 2 . . . . B 464 ARG HB2 . 34007 1 995 . 2 . 2 3 3 ARG HB3 H 1 1.893 0.020 . 2 . . . . B 464 ARG HB3 . 34007 1 996 . 2 . 2 3 3 ARG HG2 H 1 1.602 0.020 . 1 . . . . B 464 ARG HG2 . 34007 1 997 . 2 . 2 3 3 ARG HG3 H 1 1.717 0.020 . 1 . . . . B 464 ARG HG3 . 34007 1 998 . 2 . 2 3 3 ARG HD2 H 1 3.251 0.020 . 2 . . . . B 464 ARG HD2 . 34007 1 999 . 2 . 2 3 3 ARG HD3 H 1 3.251 0.020 . 2 . . . . B 464 ARG HD3 . 34007 1 1000 . 2 . 2 3 3 ARG C C 13 178.292 0.300 . 1 . . . . B 464 ARG C . 34007 1 1001 . 2 . 2 3 3 ARG CA C 13 59.200 0.300 . 1 . . . . B 464 ARG CA . 34007 1 1002 . 2 . 2 3 3 ARG CB C 13 29.648 0.300 . 1 . . . . B 464 ARG CB . 34007 1 1003 . 2 . 2 3 3 ARG CG C 13 27.375 0.300 . 1 . . . . B 464 ARG CG . 34007 1 1004 . 2 . 2 3 3 ARG CD C 13 43.457 0.300 . 1 . . . . B 464 ARG CD . 34007 1 1005 . 2 . 2 3 3 ARG N N 15 121.849 0.300 . 1 . . . . B 464 ARG N . 34007 1 1006 . 2 . 2 4 4 HIS H H 1 8.073 0.020 . 1 . . . . B 465 HIS H . 34007 1 1007 . 2 . 2 4 4 HIS HA H 1 4.465 0.020 . 1 . . . . B 465 HIS HA . 34007 1 1008 . 2 . 2 4 4 HIS HB2 H 1 3.271 0.020 . 2 . . . . B 465 HIS HB2 . 34007 1 1009 . 2 . 2 4 4 HIS HB3 H 1 3.271 0.020 . 2 . . . . B 465 HIS HB3 . 34007 1 1010 . 2 . 2 4 4 HIS HD2 H 1 7.214 0.020 . 1 . . . . B 465 HIS HD2 . 34007 1 1011 . 2 . 2 4 4 HIS HE1 H 1 8.317 0.020 . 1 . . . . B 465 HIS HE1 . 34007 1 1012 . 2 . 2 4 4 HIS C C 13 176.443 0.300 . 1 . . . . B 465 HIS C . 34007 1 1013 . 2 . 2 4 4 HIS CA C 13 58.794 0.300 . 1 . . . . B 465 HIS CA . 34007 1 1014 . 2 . 2 4 4 HIS CB C 13 29.259 0.300 . 1 . . . . B 465 HIS CB . 34007 1 1015 . 2 . 2 4 4 HIS CD2 C 13 120.122 0.300 . 1 . . . . B 465 HIS CD2 . 34007 1 1016 . 2 . 2 4 4 HIS CE1 C 13 137.339 0.300 . 1 . . . . B 465 HIS CE1 . 34007 1 1017 . 2 . 2 4 4 HIS N N 15 118.111 0.300 . 1 . . . . B 465 HIS N . 34007 1 1018 . 2 . 2 4 4 HIS ND1 N 15 192.735 0.300 . 1 . . . . B 465 HIS ND1 . 34007 1 1019 . 2 . 2 4 4 HIS NE2 N 15 180.872 0.300 . 1 . . . . B 465 HIS NE2 . 34007 1 1020 . 2 . 2 5 5 GLU H H 1 8.387 0.020 . 1 . . . . B 466 GLU H . 34007 1 1021 . 2 . 2 5 5 GLU HA H 1 3.839 0.020 . 1 . . . . B 466 GLU HA . 34007 1 1022 . 2 . 2 5 5 GLU HB2 H 1 2.102 0.020 . 2 . . . . B 466 GLU HB2 . 34007 1 1023 . 2 . 2 5 5 GLU HB3 H 1 2.102 0.020 . 2 . . . . B 466 GLU HB3 . 34007 1 1024 . 2 . 2 5 5 GLU HG2 H 1 2.234 0.020 . 1 . . . . B 466 GLU HG2 . 34007 1 1025 . 2 . 2 5 5 GLU HG3 H 1 2.382 0.020 . 1 . . . . B 466 GLU HG3 . 34007 1 1026 . 2 . 2 5 5 GLU C C 13 177.696 0.300 . 1 . . . . B 466 GLU C . 34007 1 1027 . 2 . 2 5 5 GLU CA C 13 59.696 0.300 . 1 . . . . B 466 GLU CA . 34007 1 1028 . 2 . 2 5 5 GLU CB C 13 29.371 0.300 . 1 . . . . B 466 GLU CB . 34007 1 1029 . 2 . 2 5 5 GLU CG C 13 36.680 0.300 . 1 . . . . B 466 GLU CG . 34007 1 1030 . 2 . 2 5 5 GLU N N 15 118.542 0.300 . 1 . . . . B 466 GLU N . 34007 1 1031 . 2 . 2 6 6 ARG H H 1 8.253 0.020 . 1 . . . . B 467 ARG H . 34007 1 1032 . 2 . 2 6 6 ARG HA H 1 3.960 0.020 . 1 . . . . B 467 ARG HA . 34007 1 1033 . 2 . 2 6 6 ARG HB2 H 1 2.004 0.020 . 2 . . . . B 467 ARG HB2 . 34007 1 1034 . 2 . 2 6 6 ARG HB3 H 1 2.004 0.020 . 2 . . . . B 467 ARG HB3 . 34007 1 1035 . 2 . 2 6 6 ARG HG2 H 1 1.640 0.020 . 1 . . . . B 467 ARG HG2 . 34007 1 1036 . 2 . 2 6 6 ARG HG3 H 1 1.835 0.020 . 1 . . . . B 467 ARG HG3 . 34007 1 1037 . 2 . 2 6 6 ARG HD2 H 1 3.142 0.020 . 1 . . . . B 467 ARG HD2 . 34007 1 1038 . 2 . 2 6 6 ARG HD3 H 1 3.249 0.020 . 1 . . . . B 467 ARG HD3 . 34007 1 1039 . 2 . 2 6 6 ARG C C 13 177.448 0.300 . 1 . . . . B 467 ARG C . 34007 1 1040 . 2 . 2 6 6 ARG CA C 13 59.722 0.300 . 1 . . . . B 467 ARG CA . 34007 1 1041 . 2 . 2 6 6 ARG CB C 13 30.208 0.300 . 1 . . . . B 467 ARG CB . 34007 1 1042 . 2 . 2 6 6 ARG CG C 13 27.930 0.300 . 1 . . . . B 467 ARG CG . 34007 1 1043 . 2 . 2 6 6 ARG CD C 13 43.826 0.300 . 1 . . . . B 467 ARG CD . 34007 1 1044 . 2 . 2 6 6 ARG N N 15 118.212 0.300 . 1 . . . . B 467 ARG N . 34007 1 1045 . 2 . 2 7 7 ASN H H 1 8.100 0.020 . 1 . . . . B 468 ASN H . 34007 1 1046 . 2 . 2 7 7 ASN HA H 1 4.531 0.020 . 1 . . . . B 468 ASN HA . 34007 1 1047 . 2 . 2 7 7 ASN HB2 H 1 2.853 0.020 . 1 . . . . B 468 ASN HB2 . 34007 1 1048 . 2 . 2 7 7 ASN HB3 H 1 2.984 0.020 . 1 . . . . B 468 ASN HB3 . 34007 1 1049 . 2 . 2 7 7 ASN HD21 H 1 7.028 0.020 . 1 . . . . B 468 ASN HD21 . 34007 1 1050 . 2 . 2 7 7 ASN HD22 H 1 7.915 0.020 . 1 . . . . B 468 ASN HD22 . 34007 1 1051 . 2 . 2 7 7 ASN C C 13 178.736 0.300 . 1 . . . . B 468 ASN C . 34007 1 1052 . 2 . 2 7 7 ASN CA C 13 56.282 0.300 . 1 . . . . B 468 ASN CA . 34007 1 1053 . 2 . 2 7 7 ASN CB C 13 38.276 0.300 . 1 . . . . B 468 ASN CB . 34007 1 1054 . 2 . 2 7 7 ASN CG C 13 175.992 0.300 . 1 . . . . B 468 ASN CG . 34007 1 1055 . 2 . 2 7 7 ASN N N 15 117.062 0.300 . 1 . . . . B 468 ASN N . 34007 1 1056 . 2 . 2 7 7 ASN ND2 N 15 113.404 0.300 . 1 . . . . B 468 ASN ND2 . 34007 1 1057 . 2 . 2 8 8 VAL H H 1 8.227 0.020 . 1 . . . . B 469 VAL H . 34007 1 1058 . 2 . 2 8 8 VAL HA H 1 3.574 0.020 . 1 . . . . B 469 VAL HA . 34007 1 1059 . 2 . 2 8 8 VAL HB H 1 2.026 0.020 . 1 . . . . B 469 VAL HB . 34007 1 1060 . 2 . 2 8 8 VAL HG11 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG11 . 34007 1 1061 . 2 . 2 8 8 VAL HG12 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG12 . 34007 1 1062 . 2 . 2 8 8 VAL HG13 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG13 . 34007 1 1063 . 2 . 2 8 8 VAL HG21 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG21 . 34007 1 1064 . 2 . 2 8 8 VAL HG22 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG22 . 34007 1 1065 . 2 . 2 8 8 VAL HG23 H 1 0.704 0.020 . 2 . . . . B 469 VAL HG23 . 34007 1 1066 . 2 . 2 8 8 VAL C C 13 178.861 0.300 . 1 . . . . B 469 VAL C . 34007 1 1067 . 2 . 2 8 8 VAL CA C 13 67.003 0.300 . 1 . . . . B 469 VAL CA . 34007 1 1068 . 2 . 2 8 8 VAL CB C 13 31.763 0.300 . 1 . . . . B 469 VAL CB . 34007 1 1069 . 2 . 2 8 8 VAL CG1 C 13 22.539 0.300 . 1 . . . . B 469 VAL CG1 . 34007 1 1070 . 2 . 2 8 8 VAL CG2 C 13 22.480 0.300 . 1 . . . . B 469 VAL CG2 . 34007 1 1071 . 2 . 2 8 8 VAL N N 15 121.645 0.300 . 1 . . . . B 469 VAL N . 34007 1 1072 . 2 . 2 9 9 ILE H H 1 8.566 0.020 . 1 . . . . B 470 ILE H . 34007 1 1073 . 2 . 2 9 9 ILE HA H 1 3.643 0.020 . 1 . . . . B 470 ILE HA . 34007 1 1074 . 2 . 2 9 9 ILE HB H 1 2.230 0.020 . 1 . . . . B 470 ILE HB . 34007 1 1075 . 2 . 2 9 9 ILE HG12 H 1 1.379 0.020 . 1 . . . . B 470 ILE HG12 . 34007 1 1076 . 2 . 2 9 9 ILE HG13 H 1 1.666 0.020 . 1 . . . . B 470 ILE HG13 . 34007 1 1077 . 2 . 2 9 9 ILE HG21 H 1 1.106 0.020 . 1 . . . . B 470 ILE HG21 . 34007 1 1078 . 2 . 2 9 9 ILE HG22 H 1 1.106 0.020 . 1 . . . . B 470 ILE HG22 . 34007 1 1079 . 2 . 2 9 9 ILE HG23 H 1 1.106 0.020 . 1 . . . . B 470 ILE HG23 . 34007 1 1080 . 2 . 2 9 9 ILE HD11 H 1 0.850 0.020 . 1 . . . . B 470 ILE HD11 . 34007 1 1081 . 2 . 2 9 9 ILE HD12 H 1 0.850 0.020 . 1 . . . . B 470 ILE HD12 . 34007 1 1082 . 2 . 2 9 9 ILE HD13 H 1 0.850 0.020 . 1 . . . . B 470 ILE HD13 . 34007 1 1083 . 2 . 2 9 9 ILE C C 13 178.621 0.300 . 1 . . . . B 470 ILE C . 34007 1 1084 . 2 . 2 9 9 ILE CA C 13 64.784 0.300 . 1 . . . . B 470 ILE CA . 34007 1 1085 . 2 . 2 9 9 ILE CB C 13 36.349 0.300 . 1 . . . . B 470 ILE CB . 34007 1 1086 . 2 . 2 9 9 ILE CG1 C 13 28.886 0.300 . 1 . . . . B 470 ILE CG1 . 34007 1 1087 . 2 . 2 9 9 ILE CG2 C 13 18.098 0.300 . 1 . . . . B 470 ILE CG2 . 34007 1 1088 . 2 . 2 9 9 ILE CD1 C 13 12.516 0.300 . 1 . . . . B 470 ILE CD1 . 34007 1 1089 . 2 . 2 9 9 ILE N N 15 121.209 0.300 . 1 . . . . B 470 ILE N . 34007 1 1090 . 2 . 2 10 10 LEU H H 1 8.672 0.020 . 1 . . . . B 471 LEU H . 34007 1 1091 . 2 . 2 10 10 LEU HA H 1 4.072 0.020 . 1 . . . . B 471 LEU HA . 34007 1 1092 . 2 . 2 10 10 LEU HB2 H 1 1.649 0.020 . 1 . . . . B 471 LEU HB2 . 34007 1 1093 . 2 . 2 10 10 LEU HB3 H 1 2.078 0.020 . 1 . . . . B 471 LEU HB3 . 34007 1 1094 . 2 . 2 10 10 LEU HG H 1 2.011 0.020 . 1 . . . . B 471 LEU HG . 34007 1 1095 . 2 . 2 10 10 LEU HD11 H 1 0.969 0.020 . 2 . . . . B 471 LEU HD11 . 34007 1 1096 . 2 . 2 10 10 LEU HD12 H 1 0.969 0.020 . 2 . . . . B 471 LEU HD12 . 34007 1 1097 . 2 . 2 10 10 LEU HD13 H 1 0.969 0.020 . 2 . . . . B 471 LEU HD13 . 34007 1 1098 . 2 . 2 10 10 LEU HD21 H 1 0.978 0.020 . 2 . . . . B 471 LEU HD21 . 34007 1 1099 . 2 . 2 10 10 LEU HD22 H 1 0.978 0.020 . 2 . . . . B 471 LEU HD22 . 34007 1 1100 . 2 . 2 10 10 LEU HD23 H 1 0.978 0.020 . 2 . . . . B 471 LEU HD23 . 34007 1 1101 . 2 . 2 10 10 LEU C C 13 180.043 0.300 . 1 . . . . B 471 LEU C . 34007 1 1102 . 2 . 2 10 10 LEU CA C 13 58.933 0.300 . 1 . . . . B 471 LEU CA . 34007 1 1103 . 2 . 2 10 10 LEU CB C 13 40.969 0.300 . 1 . . . . B 471 LEU CB . 34007 1 1104 . 2 . 2 10 10 LEU CG C 13 26.945 0.300 . 1 . . . . B 471 LEU CG . 34007 1 1105 . 2 . 2 10 10 LEU CD1 C 13 23.643 0.300 . 1 . . . . B 471 LEU CD1 . 34007 1 1106 . 2 . 2 10 10 LEU CD2 C 13 25.720 0.300 . 1 . . . . B 471 LEU CD2 . 34007 1 1107 . 2 . 2 10 10 LEU N N 15 119.732 0.300 . 1 . . . . B 471 LEU N . 34007 1 1108 . 2 . 2 11 11 GLN H H 1 7.898 0.020 . 1 . . . . B 472 GLN H . 34007 1 1109 . 2 . 2 11 11 GLN HA H 1 4.181 0.020 . 1 . . . . B 472 GLN HA . 34007 1 1110 . 2 . 2 11 11 GLN HB2 H 1 2.235 0.020 . 1 . . . . B 472 GLN HB2 . 34007 1 1111 . 2 . 2 11 11 GLN HB3 H 1 2.346 0.020 . 1 . . . . B 472 GLN HB3 . 34007 1 1112 . 2 . 2 11 11 GLN HG2 H 1 2.402 0.020 . 1 . . . . B 472 GLN HG2 . 34007 1 1113 . 2 . 2 11 11 GLN HG3 H 1 2.714 0.020 . 1 . . . . B 472 GLN HG3 . 34007 1 1114 . 2 . 2 11 11 GLN HE21 H 1 7.121 0.020 . 1 . . . . B 472 GLN HE21 . 34007 1 1115 . 2 . 2 11 11 GLN HE22 H 1 7.434 0.020 . 1 . . . . B 472 GLN HE22 . 34007 1 1116 . 2 . 2 11 11 GLN C C 13 179.723 0.300 . 1 . . . . B 472 GLN C . 34007 1 1117 . 2 . 2 11 11 GLN CA C 13 59.601 0.300 . 1 . . . . B 472 GLN CA . 34007 1 1118 . 2 . 2 11 11 GLN CB C 13 29.772 0.300 . 1 . . . . B 472 GLN CB . 34007 1 1119 . 2 . 2 11 11 GLN CG C 13 35.414 0.300 . 1 . . . . B 472 GLN CG . 34007 1 1120 . 2 . 2 11 11 GLN CD C 13 179.870 0.300 . 1 . . . . B 472 GLN CD . 34007 1 1121 . 2 . 2 11 11 GLN N N 15 118.640 0.300 . 1 . . . . B 472 GLN N . 34007 1 1122 . 2 . 2 11 11 GLN NE2 N 15 111.996 0.300 . 1 . . . . B 472 GLN NE2 . 34007 1 1123 . 2 . 2 12 12 CYS H H 1 8.326 0.020 . 1 . . . . B 473 CYS H . 34007 1 1124 . 2 . 2 12 12 CYS HA H 1 4.069 0.020 . 1 . . . . B 473 CYS HA . 34007 1 1125 . 2 . 2 12 12 CYS HB2 H 1 2.688 0.020 . 1 . . . . B 473 CYS HB2 . 34007 1 1126 . 2 . 2 12 12 CYS HB3 H 1 3.520 0.020 . 1 . . . . B 473 CYS HB3 . 34007 1 1127 . 2 . 2 12 12 CYS HG H 1 3.125 0.020 . 1 . . . . B 473 CYS HG . 34007 1 1128 . 2 . 2 12 12 CYS C C 13 176.408 0.300 . 1 . . . . B 473 CYS C . 34007 1 1129 . 2 . 2 12 12 CYS CA C 13 64.358 0.300 . 1 . . . . B 473 CYS CA . 34007 1 1130 . 2 . 2 12 12 CYS CB C 13 27.387 0.300 . 1 . . . . B 473 CYS CB . 34007 1 1131 . 2 . 2 12 12 CYS N N 15 119.363 0.300 . 1 . . . . B 473 CYS N . 34007 1 1132 . 2 . 2 13 13 VAL H H 1 8.932 0.020 . 1 . . . . B 474 VAL H . 34007 1 1133 . 2 . 2 13 13 VAL HA H 1 3.481 0.020 . 1 . . . . B 474 VAL HA . 34007 1 1134 . 2 . 2 13 13 VAL HB H 1 2.464 0.020 . 1 . . . . B 474 VAL HB . 34007 1 1135 . 2 . 2 13 13 VAL HG11 H 1 1.095 0.020 . 2 . . . . B 474 VAL HG11 . 34007 1 1136 . 2 . 2 13 13 VAL HG12 H 1 1.095 0.020 . 2 . . . . B 474 VAL HG12 . 34007 1 1137 . 2 . 2 13 13 VAL HG13 H 1 1.095 0.020 . 2 . . . . B 474 VAL HG13 . 34007 1 1138 . 2 . 2 13 13 VAL HG21 H 1 1.482 0.020 . 2 . . . . B 474 VAL HG21 . 34007 1 1139 . 2 . 2 13 13 VAL HG22 H 1 1.482 0.020 . 2 . . . . B 474 VAL HG22 . 34007 1 1140 . 2 . 2 13 13 VAL HG23 H 1 1.482 0.020 . 2 . . . . B 474 VAL HG23 . 34007 1 1141 . 2 . 2 13 13 VAL C C 13 176.097 0.300 . 1 . . . . B 474 VAL C . 34007 1 1142 . 2 . 2 13 13 VAL CA C 13 67.722 0.300 . 1 . . . . B 474 VAL CA . 34007 1 1143 . 2 . 2 13 13 VAL CB C 13 32.045 0.300 . 1 . . . . B 474 VAL CB . 34007 1 1144 . 2 . 2 13 13 VAL CG1 C 13 23.177 0.300 . 1 . . . . B 474 VAL CG1 . 34007 1 1145 . 2 . 2 13 13 VAL CG2 C 13 25.069 0.300 . 1 . . . . B 474 VAL CG2 . 34007 1 1146 . 2 . 2 13 13 VAL N N 15 119.149 0.300 . 1 . . . . B 474 VAL N . 34007 1 1147 . 2 . 2 14 14 ARG H H 1 8.009 0.020 . 1 . . . . B 475 ARG H . 34007 1 1148 . 2 . 2 14 14 ARG HA H 1 3.946 0.020 . 1 . . . . B 475 ARG HA . 34007 1 1149 . 2 . 2 14 14 ARG HB2 H 1 2.018 0.020 . 1 . . . . B 475 ARG HB2 . 34007 1 1150 . 2 . 2 14 14 ARG HB3 H 1 2.089 0.020 . 1 . . . . B 475 ARG HB3 . 34007 1 1151 . 2 . 2 14 14 ARG HG2 H 1 1.707 0.020 . 1 . . . . B 475 ARG HG2 . 34007 1 1152 . 2 . 2 14 14 ARG HG3 H 1 1.801 0.020 . 1 . . . . B 475 ARG HG3 . 34007 1 1153 . 2 . 2 14 14 ARG HD2 H 1 3.220 0.020 . 1 . . . . B 475 ARG HD2 . 34007 1 1154 . 2 . 2 14 14 ARG HD3 H 1 3.406 0.020 . 1 . . . . B 475 ARG HD3 . 34007 1 1155 . 2 . 2 14 14 ARG HE H 1 9.121 0.020 . 1 . . . . B 475 ARG HE . 34007 1 1156 . 2 . 2 14 14 ARG C C 13 177.528 0.300 . 1 . . . . B 475 ARG C . 34007 1 1157 . 2 . 2 14 14 ARG CA C 13 59.517 0.300 . 1 . . . . B 475 ARG CA . 34007 1 1158 . 2 . 2 14 14 ARG CB C 13 30.948 0.300 . 1 . . . . B 475 ARG CB . 34007 1 1159 . 2 . 2 14 14 ARG CG C 13 26.272 0.300 . 1 . . . . B 475 ARG CG . 34007 1 1160 . 2 . 2 14 14 ARG CD C 13 43.808 0.300 . 1 . . . . B 475 ARG CD . 34007 1 1161 . 2 . 2 14 14 ARG N N 15 118.034 0.300 . 1 . . . . B 475 ARG N . 34007 1 1162 . 2 . 2 14 14 ARG NE N 15 86.706 0.300 . 1 . . . . B 475 ARG NE . 34007 1 1163 . 2 . 2 15 15 TYR H H 1 7.791 0.020 . 1 . . . . B 476 TYR H . 34007 1 1164 . 2 . 2 15 15 TYR HA H 1 4.025 0.020 . 1 . . . . B 476 TYR HA . 34007 1 1165 . 2 . 2 15 15 TYR HB2 H 1 3.045 0.020 . 1 . . . . B 476 TYR HB2 . 34007 1 1166 . 2 . 2 15 15 TYR HB3 H 1 3.204 0.020 . 1 . . . . B 476 TYR HB3 . 34007 1 1167 . 2 . 2 15 15 TYR HD1 H 1 7.035 0.020 . 1 . . . . B 476 TYR HD1 . 34007 1 1168 . 2 . 2 15 15 TYR HD2 H 1 7.035 0.020 . 1 . . . . B 476 TYR HD2 . 34007 1 1169 . 2 . 2 15 15 TYR HE1 H 1 6.822 0.020 . 1 . . . . B 476 TYR HE1 . 34007 1 1170 . 2 . 2 15 15 TYR HE2 H 1 6.822 0.020 . 1 . . . . B 476 TYR HE2 . 34007 1 1171 . 2 . 2 15 15 TYR C C 13 176.186 0.300 . 1 . . . . B 476 TYR C . 34007 1 1172 . 2 . 2 15 15 TYR CA C 13 62.031 0.300 . 1 . . . . B 476 TYR CA . 34007 1 1173 . 2 . 2 15 15 TYR CB C 13 39.586 0.300 . 1 . . . . B 476 TYR CB . 34007 1 1174 . 2 . 2 15 15 TYR CD1 C 13 133.040 0.300 . 1 . . . . B 476 TYR CD1 . 34007 1 1175 . 2 . 2 15 15 TYR CE1 C 13 118.328 0.300 . 1 . . . . B 476 TYR CE1 . 34007 1 1176 . 2 . 2 15 15 TYR N N 15 118.488 0.300 . 1 . . . . B 476 TYR N . 34007 1 1177 . 2 . 2 16 16 ILE H H 1 8.174 0.020 . 1 . . . . B 477 ILE H . 34007 1 1178 . 2 . 2 16 16 ILE HA H 1 2.757 0.020 . 1 . . . . B 477 ILE HA . 34007 1 1179 . 2 . 2 16 16 ILE HB H 1 1.554 0.020 . 1 . . . . B 477 ILE HB . 34007 1 1180 . 2 . 2 16 16 ILE HG12 H 1 1.155 0.020 . 1 . . . . B 477 ILE HG12 . 34007 1 1181 . 2 . 2 16 16 ILE HG13 H 1 2.387 0.020 . 1 . . . . B 477 ILE HG13 . 34007 1 1182 . 2 . 2 16 16 ILE HG21 H 1 0.373 0.020 . 1 . . . . B 477 ILE HG21 . 34007 1 1183 . 2 . 2 16 16 ILE HG22 H 1 0.373 0.020 . 1 . . . . B 477 ILE HG22 . 34007 1 1184 . 2 . 2 16 16 ILE HG23 H 1 0.373 0.020 . 1 . . . . B 477 ILE HG23 . 34007 1 1185 . 2 . 2 16 16 ILE HD11 H 1 1.244 0.020 . 1 . . . . B 477 ILE HD11 . 34007 1 1186 . 2 . 2 16 16 ILE HD12 H 1 1.244 0.020 . 1 . . . . B 477 ILE HD12 . 34007 1 1187 . 2 . 2 16 16 ILE HD13 H 1 1.244 0.020 . 1 . . . . B 477 ILE HD13 . 34007 1 1188 . 2 . 2 16 16 ILE C C 13 178.070 0.300 . 1 . . . . B 477 ILE C . 34007 1 1189 . 2 . 2 16 16 ILE CA C 13 65.524 0.300 . 1 . . . . B 477 ILE CA . 34007 1 1190 . 2 . 2 16 16 ILE CB C 13 38.068 0.300 . 1 . . . . B 477 ILE CB . 34007 1 1191 . 2 . 2 16 16 ILE CG1 C 13 29.485 0.300 . 1 . . . . B 477 ILE CG1 . 34007 1 1192 . 2 . 2 16 16 ILE CG2 C 13 19.923 0.300 . 1 . . . . B 477 ILE CG2 . 34007 1 1193 . 2 . 2 16 16 ILE CD1 C 13 15.703 0.300 . 1 . . . . B 477 ILE CD1 . 34007 1 1194 . 2 . 2 16 16 ILE N N 15 117.087 0.300 . 1 . . . . B 477 ILE N . 34007 1 1195 . 2 . 2 17 17 ILE H H 1 7.866 0.020 . 1 . . . . B 478 ILE H . 34007 1 1196 . 2 . 2 17 17 ILE HA H 1 2.725 0.020 . 1 . . . . B 478 ILE HA . 34007 1 1197 . 2 . 2 17 17 ILE HB H 1 1.640 0.020 . 1 . . . . B 478 ILE HB . 34007 1 1198 . 2 . 2 17 17 ILE HG12 H 1 0.700 0.020 . 1 . . . . B 478 ILE HG12 . 34007 1 1199 . 2 . 2 17 17 ILE HG13 H 1 1.391 0.020 . 1 . . . . B 478 ILE HG13 . 34007 1 1200 . 2 . 2 17 17 ILE HG21 H 1 0.775 0.020 . 1 . . . . B 478 ILE HG21 . 34007 1 1201 . 2 . 2 17 17 ILE HG22 H 1 0.775 0.020 . 1 . . . . B 478 ILE HG22 . 34007 1 1202 . 2 . 2 17 17 ILE HG23 H 1 0.775 0.020 . 1 . . . . B 478 ILE HG23 . 34007 1 1203 . 2 . 2 17 17 ILE HD11 H 1 0.695 0.020 . 1 . . . . B 478 ILE HD11 . 34007 1 1204 . 2 . 2 17 17 ILE HD12 H 1 0.695 0.020 . 1 . . . . B 478 ILE HD12 . 34007 1 1205 . 2 . 2 17 17 ILE HD13 H 1 0.695 0.020 . 1 . . . . B 478 ILE HD13 . 34007 1 1206 . 2 . 2 17 17 ILE C C 13 180.345 0.300 . 1 . . . . B 478 ILE C . 34007 1 1207 . 2 . 2 17 17 ILE CA C 13 65.632 0.300 . 1 . . . . B 478 ILE CA . 34007 1 1208 . 2 . 2 17 17 ILE CB C 13 37.615 0.300 . 1 . . . . B 478 ILE CB . 34007 1 1209 . 2 . 2 17 17 ILE CG1 C 13 29.833 0.300 . 1 . . . . B 478 ILE CG1 . 34007 1 1210 . 2 . 2 17 17 ILE CG2 C 13 17.129 0.300 . 1 . . . . B 478 ILE CG2 . 34007 1 1211 . 2 . 2 17 17 ILE CD1 C 13 15.231 0.300 . 1 . . . . B 478 ILE CD1 . 34007 1 1212 . 2 . 2 17 17 ILE N N 15 119.877 0.300 . 1 . . . . B 478 ILE N . 34007 1 1213 . 2 . 2 18 18 LYS H H 1 8.412 0.020 . 1 . . . . B 479 LYS H . 34007 1 1214 . 2 . 2 18 18 LYS HA H 1 4.005 0.020 . 1 . . . . B 479 LYS HA . 34007 1 1215 . 2 . 2 18 18 LYS HB2 H 1 1.866 0.020 . 1 . . . . B 479 LYS HB2 . 34007 1 1216 . 2 . 2 18 18 LYS HB3 H 1 1.920 0.020 . 1 . . . . B 479 LYS HB3 . 34007 1 1217 . 2 . 2 18 18 LYS HG2 H 1 1.437 0.020 . 2 . . . . B 479 LYS HG2 . 34007 1 1218 . 2 . 2 18 18 LYS HG3 H 1 1.437 0.020 . 2 . . . . B 479 LYS HG3 . 34007 1 1219 . 2 . 2 18 18 LYS HD2 H 1 1.688 0.020 . 2 . . . . B 479 LYS HD2 . 34007 1 1220 . 2 . 2 18 18 LYS HD3 H 1 1.688 0.020 . 2 . . . . B 479 LYS HD3 . 34007 1 1221 . 2 . 2 18 18 LYS HE2 H 1 2.979 0.020 . 2 . . . . B 479 LYS HE2 . 34007 1 1222 . 2 . 2 18 18 LYS HE3 H 1 2.979 0.020 . 2 . . . . B 479 LYS HE3 . 34007 1 1223 . 2 . 2 18 18 LYS C C 13 178.283 0.300 . 1 . . . . B 479 LYS C . 34007 1 1224 . 2 . 2 18 18 LYS CA C 13 58.939 0.300 . 1 . . . . B 479 LYS CA . 34007 1 1225 . 2 . 2 18 18 LYS CB C 13 31.328 0.300 . 1 . . . . B 479 LYS CB . 34007 1 1226 . 2 . 2 18 18 LYS CG C 13 24.918 0.300 . 1 . . . . B 479 LYS CG . 34007 1 1227 . 2 . 2 18 18 LYS CD C 13 29.188 0.300 . 1 . . . . B 479 LYS CD . 34007 1 1228 . 2 . 2 18 18 LYS CE C 13 42.180 0.300 . 1 . . . . B 479 LYS CE . 34007 1 1229 . 2 . 2 18 18 LYS N N 15 124.337 0.300 . 1 . . . . B 479 LYS N . 34007 1 1230 . 2 . 2 19 19 LYS H H 1 7.189 0.020 . 1 . . . . B 480 LYS H . 34007 1 1231 . 2 . 2 19 19 LYS HA H 1 4.209 0.020 . 1 . . . . B 480 LYS HA . 34007 1 1232 . 2 . 2 19 19 LYS HB2 H 1 1.077 0.020 . 1 . . . . B 480 LYS HB2 . 34007 1 1233 . 2 . 2 19 19 LYS HB3 H 1 1.766 0.020 . 1 . . . . B 480 LYS HB3 . 34007 1 1234 . 2 . 2 19 19 LYS HG2 H 1 0.830 0.020 . 2 . . . . B 480 LYS HG2 . 34007 1 1235 . 2 . 2 19 19 LYS HG3 H 1 0.830 0.020 . 2 . . . . B 480 LYS HG3 . 34007 1 1236 . 2 . 2 19 19 LYS HD2 H 1 1.397 0.020 . 2 . . . . B 480 LYS HD2 . 34007 1 1237 . 2 . 2 19 19 LYS HD3 H 1 1.397 0.020 . 2 . . . . B 480 LYS HD3 . 34007 1 1238 . 2 . 2 19 19 LYS HE2 H 1 2.743 0.020 . 2 . . . . B 480 LYS HE2 . 34007 1 1239 . 2 . 2 19 19 LYS HE3 H 1 2.743 0.020 . 2 . . . . B 480 LYS HE3 . 34007 1 1240 . 2 . 2 19 19 LYS C C 13 176.914 0.300 . 1 . . . . B 480 LYS C . 34007 1 1241 . 2 . 2 19 19 LYS CA C 13 53.377 0.300 . 1 . . . . B 480 LYS CA . 34007 1 1242 . 2 . 2 19 19 LYS CB C 13 29.839 0.300 . 1 . . . . B 480 LYS CB . 34007 1 1243 . 2 . 2 19 19 LYS CG C 13 23.075 0.300 . 1 . . . . B 480 LYS CG . 34007 1 1244 . 2 . 2 19 19 LYS CD C 13 27.330 0.300 . 1 . . . . B 480 LYS CD . 34007 1 1245 . 2 . 2 19 19 LYS CE C 13 42.151 0.300 . 1 . . . . B 480 LYS CE . 34007 1 1246 . 2 . 2 19 19 LYS N N 15 116.358 0.300 . 1 . . . . B 480 LYS N . 34007 1 1247 . 2 . 2 20 20 ASP H H 1 8.391 0.020 . 1 . . . . B 481 ASP H . 34007 1 1248 . 2 . 2 20 20 ASP HA H 1 4.341 0.020 . 1 . . . . B 481 ASP HA . 34007 1 1249 . 2 . 2 20 20 ASP HB2 H 1 2.516 0.020 . 1 . . . . B 481 ASP HB2 . 34007 1 1250 . 2 . 2 20 20 ASP HB3 H 1 2.995 0.020 . 1 . . . . B 481 ASP HB3 . 34007 1 1251 . 2 . 2 20 20 ASP C C 13 177.030 0.300 . 1 . . . . B 481 ASP C . 34007 1 1252 . 2 . 2 20 20 ASP CA C 13 55.461 0.300 . 1 . . . . B 481 ASP CA . 34007 1 1253 . 2 . 2 20 20 ASP CB C 13 39.167 0.300 . 1 . . . . B 481 ASP CB . 34007 1 1254 . 2 . 2 20 20 ASP N N 15 122.754 0.300 . 1 . . . . B 481 ASP N . 34007 1 1255 . 2 . 2 21 21 PHE H H 1 8.289 0.020 . 1 . . . . B 482 PHE H . 34007 1 1256 . 2 . 2 21 21 PHE HA H 1 3.080 0.020 . 1 . . . . B 482 PHE HA . 34007 1 1257 . 2 . 2 21 21 PHE HB2 H 1 3.113 0.020 . 1 . . . . B 482 PHE HB2 . 34007 1 1258 . 2 . 2 21 21 PHE HB3 H 1 3.162 0.020 . 1 . . . . B 482 PHE HB3 . 34007 1 1259 . 2 . 2 21 21 PHE HD1 H 1 7.017 0.020 . 1 . . . . B 482 PHE HD1 . 34007 1 1260 . 2 . 2 21 21 PHE HD2 H 1 7.017 0.020 . 1 . . . . B 482 PHE HD2 . 34007 1 1261 . 2 . 2 21 21 PHE HE1 H 1 7.413 0.020 . 1 . . . . B 482 PHE HE1 . 34007 1 1262 . 2 . 2 21 21 PHE HE2 H 1 7.413 0.020 . 1 . . . . B 482 PHE HE2 . 34007 1 1263 . 2 . 2 21 21 PHE C C 13 174.275 0.300 . 1 . . . . B 482 PHE C . 34007 1 1264 . 2 . 2 21 21 PHE CA C 13 59.220 0.300 . 1 . . . . B 482 PHE CA . 34007 1 1265 . 2 . 2 21 21 PHE CB C 13 35.861 0.300 . 1 . . . . B 482 PHE CB . 34007 1 1266 . 2 . 2 21 21 PHE CD1 C 13 132.595 0.300 . 1 . . . . B 482 PHE CD1 . 34007 1 1267 . 2 . 2 21 21 PHE CE1 C 13 131.414 0.300 . 1 . . . . B 482 PHE CE1 . 34007 1 1268 . 2 . 2 21 21 PHE N N 15 110.546 0.300 . 1 . . . . B 482 PHE N . 34007 1 1269 . 2 . 2 22 22 PHE H H 1 7.319 0.020 . 1 . . . . B 483 PHE H . 34007 1 1270 . 2 . 2 22 22 PHE HA H 1 4.339 0.020 . 1 . . . . B 483 PHE HA . 34007 1 1271 . 2 . 2 22 22 PHE HB2 H 1 3.285 0.020 . 1 . . . . B 483 PHE HB2 . 34007 1 1272 . 2 . 2 22 22 PHE HB3 H 1 3.528 0.020 . 1 . . . . B 483 PHE HB3 . 34007 1 1273 . 2 . 2 22 22 PHE HD1 H 1 7.175 0.020 . 1 . . . . B 483 PHE HD1 . 34007 1 1274 . 2 . 2 22 22 PHE HD2 H 1 7.175 0.020 . 1 . . . . B 483 PHE HD2 . 34007 1 1275 . 2 . 2 22 22 PHE HE1 H 1 7.046 0.020 . 1 . . . . B 483 PHE HE1 . 34007 1 1276 . 2 . 2 22 22 PHE HE2 H 1 7.046 0.020 . 1 . . . . B 483 PHE HE2 . 34007 1 1277 . 2 . 2 22 22 PHE C C 13 176.212 0.300 . 1 . . . . B 483 PHE C . 34007 1 1278 . 2 . 2 22 22 PHE CA C 13 58.173 0.300 . 1 . . . . B 483 PHE CA . 34007 1 1279 . 2 . 2 22 22 PHE CB C 13 36.036 0.300 . 1 . . . . B 483 PHE CB . 34007 1 1280 . 2 . 2 22 22 PHE CD1 C 13 130.737 0.300 . 1 . . . . B 483 PHE CD1 . 34007 1 1281 . 2 . 2 22 22 PHE CE1 C 13 128.299 0.300 . 1 . . . . B 483 PHE CE1 . 34007 1 1282 . 2 . 2 22 22 PHE N N 15 109.338 0.300 . 1 . . . . B 483 PHE N . 34007 1 1283 . 2 . 2 23 23 GLY H H 1 7.819 0.020 . 1 . . . . B 484 GLY H . 34007 1 1284 . 2 . 2 23 23 GLY HA2 H 1 3.956 0.020 . 1 . . . . B 484 GLY HA2 . 34007 1 1285 . 2 . 2 23 23 GLY HA3 H 1 4.259 0.020 . 1 . . . . B 484 GLY HA3 . 34007 1 1286 . 2 . 2 23 23 GLY C C 13 175.492 0.300 . 1 . . . . B 484 GLY C . 34007 1 1287 . 2 . 2 23 23 GLY CA C 13 45.819 0.300 . 1 . . . . B 484 GLY CA . 34007 1 1288 . 2 . 2 23 23 GLY N N 15 105.733 0.300 . 1 . . . . B 484 GLY N . 34007 1 1289 . 2 . 2 24 24 LEU H H 1 7.589 0.020 . 1 . . . . B 485 LEU H . 34007 1 1290 . 2 . 2 24 24 LEU HA H 1 4.267 0.020 . 1 . . . . B 485 LEU HA . 34007 1 1291 . 2 . 2 24 24 LEU HB2 H 1 1.489 0.020 . 1 . . . . B 485 LEU HB2 . 34007 1 1292 . 2 . 2 24 24 LEU HB3 H 1 1.872 0.020 . 1 . . . . B 485 LEU HB3 . 34007 1 1293 . 2 . 2 24 24 LEU HG H 1 1.859 0.020 . 1 . . . . B 485 LEU HG . 34007 1 1294 . 2 . 2 24 24 LEU HD11 H 1 0.910 0.020 . 2 . . . . B 485 LEU HD11 . 34007 1 1295 . 2 . 2 24 24 LEU HD12 H 1 0.910 0.020 . 2 . . . . B 485 LEU HD12 . 34007 1 1296 . 2 . 2 24 24 LEU HD13 H 1 0.910 0.020 . 2 . . . . B 485 LEU HD13 . 34007 1 1297 . 2 . 2 24 24 LEU HD21 H 1 1.056 0.020 . 2 . . . . B 485 LEU HD21 . 34007 1 1298 . 2 . 2 24 24 LEU HD22 H 1 1.056 0.020 . 2 . . . . B 485 LEU HD22 . 34007 1 1299 . 2 . 2 24 24 LEU HD23 H 1 1.056 0.020 . 2 . . . . B 485 LEU HD23 . 34007 1 1300 . 2 . 2 24 24 LEU C C 13 176.861 0.300 . 1 . . . . B 485 LEU C . 34007 1 1301 . 2 . 2 24 24 LEU CA C 13 55.557 0.300 . 1 . . . . B 485 LEU CA . 34007 1 1302 . 2 . 2 24 24 LEU CB C 13 42.141 0.300 . 1 . . . . B 485 LEU CB . 34007 1 1303 . 2 . 2 24 24 LEU CG C 13 26.978 0.300 . 1 . . . . B 485 LEU CG . 34007 1 1304 . 2 . 2 24 24 LEU CD1 C 13 23.254 0.300 . 1 . . . . B 485 LEU CD1 . 34007 1 1305 . 2 . 2 24 24 LEU CD2 C 13 26.320 0.300 . 1 . . . . B 485 LEU CD2 . 34007 1 1306 . 2 . 2 24 24 LEU N N 15 119.851 0.300 . 1 . . . . B 485 LEU N . 34007 1 1307 . 2 . 2 25 25 ASP H H 1 8.378 0.020 . 1 . . . . B 486 ASP H . 34007 1 1308 . 2 . 2 25 25 ASP HA H 1 4.635 0.020 . 1 . . . . B 486 ASP HA . 34007 1 1309 . 2 . 2 25 25 ASP HB2 H 1 2.360 0.020 . 1 . . . . B 486 ASP HB2 . 34007 1 1310 . 2 . 2 25 25 ASP HB3 H 1 2.688 0.020 . 1 . . . . B 486 ASP HB3 . 34007 1 1311 . 2 . 2 25 25 ASP C C 13 176.141 0.300 . 1 . . . . B 486 ASP C . 34007 1 1312 . 2 . 2 25 25 ASP CA C 13 53.581 0.300 . 1 . . . . B 486 ASP CA . 34007 1 1313 . 2 . 2 25 25 ASP CB C 13 41.280 0.300 . 1 . . . . B 486 ASP CB . 34007 1 1314 . 2 . 2 25 25 ASP N N 15 120.178 0.300 . 1 . . . . B 486 ASP N . 34007 1 1315 . 2 . 2 26 26 THR H H 1 8.032 0.020 . 1 . . . . B 487 THR H . 34007 1 1316 . 2 . 2 26 26 THR HA H 1 4.289 0.020 . 1 . . . . B 487 THR HA . 34007 1 1317 . 2 . 2 26 26 THR HB H 1 4.298 0.020 . 1 . . . . B 487 THR HB . 34007 1 1318 . 2 . 2 26 26 THR HG21 H 1 1.119 0.020 . 1 . . . . B 487 THR HG21 . 34007 1 1319 . 2 . 2 26 26 THR HG22 H 1 1.119 0.020 . 1 . . . . B 487 THR HG22 . 34007 1 1320 . 2 . 2 26 26 THR HG23 H 1 1.119 0.020 . 1 . . . . B 487 THR HG23 . 34007 1 1321 . 2 . 2 26 26 THR C C 13 174.986 0.300 . 1 . . . . B 487 THR C . 34007 1 1322 . 2 . 2 26 26 THR CA C 13 61.871 0.300 . 1 . . . . B 487 THR CA . 34007 1 1323 . 2 . 2 26 26 THR CB C 13 69.503 0.300 . 1 . . . . B 487 THR CB . 34007 1 1324 . 2 . 2 26 26 THR CG2 C 13 21.359 0.300 . 1 . . . . B 487 THR CG2 . 34007 1 1325 . 2 . 2 26 26 THR N N 15 113.746 0.300 . 1 . . . . B 487 THR N . 34007 1 1326 . 2 . 2 27 27 ASN H H 1 8.509 0.020 . 1 . . . . B 488 ASN H . 34007 1 1327 . 2 . 2 27 27 ASN HA H 1 4.798 0.020 . 1 . . . . B 488 ASN HA . 34007 1 1328 . 2 . 2 27 27 ASN HB2 H 1 2.826 0.020 . 1 . . . . B 488 ASN HB2 . 34007 1 1329 . 2 . 2 27 27 ASN HB3 H 1 2.857 0.020 . 1 . . . . B 488 ASN HB3 . 34007 1 1330 . 2 . 2 27 27 ASN HD21 H 1 6.965 0.020 . 1 . . . . B 488 ASN HD21 . 34007 1 1331 . 2 . 2 27 27 ASN HD22 H 1 7.729 0.020 . 1 . . . . B 488 ASN HD22 . 34007 1 1332 . 2 . 2 27 27 ASN C C 13 175.723 0.300 . 1 . . . . B 488 ASN C . 34007 1 1333 . 2 . 2 27 27 ASN CA C 13 53.679 0.300 . 1 . . . . B 488 ASN CA . 34007 1 1334 . 2 . 2 27 27 ASN CB C 13 39.152 0.300 . 1 . . . . B 488 ASN CB . 34007 1 1335 . 2 . 2 27 27 ASN CG C 13 177.172 0.300 . 1 . . . . B 488 ASN CG . 34007 1 1336 . 2 . 2 27 27 ASN N N 15 120.420 0.300 . 1 . . . . B 488 ASN N . 34007 1 1337 . 2 . 2 27 27 ASN ND2 N 15 113.454 0.300 . 1 . . . . B 488 ASN ND2 . 34007 1 1338 . 2 . 2 28 28 SER H H 1 8.322 0.020 . 1 . . . . B 489 SER H . 34007 1 1339 . 2 . 2 28 28 SER HA H 1 4.375 0.020 . 1 . . . . B 489 SER HA . 34007 1 1340 . 2 . 2 28 28 SER HB2 H 1 3.859 0.020 . 2 . . . . B 489 SER HB2 . 34007 1 1341 . 2 . 2 28 28 SER HB3 H 1 3.859 0.020 . 2 . . . . B 489 SER HB3 . 34007 1 1342 . 2 . 2 28 28 SER C C 13 174.533 0.300 . 1 . . . . B 489 SER C . 34007 1 1343 . 2 . 2 28 28 SER CA C 13 59.112 0.300 . 1 . . . . B 489 SER CA . 34007 1 1344 . 2 . 2 28 28 SER CB C 13 63.654 0.300 . 1 . . . . B 489 SER CB . 34007 1 1345 . 2 . 2 28 28 SER N N 15 116.805 0.300 . 1 . . . . B 489 SER N . 34007 1 1346 . 2 . 2 29 29 ALA H H 1 8.350 0.020 . 1 . . . . B 490 ALA H . 34007 1 1347 . 2 . 2 29 29 ALA HA H 1 4.340 0.020 . 1 . . . . B 490 ALA HA . 34007 1 1348 . 2 . 2 29 29 ALA HB1 H 1 1.408 0.020 . 1 . . . . B 490 ALA HB1 . 34007 1 1349 . 2 . 2 29 29 ALA HB2 H 1 1.408 0.020 . 1 . . . . B 490 ALA HB2 . 34007 1 1350 . 2 . 2 29 29 ALA HB3 H 1 1.408 0.020 . 1 . . . . B 490 ALA HB3 . 34007 1 1351 . 2 . 2 29 29 ALA C C 13 177.723 0.300 . 1 . . . . B 490 ALA C . 34007 1 1352 . 2 . 2 29 29 ALA CA C 13 52.683 0.300 . 1 . . . . B 490 ALA CA . 34007 1 1353 . 2 . 2 29 29 ALA CB C 13 19.170 0.300 . 1 . . . . B 490 ALA CB . 34007 1 1354 . 2 . 2 29 29 ALA N N 15 125.465 0.300 . 1 . . . . B 490 ALA N . 34007 1 1355 . 2 . 2 30 30 LYS H H 1 8.143 0.020 . 1 . . . . B 491 LYS H . 34007 1 1356 . 2 . 2 30 30 LYS HA H 1 4.337 0.020 . 1 . . . . B 491 LYS HA . 34007 1 1357 . 2 . 2 30 30 LYS HB2 H 1 1.786 0.020 . 1 . . . . B 491 LYS HB2 . 34007 1 1358 . 2 . 2 30 30 LYS HB3 H 1 1.875 0.020 . 1 . . . . B 491 LYS HB3 . 34007 1 1359 . 2 . 2 30 30 LYS HG2 H 1 1.466 0.020 . 2 . . . . B 491 LYS HG2 . 34007 1 1360 . 2 . 2 30 30 LYS HG3 H 1 1.466 0.020 . 2 . . . . B 491 LYS HG3 . 34007 1 1361 . 2 . 2 30 30 LYS HD2 H 1 1.698 0.020 . 2 . . . . B 491 LYS HD2 . 34007 1 1362 . 2 . 2 30 30 LYS HD3 H 1 1.698 0.020 . 2 . . . . B 491 LYS HD3 . 34007 1 1363 . 2 . 2 30 30 LYS HE2 H 1 3.021 0.020 . 2 . . . . B 491 LYS HE2 . 34007 1 1364 . 2 . 2 30 30 LYS HE3 H 1 3.021 0.020 . 2 . . . . B 491 LYS HE3 . 34007 1 1365 . 2 . 2 30 30 LYS C C 13 176.781 0.300 . 1 . . . . B 491 LYS C . 34007 1 1366 . 2 . 2 30 30 LYS CA C 13 56.276 0.300 . 1 . . . . B 491 LYS CA . 34007 1 1367 . 2 . 2 30 30 LYS CB C 13 32.945 0.300 . 1 . . . . B 491 LYS CB . 34007 1 1368 . 2 . 2 30 30 LYS CG C 13 24.687 0.300 . 1 . . . . B 491 LYS CG . 34007 1 1369 . 2 . 2 30 30 LYS CD C 13 29.183 0.300 . 1 . . . . B 491 LYS CD . 34007 1 1370 . 2 . 2 30 30 LYS CE C 13 42.169 0.300 . 1 . . . . B 491 LYS CE . 34007 1 1371 . 2 . 2 30 30 LYS N N 15 120.176 0.300 . 1 . . . . B 491 LYS N . 34007 1 1372 . 2 . 2 31 31 SER H H 1 8.305 0.020 . 1 . . . . B 492 SER H . 34007 1 1373 . 2 . 2 31 31 SER HA H 1 4.428 0.020 . 1 . . . . B 492 SER HA . 34007 1 1374 . 2 . 2 31 31 SER HB2 H 1 3.877 0.020 . 2 . . . . B 492 SER HB2 . 34007 1 1375 . 2 . 2 31 31 SER HB3 H 1 3.877 0.020 . 2 . . . . B 492 SER HB3 . 34007 1 1376 . 2 . 2 31 31 SER C C 13 174.488 0.300 . 1 . . . . B 492 SER C . 34007 1 1377 . 2 . 2 31 31 SER CA C 13 58.497 0.300 . 1 . . . . B 492 SER CA . 34007 1 1378 . 2 . 2 31 31 SER CB C 13 63.871 0.300 . 1 . . . . B 492 SER CB . 34007 1 1379 . 2 . 2 31 31 SER N N 15 117.229 0.300 . 1 . . . . B 492 SER N . 34007 1 1380 . 2 . 2 32 32 LYS H H 1 8.362 0.020 . 1 . . . . B 493 LYS H . 34007 1 1381 . 2 . 2 32 32 LYS HA H 1 4.383 0.020 . 1 . . . . B 493 LYS HA . 34007 1 1382 . 2 . 2 32 32 LYS HB2 H 1 1.782 0.020 . 1 . . . . B 493 LYS HB2 . 34007 1 1383 . 2 . 2 32 32 LYS HB3 H 1 1.889 0.020 . 1 . . . . B 493 LYS HB3 . 34007 1 1384 . 2 . 2 32 32 LYS HG2 H 1 1.462 0.020 . 2 . . . . B 493 LYS HG2 . 34007 1 1385 . 2 . 2 32 32 LYS HG3 H 1 1.462 0.020 . 2 . . . . B 493 LYS HG3 . 34007 1 1386 . 2 . 2 32 32 LYS HD2 H 1 1.699 0.020 . 2 . . . . B 493 LYS HD2 . 34007 1 1387 . 2 . 2 32 32 LYS HD3 H 1 1.699 0.020 . 2 . . . . B 493 LYS HD3 . 34007 1 1388 . 2 . 2 32 32 LYS HE2 H 1 3.025 0.020 . 2 . . . . B 493 LYS HE2 . 34007 1 1389 . 2 . 2 32 32 LYS HE3 H 1 3.025 0.020 . 2 . . . . B 493 LYS HE3 . 34007 1 1390 . 2 . 2 32 32 LYS C C 13 176.106 0.300 . 1 . . . . B 493 LYS C . 34007 1 1391 . 2 . 2 32 32 LYS CA C 13 56.283 0.300 . 1 . . . . B 493 LYS CA . 34007 1 1392 . 2 . 2 32 32 LYS CB C 13 33.069 0.300 . 1 . . . . B 493 LYS CB . 34007 1 1393 . 2 . 2 32 32 LYS CG C 13 24.608 0.300 . 1 . . . . B 493 LYS CG . 34007 1 1394 . 2 . 2 32 32 LYS CD C 13 29.156 0.300 . 1 . . . . B 493 LYS CD . 34007 1 1395 . 2 . 2 32 32 LYS CE C 13 42.193 0.300 . 1 . . . . B 493 LYS CE . 34007 1 1396 . 2 . 2 32 32 LYS N N 15 122.997 0.300 . 1 . . . . B 493 LYS N . 34007 1 1397 . 2 . 2 33 33 ASP H H 1 8.374 0.020 . 1 . . . . B 494 ASP H . 34007 1 1398 . 2 . 2 33 33 ASP HA H 1 4.650 0.020 . 1 . . . . B 494 ASP HA . 34007 1 1399 . 2 . 2 33 33 ASP HB2 H 1 2.576 0.020 . 1 . . . . B 494 ASP HB2 . 34007 1 1400 . 2 . 2 33 33 ASP HB3 H 1 2.754 0.020 . 1 . . . . B 494 ASP HB3 . 34007 1 1401 . 2 . 2 33 33 ASP C C 13 175.155 0.300 . 1 . . . . B 494 ASP C . 34007 1 1402 . 2 . 2 33 33 ASP CA C 13 54.663 0.300 . 1 . . . . B 494 ASP CA . 34007 1 1403 . 2 . 2 33 33 ASP CB C 13 41.089 0.300 . 1 . . . . B 494 ASP CB . 34007 1 1404 . 2 . 2 33 33 ASP N N 15 122.108 0.300 . 1 . . . . B 494 ASP N . 34007 1 1405 . 2 . 2 34 34 VAL H H 1 7.626 0.020 . 1 . . . . B 495 VAL H . 34007 1 1406 . 2 . 2 34 34 VAL HA H 1 4.076 0.020 . 1 . . . . B 495 VAL HA . 34007 1 1407 . 2 . 2 34 34 VAL HB H 1 2.104 0.020 . 1 . . . . B 495 VAL HB . 34007 1 1408 . 2 . 2 34 34 VAL HG11 H 1 0.885 0.020 . 2 . . . . B 495 VAL HG11 . 34007 1 1409 . 2 . 2 34 34 VAL HG12 H 1 0.885 0.020 . 2 . . . . B 495 VAL HG12 . 34007 1 1410 . 2 . 2 34 34 VAL HG13 H 1 0.885 0.020 . 2 . . . . B 495 VAL HG13 . 34007 1 1411 . 2 . 2 34 34 VAL HG21 H 1 0.908 0.020 . 2 . . . . B 495 VAL HG21 . 34007 1 1412 . 2 . 2 34 34 VAL HG22 H 1 0.908 0.020 . 2 . . . . B 495 VAL HG22 . 34007 1 1413 . 2 . 2 34 34 VAL HG23 H 1 0.908 0.020 . 2 . . . . B 495 VAL HG23 . 34007 1 1414 . 2 . 2 34 34 VAL CA C 13 63.538 0.300 . 1 . . . . B 495 VAL CA . 34007 1 1415 . 2 . 2 34 34 VAL CB C 13 33.318 0.300 . 1 . . . . B 495 VAL CB . 34007 1 1416 . 2 . 2 34 34 VAL CG1 C 13 20.022 0.300 . 1 . . . . B 495 VAL CG1 . 34007 1 1417 . 2 . 2 34 34 VAL CG2 C 13 21.599 0.300 . 1 . . . . B 495 VAL CG2 . 34007 1 1418 . 2 . 2 34 34 VAL N N 15 123.363 0.300 . 1 . . . . B 495 VAL N . 34007 1 stop_ save_