data_26800 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26800 _Entry.Title ; Resonance assignments of a VapC family toxin from Clostridium thermocellum ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-05-13 _Entry.Accession_date 2016-05-13 _Entry.Last_release_date 2016-08-31 _Entry.Original_release_date 2016-08-31 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Chen Wang . . . . 26800 2 Jinsong Xuan . . . . 26800 3 Qiu Cui . . . . 26800 4 Yingang Feng . . . . 26800 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26800 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 625 26800 '15N chemical shifts' 143 26800 '1H chemical shifts' 1007 26800 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 . . 2016-10-26 2016-05-13 update BMRB 'update entry citation' 26800 1 . . 2016-08-31 2016-05-13 original author 'original release' 26800 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26800 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27386855 _Citation.Full_citation . _Citation.Title ; Resonance assignments of a VapC family toxin from Clostridium thermocellum ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 10 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 367 _Citation.Page_last 371 _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 Chen Wang . . . . 26800 1 2 Jinsong Xuan . . . . 26800 1 3 Qiu Cui . . . . 26800 1 4 Yingang Feng . . . . 26800 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26800 _Assembly.ID 1 _Assembly.Name 'VapC family toxin' _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 'VapC family toxin' 1 $CtVapC-D92A A . yes native no no . . . 26800 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CtVapC-D92A _Entity.Sf_category entity _Entity.Sf_framecode CtVapC-D92A _Entity.Entry_ID 26800 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CtVapC-D92A _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MRVLIDTNILISASLSCEGT PYQAYIKAVTHPNHGMVCDQ NIDELRRVYNRKFPHKIQAL ERFLAIALTVLEVVPTPAVD VSDEALVRDASARPILRAAI AAKADVLVTGDRDFLESGIT NPKIVTAAEFLQMELEHHHH HH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 142 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP A3DFW5_CLOTH . . . . . . . . . . . . . . . . 26800 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 1 MET . 26800 1 2 2 ARG . 26800 1 3 3 VAL . 26800 1 4 4 LEU . 26800 1 5 5 ILE . 26800 1 6 6 ASP . 26800 1 7 7 THR . 26800 1 8 8 ASN . 26800 1 9 9 ILE . 26800 1 10 10 LEU . 26800 1 11 11 ILE . 26800 1 12 12 SER . 26800 1 13 13 ALA . 26800 1 14 14 SER . 26800 1 15 15 LEU . 26800 1 16 16 SER . 26800 1 17 17 CYS . 26800 1 18 18 GLU . 26800 1 19 19 GLY . 26800 1 20 20 THR . 26800 1 21 21 PRO . 26800 1 22 22 TYR . 26800 1 23 23 GLN . 26800 1 24 24 ALA . 26800 1 25 25 TYR . 26800 1 26 26 ILE . 26800 1 27 27 LYS . 26800 1 28 28 ALA . 26800 1 29 29 VAL . 26800 1 30 30 THR . 26800 1 31 31 HIS . 26800 1 32 32 PRO . 26800 1 33 33 ASN . 26800 1 34 34 HIS . 26800 1 35 35 GLY . 26800 1 36 36 MET . 26800 1 37 37 VAL . 26800 1 38 38 CYS . 26800 1 39 39 ASP . 26800 1 40 40 GLN . 26800 1 41 41 ASN . 26800 1 42 42 ILE . 26800 1 43 43 ASP . 26800 1 44 44 GLU . 26800 1 45 45 LEU . 26800 1 46 46 ARG . 26800 1 47 47 ARG . 26800 1 48 48 VAL . 26800 1 49 49 TYR . 26800 1 50 50 ASN . 26800 1 51 51 ARG . 26800 1 52 52 LYS . 26800 1 53 53 PHE . 26800 1 54 54 PRO . 26800 1 55 55 HIS . 26800 1 56 56 LYS . 26800 1 57 57 ILE . 26800 1 58 58 GLN . 26800 1 59 59 ALA . 26800 1 60 60 LEU . 26800 1 61 61 GLU . 26800 1 62 62 ARG . 26800 1 63 63 PHE . 26800 1 64 64 LEU . 26800 1 65 65 ALA . 26800 1 66 66 ILE . 26800 1 67 67 ALA . 26800 1 68 68 LEU . 26800 1 69 69 THR . 26800 1 70 70 VAL . 26800 1 71 71 LEU . 26800 1 72 72 GLU . 26800 1 73 73 VAL . 26800 1 74 74 VAL . 26800 1 75 75 PRO . 26800 1 76 76 THR . 26800 1 77 77 PRO . 26800 1 78 78 ALA . 26800 1 79 79 VAL . 26800 1 80 80 ASP . 26800 1 81 81 VAL . 26800 1 82 82 SER . 26800 1 83 83 ASP . 26800 1 84 84 GLU . 26800 1 85 85 ALA . 26800 1 86 86 LEU . 26800 1 87 87 VAL . 26800 1 88 88 ARG . 26800 1 89 89 ASP . 26800 1 90 90 ALA . 26800 1 91 91 SER . 26800 1 92 92 ALA . 26800 1 93 93 ARG . 26800 1 94 94 PRO . 26800 1 95 95 ILE . 26800 1 96 96 LEU . 26800 1 97 97 ARG . 26800 1 98 98 ALA . 26800 1 99 99 ALA . 26800 1 100 100 ILE . 26800 1 101 101 ALA . 26800 1 102 102 ALA . 26800 1 103 103 LYS . 26800 1 104 104 ALA . 26800 1 105 105 ASP . 26800 1 106 106 VAL . 26800 1 107 107 LEU . 26800 1 108 108 VAL . 26800 1 109 109 THR . 26800 1 110 110 GLY . 26800 1 111 111 ASP . 26800 1 112 112 ARG . 26800 1 113 113 ASP . 26800 1 114 114 PHE . 26800 1 115 115 LEU . 26800 1 116 116 GLU . 26800 1 117 117 SER . 26800 1 118 118 GLY . 26800 1 119 119 ILE . 26800 1 120 120 THR . 26800 1 121 121 ASN . 26800 1 122 122 PRO . 26800 1 123 123 LYS . 26800 1 124 124 ILE . 26800 1 125 125 VAL . 26800 1 126 126 THR . 26800 1 127 127 ALA . 26800 1 128 128 ALA . 26800 1 129 129 GLU . 26800 1 130 130 PHE . 26800 1 131 131 LEU . 26800 1 132 132 GLN . 26800 1 133 133 MET . 26800 1 134 134 GLU . 26800 1 135 135 LEU . 26800 1 136 136 GLU . 26800 1 137 137 HIS . 26800 1 138 138 HIS . 26800 1 139 139 HIS . 26800 1 140 140 HIS . 26800 1 141 141 HIS . 26800 1 142 142 HIS . 26800 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26800 1 . ARG 2 2 26800 1 . VAL 3 3 26800 1 . LEU 4 4 26800 1 . ILE 5 5 26800 1 . ASP 6 6 26800 1 . THR 7 7 26800 1 . ASN 8 8 26800 1 . ILE 9 9 26800 1 . LEU 10 10 26800 1 . ILE 11 11 26800 1 . SER 12 12 26800 1 . ALA 13 13 26800 1 . SER 14 14 26800 1 . LEU 15 15 26800 1 . SER 16 16 26800 1 . CYS 17 17 26800 1 . GLU 18 18 26800 1 . GLY 19 19 26800 1 . THR 20 20 26800 1 . PRO 21 21 26800 1 . TYR 22 22 26800 1 . GLN 23 23 26800 1 . ALA 24 24 26800 1 . TYR 25 25 26800 1 . ILE 26 26 26800 1 . LYS 27 27 26800 1 . ALA 28 28 26800 1 . VAL 29 29 26800 1 . THR 30 30 26800 1 . HIS 31 31 26800 1 . PRO 32 32 26800 1 . ASN 33 33 26800 1 . HIS 34 34 26800 1 . GLY 35 35 26800 1 . MET 36 36 26800 1 . VAL 37 37 26800 1 . CYS 38 38 26800 1 . ASP 39 39 26800 1 . GLN 40 40 26800 1 . ASN 41 41 26800 1 . ILE 42 42 26800 1 . ASP 43 43 26800 1 . GLU 44 44 26800 1 . LEU 45 45 26800 1 . ARG 46 46 26800 1 . ARG 47 47 26800 1 . VAL 48 48 26800 1 . TYR 49 49 26800 1 . ASN 50 50 26800 1 . ARG 51 51 26800 1 . LYS 52 52 26800 1 . PHE 53 53 26800 1 . PRO 54 54 26800 1 . HIS 55 55 26800 1 . LYS 56 56 26800 1 . ILE 57 57 26800 1 . GLN 58 58 26800 1 . ALA 59 59 26800 1 . LEU 60 60 26800 1 . GLU 61 61 26800 1 . ARG 62 62 26800 1 . PHE 63 63 26800 1 . LEU 64 64 26800 1 . ALA 65 65 26800 1 . ILE 66 66 26800 1 . ALA 67 67 26800 1 . LEU 68 68 26800 1 . THR 69 69 26800 1 . VAL 70 70 26800 1 . LEU 71 71 26800 1 . GLU 72 72 26800 1 . VAL 73 73 26800 1 . VAL 74 74 26800 1 . PRO 75 75 26800 1 . THR 76 76 26800 1 . PRO 77 77 26800 1 . ALA 78 78 26800 1 . VAL 79 79 26800 1 . ASP 80 80 26800 1 . VAL 81 81 26800 1 . SER 82 82 26800 1 . ASP 83 83 26800 1 . GLU 84 84 26800 1 . ALA 85 85 26800 1 . LEU 86 86 26800 1 . VAL 87 87 26800 1 . ARG 88 88 26800 1 . ASP 89 89 26800 1 . ALA 90 90 26800 1 . SER 91 91 26800 1 . ALA 92 92 26800 1 . ARG 93 93 26800 1 . PRO 94 94 26800 1 . ILE 95 95 26800 1 . LEU 96 96 26800 1 . ARG 97 97 26800 1 . ALA 98 98 26800 1 . ALA 99 99 26800 1 . ILE 100 100 26800 1 . ALA 101 101 26800 1 . ALA 102 102 26800 1 . LYS 103 103 26800 1 . ALA 104 104 26800 1 . ASP 105 105 26800 1 . VAL 106 106 26800 1 . LEU 107 107 26800 1 . VAL 108 108 26800 1 . THR 109 109 26800 1 . GLY 110 110 26800 1 . ASP 111 111 26800 1 . ARG 112 112 26800 1 . ASP 113 113 26800 1 . PHE 114 114 26800 1 . LEU 115 115 26800 1 . GLU 116 116 26800 1 . SER 117 117 26800 1 . GLY 118 118 26800 1 . ILE 119 119 26800 1 . THR 120 120 26800 1 . ASN 121 121 26800 1 . PRO 122 122 26800 1 . LYS 123 123 26800 1 . ILE 124 124 26800 1 . VAL 125 125 26800 1 . THR 126 126 26800 1 . ALA 127 127 26800 1 . ALA 128 128 26800 1 . GLU 129 129 26800 1 . PHE 130 130 26800 1 . LEU 131 131 26800 1 . GLN 132 132 26800 1 . MET 133 133 26800 1 . GLU 134 134 26800 1 . LEU 135 135 26800 1 . GLU 136 136 26800 1 . HIS 137 137 26800 1 . HIS 138 138 26800 1 . HIS 139 139 26800 1 . HIS 140 140 26800 1 . HIS 141 141 26800 1 . HIS 142 142 26800 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26800 _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 $CtVapC-D92A . 1515 organism . 'Clostridium thermocellum' firmicutes . . Bacteria . Clostridium thermocellum ATCC27405 . . . . . . . . . . Cthe_1620 . 26800 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 26800 _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 $CtVapC-D92A . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . pET30a . . . 26800 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26800 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CtVapC-D92A '[U-13C; U-15N]' . . 1 $CtVapC-D92A . . 1.0 . . mM . . . . 26800 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 26800 1 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 26800 1 4 EDTA 'natural abundance' . . . . . . 2 . . mM . . . . 26800 1 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 26800 1 6 DSS 'natural abundance' . . . . . . 0.01 . . w/v . . . . 26800 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26800 1 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26800 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 26800 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 170 . mM 26800 1 pH 5.75 . pH 26800 1 pressure 1 . atm 26800 1 temperature 303 . K 26800 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26800 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26800 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26800 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26800 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26800 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26800 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 26800 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 26800 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26800 3 'data analysis' 26800 3 'peak picking' 26800 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26800 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 26800 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 26800 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 26800 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 8 '3D HBHANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 10 '3D CCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 11 '3D CCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 13 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26800 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26800 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26800 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26800 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26800 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26800 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26800 1 2 '2D 1H-13C HSQC' . . . 26800 1 3 '3D CBCA(CO)NH' . . . 26800 1 4 '3D HNCACB' . . . 26800 1 5 '3D HNCO' . . . 26800 1 6 '3D HN(CA)CO' . . . 26800 1 7 '3D HBHA(CO)NH' . . . 26800 1 8 '3D HBHANH' . . . 26800 1 9 '3D HCCH-TOCSY' . . . 26800 1 10 '3D CCH-TOCSY' . . . 26800 1 11 '3D CCH-COSY' . . . 26800 1 12 '3D 1H-15N NOESY' . . . 26800 1 13 '3D 1H-13C NOESY aliphatic' . . . 26800 1 14 '3D 1H-13C NOESY aromatic' . . . 26800 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 3 $NMRView . . 26800 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.2240 0.02 . 1 . . . . 1 MET HA . 26800 1 2 . 1 1 1 1 MET HB2 H 1 2.0800 0.02 . 2 . . . . 1 MET HB2 . 26800 1 3 . 1 1 1 1 MET HB3 H 1 2.0800 0.02 . 2 . . . . 1 MET HB3 . 26800 1 4 . 1 1 1 1 MET HG2 H 1 2.6240 0.02 . 2 . . . . 1 MET HG2 . 26800 1 5 . 1 1 1 1 MET HG3 H 1 2.5690 0.02 . 2 . . . . 1 MET HG3 . 26800 1 6 . 1 1 1 1 MET HE1 H 1 2.0920 0.02 . 1 . . . . 1 MET HE1 . 26800 1 7 . 1 1 1 1 MET HE2 H 1 2.0920 0.02 . 1 . . . . 1 MET HE1 . 26800 1 8 . 1 1 1 1 MET HE3 H 1 2.0920 0.02 . 1 . . . . 1 MET HE1 . 26800 1 9 . 1 1 1 1 MET C C 13 172.4010 0.3 . 1 . . . . 1 MET C . 26800 1 10 . 1 1 1 1 MET CA C 13 55.6830 0.3 . 1 . . . . 1 MET CA . 26800 1 11 . 1 1 1 1 MET CB C 13 34.7130 0.3 . 1 . . . . 1 MET CB . 26800 1 12 . 1 1 1 1 MET CG C 13 31.3300 0.3 . 1 . . . . 1 MET CG . 26800 1 13 . 1 1 1 1 MET CE C 13 17.4000 0.3 . 1 . . . . 1 MET CE . 26800 1 14 . 1 1 2 2 ARG H H 1 10.4330 0.02 . 1 . . . . 2 ARG H . 26800 1 15 . 1 1 2 2 ARG HA H 1 5.1250 0.02 . 1 . . . . 2 ARG HA . 26800 1 16 . 1 1 2 2 ARG HB2 H 1 2.0310 0.02 . 2 . . . . 2 ARG HB2 . 26800 1 17 . 1 1 2 2 ARG HB3 H 1 2.0310 0.02 . 2 . . . . 2 ARG HB3 . 26800 1 18 . 1 1 2 2 ARG HG2 H 1 1.7980 0.02 . 2 . . . . 2 ARG HG2 . 26800 1 19 . 1 1 2 2 ARG HG3 H 1 1.7980 0.02 . 2 . . . . 2 ARG HG3 . 26800 1 20 . 1 1 2 2 ARG HD2 H 1 3.1920 0.02 . 2 . . . . 2 ARG HD2 . 26800 1 21 . 1 1 2 2 ARG HD3 H 1 3.1920 0.02 . 2 . . . . 2 ARG HD3 . 26800 1 22 . 1 1 2 2 ARG C C 13 176.0310 0.3 . 1 . . . . 2 ARG C . 26800 1 23 . 1 1 2 2 ARG CA C 13 56.3980 0.3 . 1 . . . . 2 ARG CA . 26800 1 24 . 1 1 2 2 ARG CB C 13 31.2520 0.3 . 1 . . . . 2 ARG CB . 26800 1 25 . 1 1 2 2 ARG CG C 13 27.8600 0.3 . 1 . . . . 2 ARG CG . 26800 1 26 . 1 1 2 2 ARG CD C 13 43.4600 0.3 . 1 . . . . 2 ARG CD . 26800 1 27 . 1 1 2 2 ARG N N 15 125.8360 0.2 . 1 . . . . 2 ARG N . 26800 1 28 . 1 1 3 3 VAL H H 1 9.1270 0.02 . 1 . . . . 3 VAL H . 26800 1 29 . 1 1 3 3 VAL HA H 1 4.6570 0.02 . 1 . . . . 3 VAL HA . 26800 1 30 . 1 1 3 3 VAL HB H 1 2.0000 0.02 . 1 . . . . 3 VAL HB . 26800 1 31 . 1 1 3 3 VAL HG11 H 1 0.7890 0.02 . 2 . . . . 3 VAL HG11 . 26800 1 32 . 1 1 3 3 VAL HG12 H 1 0.7890 0.02 . 2 . . . . 3 VAL HG11 . 26800 1 33 . 1 1 3 3 VAL HG13 H 1 0.7890 0.02 . 2 . . . . 3 VAL HG11 . 26800 1 34 . 1 1 3 3 VAL HG21 H 1 0.3270 0.02 . 2 . . . . 3 VAL HG21 . 26800 1 35 . 1 1 3 3 VAL HG22 H 1 0.3270 0.02 . 2 . . . . 3 VAL HG21 . 26800 1 36 . 1 1 3 3 VAL HG23 H 1 0.3270 0.02 . 2 . . . . 3 VAL HG21 . 26800 1 37 . 1 1 3 3 VAL C C 13 173.0870 0.3 . 1 . . . . 3 VAL C . 26800 1 38 . 1 1 3 3 VAL CA C 13 61.0820 0.3 . 1 . . . . 3 VAL CA . 26800 1 39 . 1 1 3 3 VAL CB C 13 34.4510 0.3 . 1 . . . . 3 VAL CB . 26800 1 40 . 1 1 3 3 VAL CG1 C 13 20.6430 0.3 . 2 . . . . 3 VAL CG1 . 26800 1 41 . 1 1 3 3 VAL CG2 C 13 21.8300 0.3 . 2 . . . . 3 VAL CG2 . 26800 1 42 . 1 1 3 3 VAL N N 15 128.2720 0.2 . 1 . . . . 3 VAL N . 26800 1 43 . 1 1 4 4 LEU H H 1 8.9180 0.02 . 1 . . . . 4 LEU H . 26800 1 44 . 1 1 4 4 LEU HA H 1 5.0890 0.02 . 1 . . . . 4 LEU HA . 26800 1 45 . 1 1 4 4 LEU HB2 H 1 1.1170 0.02 . 2 . . . . 4 LEU HB2 . 26800 1 46 . 1 1 4 4 LEU HB3 H 1 1.7430 0.02 . 2 . . . . 4 LEU HB3 . 26800 1 47 . 1 1 4 4 LEU HG H 1 1.5680 0.02 . 1 . . . . 4 LEU HG . 26800 1 48 . 1 1 4 4 LEU HD11 H 1 0.7470 0.02 . 2 . . . . 4 LEU HD11 . 26800 1 49 . 1 1 4 4 LEU HD12 H 1 0.7470 0.02 . 2 . . . . 4 LEU HD11 . 26800 1 50 . 1 1 4 4 LEU HD13 H 1 0.7470 0.02 . 2 . . . . 4 LEU HD11 . 26800 1 51 . 1 1 4 4 LEU HD21 H 1 0.7630 0.02 . 2 . . . . 4 LEU HD21 . 26800 1 52 . 1 1 4 4 LEU HD22 H 1 0.7630 0.02 . 2 . . . . 4 LEU HD21 . 26800 1 53 . 1 1 4 4 LEU HD23 H 1 0.7630 0.02 . 2 . . . . 4 LEU HD21 . 26800 1 54 . 1 1 4 4 LEU C C 13 174.9270 0.3 . 1 . . . . 4 LEU C . 26800 1 55 . 1 1 4 4 LEU CA C 13 53.9860 0.3 . 1 . . . . 4 LEU CA . 26800 1 56 . 1 1 4 4 LEU CB C 13 43.3680 0.3 . 1 . . . . 4 LEU CB . 26800 1 57 . 1 1 4 4 LEU CG C 13 28.8120 0.3 . 1 . . . . 4 LEU CG . 26800 1 58 . 1 1 4 4 LEU CD1 C 13 25.3810 0.3 . 2 . . . . 4 LEU CD1 . 26800 1 59 . 1 1 4 4 LEU CD2 C 13 24.9380 0.3 . 2 . . . . 4 LEU CD2 . 26800 1 60 . 1 1 4 4 LEU N N 15 130.4450 0.2 . 1 . . . . 4 LEU N . 26800 1 61 . 1 1 5 5 ILE H H 1 8.2920 0.02 . 1 . . . . 5 ILE H . 26800 1 62 . 1 1 5 5 ILE HA H 1 4.2480 0.02 . 1 . . . . 5 ILE HA . 26800 1 63 . 1 1 5 5 ILE HB H 1 1.7030 0.02 . 1 . . . . 5 ILE HB . 26800 1 64 . 1 1 5 5 ILE HG12 H 1 0.7890 0.02 . 2 . . . . 5 ILE HG12 . 26800 1 65 . 1 1 5 5 ILE HG13 H 1 1.6380 0.02 . 2 . . . . 5 ILE HG13 . 26800 1 66 . 1 1 5 5 ILE HG21 H 1 0.8610 0.02 . 1 . . . . 5 ILE HG21 . 26800 1 67 . 1 1 5 5 ILE HG22 H 1 0.8610 0.02 . 1 . . . . 5 ILE HG21 . 26800 1 68 . 1 1 5 5 ILE HG23 H 1 0.8610 0.02 . 1 . . . . 5 ILE HG21 . 26800 1 69 . 1 1 5 5 ILE HD11 H 1 0.7890 0.02 . 1 . . . . 5 ILE HD11 . 26800 1 70 . 1 1 5 5 ILE HD12 H 1 0.7890 0.02 . 1 . . . . 5 ILE HD11 . 26800 1 71 . 1 1 5 5 ILE HD13 H 1 0.7890 0.02 . 1 . . . . 5 ILE HD11 . 26800 1 72 . 1 1 5 5 ILE C C 13 172.4750 0.3 . 1 . . . . 5 ILE C . 26800 1 73 . 1 1 5 5 ILE CA C 13 60.6310 0.3 . 1 . . . . 5 ILE CA . 26800 1 74 . 1 1 5 5 ILE CB C 13 39.7630 0.3 . 1 . . . . 5 ILE CB . 26800 1 75 . 1 1 5 5 ILE CG1 C 13 26.7960 0.3 . 1 . . . . 5 ILE CG1 . 26800 1 76 . 1 1 5 5 ILE CG2 C 13 18.9610 0.3 . 1 . . . . 5 ILE CG2 . 26800 1 77 . 1 1 5 5 ILE CD1 C 13 15.1370 0.3 . 1 . . . . 5 ILE CD1 . 26800 1 78 . 1 1 5 5 ILE N N 15 125.5980 0.2 . 1 . . . . 5 ILE N . 26800 1 79 . 1 1 6 6 ASP H H 1 8.0500 0.02 . 1 . . . . 6 ASP H . 26800 1 80 . 1 1 6 6 ASP HA H 1 4.9650 0.02 . 1 . . . . 6 ASP HA . 26800 1 81 . 1 1 6 6 ASP HB2 H 1 3.2880 0.02 . 2 . . . . 6 ASP HB2 . 26800 1 82 . 1 1 6 6 ASP HB3 H 1 2.9100 0.02 . 2 . . . . 6 ASP HB3 . 26800 1 83 . 1 1 6 6 ASP C C 13 177.9760 0.3 . 1 . . . . 6 ASP C . 26800 1 84 . 1 1 6 6 ASP CA C 13 52.3710 0.3 . 1 . . . . 6 ASP CA . 26800 1 85 . 1 1 6 6 ASP CB C 13 43.2830 0.3 . 1 . . . . 6 ASP CB . 26800 1 86 . 1 1 6 6 ASP N N 15 119.3720 0.2 . 1 . . . . 6 ASP N . 26800 1 87 . 1 1 7 7 THR H H 1 9.0190 0.02 . 1 . . . . 7 THR H . 26800 1 88 . 1 1 7 7 THR HA H 1 3.6760 0.02 . 1 . . . . 7 THR HA . 26800 1 89 . 1 1 7 7 THR HB H 1 4.1780 0.02 . 1 . . . . 7 THR HB . 26800 1 90 . 1 1 7 7 THR HG21 H 1 1.3270 0.02 . 1 . . . . 7 THR HG21 . 26800 1 91 . 1 1 7 7 THR HG22 H 1 1.3270 0.02 . 1 . . . . 7 THR HG21 . 26800 1 92 . 1 1 7 7 THR HG23 H 1 1.3270 0.02 . 1 . . . . 7 THR HG21 . 26800 1 93 . 1 1 7 7 THR C C 13 175.5770 0.3 . 1 . . . . 7 THR C . 26800 1 94 . 1 1 7 7 THR CA C 13 66.5850 0.3 . 1 . . . . 7 THR CA . 26800 1 95 . 1 1 7 7 THR CB C 13 69.1630 0.3 . 1 . . . . 7 THR CB . 26800 1 96 . 1 1 7 7 THR CG2 C 13 22.9460 0.3 . 1 . . . . 7 THR CG2 . 26800 1 97 . 1 1 7 7 THR N N 15 116.0530 0.2 . 1 . . . . 7 THR N . 26800 1 98 . 1 1 8 8 ASN H H 1 8.6640 0.02 . 1 . . . . 8 ASN H . 26800 1 99 . 1 1 8 8 ASN HA H 1 4.2690 0.02 . 1 . . . . 8 ASN HA . 26800 1 100 . 1 1 8 8 ASN HB2 H 1 2.8320 0.02 . 2 . . . . 8 ASN HB2 . 26800 1 101 . 1 1 8 8 ASN HB3 H 1 2.8320 0.02 . 2 . . . . 8 ASN HB3 . 26800 1 102 . 1 1 8 8 ASN C C 13 177.0280 0.3 . 1 . . . . 8 ASN C . 26800 1 103 . 1 1 8 8 ASN CA C 13 57.4940 0.3 . 1 . . . . 8 ASN CA . 26800 1 104 . 1 1 8 8 ASN CB C 13 37.1150 0.3 . 1 . . . . 8 ASN CB . 26800 1 105 . 1 1 8 8 ASN N N 15 116.8070 0.2 . 1 . . . . 8 ASN N . 26800 1 106 . 1 1 9 9 ILE H H 1 7.2890 0.02 . 1 . . . . 9 ILE H . 26800 1 107 . 1 1 9 9 ILE HA H 1 3.7670 0.02 . 1 . . . . 9 ILE HA . 26800 1 108 . 1 1 9 9 ILE HB H 1 2.2730 0.02 . 1 . . . . 9 ILE HB . 26800 1 109 . 1 1 9 9 ILE HG12 H 1 1.2580 0.02 . 2 . . . . 9 ILE HG12 . 26800 1 110 . 1 1 9 9 ILE HG13 H 1 1.5370 0.02 . 2 . . . . 9 ILE HG13 . 26800 1 111 . 1 1 9 9 ILE HG21 H 1 0.8610 0.02 . 1 . . . . 9 ILE HG21 . 26800 1 112 . 1 1 9 9 ILE HG22 H 1 0.8610 0.02 . 1 . . . . 9 ILE HG21 . 26800 1 113 . 1 1 9 9 ILE HG23 H 1 0.8610 0.02 . 1 . . . . 9 ILE HG21 . 26800 1 114 . 1 1 9 9 ILE HD11 H 1 0.7700 0.02 . 1 . . . . 9 ILE HD11 . 26800 1 115 . 1 1 9 9 ILE HD12 H 1 0.7700 0.02 . 1 . . . . 9 ILE HD11 . 26800 1 116 . 1 1 9 9 ILE HD13 H 1 0.7700 0.02 . 1 . . . . 9 ILE HD11 . 26800 1 117 . 1 1 9 9 ILE C C 13 176.9130 0.3 . 1 . . . . 9 ILE C . 26800 1 118 . 1 1 9 9 ILE CA C 13 62.6400 0.3 . 1 . . . . 9 ILE CA . 26800 1 119 . 1 1 9 9 ILE CB C 13 35.3940 0.3 . 1 . . . . 9 ILE CB . 26800 1 120 . 1 1 9 9 ILE CG1 C 13 28.0370 0.3 . 1 . . . . 9 ILE CG1 . 26800 1 121 . 1 1 9 9 ILE CG2 C 13 18.2970 0.3 . 1 . . . . 9 ILE CG2 . 26800 1 122 . 1 1 9 9 ILE CD1 C 13 11.1420 0.3 . 1 . . . . 9 ILE CD1 . 26800 1 123 . 1 1 9 9 ILE N N 15 119.5190 0.2 . 1 . . . . 9 ILE N . 26800 1 124 . 1 1 10 10 LEU H H 1 7.2090 0.02 . 1 . . . . 10 LEU H . 26800 1 125 . 1 1 10 10 LEU HA H 1 3.7330 0.02 . 1 . . . . 10 LEU HA . 26800 1 126 . 1 1 10 10 LEU HB2 H 1 1.4540 0.02 . 2 . . . . 10 LEU HB2 . 26800 1 127 . 1 1 10 10 LEU HB3 H 1 2.0540 0.02 . 2 . . . . 10 LEU HB3 . 26800 1 128 . 1 1 10 10 LEU HG H 1 1.7780 0.02 . 1 . . . . 10 LEU HG . 26800 1 129 . 1 1 10 10 LEU HD11 H 1 0.8890 0.02 . 2 . . . . 10 LEU HD11 . 26800 1 130 . 1 1 10 10 LEU HD12 H 1 0.8890 0.02 . 2 . . . . 10 LEU HD11 . 26800 1 131 . 1 1 10 10 LEU HD13 H 1 0.8890 0.02 . 2 . . . . 10 LEU HD11 . 26800 1 132 . 1 1 10 10 LEU HD21 H 1 0.7620 0.02 . 2 . . . . 10 LEU HD21 . 26800 1 133 . 1 1 10 10 LEU HD22 H 1 0.7620 0.02 . 2 . . . . 10 LEU HD21 . 26800 1 134 . 1 1 10 10 LEU HD23 H 1 0.7620 0.02 . 2 . . . . 10 LEU HD21 . 26800 1 135 . 1 1 10 10 LEU C C 13 178.7840 0.3 . 1 . . . . 10 LEU C . 26800 1 136 . 1 1 10 10 LEU CA C 13 57.6690 0.3 . 1 . . . . 10 LEU CA . 26800 1 137 . 1 1 10 10 LEU CB C 13 42.8300 0.3 . 1 . . . . 10 LEU CB . 26800 1 138 . 1 1 10 10 LEU CG C 13 26.2660 0.3 . 1 . . . . 10 LEU CG . 26800 1 139 . 1 1 10 10 LEU CD1 C 13 25.9800 0.3 . 2 . . . . 10 LEU CD1 . 26800 1 140 . 1 1 10 10 LEU CD2 C 13 22.3700 0.3 . 2 . . . . 10 LEU CD2 . 26800 1 141 . 1 1 10 10 LEU N N 15 117.6730 0.2 . 1 . . . . 10 LEU N . 26800 1 142 . 1 1 11 11 ILE H H 1 8.7440 0.02 . 1 . . . . 11 ILE H . 26800 1 143 . 1 1 11 11 ILE HA H 1 3.3800 0.02 . 1 . . . . 11 ILE HA . 26800 1 144 . 1 1 11 11 ILE HB H 1 1.8170 0.02 . 1 . . . . 11 ILE HB . 26800 1 145 . 1 1 11 11 ILE HG12 H 1 0.9430 0.02 . 2 . . . . 11 ILE HG12 . 26800 1 146 . 1 1 11 11 ILE HG13 H 1 1.8610 0.02 . 2 . . . . 11 ILE HG13 . 26800 1 147 . 1 1 11 11 ILE HG21 H 1 0.8570 0.02 . 1 . . . . 11 ILE HG21 . 26800 1 148 . 1 1 11 11 ILE HG22 H 1 0.8570 0.02 . 1 . . . . 11 ILE HG21 . 26800 1 149 . 1 1 11 11 ILE HG23 H 1 0.8570 0.02 . 1 . . . . 11 ILE HG21 . 26800 1 150 . 1 1 11 11 ILE HD11 H 1 0.9410 0.02 . 1 . . . . 11 ILE HD11 . 26800 1 151 . 1 1 11 11 ILE HD12 H 1 0.9410 0.02 . 1 . . . . 11 ILE HD11 . 26800 1 152 . 1 1 11 11 ILE HD13 H 1 0.9410 0.02 . 1 . . . . 11 ILE HD11 . 26800 1 153 . 1 1 11 11 ILE C C 13 178.4130 0.3 . 1 . . . . 11 ILE C . 26800 1 154 . 1 1 11 11 ILE CA C 13 65.8760 0.3 . 1 . . . . 11 ILE CA . 26800 1 155 . 1 1 11 11 ILE CB C 13 38.3020 0.3 . 1 . . . . 11 ILE CB . 26800 1 156 . 1 1 11 11 ILE CG1 C 13 29.8080 0.3 . 1 . . . . 11 ILE CG1 . 26800 1 157 . 1 1 11 11 ILE CG2 C 13 17.3950 0.3 . 1 . . . . 11 ILE CG2 . 26800 1 158 . 1 1 11 11 ILE CD1 C 13 15.1980 0.3 . 1 . . . . 11 ILE CD1 . 26800 1 159 . 1 1 11 11 ILE N N 15 117.9950 0.2 . 1 . . . . 11 ILE N . 26800 1 160 . 1 1 12 12 SER H H 1 7.4200 0.02 . 1 . . . . 12 SER H . 26800 1 161 . 1 1 12 12 SER HA H 1 3.8380 0.02 . 1 . . . . 12 SER HA . 26800 1 162 . 1 1 12 12 SER HB2 H 1 3.9330 0.02 . 2 . . . . 12 SER HB2 . 26800 1 163 . 1 1 12 12 SER HB3 H 1 3.9330 0.02 . 2 . . . . 12 SER HB3 . 26800 1 164 . 1 1 12 12 SER C C 13 176.2780 0.3 . 1 . . . . 12 SER C . 26800 1 165 . 1 1 12 12 SER CA C 13 63.5900 0.3 . 1 . . . . 12 SER CA . 26800 1 166 . 1 1 12 12 SER CB C 13 63.1600 0.3 . 1 . . . . 12 SER CB . 26800 1 167 . 1 1 12 12 SER N N 15 114.6440 0.2 . 1 . . . . 12 SER N . 26800 1 168 . 1 1 13 13 ALA H H 1 8.7150 0.02 . 1 . . . . 13 ALA H . 26800 1 169 . 1 1 13 13 ALA HA H 1 4.2280 0.02 . 1 . . . . 13 ALA HA . 26800 1 170 . 1 1 13 13 ALA HB1 H 1 1.1100 0.02 . 1 . . . . 13 ALA HB1 . 26800 1 171 . 1 1 13 13 ALA HB2 H 1 1.1100 0.02 . 1 . . . . 13 ALA HB1 . 26800 1 172 . 1 1 13 13 ALA HB3 H 1 1.1100 0.02 . 1 . . . . 13 ALA HB1 . 26800 1 173 . 1 1 13 13 ALA C C 13 176.7470 0.3 . 1 . . . . 13 ALA C . 26800 1 174 . 1 1 13 13 ALA CA C 13 54.5800 0.3 . 1 . . . . 13 ALA CA . 26800 1 175 . 1 1 13 13 ALA CB C 13 18.1000 0.3 . 1 . . . . 13 ALA CB . 26800 1 176 . 1 1 13 13 ALA N N 15 122.0240 0.2 . 1 . . . . 13 ALA N . 26800 1 177 . 1 1 14 14 SER H H 1 7.3990 0.02 . 1 . . . . 14 SER H . 26800 1 178 . 1 1 14 14 SER HA H 1 3.0270 0.02 . 1 . . . . 14 SER HA . 26800 1 179 . 1 1 14 14 SER HB2 H 1 2.8440 0.02 . 2 . . . . 14 SER HB2 . 26800 1 180 . 1 1 14 14 SER HB3 H 1 3.0910 0.02 . 2 . . . . 14 SER HB3 . 26800 1 181 . 1 1 14 14 SER C C 13 174.9590 0.3 . 1 . . . . 14 SER C . 26800 1 182 . 1 1 14 14 SER CA C 13 59.9200 0.3 . 1 . . . . 14 SER CA . 26800 1 183 . 1 1 14 14 SER CB C 13 62.7600 0.3 . 1 . . . . 14 SER CB . 26800 1 184 . 1 1 14 14 SER N N 15 109.5230 0.2 . 1 . . . . 14 SER N . 26800 1 185 . 1 1 15 15 LEU H H 1 7.1210 0.02 . 1 . . . . 15 LEU H . 26800 1 186 . 1 1 15 15 LEU HA H 1 4.1160 0.02 . 1 . . . . 15 LEU HA . 26800 1 187 . 1 1 15 15 LEU HB2 H 1 1.2240 0.02 . 2 . . . . 15 LEU HB2 . 26800 1 188 . 1 1 15 15 LEU HB3 H 1 1.6160 0.02 . 2 . . . . 15 LEU HB3 . 26800 1 189 . 1 1 15 15 LEU HG H 1 1.4760 0.02 . 1 . . . . 15 LEU HG . 26800 1 190 . 1 1 15 15 LEU HD11 H 1 0.1550 0.02 . 2 . . . . 15 LEU HD11 . 26800 1 191 . 1 1 15 15 LEU HD12 H 1 0.1550 0.02 . 2 . . . . 15 LEU HD11 . 26800 1 192 . 1 1 15 15 LEU HD13 H 1 0.1550 0.02 . 2 . . . . 15 LEU HD11 . 26800 1 193 . 1 1 15 15 LEU HD21 H 1 0.3190 0.02 . 2 . . . . 15 LEU HD21 . 26800 1 194 . 1 1 15 15 LEU HD22 H 1 0.3190 0.02 . 2 . . . . 15 LEU HD21 . 26800 1 195 . 1 1 15 15 LEU HD23 H 1 0.3190 0.02 . 2 . . . . 15 LEU HD21 . 26800 1 196 . 1 1 15 15 LEU C C 13 178.1950 0.3 . 1 . . . . 15 LEU C . 26800 1 197 . 1 1 15 15 LEU CA C 13 56.3100 0.3 . 1 . . . . 15 LEU CA . 26800 1 198 . 1 1 15 15 LEU CB C 13 44.2460 0.3 . 1 . . . . 15 LEU CB . 26800 1 199 . 1 1 15 15 LEU CG C 13 26.0200 0.3 . 1 . . . . 15 LEU CG . 26800 1 200 . 1 1 15 15 LEU CD1 C 13 22.1710 0.3 . 2 . . . . 15 LEU CD1 . 26800 1 201 . 1 1 15 15 LEU CD2 C 13 25.8300 0.3 . 2 . . . . 15 LEU CD2 . 26800 1 202 . 1 1 15 15 LEU N N 15 122.8010 0.2 . 1 . . . . 15 LEU N . 26800 1 203 . 1 1 16 16 SER H H 1 7.5930 0.02 . 1 . . . . 16 SER H . 26800 1 204 . 1 1 16 16 SER HA H 1 4.4600 0.02 . 1 . . . . 16 SER HA . 26800 1 205 . 1 1 16 16 SER HB2 H 1 3.6210 0.02 . 2 . . . . 16 SER HB2 . 26800 1 206 . 1 1 16 16 SER HB3 H 1 3.8290 0.02 . 2 . . . . 16 SER HB3 . 26800 1 207 . 1 1 16 16 SER C C 13 173.1960 0.3 . 1 . . . . 16 SER C . 26800 1 208 . 1 1 16 16 SER CA C 13 57.2100 0.3 . 1 . . . . 16 SER CA . 26800 1 209 . 1 1 16 16 SER CB C 13 64.6590 0.3 . 1 . . . . 16 SER CB . 26800 1 210 . 1 1 16 16 SER N N 15 112.0060 0.2 . 1 . . . . 16 SER N . 26800 1 211 . 1 1 17 17 CYS H H 1 8.2420 0.02 . 1 . . . . 17 CYS H . 26800 1 212 . 1 1 17 17 CYS HA H 1 3.8590 0.02 . 1 . . . . 17 CYS HA . 26800 1 213 . 1 1 17 17 CYS HB2 H 1 2.3760 0.02 . 2 . . . . 17 CYS HB2 . 26800 1 214 . 1 1 17 17 CYS HB3 H 1 2.3760 0.02 . 2 . . . . 17 CYS HB3 . 26800 1 215 . 1 1 17 17 CYS C C 13 173.7410 0.3 . 1 . . . . 17 CYS C . 26800 1 216 . 1 1 17 17 CYS CA C 13 57.2570 0.3 . 1 . . . . 17 CYS CA . 26800 1 217 . 1 1 17 17 CYS CB C 13 26.4420 0.3 . 1 . . . . 17 CYS CB . 26800 1 218 . 1 1 17 17 CYS N N 15 121.1200 0.2 . 1 . . . . 17 CYS N . 26800 1 219 . 1 1 18 18 GLU H H 1 7.9430 0.02 . 1 . . . . 18 GLU H . 26800 1 220 . 1 1 18 18 GLU HA H 1 4.4180 0.02 . 1 . . . . 18 GLU HA . 26800 1 221 . 1 1 18 18 GLU HB2 H 1 1.7830 0.02 . 2 . . . . 18 GLU HB2 . 26800 1 222 . 1 1 18 18 GLU HB3 H 1 2.0450 0.02 . 2 . . . . 18 GLU HB3 . 26800 1 223 . 1 1 18 18 GLU HG2 H 1 2.1460 0.02 . 2 . . . . 18 GLU HG2 . 26800 1 224 . 1 1 18 18 GLU HG3 H 1 2.1460 0.02 . 2 . . . . 18 GLU HG3 . 26800 1 225 . 1 1 18 18 GLU C C 13 176.5360 0.3 . 1 . . . . 18 GLU C . 26800 1 226 . 1 1 18 18 GLU CA C 13 56.0610 0.3 . 1 . . . . 18 GLU CA . 26800 1 227 . 1 1 18 18 GLU CB C 13 31.2460 0.3 . 1 . . . . 18 GLU CB . 26800 1 228 . 1 1 18 18 GLU CG C 13 36.0060 0.3 . 1 . . . . 18 GLU CG . 26800 1 229 . 1 1 18 18 GLU N N 15 119.0770 0.2 . 1 . . . . 18 GLU N . 26800 1 230 . 1 1 19 19 GLY H H 1 8.1970 0.02 . 1 . . . . 19 GLY H . 26800 1 231 . 1 1 19 19 GLY HA2 H 1 4.1320 0.02 . 2 . . . . 19 GLY HA2 . 26800 1 232 . 1 1 19 19 GLY HA3 H 1 4.3750 0.02 . 2 . . . . 19 GLY HA3 . 26800 1 233 . 1 1 19 19 GLY C C 13 173.9280 0.3 . 1 . . . . 19 GLY C . 26800 1 234 . 1 1 19 19 GLY CA C 13 44.2000 0.3 . 1 . . . . 19 GLY CA . 26800 1 235 . 1 1 19 19 GLY N N 15 108.6780 0.2 . 1 . . . . 19 GLY N . 26800 1 236 . 1 1 20 20 THR H H 1 8.7230 0.02 . 1 . . . . 20 THR H . 26800 1 237 . 1 1 20 20 THR HA H 1 4.0690 0.02 . 1 . . . . 20 THR HA . 26800 1 238 . 1 1 20 20 THR HB H 1 4.2840 0.02 . 1 . . . . 20 THR HB . 26800 1 239 . 1 1 20 20 THR HG21 H 1 1.1990 0.02 . 1 . . . . 20 THR HG21 . 26800 1 240 . 1 1 20 20 THR HG22 H 1 1.1990 0.02 . 1 . . . . 20 THR HG21 . 26800 1 241 . 1 1 20 20 THR HG23 H 1 1.1990 0.02 . 1 . . . . 20 THR HG21 . 26800 1 242 . 1 1 20 20 THR C C 13 173.9500 0.3 . 1 . . . . 20 THR C . 26800 1 243 . 1 1 20 20 THR CA C 13 67.6900 0.3 . 1 . . . . 20 THR CA . 26800 1 244 . 1 1 20 20 THR CB C 13 67.6700 0.3 . 1 . . . . 20 THR CB . 26800 1 245 . 1 1 20 20 THR CG2 C 13 22.5000 0.3 . 1 . . . . 20 THR CG2 . 26800 1 246 . 1 1 20 20 THR N N 15 115.1450 0.2 . 1 . . . . 20 THR N . 26800 1 247 . 1 1 21 21 PRO HA H 1 4.0620 0.02 . 1 . . . . 21 PRO HA . 26800 1 248 . 1 1 21 21 PRO HB2 H 1 2.3830 0.02 . 2 . . . . 21 PRO HB2 . 26800 1 249 . 1 1 21 21 PRO HB3 H 1 1.9000 0.02 . 2 . . . . 21 PRO HB3 . 26800 1 250 . 1 1 21 21 PRO HG2 H 1 2.2310 0.02 . 2 . . . . 21 PRO HG2 . 26800 1 251 . 1 1 21 21 PRO HG3 H 1 1.9340 0.02 . 2 . . . . 21 PRO HG3 . 26800 1 252 . 1 1 21 21 PRO HD2 H 1 3.9960 0.02 . 2 . . . . 21 PRO HD2 . 26800 1 253 . 1 1 21 21 PRO HD3 H 1 3.7060 0.02 . 2 . . . . 21 PRO HD3 . 26800 1 254 . 1 1 21 21 PRO C C 13 177.7200 0.3 . 1 . . . . 21 PRO C . 26800 1 255 . 1 1 21 21 PRO CA C 13 67.3470 0.3 . 1 . . . . 21 PRO CA . 26800 1 256 . 1 1 21 21 PRO CB C 13 31.8610 0.3 . 1 . . . . 21 PRO CB . 26800 1 257 . 1 1 21 21 PRO CG C 13 28.5800 0.3 . 1 . . . . 21 PRO CG . 26800 1 258 . 1 1 21 21 PRO CD C 13 50.2400 0.3 . 1 . . . . 21 PRO CD . 26800 1 259 . 1 1 22 22 TYR H H 1 7.5230 0.02 . 1 . . . . 22 TYR H . 26800 1 260 . 1 1 22 22 TYR HA H 1 4.1400 0.02 . 1 . . . . 22 TYR HA . 26800 1 261 . 1 1 22 22 TYR HB2 H 1 2.8090 0.02 . 2 . . . . 22 TYR HB2 . 26800 1 262 . 1 1 22 22 TYR HB3 H 1 3.3750 0.02 . 2 . . . . 22 TYR HB3 . 26800 1 263 . 1 1 22 22 TYR HD1 H 1 7.1600 0.02 . 3 . . . . 22 TYR HD1 . 26800 1 264 . 1 1 22 22 TYR HD2 H 1 7.1600 0.02 . 3 . . . . 22 TYR HD2 . 26800 1 265 . 1 1 22 22 TYR HE1 H 1 6.8880 0.02 . 3 . . . . 22 TYR HE1 . 26800 1 266 . 1 1 22 22 TYR HE2 H 1 6.8880 0.02 . 3 . . . . 22 TYR HE2 . 26800 1 267 . 1 1 22 22 TYR C C 13 176.6870 0.3 . 1 . . . . 22 TYR C . 26800 1 268 . 1 1 22 22 TYR CA C 13 62.5100 0.3 . 1 . . . . 22 TYR CA . 26800 1 269 . 1 1 22 22 TYR CB C 13 38.5600 0.3 . 1 . . . . 22 TYR CB . 26800 1 270 . 1 1 22 22 TYR CD1 C 13 133.8000 0.3 . 3 . . . . 22 TYR CD1 . 26800 1 271 . 1 1 22 22 TYR CD2 C 13 133.8000 0.3 . 3 . . . . 22 TYR CD2 . 26800 1 272 . 1 1 22 22 TYR CE1 C 13 118.2000 0.3 . 3 . . . . 22 TYR CE1 . 26800 1 273 . 1 1 22 22 TYR CE2 C 13 118.2000 0.3 . 3 . . . . 22 TYR CE2 . 26800 1 274 . 1 1 22 22 TYR N N 15 116.3410 0.2 . 1 . . . . 22 TYR N . 26800 1 275 . 1 1 23 23 GLN H H 1 7.9240 0.02 . 1 . . . . 23 GLN H . 26800 1 276 . 1 1 23 23 GLN HA H 1 3.9100 0.02 . 1 . . . . 23 GLN HA . 26800 1 277 . 1 1 23 23 GLN HB2 H 1 2.1460 0.02 . 2 . . . . 23 GLN HB2 . 26800 1 278 . 1 1 23 23 GLN HB3 H 1 2.2650 0.02 . 2 . . . . 23 GLN HB3 . 26800 1 279 . 1 1 23 23 GLN HG2 H 1 2.5500 0.02 . 2 . . . . 23 GLN HG2 . 26800 1 280 . 1 1 23 23 GLN HG3 H 1 2.6250 0.02 . 2 . . . . 23 GLN HG3 . 26800 1 281 . 1 1 23 23 GLN HE21 H 1 7.4720 0.02 . 2 . . . . 23 GLN HE21 . 26800 1 282 . 1 1 23 23 GLN HE22 H 1 6.8490 0.02 . 2 . . . . 23 GLN HE22 . 26800 1 283 . 1 1 23 23 GLN C C 13 179.2930 0.3 . 1 . . . . 23 GLN C . 26800 1 284 . 1 1 23 23 GLN CA C 13 58.7360 0.3 . 1 . . . . 23 GLN CA . 26800 1 285 . 1 1 23 23 GLN CB C 13 28.6010 0.3 . 1 . . . . 23 GLN CB . 26800 1 286 . 1 1 23 23 GLN CG C 13 34.0140 0.3 . 1 . . . . 23 GLN CG . 26800 1 287 . 1 1 23 23 GLN N N 15 116.0710 0.2 . 1 . . . . 23 GLN N . 26800 1 288 . 1 1 23 23 GLN NE2 N 15 111.4000 0.2 . 1 . . . . 23 GLN NE2 . 26800 1 289 . 1 1 24 24 ALA H H 1 8.7680 0.02 . 1 . . . . 24 ALA H . 26800 1 290 . 1 1 24 24 ALA HA H 1 4.1240 0.02 . 1 . . . . 24 ALA HA . 26800 1 291 . 1 1 24 24 ALA HB1 H 1 1.6430 0.02 . 1 . . . . 24 ALA HB1 . 26800 1 292 . 1 1 24 24 ALA HB2 H 1 1.6430 0.02 . 1 . . . . 24 ALA HB1 . 26800 1 293 . 1 1 24 24 ALA HB3 H 1 1.6430 0.02 . 1 . . . . 24 ALA HB1 . 26800 1 294 . 1 1 24 24 ALA C C 13 177.7600 0.3 . 1 . . . . 24 ALA C . 26800 1 295 . 1 1 24 24 ALA CA C 13 55.7470 0.3 . 1 . . . . 24 ALA CA . 26800 1 296 . 1 1 24 24 ALA CB C 13 18.4390 0.3 . 1 . . . . 24 ALA CB . 26800 1 297 . 1 1 24 24 ALA N N 15 122.5090 0.2 . 1 . . . . 24 ALA N . 26800 1 298 . 1 1 25 25 TYR H H 1 8.1160 0.02 . 1 . . . . 25 TYR H . 26800 1 299 . 1 1 25 25 TYR HA H 1 3.8700 0.02 . 1 . . . . 25 TYR HA . 26800 1 300 . 1 1 25 25 TYR HB2 H 1 3.1880 0.02 . 2 . . . . 25 TYR HB2 . 26800 1 301 . 1 1 25 25 TYR HB3 H 1 2.7960 0.02 . 2 . . . . 25 TYR HB3 . 26800 1 302 . 1 1 25 25 TYR HD1 H 1 6.6230 0.02 . 3 . . . . 25 TYR HD1 . 26800 1 303 . 1 1 25 25 TYR HD2 H 1 6.6230 0.02 . 3 . . . . 25 TYR HD2 . 26800 1 304 . 1 1 25 25 TYR HE1 H 1 6.5000 0.02 . 3 . . . . 25 TYR HE1 . 26800 1 305 . 1 1 25 25 TYR HE2 H 1 6.5000 0.02 . 3 . . . . 25 TYR HE2 . 26800 1 306 . 1 1 25 25 TYR C C 13 175.5390 0.3 . 1 . . . . 25 TYR C . 26800 1 307 . 1 1 25 25 TYR CA C 13 61.7930 0.3 . 1 . . . . 25 TYR CA . 26800 1 308 . 1 1 25 25 TYR CB C 13 37.8700 0.3 . 1 . . . . 25 TYR CB . 26800 1 309 . 1 1 25 25 TYR CD1 C 13 132.3600 0.3 . 3 . . . . 25 TYR CD1 . 26800 1 310 . 1 1 25 25 TYR CD2 C 13 132.3600 0.3 . 3 . . . . 25 TYR CD2 . 26800 1 311 . 1 1 25 25 TYR CE1 C 13 117.9000 0.3 . 3 . . . . 25 TYR CE1 . 26800 1 312 . 1 1 25 25 TYR CE2 C 13 117.9000 0.3 . 3 . . . . 25 TYR CE2 . 26800 1 313 . 1 1 25 25 TYR N N 15 119.4420 0.2 . 1 . . . . 25 TYR N . 26800 1 314 . 1 1 26 26 ILE H H 1 8.0980 0.02 . 1 . . . . 26 ILE H . 26800 1 315 . 1 1 26 26 ILE HA H 1 3.3970 0.02 . 1 . . . . 26 ILE HA . 26800 1 316 . 1 1 26 26 ILE HB H 1 1.7680 0.02 . 1 . . . . 26 ILE HB . 26800 1 317 . 1 1 26 26 ILE HG12 H 1 1.1330 0.02 . 2 . . . . 26 ILE HG12 . 26800 1 318 . 1 1 26 26 ILE HG13 H 1 1.1330 0.02 . 2 . . . . 26 ILE HG13 . 26800 1 319 . 1 1 26 26 ILE HG21 H 1 0.7560 0.02 . 1 . . . . 26 ILE HG21 . 26800 1 320 . 1 1 26 26 ILE HG22 H 1 0.7560 0.02 . 1 . . . . 26 ILE HG21 . 26800 1 321 . 1 1 26 26 ILE HG23 H 1 0.7560 0.02 . 1 . . . . 26 ILE HG21 . 26800 1 322 . 1 1 26 26 ILE HD11 H 1 0.5730 0.02 . 1 . . . . 26 ILE HD11 . 26800 1 323 . 1 1 26 26 ILE HD12 H 1 0.5730 0.02 . 1 . . . . 26 ILE HD11 . 26800 1 324 . 1 1 26 26 ILE HD13 H 1 0.5730 0.02 . 1 . . . . 26 ILE HD11 . 26800 1 325 . 1 1 26 26 ILE C C 13 179.8980 0.3 . 1 . . . . 26 ILE C . 26800 1 326 . 1 1 26 26 ILE CA C 13 61.3420 0.3 . 1 . . . . 26 ILE CA . 26800 1 327 . 1 1 26 26 ILE CB C 13 35.8730 0.3 . 1 . . . . 26 ILE CB . 26800 1 328 . 1 1 26 26 ILE CG1 C 13 27.2620 0.3 . 1 . . . . 26 ILE CG1 . 26800 1 329 . 1 1 26 26 ILE CG2 C 13 17.6330 0.3 . 1 . . . . 26 ILE CG2 . 26800 1 330 . 1 1 26 26 ILE CD1 C 13 9.5140 0.3 . 1 . . . . 26 ILE CD1 . 26800 1 331 . 1 1 26 26 ILE N N 15 116.6780 0.2 . 1 . . . . 26 ILE N . 26800 1 332 . 1 1 27 27 LYS H H 1 8.0530 0.02 . 1 . . . . 27 LYS H . 26800 1 333 . 1 1 27 27 LYS HA H 1 3.9730 0.02 . 1 . . . . 27 LYS HA . 26800 1 334 . 1 1 27 27 LYS HB2 H 1 1.8510 0.02 . 2 . . . . 27 LYS HB2 . 26800 1 335 . 1 1 27 27 LYS HB3 H 1 1.8510 0.02 . 2 . . . . 27 LYS HB3 . 26800 1 336 . 1 1 27 27 LYS HG2 H 1 1.0130 0.02 . 2 . . . . 27 LYS HG2 . 26800 1 337 . 1 1 27 27 LYS HG3 H 1 1.3510 0.02 . 2 . . . . 27 LYS HG3 . 26800 1 338 . 1 1 27 27 LYS HD2 H 1 1.4130 0.02 . 2 . . . . 27 LYS HD2 . 26800 1 339 . 1 1 27 27 LYS HD3 H 1 0.8940 0.02 . 2 . . . . 27 LYS HD3 . 26800 1 340 . 1 1 27 27 LYS HE2 H 1 2.5000 0.02 . 2 . . . . 27 LYS HE2 . 26800 1 341 . 1 1 27 27 LYS HE3 H 1 2.6670 0.02 . 2 . . . . 27 LYS HE3 . 26800 1 342 . 1 1 27 27 LYS C C 13 178.7670 0.3 . 1 . . . . 27 LYS C . 26800 1 343 . 1 1 27 27 LYS CA C 13 59.1400 0.3 . 1 . . . . 27 LYS CA . 26800 1 344 . 1 1 27 27 LYS CB C 13 32.2490 0.3 . 1 . . . . 27 LYS CB . 26800 1 345 . 1 1 27 27 LYS CG C 13 25.4600 0.3 . 1 . . . . 27 LYS CG . 26800 1 346 . 1 1 27 27 LYS CD C 13 29.5100 0.3 . 1 . . . . 27 LYS CD . 26800 1 347 . 1 1 27 27 LYS CE C 13 42.0900 0.3 . 1 . . . . 27 LYS CE . 26800 1 348 . 1 1 27 27 LYS N N 15 121.8130 0.2 . 1 . . . . 27 LYS N . 26800 1 349 . 1 1 28 28 ALA H H 1 8.3450 0.02 . 1 . . . . 28 ALA H . 26800 1 350 . 1 1 28 28 ALA HA H 1 3.9840 0.02 . 1 . . . . 28 ALA HA . 26800 1 351 . 1 1 28 28 ALA HB1 H 1 1.3380 0.02 . 1 . . . . 28 ALA HB1 . 26800 1 352 . 1 1 28 28 ALA HB2 H 1 1.3380 0.02 . 1 . . . . 28 ALA HB1 . 26800 1 353 . 1 1 28 28 ALA HB3 H 1 1.3380 0.02 . 1 . . . . 28 ALA HB1 . 26800 1 354 . 1 1 28 28 ALA C C 13 175.1380 0.3 . 1 . . . . 28 ALA C . 26800 1 355 . 1 1 28 28 ALA CA C 13 55.6200 0.3 . 1 . . . . 28 ALA CA . 26800 1 356 . 1 1 28 28 ALA CB C 13 19.5360 0.3 . 1 . . . . 28 ALA CB . 26800 1 357 . 1 1 28 28 ALA N N 15 121.8320 0.2 . 1 . . . . 28 ALA N . 26800 1 358 . 1 1 29 29 VAL H H 1 6.8760 0.02 . 1 . . . . 29 VAL H . 26800 1 359 . 1 1 29 29 VAL HA H 1 4.4180 0.02 . 1 . . . . 29 VAL HA . 26800 1 360 . 1 1 29 29 VAL HB H 1 2.2090 0.02 . 1 . . . . 29 VAL HB . 26800 1 361 . 1 1 29 29 VAL HG11 H 1 0.5310 0.02 . 2 . . . . 29 VAL HG11 . 26800 1 362 . 1 1 29 29 VAL HG12 H 1 0.5310 0.02 . 2 . . . . 29 VAL HG11 . 26800 1 363 . 1 1 29 29 VAL HG13 H 1 0.5310 0.02 . 2 . . . . 29 VAL HG11 . 26800 1 364 . 1 1 29 29 VAL HG21 H 1 0.5150 0.02 . 2 . . . . 29 VAL HG21 . 26800 1 365 . 1 1 29 29 VAL HG22 H 1 0.5150 0.02 . 2 . . . . 29 VAL HG21 . 26800 1 366 . 1 1 29 29 VAL HG23 H 1 0.5150 0.02 . 2 . . . . 29 VAL HG21 . 26800 1 367 . 1 1 29 29 VAL C C 13 177.5320 0.3 . 1 . . . . 29 VAL C . 26800 1 368 . 1 1 29 29 VAL CA C 13 59.8680 0.3 . 1 . . . . 29 VAL CA . 26800 1 369 . 1 1 29 29 VAL CB C 13 31.6710 0.3 . 1 . . . . 29 VAL CB . 26800 1 370 . 1 1 29 29 VAL CG1 C 13 21.8390 0.3 . 2 . . . . 29 VAL CG1 . 26800 1 371 . 1 1 29 29 VAL CG2 C 13 17.4120 0.3 . 2 . . . . 29 VAL CG2 . 26800 1 372 . 1 1 29 29 VAL N N 15 100.1940 0.2 . 1 . . . . 29 VAL N . 26800 1 373 . 1 1 30 30 THR H H 1 7.2720 0.02 . 1 . . . . 30 THR H . 26800 1 374 . 1 1 30 30 THR HA H 1 4.2700 0.02 . 1 . . . . 30 THR HA . 26800 1 375 . 1 1 30 30 THR HB H 1 4.0640 0.02 . 1 . . . . 30 THR HB . 26800 1 376 . 1 1 30 30 THR HG21 H 1 1.3590 0.02 . 1 . . . . 30 THR HG21 . 26800 1 377 . 1 1 30 30 THR HG22 H 1 1.3590 0.02 . 1 . . . . 30 THR HG21 . 26800 1 378 . 1 1 30 30 THR HG23 H 1 1.3590 0.02 . 1 . . . . 30 THR HG21 . 26800 1 379 . 1 1 30 30 THR C C 13 173.9030 0.3 . 1 . . . . 30 THR C . 26800 1 380 . 1 1 30 30 THR CA C 13 62.5950 0.3 . 1 . . . . 30 THR CA . 26800 1 381 . 1 1 30 30 THR CB C 13 70.0560 0.3 . 1 . . . . 30 THR CB . 26800 1 382 . 1 1 30 30 THR CG2 C 13 20.8430 0.3 . 1 . . . . 30 THR CG2 . 26800 1 383 . 1 1 30 30 THR N N 15 119.2950 0.2 . 1 . . . . 30 THR N . 26800 1 384 . 1 1 31 31 HIS H H 1 8.9650 0.02 . 1 . . . . 31 HIS H . 26800 1 385 . 1 1 31 31 HIS HA H 1 4.5000 0.02 . 1 . . . . 31 HIS HA . 26800 1 386 . 1 1 31 31 HIS HB2 H 1 3.1020 0.02 . 2 . . . . 31 HIS HB2 . 26800 1 387 . 1 1 31 31 HIS HB3 H 1 3.2560 0.02 . 2 . . . . 31 HIS HB3 . 26800 1 388 . 1 1 31 31 HIS HD2 H 1 7.1470 0.02 . 1 . . . . 31 HIS HD2 . 26800 1 389 . 1 1 31 31 HIS HE1 H 1 8.0800 0.02 . 1 . . . . 31 HIS HE1 . 26800 1 390 . 1 1 31 31 HIS C C 13 174.1170 0.3 . 1 . . . . 31 HIS C . 26800 1 391 . 1 1 31 31 HIS CA C 13 56.5030 0.3 . 1 . . . . 31 HIS CA . 26800 1 392 . 1 1 31 31 HIS CB C 13 29.8520 0.3 . 1 . . . . 31 HIS CB . 26800 1 393 . 1 1 31 31 HIS CD2 C 13 119.8030 0.3 . 1 . . . . 31 HIS CD2 . 26800 1 394 . 1 1 31 31 HIS CE1 C 13 138.4250 0.3 . 1 . . . . 31 HIS CE1 . 26800 1 395 . 1 1 31 31 HIS N N 15 128.8450 0.2 . 1 . . . . 31 HIS N . 26800 1 396 . 1 1 32 32 PRO HA H 1 3.6420 0.02 . 1 . . . . 32 PRO HA . 26800 1 397 . 1 1 32 32 PRO HB2 H 1 2.1770 0.02 . 2 . . . . 32 PRO HB2 . 26800 1 398 . 1 1 32 32 PRO HB3 H 1 1.5480 0.02 . 2 . . . . 32 PRO HB3 . 26800 1 399 . 1 1 32 32 PRO HG2 H 1 1.7850 0.02 . 2 . . . . 32 PRO HG2 . 26800 1 400 . 1 1 32 32 PRO HG3 H 1 1.4500 0.02 . 2 . . . . 32 PRO HG3 . 26800 1 401 . 1 1 32 32 PRO HD2 H 1 3.4100 0.02 . 2 . . . . 32 PRO HD2 . 26800 1 402 . 1 1 32 32 PRO HD3 H 1 3.3500 0.02 . 2 . . . . 32 PRO HD3 . 26800 1 403 . 1 1 32 32 PRO C C 13 175.8770 0.3 . 1 . . . . 32 PRO C . 26800 1 404 . 1 1 32 32 PRO CA C 13 63.5020 0.3 . 1 . . . . 32 PRO CA . 26800 1 405 . 1 1 32 32 PRO CB C 13 33.3810 0.3 . 1 . . . . 32 PRO CB . 26800 1 406 . 1 1 32 32 PRO CG C 13 24.6060 0.3 . 1 . . . . 32 PRO CG . 26800 1 407 . 1 1 32 32 PRO CD C 13 49.8000 0.3 . 1 . . . . 32 PRO CD . 26800 1 408 . 1 1 33 33 ASN H H 1 9.0860 0.02 . 1 . . . . 33 ASN H . 26800 1 409 . 1 1 33 33 ASN HA H 1 5.1300 0.02 . 1 . . . . 33 ASN HA . 26800 1 410 . 1 1 33 33 ASN HB2 H 1 2.8440 0.02 . 2 . . . . 33 ASN HB2 . 26800 1 411 . 1 1 33 33 ASN HB3 H 1 2.9740 0.02 . 2 . . . . 33 ASN HB3 . 26800 1 412 . 1 1 33 33 ASN HD21 H 1 7.6630 0.02 . 2 . . . . 33 ASN HD21 . 26800 1 413 . 1 1 33 33 ASN HD22 H 1 7.0600 0.02 . 2 . . . . 33 ASN HD22 . 26800 1 414 . 1 1 33 33 ASN C C 13 172.7240 0.3 . 1 . . . . 33 ASN C . 26800 1 415 . 1 1 33 33 ASN CA C 13 53.3290 0.3 . 1 . . . . 33 ASN CA . 26800 1 416 . 1 1 33 33 ASN CB C 13 39.6080 0.3 . 1 . . . . 33 ASN CB . 26800 1 417 . 1 1 33 33 ASN N N 15 125.9940 0.2 . 1 . . . . 33 ASN N . 26800 1 418 . 1 1 33 33 ASN ND2 N 15 111.7100 0.2 . 1 . . . . 33 ASN ND2 . 26800 1 419 . 1 1 34 34 HIS H H 1 8.5410 0.02 . 1 . . . . 34 HIS H . 26800 1 420 . 1 1 34 34 HIS HA H 1 4.9310 0.02 . 1 . . . . 34 HIS HA . 26800 1 421 . 1 1 34 34 HIS HB2 H 1 3.0680 0.02 . 2 . . . . 34 HIS HB2 . 26800 1 422 . 1 1 34 34 HIS HB3 H 1 3.1660 0.02 . 2 . . . . 34 HIS HB3 . 26800 1 423 . 1 1 34 34 HIS HD2 H 1 6.9420 0.02 . 1 . . . . 34 HIS HD2 . 26800 1 424 . 1 1 34 34 HIS HE1 H 1 8.6730 0.02 . 1 . . . . 34 HIS HE1 . 26800 1 425 . 1 1 34 34 HIS C C 13 173.1510 0.3 . 1 . . . . 34 HIS C . 26800 1 426 . 1 1 34 34 HIS CA C 13 54.1840 0.3 . 1 . . . . 34 HIS CA . 26800 1 427 . 1 1 34 34 HIS CB C 13 30.9700 0.3 . 1 . . . . 34 HIS CB . 26800 1 428 . 1 1 34 34 HIS CD2 C 13 118.9900 0.3 . 1 . . . . 34 HIS CD2 . 26800 1 429 . 1 1 34 34 HIS CE1 C 13 137.2700 0.3 . 1 . . . . 34 HIS CE1 . 26800 1 430 . 1 1 34 34 HIS N N 15 118.9770 0.2 . 1 . . . . 34 HIS N . 26800 1 431 . 1 1 35 35 GLY H H 1 9.3220 0.02 . 1 . . . . 35 GLY H . 26800 1 432 . 1 1 35 35 GLY HA2 H 1 3.1170 0.02 . 2 . . . . 35 GLY HA2 . 26800 1 433 . 1 1 35 35 GLY HA3 H 1 4.7370 0.02 . 2 . . . . 35 GLY HA3 . 26800 1 434 . 1 1 35 35 GLY C C 13 173.3240 0.3 . 1 . . . . 35 GLY C . 26800 1 435 . 1 1 35 35 GLY CA C 13 45.3590 0.3 . 1 . . . . 35 GLY CA . 26800 1 436 . 1 1 35 35 GLY N N 15 116.5150 0.2 . 1 . . . . 35 GLY N . 26800 1 437 . 1 1 36 36 MET H H 1 8.9760 0.02 . 1 . . . . 36 MET H . 26800 1 438 . 1 1 36 36 MET HA H 1 5.6840 0.02 . 1 . . . . 36 MET HA . 26800 1 439 . 1 1 36 36 MET HB2 H 1 1.7900 0.02 . 2 . . . . 36 MET HB2 . 26800 1 440 . 1 1 36 36 MET HB3 H 1 2.0140 0.02 . 2 . . . . 36 MET HB3 . 26800 1 441 . 1 1 36 36 MET HG2 H 1 2.2870 0.02 . 2 . . . . 36 MET HG2 . 26800 1 442 . 1 1 36 36 MET HG3 H 1 2.3580 0.02 . 2 . . . . 36 MET HG3 . 26800 1 443 . 1 1 36 36 MET HE1 H 1 1.8260 0.02 . 1 . . . . 36 MET HE1 . 26800 1 444 . 1 1 36 36 MET HE2 H 1 1.8260 0.02 . 1 . . . . 36 MET HE1 . 26800 1 445 . 1 1 36 36 MET HE3 H 1 1.8260 0.02 . 1 . . . . 36 MET HE1 . 26800 1 446 . 1 1 36 36 MET C C 13 173.6270 0.3 . 1 . . . . 36 MET C . 26800 1 447 . 1 1 36 36 MET CA C 13 53.9710 0.3 . 1 . . . . 36 MET CA . 26800 1 448 . 1 1 36 36 MET CB C 13 38.0570 0.3 . 1 . . . . 36 MET CB . 26800 1 449 . 1 1 36 36 MET CG C 13 31.1360 0.3 . 1 . . . . 36 MET CG . 26800 1 450 . 1 1 36 36 MET CE C 13 17.2000 0.3 . 1 . . . . 36 MET CE . 26800 1 451 . 1 1 36 36 MET N N 15 121.2310 0.2 . 1 . . . . 36 MET N . 26800 1 452 . 1 1 37 37 VAL H H 1 8.8200 0.02 . 1 . . . . 37 VAL H . 26800 1 453 . 1 1 37 37 VAL HA H 1 4.6690 0.02 . 1 . . . . 37 VAL HA . 26800 1 454 . 1 1 37 37 VAL HB H 1 2.3080 0.02 . 1 . . . . 37 VAL HB . 26800 1 455 . 1 1 37 37 VAL HG11 H 1 1.1260 0.02 . 2 . . . . 37 VAL HG11 . 26800 1 456 . 1 1 37 37 VAL HG12 H 1 1.1260 0.02 . 2 . . . . 37 VAL HG11 . 26800 1 457 . 1 1 37 37 VAL HG13 H 1 1.1260 0.02 . 2 . . . . 37 VAL HG11 . 26800 1 458 . 1 1 37 37 VAL HG21 H 1 0.7910 0.02 . 2 . . . . 37 VAL HG21 . 26800 1 459 . 1 1 37 37 VAL HG22 H 1 0.7910 0.02 . 2 . . . . 37 VAL HG21 . 26800 1 460 . 1 1 37 37 VAL HG23 H 1 0.7910 0.02 . 2 . . . . 37 VAL HG21 . 26800 1 461 . 1 1 37 37 VAL C C 13 174.0290 0.3 . 1 . . . . 37 VAL C . 26800 1 462 . 1 1 37 37 VAL CA C 13 59.2850 0.3 . 1 . . . . 37 VAL CA . 26800 1 463 . 1 1 37 37 VAL CB C 13 36.5420 0.3 . 1 . . . . 37 VAL CB . 26800 1 464 . 1 1 37 37 VAL CG1 C 13 23.9420 0.3 . 2 . . . . 37 VAL CG1 . 26800 1 465 . 1 1 37 37 VAL CG2 C 13 19.7360 0.3 . 2 . . . . 37 VAL CG2 . 26800 1 466 . 1 1 37 37 VAL N N 15 113.1760 0.2 . 1 . . . . 37 VAL N . 26800 1 467 . 1 1 38 38 CYS H H 1 9.6130 0.02 . 1 . . . . 38 CYS H . 26800 1 468 . 1 1 38 38 CYS HA H 1 5.6150 0.02 . 1 . . . . 38 CYS HA . 26800 1 469 . 1 1 38 38 CYS HB2 H 1 2.8530 0.02 . 2 . . . . 38 CYS HB2 . 26800 1 470 . 1 1 38 38 CYS HB3 H 1 2.9430 0.02 . 2 . . . . 38 CYS HB3 . 26800 1 471 . 1 1 38 38 CYS C C 13 176.6880 0.3 . 1 . . . . 38 CYS C . 26800 1 472 . 1 1 38 38 CYS CA C 13 56.6700 0.3 . 1 . . . . 38 CYS CA . 26800 1 473 . 1 1 38 38 CYS CB C 13 29.8700 0.3 . 1 . . . . 38 CYS CB . 26800 1 474 . 1 1 38 38 CYS N N 15 120.1430 0.2 . 1 . . . . 38 CYS N . 26800 1 475 . 1 1 39 39 ASP H H 1 8.8940 0.02 . 1 . . . . 39 ASP H . 26800 1 476 . 1 1 39 39 ASP HA H 1 4.0750 0.02 . 1 . . . . 39 ASP HA . 26800 1 477 . 1 1 39 39 ASP HB2 H 1 2.8300 0.02 . 2 . . . . 39 ASP HB2 . 26800 1 478 . 1 1 39 39 ASP HB3 H 1 2.6350 0.02 . 2 . . . . 39 ASP HB3 . 26800 1 479 . 1 1 39 39 ASP C C 13 178.9640 0.3 . 1 . . . . 39 ASP C . 26800 1 480 . 1 1 39 39 ASP CA C 13 58.1700 0.3 . 1 . . . . 39 ASP CA . 26800 1 481 . 1 1 39 39 ASP CB C 13 38.8750 0.3 . 1 . . . . 39 ASP CB . 26800 1 482 . 1 1 39 39 ASP N N 15 126.5090 0.2 . 1 . . . . 39 ASP N . 26800 1 483 . 1 1 40 40 GLN H H 1 8.4710 0.02 . 1 . . . . 40 GLN H . 26800 1 484 . 1 1 40 40 GLN HA H 1 4.1780 0.02 . 1 . . . . 40 GLN HA . 26800 1 485 . 1 1 40 40 GLN HB2 H 1 1.9200 0.02 . 2 . . . . 40 GLN HB2 . 26800 1 486 . 1 1 40 40 GLN HB3 H 1 2.1800 0.02 . 2 . . . . 40 GLN HB3 . 26800 1 487 . 1 1 40 40 GLN HG2 H 1 2.3520 0.02 . 2 . . . . 40 GLN HG2 . 26800 1 488 . 1 1 40 40 GLN HG3 H 1 2.5520 0.02 . 2 . . . . 40 GLN HG3 . 26800 1 489 . 1 1 40 40 GLN HE21 H 1 7.7010 0.02 . 2 . . . . 40 GLN HE21 . 26800 1 490 . 1 1 40 40 GLN HE22 H 1 6.9030 0.02 . 2 . . . . 40 GLN HE22 . 26800 1 491 . 1 1 40 40 GLN C C 13 178.3240 0.3 . 1 . . . . 40 GLN C . 26800 1 492 . 1 1 40 40 GLN CA C 13 59.0600 0.3 . 1 . . . . 40 GLN CA . 26800 1 493 . 1 1 40 40 GLN CB C 13 28.2210 0.3 . 1 . . . . 40 GLN CB . 26800 1 494 . 1 1 40 40 GLN CG C 13 33.9000 0.3 . 1 . . . . 40 GLN CG . 26800 1 495 . 1 1 40 40 GLN N N 15 120.6490 0.2 . 1 . . . . 40 GLN N . 26800 1 496 . 1 1 40 40 GLN NE2 N 15 111.1300 0.2 . 1 . . . . 40 GLN NE2 . 26800 1 497 . 1 1 41 41 ASN H H 1 7.8880 0.02 . 1 . . . . 41 ASN H . 26800 1 498 . 1 1 41 41 ASN HA H 1 4.5660 0.02 . 1 . . . . 41 ASN HA . 26800 1 499 . 1 1 41 41 ASN HB2 H 1 2.7410 0.02 . 2 . . . . 41 ASN HB2 . 26800 1 500 . 1 1 41 41 ASN HB3 H 1 3.0530 0.02 . 2 . . . . 41 ASN HB3 . 26800 1 501 . 1 1 41 41 ASN HD21 H 1 8.1230 0.02 . 2 . . . . 41 ASN HD21 . 26800 1 502 . 1 1 41 41 ASN HD22 H 1 6.3940 0.02 . 2 . . . . 41 ASN HD22 . 26800 1 503 . 1 1 41 41 ASN C C 13 176.5970 0.3 . 1 . . . . 41 ASN C . 26800 1 504 . 1 1 41 41 ASN CA C 13 58.1400 0.3 . 1 . . . . 41 ASN CA . 26800 1 505 . 1 1 41 41 ASN CB C 13 39.5090 0.3 . 1 . . . . 41 ASN CB . 26800 1 506 . 1 1 41 41 ASN N N 15 115.9370 0.2 . 1 . . . . 41 ASN N . 26800 1 507 . 1 1 41 41 ASN ND2 N 15 107.6000 0.2 . 1 . . . . 41 ASN ND2 . 26800 1 508 . 1 1 42 42 ILE H H 1 7.0860 0.02 . 1 . . . . 42 ILE H . 26800 1 509 . 1 1 42 42 ILE HA H 1 3.7050 0.02 . 1 . . . . 42 ILE HA . 26800 1 510 . 1 1 42 42 ILE HB H 1 2.2280 0.02 . 1 . . . . 42 ILE HB . 26800 1 511 . 1 1 42 42 ILE HG12 H 1 1.2380 0.02 . 2 . . . . 42 ILE HG12 . 26800 1 512 . 1 1 42 42 ILE HG13 H 1 1.5490 0.02 . 2 . . . . 42 ILE HG13 . 26800 1 513 . 1 1 42 42 ILE HG21 H 1 0.9700 0.02 . 1 . . . . 42 ILE HG21 . 26800 1 514 . 1 1 42 42 ILE HG22 H 1 0.9700 0.02 . 1 . . . . 42 ILE HG21 . 26800 1 515 . 1 1 42 42 ILE HG23 H 1 0.9700 0.02 . 1 . . . . 42 ILE HG21 . 26800 1 516 . 1 1 42 42 ILE HD11 H 1 0.7540 0.02 . 1 . . . . 42 ILE HD11 . 26800 1 517 . 1 1 42 42 ILE HD12 H 1 0.7540 0.02 . 1 . . . . 42 ILE HD11 . 26800 1 518 . 1 1 42 42 ILE HD13 H 1 0.7540 0.02 . 1 . . . . 42 ILE HD11 . 26800 1 519 . 1 1 42 42 ILE C C 13 177.5050 0.3 . 1 . . . . 42 ILE C . 26800 1 520 . 1 1 42 42 ILE CA C 13 63.6180 0.3 . 1 . . . . 42 ILE CA . 26800 1 521 . 1 1 42 42 ILE CB C 13 36.0510 0.3 . 1 . . . . 42 ILE CB . 26800 1 522 . 1 1 42 42 ILE CG1 C 13 27.5940 0.3 . 1 . . . . 42 ILE CG1 . 26800 1 523 . 1 1 42 42 ILE CG2 C 13 17.5220 0.3 . 1 . . . . 42 ILE CG2 . 26800 1 524 . 1 1 42 42 ILE CD1 C 13 11.0600 0.3 . 1 . . . . 42 ILE CD1 . 26800 1 525 . 1 1 42 42 ILE N N 15 117.4940 0.2 . 1 . . . . 42 ILE N . 26800 1 526 . 1 1 43 43 ASP H H 1 7.6750 0.02 . 1 . . . . 43 ASP H . 26800 1 527 . 1 1 43 43 ASP HA H 1 4.3950 0.02 . 1 . . . . 43 ASP HA . 26800 1 528 . 1 1 43 43 ASP HB2 H 1 2.7300 0.02 . 2 . . . . 43 ASP HB2 . 26800 1 529 . 1 1 43 43 ASP HB3 H 1 2.7300 0.02 . 2 . . . . 43 ASP HB3 . 26800 1 530 . 1 1 43 43 ASP C C 13 179.1790 0.3 . 1 . . . . 43 ASP C . 26800 1 531 . 1 1 43 43 ASP CA C 13 57.9720 0.3 . 1 . . . . 43 ASP CA . 26800 1 532 . 1 1 43 43 ASP CB C 13 41.1320 0.3 . 1 . . . . 43 ASP CB . 26800 1 533 . 1 1 43 43 ASP N N 15 119.8330 0.2 . 1 . . . . 43 ASP N . 26800 1 534 . 1 1 44 44 GLU H H 1 8.4560 0.02 . 1 . . . . 44 GLU H . 26800 1 535 . 1 1 44 44 GLU HA H 1 3.9730 0.02 . 1 . . . . 44 GLU HA . 26800 1 536 . 1 1 44 44 GLU HB2 H 1 2.1000 0.02 . 2 . . . . 44 GLU HB2 . 26800 1 537 . 1 1 44 44 GLU HB3 H 1 2.3930 0.02 . 2 . . . . 44 GLU HB3 . 26800 1 538 . 1 1 44 44 GLU HG2 H 1 2.3620 0.02 . 2 . . . . 44 GLU HG2 . 26800 1 539 . 1 1 44 44 GLU HG3 H 1 2.6630 0.02 . 2 . . . . 44 GLU HG3 . 26800 1 540 . 1 1 44 44 GLU C C 13 178.3890 0.3 . 1 . . . . 44 GLU C . 26800 1 541 . 1 1 44 44 GLU CA C 13 59.5980 0.3 . 1 . . . . 44 GLU CA . 26800 1 542 . 1 1 44 44 GLU CB C 13 30.6840 0.3 . 1 . . . . 44 GLU CB . 26800 1 543 . 1 1 44 44 GLU CG C 13 36.8920 0.3 . 1 . . . . 44 GLU CG . 26800 1 544 . 1 1 44 44 GLU N N 15 119.0420 0.2 . 1 . . . . 44 GLU N . 26800 1 545 . 1 1 45 45 LEU H H 1 8.0540 0.02 . 1 . . . . 45 LEU H . 26800 1 546 . 1 1 45 45 LEU HA H 1 3.9710 0.02 . 1 . . . . 45 LEU HA . 26800 1 547 . 1 1 45 45 LEU HB2 H 1 1.7720 0.02 . 2 . . . . 45 LEU HB2 . 26800 1 548 . 1 1 45 45 LEU HB3 H 1 2.3080 0.02 . 2 . . . . 45 LEU HB3 . 26800 1 549 . 1 1 45 45 LEU HG H 1 1.7000 0.02 . 1 . . . . 45 LEU HG . 26800 1 550 . 1 1 45 45 LEU HD11 H 1 0.9430 0.02 . 2 . . . . 45 LEU HD11 . 26800 1 551 . 1 1 45 45 LEU HD12 H 1 0.9430 0.02 . 2 . . . . 45 LEU HD11 . 26800 1 552 . 1 1 45 45 LEU HD13 H 1 0.9430 0.02 . 2 . . . . 45 LEU HD11 . 26800 1 553 . 1 1 45 45 LEU HD21 H 1 0.9320 0.02 . 2 . . . . 45 LEU HD21 . 26800 1 554 . 1 1 45 45 LEU HD22 H 1 0.9320 0.02 . 2 . . . . 45 LEU HD21 . 26800 1 555 . 1 1 45 45 LEU HD23 H 1 0.9320 0.02 . 2 . . . . 45 LEU HD21 . 26800 1 556 . 1 1 45 45 LEU C C 13 177.9950 0.3 . 1 . . . . 45 LEU C . 26800 1 557 . 1 1 45 45 LEU CA C 13 58.5700 0.3 . 1 . . . . 45 LEU CA . 26800 1 558 . 1 1 45 45 LEU CB C 13 42.8650 0.3 . 1 . . . . 45 LEU CB . 26800 1 559 . 1 1 45 45 LEU CG C 13 27.0410 0.3 . 1 . . . . 45 LEU CG . 26800 1 560 . 1 1 45 45 LEU CD1 C 13 24.7170 0.3 . 2 . . . . 45 LEU CD1 . 26800 1 561 . 1 1 45 45 LEU CD2 C 13 26.8300 0.3 . 2 . . . . 45 LEU CD2 . 26800 1 562 . 1 1 45 45 LEU N N 15 120.7180 0.2 . 1 . . . . 45 LEU N . 26800 1 563 . 1 1 46 46 ARG H H 1 8.0630 0.02 . 1 . . . . 46 ARG H . 26800 1 564 . 1 1 46 46 ARG HA H 1 3.8470 0.02 . 1 . . . . 46 ARG HA . 26800 1 565 . 1 1 46 46 ARG HB2 H 1 1.9620 0.02 . 2 . . . . 46 ARG HB2 . 26800 1 566 . 1 1 46 46 ARG HB3 H 1 1.8390 0.02 . 2 . . . . 46 ARG HB3 . 26800 1 567 . 1 1 46 46 ARG HG2 H 1 1.4990 0.02 . 2 . . . . 46 ARG HG2 . 26800 1 568 . 1 1 46 46 ARG HG3 H 1 1.8410 0.02 . 2 . . . . 46 ARG HG3 . 26800 1 569 . 1 1 46 46 ARG HD2 H 1 3.1770 0.02 . 2 . . . . 46 ARG HD2 . 26800 1 570 . 1 1 46 46 ARG HD3 H 1 3.1770 0.02 . 2 . . . . 46 ARG HD3 . 26800 1 571 . 1 1 46 46 ARG HE H 1 7.6650 0.02 . 1 . . . . 46 ARG HE . 26800 1 572 . 1 1 46 46 ARG C C 13 178.8900 0.3 . 1 . . . . 46 ARG C . 26800 1 573 . 1 1 46 46 ARG CA C 13 60.5470 0.3 . 1 . . . . 46 ARG CA . 26800 1 574 . 1 1 46 46 ARG CB C 13 29.8410 0.3 . 1 . . . . 46 ARG CB . 26800 1 575 . 1 1 46 46 ARG CG C 13 29.1000 0.3 . 1 . . . . 46 ARG CG . 26800 1 576 . 1 1 46 46 ARG CD C 13 43.4220 0.3 . 1 . . . . 46 ARG CD . 26800 1 577 . 1 1 46 46 ARG N N 15 116.4550 0.2 . 1 . . . . 46 ARG N . 26800 1 578 . 1 1 46 46 ARG NE N 15 84.4700 0.2 . 1 . . . . 46 ARG NE . 26800 1 579 . 1 1 47 47 ARG H H 1 8.1870 0.02 . 1 . . . . 47 ARG H . 26800 1 580 . 1 1 47 47 ARG HA H 1 4.0750 0.02 . 1 . . . . 47 ARG HA . 26800 1 581 . 1 1 47 47 ARG HB2 H 1 1.9200 0.02 . 2 . . . . 47 ARG HB2 . 26800 1 582 . 1 1 47 47 ARG HB3 H 1 2.0330 0.02 . 2 . . . . 47 ARG HB3 . 26800 1 583 . 1 1 47 47 ARG HG2 H 1 1.6190 0.02 . 2 . . . . 47 ARG HG2 . 26800 1 584 . 1 1 47 47 ARG HG3 H 1 1.8640 0.02 . 2 . . . . 47 ARG HG3 . 26800 1 585 . 1 1 47 47 ARG HD2 H 1 3.1770 0.02 . 2 . . . . 47 ARG HD2 . 26800 1 586 . 1 1 47 47 ARG HD3 H 1 3.2730 0.02 . 2 . . . . 47 ARG HD3 . 26800 1 587 . 1 1 47 47 ARG HE H 1 7.4600 0.02 . 1 . . . . 47 ARG HE . 26800 1 588 . 1 1 47 47 ARG C C 13 179.4690 0.3 . 1 . . . . 47 ARG C . 26800 1 589 . 1 1 47 47 ARG CA C 13 60.2420 0.3 . 1 . . . . 47 ARG CA . 26800 1 590 . 1 1 47 47 ARG CB C 13 30.5060 0.3 . 1 . . . . 47 ARG CB . 26800 1 591 . 1 1 47 47 ARG CG C 13 28.2590 0.3 . 1 . . . . 47 ARG CG . 26800 1 592 . 1 1 47 47 ARG CD C 13 43.7330 0.3 . 1 . . . . 47 ARG CD . 26800 1 593 . 1 1 47 47 ARG N N 15 119.9310 0.2 . 1 . . . . 47 ARG N . 26800 1 594 . 1 1 47 47 ARG NE N 15 85.1500 0.2 . 1 . . . . 47 ARG NE . 26800 1 595 . 1 1 48 48 VAL H H 1 8.5690 0.02 . 1 . . . . 48 VAL H . 26800 1 596 . 1 1 48 48 VAL HA H 1 3.6730 0.02 . 1 . . . . 48 VAL HA . 26800 1 597 . 1 1 48 48 VAL HB H 1 2.2590 0.02 . 1 . . . . 48 VAL HB . 26800 1 598 . 1 1 48 48 VAL HG11 H 1 1.1020 0.02 . 2 . . . . 48 VAL HG11 . 26800 1 599 . 1 1 48 48 VAL HG12 H 1 1.1020 0.02 . 2 . . . . 48 VAL HG11 . 26800 1 600 . 1 1 48 48 VAL HG13 H 1 1.1020 0.02 . 2 . . . . 48 VAL HG11 . 26800 1 601 . 1 1 48 48 VAL HG21 H 1 0.9410 0.02 . 2 . . . . 48 VAL HG21 . 26800 1 602 . 1 1 48 48 VAL HG22 H 1 0.9410 0.02 . 2 . . . . 48 VAL HG21 . 26800 1 603 . 1 1 48 48 VAL HG23 H 1 0.9410 0.02 . 2 . . . . 48 VAL HG21 . 26800 1 604 . 1 1 48 48 VAL C C 13 178.6040 0.3 . 1 . . . . 48 VAL C . 26800 1 605 . 1 1 48 48 VAL CA C 13 67.0050 0.3 . 1 . . . . 48 VAL CA . 26800 1 606 . 1 1 48 48 VAL CB C 13 31.3820 0.3 . 1 . . . . 48 VAL CB . 26800 1 607 . 1 1 48 48 VAL CG1 C 13 23.0560 0.3 . 2 . . . . 48 VAL CG1 . 26800 1 608 . 1 1 48 48 VAL CG2 C 13 21.0640 0.3 . 2 . . . . 48 VAL CG2 . 26800 1 609 . 1 1 48 48 VAL N N 15 120.2030 0.2 . 1 . . . . 48 VAL N . 26800 1 610 . 1 1 49 49 TYR H H 1 8.1840 0.02 . 1 . . . . 49 TYR H . 26800 1 611 . 1 1 49 49 TYR HA H 1 4.0530 0.02 . 1 . . . . 49 TYR HA . 26800 1 612 . 1 1 49 49 TYR HB2 H 1 2.7230 0.02 . 2 . . . . 49 TYR HB2 . 26800 1 613 . 1 1 49 49 TYR HB3 H 1 3.1970 0.02 . 2 . . . . 49 TYR HB3 . 26800 1 614 . 1 1 49 49 TYR HD1 H 1 7.1600 0.02 . 3 . . . . 49 TYR HD1 . 26800 1 615 . 1 1 49 49 TYR HD2 H 1 7.1600 0.02 . 3 . . . . 49 TYR HD2 . 26800 1 616 . 1 1 49 49 TYR HE1 H 1 6.5900 0.02 . 3 . . . . 49 TYR HE1 . 26800 1 617 . 1 1 49 49 TYR HE2 H 1 6.5900 0.02 . 3 . . . . 49 TYR HE2 . 26800 1 618 . 1 1 49 49 TYR C C 13 178.2920 0.3 . 1 . . . . 49 TYR C . 26800 1 619 . 1 1 49 49 TYR CA C 13 63.1710 0.3 . 1 . . . . 49 TYR CA . 26800 1 620 . 1 1 49 49 TYR CB C 13 38.7560 0.3 . 1 . . . . 49 TYR CB . 26800 1 621 . 1 1 49 49 TYR CD1 C 13 134.0000 0.3 . 3 . . . . 49 TYR CD1 . 26800 1 622 . 1 1 49 49 TYR CD2 C 13 134.0000 0.3 . 3 . . . . 49 TYR CD2 . 26800 1 623 . 1 1 49 49 TYR CE1 C 13 118.1700 0.3 . 3 . . . . 49 TYR CE1 . 26800 1 624 . 1 1 49 49 TYR CE2 C 13 118.1700 0.3 . 3 . . . . 49 TYR CE2 . 26800 1 625 . 1 1 49 49 TYR N N 15 120.6700 0.2 . 1 . . . . 49 TYR N . 26800 1 626 . 1 1 50 50 ASN H H 1 8.1260 0.02 . 1 . . . . 50 ASN H . 26800 1 627 . 1 1 50 50 ASN HA H 1 4.3150 0.02 . 1 . . . . 50 ASN HA . 26800 1 628 . 1 1 50 50 ASN HB2 H 1 2.7700 0.02 . 2 . . . . 50 ASN HB2 . 26800 1 629 . 1 1 50 50 ASN HB3 H 1 2.8890 0.02 . 2 . . . . 50 ASN HB3 . 26800 1 630 . 1 1 50 50 ASN HD21 H 1 7.5100 0.02 . 2 . . . . 50 ASN HD21 . 26800 1 631 . 1 1 50 50 ASN HD22 H 1 6.9010 0.02 . 2 . . . . 50 ASN HD22 . 26800 1 632 . 1 1 50 50 ASN C C 13 176.3260 0.3 . 1 . . . . 50 ASN C . 26800 1 633 . 1 1 50 50 ASN CA C 13 56.6130 0.3 . 1 . . . . 50 ASN CA . 26800 1 634 . 1 1 50 50 ASN CB C 13 38.8900 0.3 . 1 . . . . 50 ASN CB . 26800 1 635 . 1 1 50 50 ASN N N 15 114.0360 0.2 . 1 . . . . 50 ASN N . 26800 1 636 . 1 1 50 50 ASN ND2 N 15 111.8400 0.2 . 1 . . . . 50 ASN ND2 . 26800 1 637 . 1 1 51 51 ARG H H 1 7.6280 0.02 . 1 . . . . 51 ARG H . 26800 1 638 . 1 1 51 51 ARG HA H 1 4.2350 0.02 . 1 . . . . 51 ARG HA . 26800 1 639 . 1 1 51 51 ARG HB2 H 1 1.8290 0.02 . 2 . . . . 51 ARG HB2 . 26800 1 640 . 1 1 51 51 ARG HB3 H 1 1.8290 0.02 . 2 . . . . 51 ARG HB3 . 26800 1 641 . 1 1 51 51 ARG HG2 H 1 1.6990 0.02 . 2 . . . . 51 ARG HG2 . 26800 1 642 . 1 1 51 51 ARG HG3 H 1 1.6170 0.02 . 2 . . . . 51 ARG HG3 . 26800 1 643 . 1 1 51 51 ARG HD2 H 1 3.1790 0.02 . 2 . . . . 51 ARG HD2 . 26800 1 644 . 1 1 51 51 ARG HD3 H 1 3.1790 0.02 . 2 . . . . 51 ARG HD3 . 26800 1 645 . 1 1 51 51 ARG C C 13 177.6060 0.3 . 1 . . . . 51 ARG C . 26800 1 646 . 1 1 51 51 ARG CA C 13 57.9580 0.3 . 1 . . . . 51 ARG CA . 26800 1 647 . 1 1 51 51 ARG CB C 13 31.6390 0.3 . 1 . . . . 51 ARG CB . 26800 1 648 . 1 1 51 51 ARG CG C 13 27.3730 0.3 . 1 . . . . 51 ARG CG . 26800 1 649 . 1 1 51 51 ARG CD C 13 43.4220 0.3 . 1 . . . . 51 ARG CD . 26800 1 650 . 1 1 51 51 ARG N N 15 115.1460 0.2 . 1 . . . . 51 ARG N . 26800 1 651 . 1 1 52 52 LYS H H 1 8.5350 0.02 . 1 . . . . 52 LYS H . 26800 1 652 . 1 1 52 52 LYS HA H 1 4.1210 0.02 . 1 . . . . 52 LYS HA . 26800 1 653 . 1 1 52 52 LYS HB2 H 1 0.7910 0.02 . 2 . . . . 52 LYS HB2 . 26800 1 654 . 1 1 52 52 LYS HB3 H 1 0.8980 0.02 . 2 . . . . 52 LYS HB3 . 26800 1 655 . 1 1 52 52 LYS HG2 H 1 0.8970 0.02 . 2 . . . . 52 LYS HG2 . 26800 1 656 . 1 1 52 52 LYS HG3 H 1 1.1180 0.02 . 2 . . . . 52 LYS HG3 . 26800 1 657 . 1 1 52 52 LYS HD2 H 1 1.3870 0.02 . 2 . . . . 52 LYS HD2 . 26800 1 658 . 1 1 52 52 LYS HD3 H 1 1.3410 0.02 . 2 . . . . 52 LYS HD3 . 26800 1 659 . 1 1 52 52 LYS HE2 H 1 2.7850 0.02 . 2 . . . . 52 LYS HE2 . 26800 1 660 . 1 1 52 52 LYS HE3 H 1 2.7850 0.02 . 2 . . . . 52 LYS HE3 . 26800 1 661 . 1 1 52 52 LYS C C 13 176.2410 0.3 . 1 . . . . 52 LYS C . 26800 1 662 . 1 1 52 52 LYS CA C 13 57.5160 0.3 . 1 . . . . 52 LYS CA . 26800 1 663 . 1 1 52 52 LYS CB C 13 33.8900 0.3 . 1 . . . . 52 LYS CB . 26800 1 664 . 1 1 52 52 LYS CG C 13 24.9920 0.3 . 1 . . . . 52 LYS CG . 26800 1 665 . 1 1 52 52 LYS CD C 13 28.8970 0.3 . 1 . . . . 52 LYS CD . 26800 1 666 . 1 1 52 52 LYS CE C 13 41.8730 0.3 . 1 . . . . 52 LYS CE . 26800 1 667 . 1 1 52 52 LYS N N 15 116.1320 0.2 . 1 . . . . 52 LYS N . 26800 1 668 . 1 1 53 53 PHE H H 1 7.9890 0.02 . 1 . . . . 53 PHE H . 26800 1 669 . 1 1 53 53 PHE HA H 1 5.3010 0.02 . 1 . . . . 53 PHE HA . 26800 1 670 . 1 1 53 53 PHE HB2 H 1 2.8320 0.02 . 2 . . . . 53 PHE HB2 . 26800 1 671 . 1 1 53 53 PHE HB3 H 1 2.6370 0.02 . 2 . . . . 53 PHE HB3 . 26800 1 672 . 1 1 53 53 PHE HD1 H 1 6.5520 0.02 . 3 . . . . 53 PHE HD1 . 26800 1 673 . 1 1 53 53 PHE HD2 H 1 6.5520 0.02 . 3 . . . . 53 PHE HD2 . 26800 1 674 . 1 1 53 53 PHE HE1 H 1 6.8300 0.02 . 3 . . . . 53 PHE HE1 . 26800 1 675 . 1 1 53 53 PHE HE2 H 1 6.8300 0.02 . 3 . . . . 53 PHE HE2 . 26800 1 676 . 1 1 53 53 PHE HZ H 1 6.9830 0.02 . 1 . . . . 53 PHE HZ . 26800 1 677 . 1 1 53 53 PHE C C 13 174.0910 0.3 . 1 . . . . 53 PHE C . 26800 1 678 . 1 1 53 53 PHE CA C 13 53.8830 0.3 . 1 . . . . 53 PHE CA . 26800 1 679 . 1 1 53 53 PHE CB C 13 39.6860 0.3 . 1 . . . . 53 PHE CB . 26800 1 680 . 1 1 53 53 PHE CD1 C 13 132.4000 0.3 . 3 . . . . 53 PHE CD1 . 26800 1 681 . 1 1 53 53 PHE CD2 C 13 132.4000 0.3 . 3 . . . . 53 PHE CD2 . 26800 1 682 . 1 1 53 53 PHE CE1 C 13 130.6000 0.3 . 3 . . . . 53 PHE CE1 . 26800 1 683 . 1 1 53 53 PHE CE2 C 13 130.6000 0.3 . 3 . . . . 53 PHE CE2 . 26800 1 684 . 1 1 53 53 PHE CZ C 13 129.4900 0.3 . 1 . . . . 53 PHE CZ . 26800 1 685 . 1 1 53 53 PHE N N 15 116.2690 0.2 . 1 . . . . 53 PHE N . 26800 1 686 . 1 1 54 54 PRO HA H 1 4.3490 0.02 . 1 . . . . 54 PRO HA . 26800 1 687 . 1 1 54 54 PRO HB2 H 1 2.4220 0.02 . 2 . . . . 54 PRO HB2 . 26800 1 688 . 1 1 54 54 PRO HB3 H 1 1.9650 0.02 . 2 . . . . 54 PRO HB3 . 26800 1 689 . 1 1 54 54 PRO HG2 H 1 2.0450 0.02 . 2 . . . . 54 PRO HG2 . 26800 1 690 . 1 1 54 54 PRO HG3 H 1 1.8400 0.02 . 2 . . . . 54 PRO HG3 . 26800 1 691 . 1 1 54 54 PRO HD2 H 1 3.6060 0.02 . 2 . . . . 54 PRO HD2 . 26800 1 692 . 1 1 54 54 PRO HD3 H 1 3.1730 0.02 . 2 . . . . 54 PRO HD3 . 26800 1 693 . 1 1 54 54 PRO C C 13 178.8960 0.3 . 1 . . . . 54 PRO C . 26800 1 694 . 1 1 54 54 PRO CA C 13 65.5150 0.3 . 1 . . . . 54 PRO CA . 26800 1 695 . 1 1 54 54 PRO CB C 13 30.9560 0.3 . 1 . . . . 54 PRO CB . 26800 1 696 . 1 1 54 54 PRO CG C 13 27.7840 0.3 . 1 . . . . 54 PRO CG . 26800 1 697 . 1 1 54 54 PRO CD C 13 50.4600 0.3 . 1 . . . . 54 PRO CD . 26800 1 698 . 1 1 55 55 HIS H H 1 8.9300 0.02 . 1 . . . . 55 HIS H . 26800 1 699 . 1 1 55 55 HIS HA H 1 4.8970 0.02 . 1 . . . . 55 HIS HA . 26800 1 700 . 1 1 55 55 HIS HB2 H 1 3.3460 0.02 . 2 . . . . 55 HIS HB2 . 26800 1 701 . 1 1 55 55 HIS HB3 H 1 3.3460 0.02 . 2 . . . . 55 HIS HB3 . 26800 1 702 . 1 1 55 55 HIS HD2 H 1 7.2220 0.02 . 1 . . . . 55 HIS HD2 . 26800 1 703 . 1 1 55 55 HIS HE1 H 1 8.2490 0.02 . 1 . . . . 55 HIS HE1 . 26800 1 704 . 1 1 55 55 HIS C C 13 176.3710 0.3 . 1 . . . . 55 HIS C . 26800 1 705 . 1 1 55 55 HIS CA C 13 56.5800 0.3 . 1 . . . . 55 HIS CA . 26800 1 706 . 1 1 55 55 HIS CB C 13 28.8500 0.3 . 1 . . . . 55 HIS CB . 26800 1 707 . 1 1 55 55 HIS CD2 C 13 118.6000 0.3 . 1 . . . . 55 HIS CD2 . 26800 1 708 . 1 1 55 55 HIS CE1 C 13 138.2230 0.3 . 1 . . . . 55 HIS CE1 . 26800 1 709 . 1 1 55 55 HIS N N 15 116.0480 0.2 . 1 . . . . 55 HIS N . 26800 1 710 . 1 1 56 56 LYS H H 1 8.2900 0.02 . 1 . . . . 56 LYS H . 26800 1 711 . 1 1 56 56 LYS HA H 1 4.9540 0.02 . 1 . . . . 56 LYS HA . 26800 1 712 . 1 1 56 56 LYS HB2 H 1 1.8530 0.02 . 2 . . . . 56 LYS HB2 . 26800 1 713 . 1 1 56 56 LYS HB3 H 1 2.4220 0.02 . 2 . . . . 56 LYS HB3 . 26800 1 714 . 1 1 56 56 LYS HG2 H 1 1.0850 0.02 . 2 . . . . 56 LYS HG2 . 26800 1 715 . 1 1 56 56 LYS HG3 H 1 1.1240 0.02 . 2 . . . . 56 LYS HG3 . 26800 1 716 . 1 1 56 56 LYS HD2 H 1 1.3900 0.02 . 2 . . . . 56 LYS HD2 . 26800 1 717 . 1 1 56 56 LYS HD3 H 1 1.5590 0.02 . 2 . . . . 56 LYS HD3 . 26800 1 718 . 1 1 56 56 LYS HE2 H 1 2.9040 0.02 . 2 . . . . 56 LYS HE2 . 26800 1 719 . 1 1 56 56 LYS HE3 H 1 2.9040 0.02 . 2 . . . . 56 LYS HE3 . 26800 1 720 . 1 1 56 56 LYS C C 13 176.6830 0.3 . 1 . . . . 56 LYS C . 26800 1 721 . 1 1 56 56 LYS CA C 13 55.3150 0.3 . 1 . . . . 56 LYS CA . 26800 1 722 . 1 1 56 56 LYS CB C 13 32.8640 0.3 . 1 . . . . 56 LYS CB . 26800 1 723 . 1 1 56 56 LYS CG C 13 24.7170 0.3 . 1 . . . . 56 LYS CG . 26800 1 724 . 1 1 56 56 LYS CD C 13 29.2550 0.3 . 1 . . . . 56 LYS CD . 26800 1 725 . 1 1 56 56 LYS CE C 13 42.1820 0.3 . 1 . . . . 56 LYS CE . 26800 1 726 . 1 1 56 56 LYS N N 15 120.2080 0.2 . 1 . . . . 56 LYS N . 26800 1 727 . 1 1 57 57 ILE H H 1 7.4360 0.02 . 1 . . . . 57 ILE H . 26800 1 728 . 1 1 57 57 ILE HA H 1 3.8700 0.02 . 1 . . . . 57 ILE HA . 26800 1 729 . 1 1 57 57 ILE HB H 1 2.0570 0.02 . 1 . . . . 57 ILE HB . 26800 1 730 . 1 1 57 57 ILE HG12 H 1 1.5360 0.02 . 2 . . . . 57 ILE HG12 . 26800 1 731 . 1 1 57 57 ILE HG13 H 1 1.7120 0.02 . 2 . . . . 57 ILE HG13 . 26800 1 732 . 1 1 57 57 ILE HG21 H 1 1.0460 0.02 . 1 . . . . 57 ILE HG21 . 26800 1 733 . 1 1 57 57 ILE HG22 H 1 1.0460 0.02 . 1 . . . . 57 ILE HG21 . 26800 1 734 . 1 1 57 57 ILE HG23 H 1 1.0460 0.02 . 1 . . . . 57 ILE HG21 . 26800 1 735 . 1 1 57 57 ILE HD11 H 1 1.0040 0.02 . 1 . . . . 57 ILE HD11 . 26800 1 736 . 1 1 57 57 ILE HD12 H 1 1.0040 0.02 . 1 . . . . 57 ILE HD11 . 26800 1 737 . 1 1 57 57 ILE HD13 H 1 1.0040 0.02 . 1 . . . . 57 ILE HD11 . 26800 1 738 . 1 1 57 57 ILE C C 13 177.2420 0.3 . 1 . . . . 57 ILE C . 26800 1 739 . 1 1 57 57 ILE CA C 13 64.2050 0.3 . 1 . . . . 57 ILE CA . 26800 1 740 . 1 1 57 57 ILE CB C 13 37.5480 0.3 . 1 . . . . 57 ILE CB . 26800 1 741 . 1 1 57 57 ILE CG1 C 13 29.1740 0.3 . 1 . . . . 57 ILE CG1 . 26800 1 742 . 1 1 57 57 ILE CG2 C 13 18.0660 0.3 . 1 . . . . 57 ILE CG2 . 26800 1 743 . 1 1 57 57 ILE CD1 C 13 13.1110 0.3 . 1 . . . . 57 ILE CD1 . 26800 1 744 . 1 1 57 57 ILE N N 15 120.7860 0.2 . 1 . . . . 57 ILE N . 26800 1 745 . 1 1 58 58 GLN H H 1 8.7070 0.02 . 1 . . . . 58 GLN H . 26800 1 746 . 1 1 58 58 GLN HA H 1 4.1100 0.02 . 1 . . . . 58 GLN HA . 26800 1 747 . 1 1 58 58 GLN HB2 H 1 2.1170 0.02 . 2 . . . . 58 GLN HB2 . 26800 1 748 . 1 1 58 58 GLN HB3 H 1 2.1170 0.02 . 2 . . . . 58 GLN HB3 . 26800 1 749 . 1 1 58 58 GLN HG2 H 1 2.4250 0.02 . 2 . . . . 58 GLN HG2 . 26800 1 750 . 1 1 58 58 GLN HG3 H 1 2.5000 0.02 . 2 . . . . 58 GLN HG3 . 26800 1 751 . 1 1 58 58 GLN HE21 H 1 7.5940 0.02 . 2 . . . . 58 GLN HE21 . 26800 1 752 . 1 1 58 58 GLN HE22 H 1 6.9260 0.02 . 2 . . . . 58 GLN HE22 . 26800 1 753 . 1 1 58 58 GLN C C 13 178.7260 0.3 . 1 . . . . 58 GLN C . 26800 1 754 . 1 1 58 58 GLN CA C 13 59.6100 0.3 . 1 . . . . 58 GLN CA . 26800 1 755 . 1 1 58 58 GLN CB C 13 27.6780 0.3 . 1 . . . . 58 GLN CB . 26800 1 756 . 1 1 58 58 GLN CG C 13 34.5900 0.3 . 1 . . . . 58 GLN CG . 26800 1 757 . 1 1 58 58 GLN N N 15 119.3090 0.2 . 1 . . . . 58 GLN N . 26800 1 758 . 1 1 58 58 GLN NE2 N 15 112.4900 0.2 . 1 . . . . 58 GLN NE2 . 26800 1 759 . 1 1 59 59 ALA H H 1 7.6830 0.02 . 1 . . . . 59 ALA H . 26800 1 760 . 1 1 59 59 ALA HA H 1 4.1550 0.02 . 1 . . . . 59 ALA HA . 26800 1 761 . 1 1 59 59 ALA HB1 H 1 1.6350 0.02 . 1 . . . . 59 ALA HB1 . 26800 1 762 . 1 1 59 59 ALA HB2 H 1 1.6350 0.02 . 1 . . . . 59 ALA HB1 . 26800 1 763 . 1 1 59 59 ALA HB3 H 1 1.6350 0.02 . 1 . . . . 59 ALA HB1 . 26800 1 764 . 1 1 59 59 ALA C C 13 181.0720 0.3 . 1 . . . . 59 ALA C . 26800 1 765 . 1 1 59 59 ALA CA C 13 55.1800 0.3 . 1 . . . . 59 ALA CA . 26800 1 766 . 1 1 59 59 ALA CB C 13 17.8170 0.3 . 1 . . . . 59 ALA CB . 26800 1 767 . 1 1 59 59 ALA N N 15 122.9440 0.2 . 1 . . . . 59 ALA N . 26800 1 768 . 1 1 60 60 LEU H H 1 7.6730 0.02 . 1 . . . . 60 LEU H . 26800 1 769 . 1 1 60 60 LEU HA H 1 3.8360 0.02 . 1 . . . . 60 LEU HA . 26800 1 770 . 1 1 60 60 LEU HB2 H 1 1.7370 0.02 . 2 . . . . 60 LEU HB2 . 26800 1 771 . 1 1 60 60 LEU HB3 H 1 0.3340 0.02 . 2 . . . . 60 LEU HB3 . 26800 1 772 . 1 1 60 60 LEU HG H 1 1.2140 0.02 . 1 . . . . 60 LEU HG . 26800 1 773 . 1 1 60 60 LEU HD11 H 1 0.5110 0.02 . 2 . . . . 60 LEU HD11 . 26800 1 774 . 1 1 60 60 LEU HD12 H 1 0.5110 0.02 . 2 . . . . 60 LEU HD11 . 26800 1 775 . 1 1 60 60 LEU HD13 H 1 0.5110 0.02 . 2 . . . . 60 LEU HD11 . 26800 1 776 . 1 1 60 60 LEU HD21 H 1 0.5390 0.02 . 2 . . . . 60 LEU HD21 . 26800 1 777 . 1 1 60 60 LEU HD22 H 1 0.5390 0.02 . 2 . . . . 60 LEU HD21 . 26800 1 778 . 1 1 60 60 LEU HD23 H 1 0.5390 0.02 . 2 . . . . 60 LEU HD21 . 26800 1 779 . 1 1 60 60 LEU C C 13 178.4180 0.3 . 1 . . . . 60 LEU C . 26800 1 780 . 1 1 60 60 LEU CA C 13 58.0720 0.3 . 1 . . . . 60 LEU CA . 26800 1 781 . 1 1 60 60 LEU CB C 13 39.0700 0.3 . 1 . . . . 60 LEU CB . 26800 1 782 . 1 1 60 60 LEU CG C 13 26.4590 0.3 . 1 . . . . 60 LEU CG . 26800 1 783 . 1 1 60 60 LEU CD1 C 13 25.3800 0.3 . 2 . . . . 60 LEU CD1 . 26800 1 784 . 1 1 60 60 LEU CD2 C 13 22.0680 0.3 . 2 . . . . 60 LEU CD2 . 26800 1 785 . 1 1 60 60 LEU N N 15 121.6320 0.2 . 1 . . . . 60 LEU N . 26800 1 786 . 1 1 61 61 GLU H H 1 8.2580 0.02 . 1 . . . . 61 GLU H . 26800 1 787 . 1 1 61 61 GLU HA H 1 4.0070 0.02 . 1 . . . . 61 GLU HA . 26800 1 788 . 1 1 61 61 GLU HB2 H 1 2.0680 0.02 . 2 . . . . 61 GLU HB2 . 26800 1 789 . 1 1 61 61 GLU HB3 H 1 2.0680 0.02 . 2 . . . . 61 GLU HB3 . 26800 1 790 . 1 1 61 61 GLU HG2 H 1 2.3400 0.02 . 2 . . . . 61 GLU HG2 . 26800 1 791 . 1 1 61 61 GLU HG3 H 1 2.4300 0.02 . 2 . . . . 61 GLU HG3 . 26800 1 792 . 1 1 61 61 GLU C C 13 180.2700 0.3 . 1 . . . . 61 GLU C . 26800 1 793 . 1 1 61 61 GLU CA C 13 59.2540 0.3 . 1 . . . . 61 GLU CA . 26800 1 794 . 1 1 61 61 GLU CB C 13 28.5740 0.3 . 1 . . . . 61 GLU CB . 26800 1 795 . 1 1 61 61 GLU CG C 13 35.7850 0.3 . 1 . . . . 61 GLU CG . 26800 1 796 . 1 1 61 61 GLU N N 15 117.5800 0.2 . 1 . . . . 61 GLU N . 26800 1 797 . 1 1 62 62 ARG H H 1 7.9740 0.02 . 1 . . . . 62 ARG H . 26800 1 798 . 1 1 62 62 ARG HA H 1 4.1280 0.02 . 1 . . . . 62 ARG HA . 26800 1 799 . 1 1 62 62 ARG HB2 H 1 2.0000 0.02 . 2 . . . . 62 ARG HB2 . 26800 1 800 . 1 1 62 62 ARG HB3 H 1 1.9500 0.02 . 2 . . . . 62 ARG HB3 . 26800 1 801 . 1 1 62 62 ARG HG2 H 1 1.8760 0.02 . 2 . . . . 62 ARG HG2 . 26800 1 802 . 1 1 62 62 ARG HG3 H 1 1.6740 0.02 . 2 . . . . 62 ARG HG3 . 26800 1 803 . 1 1 62 62 ARG HD2 H 1 3.2730 0.02 . 2 . . . . 62 ARG HD2 . 26800 1 804 . 1 1 62 62 ARG HD3 H 1 3.2310 0.02 . 2 . . . . 62 ARG HD3 . 26800 1 805 . 1 1 62 62 ARG HE H 1 7.3370 0.02 . 1 . . . . 62 ARG HE . 26800 1 806 . 1 1 62 62 ARG C C 13 178.5230 0.3 . 1 . . . . 62 ARG C . 26800 1 807 . 1 1 62 62 ARG CA C 13 59.4900 0.3 . 1 . . . . 62 ARG CA . 26800 1 808 . 1 1 62 62 ARG CB C 13 30.1840 0.3 . 1 . . . . 62 ARG CB . 26800 1 809 . 1 1 62 62 ARG CG C 13 27.6900 0.3 . 1 . . . . 62 ARG CG . 26800 1 810 . 1 1 62 62 ARG CD C 13 43.5000 0.3 . 1 . . . . 62 ARG CD . 26800 1 811 . 1 1 62 62 ARG N N 15 119.9780 0.2 . 1 . . . . 62 ARG N . 26800 1 812 . 1 1 62 62 ARG NE N 15 84.5700 0.2 . 1 . . . . 62 ARG NE . 26800 1 813 . 1 1 63 63 PHE H H 1 7.9040 0.02 . 1 . . . . 63 PHE H . 26800 1 814 . 1 1 63 63 PHE HA H 1 4.2810 0.02 . 1 . . . . 63 PHE HA . 26800 1 815 . 1 1 63 63 PHE HB2 H 1 3.2470 0.02 . 2 . . . . 63 PHE HB2 . 26800 1 816 . 1 1 63 63 PHE HB3 H 1 3.3530 0.02 . 2 . . . . 63 PHE HB3 . 26800 1 817 . 1 1 63 63 PHE HD1 H 1 7.0700 0.02 . 3 . . . . 63 PHE HD1 . 26800 1 818 . 1 1 63 63 PHE HD2 H 1 7.0700 0.02 . 3 . . . . 63 PHE HD2 . 26800 1 819 . 1 1 63 63 PHE HE1 H 1 6.7240 0.02 . 3 . . . . 63 PHE HE1 . 26800 1 820 . 1 1 63 63 PHE HE2 H 1 6.7240 0.02 . 3 . . . . 63 PHE HE2 . 26800 1 821 . 1 1 63 63 PHE HZ H 1 6.2270 0.02 . 1 . . . . 63 PHE HZ . 26800 1 822 . 1 1 63 63 PHE C C 13 178.1330 0.3 . 1 . . . . 63 PHE C . 26800 1 823 . 1 1 63 63 PHE CA C 13 61.6310 0.3 . 1 . . . . 63 PHE CA . 26800 1 824 . 1 1 63 63 PHE CB C 13 38.9250 0.3 . 1 . . . . 63 PHE CB . 26800 1 825 . 1 1 63 63 PHE CD1 C 13 131.9650 0.3 . 3 . . . . 63 PHE CD1 . 26800 1 826 . 1 1 63 63 PHE CD2 C 13 131.9650 0.3 . 3 . . . . 63 PHE CD2 . 26800 1 827 . 1 1 63 63 PHE CE1 C 13 130.3000 0.3 . 3 . . . . 63 PHE CE1 . 26800 1 828 . 1 1 63 63 PHE CE2 C 13 130.3000 0.3 . 3 . . . . 63 PHE CE2 . 26800 1 829 . 1 1 63 63 PHE CZ C 13 129.5000 0.3 . 1 . . . . 63 PHE CZ . 26800 1 830 . 1 1 63 63 PHE N N 15 120.0390 0.2 . 1 . . . . 63 PHE N . 26800 1 831 . 1 1 64 64 LEU H H 1 9.1200 0.02 . 1 . . . . 64 LEU H . 26800 1 832 . 1 1 64 64 LEU HA H 1 3.7560 0.02 . 1 . . . . 64 LEU HA . 26800 1 833 . 1 1 64 64 LEU HB2 H 1 1.3950 0.02 . 2 . . . . 64 LEU HB2 . 26800 1 834 . 1 1 64 64 LEU HB3 H 1 1.8860 0.02 . 2 . . . . 64 LEU HB3 . 26800 1 835 . 1 1 64 64 LEU HG H 1 1.8610 0.02 . 1 . . . . 64 LEU HG . 26800 1 836 . 1 1 64 64 LEU HD11 H 1 0.8150 0.02 . 2 . . . . 64 LEU HD11 . 26800 1 837 . 1 1 64 64 LEU HD12 H 1 0.8150 0.02 . 2 . . . . 64 LEU HD11 . 26800 1 838 . 1 1 64 64 LEU HD13 H 1 0.8150 0.02 . 2 . . . . 64 LEU HD11 . 26800 1 839 . 1 1 64 64 LEU HD21 H 1 0.7860 0.02 . 2 . . . . 64 LEU HD21 . 26800 1 840 . 1 1 64 64 LEU HD22 H 1 0.7860 0.02 . 2 . . . . 64 LEU HD21 . 26800 1 841 . 1 1 64 64 LEU HD23 H 1 0.7860 0.02 . 2 . . . . 64 LEU HD21 . 26800 1 842 . 1 1 64 64 LEU C C 13 177.7990 0.3 . 1 . . . . 64 LEU C . 26800 1 843 . 1 1 64 64 LEU CA C 13 57.6770 0.3 . 1 . . . . 64 LEU CA . 26800 1 844 . 1 1 64 64 LEU CB C 13 41.6790 0.3 . 1 . . . . 64 LEU CB . 26800 1 845 . 1 1 64 64 LEU CG C 13 26.8000 0.3 . 1 . . . . 64 LEU CG . 26800 1 846 . 1 1 64 64 LEU CD1 C 13 25.1320 0.3 . 2 . . . . 64 LEU CD1 . 26800 1 847 . 1 1 64 64 LEU CD2 C 13 22.0020 0.3 . 2 . . . . 64 LEU CD2 . 26800 1 848 . 1 1 64 64 LEU N N 15 119.6060 0.2 . 1 . . . . 64 LEU N . 26800 1 849 . 1 1 65 65 ALA H H 1 7.8900 0.02 . 1 . . . . 65 ALA H . 26800 1 850 . 1 1 65 65 ALA HA H 1 4.0180 0.02 . 1 . . . . 65 ALA HA . 26800 1 851 . 1 1 65 65 ALA HB1 H 1 1.4860 0.02 . 1 . . . . 65 ALA HB1 . 26800 1 852 . 1 1 65 65 ALA HB2 H 1 1.4860 0.02 . 1 . . . . 65 ALA HB1 . 26800 1 853 . 1 1 65 65 ALA HB3 H 1 1.4860 0.02 . 1 . . . . 65 ALA HB1 . 26800 1 854 . 1 1 65 65 ALA C C 13 180.1050 0.3 . 1 . . . . 65 ALA C . 26800 1 855 . 1 1 65 65 ALA CA C 13 54.8710 0.3 . 1 . . . . 65 ALA CA . 26800 1 856 . 1 1 65 65 ALA CB C 13 17.7140 0.3 . 1 . . . . 65 ALA CB . 26800 1 857 . 1 1 65 65 ALA N N 15 119.9890 0.2 . 1 . . . . 65 ALA N . 26800 1 858 . 1 1 66 66 ILE H H 1 6.9160 0.02 . 1 . . . . 66 ILE H . 26800 1 859 . 1 1 66 66 ILE HA H 1 3.9500 0.02 . 1 . . . . 66 ILE HA . 26800 1 860 . 1 1 66 66 ILE HB H 1 1.8400 0.02 . 1 . . . . 66 ILE HB . 26800 1 861 . 1 1 66 66 ILE HG12 H 1 1.1970 0.02 . 2 . . . . 66 ILE HG12 . 26800 1 862 . 1 1 66 66 ILE HG13 H 1 1.5980 0.02 . 2 . . . . 66 ILE HG13 . 26800 1 863 . 1 1 66 66 ILE HG21 H 1 0.8600 0.02 . 1 . . . . 66 ILE HG21 . 26800 1 864 . 1 1 66 66 ILE HG22 H 1 0.8600 0.02 . 1 . . . . 66 ILE HG21 . 26800 1 865 . 1 1 66 66 ILE HG23 H 1 0.8600 0.02 . 1 . . . . 66 ILE HG21 . 26800 1 866 . 1 1 66 66 ILE HD11 H 1 0.8600 0.02 . 1 . . . . 66 ILE HD11 . 26800 1 867 . 1 1 66 66 ILE HD12 H 1 0.8600 0.02 . 1 . . . . 66 ILE HD11 . 26800 1 868 . 1 1 66 66 ILE HD13 H 1 0.8600 0.02 . 1 . . . . 66 ILE HD11 . 26800 1 869 . 1 1 66 66 ILE C C 13 179.0850 0.3 . 1 . . . . 66 ILE C . 26800 1 870 . 1 1 66 66 ILE CA C 13 62.7050 0.3 . 1 . . . . 66 ILE CA . 26800 1 871 . 1 1 66 66 ILE CB C 13 38.3300 0.3 . 1 . . . . 66 ILE CB . 26800 1 872 . 1 1 66 66 ILE CG1 C 13 28.1480 0.3 . 1 . . . . 66 ILE CG1 . 26800 1 873 . 1 1 66 66 ILE CG2 C 13 17.1900 0.3 . 1 . . . . 66 ILE CG2 . 26800 1 874 . 1 1 66 66 ILE CD1 C 13 12.2730 0.3 . 1 . . . . 66 ILE CD1 . 26800 1 875 . 1 1 66 66 ILE N N 15 115.1060 0.2 . 1 . . . . 66 ILE N . 26800 1 876 . 1 1 67 67 ALA H H 1 8.8360 0.02 . 1 . . . . 67 ALA H . 26800 1 877 . 1 1 67 67 ALA HA H 1 4.0300 0.02 . 1 . . . . 67 ALA HA . 26800 1 878 . 1 1 67 67 ALA HB1 H 1 0.7790 0.02 . 1 . . . . 67 ALA HB1 . 26800 1 879 . 1 1 67 67 ALA HB2 H 1 0.7790 0.02 . 1 . . . . 67 ALA HB1 . 26800 1 880 . 1 1 67 67 ALA HB3 H 1 0.7790 0.02 . 1 . . . . 67 ALA HB1 . 26800 1 881 . 1 1 67 67 ALA C C 13 179.9570 0.3 . 1 . . . . 67 ALA C . 26800 1 882 . 1 1 67 67 ALA CA C 13 55.1940 0.3 . 1 . . . . 67 ALA CA . 26800 1 883 . 1 1 67 67 ALA CB C 13 18.2100 0.3 . 1 . . . . 67 ALA CB . 26800 1 884 . 1 1 67 67 ALA N N 15 125.8610 0.2 . 1 . . . . 67 ALA N . 26800 1 885 . 1 1 68 68 LEU H H 1 8.4920 0.02 . 1 . . . . 68 LEU H . 26800 1 886 . 1 1 68 68 LEU HA H 1 4.1890 0.02 . 1 . . . . 68 LEU HA . 26800 1 887 . 1 1 68 68 LEU HB2 H 1 1.6120 0.02 . 2 . . . . 68 LEU HB2 . 26800 1 888 . 1 1 68 68 LEU HB3 H 1 1.8650 0.02 . 2 . . . . 68 LEU HB3 . 26800 1 889 . 1 1 68 68 LEU HG H 1 1.7790 0.02 . 1 . . . . 68 LEU HG . 26800 1 890 . 1 1 68 68 LEU HD11 H 1 0.8640 0.02 . 2 . . . . 68 LEU HD11 . 26800 1 891 . 1 1 68 68 LEU HD12 H 1 0.8640 0.02 . 2 . . . . 68 LEU HD11 . 26800 1 892 . 1 1 68 68 LEU HD13 H 1 0.8640 0.02 . 2 . . . . 68 LEU HD11 . 26800 1 893 . 1 1 68 68 LEU HD21 H 1 0.7160 0.02 . 2 . . . . 68 LEU HD21 . 26800 1 894 . 1 1 68 68 LEU HD22 H 1 0.7160 0.02 . 2 . . . . 68 LEU HD21 . 26800 1 895 . 1 1 68 68 LEU HD23 H 1 0.7160 0.02 . 2 . . . . 68 LEU HD21 . 26800 1 896 . 1 1 68 68 LEU C C 13 178.0110 0.3 . 1 . . . . 68 LEU C . 26800 1 897 . 1 1 68 68 LEU CA C 13 56.7310 0.3 . 1 . . . . 68 LEU CA . 26800 1 898 . 1 1 68 68 LEU CB C 13 39.5940 0.3 . 1 . . . . 68 LEU CB . 26800 1 899 . 1 1 68 68 LEU CG C 13 27.1960 0.3 . 1 . . . . 68 LEU CG . 26800 1 900 . 1 1 68 68 LEU CD1 C 13 25.0930 0.3 . 2 . . . . 68 LEU CD1 . 26800 1 901 . 1 1 68 68 LEU CD2 C 13 21.6290 0.3 . 2 . . . . 68 LEU CD2 . 26800 1 902 . 1 1 68 68 LEU N N 15 112.8250 0.2 . 1 . . . . 68 LEU N . 26800 1 903 . 1 1 69 69 THR H H 1 7.7750 0.02 . 1 . . . . 69 THR H . 26800 1 904 . 1 1 69 69 THR HA H 1 4.4600 0.02 . 1 . . . . 69 THR HA . 26800 1 905 . 1 1 69 69 THR HB H 1 4.3800 0.02 . 1 . . . . 69 THR HB . 26800 1 906 . 1 1 69 69 THR HG21 H 1 1.3700 0.02 . 1 . . . . 69 THR HG21 . 26800 1 907 . 1 1 69 69 THR HG22 H 1 1.3700 0.02 . 1 . . . . 69 THR HG21 . 26800 1 908 . 1 1 69 69 THR HG23 H 1 1.3700 0.02 . 1 . . . . 69 THR HG21 . 26800 1 909 . 1 1 69 69 THR C C 13 175.6810 0.3 . 1 . . . . 69 THR C . 26800 1 910 . 1 1 69 69 THR CA C 13 63.6370 0.3 . 1 . . . . 69 THR CA . 26800 1 911 . 1 1 69 69 THR CB C 13 69.9180 0.3 . 1 . . . . 69 THR CB . 26800 1 912 . 1 1 69 69 THR CG2 C 13 21.5750 0.3 . 1 . . . . 69 THR CG2 . 26800 1 913 . 1 1 69 69 THR N N 15 109.0380 0.2 . 1 . . . . 69 THR N . 26800 1 914 . 1 1 70 70 VAL H H 1 7.3420 0.02 . 1 . . . . 70 VAL H . 26800 1 915 . 1 1 70 70 VAL HA H 1 4.5770 0.02 . 1 . . . . 70 VAL HA . 26800 1 916 . 1 1 70 70 VAL HB H 1 2.2510 0.02 . 1 . . . . 70 VAL HB . 26800 1 917 . 1 1 70 70 VAL HG11 H 1 0.9260 0.02 . 2 . . . . 70 VAL HG11 . 26800 1 918 . 1 1 70 70 VAL HG12 H 1 0.9260 0.02 . 2 . . . . 70 VAL HG11 . 26800 1 919 . 1 1 70 70 VAL HG13 H 1 0.9260 0.02 . 2 . . . . 70 VAL HG11 . 26800 1 920 . 1 1 70 70 VAL HG21 H 1 0.9080 0.02 . 2 . . . . 70 VAL HG21 . 26800 1 921 . 1 1 70 70 VAL HG22 H 1 0.9080 0.02 . 2 . . . . 70 VAL HG21 . 26800 1 922 . 1 1 70 70 VAL HG23 H 1 0.9080 0.02 . 2 . . . . 70 VAL HG21 . 26800 1 923 . 1 1 70 70 VAL C C 13 175.4170 0.3 . 1 . . . . 70 VAL C . 26800 1 924 . 1 1 70 70 VAL CA C 13 61.9000 0.3 . 1 . . . . 70 VAL CA . 26800 1 925 . 1 1 70 70 VAL CB C 13 33.6820 0.3 . 1 . . . . 70 VAL CB . 26800 1 926 . 1 1 70 70 VAL CG1 C 13 21.6180 0.3 . 2 . . . . 70 VAL CG1 . 26800 1 927 . 1 1 70 70 VAL CG2 C 13 19.6250 0.3 . 2 . . . . 70 VAL CG2 . 26800 1 928 . 1 1 70 70 VAL N N 15 114.5560 0.2 . 1 . . . . 70 VAL N . 26800 1 929 . 1 1 71 71 LEU H H 1 7.7880 0.02 . 1 . . . . 71 LEU H . 26800 1 930 . 1 1 71 71 LEU HA H 1 4.3870 0.02 . 1 . . . . 71 LEU HA . 26800 1 931 . 1 1 71 71 LEU HB2 H 1 0.9970 0.02 . 2 . . . . 71 LEU HB2 . 26800 1 932 . 1 1 71 71 LEU HB3 H 1 1.5520 0.02 . 2 . . . . 71 LEU HB3 . 26800 1 933 . 1 1 71 71 LEU HG H 1 1.8270 0.02 . 1 . . . . 71 LEU HG . 26800 1 934 . 1 1 71 71 LEU HD11 H 1 0.7060 0.02 . 2 . . . . 71 LEU HD11 . 26800 1 935 . 1 1 71 71 LEU HD12 H 1 0.7060 0.02 . 2 . . . . 71 LEU HD11 . 26800 1 936 . 1 1 71 71 LEU HD13 H 1 0.7060 0.02 . 2 . . . . 71 LEU HD11 . 26800 1 937 . 1 1 71 71 LEU HD21 H 1 0.6510 0.02 . 2 . . . . 71 LEU HD21 . 26800 1 938 . 1 1 71 71 LEU HD22 H 1 0.6510 0.02 . 2 . . . . 71 LEU HD21 . 26800 1 939 . 1 1 71 71 LEU HD23 H 1 0.6510 0.02 . 2 . . . . 71 LEU HD21 . 26800 1 940 . 1 1 71 71 LEU C C 13 175.7150 0.3 . 1 . . . . 71 LEU C . 26800 1 941 . 1 1 71 71 LEU CA C 13 53.6310 0.3 . 1 . . . . 71 LEU CA . 26800 1 942 . 1 1 71 71 LEU CB C 13 44.6760 0.3 . 1 . . . . 71 LEU CB . 26800 1 943 . 1 1 71 71 LEU CG C 13 25.7000 0.3 . 1 . . . . 71 LEU CG . 26800 1 944 . 1 1 71 71 LEU CD1 C 13 25.7000 0.3 . 2 . . . . 71 LEU CD1 . 26800 1 945 . 1 1 71 71 LEU CD2 C 13 24.0430 0.3 . 2 . . . . 71 LEU CD2 . 26800 1 946 . 1 1 71 71 LEU N N 15 121.7420 0.2 . 1 . . . . 71 LEU N . 26800 1 947 . 1 1 72 72 GLU H H 1 8.1950 0.02 . 1 . . . . 72 GLU H . 26800 1 948 . 1 1 72 72 GLU HA H 1 4.4290 0.02 . 1 . . . . 72 GLU HA . 26800 1 949 . 1 1 72 72 GLU HB2 H 1 2.0500 0.02 . 2 . . . . 72 GLU HB2 . 26800 1 950 . 1 1 72 72 GLU HB3 H 1 2.0500 0.02 . 2 . . . . 72 GLU HB3 . 26800 1 951 . 1 1 72 72 GLU HG2 H 1 2.1470 0.02 . 2 . . . . 72 GLU HG2 . 26800 1 952 . 1 1 72 72 GLU HG3 H 1 2.1470 0.02 . 2 . . . . 72 GLU HG3 . 26800 1 953 . 1 1 72 72 GLU C C 13 174.9600 0.3 . 1 . . . . 72 GLU C . 26800 1 954 . 1 1 72 72 GLU CA C 13 55.6810 0.3 . 1 . . . . 72 GLU CA . 26800 1 955 . 1 1 72 72 GLU CB C 13 31.4600 0.3 . 1 . . . . 72 GLU CB . 26800 1 956 . 1 1 72 72 GLU CG C 13 35.8960 0.3 . 1 . . . . 72 GLU CG . 26800 1 957 . 1 1 72 72 GLU N N 15 123.1990 0.2 . 1 . . . . 72 GLU N . 26800 1 958 . 1 1 73 73 VAL H H 1 8.6240 0.02 . 1 . . . . 73 VAL H . 26800 1 959 . 1 1 73 73 VAL HA H 1 4.6400 0.02 . 1 . . . . 73 VAL HA . 26800 1 960 . 1 1 73 73 VAL HB H 1 1.9620 0.02 . 1 . . . . 73 VAL HB . 26800 1 961 . 1 1 73 73 VAL HG11 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG11 . 26800 1 962 . 1 1 73 73 VAL HG12 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG11 . 26800 1 963 . 1 1 73 73 VAL HG13 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG11 . 26800 1 964 . 1 1 73 73 VAL HG21 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG21 . 26800 1 965 . 1 1 73 73 VAL HG22 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG21 . 26800 1 966 . 1 1 73 73 VAL HG23 H 1 0.7640 0.02 . 2 . . . . 73 VAL HG21 . 26800 1 967 . 1 1 73 73 VAL C C 13 176.9650 0.3 . 1 . . . . 73 VAL C . 26800 1 968 . 1 1 73 73 VAL CA C 13 61.3890 0.3 . 1 . . . . 73 VAL CA . 26800 1 969 . 1 1 73 73 VAL CB C 13 31.2190 0.3 . 1 . . . . 73 VAL CB . 26800 1 970 . 1 1 73 73 VAL CG1 C 13 21.0640 0.3 . 2 . . . . 73 VAL CG1 . 26800 1 971 . 1 1 73 73 VAL CG2 C 13 21.0640 0.3 . 2 . . . . 73 VAL CG2 . 26800 1 972 . 1 1 73 73 VAL N N 15 127.9310 0.2 . 1 . . . . 73 VAL N . 26800 1 973 . 1 1 74 74 VAL H H 1 9.3060 0.02 . 1 . . . . 74 VAL H . 26800 1 974 . 1 1 74 74 VAL HA H 1 4.8320 0.02 . 1 . . . . 74 VAL HA . 26800 1 975 . 1 1 74 74 VAL HB H 1 2.3000 0.02 . 1 . . . . 74 VAL HB . 26800 1 976 . 1 1 74 74 VAL HG11 H 1 0.7450 0.02 . 2 . . . . 74 VAL HG11 . 26800 1 977 . 1 1 74 74 VAL HG12 H 1 0.7450 0.02 . 2 . . . . 74 VAL HG11 . 26800 1 978 . 1 1 74 74 VAL HG13 H 1 0.7450 0.02 . 2 . . . . 74 VAL HG11 . 26800 1 979 . 1 1 74 74 VAL HG21 H 1 0.9540 0.02 . 2 . . . . 74 VAL HG21 . 26800 1 980 . 1 1 74 74 VAL HG22 H 1 0.9540 0.02 . 2 . . . . 74 VAL HG21 . 26800 1 981 . 1 1 74 74 VAL HG23 H 1 0.9540 0.02 . 2 . . . . 74 VAL HG21 . 26800 1 982 . 1 1 74 74 VAL C C 13 173.2900 0.3 . 1 . . . . 74 VAL C . 26800 1 983 . 1 1 74 74 VAL CA C 13 58.2600 0.3 . 1 . . . . 74 VAL CA . 26800 1 984 . 1 1 74 74 VAL CB C 13 31.5510 0.3 . 1 . . . . 74 VAL CB . 26800 1 985 . 1 1 74 74 VAL CG1 C 13 19.2300 0.3 . 2 . . . . 74 VAL CG1 . 26800 1 986 . 1 1 74 74 VAL CG2 C 13 21.6800 0.3 . 2 . . . . 74 VAL CG2 . 26800 1 987 . 1 1 74 74 VAL N N 15 126.8470 0.2 . 1 . . . . 74 VAL N . 26800 1 988 . 1 1 75 75 PRO HA H 1 4.6700 0.02 . 1 . . . . 75 PRO HA . 26800 1 989 . 1 1 75 75 PRO HB2 H 1 1.8270 0.02 . 2 . . . . 75 PRO HB2 . 26800 1 990 . 1 1 75 75 PRO HB3 H 1 2.2750 0.02 . 2 . . . . 75 PRO HB3 . 26800 1 991 . 1 1 75 75 PRO HG2 H 1 2.0100 0.02 . 2 . . . . 75 PRO HG2 . 26800 1 992 . 1 1 75 75 PRO HG3 H 1 2.0100 0.02 . 2 . . . . 75 PRO HG3 . 26800 1 993 . 1 1 75 75 PRO HD2 H 1 3.8150 0.02 . 2 . . . . 75 PRO HD2 . 26800 1 994 . 1 1 75 75 PRO HD3 H 1 3.7050 0.02 . 2 . . . . 75 PRO HD3 . 26800 1 995 . 1 1 75 75 PRO C C 13 176.6620 0.3 . 1 . . . . 75 PRO C . 26800 1 996 . 1 1 75 75 PRO CA C 13 62.0460 0.3 . 1 . . . . 75 PRO CA . 26800 1 997 . 1 1 75 75 PRO CB C 13 32.5150 0.3 . 1 . . . . 75 PRO CB . 26800 1 998 . 1 1 75 75 PRO CG C 13 27.3730 0.3 . 1 . . . . 75 PRO CG . 26800 1 999 . 1 1 75 75 PRO CD C 13 50.8380 0.3 . 1 . . . . 75 PRO CD . 26800 1 1000 . 1 1 76 76 THR H H 1 8.6510 0.02 . 1 . . . . 76 THR H . 26800 1 1001 . 1 1 76 76 THR HA H 1 4.4050 0.02 . 1 . . . . 76 THR HA . 26800 1 1002 . 1 1 76 76 THR HB H 1 4.1230 0.02 . 1 . . . . 76 THR HB . 26800 1 1003 . 1 1 76 76 THR HG21 H 1 1.2220 0.02 . 1 . . . . 76 THR HG21 . 26800 1 1004 . 1 1 76 76 THR HG22 H 1 1.2220 0.02 . 1 . . . . 76 THR HG21 . 26800 1 1005 . 1 1 76 76 THR HG23 H 1 1.2220 0.02 . 1 . . . . 76 THR HG21 . 26800 1 1006 . 1 1 76 76 THR C C 13 173.3600 0.3 . 1 . . . . 76 THR C . 26800 1 1007 . 1 1 76 76 THR CA C 13 60.8840 0.3 . 1 . . . . 76 THR CA . 26800 1 1008 . 1 1 76 76 THR CB C 13 69.3110 0.3 . 1 . . . . 76 THR CB . 26800 1 1009 . 1 1 76 76 THR CG2 C 13 21.8390 0.3 . 1 . . . . 76 THR CG2 . 26800 1 1010 . 1 1 76 76 THR N N 15 118.3910 0.2 . 1 . . . . 76 THR N . 26800 1 1011 . 1 1 77 77 PRO HA H 1 4.4300 0.02 . 1 . . . . 77 PRO HA . 26800 1 1012 . 1 1 77 77 PRO HB2 H 1 2.3300 0.02 . 2 . . . . 77 PRO HB2 . 26800 1 1013 . 1 1 77 77 PRO HB3 H 1 1.8620 0.02 . 2 . . . . 77 PRO HB3 . 26800 1 1014 . 1 1 77 77 PRO HG2 H 1 1.8870 0.02 . 2 . . . . 77 PRO HG2 . 26800 1 1015 . 1 1 77 77 PRO HG3 H 1 1.8870 0.02 . 2 . . . . 77 PRO HG3 . 26800 1 1016 . 1 1 77 77 PRO HD2 H 1 3.4600 0.02 . 2 . . . . 77 PRO HD2 . 26800 1 1017 . 1 1 77 77 PRO HD3 H 1 3.9900 0.02 . 2 . . . . 77 PRO HD3 . 26800 1 1018 . 1 1 77 77 PRO C C 13 175.9000 0.3 . 1 . . . . 77 PRO C . 26800 1 1019 . 1 1 77 77 PRO CA C 13 62.4700 0.3 . 1 . . . . 77 PRO CA . 26800 1 1020 . 1 1 77 77 PRO CB C 13 32.2200 0.3 . 1 . . . . 77 PRO CB . 26800 1 1021 . 1 1 77 77 PRO CG C 13 27.4700 0.3 . 1 . . . . 77 PRO CG . 26800 1 1022 . 1 1 77 77 PRO CD C 13 50.8300 0.3 . 1 . . . . 77 PRO CD . 26800 1 1023 . 1 1 78 78 ALA H H 1 8.4360 0.02 . 1 . . . . 78 ALA H . 26800 1 1024 . 1 1 78 78 ALA HA H 1 4.3290 0.02 . 1 . . . . 78 ALA HA . 26800 1 1025 . 1 1 78 78 ALA HB1 H 1 1.4090 0.02 . 1 . . . . 78 ALA HB1 . 26800 1 1026 . 1 1 78 78 ALA HB2 H 1 1.4090 0.02 . 1 . . . . 78 ALA HB1 . 26800 1 1027 . 1 1 78 78 ALA HB3 H 1 1.4090 0.02 . 1 . . . . 78 ALA HB1 . 26800 1 1028 . 1 1 78 78 ALA C C 13 177.8600 0.3 . 1 . . . . 78 ALA C . 26800 1 1029 . 1 1 78 78 ALA CA C 13 52.2000 0.3 . 1 . . . . 78 ALA CA . 26800 1 1030 . 1 1 78 78 ALA CB C 13 19.3200 0.3 . 1 . . . . 78 ALA CB . 26800 1 1031 . 1 1 78 78 ALA N N 15 124.6950 0.2 . 1 . . . . 78 ALA N . 26800 1 1032 . 1 1 79 79 VAL H H 1 8.0860 0.02 . 1 . . . . 79 VAL H . 26800 1 1033 . 1 1 79 79 VAL HA H 1 4.0600 0.02 . 1 . . . . 79 VAL HA . 26800 1 1034 . 1 1 79 79 VAL HB H 1 2.0300 0.02 . 1 . . . . 79 VAL HB . 26800 1 1035 . 1 1 79 79 VAL HG11 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG11 . 26800 1 1036 . 1 1 79 79 VAL HG12 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG11 . 26800 1 1037 . 1 1 79 79 VAL HG13 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG11 . 26800 1 1038 . 1 1 79 79 VAL HG21 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG21 . 26800 1 1039 . 1 1 79 79 VAL HG22 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG21 . 26800 1 1040 . 1 1 79 79 VAL HG23 H 1 0.9340 0.02 . 2 . . . . 79 VAL HG21 . 26800 1 1041 . 1 1 79 79 VAL C C 13 175.3500 0.3 . 1 . . . . 79 VAL C . 26800 1 1042 . 1 1 79 79 VAL CA C 13 62.2000 0.3 . 1 . . . . 79 VAL CA . 26800 1 1043 . 1 1 79 79 VAL CB C 13 32.7000 0.3 . 1 . . . . 79 VAL CB . 26800 1 1044 . 1 1 79 79 VAL CG1 C 13 20.9800 0.3 . 2 . . . . 79 VAL CG1 . 26800 1 1045 . 1 1 79 79 VAL CG2 C 13 20.9800 0.3 . 2 . . . . 79 VAL CG2 . 26800 1 1046 . 1 1 79 79 VAL N N 15 119.1460 0.2 . 1 . . . . 79 VAL N . 26800 1 1047 . 1 1 80 80 ASP H H 1 8.4460 0.02 . 1 . . . . 80 ASP H . 26800 1 1048 . 1 1 80 80 ASP HA H 1 4.6980 0.02 . 1 . . . . 80 ASP HA . 26800 1 1049 . 1 1 80 80 ASP HB2 H 1 2.7150 0.02 . 2 . . . . 80 ASP HB2 . 26800 1 1050 . 1 1 80 80 ASP HB3 H 1 2.6110 0.02 . 2 . . . . 80 ASP HB3 . 26800 1 1051 . 1 1 80 80 ASP C C 13 176.4000 0.3 . 1 . . . . 80 ASP C . 26800 1 1052 . 1 1 80 80 ASP CA C 13 54.0000 0.3 . 1 . . . . 80 ASP CA . 26800 1 1053 . 1 1 80 80 ASP CB C 13 41.6800 0.3 . 1 . . . . 80 ASP CB . 26800 1 1054 . 1 1 80 80 ASP N N 15 124.6420 0.2 . 1 . . . . 80 ASP N . 26800 1 1055 . 1 1 81 81 VAL H H 1 8.1040 0.02 . 1 . . . . 81 VAL H . 26800 1 1056 . 1 1 81 81 VAL HA H 1 4.2120 0.02 . 1 . . . . 81 VAL HA . 26800 1 1057 . 1 1 81 81 VAL HB H 1 2.2340 0.02 . 1 . . . . 81 VAL HB . 26800 1 1058 . 1 1 81 81 VAL HG11 H 1 0.9560 0.02 . 2 . . . . 81 VAL HG11 . 26800 1 1059 . 1 1 81 81 VAL HG12 H 1 0.9560 0.02 . 2 . . . . 81 VAL HG11 . 26800 1 1060 . 1 1 81 81 VAL HG13 H 1 0.9560 0.02 . 2 . . . . 81 VAL HG11 . 26800 1 1061 . 1 1 81 81 VAL HG21 H 1 0.9480 0.02 . 2 . . . . 81 VAL HG21 . 26800 1 1062 . 1 1 81 81 VAL HG22 H 1 0.9480 0.02 . 2 . . . . 81 VAL HG21 . 26800 1 1063 . 1 1 81 81 VAL HG23 H 1 0.9480 0.02 . 2 . . . . 81 VAL HG21 . 26800 1 1064 . 1 1 81 81 VAL C C 13 176.3790 0.3 . 1 . . . . 81 VAL C . 26800 1 1065 . 1 1 81 81 VAL CA C 13 62.1020 0.3 . 1 . . . . 81 VAL CA . 26800 1 1066 . 1 1 81 81 VAL CB C 13 32.3700 0.3 . 1 . . . . 81 VAL CB . 26800 1 1067 . 1 1 81 81 VAL CG1 C 13 21.2540 0.3 . 2 . . . . 81 VAL CG1 . 26800 1 1068 . 1 1 81 81 VAL CG2 C 13 19.9490 0.3 . 2 . . . . 81 VAL CG2 . 26800 1 1069 . 1 1 81 81 VAL N N 15 119.1480 0.2 . 1 . . . . 81 VAL N . 26800 1 1070 . 1 1 82 82 SER H H 1 8.4200 0.02 . 1 . . . . 82 SER H . 26800 1 1071 . 1 1 82 82 SER HA H 1 4.3830 0.02 . 1 . . . . 82 SER HA . 26800 1 1072 . 1 1 82 82 SER HB2 H 1 3.8770 0.02 . 2 . . . . 82 SER HB2 . 26800 1 1073 . 1 1 82 82 SER HB3 H 1 3.9730 0.02 . 2 . . . . 82 SER HB3 . 26800 1 1074 . 1 1 82 82 SER C C 13 174.6900 0.3 . 1 . . . . 82 SER C . 26800 1 1075 . 1 1 82 82 SER CA C 13 59.0570 0.3 . 1 . . . . 82 SER CA . 26800 1 1076 . 1 1 82 82 SER CB C 13 63.9690 0.3 . 1 . . . . 82 SER CB . 26800 1 1077 . 1 1 82 82 SER N N 15 118.1570 0.2 . 1 . . . . 82 SER N . 26800 1 1078 . 1 1 83 83 ASP H H 1 8.1550 0.02 . 1 . . . . 83 ASP H . 26800 1 1079 . 1 1 83 83 ASP HA H 1 4.5650 0.02 . 1 . . . . 83 ASP HA . 26800 1 1080 . 1 1 83 83 ASP HB2 H 1 2.6270 0.02 . 2 . . . . 83 ASP HB2 . 26800 1 1081 . 1 1 83 83 ASP HB3 H 1 2.7410 0.02 . 2 . . . . 83 ASP HB3 . 26800 1 1082 . 1 1 83 83 ASP C C 13 176.8450 0.3 . 1 . . . . 83 ASP C . 26800 1 1083 . 1 1 83 83 ASP CA C 13 55.0890 0.3 . 1 . . . . 83 ASP CA . 26800 1 1084 . 1 1 83 83 ASP CB C 13 41.2050 0.3 . 1 . . . . 83 ASP CB . 26800 1 1085 . 1 1 83 83 ASP N N 15 121.9650 0.2 . 1 . . . . 83 ASP N . 26800 1 1086 . 1 1 84 84 GLU H H 1 8.3690 0.02 . 1 . . . . 84 GLU H . 26800 1 1087 . 1 1 84 84 GLU HA H 1 4.1060 0.02 . 1 . . . . 84 GLU HA . 26800 1 1088 . 1 1 84 84 GLU HB2 H 1 1.9990 0.02 . 2 . . . . 84 GLU HB2 . 26800 1 1089 . 1 1 84 84 GLU HB3 H 1 2.0720 0.02 . 2 . . . . 84 GLU HB3 . 26800 1 1090 . 1 1 84 84 GLU HG2 H 1 2.3080 0.02 . 2 . . . . 84 GLU HG2 . 26800 1 1091 . 1 1 84 84 GLU HG3 H 1 2.3080 0.02 . 2 . . . . 84 GLU HG3 . 26800 1 1092 . 1 1 84 84 GLU C C 13 176.9700 0.3 . 1 . . . . 84 GLU C . 26800 1 1093 . 1 1 84 84 GLU CA C 13 57.9000 0.3 . 1 . . . . 84 GLU CA . 26800 1 1094 . 1 1 84 84 GLU CB C 13 29.8070 0.3 . 1 . . . . 84 GLU CB . 26800 1 1095 . 1 1 84 84 GLU CG C 13 36.4270 0.3 . 1 . . . . 84 GLU CG . 26800 1 1096 . 1 1 84 84 GLU N N 15 121.1810 0.2 . 1 . . . . 84 GLU N . 26800 1 1097 . 1 1 85 85 ALA H H 1 8.1670 0.02 . 1 . . . . 85 ALA H . 26800 1 1098 . 1 1 85 85 ALA HA H 1 4.1550 0.02 . 1 . . . . 85 ALA HA . 26800 1 1099 . 1 1 85 85 ALA HB1 H 1 1.4180 0.02 . 1 . . . . 85 ALA HB1 . 26800 1 1100 . 1 1 85 85 ALA HB2 H 1 1.4180 0.02 . 1 . . . . 85 ALA HB1 . 26800 1 1101 . 1 1 85 85 ALA HB3 H 1 1.4180 0.02 . 1 . . . . 85 ALA HB1 . 26800 1 1102 . 1 1 85 85 ALA C C 13 178.3420 0.3 . 1 . . . . 85 ALA C . 26800 1 1103 . 1 1 85 85 ALA CA C 13 53.6950 0.3 . 1 . . . . 85 ALA CA . 26800 1 1104 . 1 1 85 85 ALA CB C 13 18.7920 0.3 . 1 . . . . 85 ALA CB . 26800 1 1105 . 1 1 85 85 ALA N N 15 122.8120 0.2 . 1 . . . . 85 ALA N . 26800 1 1106 . 1 1 86 86 LEU H H 1 7.8890 0.02 . 1 . . . . 86 LEU H . 26800 1 1107 . 1 1 86 86 LEU HA H 1 4.2350 0.02 . 1 . . . . 86 LEU HA . 26800 1 1108 . 1 1 86 86 LEU HB2 H 1 1.6200 0.02 . 2 . . . . 86 LEU HB2 . 26800 1 1109 . 1 1 86 86 LEU HB3 H 1 1.7390 0.02 . 2 . . . . 86 LEU HB3 . 26800 1 1110 . 1 1 86 86 LEU HG H 1 1.6460 0.02 . 1 . . . . 86 LEU HG . 26800 1 1111 . 1 1 86 86 LEU HD11 H 1 0.9390 0.02 . 2 . . . . 86 LEU HD11 . 26800 1 1112 . 1 1 86 86 LEU HD12 H 1 0.9390 0.02 . 2 . . . . 86 LEU HD11 . 26800 1 1113 . 1 1 86 86 LEU HD13 H 1 0.9390 0.02 . 2 . . . . 86 LEU HD11 . 26800 1 1114 . 1 1 86 86 LEU HD21 H 1 0.8740 0.02 . 2 . . . . 86 LEU HD21 . 26800 1 1115 . 1 1 86 86 LEU HD22 H 1 0.8740 0.02 . 2 . . . . 86 LEU HD21 . 26800 1 1116 . 1 1 86 86 LEU HD23 H 1 0.8740 0.02 . 2 . . . . 86 LEU HD21 . 26800 1 1117 . 1 1 86 86 LEU C C 13 177.7880 0.3 . 1 . . . . 86 LEU C . 26800 1 1118 . 1 1 86 86 LEU CA C 13 56.1270 0.3 . 1 . . . . 86 LEU CA . 26800 1 1119 . 1 1 86 86 LEU CB C 13 42.2900 0.3 . 1 . . . . 86 LEU CB . 26800 1 1120 . 1 1 86 86 LEU CG C 13 27.1000 0.3 . 1 . . . . 86 LEU CG . 26800 1 1121 . 1 1 86 86 LEU CD1 C 13 25.0560 0.3 . 2 . . . . 86 LEU CD1 . 26800 1 1122 . 1 1 86 86 LEU CD2 C 13 23.4990 0.3 . 2 . . . . 86 LEU CD2 . 26800 1 1123 . 1 1 86 86 LEU N N 15 118.2930 0.2 . 1 . . . . 86 LEU N . 26800 1 1124 . 1 1 87 87 VAL H H 1 7.6520 0.02 . 1 . . . . 87 VAL H . 26800 1 1125 . 1 1 87 87 VAL HA H 1 3.9700 0.02 . 1 . . . . 87 VAL HA . 26800 1 1126 . 1 1 87 87 VAL HB H 1 2.1310 0.02 . 1 . . . . 87 VAL HB . 26800 1 1127 . 1 1 87 87 VAL HG11 H 1 0.9560 0.02 . 2 . . . . 87 VAL HG11 . 26800 1 1128 . 1 1 87 87 VAL HG12 H 1 0.9560 0.02 . 2 . . . . 87 VAL HG11 . 26800 1 1129 . 1 1 87 87 VAL HG13 H 1 0.9560 0.02 . 2 . . . . 87 VAL HG11 . 26800 1 1130 . 1 1 87 87 VAL HG21 H 1 0.8980 0.02 . 2 . . . . 87 VAL HG21 . 26800 1 1131 . 1 1 87 87 VAL HG22 H 1 0.8980 0.02 . 2 . . . . 87 VAL HG21 . 26800 1 1132 . 1 1 87 87 VAL HG23 H 1 0.8980 0.02 . 2 . . . . 87 VAL HG21 . 26800 1 1133 . 1 1 87 87 VAL C C 13 176.5000 0.3 . 1 . . . . 87 VAL C . 26800 1 1134 . 1 1 87 87 VAL CA C 13 63.1350 0.3 . 1 . . . . 87 VAL CA . 26800 1 1135 . 1 1 87 87 VAL CB C 13 32.2900 0.3 . 1 . . . . 87 VAL CB . 26800 1 1136 . 1 1 87 87 VAL CG1 C 13 21.3960 0.3 . 2 . . . . 87 VAL CG1 . 26800 1 1137 . 1 1 87 87 VAL CG2 C 13 21.3960 0.3 . 2 . . . . 87 VAL CG2 . 26800 1 1138 . 1 1 87 87 VAL N N 15 118.2980 0.2 . 1 . . . . 87 VAL N . 26800 1 1139 . 1 1 88 88 ARG H H 1 8.2040 0.02 . 1 . . . . 88 ARG H . 26800 1 1140 . 1 1 88 88 ARG HA H 1 4.2310 0.02 . 1 . . . . 88 ARG HA . 26800 1 1141 . 1 1 88 88 ARG HB2 H 1 1.8520 0.02 . 2 . . . . 88 ARG HB2 . 26800 1 1142 . 1 1 88 88 ARG HB3 H 1 1.7880 0.02 . 2 . . . . 88 ARG HB3 . 26800 1 1143 . 1 1 88 88 ARG HG2 H 1 1.6500 0.02 . 2 . . . . 88 ARG HG2 . 26800 1 1144 . 1 1 88 88 ARG HG3 H 1 1.5940 0.02 . 2 . . . . 88 ARG HG3 . 26800 1 1145 . 1 1 88 88 ARG HD2 H 1 3.1950 0.02 . 2 . . . . 88 ARG HD2 . 26800 1 1146 . 1 1 88 88 ARG HD3 H 1 3.1950 0.02 . 2 . . . . 88 ARG HD3 . 26800 1 1147 . 1 1 88 88 ARG HE H 1 7.3050 0.02 . 1 . . . . 88 ARG HE . 26800 1 1148 . 1 1 88 88 ARG C C 13 176.2100 0.3 . 1 . . . . 88 ARG C . 26800 1 1149 . 1 1 88 88 ARG CA C 13 57.1600 0.3 . 1 . . . . 88 ARG CA . 26800 1 1150 . 1 1 88 88 ARG CB C 13 30.6100 0.3 . 1 . . . . 88 ARG CB . 26800 1 1151 . 1 1 88 88 ARG CG C 13 27.1300 0.3 . 1 . . . . 88 ARG CG . 26800 1 1152 . 1 1 88 88 ARG CD C 13 43.4800 0.3 . 1 . . . . 88 ARG CD . 26800 1 1153 . 1 1 88 88 ARG N N 15 122.8520 0.2 . 1 . . . . 88 ARG N . 26800 1 1154 . 1 1 88 88 ARG NE N 15 84.7400 0.2 . 1 . . . . 88 ARG NE . 26800 1 1155 . 1 1 89 89 ASP H H 1 7.9670 0.02 . 1 . . . . 89 ASP H . 26800 1 1156 . 1 1 89 89 ASP HA H 1 4.6280 0.02 . 1 . . . . 89 ASP HA . 26800 1 1157 . 1 1 89 89 ASP HB2 H 1 2.7350 0.02 . 2 . . . . 89 ASP HB2 . 26800 1 1158 . 1 1 89 89 ASP HB3 H 1 2.6470 0.02 . 2 . . . . 89 ASP HB3 . 26800 1 1159 . 1 1 89 89 ASP C C 13 176.3300 0.3 . 1 . . . . 89 ASP C . 26800 1 1160 . 1 1 89 89 ASP CA C 13 54.0700 0.3 . 1 . . . . 89 ASP CA . 26800 1 1161 . 1 1 89 89 ASP CB C 13 41.4400 0.3 . 1 . . . . 89 ASP CB . 26800 1 1162 . 1 1 89 89 ASP N N 15 119.1700 0.2 . 1 . . . . 89 ASP N . 26800 1 1163 . 1 1 90 90 ALA H H 1 8.4180 0.02 . 1 . . . . 90 ALA H . 26800 1 1164 . 1 1 90 90 ALA HA H 1 4.1550 0.02 . 1 . . . . 90 ALA HA . 26800 1 1165 . 1 1 90 90 ALA HB1 H 1 1.4290 0.02 . 1 . . . . 90 ALA HB1 . 26800 1 1166 . 1 1 90 90 ALA HB2 H 1 1.4290 0.02 . 1 . . . . 90 ALA HB1 . 26800 1 1167 . 1 1 90 90 ALA HB3 H 1 1.4290 0.02 . 1 . . . . 90 ALA HB1 . 26800 1 1168 . 1 1 90 90 ALA C C 13 178.2300 0.3 . 1 . . . . 90 ALA C . 26800 1 1169 . 1 1 90 90 ALA CA C 13 53.9910 0.3 . 1 . . . . 90 ALA CA . 26800 1 1170 . 1 1 90 90 ALA CB C 13 18.8590 0.3 . 1 . . . . 90 ALA CB . 26800 1 1171 . 1 1 90 90 ALA N N 15 125.4160 0.2 . 1 . . . . 90 ALA N . 26800 1 1172 . 1 1 91 91 SER H H 1 8.1340 0.02 . 1 . . . . 91 SER H . 26800 1 1173 . 1 1 91 91 SER HA H 1 4.2830 0.02 . 1 . . . . 91 SER HA . 26800 1 1174 . 1 1 91 91 SER HB2 H 1 3.8760 0.02 . 2 . . . . 91 SER HB2 . 26800 1 1175 . 1 1 91 91 SER HB3 H 1 3.9530 0.02 . 2 . . . . 91 SER HB3 . 26800 1 1176 . 1 1 91 91 SER C C 13 174.2500 0.3 . 1 . . . . 91 SER C . 26800 1 1177 . 1 1 91 91 SER CA C 13 59.5000 0.3 . 1 . . . . 91 SER CA . 26800 1 1178 . 1 1 91 91 SER CB C 13 63.6660 0.3 . 1 . . . . 91 SER CB . 26800 1 1179 . 1 1 91 91 SER N N 15 111.6840 0.2 . 1 . . . . 91 SER N . 26800 1 1180 . 1 1 92 92 ALA H H 1 7.9290 0.02 . 1 . . . . 92 ALA H . 26800 1 1181 . 1 1 92 92 ALA HA H 1 4.3470 0.02 . 1 . . . . 92 ALA HA . 26800 1 1182 . 1 1 92 92 ALA HB1 H 1 1.4070 0.02 . 1 . . . . 92 ALA HB1 . 26800 1 1183 . 1 1 92 92 ALA HB2 H 1 1.4070 0.02 . 1 . . . . 92 ALA HB1 . 26800 1 1184 . 1 1 92 92 ALA HB3 H 1 1.4070 0.02 . 1 . . . . 92 ALA HB1 . 26800 1 1185 . 1 1 92 92 ALA C C 13 178.3300 0.3 . 1 . . . . 92 ALA C . 26800 1 1186 . 1 1 92 92 ALA CA C 13 52.5050 0.3 . 1 . . . . 92 ALA CA . 26800 1 1187 . 1 1 92 92 ALA CB C 13 19.2770 0.3 . 1 . . . . 92 ALA CB . 26800 1 1188 . 1 1 92 92 ALA N N 15 124.4020 0.2 . 1 . . . . 92 ALA N . 26800 1 1189 . 1 1 94 94 PRO HA H 1 4.4390 0.02 . 1 . . . . 94 PRO HA . 26800 1 1190 . 1 1 94 94 PRO HB2 H 1 2.1260 0.02 . 2 . . . . 94 PRO HB2 . 26800 1 1191 . 1 1 94 94 PRO HB3 H 1 2.3050 0.02 . 2 . . . . 94 PRO HB3 . 26800 1 1192 . 1 1 94 94 PRO HG2 H 1 2.1570 0.02 . 2 . . . . 94 PRO HG2 . 26800 1 1193 . 1 1 94 94 PRO HG3 H 1 1.9320 0.02 . 2 . . . . 94 PRO HG3 . 26800 1 1194 . 1 1 94 94 PRO HD2 H 1 3.8070 0.02 . 2 . . . . 94 PRO HD2 . 26800 1 1195 . 1 1 94 94 PRO HD3 H 1 3.9500 0.02 . 2 . . . . 94 PRO HD3 . 26800 1 1196 . 1 1 94 94 PRO C C 13 176.7400 0.3 . 1 . . . . 94 PRO C . 26800 1 1197 . 1 1 94 94 PRO CA C 13 65.9000 0.3 . 1 . . . . 94 PRO CA . 26800 1 1198 . 1 1 94 94 PRO CB C 13 31.8900 0.3 . 1 . . . . 94 PRO CB . 26800 1 1199 . 1 1 94 94 PRO CG C 13 27.9500 0.3 . 1 . . . . 94 PRO CG . 26800 1 1200 . 1 1 94 94 PRO CD C 13 50.9100 0.3 . 1 . . . . 94 PRO CD . 26800 1 1201 . 1 1 95 95 ILE H H 1 7.4040 0.02 . 1 . . . . 95 ILE H . 26800 1 1202 . 1 1 95 95 ILE HA H 1 3.7900 0.02 . 1 . . . . 95 ILE HA . 26800 1 1203 . 1 1 95 95 ILE HB H 1 2.0490 0.02 . 1 . . . . 95 ILE HB . 26800 1 1204 . 1 1 95 95 ILE HG12 H 1 1.5280 0.02 . 2 . . . . 95 ILE HG12 . 26800 1 1205 . 1 1 95 95 ILE HG13 H 1 1.8040 0.02 . 2 . . . . 95 ILE HG13 . 26800 1 1206 . 1 1 95 95 ILE HG21 H 1 0.9250 0.02 . 1 . . . . 95 ILE HG21 . 26800 1 1207 . 1 1 95 95 ILE HG22 H 1 0.9250 0.02 . 1 . . . . 95 ILE HG21 . 26800 1 1208 . 1 1 95 95 ILE HG23 H 1 0.9250 0.02 . 1 . . . . 95 ILE HG21 . 26800 1 1209 . 1 1 95 95 ILE HD11 H 1 0.8530 0.02 . 1 . . . . 95 ILE HD11 . 26800 1 1210 . 1 1 95 95 ILE HD12 H 1 0.8530 0.02 . 1 . . . . 95 ILE HD11 . 26800 1 1211 . 1 1 95 95 ILE HD13 H 1 0.8530 0.02 . 1 . . . . 95 ILE HD11 . 26800 1 1212 . 1 1 95 95 ILE C C 13 176.5230 0.3 . 1 . . . . 95 ILE C . 26800 1 1213 . 1 1 95 95 ILE CA C 13 63.6250 0.3 . 1 . . . . 95 ILE CA . 26800 1 1214 . 1 1 95 95 ILE CB C 13 37.1770 0.3 . 1 . . . . 95 ILE CB . 26800 1 1215 . 1 1 95 95 ILE CG1 C 13 29.2550 0.3 . 1 . . . . 95 ILE CG1 . 26800 1 1216 . 1 1 95 95 ILE CG2 C 13 18.2800 0.3 . 1 . . . . 95 ILE CG2 . 26800 1 1217 . 1 1 95 95 ILE CD1 C 13 12.0300 0.3 . 1 . . . . 95 ILE CD1 . 26800 1 1218 . 1 1 95 95 ILE N N 15 116.0580 0.2 . 1 . . . . 95 ILE N . 26800 1 1219 . 1 1 96 96 LEU H H 1 6.7530 0.02 . 1 . . . . 96 LEU H . 26800 1 1220 . 1 1 96 96 LEU HA H 1 3.8020 0.02 . 1 . . . . 96 LEU HA . 26800 1 1221 . 1 1 96 96 LEU HB2 H 1 1.7490 0.02 . 2 . . . . 96 LEU HB2 . 26800 1 1222 . 1 1 96 96 LEU HB3 H 1 1.7490 0.02 . 2 . . . . 96 LEU HB3 . 26800 1 1223 . 1 1 96 96 LEU HG H 1 1.4240 0.02 . 1 . . . . 96 LEU HG . 26800 1 1224 . 1 1 96 96 LEU HD11 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD11 . 26800 1 1225 . 1 1 96 96 LEU HD12 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD11 . 26800 1 1226 . 1 1 96 96 LEU HD13 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD11 . 26800 1 1227 . 1 1 96 96 LEU HD21 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD21 . 26800 1 1228 . 1 1 96 96 LEU HD22 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD21 . 26800 1 1229 . 1 1 96 96 LEU HD23 H 1 0.7480 0.02 . 2 . . . . 96 LEU HD21 . 26800 1 1230 . 1 1 96 96 LEU C C 13 178.5020 0.3 . 1 . . . . 96 LEU C . 26800 1 1231 . 1 1 96 96 LEU CA C 13 57.3140 0.3 . 1 . . . . 96 LEU CA . 26800 1 1232 . 1 1 96 96 LEU CB C 13 41.1910 0.3 . 1 . . . . 96 LEU CB . 26800 1 1233 . 1 1 96 96 LEU CG C 13 27.4000 0.3 . 1 . . . . 96 LEU CG . 26800 1 1234 . 1 1 96 96 LEU CD1 C 13 25.1880 0.3 . 2 . . . . 96 LEU CD1 . 26800 1 1235 . 1 1 96 96 LEU CD2 C 13 23.8310 0.3 . 2 . . . . 96 LEU CD2 . 26800 1 1236 . 1 1 96 96 LEU N N 15 120.9950 0.2 . 1 . . . . 96 LEU N . 26800 1 1237 . 1 1 97 97 ARG H H 1 8.0990 0.02 . 1 . . . . 97 ARG H . 26800 1 1238 . 1 1 97 97 ARG HA H 1 3.8700 0.02 . 1 . . . . 97 ARG HA . 26800 1 1239 . 1 1 97 97 ARG HB2 H 1 1.8940 0.02 . 2 . . . . 97 ARG HB2 . 26800 1 1240 . 1 1 97 97 ARG HB3 H 1 1.8940 0.02 . 2 . . . . 97 ARG HB3 . 26800 1 1241 . 1 1 97 97 ARG HG2 H 1 1.8670 0.02 . 2 . . . . 97 ARG HG2 . 26800 1 1242 . 1 1 97 97 ARG HG3 H 1 1.8670 0.02 . 2 . . . . 97 ARG HG3 . 26800 1 1243 . 1 1 97 97 ARG HD2 H 1 3.2320 0.02 . 2 . . . . 97 ARG HD2 . 26800 1 1244 . 1 1 97 97 ARG HD3 H 1 3.2320 0.02 . 2 . . . . 97 ARG HD3 . 26800 1 1245 . 1 1 97 97 ARG C C 13 179.8360 0.3 . 1 . . . . 97 ARG C . 26800 1 1246 . 1 1 97 97 ARG CA C 13 59.6860 0.3 . 1 . . . . 97 ARG CA . 26800 1 1247 . 1 1 97 97 ARG CB C 13 29.6700 0.3 . 1 . . . . 97 ARG CB . 26800 1 1248 . 1 1 97 97 ARG CG C 13 27.9400 0.3 . 1 . . . . 97 ARG CG . 26800 1 1249 . 1 1 97 97 ARG CD C 13 43.8700 0.3 . 1 . . . . 97 ARG CD . 26800 1 1250 . 1 1 97 97 ARG N N 15 118.4080 0.2 . 1 . . . . 97 ARG N . 26800 1 1251 . 1 1 98 98 ALA H H 1 8.4140 0.02 . 1 . . . . 98 ALA H . 26800 1 1252 . 1 1 98 98 ALA HA H 1 4.0530 0.02 . 1 . . . . 98 ALA HA . 26800 1 1253 . 1 1 98 98 ALA HB1 H 1 1.5550 0.02 . 1 . . . . 98 ALA HB1 . 26800 1 1254 . 1 1 98 98 ALA HB2 H 1 1.5550 0.02 . 1 . . . . 98 ALA HB1 . 26800 1 1255 . 1 1 98 98 ALA HB3 H 1 1.5550 0.02 . 1 . . . . 98 ALA HB1 . 26800 1 1256 . 1 1 98 98 ALA C C 13 178.9500 0.3 . 1 . . . . 98 ALA C . 26800 1 1257 . 1 1 98 98 ALA CA C 13 55.0320 0.3 . 1 . . . . 98 ALA CA . 26800 1 1258 . 1 1 98 98 ALA CB C 13 18.8700 0.3 . 1 . . . . 98 ALA CB . 26800 1 1259 . 1 1 98 98 ALA N N 15 121.6260 0.2 . 1 . . . . 98 ALA N . 26800 1 1260 . 1 1 99 99 ALA H H 1 8.1970 0.02 . 1 . . . . 99 ALA H . 26800 1 1261 . 1 1 99 99 ALA HA H 1 3.7220 0.02 . 1 . . . . 99 ALA HA . 26800 1 1262 . 1 1 99 99 ALA HB1 H 1 1.4070 0.02 . 1 . . . . 99 ALA HB1 . 26800 1 1263 . 1 1 99 99 ALA HB2 H 1 1.4070 0.02 . 1 . . . . 99 ALA HB1 . 26800 1 1264 . 1 1 99 99 ALA HB3 H 1 1.4070 0.02 . 1 . . . . 99 ALA HB1 . 26800 1 1265 . 1 1 99 99 ALA C C 13 178.7410 0.3 . 1 . . . . 99 ALA C . 26800 1 1266 . 1 1 99 99 ALA CA C 13 55.2800 0.3 . 1 . . . . 99 ALA CA . 26800 1 1267 . 1 1 99 99 ALA CB C 13 18.2790 0.3 . 1 . . . . 99 ALA CB . 26800 1 1268 . 1 1 99 99 ALA N N 15 120.3230 0.2 . 1 . . . . 99 ALA N . 26800 1 1269 . 1 1 100 100 ILE H H 1 8.1150 0.02 . 1 . . . . 100 ILE H . 26800 1 1270 . 1 1 100 100 ILE HA H 1 3.7790 0.02 . 1 . . . . 100 ILE HA . 26800 1 1271 . 1 1 100 100 ILE HB H 1 1.8090 0.02 . 1 . . . . 100 ILE HB . 26800 1 1272 . 1 1 100 100 ILE HG12 H 1 1.1500 0.02 . 2 . . . . 100 ILE HG12 . 26800 1 1273 . 1 1 100 100 ILE HG13 H 1 1.6400 0.02 . 2 . . . . 100 ILE HG13 . 26800 1 1274 . 1 1 100 100 ILE HG21 H 1 0.9170 0.02 . 1 . . . . 100 ILE HG21 . 26800 1 1275 . 1 1 100 100 ILE HG22 H 1 0.9170 0.02 . 1 . . . . 100 ILE HG21 . 26800 1 1276 . 1 1 100 100 ILE HG23 H 1 0.9170 0.02 . 1 . . . . 100 ILE HG21 . 26800 1 1277 . 1 1 100 100 ILE HD11 H 1 0.8370 0.02 . 1 . . . . 100 ILE HD11 . 26800 1 1278 . 1 1 100 100 ILE HD12 H 1 0.8370 0.02 . 1 . . . . 100 ILE HD11 . 26800 1 1279 . 1 1 100 100 ILE HD13 H 1 0.8370 0.02 . 1 . . . . 100 ILE HD11 . 26800 1 1280 . 1 1 100 100 ILE C C 13 180.6070 0.3 . 1 . . . . 100 ILE C . 26800 1 1281 . 1 1 100 100 ILE CA C 13 64.7010 0.3 . 1 . . . . 100 ILE CA . 26800 1 1282 . 1 1 100 100 ILE CB C 13 38.5300 0.3 . 1 . . . . 100 ILE CB . 26800 1 1283 . 1 1 100 100 ILE CG1 C 13 29.7830 0.3 . 1 . . . . 100 ILE CG1 . 26800 1 1284 . 1 1 100 100 ILE CG2 C 13 16.8350 0.3 . 1 . . . . 100 ILE CG2 . 26800 1 1285 . 1 1 100 100 ILE CD1 C 13 13.6850 0.3 . 1 . . . . 100 ILE CD1 . 26800 1 1286 . 1 1 100 100 ILE N N 15 117.9950 0.2 . 1 . . . . 100 ILE N . 26800 1 1287 . 1 1 101 101 ALA H H 1 8.0540 0.02 . 1 . . . . 101 ALA H . 26800 1 1288 . 1 1 101 101 ALA HA H 1 4.1240 0.02 . 1 . . . . 101 ALA HA . 26800 1 1289 . 1 1 101 101 ALA HB1 H 1 1.5100 0.02 . 1 . . . . 101 ALA HB1 . 26800 1 1290 . 1 1 101 101 ALA HB2 H 1 1.5100 0.02 . 1 . . . . 101 ALA HB1 . 26800 1 1291 . 1 1 101 101 ALA HB3 H 1 1.5100 0.02 . 1 . . . . 101 ALA HB1 . 26800 1 1292 . 1 1 101 101 ALA C C 13 178.7680 0.3 . 1 . . . . 101 ALA C . 26800 1 1293 . 1 1 101 101 ALA CA C 13 55.1840 0.3 . 1 . . . . 101 ALA CA . 26800 1 1294 . 1 1 101 101 ALA CB C 13 18.0440 0.3 . 1 . . . . 101 ALA CB . 26800 1 1295 . 1 1 101 101 ALA N N 15 124.1880 0.2 . 1 . . . . 101 ALA N . 26800 1 1296 . 1 1 102 102 ALA H H 1 7.8400 0.02 . 1 . . . . 102 ALA H . 26800 1 1297 . 1 1 102 102 ALA HA H 1 4.4180 0.02 . 1 . . . . 102 ALA HA . 26800 1 1298 . 1 1 102 102 ALA HB1 H 1 1.4070 0.02 . 1 . . . . 102 ALA HB1 . 26800 1 1299 . 1 1 102 102 ALA HB2 H 1 1.4070 0.02 . 1 . . . . 102 ALA HB1 . 26800 1 1300 . 1 1 102 102 ALA HB3 H 1 1.4070 0.02 . 1 . . . . 102 ALA HB1 . 26800 1 1301 . 1 1 102 102 ALA C C 13 175.7020 0.3 . 1 . . . . 102 ALA C . 26800 1 1302 . 1 1 102 102 ALA CA C 13 51.3510 0.3 . 1 . . . . 102 ALA CA . 26800 1 1303 . 1 1 102 102 ALA CB C 13 18.6980 0.3 . 1 . . . . 102 ALA CB . 26800 1 1304 . 1 1 102 102 ALA N N 15 116.8770 0.2 . 1 . . . . 102 ALA N . 26800 1 1305 . 1 1 103 103 LYS H H 1 7.8490 0.02 . 1 . . . . 103 LYS H . 26800 1 1306 . 1 1 103 103 LYS HA H 1 3.8590 0.02 . 1 . . . . 103 LYS HA . 26800 1 1307 . 1 1 103 103 LYS HB2 H 1 1.7770 0.02 . 2 . . . . 103 LYS HB2 . 26800 1 1308 . 1 1 103 103 LYS HB3 H 1 1.9520 0.02 . 2 . . . . 103 LYS HB3 . 26800 1 1309 . 1 1 103 103 LYS HG2 H 1 1.3600 0.02 . 2 . . . . 103 LYS HG2 . 26800 1 1310 . 1 1 103 103 LYS HG3 H 1 1.3600 0.02 . 2 . . . . 103 LYS HG3 . 26800 1 1311 . 1 1 103 103 LYS HD2 H 1 1.7000 0.02 . 2 . . . . 103 LYS HD2 . 26800 1 1312 . 1 1 103 103 LYS HD3 H 1 1.7000 0.02 . 2 . . . . 103 LYS HD3 . 26800 1 1313 . 1 1 103 103 LYS HE2 H 1 3.0100 0.02 . 2 . . . . 103 LYS HE2 . 26800 1 1314 . 1 1 103 103 LYS HE3 H 1 3.0100 0.02 . 2 . . . . 103 LYS HE3 . 26800 1 1315 . 1 1 103 103 LYS C C 13 176.8820 0.3 . 1 . . . . 103 LYS C . 26800 1 1316 . 1 1 103 103 LYS CA C 13 56.6710 0.3 . 1 . . . . 103 LYS CA . 26800 1 1317 . 1 1 103 103 LYS CB C 13 28.5490 0.3 . 1 . . . . 103 LYS CB . 26800 1 1318 . 1 1 103 103 LYS CG C 13 24.8100 0.3 . 1 . . . . 103 LYS CG . 26800 1 1319 . 1 1 103 103 LYS CD C 13 29.2000 0.3 . 1 . . . . 103 LYS CD . 26800 1 1320 . 1 1 103 103 LYS CE C 13 42.4000 0.3 . 1 . . . . 103 LYS CE . 26800 1 1321 . 1 1 103 103 LYS N N 15 115.2830 0.2 . 1 . . . . 103 LYS N . 26800 1 1322 . 1 1 104 104 ALA H H 1 8.3420 0.02 . 1 . . . . 104 ALA H . 26800 1 1323 . 1 1 104 104 ALA HA H 1 3.9270 0.02 . 1 . . . . 104 ALA HA . 26800 1 1324 . 1 1 104 104 ALA HB1 H 1 1.1140 0.02 . 1 . . . . 104 ALA HB1 . 26800 1 1325 . 1 1 104 104 ALA HB2 H 1 1.1140 0.02 . 1 . . . . 104 ALA HB1 . 26800 1 1326 . 1 1 104 104 ALA HB3 H 1 1.1140 0.02 . 1 . . . . 104 ALA HB1 . 26800 1 1327 . 1 1 104 104 ALA C C 13 176.9560 0.3 . 1 . . . . 104 ALA C . 26800 1 1328 . 1 1 104 104 ALA CA C 13 52.9860 0.3 . 1 . . . . 104 ALA CA . 26800 1 1329 . 1 1 104 104 ALA CB C 13 18.1660 0.3 . 1 . . . . 104 ALA CB . 26800 1 1330 . 1 1 104 104 ALA N N 15 119.0990 0.2 . 1 . . . . 104 ALA N . 26800 1 1331 . 1 1 105 105 ASP H H 1 9.3480 0.02 . 1 . . . . 105 ASP H . 26800 1 1332 . 1 1 105 105 ASP HA H 1 4.7830 0.02 . 1 . . . . 105 ASP HA . 26800 1 1333 . 1 1 105 105 ASP HB2 H 1 2.6610 0.02 . 2 . . . . 105 ASP HB2 . 26800 1 1334 . 1 1 105 105 ASP HB3 H 1 2.9080 0.02 . 2 . . . . 105 ASP HB3 . 26800 1 1335 . 1 1 105 105 ASP C C 13 177.1370 0.3 . 1 . . . . 105 ASP C . 26800 1 1336 . 1 1 105 105 ASP CA C 13 56.8480 0.3 . 1 . . . . 105 ASP CA . 26800 1 1337 . 1 1 105 105 ASP CB C 13 44.1200 0.3 . 1 . . . . 105 ASP CB . 26800 1 1338 . 1 1 105 105 ASP N N 15 120.7160 0.2 . 1 . . . . 105 ASP N . 26800 1 1339 . 1 1 106 106 VAL H H 1 7.7410 0.02 . 1 . . . . 106 VAL H . 26800 1 1340 . 1 1 106 106 VAL HA H 1 5.1130 0.02 . 1 . . . . 106 VAL HA . 26800 1 1341 . 1 1 106 106 VAL HB H 1 1.7490 0.02 . 1 . . . . 106 VAL HB . 26800 1 1342 . 1 1 106 106 VAL HG11 H 1 0.8250 0.02 . 2 . . . . 106 VAL HG11 . 26800 1 1343 . 1 1 106 106 VAL HG12 H 1 0.8250 0.02 . 2 . . . . 106 VAL HG11 . 26800 1 1344 . 1 1 106 106 VAL HG13 H 1 0.8250 0.02 . 2 . . . . 106 VAL HG11 . 26800 1 1345 . 1 1 106 106 VAL HG21 H 1 0.9520 0.02 . 2 . . . . 106 VAL HG21 . 26800 1 1346 . 1 1 106 106 VAL HG22 H 1 0.9520 0.02 . 2 . . . . 106 VAL HG21 . 26800 1 1347 . 1 1 106 106 VAL HG23 H 1 0.9520 0.02 . 2 . . . . 106 VAL HG21 . 26800 1 1348 . 1 1 106 106 VAL C C 13 172.1460 0.3 . 1 . . . . 106 VAL C . 26800 1 1349 . 1 1 106 106 VAL CA C 13 59.7920 0.3 . 1 . . . . 106 VAL CA . 26800 1 1350 . 1 1 106 106 VAL CB C 13 37.2800 0.3 . 1 . . . . 106 VAL CB . 26800 1 1351 . 1 1 106 106 VAL CG1 C 13 23.0500 0.3 . 2 . . . . 106 VAL CG1 . 26800 1 1352 . 1 1 106 106 VAL CG2 C 13 23.0500 0.3 . 2 . . . . 106 VAL CG2 . 26800 1 1353 . 1 1 106 106 VAL N N 15 117.2700 0.2 . 1 . . . . 106 VAL N . 26800 1 1354 . 1 1 107 107 LEU H H 1 9.1130 0.02 . 1 . . . . 107 LEU H . 26800 1 1355 . 1 1 107 107 LEU HA H 1 5.1700 0.02 . 1 . . . . 107 LEU HA . 26800 1 1356 . 1 1 107 107 LEU HB2 H 1 1.6760 0.02 . 2 . . . . 107 LEU HB2 . 26800 1 1357 . 1 1 107 107 LEU HB3 H 1 0.7790 0.02 . 2 . . . . 107 LEU HB3 . 26800 1 1358 . 1 1 107 107 LEU HG H 1 1.3670 0.02 . 1 . . . . 107 LEU HG . 26800 1 1359 . 1 1 107 107 LEU HD11 H 1 0.6330 0.02 . 2 . . . . 107 LEU HD11 . 26800 1 1360 . 1 1 107 107 LEU HD12 H 1 0.6330 0.02 . 2 . . . . 107 LEU HD11 . 26800 1 1361 . 1 1 107 107 LEU HD13 H 1 0.6330 0.02 . 2 . . . . 107 LEU HD11 . 26800 1 1362 . 1 1 107 107 LEU HD21 H 1 0.4690 0.02 . 2 . . . . 107 LEU HD21 . 26800 1 1363 . 1 1 107 107 LEU HD22 H 1 0.4690 0.02 . 2 . . . . 107 LEU HD21 . 26800 1 1364 . 1 1 107 107 LEU HD23 H 1 0.4690 0.02 . 2 . . . . 107 LEU HD21 . 26800 1 1365 . 1 1 107 107 LEU C C 13 173.5390 0.3 . 1 . . . . 107 LEU C . 26800 1 1366 . 1 1 107 107 LEU CA C 13 53.5000 0.3 . 1 . . . . 107 LEU CA . 26800 1 1367 . 1 1 107 107 LEU CB C 13 45.4190 0.3 . 1 . . . . 107 LEU CB . 26800 1 1368 . 1 1 107 107 LEU CG C 13 28.2000 0.3 . 1 . . . . 107 LEU CG . 26800 1 1369 . 1 1 107 107 LEU CD1 C 13 25.4200 0.3 . 2 . . . . 107 LEU CD1 . 26800 1 1370 . 1 1 107 107 LEU CD2 C 13 25.7900 0.3 . 2 . . . . 107 LEU CD2 . 26800 1 1371 . 1 1 107 107 LEU N N 15 130.3220 0.2 . 1 . . . . 107 LEU N . 26800 1 1372 . 1 1 108 108 VAL H H 1 8.5870 0.02 . 1 . . . . 108 VAL H . 26800 1 1373 . 1 1 108 108 VAL HA H 1 4.8970 0.02 . 1 . . . . 108 VAL HA . 26800 1 1374 . 1 1 108 108 VAL HB H 1 1.6350 0.02 . 1 . . . . 108 VAL HB . 26800 1 1375 . 1 1 108 108 VAL HG11 H 1 0.6440 0.02 . 2 . . . . 108 VAL HG11 . 26800 1 1376 . 1 1 108 108 VAL HG12 H 1 0.6440 0.02 . 2 . . . . 108 VAL HG11 . 26800 1 1377 . 1 1 108 108 VAL HG13 H 1 0.6440 0.02 . 2 . . . . 108 VAL HG11 . 26800 1 1378 . 1 1 108 108 VAL HG21 H 1 0.0200 0.02 . 2 . . . . 108 VAL HG21 . 26800 1 1379 . 1 1 108 108 VAL HG22 H 1 0.0200 0.02 . 2 . . . . 108 VAL HG21 . 26800 1 1380 . 1 1 108 108 VAL HG23 H 1 0.0200 0.02 . 2 . . . . 108 VAL HG21 . 26800 1 1381 . 1 1 108 108 VAL C C 13 174.3710 0.3 . 1 . . . . 108 VAL C . 26800 1 1382 . 1 1 108 108 VAL CA C 13 60.1380 0.3 . 1 . . . . 108 VAL CA . 26800 1 1383 . 1 1 108 108 VAL CB C 13 32.0500 0.3 . 1 . . . . 108 VAL CB . 26800 1 1384 . 1 1 108 108 VAL CG1 C 13 20.9990 0.3 . 2 . . . . 108 VAL CG1 . 26800 1 1385 . 1 1 108 108 VAL CG2 C 13 20.9990 0.3 . 2 . . . . 108 VAL CG2 . 26800 1 1386 . 1 1 108 108 VAL N N 15 127.2170 0.2 . 1 . . . . 108 VAL N . 26800 1 1387 . 1 1 109 109 THR H H 1 9.1290 0.02 . 1 . . . . 109 THR H . 26800 1 1388 . 1 1 109 109 THR HA H 1 4.8650 0.02 . 1 . . . . 109 THR HA . 26800 1 1389 . 1 1 109 109 THR HB H 1 4.0540 0.02 . 1 . . . . 109 THR HB . 26800 1 1390 . 1 1 109 109 THR HG21 H 1 1.0810 0.02 . 1 . . . . 109 THR HG21 . 26800 1 1391 . 1 1 109 109 THR HG22 H 1 1.0810 0.02 . 1 . . . . 109 THR HG21 . 26800 1 1392 . 1 1 109 109 THR HG23 H 1 1.0810 0.02 . 1 . . . . 109 THR HG21 . 26800 1 1393 . 1 1 109 109 THR C C 13 171.0490 0.3 . 1 . . . . 109 THR C . 26800 1 1394 . 1 1 109 109 THR CA C 13 60.6680 0.3 . 1 . . . . 109 THR CA . 26800 1 1395 . 1 1 109 109 THR CB C 13 68.7160 0.3 . 1 . . . . 109 THR CB . 26800 1 1396 . 1 1 109 109 THR CG2 C 13 20.3000 0.3 . 1 . . . . 109 THR CG2 . 26800 1 1397 . 1 1 109 109 THR N N 15 120.7910 0.2 . 1 . . . . 109 THR N . 26800 1 1398 . 1 1 110 110 GLY H H 1 7.8540 0.02 . 1 . . . . 110 GLY H . 26800 1 1399 . 1 1 110 110 GLY HA2 H 1 3.5170 0.02 . 2 . . . . 110 GLY HA2 . 26800 1 1400 . 1 1 110 110 GLY HA3 H 1 4.6570 0.02 . 2 . . . . 110 GLY HA3 . 26800 1 1401 . 1 1 110 110 GLY C C 13 174.5590 0.3 . 1 . . . . 110 GLY C . 26800 1 1402 . 1 1 110 110 GLY CA C 13 44.9000 0.3 . 1 . . . . 110 GLY CA . 26800 1 1403 . 1 1 110 110 GLY N N 15 111.5200 0.2 . 1 . . . . 110 GLY N . 26800 1 1404 . 1 1 111 111 ASP H H 1 9.0440 0.02 . 1 . . . . 111 ASP H . 26800 1 1405 . 1 1 111 111 ASP HA H 1 4.4060 0.02 . 1 . . . . 111 ASP HA . 26800 1 1406 . 1 1 111 111 ASP HB2 H 1 2.9320 0.02 . 2 . . . . 111 ASP HB2 . 26800 1 1407 . 1 1 111 111 ASP HB3 H 1 2.2760 0.02 . 2 . . . . 111 ASP HB3 . 26800 1 1408 . 1 1 111 111 ASP C C 13 177.0080 0.3 . 1 . . . . 111 ASP C . 26800 1 1409 . 1 1 111 111 ASP CA C 13 54.6220 0.3 . 1 . . . . 111 ASP CA . 26800 1 1410 . 1 1 111 111 ASP CB C 13 41.6890 0.3 . 1 . . . . 111 ASP CB . 26800 1 1411 . 1 1 111 111 ASP N N 15 124.8700 0.2 . 1 . . . . 111 ASP N . 26800 1 1412 . 1 1 112 112 ARG H H 1 8.9080 0.02 . 1 . . . . 112 ARG H . 26800 1 1413 . 1 1 112 112 ARG HA H 1 3.9160 0.02 . 1 . . . . 112 ARG HA . 26800 1 1414 . 1 1 112 112 ARG HB2 H 1 1.8630 0.02 . 2 . . . . 112 ARG HB2 . 26800 1 1415 . 1 1 112 112 ARG HB3 H 1 1.8950 0.02 . 2 . . . . 112 ARG HB3 . 26800 1 1416 . 1 1 112 112 ARG HG2 H 1 1.7450 0.02 . 2 . . . . 112 ARG HG2 . 26800 1 1417 . 1 1 112 112 ARG HG3 H 1 1.6470 0.02 . 2 . . . . 112 ARG HG3 . 26800 1 1418 . 1 1 112 112 ARG HD2 H 1 3.1910 0.02 . 2 . . . . 112 ARG HD2 . 26800 1 1419 . 1 1 112 112 ARG HD3 H 1 3.1910 0.02 . 2 . . . . 112 ARG HD3 . 26800 1 1420 . 1 1 112 112 ARG HE H 1 7.3600 0.02 . 1 . . . . 112 ARG HE . 26800 1 1421 . 1 1 112 112 ARG C C 13 177.2670 0.3 . 1 . . . . 112 ARG C . 26800 1 1422 . 1 1 112 112 ARG CA C 13 59.3230 0.3 . 1 . . . . 112 ARG CA . 26800 1 1423 . 1 1 112 112 ARG CB C 13 29.8820 0.3 . 1 . . . . 112 ARG CB . 26800 1 1424 . 1 1 112 112 ARG CG C 13 26.8200 0.3 . 1 . . . . 112 ARG CG . 26800 1 1425 . 1 1 112 112 ARG CD C 13 43.0900 0.3 . 1 . . . . 112 ARG CD . 26800 1 1426 . 1 1 112 112 ARG N N 15 129.5110 0.2 . 1 . . . . 112 ARG N . 26800 1 1427 . 1 1 112 112 ARG NE N 15 84.2300 0.2 . 1 . . . . 112 ARG NE . 26800 1 1428 . 1 1 113 113 ASP H H 1 8.3730 0.02 . 1 . . . . 113 ASP H . 26800 1 1429 . 1 1 113 113 ASP HA H 1 4.3040 0.02 . 1 . . . . 113 ASP HA . 26800 1 1430 . 1 1 113 113 ASP HB2 H 1 2.4580 0.02 . 2 . . . . 113 ASP HB2 . 26800 1 1431 . 1 1 113 113 ASP HB3 H 1 2.5050 0.02 . 2 . . . . 113 ASP HB3 . 26800 1 1432 . 1 1 113 113 ASP C C 13 179.3440 0.3 . 1 . . . . 113 ASP C . 26800 1 1433 . 1 1 113 113 ASP CA C 13 57.2940 0.3 . 1 . . . . 113 ASP CA . 26800 1 1434 . 1 1 113 113 ASP CB C 13 39.4700 0.3 . 1 . . . . 113 ASP CB . 26800 1 1435 . 1 1 113 113 ASP N N 15 117.8620 0.2 . 1 . . . . 113 ASP N . 26800 1 1436 . 1 1 114 114 PHE H H 1 7.5040 0.02 . 1 . . . . 114 PHE H . 26800 1 1437 . 1 1 114 114 PHE HA H 1 4.7030 0.02 . 1 . . . . 114 PHE HA . 26800 1 1438 . 1 1 114 114 PHE HB2 H 1 3.2290 0.02 . 2 . . . . 114 PHE HB2 . 26800 1 1439 . 1 1 114 114 PHE HB3 H 1 3.2290 0.02 . 2 . . . . 114 PHE HB3 . 26800 1 1440 . 1 1 114 114 PHE HD1 H 1 7.1900 0.02 . 3 . . . . 114 PHE HD1 . 26800 1 1441 . 1 1 114 114 PHE HD2 H 1 7.1900 0.02 . 3 . . . . 114 PHE HD2 . 26800 1 1442 . 1 1 114 114 PHE HE1 H 1 7.4500 0.02 . 3 . . . . 114 PHE HE1 . 26800 1 1443 . 1 1 114 114 PHE HE2 H 1 7.4500 0.02 . 3 . . . . 114 PHE HE2 . 26800 1 1444 . 1 1 114 114 PHE C C 13 179.2760 0.3 . 1 . . . . 114 PHE C . 26800 1 1445 . 1 1 114 114 PHE CA C 13 57.5000 0.3 . 1 . . . . 114 PHE CA . 26800 1 1446 . 1 1 114 114 PHE CB C 13 37.9000 0.3 . 1 . . . . 114 PHE CB . 26800 1 1447 . 1 1 114 114 PHE CD1 C 13 130.0000 0.3 . 3 . . . . 114 PHE CD1 . 26800 1 1448 . 1 1 114 114 PHE CD2 C 13 130.0000 0.3 . 3 . . . . 114 PHE CD2 . 26800 1 1449 . 1 1 114 114 PHE CE1 C 13 132.1000 0.3 . 3 . . . . 114 PHE CE1 . 26800 1 1450 . 1 1 114 114 PHE CE2 C 13 132.1000 0.3 . 3 . . . . 114 PHE CE2 . 26800 1 1451 . 1 1 114 114 PHE N N 15 116.3410 0.2 . 1 . . . . 114 PHE N . 26800 1 1452 . 1 1 115 115 LEU H H 1 8.3780 0.02 . 1 . . . . 115 LEU H . 26800 1 1453 . 1 1 115 115 LEU HA H 1 3.9040 0.02 . 1 . . . . 115 LEU HA . 26800 1 1454 . 1 1 115 115 LEU HB2 H 1 1.6230 0.02 . 2 . . . . 115 LEU HB2 . 26800 1 1455 . 1 1 115 115 LEU HB3 H 1 1.7490 0.02 . 2 . . . . 115 LEU HB3 . 26800 1 1456 . 1 1 115 115 LEU HG H 1 1.4880 0.02 . 1 . . . . 115 LEU HG . 26800 1 1457 . 1 1 115 115 LEU HD11 H 1 0.7640 0.02 . 2 . . . . 115 LEU HD11 . 26800 1 1458 . 1 1 115 115 LEU HD12 H 1 0.7640 0.02 . 2 . . . . 115 LEU HD11 . 26800 1 1459 . 1 1 115 115 LEU HD13 H 1 0.7640 0.02 . 2 . . . . 115 LEU HD11 . 26800 1 1460 . 1 1 115 115 LEU HD21 H 1 0.8690 0.02 . 2 . . . . 115 LEU HD21 . 26800 1 1461 . 1 1 115 115 LEU HD22 H 1 0.8690 0.02 . 2 . . . . 115 LEU HD21 . 26800 1 1462 . 1 1 115 115 LEU HD23 H 1 0.8690 0.02 . 2 . . . . 115 LEU HD21 . 26800 1 1463 . 1 1 115 115 LEU C C 13 178.6080 0.3 . 1 . . . . 115 LEU C . 26800 1 1464 . 1 1 115 115 LEU CA C 13 58.6590 0.3 . 1 . . . . 115 LEU CA . 26800 1 1465 . 1 1 115 115 LEU CB C 13 42.2000 0.3 . 1 . . . . 115 LEU CB . 26800 1 1466 . 1 1 115 115 LEU CG C 13 26.9340 0.3 . 1 . . . . 115 LEU CG . 26800 1 1467 . 1 1 115 115 LEU CD1 C 13 25.2700 0.3 . 2 . . . . 115 LEU CD1 . 26800 1 1468 . 1 1 115 115 LEU CD2 C 13 22.6500 0.3 . 2 . . . . 115 LEU CD2 . 26800 1 1469 . 1 1 115 115 LEU N N 15 121.7510 0.2 . 1 . . . . 115 LEU N . 26800 1 1470 . 1 1 116 116 GLU H H 1 7.9870 0.02 . 1 . . . . 116 GLU H . 26800 1 1471 . 1 1 116 116 GLU HA H 1 4.5320 0.02 . 1 . . . . 116 GLU HA . 26800 1 1472 . 1 1 116 116 GLU HB2 H 1 1.9650 0.02 . 2 . . . . 116 GLU HB2 . 26800 1 1473 . 1 1 116 116 GLU HB3 H 1 2.3530 0.02 . 2 . . . . 116 GLU HB3 . 26800 1 1474 . 1 1 116 116 GLU HG2 H 1 2.2990 0.02 . 2 . . . . 116 GLU HG2 . 26800 1 1475 . 1 1 116 116 GLU HG3 H 1 2.4030 0.02 . 2 . . . . 116 GLU HG3 . 26800 1 1476 . 1 1 116 116 GLU C C 13 176.8900 0.3 . 1 . . . . 116 GLU C . 26800 1 1477 . 1 1 116 116 GLU CA C 13 55.7610 0.3 . 1 . . . . 116 GLU CA . 26800 1 1478 . 1 1 116 116 GLU CB C 13 28.7290 0.3 . 1 . . . . 116 GLU CB . 26800 1 1479 . 1 1 116 116 GLU CG C 13 36.4490 0.3 . 1 . . . . 116 GLU CG . 26800 1 1480 . 1 1 116 116 GLU N N 15 115.1690 0.2 . 1 . . . . 116 GLU N . 26800 1 1481 . 1 1 117 117 SER H H 1 7.4400 0.02 . 1 . . . . 117 SER H . 26800 1 1482 . 1 1 117 117 SER HA H 1 4.2010 0.02 . 1 . . . . 117 SER HA . 26800 1 1483 . 1 1 117 117 SER HB2 H 1 3.9840 0.02 . 2 . . . . 117 SER HB2 . 26800 1 1484 . 1 1 117 117 SER HB3 H 1 4.4560 0.02 . 2 . . . . 117 SER HB3 . 26800 1 1485 . 1 1 117 117 SER C C 13 175.7510 0.3 . 1 . . . . 117 SER C . 26800 1 1486 . 1 1 117 117 SER CA C 13 61.0180 0.3 . 1 . . . . 117 SER CA . 26800 1 1487 . 1 1 117 117 SER CB C 13 64.5550 0.3 . 1 . . . . 117 SER CB . 26800 1 1488 . 1 1 117 117 SER N N 15 114.7120 0.2 . 1 . . . . 117 SER N . 26800 1 1489 . 1 1 118 118 GLY H H 1 8.5320 0.02 . 1 . . . . 118 GLY H . 26800 1 1490 . 1 1 118 118 GLY HA2 H 1 4.1700 0.02 . 2 . . . . 118 GLY HA2 . 26800 1 1491 . 1 1 118 118 GLY HA3 H 1 3.7460 0.02 . 2 . . . . 118 GLY HA3 . 26800 1 1492 . 1 1 118 118 GLY C C 13 174.1650 0.3 . 1 . . . . 118 GLY C . 26800 1 1493 . 1 1 118 118 GLY CA C 13 45.5160 0.3 . 1 . . . . 118 GLY CA . 26800 1 1494 . 1 1 118 118 GLY N N 15 110.9460 0.2 . 1 . . . . 118 GLY N . 26800 1 1495 . 1 1 119 119 ILE H H 1 7.6590 0.02 . 1 . . . . 119 ILE H . 26800 1 1496 . 1 1 119 119 ILE HA H 1 3.9960 0.02 . 1 . . . . 119 ILE HA . 26800 1 1497 . 1 1 119 119 ILE HB H 1 1.8630 0.02 . 1 . . . . 119 ILE HB . 26800 1 1498 . 1 1 119 119 ILE HG12 H 1 1.2220 0.02 . 2 . . . . 119 ILE HG12 . 26800 1 1499 . 1 1 119 119 ILE HG13 H 1 1.4580 0.02 . 2 . . . . 119 ILE HG13 . 26800 1 1500 . 1 1 119 119 ILE HG21 H 1 0.9430 0.02 . 1 . . . . 119 ILE HG21 . 26800 1 1501 . 1 1 119 119 ILE HG22 H 1 0.9430 0.02 . 1 . . . . 119 ILE HG21 . 26800 1 1502 . 1 1 119 119 ILE HG23 H 1 0.9430 0.02 . 1 . . . . 119 ILE HG21 . 26800 1 1503 . 1 1 119 119 ILE HD11 H 1 0.8670 0.02 . 1 . . . . 119 ILE HD11 . 26800 1 1504 . 1 1 119 119 ILE HD12 H 1 0.8670 0.02 . 1 . . . . 119 ILE HD11 . 26800 1 1505 . 1 1 119 119 ILE HD13 H 1 0.8670 0.02 . 1 . . . . 119 ILE HD11 . 26800 1 1506 . 1 1 119 119 ILE C C 13 176.8420 0.3 . 1 . . . . 119 ILE C . 26800 1 1507 . 1 1 119 119 ILE CA C 13 61.8410 0.3 . 1 . . . . 119 ILE CA . 26800 1 1508 . 1 1 119 119 ILE CB C 13 37.7350 0.3 . 1 . . . . 119 ILE CB . 26800 1 1509 . 1 1 119 119 ILE CG1 C 13 28.5910 0.3 . 1 . . . . 119 ILE CG1 . 26800 1 1510 . 1 1 119 119 ILE CG2 C 13 17.7440 0.3 . 1 . . . . 119 ILE CG2 . 26800 1 1511 . 1 1 119 119 ILE CD1 C 13 12.6520 0.3 . 1 . . . . 119 ILE CD1 . 26800 1 1512 . 1 1 119 119 ILE N N 15 122.7330 0.2 . 1 . . . . 119 ILE N . 26800 1 1513 . 1 1 120 120 THR H H 1 8.5750 0.02 . 1 . . . . 120 THR H . 26800 1 1514 . 1 1 120 120 THR HA H 1 4.4600 0.02 . 1 . . . . 120 THR HA . 26800 1 1515 . 1 1 120 120 THR HB H 1 4.3880 0.02 . 1 . . . . 120 THR HB . 26800 1 1516 . 1 1 120 120 THR HG21 H 1 1.1820 0.02 . 1 . . . . 120 THR HG21 . 26800 1 1517 . 1 1 120 120 THR HG22 H 1 1.1820 0.02 . 1 . . . . 120 THR HG21 . 26800 1 1518 . 1 1 120 120 THR HG23 H 1 1.1820 0.02 . 1 . . . . 120 THR HG21 . 26800 1 1519 . 1 1 120 120 THR C C 13 173.7930 0.3 . 1 . . . . 120 THR C . 26800 1 1520 . 1 1 120 120 THR CA C 13 61.9210 0.3 . 1 . . . . 120 THR CA . 26800 1 1521 . 1 1 120 120 THR CB C 13 69.9000 0.3 . 1 . . . . 120 THR CB . 26800 1 1522 . 1 1 120 120 THR CG2 C 13 21.5070 0.3 . 1 . . . . 120 THR CG2 . 26800 1 1523 . 1 1 120 120 THR N N 15 115.4600 0.2 . 1 . . . . 120 THR N . 26800 1 1524 . 1 1 121 121 ASN H H 1 6.8740 0.02 . 1 . . . . 121 ASN H . 26800 1 1525 . 1 1 121 121 ASN HA H 1 4.6690 0.02 . 1 . . . . 121 ASN HA . 26800 1 1526 . 1 1 121 121 ASN HB2 H 1 2.6620 0.02 . 2 . . . . 121 ASN HB2 . 26800 1 1527 . 1 1 121 121 ASN HB3 H 1 2.7810 0.02 . 2 . . . . 121 ASN HB3 . 26800 1 1528 . 1 1 121 121 ASN HD21 H 1 7.5400 0.02 . 2 . . . . 121 ASN HD21 . 26800 1 1529 . 1 1 121 121 ASN HD22 H 1 6.8190 0.02 . 2 . . . . 121 ASN HD22 . 26800 1 1530 . 1 1 121 121 ASN C C 13 172.1840 0.3 . 1 . . . . 121 ASN C . 26800 1 1531 . 1 1 121 121 ASN CA C 13 51.2100 0.3 . 1 . . . . 121 ASN CA . 26800 1 1532 . 1 1 121 121 ASN CB C 13 40.6840 0.3 . 1 . . . . 121 ASN CB . 26800 1 1533 . 1 1 121 121 ASN N N 15 120.5030 0.2 . 1 . . . . 121 ASN N . 26800 1 1534 . 1 1 121 121 ASN ND2 N 15 111.5900 0.2 . 1 . . . . 121 ASN ND2 . 26800 1 1535 . 1 1 122 122 PRO HA H 1 4.5320 0.02 . 1 . . . . 122 PRO HA . 26800 1 1536 . 1 1 122 122 PRO HB2 H 1 1.4590 0.02 . 2 . . . . 122 PRO HB2 . 26800 1 1537 . 1 1 122 122 PRO HB3 H 1 1.9770 0.02 . 2 . . . . 122 PRO HB3 . 26800 1 1538 . 1 1 122 122 PRO HG2 H 1 1.3330 0.02 . 2 . . . . 122 PRO HG2 . 26800 1 1539 . 1 1 122 122 PRO HG3 H 1 1.3120 0.02 . 2 . . . . 122 PRO HG3 . 26800 1 1540 . 1 1 122 122 PRO HD2 H 1 3.3630 0.02 . 2 . . . . 122 PRO HD2 . 26800 1 1541 . 1 1 122 122 PRO HD3 H 1 3.2230 0.02 . 2 . . . . 122 PRO HD3 . 26800 1 1542 . 1 1 122 122 PRO C C 13 173.3840 0.3 . 1 . . . . 122 PRO C . 26800 1 1543 . 1 1 122 122 PRO CA C 13 62.3570 0.3 . 1 . . . . 122 PRO CA . 26800 1 1544 . 1 1 122 122 PRO CB C 13 33.3530 0.3 . 1 . . . . 122 PRO CB . 26800 1 1545 . 1 1 122 122 PRO CG C 13 24.6740 0.3 . 1 . . . . 122 PRO CG . 26800 1 1546 . 1 1 122 122 PRO CD C 13 49.9100 0.3 . 1 . . . . 122 PRO CD . 26800 1 1547 . 1 1 123 123 LYS H H 1 7.4270 0.02 . 1 . . . . 123 LYS H . 26800 1 1548 . 1 1 123 123 LYS HA H 1 4.1670 0.02 . 1 . . . . 123 LYS HA . 26800 1 1549 . 1 1 123 123 LYS HB2 H 1 1.8140 0.02 . 2 . . . . 123 LYS HB2 . 26800 1 1550 . 1 1 123 123 LYS HB3 H 1 1.8140 0.02 . 2 . . . . 123 LYS HB3 . 26800 1 1551 . 1 1 123 123 LYS HG2 H 1 1.4690 0.02 . 2 . . . . 123 LYS HG2 . 26800 1 1552 . 1 1 123 123 LYS HG3 H 1 1.5800 0.02 . 2 . . . . 123 LYS HG3 . 26800 1 1553 . 1 1 123 123 LYS HD2 H 1 1.7050 0.02 . 2 . . . . 123 LYS HD2 . 26800 1 1554 . 1 1 123 123 LYS HD3 H 1 1.7050 0.02 . 2 . . . . 123 LYS HD3 . 26800 1 1555 . 1 1 123 123 LYS HE2 H 1 3.0120 0.02 . 2 . . . . 123 LYS HE2 . 26800 1 1556 . 1 1 123 123 LYS HE3 H 1 3.0660 0.02 . 2 . . . . 123 LYS HE3 . 26800 1 1557 . 1 1 123 123 LYS C C 13 175.6730 0.3 . 1 . . . . 123 LYS C . 26800 1 1558 . 1 1 123 123 LYS CA C 13 56.7060 0.3 . 1 . . . . 123 LYS CA . 26800 1 1559 . 1 1 123 123 LYS CB C 13 32.9200 0.3 . 1 . . . . 123 LYS CB . 26800 1 1560 . 1 1 123 123 LYS CG C 13 25.0800 0.3 . 1 . . . . 123 LYS CG . 26800 1 1561 . 1 1 123 123 LYS CD C 13 29.2600 0.3 . 1 . . . . 123 LYS CD . 26800 1 1562 . 1 1 123 123 LYS CE C 13 42.2300 0.3 . 1 . . . . 123 LYS CE . 26800 1 1563 . 1 1 123 123 LYS N N 15 116.4580 0.2 . 1 . . . . 123 LYS N . 26800 1 1564 . 1 1 124 124 ILE H H 1 8.7790 0.02 . 1 . . . . 124 ILE H . 26800 1 1565 . 1 1 124 124 ILE HA H 1 4.8850 0.02 . 1 . . . . 124 ILE HA . 26800 1 1566 . 1 1 124 124 ILE HB H 1 1.8140 0.02 . 1 . . . . 124 ILE HB . 26800 1 1567 . 1 1 124 124 ILE HG12 H 1 1.7510 0.02 . 2 . . . . 124 ILE HG12 . 26800 1 1568 . 1 1 124 124 ILE HG13 H 1 0.6670 0.02 . 2 . . . . 124 ILE HG13 . 26800 1 1569 . 1 1 124 124 ILE HG21 H 1 0.7030 0.02 . 1 . . . . 124 ILE HG21 . 26800 1 1570 . 1 1 124 124 ILE HG22 H 1 0.7030 0.02 . 1 . . . . 124 ILE HG21 . 26800 1 1571 . 1 1 124 124 ILE HG23 H 1 0.7030 0.02 . 1 . . . . 124 ILE HG21 . 26800 1 1572 . 1 1 124 124 ILE HD11 H 1 0.6930 0.02 . 1 . . . . 124 ILE HD11 . 26800 1 1573 . 1 1 124 124 ILE HD12 H 1 0.6930 0.02 . 1 . . . . 124 ILE HD11 . 26800 1 1574 . 1 1 124 124 ILE HD13 H 1 0.6930 0.02 . 1 . . . . 124 ILE HD11 . 26800 1 1575 . 1 1 124 124 ILE C C 13 176.2510 0.3 . 1 . . . . 124 ILE C . 26800 1 1576 . 1 1 124 124 ILE CA C 13 61.1670 0.3 . 1 . . . . 124 ILE CA . 26800 1 1577 . 1 1 124 124 ILE CB C 13 37.7470 0.3 . 1 . . . . 124 ILE CB . 26800 1 1578 . 1 1 124 124 ILE CG1 C 13 27.2620 0.3 . 1 . . . . 124 ILE CG1 . 26800 1 1579 . 1 1 124 124 ILE CG2 C 13 18.8860 0.3 . 1 . . . . 124 ILE CG2 . 26800 1 1580 . 1 1 124 124 ILE CD1 C 13 14.8500 0.3 . 1 . . . . 124 ILE CD1 . 26800 1 1581 . 1 1 124 124 ILE N N 15 128.7990 0.2 . 1 . . . . 124 ILE N . 26800 1 1582 . 1 1 125 125 VAL H H 1 8.7560 0.02 . 1 . . . . 125 VAL H . 26800 1 1583 . 1 1 125 125 VAL HA H 1 4.9760 0.02 . 1 . . . . 125 VAL HA . 26800 1 1584 . 1 1 125 125 VAL HB H 1 2.5290 0.02 . 1 . . . . 125 VAL HB . 26800 1 1585 . 1 1 125 125 VAL HG11 H 1 0.8890 0.02 . 2 . . . . 125 VAL HG11 . 26800 1 1586 . 1 1 125 125 VAL HG12 H 1 0.8890 0.02 . 2 . . . . 125 VAL HG11 . 26800 1 1587 . 1 1 125 125 VAL HG13 H 1 0.8890 0.02 . 2 . . . . 125 VAL HG11 . 26800 1 1588 . 1 1 125 125 VAL HG21 H 1 0.8180 0.02 . 2 . . . . 125 VAL HG21 . 26800 1 1589 . 1 1 125 125 VAL HG22 H 1 0.8180 0.02 . 2 . . . . 125 VAL HG21 . 26800 1 1590 . 1 1 125 125 VAL HG23 H 1 0.8180 0.02 . 2 . . . . 125 VAL HG21 . 26800 1 1591 . 1 1 125 125 VAL C C 13 174.3860 0.3 . 1 . . . . 125 VAL C . 26800 1 1592 . 1 1 125 125 VAL CA C 13 58.4670 0.3 . 1 . . . . 125 VAL CA . 26800 1 1593 . 1 1 125 125 VAL CB C 13 36.5350 0.3 . 1 . . . . 125 VAL CB . 26800 1 1594 . 1 1 125 125 VAL CG1 C 13 22.5660 0.3 . 2 . . . . 125 VAL CG1 . 26800 1 1595 . 1 1 125 125 VAL CG2 C 13 19.8450 0.3 . 2 . . . . 125 VAL CG2 . 26800 1 1596 . 1 1 125 125 VAL N N 15 119.6490 0.2 . 1 . . . . 125 VAL N . 26800 1 1597 . 1 1 126 126 THR H H 1 8.2890 0.02 . 1 . . . . 126 THR H . 26800 1 1598 . 1 1 126 126 THR HA H 1 5.0900 0.02 . 1 . . . . 126 THR HA . 26800 1 1599 . 1 1 126 126 THR HB H 1 4.7940 0.02 . 1 . . . . 126 THR HB . 26800 1 1600 . 1 1 126 126 THR HG21 H 1 1.4850 0.02 . 1 . . . . 126 THR HG21 . 26800 1 1601 . 1 1 126 126 THR HG22 H 1 1.4850 0.02 . 1 . . . . 126 THR HG21 . 26800 1 1602 . 1 1 126 126 THR HG23 H 1 1.4850 0.02 . 1 . . . . 126 THR HG21 . 26800 1 1603 . 1 1 126 126 THR C C 13 176.5660 0.3 . 1 . . . . 126 THR C . 26800 1 1604 . 1 1 126 126 THR CA C 13 60.2380 0.3 . 1 . . . . 126 THR CA . 26800 1 1605 . 1 1 126 126 THR CB C 13 72.0390 0.3 . 1 . . . . 126 THR CB . 26800 1 1606 . 1 1 126 126 THR CG2 C 13 22.9170 0.3 . 1 . . . . 126 THR CG2 . 26800 1 1607 . 1 1 126 126 THR N N 15 109.6590 0.2 . 1 . . . . 126 THR N . 26800 1 1608 . 1 1 127 127 ALA H H 1 8.8120 0.02 . 1 . . . . 127 ALA H . 26800 1 1609 . 1 1 127 127 ALA HA H 1 3.7900 0.02 . 1 . . . . 127 ALA HA . 26800 1 1610 . 1 1 127 127 ALA HB1 H 1 1.3070 0.02 . 1 . . . . 127 ALA HB1 . 26800 1 1611 . 1 1 127 127 ALA HB2 H 1 1.3070 0.02 . 1 . . . . 127 ALA HB1 . 26800 1 1612 . 1 1 127 127 ALA HB3 H 1 1.3070 0.02 . 1 . . . . 127 ALA HB1 . 26800 1 1613 . 1 1 127 127 ALA C C 13 178.5400 0.3 . 1 . . . . 127 ALA C . 26800 1 1614 . 1 1 127 127 ALA CA C 13 56.1420 0.3 . 1 . . . . 127 ALA CA . 26800 1 1615 . 1 1 127 127 ALA CB C 13 18.2260 0.3 . 1 . . . . 127 ALA CB . 26800 1 1616 . 1 1 127 127 ALA N N 15 122.1100 0.2 . 1 . . . . 127 ALA N . 26800 1 1617 . 1 1 128 128 ALA H H 1 8.3790 0.02 . 1 . . . . 128 ALA H . 26800 1 1618 . 1 1 128 128 ALA HA H 1 3.9390 0.02 . 1 . . . . 128 ALA HA . 26800 1 1619 . 1 1 128 128 ALA HB1 H 1 1.4400 0.02 . 1 . . . . 128 ALA HB1 . 26800 1 1620 . 1 1 128 128 ALA HB2 H 1 1.4400 0.02 . 1 . . . . 128 ALA HB1 . 26800 1 1621 . 1 1 128 128 ALA HB3 H 1 1.4400 0.02 . 1 . . . . 128 ALA HB1 . 26800 1 1622 . 1 1 128 128 ALA C C 13 181.0240 0.3 . 1 . . . . 128 ALA C . 26800 1 1623 . 1 1 128 128 ALA CA C 13 55.5190 0.3 . 1 . . . . 128 ALA CA . 26800 1 1624 . 1 1 128 128 ALA CB C 13 18.3880 0.3 . 1 . . . . 128 ALA CB . 26800 1 1625 . 1 1 128 128 ALA N N 15 117.0180 0.2 . 1 . . . . 128 ALA N . 26800 1 1626 . 1 1 129 129 GLU H H 1 7.7100 0.02 . 1 . . . . 129 GLU H . 26800 1 1627 . 1 1 129 129 GLU HA H 1 3.9730 0.02 . 1 . . . . 129 GLU HA . 26800 1 1628 . 1 1 129 129 GLU HB2 H 1 1.9880 0.02 . 2 . . . . 129 GLU HB2 . 26800 1 1629 . 1 1 129 129 GLU HB3 H 1 2.3760 0.02 . 2 . . . . 129 GLU HB3 . 26800 1 1630 . 1 1 129 129 GLU HG2 H 1 2.2980 0.02 . 2 . . . . 129 GLU HG2 . 26800 1 1631 . 1 1 129 129 GLU HG3 H 1 2.2980 0.02 . 2 . . . . 129 GLU HG3 . 26800 1 1632 . 1 1 129 129 GLU C C 13 180.1540 0.3 . 1 . . . . 129 GLU C . 26800 1 1633 . 1 1 129 129 GLU CA C 13 58.7630 0.3 . 1 . . . . 129 GLU CA . 26800 1 1634 . 1 1 129 129 GLU CB C 13 30.4240 0.3 . 1 . . . . 129 GLU CB . 26800 1 1635 . 1 1 129 129 GLU CG C 13 37.0610 0.3 . 1 . . . . 129 GLU CG . 26800 1 1636 . 1 1 129 129 GLU N N 15 118.2810 0.2 . 1 . . . . 129 GLU N . 26800 1 1637 . 1 1 130 130 PHE H H 1 8.9210 0.02 . 1 . . . . 130 PHE H . 26800 1 1638 . 1 1 130 130 PHE HA H 1 4.3930 0.02 . 1 . . . . 130 PHE HA . 26800 1 1639 . 1 1 130 130 PHE HB2 H 1 3.1860 0.02 . 2 . . . . 130 PHE HB2 . 26800 1 1640 . 1 1 130 130 PHE HB3 H 1 3.3340 0.02 . 2 . . . . 130 PHE HB3 . 26800 1 1641 . 1 1 130 130 PHE HD1 H 1 7.1400 0.02 . 3 . . . . 130 PHE HD1 . 26800 1 1642 . 1 1 130 130 PHE HD2 H 1 7.1400 0.02 . 3 . . . . 130 PHE HD2 . 26800 1 1643 . 1 1 130 130 PHE HE1 H 1 7.3350 0.02 . 3 . . . . 130 PHE HE1 . 26800 1 1644 . 1 1 130 130 PHE HE2 H 1 7.3350 0.02 . 3 . . . . 130 PHE HE2 . 26800 1 1645 . 1 1 130 130 PHE HZ H 1 6.8650 0.02 . 1 . . . . 130 PHE HZ . 26800 1 1646 . 1 1 130 130 PHE C C 13 177.8280 0.3 . 1 . . . . 130 PHE C . 26800 1 1647 . 1 1 130 130 PHE CA C 13 60.1650 0.3 . 1 . . . . 130 PHE CA . 26800 1 1648 . 1 1 130 130 PHE CB C 13 39.2060 0.3 . 1 . . . . 130 PHE CB . 26800 1 1649 . 1 1 130 130 PHE CD1 C 13 131.1000 0.3 . 3 . . . . 130 PHE CD1 . 26800 1 1650 . 1 1 130 130 PHE CD2 C 13 131.1000 0.3 . 3 . . . . 130 PHE CD2 . 26800 1 1651 . 1 1 130 130 PHE CE1 C 13 131.2000 0.3 . 3 . . . . 130 PHE CE1 . 26800 1 1652 . 1 1 130 130 PHE CE2 C 13 131.2000 0.3 . 3 . . . . 130 PHE CE2 . 26800 1 1653 . 1 1 130 130 PHE CZ C 13 129.0000 0.3 . 1 . . . . 130 PHE CZ . 26800 1 1654 . 1 1 130 130 PHE N N 15 120.9320 0.2 . 1 . . . . 130 PHE N . 26800 1 1655 . 1 1 131 131 LEU H H 1 7.8340 0.02 . 1 . . . . 131 LEU H . 26800 1 1656 . 1 1 131 131 LEU HA H 1 3.6080 0.02 . 1 . . . . 131 LEU HA . 26800 1 1657 . 1 1 131 131 LEU HB2 H 1 1.5410 0.02 . 2 . . . . 131 LEU HB2 . 26800 1 1658 . 1 1 131 131 LEU HB3 H 1 1.8740 0.02 . 2 . . . . 131 LEU HB3 . 26800 1 1659 . 1 1 131 131 LEU HG H 1 1.9470 0.02 . 1 . . . . 131 LEU HG . 26800 1 1660 . 1 1 131 131 LEU HD11 H 1 0.7520 0.02 . 2 . . . . 131 LEU HD11 . 26800 1 1661 . 1 1 131 131 LEU HD12 H 1 0.7520 0.02 . 2 . . . . 131 LEU HD11 . 26800 1 1662 . 1 1 131 131 LEU HD13 H 1 0.7520 0.02 . 2 . . . . 131 LEU HD11 . 26800 1 1663 . 1 1 131 131 LEU HD21 H 1 0.9960 0.02 . 2 . . . . 131 LEU HD21 . 26800 1 1664 . 1 1 131 131 LEU HD22 H 1 0.9960 0.02 . 2 . . . . 131 LEU HD21 . 26800 1 1665 . 1 1 131 131 LEU HD23 H 1 0.9960 0.02 . 2 . . . . 131 LEU HD21 . 26800 1 1666 . 1 1 131 131 LEU C C 13 178.0780 0.3 . 1 . . . . 131 LEU C . 26800 1 1667 . 1 1 131 131 LEU CA C 13 57.5350 0.3 . 1 . . . . 131 LEU CA . 26800 1 1668 . 1 1 131 131 LEU CB C 13 41.5440 0.3 . 1 . . . . 131 LEU CB . 26800 1 1669 . 1 1 131 131 LEU CG C 13 26.6000 0.3 . 1 . . . . 131 LEU CG . 26800 1 1670 . 1 1 131 131 LEU CD1 C 13 22.3450 0.3 . 2 . . . . 131 LEU CD1 . 26800 1 1671 . 1 1 131 131 LEU CD2 C 13 26.3000 0.3 . 2 . . . . 131 LEU CD2 . 26800 1 1672 . 1 1 131 131 LEU N N 15 116.8680 0.2 . 1 . . . . 131 LEU N . 26800 1 1673 . 1 1 132 132 GLN H H 1 7.2740 0.02 . 1 . . . . 132 GLN H . 26800 1 1674 . 1 1 132 132 GLN HA H 1 4.2010 0.02 . 1 . . . . 132 GLN HA . 26800 1 1675 . 1 1 132 132 GLN HB2 H 1 2.0340 0.02 . 2 . . . . 132 GLN HB2 . 26800 1 1676 . 1 1 132 132 GLN HB3 H 1 2.2280 0.02 . 2 . . . . 132 GLN HB3 . 26800 1 1677 . 1 1 132 132 GLN HG2 H 1 2.3840 0.02 . 2 . . . . 132 GLN HG2 . 26800 1 1678 . 1 1 132 132 GLN HG3 H 1 2.4400 0.02 . 2 . . . . 132 GLN HG3 . 26800 1 1679 . 1 1 132 132 GLN HE21 H 1 7.4290 0.02 . 2 . . . . 132 GLN HE21 . 26800 1 1680 . 1 1 132 132 GLN HE22 H 1 6.7710 0.02 . 2 . . . . 132 GLN HE22 . 26800 1 1681 . 1 1 132 132 GLN C C 13 176.6010 0.3 . 1 . . . . 132 GLN C . 26800 1 1682 . 1 1 132 132 GLN CA C 13 56.3190 0.3 . 1 . . . . 132 GLN CA . 26800 1 1683 . 1 1 132 132 GLN CB C 13 29.1850 0.3 . 1 . . . . 132 GLN CB . 26800 1 1684 . 1 1 132 132 GLN CG C 13 33.7420 0.3 . 1 . . . . 132 GLN CG . 26800 1 1685 . 1 1 132 132 GLN N N 15 115.6000 0.2 . 1 . . . . 132 GLN N . 26800 1 1686 . 1 1 132 132 GLN NE2 N 15 111.6900 0.2 . 1 . . . . 132 GLN NE2 . 26800 1 1687 . 1 1 133 133 MET H H 1 7.4620 0.02 . 1 . . . . 133 MET H . 26800 1 1688 . 1 1 133 133 MET HA H 1 4.1050 0.02 . 1 . . . . 133 MET HA . 26800 1 1689 . 1 1 133 133 MET HB2 H 1 2.0590 0.02 . 2 . . . . 133 MET HB2 . 26800 1 1690 . 1 1 133 133 MET HB3 H 1 2.0590 0.02 . 2 . . . . 133 MET HB3 . 26800 1 1691 . 1 1 133 133 MET HG2 H 1 2.7000 0.02 . 2 . . . . 133 MET HG2 . 26800 1 1692 . 1 1 133 133 MET HG3 H 1 2.5440 0.02 . 2 . . . . 133 MET HG3 . 26800 1 1693 . 1 1 133 133 MET HE1 H 1 2.0960 0.02 . 1 . . . . 133 MET HE1 . 26800 1 1694 . 1 1 133 133 MET HE2 H 1 2.0960 0.02 . 1 . . . . 133 MET HE1 . 26800 1 1695 . 1 1 133 133 MET HE3 H 1 2.0960 0.02 . 1 . . . . 133 MET HE1 . 26800 1 1696 . 1 1 133 133 MET C C 13 176.4200 0.3 . 1 . . . . 133 MET C . 26800 1 1697 . 1 1 133 133 MET CA C 13 57.5840 0.3 . 1 . . . . 133 MET CA . 26800 1 1698 . 1 1 133 133 MET CB C 13 33.6220 0.3 . 1 . . . . 133 MET CB . 26800 1 1699 . 1 1 133 133 MET CG C 13 31.6600 0.3 . 1 . . . . 133 MET CG . 26800 1 1700 . 1 1 133 133 MET CE C 13 17.1600 0.3 . 1 . . . . 133 MET CE . 26800 1 1701 . 1 1 133 133 MET N N 15 119.6920 0.2 . 1 . . . . 133 MET N . 26800 1 1702 . 1 1 134 134 GLU H H 1 8.3610 0.02 . 1 . . . . 134 GLU H . 26800 1 1703 . 1 1 134 134 GLU HA H 1 4.1740 0.02 . 1 . . . . 134 GLU HA . 26800 1 1704 . 1 1 134 134 GLU HB2 H 1 1.8130 0.02 . 2 . . . . 134 GLU HB2 . 26800 1 1705 . 1 1 134 134 GLU HB3 H 1 1.9900 0.02 . 2 . . . . 134 GLU HB3 . 26800 1 1706 . 1 1 134 134 GLU HG2 H 1 2.0710 0.02 . 2 . . . . 134 GLU HG2 . 26800 1 1707 . 1 1 134 134 GLU HG3 H 1 2.0710 0.02 . 2 . . . . 134 GLU HG3 . 26800 1 1708 . 1 1 134 134 GLU C C 13 176.5620 0.3 . 1 . . . . 134 GLU C . 26800 1 1709 . 1 1 134 134 GLU CA C 13 56.6500 0.3 . 1 . . . . 134 GLU CA . 26800 1 1710 . 1 1 134 134 GLU CB C 13 30.0060 0.3 . 1 . . . . 134 GLU CB . 26800 1 1711 . 1 1 134 134 GLU CG C 13 36.1170 0.3 . 1 . . . . 134 GLU CG . 26800 1 1712 . 1 1 134 134 GLU N N 15 122.1970 0.2 . 1 . . . . 134 GLU N . 26800 1 1713 . 1 1 135 135 LEU H H 1 8.0810 0.02 . 1 . . . . 135 LEU H . 26800 1 1714 . 1 1 135 135 LEU HA H 1 4.2120 0.02 . 1 . . . . 135 LEU HA . 26800 1 1715 . 1 1 135 135 LEU HB2 H 1 1.5140 0.02 . 2 . . . . 135 LEU HB2 . 26800 1 1716 . 1 1 135 135 LEU HB3 H 1 1.6350 0.02 . 2 . . . . 135 LEU HB3 . 26800 1 1717 . 1 1 135 135 LEU HG H 1 1.6000 0.02 . 1 . . . . 135 LEU HG . 26800 1 1718 . 1 1 135 135 LEU HD11 H 1 0.8870 0.02 . 2 . . . . 135 LEU HD11 . 26800 1 1719 . 1 1 135 135 LEU HD12 H 1 0.8870 0.02 . 2 . . . . 135 LEU HD11 . 26800 1 1720 . 1 1 135 135 LEU HD13 H 1 0.8870 0.02 . 2 . . . . 135 LEU HD11 . 26800 1 1721 . 1 1 135 135 LEU HD21 H 1 0.8340 0.02 . 2 . . . . 135 LEU HD21 . 26800 1 1722 . 1 1 135 135 LEU HD22 H 1 0.8340 0.02 . 2 . . . . 135 LEU HD21 . 26800 1 1723 . 1 1 135 135 LEU HD23 H 1 0.8340 0.02 . 2 . . . . 135 LEU HD21 . 26800 1 1724 . 1 1 135 135 LEU C C 13 177.5230 0.3 . 1 . . . . 135 LEU C . 26800 1 1725 . 1 1 135 135 LEU CA C 13 55.7600 0.3 . 1 . . . . 135 LEU CA . 26800 1 1726 . 1 1 135 135 LEU CB C 13 42.2000 0.3 . 1 . . . . 135 LEU CB . 26800 1 1727 . 1 1 135 135 LEU CG C 13 27.0000 0.3 . 1 . . . . 135 LEU CG . 26800 1 1728 . 1 1 135 135 LEU CD1 C 13 25.1300 0.3 . 2 . . . . 135 LEU CD1 . 26800 1 1729 . 1 1 135 135 LEU CD2 C 13 23.6650 0.3 . 2 . . . . 135 LEU CD2 . 26800 1 1730 . 1 1 135 135 LEU N N 15 122.4560 0.2 . 1 . . . . 135 LEU N . 26800 1 1731 . 1 1 136 136 GLU H H 1 8.1140 0.02 . 1 . . . . 136 GLU H . 26800 1 1732 . 1 1 136 136 GLU HA H 1 4.1550 0.02 . 1 . . . . 136 GLU HA . 26800 1 1733 . 1 1 136 136 GLU HB2 H 1 1.8970 0.02 . 2 . . . . 136 GLU HB2 . 26800 1 1734 . 1 1 136 136 GLU HB3 H 1 1.8970 0.02 . 2 . . . . 136 GLU HB3 . 26800 1 1735 . 1 1 136 136 GLU HG2 H 1 2.1440 0.02 . 2 . . . . 136 GLU HG2 . 26800 1 1736 . 1 1 136 136 GLU HG3 H 1 2.2060 0.02 . 2 . . . . 136 GLU HG3 . 26800 1 1737 . 1 1 136 136 GLU C C 13 176.2240 0.3 . 1 . . . . 136 GLU C . 26800 1 1738 . 1 1 136 136 GLU CA C 13 56.6380 0.3 . 1 . . . . 136 GLU CA . 26800 1 1739 . 1 1 136 136 GLU CB C 13 30.4100 0.3 . 1 . . . . 136 GLU CB . 26800 1 1740 . 1 1 136 136 GLU CG C 13 36.1170 0.3 . 1 . . . . 136 GLU CG . 26800 1 1741 . 1 1 136 136 GLU N N 15 119.8470 0.2 . 1 . . . . 136 GLU N . 26800 1 1742 . 1 1 137 137 HIS H H 1 8.3200 0.02 . 1 . . . . 137 HIS H . 26800 1 1743 . 1 1 137 137 HIS HA H 1 4.5790 0.02 . 1 . . . . 137 HIS HA . 26800 1 1744 . 1 1 137 137 HIS HB2 H 1 3.0600 0.02 . 2 . . . . 137 HIS HB2 . 26800 1 1745 . 1 1 137 137 HIS HB3 H 1 3.1070 0.02 . 2 . . . . 137 HIS HB3 . 26800 1 1746 . 1 1 137 137 HIS C C 13 174.6100 0.3 . 1 . . . . 137 HIS C . 26800 1 1747 . 1 1 137 137 HIS CA C 13 55.7500 0.3 . 1 . . . . 137 HIS CA . 26800 1 1748 . 1 1 137 137 HIS CB C 13 29.3100 0.3 . 1 . . . . 137 HIS CB . 26800 1 1749 . 1 1 137 137 HIS N N 15 119.1030 0.2 . 1 . . . . 137 HIS N . 26800 1 1750 . 1 1 138 138 HIS H H 1 8.4030 0.02 . 1 . . . . 138 HIS H . 26800 1 1751 . 1 1 138 138 HIS HA H 1 4.5960 0.02 . 1 . . . . 138 HIS HA . 26800 1 1752 . 1 1 138 138 HIS HB2 H 1 3.1360 0.02 . 2 . . . . 138 HIS HB2 . 26800 1 1753 . 1 1 138 138 HIS HB3 H 1 3.0530 0.02 . 2 . . . . 138 HIS HB3 . 26800 1 1754 . 1 1 138 138 HIS HD2 H 1 7.1070 0.02 . 1 . . . . 138 HIS HD2 . 26800 1 1755 . 1 1 138 138 HIS HE1 H 1 8.3260 0.02 . 1 . . . . 138 HIS HE1 . 26800 1 1756 . 1 1 138 138 HIS C C 13 174.4800 0.3 . 1 . . . . 138 HIS C . 26800 1 1757 . 1 1 138 138 HIS CA C 13 55.6500 0.3 . 1 . . . . 138 HIS CA . 26800 1 1758 . 1 1 138 138 HIS CB C 13 29.5300 0.3 . 1 . . . . 138 HIS CB . 26800 1 1759 . 1 1 138 138 HIS CD2 C 13 119.8000 0.3 . 1 . . . . 138 HIS CD2 . 26800 1 1760 . 1 1 138 138 HIS CE1 C 13 136.9500 0.3 . 1 . . . . 138 HIS CE1 . 26800 1 1761 . 1 1 138 138 HIS N N 15 119.5560 0.2 . 1 . . . . 138 HIS N . 26800 1 1762 . 1 1 141 141 HIS HA H 1 4.6330 0.02 . 1 . . . . 141 HIS HA . 26800 1 1763 . 1 1 141 141 HIS HB2 H 1 3.1850 0.02 . 2 . . . . 141 HIS HB2 . 26800 1 1764 . 1 1 141 141 HIS HB3 H 1 3.1850 0.02 . 2 . . . . 141 HIS HB3 . 26800 1 1765 . 1 1 141 141 HIS C C 13 173.7500 0.3 . 1 . . . . 141 HIS C . 26800 1 1766 . 1 1 141 141 HIS CA C 13 55.8600 0.3 . 1 . . . . 141 HIS CA . 26800 1 1767 . 1 1 141 141 HIS CB C 13 29.6600 0.3 . 1 . . . . 141 HIS CB . 26800 1 1768 . 1 1 142 142 HIS H H 1 8.2640 0.02 . 1 . . . . 142 HIS H . 26800 1 1769 . 1 1 142 142 HIS HA H 1 4.4470 0.02 . 1 . . . . 142 HIS HA . 26800 1 1770 . 1 1 142 142 HIS HB2 H 1 3.1110 0.02 . 2 . . . . 142 HIS HB2 . 26800 1 1771 . 1 1 142 142 HIS HB3 H 1 3.2270 0.02 . 2 . . . . 142 HIS HB3 . 26800 1 1772 . 1 1 142 142 HIS C C 13 178.9600 0.3 . 1 . . . . 142 HIS C . 26800 1 1773 . 1 1 142 142 HIS CA C 13 57.2500 0.3 . 1 . . . . 142 HIS CA . 26800 1 1774 . 1 1 142 142 HIS CB C 13 29.7800 0.3 . 1 . . . . 142 HIS CB . 26800 1 1775 . 1 1 142 142 HIS N N 15 125.3340 0.2 . 1 . . . . 142 HIS N . 26800 1 stop_ save_