data_26780 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26780 _Entry.Title ; Chemical Shift Assignments for Interleukin-36alpha ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-04-18 _Entry.Accession_date 2016-04-18 _Entry.Last_release_date 2016-04-18 _Entry.Original_release_date 2016-04-18 _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 Oliver Ohlenschlaeger . . . . 26780 2 Nishit Goradia . . . . 26780 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26780 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 645 26780 '15N chemical shifts' 144 26780 '1H chemical shifts' 1030 26780 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-04-25 . original BMRB . 26780 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 26780 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27351892 _Citation.Full_citation . _Citation.Title ; (1)H, (13)C, and (15)N resonance assignments for the pro-inflammatory cytokine interleukin-36alpha ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 10 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 329 _Citation.Page_last 333 _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 Nishit Goradia . . . . 26780 1 2 Amelie Wissbrock . . . . 26780 1 3 Christoph Wiedemann . . . . 26780 1 4 Frank Bordusa . . . . 26780 1 5 Ramadurai Ramachandran . . . . 26780 1 6 Diana Imhof . . . . 26780 1 7 Oliver Ohlenschlaeger . . . . 26780 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Backbone resonance assignments' 26780 1 Cytokines 26780 1 'Heteronuclear NMR' 26780 1 'Interleukin-1 superfamily' 26780 1 Interleukin-36alpha 26780 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26780 _Assembly.ID 1 _Assembly.Name IL36A _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 17965.6 _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 IL36A 1 $Interleukin-36alpha A . yes native no no . . . 26780 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Interleukin-36alpha _Entity.Sf_category entity _Entity.Sf_framecode Interleukin-36alpha _Entity.Entry_ID 26780 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Interleukin-36alpha _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 ; GSHMEKALKIDTPQQGSIQD INHRVWVLQDQTLIAVPRKD RMSPVTIALISCRHVETLEK DRGNPIYLGLNGLNLCLMCA KVGDQPTLQLKEKDIMDLYN QPEPVKSFLFYHSQSGRNST FESVAFPGWFIAVSSEGGCP LILTQELGKANTTDFGLTML F ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-3 represent a non-native cloning artifact' _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 161 _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 17965.6 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes UNP Q9UHA7 . IL36A_HUMAN . . . . . . . . . . . . . . 26780 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID Cytokine 26780 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 -2 GLY . 26780 1 2 -1 SER . 26780 1 3 0 HIS . 26780 1 4 1 MET . 26780 1 5 2 GLU . 26780 1 6 3 LYS . 26780 1 7 4 ALA . 26780 1 8 5 LEU . 26780 1 9 6 LYS . 26780 1 10 7 ILE . 26780 1 11 8 ASP . 26780 1 12 9 THR . 26780 1 13 10 PRO . 26780 1 14 11 GLN . 26780 1 15 12 GLN . 26780 1 16 13 GLY . 26780 1 17 14 SER . 26780 1 18 15 ILE . 26780 1 19 16 GLN . 26780 1 20 17 ASP . 26780 1 21 18 ILE . 26780 1 22 19 ASN . 26780 1 23 20 HIS . 26780 1 24 21 ARG . 26780 1 25 22 VAL . 26780 1 26 23 TRP . 26780 1 27 24 VAL . 26780 1 28 25 LEU . 26780 1 29 26 GLN . 26780 1 30 27 ASP . 26780 1 31 28 GLN . 26780 1 32 29 THR . 26780 1 33 30 LEU . 26780 1 34 31 ILE . 26780 1 35 32 ALA . 26780 1 36 33 VAL . 26780 1 37 34 PRO . 26780 1 38 35 ARG . 26780 1 39 36 LYS . 26780 1 40 37 ASP . 26780 1 41 38 ARG . 26780 1 42 39 MET . 26780 1 43 40 SER . 26780 1 44 41 PRO . 26780 1 45 42 VAL . 26780 1 46 43 THR . 26780 1 47 44 ILE . 26780 1 48 45 ALA . 26780 1 49 46 LEU . 26780 1 50 47 ILE . 26780 1 51 48 SER . 26780 1 52 49 CYS . 26780 1 53 50 ARG . 26780 1 54 51 HIS . 26780 1 55 52 VAL . 26780 1 56 53 GLU . 26780 1 57 54 THR . 26780 1 58 55 LEU . 26780 1 59 56 GLU . 26780 1 60 57 LYS . 26780 1 61 58 ASP . 26780 1 62 59 ARG . 26780 1 63 60 GLY . 26780 1 64 61 ASN . 26780 1 65 62 PRO . 26780 1 66 63 ILE . 26780 1 67 64 TYR . 26780 1 68 65 LEU . 26780 1 69 66 GLY . 26780 1 70 67 LEU . 26780 1 71 68 ASN . 26780 1 72 69 GLY . 26780 1 73 70 LEU . 26780 1 74 71 ASN . 26780 1 75 72 LEU . 26780 1 76 73 CYS . 26780 1 77 74 LEU . 26780 1 78 75 MET . 26780 1 79 76 CYS . 26780 1 80 77 ALA . 26780 1 81 78 LYS . 26780 1 82 79 VAL . 26780 1 83 80 GLY . 26780 1 84 81 ASP . 26780 1 85 82 GLN . 26780 1 86 83 PRO . 26780 1 87 84 THR . 26780 1 88 85 LEU . 26780 1 89 86 GLN . 26780 1 90 87 LEU . 26780 1 91 88 LYS . 26780 1 92 89 GLU . 26780 1 93 90 LYS . 26780 1 94 91 ASP . 26780 1 95 92 ILE . 26780 1 96 93 MET . 26780 1 97 94 ASP . 26780 1 98 95 LEU . 26780 1 99 96 TYR . 26780 1 100 97 ASN . 26780 1 101 98 GLN . 26780 1 102 99 PRO . 26780 1 103 100 GLU . 26780 1 104 101 PRO . 26780 1 105 102 VAL . 26780 1 106 103 LYS . 26780 1 107 104 SER . 26780 1 108 105 PHE . 26780 1 109 106 LEU . 26780 1 110 107 PHE . 26780 1 111 108 TYR . 26780 1 112 109 HIS . 26780 1 113 110 SER . 26780 1 114 111 GLN . 26780 1 115 112 SER . 26780 1 116 113 GLY . 26780 1 117 114 ARG . 26780 1 118 115 ASN . 26780 1 119 116 SER . 26780 1 120 117 THR . 26780 1 121 118 PHE . 26780 1 122 119 GLU . 26780 1 123 120 SER . 26780 1 124 121 VAL . 26780 1 125 122 ALA . 26780 1 126 123 PHE . 26780 1 127 124 PRO . 26780 1 128 125 GLY . 26780 1 129 126 TRP . 26780 1 130 127 PHE . 26780 1 131 128 ILE . 26780 1 132 129 ALA . 26780 1 133 130 VAL . 26780 1 134 131 SER . 26780 1 135 132 SER . 26780 1 136 133 GLU . 26780 1 137 134 GLY . 26780 1 138 135 GLY . 26780 1 139 136 CYS . 26780 1 140 137 PRO . 26780 1 141 138 LEU . 26780 1 142 139 ILE . 26780 1 143 140 LEU . 26780 1 144 141 THR . 26780 1 145 142 GLN . 26780 1 146 143 GLU . 26780 1 147 144 LEU . 26780 1 148 145 GLY . 26780 1 149 146 LYS . 26780 1 150 147 ALA . 26780 1 151 148 ASN . 26780 1 152 149 THR . 26780 1 153 150 THR . 26780 1 154 151 ASP . 26780 1 155 152 PHE . 26780 1 156 153 GLY . 26780 1 157 154 LEU . 26780 1 158 155 THR . 26780 1 159 156 MET . 26780 1 160 157 LEU . 26780 1 161 158 PHE . 26780 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 26780 1 . SER 2 2 26780 1 . HIS 3 3 26780 1 . MET 4 4 26780 1 . GLU 5 5 26780 1 . LYS 6 6 26780 1 . ALA 7 7 26780 1 . LEU 8 8 26780 1 . LYS 9 9 26780 1 . ILE 10 10 26780 1 . ASP 11 11 26780 1 . THR 12 12 26780 1 . PRO 13 13 26780 1 . GLN 14 14 26780 1 . GLN 15 15 26780 1 . GLY 16 16 26780 1 . SER 17 17 26780 1 . ILE 18 18 26780 1 . GLN 19 19 26780 1 . ASP 20 20 26780 1 . ILE 21 21 26780 1 . ASN 22 22 26780 1 . HIS 23 23 26780 1 . ARG 24 24 26780 1 . VAL 25 25 26780 1 . TRP 26 26 26780 1 . VAL 27 27 26780 1 . LEU 28 28 26780 1 . GLN 29 29 26780 1 . ASP 30 30 26780 1 . GLN 31 31 26780 1 . THR 32 32 26780 1 . LEU 33 33 26780 1 . ILE 34 34 26780 1 . ALA 35 35 26780 1 . VAL 36 36 26780 1 . PRO 37 37 26780 1 . ARG 38 38 26780 1 . LYS 39 39 26780 1 . ASP 40 40 26780 1 . ARG 41 41 26780 1 . MET 42 42 26780 1 . SER 43 43 26780 1 . PRO 44 44 26780 1 . VAL 45 45 26780 1 . THR 46 46 26780 1 . ILE 47 47 26780 1 . ALA 48 48 26780 1 . LEU 49 49 26780 1 . ILE 50 50 26780 1 . SER 51 51 26780 1 . CYS 52 52 26780 1 . ARG 53 53 26780 1 . HIS 54 54 26780 1 . VAL 55 55 26780 1 . GLU 56 56 26780 1 . THR 57 57 26780 1 . LEU 58 58 26780 1 . GLU 59 59 26780 1 . LYS 60 60 26780 1 . ASP 61 61 26780 1 . ARG 62 62 26780 1 . GLY 63 63 26780 1 . ASN 64 64 26780 1 . PRO 65 65 26780 1 . ILE 66 66 26780 1 . TYR 67 67 26780 1 . LEU 68 68 26780 1 . GLY 69 69 26780 1 . LEU 70 70 26780 1 . ASN 71 71 26780 1 . GLY 72 72 26780 1 . LEU 73 73 26780 1 . ASN 74 74 26780 1 . LEU 75 75 26780 1 . CYS 76 76 26780 1 . LEU 77 77 26780 1 . MET 78 78 26780 1 . CYS 79 79 26780 1 . ALA 80 80 26780 1 . LYS 81 81 26780 1 . VAL 82 82 26780 1 . GLY 83 83 26780 1 . ASP 84 84 26780 1 . GLN 85 85 26780 1 . PRO 86 86 26780 1 . THR 87 87 26780 1 . LEU 88 88 26780 1 . GLN 89 89 26780 1 . LEU 90 90 26780 1 . LYS 91 91 26780 1 . GLU 92 92 26780 1 . LYS 93 93 26780 1 . ASP 94 94 26780 1 . ILE 95 95 26780 1 . MET 96 96 26780 1 . ASP 97 97 26780 1 . LEU 98 98 26780 1 . TYR 99 99 26780 1 . ASN 100 100 26780 1 . GLN 101 101 26780 1 . PRO 102 102 26780 1 . GLU 103 103 26780 1 . PRO 104 104 26780 1 . VAL 105 105 26780 1 . LYS 106 106 26780 1 . SER 107 107 26780 1 . PHE 108 108 26780 1 . LEU 109 109 26780 1 . PHE 110 110 26780 1 . TYR 111 111 26780 1 . HIS 112 112 26780 1 . SER 113 113 26780 1 . GLN 114 114 26780 1 . SER 115 115 26780 1 . GLY 116 116 26780 1 . ARG 117 117 26780 1 . ASN 118 118 26780 1 . SER 119 119 26780 1 . THR 120 120 26780 1 . PHE 121 121 26780 1 . GLU 122 122 26780 1 . SER 123 123 26780 1 . VAL 124 124 26780 1 . ALA 125 125 26780 1 . PHE 126 126 26780 1 . PRO 127 127 26780 1 . GLY 128 128 26780 1 . TRP 129 129 26780 1 . PHE 130 130 26780 1 . ILE 131 131 26780 1 . ALA 132 132 26780 1 . VAL 133 133 26780 1 . SER 134 134 26780 1 . SER 135 135 26780 1 . GLU 136 136 26780 1 . GLY 137 137 26780 1 . GLY 138 138 26780 1 . CYS 139 139 26780 1 . PRO 140 140 26780 1 . LEU 141 141 26780 1 . ILE 142 142 26780 1 . LEU 143 143 26780 1 . THR 144 144 26780 1 . GLN 145 145 26780 1 . GLU 146 146 26780 1 . LEU 147 147 26780 1 . GLY 148 148 26780 1 . LYS 149 149 26780 1 . ALA 150 150 26780 1 . ASN 151 151 26780 1 . THR 152 152 26780 1 . THR 153 153 26780 1 . ASP 154 154 26780 1 . PHE 155 155 26780 1 . GLY 156 156 26780 1 . LEU 157 157 26780 1 . THR 158 158 26780 1 . MET 159 159 26780 1 . LEU 160 160 26780 1 . PHE 161 161 26780 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 26780 _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 $Interleukin-36alpha . 9606 organism . 'Homo sapiens' humans . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 26780 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 26780 _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 $Interleukin-36alpha . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-28a . . . 26780 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26780 _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 Interleukin-36alpha '[U-100% 13C; U-100% 15N]' . . 1 $Interleukin-36alpha . . 1.3 . . mM . . . . 26780 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 26780 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26780 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26780 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 26780 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Interleukin-36alpha '[U-100% 15N]' . . 1 $Interleukin-36alpha . . 1.3 . . mM . . . . 26780 2 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 26780 2 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26780 2 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26780 2 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 26780 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M 26780 1 pH 6.9 . pH 26780 1 pressure 1 . atm 26780 1 temperature 273 . K 26780 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26780 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 3.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26780 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26780 1 processing 26780 1 stop_ save_ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 26780 _Software.ID 2 _Software.Name CCPN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 26780 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26780 2 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 26780 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26780 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 26780 _NMR_spectrometer.ID 3 _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 26780 _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 . 750 . . . 26780 1 2 spectrometer_2 Bruker Avance . 700 . . . 26780 1 3 spectrometer_3 Bruker Avance . 600 . . . 26780 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 26780 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26780 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26780 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26780 1 4 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26780 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26780 1 6 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26780 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26780 1 8 '3D HNHA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26780 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26780 1 10 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 26780 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 26780 _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 . . . . . 26780 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26780 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26780 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 26780 _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' . . . 26780 1 2 '2D 1H-13C HSQC' . . . 26780 1 3 '3D HNCO' . . . 26780 1 9 '3D HCCH-TOCSY' . . . 26780 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $TOPSPIN . . 26780 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 4 4 MET HA H 1 4.292 0.020 . 1 . . . . 1 MET HA . 26780 1 2 . 1 1 4 4 MET HB2 H 1 1.890 0.020 . 2 . . . . 1 MET HB2 . 26780 1 3 . 1 1 4 4 MET HB3 H 1 1.890 0.020 . 2 . . . . 1 MET HB3 . 26780 1 4 . 1 1 4 4 MET HG2 H 1 2.286 0.020 . 2 . . . . 1 MET HG2 . 26780 1 5 . 1 1 4 4 MET HG3 H 1 2.364 0.020 . 2 . . . . 1 MET HG3 . 26780 1 6 . 1 1 4 4 MET HE1 H 1 1.930 0.020 . 1 . . . . 1 MET QE . 26780 1 7 . 1 1 4 4 MET HE2 H 1 1.930 0.020 . 1 . . . . 1 MET QE . 26780 1 8 . 1 1 4 4 MET HE3 H 1 1.930 0.020 . 1 . . . . 1 MET QE . 26780 1 9 . 1 1 4 4 MET C C 13 175.953 0.300 . 1 . . . . 1 MET C . 26780 1 10 . 1 1 4 4 MET CA C 13 55.429 0.300 . 1 . . . . 1 MET CA . 26780 1 11 . 1 1 4 4 MET CB C 13 32.638 0.300 . 1 . . . . 1 MET CB . 26780 1 12 . 1 1 4 4 MET CG C 13 31.711 0.300 . 1 . . . . 1 MET CG . 26780 1 13 . 1 1 4 4 MET CE C 13 17.340 0.300 . 1 . . . . 1 MET CE . 26780 1 14 . 1 1 4 4 MET N N 15 121.545 0.200 . 1 . . . . 1 MET N . 26780 1 15 . 1 1 5 5 GLU H H 1 8.294 0.020 . 1 . . . . 2 GLU H . 26780 1 16 . 1 1 5 5 GLU HA H 1 4.103 0.020 . 1 . . . . 2 GLU HA . 26780 1 17 . 1 1 5 5 GLU HB2 H 1 1.898 0.020 . 2 . . . . 2 GLU HB2 . 26780 1 18 . 1 1 5 5 GLU HB3 H 1 1.844 0.020 . 2 . . . . 2 GLU HB3 . 26780 1 19 . 1 1 5 5 GLU HG2 H 1 2.147 0.020 . 2 . . . . 2 GLU HG2 . 26780 1 20 . 1 1 5 5 GLU HG3 H 1 2.147 0.020 . 2 . . . . 2 GLU HG3 . 26780 1 21 . 1 1 5 5 GLU C C 13 176.413 0.300 . 1 . . . . 2 GLU C . 26780 1 22 . 1 1 5 5 GLU CA C 13 56.609 0.300 . 1 . . . . 2 GLU CA . 26780 1 23 . 1 1 5 5 GLU CB C 13 30.065 0.300 . 1 . . . . 2 GLU CB . 26780 1 24 . 1 1 5 5 GLU CG C 13 36.173 0.300 . 1 . . . . 2 GLU CG . 26780 1 25 . 1 1 5 5 GLU N N 15 122.391 0.200 . 1 . . . . 2 GLU N . 26780 1 26 . 1 1 6 6 LYS H H 1 8.198 0.020 . 1 . . . . 3 LYS H . 26780 1 27 . 1 1 6 6 LYS HA H 1 4.133 0.020 . 1 . . . . 3 LYS HA . 26780 1 28 . 1 1 6 6 LYS HB2 H 1 1.632 0.020 . 2 . . . . 3 LYS HB2 . 26780 1 29 . 1 1 6 6 LYS HB3 H 1 1.707 0.020 . 2 . . . . 3 LYS HB3 . 26780 1 30 . 1 1 6 6 LYS HG2 H 1 1.312 0.020 . 2 . . . . 3 LYS HG2 . 26780 1 31 . 1 1 6 6 LYS HG3 H 1 1.312 0.020 . 2 . . . . 3 LYS HG3 . 26780 1 32 . 1 1 6 6 LYS HD2 H 1 1.563 0.020 . 2 . . . . 3 LYS HD2 . 26780 1 33 . 1 1 6 6 LYS HD3 H 1 1.563 0.020 . 2 . . . . 3 LYS HD3 . 26780 1 34 . 1 1 6 6 LYS HE2 H 1 2.860 0.020 . 2 . . . . 3 LYS HE2 . 26780 1 35 . 1 1 6 6 LYS HE3 H 1 2.860 0.020 . 2 . . . . 3 LYS HE3 . 26780 1 36 . 1 1 6 6 LYS C C 13 176.069 0.300 . 1 . . . . 3 LYS C . 26780 1 37 . 1 1 6 6 LYS CA C 13 56.084 0.300 . 1 . . . . 3 LYS CA . 26780 1 38 . 1 1 6 6 LYS CB C 13 32.844 0.300 . 1 . . . . 3 LYS CB . 26780 1 39 . 1 1 6 6 LYS CG C 13 24.660 0.300 . 1 . . . . 3 LYS CG . 26780 1 40 . 1 1 6 6 LYS CD C 13 28.934 0.300 . 1 . . . . 3 LYS CD . 26780 1 41 . 1 1 6 6 LYS CE C 13 42.028 0.300 . 1 . . . . 3 LYS CE . 26780 1 42 . 1 1 6 6 LYS N N 15 122.186 0.200 . 1 . . . . 3 LYS N . 26780 1 43 . 1 1 7 7 ALA H H 1 8.148 0.020 . 1 . . . . 4 ALA H . 26780 1 44 . 1 1 7 7 ALA HA H 1 4.170 0.020 . 1 . . . . 4 ALA HA . 26780 1 45 . 1 1 7 7 ALA HB1 H 1 1.247 0.020 . 1 . . . . 4 ALA QB . 26780 1 46 . 1 1 7 7 ALA HB2 H 1 1.247 0.020 . 1 . . . . 4 ALA QB . 26780 1 47 . 1 1 7 7 ALA HB3 H 1 1.247 0.020 . 1 . . . . 4 ALA QB . 26780 1 48 . 1 1 7 7 ALA C C 13 177.421 0.300 . 1 . . . . 4 ALA C . 26780 1 49 . 1 1 7 7 ALA CA C 13 52.181 0.300 . 1 . . . . 4 ALA CA . 26780 1 50 . 1 1 7 7 ALA CB C 13 19.110 0.300 . 1 . . . . 4 ALA CB . 26780 1 51 . 1 1 7 7 ALA N N 15 124.859 0.200 . 1 . . . . 4 ALA N . 26780 1 52 . 1 1 8 8 LEU H H 1 8.069 0.020 . 1 . . . . 5 LEU H . 26780 1 53 . 1 1 8 8 LEU HA H 1 4.191 0.020 . 1 . . . . 5 LEU HA . 26780 1 54 . 1 1 8 8 LEU HB2 H 1 1.438 0.020 . 2 . . . . 5 LEU HB2 . 26780 1 55 . 1 1 8 8 LEU HB3 H 1 1.514 0.020 . 2 . . . . 5 LEU HB3 . 26780 1 56 . 1 1 8 8 LEU HG H 1 1.506 0.020 . 1 . . . . 5 LEU HG . 26780 1 57 . 1 1 8 8 LEU HD11 H 1 0.808 0.020 . 2 . . . . 5 LEU QD1 . 26780 1 58 . 1 1 8 8 LEU HD12 H 1 0.808 0.020 . 2 . . . . 5 LEU QD1 . 26780 1 59 . 1 1 8 8 LEU HD13 H 1 0.808 0.020 . 2 . . . . 5 LEU QD1 . 26780 1 60 . 1 1 8 8 LEU HD21 H 1 0.756 0.020 . 2 . . . . 5 LEU QD2 . 26780 1 61 . 1 1 8 8 LEU HD22 H 1 0.756 0.020 . 2 . . . . 5 LEU QD2 . 26780 1 62 . 1 1 8 8 LEU HD23 H 1 0.756 0.020 . 2 . . . . 5 LEU QD2 . 26780 1 63 . 1 1 8 8 LEU C C 13 177.081 0.300 . 1 . . . . 5 LEU C . 26780 1 64 . 1 1 8 8 LEU CA C 13 55.005 0.300 . 1 . . . . 5 LEU CA . 26780 1 65 . 1 1 8 8 LEU CB C 13 42.403 0.300 . 1 . . . . 5 LEU CB . 26780 1 66 . 1 1 8 8 LEU CG C 13 27.089 0.300 . 1 . . . . 5 LEU CG . 26780 1 67 . 1 1 8 8 LEU CD1 C 13 24.603 0.300 . 1 . . . . 5 LEU CD1 . 26780 1 68 . 1 1 8 8 LEU CD2 C 13 23.429 0.300 . 1 . . . . 5 LEU CD2 . 26780 1 69 . 1 1 8 8 LEU N N 15 121.619 0.200 . 1 . . . . 5 LEU N . 26780 1 70 . 1 1 9 9 LYS H H 1 8.195 0.020 . 1 . . . . 6 LYS H . 26780 1 71 . 1 1 9 9 LYS HA H 1 4.249 0.020 . 1 . . . . 6 LYS HA . 26780 1 72 . 1 1 9 9 LYS HB2 H 1 1.709 0.020 . 2 . . . . 6 LYS HB2 . 26780 1 73 . 1 1 9 9 LYS HB3 H 1 1.631 0.020 . 2 . . . . 6 LYS HB3 . 26780 1 74 . 1 1 9 9 LYS HG2 H 1 1.250 0.020 . 2 . . . . 6 LYS HG2 . 26780 1 75 . 1 1 9 9 LYS HG3 H 1 1.313 0.020 . 2 . . . . 6 LYS HG3 . 26780 1 76 . 1 1 9 9 LYS HD2 H 1 1.555 0.020 . 2 . . . . 6 LYS HD2 . 26780 1 77 . 1 1 9 9 LYS HD3 H 1 1.555 0.020 . 2 . . . . 6 LYS HD3 . 26780 1 78 . 1 1 9 9 LYS HE2 H 1 2.860 0.020 . 2 . . . . 6 LYS HE2 . 26780 1 79 . 1 1 9 9 LYS HE3 H 1 2.860 0.020 . 2 . . . . 6 LYS HE3 . 26780 1 80 . 1 1 9 9 LYS C C 13 175.979 0.300 . 1 . . . . 6 LYS C . 26780 1 81 . 1 1 9 9 LYS CA C 13 55.950 0.300 . 1 . . . . 6 LYS CA . 26780 1 82 . 1 1 9 9 LYS CB C 13 32.714 0.300 . 1 . . . . 6 LYS CB . 26780 1 83 . 1 1 9 9 LYS CG C 13 24.597 0.300 . 1 . . . . 6 LYS CG . 26780 1 84 . 1 1 9 9 LYS CD C 13 28.742 0.300 . 1 . . . . 6 LYS CD . 26780 1 85 . 1 1 9 9 LYS CE C 13 41.793 0.300 . 1 . . . . 6 LYS CE . 26780 1 86 . 1 1 9 9 LYS N N 15 123.204 0.200 . 1 . . . . 6 LYS N . 26780 1 87 . 1 1 10 10 ILE H H 1 8.113 0.020 . 1 . . . . 7 ILE H . 26780 1 88 . 1 1 10 10 ILE HA H 1 4.154 0.020 . 1 . . . . 7 ILE HA . 26780 1 89 . 1 1 10 10 ILE HB H 1 1.768 0.020 . 1 . . . . 7 ILE HB . 26780 1 90 . 1 1 10 10 ILE HG12 H 1 1.346 0.020 . 2 . . . . 7 ILE HG12 . 26780 1 91 . 1 1 10 10 ILE HG13 H 1 1.060 0.020 . 2 . . . . 7 ILE HG13 . 26780 1 92 . 1 1 10 10 ILE HG21 H 1 0.810 0.020 . 1 . . . . 7 ILE QG2 . 26780 1 93 . 1 1 10 10 ILE HG22 H 1 0.810 0.020 . 1 . . . . 7 ILE QG2 . 26780 1 94 . 1 1 10 10 ILE HG23 H 1 0.810 0.020 . 1 . . . . 7 ILE QG2 . 26780 1 95 . 1 1 10 10 ILE HD11 H 1 0.757 0.020 . 1 . . . . 7 ILE QD1 . 26780 1 96 . 1 1 10 10 ILE HD12 H 1 0.757 0.020 . 1 . . . . 7 ILE QD1 . 26780 1 97 . 1 1 10 10 ILE HD13 H 1 0.757 0.020 . 1 . . . . 7 ILE QD1 . 26780 1 98 . 1 1 10 10 ILE C C 13 175.549 0.300 . 1 . . . . 7 ILE C . 26780 1 99 . 1 1 10 10 ILE CA C 13 60.920 0.300 . 1 . . . . 7 ILE CA . 26780 1 100 . 1 1 10 10 ILE CB C 13 38.859 0.300 . 1 . . . . 7 ILE CB . 26780 1 101 . 1 1 10 10 ILE CG1 C 13 26.921 0.300 . 1 . . . . 7 ILE CG1 . 26780 1 102 . 1 1 10 10 ILE CG2 C 13 17.738 0.300 . 1 . . . . 7 ILE CG2 . 26780 1 103 . 1 1 10 10 ILE CD1 C 13 13.021 0.300 . 1 . . . . 7 ILE CD1 . 26780 1 104 . 1 1 10 10 ILE N N 15 122.524 0.200 . 1 . . . . 7 ILE N . 26780 1 105 . 1 1 11 11 ASP H H 1 8.172 0.020 . 1 . . . . 8 ASP H . 26780 1 106 . 1 1 11 11 ASP HA H 1 4.490 0.020 . 1 . . . . 8 ASP HA . 26780 1 107 . 1 1 11 11 ASP HB2 H 1 2.478 0.020 . 2 . . . . 8 ASP HB2 . 26780 1 108 . 1 1 11 11 ASP HB3 H 1 2.478 0.020 . 2 . . . . 8 ASP HB3 . 26780 1 109 . 1 1 11 11 ASP C C 13 174.009 0.300 . 1 . . . . 8 ASP C . 26780 1 110 . 1 1 11 11 ASP CA C 13 54.086 0.300 . 1 . . . . 8 ASP CA . 26780 1 111 . 1 1 11 11 ASP CB C 13 41.517 0.300 . 1 . . . . 8 ASP CB . 26780 1 112 . 1 1 11 11 ASP N N 15 123.282 0.200 . 1 . . . . 8 ASP N . 26780 1 113 . 1 1 12 12 THR H H 1 7.547 0.020 . 1 . . . . 9 THR H . 26780 1 114 . 1 1 12 12 THR HA H 1 4.541 0.020 . 1 . . . . 9 THR HA . 26780 1 115 . 1 1 12 12 THR HB H 1 3.956 0.020 . 1 . . . . 9 THR HB . 26780 1 116 . 1 1 12 12 THR HG21 H 1 1.069 0.020 . 1 . . . . 9 THR QG2 . 26780 1 117 . 1 1 12 12 THR HG22 H 1 1.069 0.020 . 1 . . . . 9 THR QG2 . 26780 1 118 . 1 1 12 12 THR HG23 H 1 1.069 0.020 . 1 . . . . 9 THR QG2 . 26780 1 119 . 1 1 12 12 THR CA C 13 58.392 0.300 . 1 . . . . 9 THR CA . 26780 1 120 . 1 1 12 12 THR CB C 13 70.614 0.300 . 1 . . . . 9 THR CB . 26780 1 121 . 1 1 12 12 THR CG2 C 13 20.928 0.300 . 1 . . . . 9 THR CG2 . 26780 1 122 . 1 1 12 12 THR N N 15 112.042 0.200 . 1 . . . . 9 THR N . 26780 1 123 . 1 1 13 13 PRO HA H 1 4.274 0.020 . 1 . . . . 10 PRO HA . 26780 1 124 . 1 1 13 13 PRO HB2 H 1 1.759 0.020 . 2 . . . . 10 PRO HB2 . 26780 1 125 . 1 1 13 13 PRO HB3 H 1 1.759 0.020 . 2 . . . . 10 PRO HB3 . 26780 1 126 . 1 1 13 13 PRO HG2 H 1 1.839 0.020 . 2 . . . . 10 PRO HG2 . 26780 1 127 . 1 1 13 13 PRO HG3 H 1 1.839 0.020 . 2 . . . . 10 PRO HG3 . 26780 1 128 . 1 1 13 13 PRO HD2 H 1 3.500 0.020 . 2 . . . . 10 PRO HD2 . 26780 1 129 . 1 1 13 13 PRO HD3 H 1 3.500 0.020 . 2 . . . . 10 PRO HD3 . 26780 1 130 . 1 1 13 13 PRO C C 13 176.620 0.300 . 1 . . . . 10 PRO C . 26780 1 131 . 1 1 13 13 PRO CA C 13 62.904 0.300 . 1 . . . . 10 PRO CA . 26780 1 132 . 1 1 13 13 PRO CB C 13 32.067 0.300 . 1 . . . . 10 PRO CB . 26780 1 133 . 1 1 13 13 PRO CG C 13 27.311 0.300 . 1 . . . . 10 PRO CG . 26780 1 134 . 1 1 13 13 PRO CD C 13 51.124 0.300 . 1 . . . . 10 PRO CD . 26780 1 135 . 1 1 14 14 GLN H H 1 8.851 0.020 . 1 . . . . 11 GLN H . 26780 1 136 . 1 1 14 14 GLN HA H 1 4.357 0.020 . 1 . . . . 11 GLN HA . 26780 1 137 . 1 1 14 14 GLN HB2 H 1 1.777 0.020 . 2 . . . . 11 GLN HB2 . 26780 1 138 . 1 1 14 14 GLN HB3 H 1 1.991 0.020 . 2 . . . . 11 GLN HB3 . 26780 1 139 . 1 1 14 14 GLN HG2 H 1 2.314 0.020 . 2 . . . . 11 GLN HG2 . 26780 1 140 . 1 1 14 14 GLN HG3 H 1 2.314 0.020 . 2 . . . . 11 GLN HG3 . 26780 1 141 . 1 1 14 14 GLN C C 13 174.892 0.300 . 1 . . . . 11 GLN C . 26780 1 142 . 1 1 14 14 GLN CA C 13 55.098 0.300 . 1 . . . . 11 GLN CA . 26780 1 143 . 1 1 14 14 GLN CB C 13 31.425 0.300 . 1 . . . . 11 GLN CB . 26780 1 144 . 1 1 14 14 GLN CG C 13 34.666 0.300 . 1 . . . . 11 GLN CG . 26780 1 145 . 1 1 14 14 GLN N N 15 121.994 0.200 . 1 . . . . 11 GLN N . 26780 1 146 . 1 1 15 15 GLN H H 1 8.312 0.020 . 1 . . . . 12 GLN H . 26780 1 147 . 1 1 15 15 GLN HA H 1 5.373 0.020 . 1 . . . . 12 GLN HA . 26780 1 148 . 1 1 15 15 GLN HB2 H 1 1.754 0.020 . 2 . . . . 12 GLN HB2 . 26780 1 149 . 1 1 15 15 GLN HG2 H 1 2.099 0.020 . 2 . . . . 12 GLN HG2 . 26780 1 150 . 1 1 15 15 GLN HG3 H 1 2.099 0.020 . 2 . . . . 12 GLN HG3 . 26780 1 151 . 1 1 15 15 GLN C C 13 175.946 0.300 . 1 . . . . 12 GLN C . 26780 1 152 . 1 1 15 15 GLN CA C 13 54.177 0.300 . 1 . . . . 12 GLN CA . 26780 1 153 . 1 1 15 15 GLN CB C 13 31.891 0.300 . 1 . . . . 12 GLN CB . 26780 1 154 . 1 1 15 15 GLN CG C 13 33.913 0.300 . 1 . . . . 12 GLN CG . 26780 1 155 . 1 1 15 15 GLN N N 15 120.325 0.200 . 1 . . . . 12 GLN N . 26780 1 156 . 1 1 16 16 GLY H H 1 8.670 0.020 . 1 . . . . 13 GLY H . 26780 1 157 . 1 1 16 16 GLY HA2 H 1 3.526 0.020 . 2 . . . . 13 GLY HA2 . 26780 1 158 . 1 1 16 16 GLY HA3 H 1 4.686 0.020 . 2 . . . . 13 GLY HA3 . 26780 1 159 . 1 1 16 16 GLY C C 13 170.865 0.300 . 1 . . . . 13 GLY C . 26780 1 160 . 1 1 16 16 GLY CA C 13 45.503 0.300 . 1 . . . . 13 GLY CA . 26780 1 161 . 1 1 16 16 GLY N N 15 108.028 0.200 . 1 . . . . 13 GLY N . 26780 1 162 . 1 1 17 17 SER H H 1 8.703 0.020 . 1 . . . . 14 SER H . 26780 1 163 . 1 1 17 17 SER HA H 1 4.771 0.020 . 1 . . . . 14 SER HA . 26780 1 164 . 1 1 17 17 SER HB2 H 1 3.676 0.020 . 2 . . . . 14 SER HB2 . 26780 1 165 . 1 1 17 17 SER HB3 H 1 3.730 0.020 . 2 . . . . 14 SER HB3 . 26780 1 166 . 1 1 17 17 SER C C 13 172.772 0.300 . 1 . . . . 14 SER C . 26780 1 167 . 1 1 17 17 SER CA C 13 56.480 0.300 . 1 . . . . 14 SER CA . 26780 1 168 . 1 1 17 17 SER CB C 13 64.979 0.300 . 1 . . . . 14 SER CB . 26780 1 169 . 1 1 17 17 SER N N 15 115.172 0.200 . 1 . . . . 14 SER N . 26780 1 170 . 1 1 18 18 ILE H H 1 8.261 0.020 . 1 . . . . 15 ILE H . 26780 1 171 . 1 1 18 18 ILE HA H 1 4.842 0.020 . 1 . . . . 15 ILE HA . 26780 1 172 . 1 1 18 18 ILE HB H 1 0.390 0.020 . 1 . . . . 15 ILE HB . 26780 1 173 . 1 1 18 18 ILE HG12 H 1 0.050 0.020 . 2 . . . . 15 ILE HG12 . 26780 1 174 . 1 1 18 18 ILE HG13 H 1 0.680 0.020 . 2 . . . . 15 ILE HG13 . 26780 1 175 . 1 1 18 18 ILE HG21 H 1 -0.420 0.020 . 1 . . . . 15 ILE QG2 . 26780 1 176 . 1 1 18 18 ILE HG22 H 1 -0.420 0.020 . 1 . . . . 15 ILE QG2 . 26780 1 177 . 1 1 18 18 ILE HG23 H 1 -0.420 0.020 . 1 . . . . 15 ILE QG2 . 26780 1 178 . 1 1 18 18 ILE HD11 H 1 -0.350 0.020 . 1 . . . . 15 ILE QD1 . 26780 1 179 . 1 1 18 18 ILE HD12 H 1 -0.350 0.020 . 1 . . . . 15 ILE QD1 . 26780 1 180 . 1 1 18 18 ILE HD13 H 1 -0.350 0.020 . 1 . . . . 15 ILE QD1 . 26780 1 181 . 1 1 18 18 ILE CA C 13 59.404 0.300 . 1 . . . . 15 ILE CA . 26780 1 182 . 1 1 18 18 ILE CB C 13 41.100 0.300 . 1 . . . . 15 ILE CB . 26780 1 183 . 1 1 18 18 ILE CG1 C 13 28.500 0.300 . 1 . . . . 15 ILE CG1 . 26780 1 184 . 1 1 18 18 ILE CG2 C 13 15.200 0.300 . 1 . . . . 15 ILE CG2 . 26780 1 185 . 1 1 18 18 ILE CD1 C 13 12.900 0.300 . 1 . . . . 15 ILE CD1 . 26780 1 186 . 1 1 18 18 ILE N N 15 121.946 0.200 . 1 . . . . 15 ILE N . 26780 1 187 . 1 1 19 19 GLN HA H 1 4.280 0.020 . 1 . . . . 16 GLN HA . 26780 1 188 . 1 1 19 19 GLN HB2 H 1 2.170 0.020 . 2 . . . . 16 GLN HB2 . 26780 1 189 . 1 1 19 19 GLN HB3 H 1 2.170 0.020 . 2 . . . . 16 GLN HB3 . 26780 1 190 . 1 1 19 19 GLN HG2 H 1 1.750 0.020 . 2 . . . . 16 GLN HG2 . 26780 1 191 . 1 1 19 19 GLN HG3 H 1 1.830 0.020 . 2 . . . . 16 GLN HG3 . 26780 1 192 . 1 1 19 19 GLN C C 13 176.897 0.300 . 1 . . . . 16 GLN C . 26780 1 193 . 1 1 19 19 GLN CA C 13 63.100 0.300 . 1 . . . . 16 GLN CA . 26780 1 194 . 1 1 19 19 GLN CB C 13 32.000 0.300 . 1 . . . . 16 GLN CB . 26780 1 195 . 1 1 19 19 GLN CG C 13 27.200 0.300 . 1 . . . . 16 GLN CG . 26780 1 196 . 1 1 20 20 ASP H H 1 8.440 0.020 . 1 . . . . 17 ASP H . 26780 1 197 . 1 1 20 20 ASP HA H 1 4.140 0.020 . 1 . . . . 17 ASP HA . 26780 1 198 . 1 1 20 20 ASP HB2 H 1 2.660 0.020 . 2 . . . . 17 ASP HB2 . 26780 1 199 . 1 1 20 20 ASP HB3 H 1 1.680 0.020 . 2 . . . . 17 ASP HB3 . 26780 1 200 . 1 1 20 20 ASP CA C 13 55.800 0.300 . 1 . . . . 17 ASP CA . 26780 1 201 . 1 1 20 20 ASP CB C 13 29.600 0.300 . 1 . . . . 17 ASP CB . 26780 1 202 . 1 1 20 20 ASP N N 15 120.800 0.200 . 1 . . . . 17 ASP N . 26780 1 203 . 1 1 21 21 ILE HA H 1 3.884 0.020 . 1 . . . . 18 ILE HA . 26780 1 204 . 1 1 21 21 ILE HB H 1 1.700 0.020 . 1 . . . . 18 ILE HB . 26780 1 205 . 1 1 21 21 ILE HG12 H 1 1.060 0.020 . 2 . . . . 18 ILE HG12 . 26780 1 206 . 1 1 21 21 ILE HG13 H 1 1.160 0.020 . 2 . . . . 18 ILE HG13 . 26780 1 207 . 1 1 21 21 ILE HG21 H 1 0.700 0.020 . 1 . . . . 18 ILE QG2 . 26780 1 208 . 1 1 21 21 ILE HG22 H 1 0.700 0.020 . 1 . . . . 18 ILE QG2 . 26780 1 209 . 1 1 21 21 ILE HG23 H 1 0.700 0.020 . 1 . . . . 18 ILE QG2 . 26780 1 210 . 1 1 21 21 ILE HD11 H 1 0.740 0.020 . 1 . . . . 18 ILE QD1 . 26780 1 211 . 1 1 21 21 ILE HD12 H 1 0.740 0.020 . 1 . . . . 18 ILE QD1 . 26780 1 212 . 1 1 21 21 ILE HD13 H 1 0.740 0.020 . 1 . . . . 18 ILE QD1 . 26780 1 213 . 1 1 21 21 ILE C C 13 175.507 0.300 . 1 . . . . 18 ILE C . 26780 1 214 . 1 1 21 21 ILE CA C 13 63.041 0.300 . 1 . . . . 18 ILE CA . 26780 1 215 . 1 1 21 21 ILE CB C 13 38.482 0.300 . 1 . . . . 18 ILE CB . 26780 1 216 . 1 1 21 21 ILE CG1 C 13 26.900 0.300 . 1 . . . . 18 ILE CG1 . 26780 1 217 . 1 1 21 21 ILE CG2 C 13 18.100 0.300 . 1 . . . . 18 ILE CG2 . 26780 1 218 . 1 1 21 21 ILE CD1 C 13 14.200 0.300 . 1 . . . . 18 ILE CD1 . 26780 1 219 . 1 1 22 22 ASN H H 1 8.099 0.020 . 1 . . . . 19 ASN H . 26780 1 220 . 1 1 22 22 ASN HA H 1 4.622 0.020 . 1 . . . . 19 ASN HA . 26780 1 221 . 1 1 22 22 ASN HB2 H 1 2.894 0.020 . 2 . . . . 19 ASN HB2 . 26780 1 222 . 1 1 22 22 ASN HB3 H 1 2.544 0.020 . 2 . . . . 19 ASN HB3 . 26780 1 223 . 1 1 22 22 ASN C C 13 174.192 0.300 . 1 . . . . 19 ASN C . 26780 1 224 . 1 1 22 22 ASN CA C 13 53.095 0.300 . 1 . . . . 19 ASN CA . 26780 1 225 . 1 1 22 22 ASN CB C 13 38.772 0.300 . 1 . . . . 19 ASN CB . 26780 1 226 . 1 1 22 22 ASN N N 15 119.456 0.200 . 1 . . . . 19 ASN N . 26780 1 227 . 1 1 23 23 HIS H H 1 8.040 0.020 . 1 . . . . 20 HIS H . 26780 1 228 . 1 1 23 23 HIS HA H 1 4.084 0.020 . 1 . . . . 20 HIS HA . 26780 1 229 . 1 1 23 23 HIS HB2 H 1 3.453 0.020 . 2 . . . . 20 HIS HB2 . 26780 1 230 . 1 1 23 23 HIS HB3 H 1 3.241 0.020 . 2 . . . . 20 HIS HB3 . 26780 1 231 . 1 1 23 23 HIS C C 13 174.000 0.300 . 1 . . . . 20 HIS C . 26780 1 232 . 1 1 23 23 HIS CA C 13 57.234 0.300 . 1 . . . . 20 HIS CA . 26780 1 233 . 1 1 23 23 HIS CB C 13 26.568 0.300 . 1 . . . . 20 HIS CB . 26780 1 234 . 1 1 23 23 HIS N N 15 112.085 0.200 . 1 . . . . 20 HIS N . 26780 1 235 . 1 1 24 24 ARG H H 1 8.430 0.020 . 1 . . . . 21 ARG H . 26780 1 236 . 1 1 24 24 ARG HA H 1 4.599 0.020 . 1 . . . . 21 ARG HA . 26780 1 237 . 1 1 24 24 ARG HB2 H 1 2.155 0.020 . 2 . . . . 21 ARG HB2 . 26780 1 238 . 1 1 24 24 ARG HB3 H 1 1.285 0.020 . 2 . . . . 21 ARG HB3 . 26780 1 239 . 1 1 24 24 ARG HG2 H 1 1.573 0.020 . 2 . . . . 21 ARG HG2 . 26780 1 240 . 1 1 24 24 ARG HG3 H 1 1.573 0.020 . 2 . . . . 21 ARG HG3 . 26780 1 241 . 1 1 24 24 ARG HD2 H 1 3.080 0.020 . 2 . . . . 21 ARG HD2 . 26780 1 242 . 1 1 24 24 ARG HD3 H 1 3.080 0.020 . 2 . . . . 21 ARG HD3 . 26780 1 243 . 1 1 24 24 ARG C C 13 176.615 0.300 . 1 . . . . 21 ARG C . 26780 1 244 . 1 1 24 24 ARG CA C 13 55.948 0.300 . 1 . . . . 21 ARG CA . 26780 1 245 . 1 1 24 24 ARG CB C 13 30.905 0.300 . 1 . . . . 21 ARG CB . 26780 1 246 . 1 1 24 24 ARG CG C 13 27.532 0.300 . 1 . . . . 21 ARG CG . 26780 1 247 . 1 1 24 24 ARG CD C 13 43.367 0.300 . 1 . . . . 21 ARG CD . 26780 1 248 . 1 1 24 24 ARG N N 15 118.572 0.200 . 1 . . . . 21 ARG N . 26780 1 249 . 1 1 25 25 VAL H H 1 8.964 0.020 . 1 . . . . 22 VAL H . 26780 1 250 . 1 1 25 25 VAL HA H 1 4.780 0.020 . 1 . . . . 22 VAL HA . 26780 1 251 . 1 1 25 25 VAL HB H 1 2.319 0.020 . 1 . . . . 22 VAL HB . 26780 1 252 . 1 1 25 25 VAL HG11 H 1 0.959 0.020 . 2 . . . . 22 VAL QG1 . 26780 1 253 . 1 1 25 25 VAL HG12 H 1 0.959 0.020 . 2 . . . . 22 VAL QG1 . 26780 1 254 . 1 1 25 25 VAL HG13 H 1 0.959 0.020 . 2 . . . . 22 VAL QG1 . 26780 1 255 . 1 1 25 25 VAL HG21 H 1 0.843 0.020 . 2 . . . . 22 VAL QG2 . 26780 1 256 . 1 1 25 25 VAL HG22 H 1 0.843 0.020 . 2 . . . . 22 VAL QG2 . 26780 1 257 . 1 1 25 25 VAL HG23 H 1 0.843 0.020 . 2 . . . . 22 VAL QG2 . 26780 1 258 . 1 1 25 25 VAL C C 13 174.826 0.300 . 1 . . . . 22 VAL C . 26780 1 259 . 1 1 25 25 VAL CA C 13 59.157 0.300 . 1 . . . . 22 VAL CA . 26780 1 260 . 1 1 25 25 VAL CB C 13 33.629 0.300 . 1 . . . . 22 VAL CB . 26780 1 261 . 1 1 25 25 VAL CG1 C 13 22.170 0.300 . 1 . . . . 22 VAL CG1 . 26780 1 262 . 1 1 25 25 VAL CG2 C 13 19.100 0.300 . 1 . . . . 22 VAL CG2 . 26780 1 263 . 1 1 25 25 VAL N N 15 118.441 0.200 . 1 . . . . 22 VAL N . 26780 1 264 . 1 1 26 26 TRP H H 1 8.378 0.020 . 1 . . . . 23 TRP H . 26780 1 265 . 1 1 26 26 TRP HA H 1 5.480 0.020 . 1 . . . . 23 TRP HA . 26780 1 266 . 1 1 26 26 TRP HB2 H 1 2.656 0.020 . 2 . . . . 23 TRP HB2 . 26780 1 267 . 1 1 26 26 TRP HB3 H 1 3.083 0.020 . 2 . . . . 23 TRP HB3 . 26780 1 268 . 1 1 26 26 TRP C C 13 175.877 0.300 . 1 . . . . 23 TRP C . 26780 1 269 . 1 1 26 26 TRP CA C 13 55.526 0.300 . 1 . . . . 23 TRP CA . 26780 1 270 . 1 1 26 26 TRP CB C 13 29.498 0.300 . 1 . . . . 23 TRP CB . 26780 1 271 . 1 1 26 26 TRP N N 15 121.703 0.200 . 1 . . . . 23 TRP N . 26780 1 272 . 1 1 27 27 VAL H H 1 9.223 0.020 . 1 . . . . 24 VAL H . 26780 1 273 . 1 1 27 27 VAL HA H 1 4.320 0.020 . 1 . . . . 24 VAL HA . 26780 1 274 . 1 1 27 27 VAL HB H 1 1.849 0.020 . 1 . . . . 24 VAL HB . 26780 1 275 . 1 1 27 27 VAL HG11 H 1 0.726 0.020 . 2 . . . . 24 VAL QG1 . 26780 1 276 . 1 1 27 27 VAL HG12 H 1 0.726 0.020 . 2 . . . . 24 VAL QG1 . 26780 1 277 . 1 1 27 27 VAL HG13 H 1 0.726 0.020 . 2 . . . . 24 VAL QG1 . 26780 1 278 . 1 1 27 27 VAL HG21 H 1 0.774 0.020 . 2 . . . . 24 VAL QG2 . 26780 1 279 . 1 1 27 27 VAL HG22 H 1 0.774 0.020 . 2 . . . . 24 VAL QG2 . 26780 1 280 . 1 1 27 27 VAL HG23 H 1 0.774 0.020 . 2 . . . . 24 VAL QG2 . 26780 1 281 . 1 1 27 27 VAL C C 13 173.003 0.300 . 1 . . . . 24 VAL C . 26780 1 282 . 1 1 27 27 VAL CA C 13 60.680 0.300 . 1 . . . . 24 VAL CA . 26780 1 283 . 1 1 27 27 VAL CB C 13 36.898 0.300 . 1 . . . . 24 VAL CB . 26780 1 284 . 1 1 27 27 VAL CG1 C 13 21.467 0.300 . 1 . . . . 24 VAL CG1 . 26780 1 285 . 1 1 27 27 VAL CG2 C 13 21.974 0.300 . 1 . . . . 24 VAL CG2 . 26780 1 286 . 1 1 27 27 VAL N N 15 120.108 0.200 . 1 . . . . 24 VAL N . 26780 1 287 . 1 1 28 28 LEU H H 1 8.201 0.020 . 1 . . . . 25 LEU H . 26780 1 288 . 1 1 28 28 LEU HA H 1 4.649 0.020 . 1 . . . . 25 LEU HA . 26780 1 289 . 1 1 28 28 LEU HB2 H 1 1.617 0.020 . 2 . . . . 25 LEU HB2 . 26780 1 290 . 1 1 28 28 LEU HB3 H 1 0.933 0.020 . 2 . . . . 25 LEU HB3 . 26780 1 291 . 1 1 28 28 LEU HG H 1 1.166 0.020 . 1 . . . . 25 LEU HG . 26780 1 292 . 1 1 28 28 LEU HD11 H 1 0.581 0.020 . 2 . . . . 25 LEU QD1 . 26780 1 293 . 1 1 28 28 LEU HD12 H 1 0.581 0.020 . 2 . . . . 25 LEU QD1 . 26780 1 294 . 1 1 28 28 LEU HD13 H 1 0.581 0.020 . 2 . . . . 25 LEU QD1 . 26780 1 295 . 1 1 28 28 LEU HD21 H 1 0.442 0.020 . 2 . . . . 25 LEU QD2 . 26780 1 296 . 1 1 28 28 LEU HD22 H 1 0.442 0.020 . 2 . . . . 25 LEU QD2 . 26780 1 297 . 1 1 28 28 LEU HD23 H 1 0.442 0.020 . 2 . . . . 25 LEU QD2 . 26780 1 298 . 1 1 28 28 LEU C C 13 175.813 0.300 . 1 . . . . 25 LEU C . 26780 1 299 . 1 1 28 28 LEU CA C 13 53.595 0.300 . 1 . . . . 25 LEU CA . 26780 1 300 . 1 1 28 28 LEU CB C 13 43.605 0.300 . 1 . . . . 25 LEU CB . 26780 1 301 . 1 1 28 28 LEU CG C 13 27.007 0.300 . 1 . . . . 25 LEU CG . 26780 1 302 . 1 1 28 28 LEU CD1 C 13 25.794 0.300 . 1 . . . . 25 LEU CD1 . 26780 1 303 . 1 1 28 28 LEU CD2 C 13 23.952 0.300 . 1 . . . . 25 LEU CD2 . 26780 1 304 . 1 1 28 28 LEU N N 15 123.976 0.200 . 1 . . . . 25 LEU N . 26780 1 305 . 1 1 29 29 GLN H H 1 8.948 0.020 . 1 . . . . 26 GLN H . 26780 1 306 . 1 1 29 29 GLN HA H 1 4.371 0.020 . 1 . . . . 26 GLN HA . 26780 1 307 . 1 1 29 29 GLN HB2 H 1 2.018 0.020 . 2 . . . . 26 GLN HB2 . 26780 1 308 . 1 1 29 29 GLN HB3 H 1 1.783 0.020 . 2 . . . . 26 GLN HB3 . 26780 1 309 . 1 1 29 29 GLN HG2 H 1 1.682 0.020 . 2 . . . . 26 GLN HG2 . 26780 1 310 . 1 1 29 29 GLN HG3 H 1 1.682 0.020 . 2 . . . . 26 GLN HG3 . 26780 1 311 . 1 1 29 29 GLN C C 13 174.747 0.300 . 1 . . . . 26 GLN C . 26780 1 312 . 1 1 29 29 GLN CA C 13 54.784 0.300 . 1 . . . . 26 GLN CA . 26780 1 313 . 1 1 29 29 GLN CB C 13 31.378 0.300 . 1 . . . . 26 GLN CB . 26780 1 314 . 1 1 29 29 GLN CG C 13 34.065 0.300 . 1 . . . . 26 GLN CG . 26780 1 315 . 1 1 29 29 GLN N N 15 128.693 0.200 . 1 . . . . 26 GLN N . 26780 1 316 . 1 1 30 30 ASP H H 1 9.192 0.020 . 1 . . . . 27 ASP H . 26780 1 317 . 1 1 30 30 ASP HA H 1 4.019 0.020 . 1 . . . . 27 ASP HA . 26780 1 318 . 1 1 30 30 ASP HB2 H 1 2.784 0.020 . 2 . . . . 27 ASP HB2 . 26780 1 319 . 1 1 30 30 ASP HB3 H 1 2.695 0.020 . 2 . . . . 27 ASP HB3 . 26780 1 320 . 1 1 30 30 ASP CA C 13 56.702 0.300 . 1 . . . . 27 ASP CA . 26780 1 321 . 1 1 30 30 ASP CB C 13 39.088 0.300 . 1 . . . . 27 ASP CB . 26780 1 322 . 1 1 30 30 ASP N N 15 127.216 0.200 . 1 . . . . 27 ASP N . 26780 1 323 . 1 1 31 31 GLN HA H 1 3.901 0.020 . 1 . . . . 28 GLN HA . 26780 1 324 . 1 1 31 31 GLN HB2 H 1 2.270 0.020 . 2 . . . . 28 GLN HB2 . 26780 1 325 . 1 1 31 31 GLN HB3 H 1 1.930 0.020 . 2 . . . . 28 GLN HB3 . 26780 1 326 . 1 1 31 31 GLN HG2 H 1 2.189 0.020 . 2 . . . . 28 GLN HG2 . 26780 1 327 . 1 1 31 31 GLN HG3 H 1 2.189 0.020 . 2 . . . . 28 GLN HG3 . 26780 1 328 . 1 1 31 31 GLN C C 13 173.854 0.300 . 1 . . . . 28 GLN C . 26780 1 329 . 1 1 31 31 GLN CA C 13 56.354 0.300 . 1 . . . . 28 GLN CA . 26780 1 330 . 1 1 31 31 GLN CB C 13 28.387 0.300 . 1 . . . . 28 GLN CB . 26780 1 331 . 1 1 31 31 GLN CG C 13 34.700 0.300 . 1 . . . . 28 GLN CG . 26780 1 332 . 1 1 32 32 THR H H 1 7.695 0.020 . 1 . . . . 29 THR H . 26780 1 333 . 1 1 32 32 THR HA H 1 4.384 0.020 . 1 . . . . 29 THR HA . 26780 1 334 . 1 1 32 32 THR HB H 1 3.974 0.020 . 1 . . . . 29 THR HB . 26780 1 335 . 1 1 32 32 THR HG21 H 1 1.083 0.020 . 1 . . . . 29 THR QG2 . 26780 1 336 . 1 1 32 32 THR HG22 H 1 1.083 0.020 . 1 . . . . 29 THR QG2 . 26780 1 337 . 1 1 32 32 THR HG23 H 1 1.083 0.020 . 1 . . . . 29 THR QG2 . 26780 1 338 . 1 1 32 32 THR C C 13 172.110 0.300 . 1 . . . . 29 THR C . 26780 1 339 . 1 1 32 32 THR CA C 13 61.101 0.300 . 1 . . . . 29 THR CA . 26780 1 340 . 1 1 32 32 THR CB C 13 71.700 0.300 . 1 . . . . 29 THR CB . 26780 1 341 . 1 1 32 32 THR CG2 C 13 21.175 0.300 . 1 . . . . 29 THR CG2 . 26780 1 342 . 1 1 32 32 THR N N 15 114.448 0.200 . 1 . . . . 29 THR N . 26780 1 343 . 1 1 33 33 LEU H H 1 8.581 0.020 . 1 . . . . 30 LEU H . 26780 1 344 . 1 1 33 33 LEU HA H 1 4.831 0.020 . 1 . . . . 30 LEU HA . 26780 1 345 . 1 1 33 33 LEU HB2 H 1 1.188 0.020 . 2 . . . . 30 LEU HB2 . 26780 1 346 . 1 1 33 33 LEU HB3 H 1 0.900 0.020 . 2 . . . . 30 LEU HB3 . 26780 1 347 . 1 1 33 33 LEU HG H 1 1.227 0.020 . 1 . . . . 30 LEU HG . 26780 1 348 . 1 1 33 33 LEU HD11 H 1 0.507 0.020 . 2 . . . . 30 LEU QD1 . 26780 1 349 . 1 1 33 33 LEU HD12 H 1 0.507 0.020 . 2 . . . . 30 LEU QD1 . 26780 1 350 . 1 1 33 33 LEU HD13 H 1 0.507 0.020 . 2 . . . . 30 LEU QD1 . 26780 1 351 . 1 1 33 33 LEU HD21 H 1 0.878 0.020 . 2 . . . . 30 LEU QD2 . 26780 1 352 . 1 1 33 33 LEU HD22 H 1 0.878 0.020 . 2 . . . . 30 LEU QD2 . 26780 1 353 . 1 1 33 33 LEU HD23 H 1 0.878 0.020 . 2 . . . . 30 LEU QD2 . 26780 1 354 . 1 1 33 33 LEU C C 13 175.570 0.300 . 1 . . . . 30 LEU C . 26780 1 355 . 1 1 33 33 LEU CA C 13 53.990 0.300 . 1 . . . . 30 LEU CA . 26780 1 356 . 1 1 33 33 LEU CB C 13 43.609 0.300 . 1 . . . . 30 LEU CB . 26780 1 357 . 1 1 33 33 LEU CG C 13 26.792 0.300 . 1 . . . . 30 LEU CG . 26780 1 358 . 1 1 33 33 LEU CD1 C 13 24.801 0.300 . 1 . . . . 30 LEU CD1 . 26780 1 359 . 1 1 33 33 LEU CD2 C 13 25.897 0.300 . 1 . . . . 30 LEU CD2 . 26780 1 360 . 1 1 33 33 LEU N N 15 125.667 0.200 . 1 . . . . 30 LEU N . 26780 1 361 . 1 1 34 34 ILE H H 1 8.776 0.020 . 1 . . . . 31 ILE H . 26780 1 362 . 1 1 34 34 ILE HA H 1 4.664 0.020 . 1 . . . . 31 ILE HA . 26780 1 363 . 1 1 34 34 ILE HB H 1 1.667 0.020 . 1 . . . . 31 ILE HB . 26780 1 364 . 1 1 34 34 ILE HG12 H 1 1.028 0.020 . 2 . . . . 31 ILE HG12 . 26780 1 365 . 1 1 34 34 ILE HG13 H 1 1.686 0.020 . 2 . . . . 31 ILE HG13 . 26780 1 366 . 1 1 34 34 ILE HG21 H 1 0.574 0.020 . 1 . . . . 31 ILE QG2 . 26780 1 367 . 1 1 34 34 ILE HG22 H 1 0.574 0.020 . 1 . . . . 31 ILE QG2 . 26780 1 368 . 1 1 34 34 ILE HG23 H 1 0.574 0.020 . 1 . . . . 31 ILE QG2 . 26780 1 369 . 1 1 34 34 ILE HD11 H 1 0.546 0.020 . 1 . . . . 31 ILE QD1 . 26780 1 370 . 1 1 34 34 ILE HD12 H 1 0.546 0.020 . 1 . . . . 31 ILE QD1 . 26780 1 371 . 1 1 34 34 ILE HD13 H 1 0.546 0.020 . 1 . . . . 31 ILE QD1 . 26780 1 372 . 1 1 34 34 ILE C C 13 172.839 0.300 . 1 . . . . 31 ILE C . 26780 1 373 . 1 1 34 34 ILE CA C 13 59.271 0.300 . 1 . . . . 31 ILE CA . 26780 1 374 . 1 1 34 34 ILE CB C 13 41.180 0.300 . 1 . . . . 31 ILE CB . 26780 1 375 . 1 1 34 34 ILE CG1 C 13 26.125 0.300 . 1 . . . . 31 ILE CG1 . 26780 1 376 . 1 1 34 34 ILE CG2 C 13 17.073 0.300 . 1 . . . . 31 ILE CG2 . 26780 1 377 . 1 1 34 34 ILE CD1 C 13 13.646 0.300 . 1 . . . . 31 ILE CD1 . 26780 1 378 . 1 1 34 34 ILE N N 15 120.661 0.200 . 1 . . . . 31 ILE N . 26780 1 379 . 1 1 35 35 ALA H H 1 7.969 0.020 . 1 . . . . 32 ALA H . 26780 1 380 . 1 1 35 35 ALA HA H 1 5.594 0.020 . 1 . . . . 32 ALA HA . 26780 1 381 . 1 1 35 35 ALA HB1 H 1 1.165 0.020 . 1 . . . . 32 ALA QB . 26780 1 382 . 1 1 35 35 ALA HB2 H 1 1.165 0.020 . 1 . . . . 32 ALA QB . 26780 1 383 . 1 1 35 35 ALA HB3 H 1 1.165 0.020 . 1 . . . . 32 ALA QB . 26780 1 384 . 1 1 35 35 ALA C C 13 176.828 0.300 . 1 . . . . 32 ALA C . 26780 1 385 . 1 1 35 35 ALA CA C 13 49.716 0.300 . 1 . . . . 32 ALA CA . 26780 1 386 . 1 1 35 35 ALA CB C 13 22.359 0.300 . 1 . . . . 32 ALA CB . 26780 1 387 . 1 1 35 35 ALA N N 15 122.862 0.200 . 1 . . . . 32 ALA N . 26780 1 388 . 1 1 36 36 VAL H H 1 8.862 0.020 . 1 . . . . 33 VAL H . 26780 1 389 . 1 1 36 36 VAL HA H 1 4.790 0.020 . 1 . . . . 33 VAL HA . 26780 1 390 . 1 1 36 36 VAL HB H 1 2.028 0.020 . 1 . . . . 33 VAL HB . 26780 1 391 . 1 1 36 36 VAL HG11 H 1 0.841 0.020 . 2 . . . . 33 VAL QG1 . 26780 1 392 . 1 1 36 36 VAL HG12 H 1 0.841 0.020 . 2 . . . . 33 VAL QG1 . 26780 1 393 . 1 1 36 36 VAL HG13 H 1 0.841 0.020 . 2 . . . . 33 VAL QG1 . 26780 1 394 . 1 1 36 36 VAL HG21 H 1 0.723 0.020 . 2 . . . . 33 VAL QG2 . 26780 1 395 . 1 1 36 36 VAL HG22 H 1 0.723 0.020 . 2 . . . . 33 VAL QG2 . 26780 1 396 . 1 1 36 36 VAL HG23 H 1 0.723 0.020 . 2 . . . . 33 VAL QG2 . 26780 1 397 . 1 1 36 36 VAL CA C 13 57.560 0.300 . 1 . . . . 33 VAL CA . 26780 1 398 . 1 1 36 36 VAL CB C 13 34.622 0.300 . 1 . . . . 33 VAL CB . 26780 1 399 . 1 1 36 36 VAL CG1 C 13 21.859 0.300 . 1 . . . . 33 VAL CG1 . 26780 1 400 . 1 1 36 36 VAL CG2 C 13 19.937 0.300 . 1 . . . . 33 VAL CG2 . 26780 1 401 . 1 1 36 36 VAL N N 15 117.506 0.200 . 1 . . . . 33 VAL N . 26780 1 402 . 1 1 37 37 PRO HA H 1 4.302 0.020 . 1 . . . . 34 PRO HA . 26780 1 403 . 1 1 37 37 PRO HB2 H 1 1.976 0.020 . 2 . . . . 34 PRO HB2 . 26780 1 404 . 1 1 37 37 PRO HB3 H 1 2.074 0.020 . 2 . . . . 34 PRO HB3 . 26780 1 405 . 1 1 37 37 PRO HG2 H 1 1.784 0.020 . 2 . . . . 34 PRO HG2 . 26780 1 406 . 1 1 37 37 PRO HG3 H 1 2.035 0.020 . 2 . . . . 34 PRO HG3 . 26780 1 407 . 1 1 37 37 PRO HD2 H 1 2.725 0.020 . 2 . . . . 34 PRO HD2 . 26780 1 408 . 1 1 37 37 PRO HD3 H 1 3.311 0.020 . 2 . . . . 34 PRO HD3 . 26780 1 409 . 1 1 37 37 PRO C C 13 174.924 0.300 . 1 . . . . 34 PRO C . 26780 1 410 . 1 1 37 37 PRO CA C 13 55.149 0.300 . 1 . . . . 34 PRO CA . 26780 1 411 . 1 1 37 37 PRO CB C 13 26.845 0.300 . 1 . . . . 34 PRO CB . 26780 1 412 . 1 1 37 37 PRO CG C 13 31.740 0.300 . 1 . . . . 34 PRO CG . 26780 1 413 . 1 1 37 37 PRO CD C 13 51.107 0.300 . 1 . . . . 34 PRO CD . 26780 1 414 . 1 1 38 38 ARG H H 1 8.452 0.020 . 1 . . . . 35 ARG H . 26780 1 415 . 1 1 38 38 ARG HA H 1 4.093 0.020 . 1 . . . . 35 ARG HA . 26780 1 416 . 1 1 38 38 ARG HB2 H 1 3.010 0.020 . 2 . . . . 35 ARG HB2 . 26780 1 417 . 1 1 38 38 ARG HB3 H 1 2.978 0.020 . 2 . . . . 35 ARG HB3 . 26780 1 418 . 1 1 38 38 ARG HG2 H 1 3.018 0.020 . 2 . . . . 35 ARG HG2 . 26780 1 419 . 1 1 38 38 ARG HG3 H 1 3.018 0.020 . 2 . . . . 35 ARG HG3 . 26780 1 420 . 1 1 38 38 ARG HD2 H 1 2.822 0.020 . 2 . . . . 35 ARG HD2 . 26780 1 421 . 1 1 38 38 ARG HD3 H 1 2.822 0.020 . 2 . . . . 35 ARG HD3 . 26780 1 422 . 1 1 38 38 ARG C C 13 172.915 0.300 . 1 . . . . 35 ARG C . 26780 1 423 . 1 1 38 38 ARG CA C 13 56.945 0.300 . 1 . . . . 35 ARG CA . 26780 1 424 . 1 1 38 38 ARG CB C 13 30.279 0.300 . 1 . . . . 35 ARG CB . 26780 1 425 . 1 1 38 38 ARG CG C 13 26.978 0.300 . 1 . . . . 35 ARG CG . 26780 1 426 . 1 1 38 38 ARG CD C 13 43.059 0.300 . 1 . . . . 35 ARG CD . 26780 1 427 . 1 1 38 38 ARG N N 15 122.853 0.200 . 1 . . . . 35 ARG N . 26780 1 428 . 1 1 39 39 LYS H H 1 7.951 0.020 . 1 . . . . 36 LYS H . 26780 1 429 . 1 1 39 39 LYS HA H 1 4.327 0.020 . 1 . . . . 36 LYS HA . 26780 1 430 . 1 1 39 39 LYS HB2 H 1 1.778 0.020 . 2 . . . . 36 LYS HB2 . 26780 1 431 . 1 1 39 39 LYS HB3 H 1 1.662 0.020 . 2 . . . . 36 LYS HB3 . 26780 1 432 . 1 1 39 39 LYS HG2 H 1 1.312 0.020 . 2 . . . . 36 LYS HG2 . 26780 1 433 . 1 1 39 39 LYS HD2 H 1 1.562 0.020 . 2 . . . . 36 LYS HD2 . 26780 1 434 . 1 1 39 39 LYS HE2 H 1 2.862 0.020 . 2 . . . . 36 LYS HE2 . 26780 1 435 . 1 1 39 39 LYS C C 13 175.814 0.300 . 1 . . . . 36 LYS C . 26780 1 436 . 1 1 39 39 LYS CA C 13 55.825 0.300 . 1 . . . . 36 LYS CA . 26780 1 437 . 1 1 39 39 LYS CB C 13 33.965 0.300 . 1 . . . . 36 LYS CB . 26780 1 438 . 1 1 39 39 LYS CG C 13 24.223 0.300 . 1 . . . . 36 LYS CG . 26780 1 439 . 1 1 39 39 LYS CD C 13 28.938 0.300 . 1 . . . . 36 LYS CD . 26780 1 440 . 1 1 39 39 LYS CE C 13 41.945 0.300 . 1 . . . . 36 LYS CE . 26780 1 441 . 1 1 39 39 LYS N N 15 121.855 0.200 . 1 . . . . 36 LYS N . 26780 1 442 . 1 1 40 40 ASP H H 1 8.158 0.020 . 1 . . . . 37 ASP H . 26780 1 443 . 1 1 40 40 ASP HA H 1 4.335 0.020 . 1 . . . . 37 ASP HA . 26780 1 444 . 1 1 40 40 ASP HB2 H 1 2.557 0.020 . 2 . . . . 37 ASP HB2 . 26780 1 445 . 1 1 40 40 ASP C C 13 176.162 0.300 . 1 . . . . 37 ASP C . 26780 1 446 . 1 1 40 40 ASP CA C 13 55.834 0.300 . 1 . . . . 37 ASP CA . 26780 1 447 . 1 1 40 40 ASP CB C 13 40.802 0.300 . 1 . . . . 37 ASP CB . 26780 1 448 . 1 1 40 40 ASP N N 15 120.650 0.200 . 1 . . . . 37 ASP N . 26780 1 449 . 1 1 41 41 ARG H H 1 8.171 0.020 . 1 . . . . 38 ARG H . 26780 1 450 . 1 1 41 41 ARG HA H 1 4.013 0.020 . 1 . . . . 38 ARG HA . 26780 1 451 . 1 1 41 41 ARG HB2 H 1 1.808 0.020 . 2 . . . . 38 ARG HB2 . 26780 1 452 . 1 1 41 41 ARG HG2 H 1 1.460 0.020 . 2 . . . . 38 ARG HG2 . 26780 1 453 . 1 1 41 41 ARG HD2 H 1 3.086 0.020 . 2 . . . . 38 ARG HD2 . 26780 1 454 . 1 1 41 41 ARG C C 13 175.336 0.300 . 1 . . . . 38 ARG C . 26780 1 455 . 1 1 41 41 ARG CA C 13 56.787 0.300 . 1 . . . . 38 ARG CA . 26780 1 456 . 1 1 41 41 ARG CB C 13 28.345 0.300 . 1 . . . . 38 ARG CB . 26780 1 457 . 1 1 41 41 ARG CG C 13 27.139 0.300 . 1 . . . . 38 ARG CG . 26780 1 458 . 1 1 41 41 ARG CD C 13 42.959 0.300 . 1 . . . . 38 ARG CD . 26780 1 459 . 1 1 41 41 ARG N N 15 115.937 0.200 . 1 . . . . 38 ARG N . 26780 1 460 . 1 1 42 42 MET H H 1 7.897 0.020 . 1 . . . . 39 MET H . 26780 1 461 . 1 1 42 42 MET HA H 1 4.433 0.020 . 1 . . . . 39 MET HA . 26780 1 462 . 1 1 42 42 MET HB2 H 1 1.906 0.020 . 2 . . . . 39 MET HB2 . 26780 1 463 . 1 1 42 42 MET HG2 H 1 2.346 0.020 . 2 . . . . 39 MET HG2 . 26780 1 464 . 1 1 42 42 MET HE1 H 1 1.780 0.020 . 1 . . . . 39 MET QE . 26780 1 465 . 1 1 42 42 MET HE2 H 1 1.780 0.020 . 1 . . . . 39 MET QE . 26780 1 466 . 1 1 42 42 MET HE3 H 1 1.780 0.020 . 1 . . . . 39 MET QE . 26780 1 467 . 1 1 42 42 MET C C 13 175.503 0.300 . 1 . . . . 39 MET C . 26780 1 468 . 1 1 42 42 MET CA C 13 55.125 0.300 . 1 . . . . 39 MET CA . 26780 1 469 . 1 1 42 42 MET CB C 13 34.062 0.300 . 1 . . . . 39 MET CB . 26780 1 470 . 1 1 42 42 MET CG C 13 31.722 0.300 . 1 . . . . 39 MET CG . 26780 1 471 . 1 1 42 42 MET CE C 13 16.570 0.300 . 1 . . . . 39 MET CE . 26780 1 472 . 1 1 42 42 MET N N 15 119.122 0.200 . 1 . . . . 39 MET N . 26780 1 473 . 1 1 43 43 SER H H 1 8.594 0.020 . 1 . . . . 40 SER H . 26780 1 474 . 1 1 43 43 SER HA H 1 4.768 0.020 . 1 . . . . 40 SER HA . 26780 1 475 . 1 1 43 43 SER HB2 H 1 3.641 0.020 . 2 . . . . 40 SER HB2 . 26780 1 476 . 1 1 43 43 SER HB3 H 1 3.796 0.020 . 2 . . . . 40 SER HB3 . 26780 1 477 . 1 1 43 43 SER CA C 13 55.489 0.300 . 1 . . . . 40 SER CA . 26780 1 478 . 1 1 43 43 SER CB C 13 63.233 0.300 . 1 . . . . 40 SER CB . 26780 1 479 . 1 1 43 43 SER N N 15 118.549 0.200 . 1 . . . . 40 SER N . 26780 1 480 . 1 1 44 44 PRO HA H 1 3.479 0.020 . 1 . . . . 41 PRO HA . 26780 1 481 . 1 1 44 44 PRO HB2 H 1 1.213 0.020 . 2 . . . . 41 PRO HB2 . 26780 1 482 . 1 1 44 44 PRO HB3 H 1 1.650 0.020 . 2 . . . . 41 PRO HB3 . 26780 1 483 . 1 1 44 44 PRO HG2 H 1 0.829 0.020 . 2 . . . . 41 PRO HG2 . 26780 1 484 . 1 1 44 44 PRO HG3 H 1 1.438 0.020 . 2 . . . . 41 PRO HG3 . 26780 1 485 . 1 1 44 44 PRO HD2 H 1 3.720 0.020 . 2 . . . . 41 PRO HD2 . 26780 1 486 . 1 1 44 44 PRO HD3 H 1 3.930 0.020 . 2 . . . . 41 PRO HD3 . 26780 1 487 . 1 1 44 44 PRO C C 13 178.129 0.300 . 1 . . . . 41 PRO C . 26780 1 488 . 1 1 44 44 PRO CA C 13 61.965 0.300 . 1 . . . . 41 PRO CA . 26780 1 489 . 1 1 44 44 PRO CB C 13 32.002 0.300 . 1 . . . . 41 PRO CB . 26780 1 490 . 1 1 44 44 PRO CG C 13 27.083 0.300 . 1 . . . . 41 PRO CG . 26780 1 491 . 1 1 44 44 PRO CD C 13 50.727 0.300 . 1 . . . . 41 PRO CD . 26780 1 492 . 1 1 45 45 VAL H H 1 8.802 0.020 . 1 . . . . 42 VAL H . 26780 1 493 . 1 1 45 45 VAL HA H 1 4.602 0.020 . 1 . . . . 42 VAL HA . 26780 1 494 . 1 1 45 45 VAL HB H 1 2.148 0.020 . 1 . . . . 42 VAL HB . 26780 1 495 . 1 1 45 45 VAL HG11 H 1 0.871 0.020 . 2 . . . . 42 VAL QG1 . 26780 1 496 . 1 1 45 45 VAL HG12 H 1 0.871 0.020 . 2 . . . . 42 VAL QG1 . 26780 1 497 . 1 1 45 45 VAL HG13 H 1 0.871 0.020 . 2 . . . . 42 VAL QG1 . 26780 1 498 . 1 1 45 45 VAL HG21 H 1 0.897 0.020 . 2 . . . . 42 VAL QG2 . 26780 1 499 . 1 1 45 45 VAL HG22 H 1 0.897 0.020 . 2 . . . . 42 VAL QG2 . 26780 1 500 . 1 1 45 45 VAL HG23 H 1 0.897 0.020 . 2 . . . . 42 VAL QG2 . 26780 1 501 . 1 1 45 45 VAL C C 13 175.438 0.300 . 1 . . . . 42 VAL C . 26780 1 502 . 1 1 45 45 VAL CA C 13 62.205 0.300 . 1 . . . . 42 VAL CA . 26780 1 503 . 1 1 45 45 VAL CB C 13 32.538 0.300 . 1 . . . . 42 VAL CB . 26780 1 504 . 1 1 45 45 VAL CG1 C 13 21.632 0.300 . 1 . . . . 42 VAL CG1 . 26780 1 505 . 1 1 45 45 VAL N N 15 112.576 0.200 . 1 . . . . 42 VAL N . 26780 1 506 . 1 1 46 46 THR H H 1 8.469 0.020 . 1 . . . . 43 THR H . 26780 1 507 . 1 1 46 46 THR HA H 1 4.465 0.020 . 1 . . . . 43 THR HA . 26780 1 508 . 1 1 46 46 THR HB H 1 4.094 0.020 . 1 . . . . 43 THR HB . 26780 1 509 . 1 1 46 46 THR HG21 H 1 1.133 0.020 . 1 . . . . 43 THR QG2 . 26780 1 510 . 1 1 46 46 THR HG22 H 1 1.133 0.020 . 1 . . . . 43 THR QG2 . 26780 1 511 . 1 1 46 46 THR HG23 H 1 1.133 0.020 . 1 . . . . 43 THR QG2 . 26780 1 512 . 1 1 46 46 THR C C 13 174.508 0.300 . 1 . . . . 43 THR C . 26780 1 513 . 1 1 46 46 THR CA C 13 61.589 0.300 . 1 . . . . 43 THR CA . 26780 1 514 . 1 1 46 46 THR CB C 13 69.861 0.300 . 1 . . . . 43 THR CB . 26780 1 515 . 1 1 46 46 THR CG2 C 13 22.212 0.300 . 1 . . . . 43 THR CG2 . 26780 1 516 . 1 1 46 46 THR N N 15 119.716 0.200 . 1 . . . . 43 THR N . 26780 1 517 . 1 1 47 47 ILE H H 1 8.833 0.020 . 1 . . . . 44 ILE H . 26780 1 518 . 1 1 47 47 ILE HA H 1 4.789 0.020 . 1 . . . . 44 ILE HA . 26780 1 519 . 1 1 47 47 ILE HB H 1 1.657 0.020 . 1 . . . . 44 ILE HB . 26780 1 520 . 1 1 47 47 ILE HG12 H 1 0.860 0.020 . 2 . . . . 44 ILE HG12 . 26780 1 521 . 1 1 47 47 ILE HG13 H 1 0.761 0.020 . 2 . . . . 44 ILE HG13 . 26780 1 522 . 1 1 47 47 ILE HG21 H 1 0.524 0.020 . 1 . . . . 44 ILE QG2 . 26780 1 523 . 1 1 47 47 ILE HG22 H 1 0.524 0.020 . 1 . . . . 44 ILE QG2 . 26780 1 524 . 1 1 47 47 ILE HG23 H 1 0.524 0.020 . 1 . . . . 44 ILE QG2 . 26780 1 525 . 1 1 47 47 ILE HD11 H 1 0.349 0.020 . 1 . . . . 44 ILE QD1 . 26780 1 526 . 1 1 47 47 ILE HD12 H 1 0.349 0.020 . 1 . . . . 44 ILE QD1 . 26780 1 527 . 1 1 47 47 ILE HD13 H 1 0.349 0.020 . 1 . . . . 44 ILE QD1 . 26780 1 528 . 1 1 47 47 ILE C C 13 174.264 0.300 . 1 . . . . 44 ILE C . 26780 1 529 . 1 1 47 47 ILE CA C 13 58.730 0.300 . 1 . . . . 44 ILE CA . 26780 1 530 . 1 1 47 47 ILE CB C 13 39.750 0.300 . 1 . . . . 44 ILE CB . 26780 1 531 . 1 1 47 47 ILE CG1 C 13 26.505 0.300 . 1 . . . . 44 ILE CG1 . 26780 1 532 . 1 1 47 47 ILE CG2 C 13 19.137 0.300 . 1 . . . . 44 ILE CG2 . 26780 1 533 . 1 1 47 47 ILE CD1 C 13 13.090 0.300 . 1 . . . . 44 ILE CD1 . 26780 1 534 . 1 1 47 47 ILE N N 15 122.725 0.200 . 1 . . . . 44 ILE N . 26780 1 535 . 1 1 48 48 ALA H H 1 8.675 0.020 . 1 . . . . 45 ALA H . 26780 1 536 . 1 1 48 48 ALA HA H 1 5.156 0.020 . 1 . . . . 45 ALA HA . 26780 1 537 . 1 1 48 48 ALA HB1 H 1 1.023 0.020 . 1 . . . . 45 ALA QB . 26780 1 538 . 1 1 48 48 ALA HB2 H 1 1.023 0.020 . 1 . . . . 45 ALA QB . 26780 1 539 . 1 1 48 48 ALA HB3 H 1 1.023 0.020 . 1 . . . . 45 ALA QB . 26780 1 540 . 1 1 48 48 ALA C C 13 174.606 0.300 . 1 . . . . 45 ALA C . 26780 1 541 . 1 1 48 48 ALA CA C 13 49.652 0.300 . 1 . . . . 45 ALA CA . 26780 1 542 . 1 1 48 48 ALA CB C 13 21.259 0.300 . 1 . . . . 45 ALA CB . 26780 1 543 . 1 1 48 48 ALA N N 15 126.059 0.200 . 1 . . . . 45 ALA N . 26780 1 544 . 1 1 49 49 LEU H H 1 8.624 0.020 . 1 . . . . 46 LEU H . 26780 1 545 . 1 1 49 49 LEU HA H 1 5.429 0.020 . 1 . . . . 46 LEU HA . 26780 1 546 . 1 1 49 49 LEU HB2 H 1 1.465 0.020 . 2 . . . . 46 LEU HB2 . 26780 1 547 . 1 1 49 49 LEU HB3 H 1 1.511 0.020 . 2 . . . . 46 LEU HB3 . 26780 1 548 . 1 1 49 49 LEU HG H 1 1.495 0.020 . 1 . . . . 46 LEU HG . 26780 1 549 . 1 1 49 49 LEU HD11 H 1 0.604 0.020 . 2 . . . . 46 LEU QD1 . 26780 1 550 . 1 1 49 49 LEU HD12 H 1 0.604 0.020 . 2 . . . . 46 LEU QD1 . 26780 1 551 . 1 1 49 49 LEU HD13 H 1 0.604 0.020 . 2 . . . . 46 LEU QD1 . 26780 1 552 . 1 1 49 49 LEU HD21 H 1 0.478 0.020 . 2 . . . . 46 LEU QD2 . 26780 1 553 . 1 1 49 49 LEU HD22 H 1 0.478 0.020 . 2 . . . . 46 LEU QD2 . 26780 1 554 . 1 1 49 49 LEU HD23 H 1 0.478 0.020 . 2 . . . . 46 LEU QD2 . 26780 1 555 . 1 1 49 49 LEU C C 13 175.398 0.300 . 1 . . . . 46 LEU C . 26780 1 556 . 1 1 49 49 LEU CA C 13 53.750 0.300 . 1 . . . . 46 LEU CA . 26780 1 557 . 1 1 49 49 LEU CB C 13 45.931 0.300 . 1 . . . . 46 LEU CB . 26780 1 558 . 1 1 49 49 LEU CG C 13 24.588 0.300 . 1 . . . . 46 LEU CG . 26780 1 559 . 1 1 49 49 LEU CD1 C 13 26.181 0.300 . 1 . . . . 46 LEU CD1 . 26780 1 560 . 1 1 49 49 LEU CD2 C 13 26.037 0.300 . 1 . . . . 46 LEU CD2 . 26780 1 561 . 1 1 49 49 LEU N N 15 119.133 0.200 . 1 . . . . 46 LEU N . 26780 1 562 . 1 1 50 50 ILE H H 1 8.221 0.020 . 1 . . . . 47 ILE H . 26780 1 563 . 1 1 50 50 ILE HA H 1 4.488 0.020 . 1 . . . . 47 ILE HA . 26780 1 564 . 1 1 50 50 ILE HB H 1 1.367 0.020 . 1 . . . . 47 ILE HB . 26780 1 565 . 1 1 50 50 ILE HG12 H 1 1.306 0.020 . 2 . . . . 47 ILE HG12 . 26780 1 566 . 1 1 50 50 ILE HG13 H 1 1.306 0.020 . 2 . . . . 47 ILE HG13 . 26780 1 567 . 1 1 50 50 ILE HG21 H 1 0.842 0.020 . 1 . . . . 47 ILE QG2 . 26780 1 568 . 1 1 50 50 ILE HG22 H 1 0.842 0.020 . 1 . . . . 47 ILE QG2 . 26780 1 569 . 1 1 50 50 ILE HG23 H 1 0.842 0.020 . 1 . . . . 47 ILE QG2 . 26780 1 570 . 1 1 50 50 ILE HD11 H 1 -0.275 0.020 . 1 . . . . 47 ILE QD1 . 26780 1 571 . 1 1 50 50 ILE HD12 H 1 -0.275 0.020 . 1 . . . . 47 ILE QD1 . 26780 1 572 . 1 1 50 50 ILE HD13 H 1 -0.275 0.020 . 1 . . . . 47 ILE QD1 . 26780 1 573 . 1 1 50 50 ILE C C 13 172.333 0.300 . 1 . . . . 47 ILE C . 26780 1 574 . 1 1 50 50 ILE CA C 13 60.899 0.300 . 1 . . . . 47 ILE CA . 26780 1 575 . 1 1 50 50 ILE CB C 13 42.771 0.300 . 1 . . . . 47 ILE CB . 26780 1 576 . 1 1 50 50 ILE CG1 C 13 28.840 0.300 . 1 . . . . 47 ILE CG1 . 26780 1 577 . 1 1 50 50 ILE CG2 C 13 16.179 0.300 . 1 . . . . 47 ILE CG2 . 26780 1 578 . 1 1 50 50 ILE CD1 C 13 13.753 0.300 . 1 . . . . 47 ILE CD1 . 26780 1 579 . 1 1 50 50 ILE N N 15 120.301 0.200 . 1 . . . . 47 ILE N . 26780 1 580 . 1 1 51 51 SER H H 1 8.371 0.020 . 1 . . . . 48 SER H . 26780 1 581 . 1 1 51 51 SER HA H 1 4.639 0.020 . 1 . . . . 48 SER HA . 26780 1 582 . 1 1 51 51 SER HB2 H 1 3.745 0.020 . 2 . . . . 48 SER HB2 . 26780 1 583 . 1 1 51 51 SER HB3 H 1 3.923 0.020 . 2 . . . . 48 SER HB3 . 26780 1 584 . 1 1 51 51 SER C C 13 172.990 0.300 . 1 . . . . 48 SER C . 26780 1 585 . 1 1 51 51 SER CA C 13 59.324 0.300 . 1 . . . . 48 SER CA . 26780 1 586 . 1 1 51 51 SER CB C 13 63.184 0.300 . 1 . . . . 48 SER CB . 26780 1 587 . 1 1 51 51 SER N N 15 122.891 0.200 . 1 . . . . 48 SER N . 26780 1 588 . 1 1 52 52 CYS H H 1 8.068 0.020 . 1 . . . . 49 CYS H . 26780 1 589 . 1 1 52 52 CYS HA H 1 4.308 0.020 . 1 . . . . 49 CYS HA . 26780 1 590 . 1 1 52 52 CYS HB2 H 1 2.272 0.020 . 2 . . . . 49 CYS HB2 . 26780 1 591 . 1 1 52 52 CYS HB3 H 1 2.193 0.020 . 2 . . . . 49 CYS HB3 . 26780 1 592 . 1 1 52 52 CYS C C 13 175.149 0.300 . 1 . . . . 49 CYS C . 26780 1 593 . 1 1 52 52 CYS CA C 13 58.084 0.300 . 1 . . . . 49 CYS CA . 26780 1 594 . 1 1 52 52 CYS CB C 13 27.970 0.300 . 1 . . . . 49 CYS CB . 26780 1 595 . 1 1 52 52 CYS N N 15 121.616 0.200 . 1 . . . . 49 CYS N . 26780 1 596 . 1 1 53 53 ARG H H 1 9.062 0.020 . 1 . . . . 50 ARG H . 26780 1 597 . 1 1 53 53 ARG HA H 1 4.041 0.020 . 1 . . . . 50 ARG HA . 26780 1 598 . 1 1 53 53 ARG HB2 H 1 1.233 0.020 . 2 . . . . 50 ARG HB2 . 26780 1 599 . 1 1 53 53 ARG HB3 H 1 0.984 0.020 . 2 . . . . 50 ARG HB3 . 26780 1 600 . 1 1 53 53 ARG HG2 H 1 1.203 0.020 . 2 . . . . 50 ARG HG2 . 26780 1 601 . 1 1 53 53 ARG HG3 H 1 1.004 0.020 . 2 . . . . 50 ARG HG3 . 26780 1 602 . 1 1 53 53 ARG HD2 H 1 2.784 0.020 . 2 . . . . 50 ARG HD2 . 26780 1 603 . 1 1 53 53 ARG HD3 H 1 2.686 0.020 . 2 . . . . 50 ARG HD3 . 26780 1 604 . 1 1 53 53 ARG C C 13 175.988 0.300 . 1 . . . . 50 ARG C . 26780 1 605 . 1 1 53 53 ARG CA C 13 57.165 0.300 . 1 . . . . 50 ARG CA . 26780 1 606 . 1 1 53 53 ARG CB C 13 30.595 0.300 . 1 . . . . 50 ARG CB . 26780 1 607 . 1 1 53 53 ARG CG C 13 27.097 0.300 . 1 . . . . 50 ARG CG . 26780 1 608 . 1 1 53 53 ARG CD C 13 43.128 0.300 . 1 . . . . 50 ARG CD . 26780 1 609 . 1 1 53 53 ARG N N 15 126.895 0.200 . 1 . . . . 50 ARG N . 26780 1 610 . 1 1 54 54 HIS H H 1 7.224 0.020 . 1 . . . . 51 HIS H . 26780 1 611 . 1 1 54 54 HIS HA H 1 4.863 0.020 . 1 . . . . 51 HIS HA . 26780 1 612 . 1 1 54 54 HIS HB2 H 1 3.081 0.020 . 2 . . . . 51 HIS HB2 . 26780 1 613 . 1 1 54 54 HIS HB3 H 1 2.576 0.020 . 2 . . . . 51 HIS HB3 . 26780 1 614 . 1 1 54 54 HIS C C 13 175.612 0.300 . 1 . . . . 51 HIS C . 26780 1 615 . 1 1 54 54 HIS CA C 13 54.018 0.300 . 1 . . . . 51 HIS CA . 26780 1 616 . 1 1 54 54 HIS CB C 13 30.168 0.300 . 1 . . . . 51 HIS CB . 26780 1 617 . 1 1 54 54 HIS N N 15 119.612 0.200 . 1 . . . . 51 HIS N . 26780 1 618 . 1 1 55 55 VAL H H 1 8.089 0.020 . 1 . . . . 52 VAL H . 26780 1 619 . 1 1 55 55 VAL HA H 1 4.297 0.020 . 1 . . . . 52 VAL HA . 26780 1 620 . 1 1 55 55 VAL HB H 1 2.415 0.020 . 1 . . . . 52 VAL HB . 26780 1 621 . 1 1 55 55 VAL HG11 H 1 0.771 0.020 . 2 . . . . 52 VAL QG1 . 26780 1 622 . 1 1 55 55 VAL HG12 H 1 0.771 0.020 . 2 . . . . 52 VAL QG1 . 26780 1 623 . 1 1 55 55 VAL HG13 H 1 0.771 0.020 . 2 . . . . 52 VAL QG1 . 26780 1 624 . 1 1 55 55 VAL HG21 H 1 0.766 0.020 . 2 . . . . 52 VAL QG2 . 26780 1 625 . 1 1 55 55 VAL HG22 H 1 0.766 0.020 . 2 . . . . 52 VAL QG2 . 26780 1 626 . 1 1 55 55 VAL HG23 H 1 0.766 0.020 . 2 . . . . 52 VAL QG2 . 26780 1 627 . 1 1 55 55 VAL C C 13 177.962 0.300 . 1 . . . . 52 VAL C . 26780 1 628 . 1 1 55 55 VAL CA C 13 61.252 0.300 . 1 . . . . 52 VAL CA . 26780 1 629 . 1 1 55 55 VAL CB C 13 32.373 0.300 . 1 . . . . 52 VAL CB . 26780 1 630 . 1 1 55 55 VAL CG1 C 13 21.897 0.300 . 1 . . . . 52 VAL CG1 . 26780 1 631 . 1 1 55 55 VAL CG2 C 13 18.163 0.300 . 1 . . . . 52 VAL CG2 . 26780 1 632 . 1 1 55 55 VAL N N 15 114.011 0.200 . 1 . . . . 52 VAL N . 26780 1 633 . 1 1 56 56 GLU H H 1 9.112 0.020 . 1 . . . . 53 GLU H . 26780 1 634 . 1 1 56 56 GLU HA H 1 4.043 0.020 . 1 . . . . 53 GLU HA . 26780 1 635 . 1 1 56 56 GLU HB2 H 1 2.019 0.020 . 2 . . . . 53 GLU HB2 . 26780 1 636 . 1 1 56 56 GLU HG2 H 1 2.314 0.020 . 2 . . . . 53 GLU HG2 . 26780 1 637 . 1 1 56 56 GLU C C 13 178.074 0.300 . 1 . . . . 53 GLU C . 26780 1 638 . 1 1 56 56 GLU CA C 13 59.761 0.300 . 1 . . . . 53 GLU CA . 26780 1 639 . 1 1 56 56 GLU CB C 13 29.030 0.300 . 1 . . . . 53 GLU CB . 26780 1 640 . 1 1 56 56 GLU CG C 13 36.434 0.300 . 1 . . . . 53 GLU CG . 26780 1 641 . 1 1 56 56 GLU N N 15 123.892 0.200 . 1 . . . . 53 GLU N . 26780 1 642 . 1 1 57 57 THR H H 1 8.204 0.020 . 1 . . . . 54 THR H . 26780 1 643 . 1 1 57 57 THR HA H 1 4.337 0.020 . 1 . . . . 54 THR HA . 26780 1 644 . 1 1 57 57 THR HB H 1 4.359 0.020 . 1 . . . . 54 THR HB . 26780 1 645 . 1 1 57 57 THR HG21 H 1 1.070 0.020 . 1 . . . . 54 THR QG2 . 26780 1 646 . 1 1 57 57 THR HG22 H 1 1.070 0.020 . 1 . . . . 54 THR QG2 . 26780 1 647 . 1 1 57 57 THR HG23 H 1 1.070 0.020 . 1 . . . . 54 THR QG2 . 26780 1 648 . 1 1 57 57 THR C C 13 174.219 0.300 . 1 . . . . 54 THR C . 26780 1 649 . 1 1 57 57 THR CA C 13 61.963 0.300 . 1 . . . . 54 THR CA . 26780 1 650 . 1 1 57 57 THR CB C 13 69.130 0.300 . 1 . . . . 54 THR CB . 26780 1 651 . 1 1 57 57 THR CG2 C 13 21.499 0.300 . 1 . . . . 54 THR CG2 . 26780 1 652 . 1 1 57 57 THR N N 15 107.893 0.200 . 1 . . . . 54 THR N . 26780 1 653 . 1 1 58 58 LEU H H 1 7.234 0.020 . 1 . . . . 55 LEU H . 26780 1 654 . 1 1 58 58 LEU HA H 1 4.592 0.020 . 1 . . . . 55 LEU HA . 26780 1 655 . 1 1 58 58 LEU HB2 H 1 1.810 0.020 . 2 . . . . 55 LEU HB2 . 26780 1 656 . 1 1 58 58 LEU HB3 H 1 1.849 0.020 . 2 . . . . 55 LEU HB3 . 26780 1 657 . 1 1 58 58 LEU HG H 1 1.470 0.020 . 1 . . . . 55 LEU HG . 26780 1 658 . 1 1 58 58 LEU HD11 H 1 0.605 0.020 . 2 . . . . 55 LEU QD1 . 26780 1 659 . 1 1 58 58 LEU HD12 H 1 0.605 0.020 . 2 . . . . 55 LEU QD1 . 26780 1 660 . 1 1 58 58 LEU HD13 H 1 0.605 0.020 . 2 . . . . 55 LEU QD1 . 26780 1 661 . 1 1 58 58 LEU HD21 H 1 0.748 0.020 . 2 . . . . 55 LEU QD2 . 26780 1 662 . 1 1 58 58 LEU HD22 H 1 0.748 0.020 . 2 . . . . 55 LEU QD2 . 26780 1 663 . 1 1 58 58 LEU HD23 H 1 0.748 0.020 . 2 . . . . 55 LEU QD2 . 26780 1 664 . 1 1 58 58 LEU C C 13 176.471 0.300 . 1 . . . . 55 LEU C . 26780 1 665 . 1 1 58 58 LEU CA C 13 53.175 0.300 . 1 . . . . 55 LEU CA . 26780 1 666 . 1 1 58 58 LEU CB C 13 42.056 0.300 . 1 . . . . 55 LEU CB . 26780 1 667 . 1 1 58 58 LEU CG C 13 26.953 0.300 . 1 . . . . 55 LEU CG . 26780 1 668 . 1 1 58 58 LEU CD1 C 13 22.453 0.300 . 1 . . . . 55 LEU CD1 . 26780 1 669 . 1 1 58 58 LEU CD2 C 13 22.532 0.300 . 1 . . . . 55 LEU CD2 . 26780 1 670 . 1 1 58 58 LEU N N 15 121.155 0.200 . 1 . . . . 55 LEU N . 26780 1 671 . 1 1 59 59 GLU H H 1 7.878 0.020 . 1 . . . . 56 GLU H . 26780 1 672 . 1 1 59 59 GLU HA H 1 4.209 0.020 . 1 . . . . 56 GLU HA . 26780 1 673 . 1 1 59 59 GLU HB2 H 1 1.909 0.020 . 2 . . . . 56 GLU HB2 . 26780 1 674 . 1 1 59 59 GLU HB3 H 1 1.502 0.020 . 2 . . . . 56 GLU HB3 . 26780 1 675 . 1 1 59 59 GLU HG2 H 1 2.269 0.020 . 2 . . . . 56 GLU HG2 . 26780 1 676 . 1 1 59 59 GLU C C 13 178.218 0.300 . 1 . . . . 56 GLU C . 26780 1 677 . 1 1 59 59 GLU CA C 13 56.381 0.300 . 1 . . . . 56 GLU CA . 26780 1 678 . 1 1 59 59 GLU CB C 13 29.792 0.300 . 1 . . . . 56 GLU CB . 26780 1 679 . 1 1 59 59 GLU CG C 13 35.914 0.300 . 1 . . . . 56 GLU CG . 26780 1 680 . 1 1 59 59 GLU N N 15 117.640 0.200 . 1 . . . . 56 GLU N . 26780 1 681 . 1 1 60 60 LYS H H 1 8.775 0.020 . 1 . . . . 57 LYS H . 26780 1 682 . 1 1 60 60 LYS HA H 1 4.416 0.020 . 1 . . . . 57 LYS HA . 26780 1 683 . 1 1 60 60 LYS HB2 H 1 1.587 0.020 . 2 . . . . 57 LYS HB2 . 26780 1 684 . 1 1 60 60 LYS HG2 H 1 1.374 0.020 . 2 . . . . 57 LYS HG2 . 26780 1 685 . 1 1 60 60 LYS HD2 H 1 1.841 0.020 . 2 . . . . 57 LYS HD2 . 26780 1 686 . 1 1 60 60 LYS HE2 H 1 2.933 0.020 . 2 . . . . 57 LYS HE2 . 26780 1 687 . 1 1 60 60 LYS C C 13 177.345 0.300 . 1 . . . . 57 LYS C . 26780 1 688 . 1 1 60 60 LYS CA C 13 56.538 0.300 . 1 . . . . 57 LYS CA . 26780 1 689 . 1 1 60 60 LYS CB C 13 33.524 0.300 . 1 . . . . 57 LYS CB . 26780 1 690 . 1 1 60 60 LYS CG C 13 24.711 0.300 . 1 . . . . 57 LYS CG . 26780 1 691 . 1 1 60 60 LYS CD C 13 28.585 0.300 . 1 . . . . 57 LYS CD . 26780 1 692 . 1 1 60 60 LYS CE C 13 42.170 0.300 . 1 . . . . 57 LYS CE . 26780 1 693 . 1 1 60 60 LYS N N 15 120.465 0.200 . 1 . . . . 57 LYS N . 26780 1 694 . 1 1 61 61 ASP H H 1 8.363 0.020 . 1 . . . . 58 ASP H . 26780 1 695 . 1 1 61 61 ASP HA H 1 4.496 0.020 . 1 . . . . 58 ASP HA . 26780 1 696 . 1 1 61 61 ASP HB2 H 1 2.706 0.020 . 2 . . . . 58 ASP HB2 . 26780 1 697 . 1 1 61 61 ASP HB3 H 1 2.472 0.020 . 2 . . . . 58 ASP HB3 . 26780 1 698 . 1 1 61 61 ASP C C 13 176.272 0.300 . 1 . . . . 58 ASP C . 26780 1 699 . 1 1 61 61 ASP CA C 13 53.907 0.300 . 1 . . . . 58 ASP CA . 26780 1 700 . 1 1 61 61 ASP CB C 13 40.312 0.300 . 1 . . . . 58 ASP CB . 26780 1 701 . 1 1 61 61 ASP N N 15 117.869 0.200 . 1 . . . . 58 ASP N . 26780 1 702 . 1 1 62 62 ARG H H 1 8.490 0.020 . 1 . . . . 59 ARG H . 26780 1 703 . 1 1 62 62 ARG HA H 1 4.284 0.020 . 1 . . . . 59 ARG HA . 26780 1 704 . 1 1 62 62 ARG HB2 H 1 1.148 0.020 . 2 . . . . 59 ARG HB2 . 26780 1 705 . 1 1 62 62 ARG HB3 H 1 0.381 0.020 . 2 . . . . 59 ARG HB3 . 26780 1 706 . 1 1 62 62 ARG HG2 H 1 0.987 0.020 . 2 . . . . 59 ARG HG2 . 26780 1 707 . 1 1 62 62 ARG HG3 H 1 0.987 0.020 . 2 . . . . 59 ARG HG3 . 26780 1 708 . 1 1 62 62 ARG HD2 H 1 2.800 0.020 . 2 . . . . 59 ARG HD2 . 26780 1 709 . 1 1 62 62 ARG HD3 H 1 2.800 0.020 . 2 . . . . 59 ARG HD3 . 26780 1 710 . 1 1 62 62 ARG C C 13 174.606 0.300 . 1 . . . . 59 ARG C . 26780 1 711 . 1 1 62 62 ARG CA C 13 54.616 0.300 . 1 . . . . 59 ARG CA . 26780 1 712 . 1 1 62 62 ARG CB C 13 30.616 0.300 . 1 . . . . 59 ARG CB . 26780 1 713 . 1 1 62 62 ARG CG C 13 26.381 0.300 . 1 . . . . 59 ARG CG . 26780 1 714 . 1 1 62 62 ARG CD C 13 42.056 0.300 . 1 . . . . 59 ARG CD . 26780 1 715 . 1 1 62 62 ARG N N 15 117.925 0.200 . 1 . . . . 59 ARG N . 26780 1 716 . 1 1 63 63 GLY H H 1 7.675 0.020 . 1 . . . . 60 GLY H . 26780 1 717 . 1 1 63 63 GLY HA2 H 1 3.520 0.020 . 2 . . . . 60 GLY HA2 . 26780 1 718 . 1 1 63 63 GLY HA3 H 1 4.208 0.020 . 2 . . . . 60 GLY HA3 . 26780 1 719 . 1 1 63 63 GLY C C 13 173.593 0.300 . 1 . . . . 60 GLY C . 26780 1 720 . 1 1 63 63 GLY CA C 13 42.596 0.300 . 1 . . . . 60 GLY CA . 26780 1 721 . 1 1 63 63 GLY N N 15 106.427 0.200 . 1 . . . . 60 GLY N . 26780 1 722 . 1 1 64 64 ASN H H 1 8.238 0.020 . 1 . . . . 61 ASN H . 26780 1 723 . 1 1 64 64 ASN HA H 1 4.338 0.020 . 1 . . . . 61 ASN HA . 26780 1 724 . 1 1 64 64 ASN HB2 H 1 2.935 0.020 . 2 . . . . 61 ASN HB2 . 26780 1 725 . 1 1 64 64 ASN HB3 H 1 2.935 0.020 . 2 . . . . 61 ASN HB3 . 26780 1 726 . 1 1 64 64 ASN CA C 13 51.201 0.300 . 1 . . . . 61 ASN CA . 26780 1 727 . 1 1 64 64 ASN CB C 13 40.251 0.300 . 1 . . . . 61 ASN CB . 26780 1 728 . 1 1 64 64 ASN N N 15 119.267 0.200 . 1 . . . . 61 ASN N . 26780 1 729 . 1 1 65 65 PRO HA H 1 5.057 0.020 . 1 . . . . 62 PRO HA . 26780 1 730 . 1 1 65 65 PRO HB2 H 1 1.659 0.020 . 2 . . . . 62 PRO HB2 . 26780 1 731 . 1 1 65 65 PRO HB3 H 1 1.659 0.020 . 2 . . . . 62 PRO HB3 . 26780 1 732 . 1 1 65 65 PRO HG2 H 1 2.324 0.020 . 2 . . . . 62 PRO HG2 . 26780 1 733 . 1 1 65 65 PRO HG3 H 1 2.324 0.020 . 2 . . . . 62 PRO HG3 . 26780 1 734 . 1 1 65 65 PRO HD2 H 1 1.727 0.020 . 2 . . . . 62 PRO HD2 . 26780 1 735 . 1 1 65 65 PRO HD3 H 1 1.727 0.020 . 2 . . . . 62 PRO HD3 . 26780 1 736 . 1 1 65 65 PRO C C 13 175.908 0.300 . 1 . . . . 62 PRO C . 26780 1 737 . 1 1 65 65 PRO CA C 13 61.941 0.300 . 1 . . . . 62 PRO CA . 26780 1 738 . 1 1 65 65 PRO CB C 13 31.321 0.300 . 1 . . . . 62 PRO CB . 26780 1 739 . 1 1 65 65 PRO CG C 13 28.566 0.300 . 1 . . . . 62 PRO CG . 26780 1 740 . 1 1 65 65 PRO CD C 13 50.471 0.300 . 1 . . . . 62 PRO CD . 26780 1 741 . 1 1 66 66 ILE H H 1 9.700 0.020 . 1 . . . . 63 ILE H . 26780 1 742 . 1 1 66 66 ILE HA H 1 5.045 0.020 . 1 . . . . 63 ILE HA . 26780 1 743 . 1 1 66 66 ILE HB H 1 1.820 0.020 . 1 . . . . 63 ILE HB . 26780 1 744 . 1 1 66 66 ILE HG12 H 1 1.349 0.020 . 2 . . . . 63 ILE HG12 . 26780 1 745 . 1 1 66 66 ILE HG13 H 1 0.841 0.020 . 2 . . . . 63 ILE HG13 . 26780 1 746 . 1 1 66 66 ILE HG21 H 1 0.916 0.020 . 1 . . . . 63 ILE QG2 . 26780 1 747 . 1 1 66 66 ILE HG22 H 1 0.916 0.020 . 1 . . . . 63 ILE QG2 . 26780 1 748 . 1 1 66 66 ILE HG23 H 1 0.916 0.020 . 1 . . . . 63 ILE QG2 . 26780 1 749 . 1 1 66 66 ILE HD11 H 1 0.909 0.020 . 1 . . . . 63 ILE QD1 . 26780 1 750 . 1 1 66 66 ILE HD12 H 1 0.909 0.020 . 1 . . . . 63 ILE QD1 . 26780 1 751 . 1 1 66 66 ILE HD13 H 1 0.909 0.020 . 1 . . . . 63 ILE QD1 . 26780 1 752 . 1 1 66 66 ILE C C 13 177.130 0.300 . 1 . . . . 63 ILE C . 26780 1 753 . 1 1 66 66 ILE CA C 13 59.387 0.300 . 1 . . . . 63 ILE CA . 26780 1 754 . 1 1 66 66 ILE CB C 13 42.858 0.300 . 1 . . . . 63 ILE CB . 26780 1 755 . 1 1 66 66 ILE CG1 C 13 25.456 0.300 . 1 . . . . 63 ILE CG1 . 26780 1 756 . 1 1 66 66 ILE CG2 C 13 21.743 0.300 . 1 . . . . 63 ILE CG2 . 26780 1 757 . 1 1 66 66 ILE CD1 C 13 18.272 0.300 . 1 . . . . 63 ILE CD1 . 26780 1 758 . 1 1 66 66 ILE N N 15 121.999 0.200 . 1 . . . . 63 ILE N . 26780 1 759 . 1 1 67 67 TYR H H 1 8.477 0.020 . 1 . . . . 64 TYR H . 26780 1 760 . 1 1 67 67 TYR HA H 1 5.202 0.020 . 1 . . . . 64 TYR HA . 26780 1 761 . 1 1 67 67 TYR HB2 H 1 3.068 0.020 . 2 . . . . 64 TYR HB2 . 26780 1 762 . 1 1 67 67 TYR HB3 H 1 2.525 0.020 . 2 . . . . 64 TYR HB3 . 26780 1 763 . 1 1 67 67 TYR C C 13 174.481 0.300 . 1 . . . . 64 TYR C . 26780 1 764 . 1 1 67 67 TYR CA C 13 57.700 0.300 . 1 . . . . 64 TYR CA . 26780 1 765 . 1 1 67 67 TYR CB C 13 40.429 0.300 . 1 . . . . 64 TYR CB . 26780 1 766 . 1 1 67 67 TYR N N 15 119.674 0.200 . 1 . . . . 64 TYR N . 26780 1 767 . 1 1 68 68 LEU H H 1 10.553 0.020 . 1 . . . . 65 LEU H . 26780 1 768 . 1 1 68 68 LEU HA H 1 5.106 0.020 . 1 . . . . 65 LEU HA . 26780 1 769 . 1 1 68 68 LEU HB2 H 1 1.363 0.020 . 2 . . . . 65 LEU HB2 . 26780 1 770 . 1 1 68 68 LEU HB3 H 1 1.084 0.020 . 2 . . . . 65 LEU HB3 . 26780 1 771 . 1 1 68 68 LEU HG H 1 1.154 0.020 . 1 . . . . 65 LEU HG . 26780 1 772 . 1 1 68 68 LEU HD11 H 1 0.017 0.020 . 2 . . . . 65 LEU QD1 . 26780 1 773 . 1 1 68 68 LEU HD12 H 1 0.017 0.020 . 2 . . . . 65 LEU QD1 . 26780 1 774 . 1 1 68 68 LEU HD13 H 1 0.017 0.020 . 2 . . . . 65 LEU QD1 . 26780 1 775 . 1 1 68 68 LEU HD21 H 1 -0.008 0.020 . 2 . . . . 65 LEU QD2 . 26780 1 776 . 1 1 68 68 LEU HD22 H 1 -0.008 0.020 . 2 . . . . 65 LEU QD2 . 26780 1 777 . 1 1 68 68 LEU HD23 H 1 -0.008 0.020 . 2 . . . . 65 LEU QD2 . 26780 1 778 . 1 1 68 68 LEU C C 13 174.512 0.300 . 1 . . . . 65 LEU C . 26780 1 779 . 1 1 68 68 LEU CA C 13 54.125 0.300 . 1 . . . . 65 LEU CA . 26780 1 780 . 1 1 68 68 LEU CB C 13 47.740 0.300 . 1 . . . . 65 LEU CB . 26780 1 781 . 1 1 68 68 LEU CG C 13 27.177 0.300 . 1 . . . . 65 LEU CG . 26780 1 782 . 1 1 68 68 LEU CD1 C 13 24.067 0.300 . 1 . . . . 65 LEU CD1 . 26780 1 783 . 1 1 68 68 LEU CD2 C 13 24.907 0.300 . 1 . . . . 65 LEU CD2 . 26780 1 784 . 1 1 68 68 LEU N N 15 124.728 0.200 . 1 . . . . 65 LEU N . 26780 1 785 . 1 1 69 69 GLY H H 1 9.396 0.020 . 1 . . . . 66 GLY H . 26780 1 786 . 1 1 69 69 GLY HA2 H 1 3.997 0.020 . 2 . . . . 66 GLY HA2 . 26780 1 787 . 1 1 69 69 GLY HA3 H 1 4.855 0.020 . 2 . . . . 66 GLY HA3 . 26780 1 788 . 1 1 69 69 GLY C C 13 173.732 0.300 . 1 . . . . 66 GLY C . 26780 1 789 . 1 1 69 69 GLY CA C 13 45.111 0.300 . 1 . . . . 66 GLY CA . 26780 1 790 . 1 1 69 69 GLY N N 15 111.363 0.200 . 1 . . . . 66 GLY N . 26780 1 791 . 1 1 70 70 LEU H H 1 8.289 0.020 . 1 . . . . 67 LEU H . 26780 1 792 . 1 1 70 70 LEU HA H 1 4.838 0.020 . 1 . . . . 67 LEU HA . 26780 1 793 . 1 1 70 70 LEU HB2 H 1 1.751 0.020 . 2 . . . . 67 LEU HB2 . 26780 1 794 . 1 1 70 70 LEU HB3 H 1 1.357 0.020 . 2 . . . . 67 LEU HB3 . 26780 1 795 . 1 1 70 70 LEU HG H 1 1.454 0.020 . 1 . . . . 67 LEU HG . 26780 1 796 . 1 1 70 70 LEU HD11 H 1 0.813 0.020 . 2 . . . . 67 LEU QD1 . 26780 1 797 . 1 1 70 70 LEU HD12 H 1 0.813 0.020 . 2 . . . . 67 LEU QD1 . 26780 1 798 . 1 1 70 70 LEU HD13 H 1 0.813 0.020 . 2 . . . . 67 LEU QD1 . 26780 1 799 . 1 1 70 70 LEU HD21 H 1 0.804 0.020 . 2 . . . . 67 LEU QD2 . 26780 1 800 . 1 1 70 70 LEU HD22 H 1 0.804 0.020 . 2 . . . . 67 LEU QD2 . 26780 1 801 . 1 1 70 70 LEU HD23 H 1 0.804 0.020 . 2 . . . . 67 LEU QD2 . 26780 1 802 . 1 1 70 70 LEU C C 13 177.393 0.300 . 1 . . . . 67 LEU C . 26780 1 803 . 1 1 70 70 LEU CA C 13 53.289 0.300 . 1 . . . . 67 LEU CA . 26780 1 804 . 1 1 70 70 LEU CB C 13 41.085 0.300 . 1 . . . . 67 LEU CB . 26780 1 805 . 1 1 70 70 LEU CG C 13 26.947 0.300 . 1 . . . . 67 LEU CG . 26780 1 806 . 1 1 70 70 LEU CD1 C 13 22.960 0.300 . 1 . . . . 67 LEU CD1 . 26780 1 807 . 1 1 70 70 LEU CD2 C 13 22.848 0.300 . 1 . . . . 67 LEU CD2 . 26780 1 808 . 1 1 70 70 LEU N N 15 117.660 0.200 . 1 . . . . 67 LEU N . 26780 1 809 . 1 1 71 71 ASN H H 1 8.596 0.020 . 1 . . . . 68 ASN H . 26780 1 810 . 1 1 71 71 ASN HA H 1 4.194 0.020 . 1 . . . . 68 ASN HA . 26780 1 811 . 1 1 71 71 ASN HB2 H 1 2.551 0.020 . 2 . . . . 68 ASN HB2 . 26780 1 812 . 1 1 71 71 ASN HB3 H 1 2.026 0.020 . 2 . . . . 68 ASN HB3 . 26780 1 813 . 1 1 71 71 ASN C C 13 176.109 0.300 . 1 . . . . 68 ASN C . 26780 1 814 . 1 1 71 71 ASN CA C 13 55.714 0.300 . 1 . . . . 68 ASN CA . 26780 1 815 . 1 1 71 71 ASN CB C 13 39.472 0.300 . 1 . . . . 68 ASN CB . 26780 1 816 . 1 1 71 71 ASN N N 15 124.432 0.200 . 1 . . . . 68 ASN N . 26780 1 817 . 1 1 72 72 GLY H H 1 8.866 0.020 . 1 . . . . 69 GLY H . 26780 1 818 . 1 1 72 72 GLY HA2 H 1 3.664 0.020 . 2 . . . . 69 GLY HA2 . 26780 1 819 . 1 1 72 72 GLY HA3 H 1 4.000 0.020 . 2 . . . . 69 GLY HA3 . 26780 1 820 . 1 1 72 72 GLY C C 13 173.800 0.300 . 1 . . . . 69 GLY C . 26780 1 821 . 1 1 72 72 GLY CA C 13 45.538 0.300 . 1 . . . . 69 GLY CA . 26780 1 822 . 1 1 72 72 GLY N N 15 114.783 0.200 . 1 . . . . 69 GLY N . 26780 1 823 . 1 1 73 73 LEU H H 1 7.304 0.020 . 1 . . . . 70 LEU H . 26780 1 824 . 1 1 73 73 LEU HA H 1 4.479 0.020 . 1 . . . . 70 LEU HA . 26780 1 825 . 1 1 73 73 LEU HB2 H 1 1.480 0.020 . 2 . . . . 70 LEU HB2 . 26780 1 826 . 1 1 73 73 LEU HB3 H 1 1.362 0.020 . 2 . . . . 70 LEU HB3 . 26780 1 827 . 1 1 73 73 LEU HG H 1 0.797 0.020 . 1 . . . . 70 LEU HG . 26780 1 828 . 1 1 73 73 LEU HD11 H 1 0.761 0.020 . 2 . . . . 70 LEU QD1 . 26780 1 829 . 1 1 73 73 LEU HD12 H 1 0.761 0.020 . 2 . . . . 70 LEU QD1 . 26780 1 830 . 1 1 73 73 LEU HD13 H 1 0.761 0.020 . 2 . . . . 70 LEU QD1 . 26780 1 831 . 1 1 73 73 LEU HD21 H 1 0.734 0.020 . 2 . . . . 70 LEU QD2 . 26780 1 832 . 1 1 73 73 LEU HD22 H 1 0.734 0.020 . 2 . . . . 70 LEU QD2 . 26780 1 833 . 1 1 73 73 LEU HD23 H 1 0.734 0.020 . 2 . . . . 70 LEU QD2 . 26780 1 834 . 1 1 73 73 LEU C C 13 176.348 0.300 . 1 . . . . 70 LEU C . 26780 1 835 . 1 1 73 73 LEU CA C 13 53.765 0.300 . 1 . . . . 70 LEU CA . 26780 1 836 . 1 1 73 73 LEU CB C 13 44.265 0.300 . 1 . . . . 70 LEU CB . 26780 1 837 . 1 1 73 73 LEU CG C 13 25.804 0.300 . 1 . . . . 70 LEU CG . 26780 1 838 . 1 1 73 73 LEU CD1 C 13 22.739 0.300 . 1 . . . . 70 LEU CD1 . 26780 1 839 . 1 1 73 73 LEU CD2 C 13 22.739 0.300 . 1 . . . . 70 LEU CD2 . 26780 1 840 . 1 1 73 73 LEU N N 15 118.224 0.200 . 1 . . . . 70 LEU N . 26780 1 841 . 1 1 74 74 ASN H H 1 8.683 0.020 . 1 . . . . 71 ASN H . 26780 1 842 . 1 1 74 74 ASN HA H 1 4.430 0.020 . 1 . . . . 71 ASN HA . 26780 1 843 . 1 1 74 74 ASN HB2 H 1 2.550 0.020 . 2 . . . . 71 ASN HB2 . 26780 1 844 . 1 1 74 74 ASN HB3 H 1 2.550 0.020 . 2 . . . . 71 ASN HB3 . 26780 1 845 . 1 1 74 74 ASN CA C 13 52.260 0.300 . 1 . . . . 71 ASN CA . 26780 1 846 . 1 1 74 74 ASN CB C 13 41.442 0.300 . 1 . . . . 71 ASN CB . 26780 1 847 . 1 1 74 74 ASN N N 15 118.558 0.200 . 1 . . . . 71 ASN N . 26780 1 848 . 1 1 75 75 LEU HA H 1 5.288 0.020 . 1 . . . . 72 LEU HA . 26780 1 849 . 1 1 75 75 LEU HB2 H 1 1.357 0.020 . 2 . . . . 72 LEU HB2 . 26780 1 850 . 1 1 75 75 LEU HB3 H 1 1.064 0.020 . 2 . . . . 72 LEU HB3 . 26780 1 851 . 1 1 75 75 LEU HG H 1 1.568 0.020 . 1 . . . . 72 LEU HG . 26780 1 852 . 1 1 75 75 LEU HD11 H 1 0.743 0.020 . 2 . . . . 72 LEU QD1 . 26780 1 853 . 1 1 75 75 LEU HD12 H 1 0.743 0.020 . 2 . . . . 72 LEU QD1 . 26780 1 854 . 1 1 75 75 LEU HD13 H 1 0.743 0.020 . 2 . . . . 72 LEU QD1 . 26780 1 855 . 1 1 75 75 LEU HD21 H 1 0.721 0.020 . 2 . . . . 72 LEU QD2 . 26780 1 856 . 1 1 75 75 LEU HD22 H 1 0.721 0.020 . 2 . . . . 72 LEU QD2 . 26780 1 857 . 1 1 75 75 LEU HD23 H 1 0.721 0.020 . 2 . . . . 72 LEU QD2 . 26780 1 858 . 1 1 75 75 LEU C C 13 176.763 0.300 . 1 . . . . 72 LEU C . 26780 1 859 . 1 1 75 75 LEU CA C 13 53.201 0.300 . 1 . . . . 72 LEU CA . 26780 1 860 . 1 1 75 75 LEU CB C 13 47.858 0.300 . 1 . . . . 72 LEU CB . 26780 1 861 . 1 1 75 75 LEU CG C 13 26.593 0.300 . 1 . . . . 72 LEU CG . 26780 1 862 . 1 1 75 75 LEU CD1 C 13 23.190 0.300 . 1 . . . . 72 LEU CD1 . 26780 1 863 . 1 1 75 75 LEU CD2 C 13 22.920 0.300 . 1 . . . . 72 LEU CD2 . 26780 1 864 . 1 1 76 76 CYS H H 1 9.066 0.020 . 1 . . . . 73 CYS H . 26780 1 865 . 1 1 76 76 CYS HA H 1 5.278 0.020 . 1 . . . . 73 CYS HA . 26780 1 866 . 1 1 76 76 CYS HB2 H 1 3.113 0.020 . 2 . . . . 73 CYS HB2 . 26780 1 867 . 1 1 76 76 CYS HB3 H 1 2.625 0.020 . 2 . . . . 73 CYS HB3 . 26780 1 868 . 1 1 76 76 CYS C C 13 172.952 0.300 . 1 . . . . 73 CYS C . 26780 1 869 . 1 1 76 76 CYS CA C 13 58.260 0.300 . 1 . . . . 73 CYS CA . 26780 1 870 . 1 1 76 76 CYS CB C 13 32.071 0.300 . 1 . . . . 73 CYS CB . 26780 1 871 . 1 1 76 76 CYS N N 15 117.116 0.200 . 1 . . . . 73 CYS N . 26780 1 872 . 1 1 77 77 LEU H H 1 8.714 0.020 . 1 . . . . 74 LEU H . 26780 1 873 . 1 1 77 77 LEU HA H 1 4.558 0.020 . 1 . . . . 74 LEU HA . 26780 1 874 . 1 1 77 77 LEU HB2 H 1 1.484 0.020 . 2 . . . . 74 LEU HB2 . 26780 1 875 . 1 1 77 77 LEU HB3 H 1 1.330 0.020 . 2 . . . . 74 LEU HB3 . 26780 1 876 . 1 1 77 77 LEU HG H 1 1.318 0.020 . 1 . . . . 74 LEU HG . 26780 1 877 . 1 1 77 77 LEU HD11 H 1 0.357 0.020 . 2 . . . . 74 LEU QD1 . 26780 1 878 . 1 1 77 77 LEU HD12 H 1 0.357 0.020 . 2 . . . . 74 LEU QD1 . 26780 1 879 . 1 1 77 77 LEU HD13 H 1 0.357 0.020 . 2 . . . . 74 LEU QD1 . 26780 1 880 . 1 1 77 77 LEU HD21 H 1 0.464 0.020 . 2 . . . . 74 LEU QD2 . 26780 1 881 . 1 1 77 77 LEU HD22 H 1 0.464 0.020 . 2 . . . . 74 LEU QD2 . 26780 1 882 . 1 1 77 77 LEU HD23 H 1 0.464 0.020 . 2 . . . . 74 LEU QD2 . 26780 1 883 . 1 1 77 77 LEU C C 13 174.472 0.300 . 1 . . . . 74 LEU C . 26780 1 884 . 1 1 77 77 LEU CA C 13 56.590 0.300 . 1 . . . . 74 LEU CA . 26780 1 885 . 1 1 77 77 LEU CB C 13 43.211 0.300 . 1 . . . . 74 LEU CB . 26780 1 886 . 1 1 77 77 LEU CG C 13 29.710 0.300 . 1 . . . . 74 LEU CG . 26780 1 887 . 1 1 77 77 LEU CD1 C 13 25.214 0.300 . 1 . . . . 74 LEU CD1 . 26780 1 888 . 1 1 77 77 LEU CD2 C 13 24.001 0.300 . 1 . . . . 74 LEU CD2 . 26780 1 889 . 1 1 77 77 LEU N N 15 124.494 0.200 . 1 . . . . 74 LEU N . 26780 1 890 . 1 1 78 78 MET H H 1 8.800 0.020 . 1 . . . . 75 MET H . 26780 1 891 . 1 1 78 78 MET HA H 1 4.544 0.020 . 1 . . . . 75 MET HA . 26780 1 892 . 1 1 78 78 MET HB2 H 1 0.923 0.020 . 2 . . . . 75 MET HB2 . 26780 1 893 . 1 1 78 78 MET HB3 H 1 0.987 0.020 . 2 . . . . 75 MET HB3 . 26780 1 894 . 1 1 78 78 MET HG2 H 1 1.511 0.020 . 2 . . . . 75 MET HG2 . 26780 1 895 . 1 1 78 78 MET HG3 H 1 1.256 0.020 . 2 . . . . 75 MET HG3 . 26780 1 896 . 1 1 78 78 MET HE1 H 1 1.560 0.020 . 1 . . . . 75 MET QE . 26780 1 897 . 1 1 78 78 MET HE2 H 1 1.560 0.020 . 1 . . . . 75 MET QE . 26780 1 898 . 1 1 78 78 MET HE3 H 1 1.560 0.020 . 1 . . . . 75 MET QE . 26780 1 899 . 1 1 78 78 MET C C 13 172.062 0.300 . 1 . . . . 75 MET C . 26780 1 900 . 1 1 78 78 MET CA C 13 53.526 0.300 . 1 . . . . 75 MET CA . 26780 1 901 . 1 1 78 78 MET CB C 13 34.958 0.300 . 1 . . . . 75 MET CB . 26780 1 902 . 1 1 78 78 MET CG C 13 30.955 0.300 . 1 . . . . 75 MET CG . 26780 1 903 . 1 1 78 78 MET CE C 13 17.390 0.300 . 1 . . . . 75 MET CE . 26780 1 904 . 1 1 78 78 MET N N 15 116.892 0.200 . 1 . . . . 75 MET N . 26780 1 905 . 1 1 79 79 CYS H H 1 8.291 0.020 . 1 . . . . 76 CYS H . 26780 1 906 . 1 1 79 79 CYS HA H 1 5.288 0.020 . 1 . . . . 76 CYS HA . 26780 1 907 . 1 1 79 79 CYS HB2 H 1 2.687 0.020 . 2 . . . . 76 CYS HB2 . 26780 1 908 . 1 1 79 79 CYS HB3 H 1 2.255 0.020 . 2 . . . . 76 CYS HB3 . 26780 1 909 . 1 1 79 79 CYS C C 13 173.539 0.300 . 1 . . . . 76 CYS C . 26780 1 910 . 1 1 79 79 CYS CA C 13 56.480 0.300 . 1 . . . . 76 CYS CA . 26780 1 911 . 1 1 79 79 CYS CB C 13 30.871 0.300 . 1 . . . . 76 CYS CB . 26780 1 912 . 1 1 79 79 CYS N N 15 117.689 0.200 . 1 . . . . 76 CYS N . 26780 1 913 . 1 1 80 80 ALA H H 1 8.505 0.020 . 1 . . . . 77 ALA H . 26780 1 914 . 1 1 80 80 ALA HA H 1 4.384 0.020 . 1 . . . . 77 ALA HA . 26780 1 915 . 1 1 80 80 ALA HB1 H 1 0.996 0.020 . 1 . . . . 77 ALA QB . 26780 1 916 . 1 1 80 80 ALA HB2 H 1 0.996 0.020 . 1 . . . . 77 ALA QB . 26780 1 917 . 1 1 80 80 ALA HB3 H 1 0.996 0.020 . 1 . . . . 77 ALA QB . 26780 1 918 . 1 1 80 80 ALA C C 13 175.392 0.300 . 1 . . . . 77 ALA C . 26780 1 919 . 1 1 80 80 ALA CA C 13 50.623 0.300 . 1 . . . . 77 ALA CA . 26780 1 920 . 1 1 80 80 ALA CB C 13 22.397 0.300 . 1 . . . . 77 ALA CB . 26780 1 921 . 1 1 80 80 ALA N N 15 124.717 0.200 . 1 . . . . 77 ALA N . 26780 1 922 . 1 1 81 81 LYS H H 1 8.712 0.020 . 1 . . . . 78 LYS H . 26780 1 923 . 1 1 81 81 LYS HA H 1 3.865 0.020 . 1 . . . . 78 LYS HA . 26780 1 924 . 1 1 81 81 LYS HB2 H 1 1.445 0.020 . 2 . . . . 78 LYS HB2 . 26780 1 925 . 1 1 81 81 LYS HB3 H 1 1.203 0.020 . 2 . . . . 78 LYS HB3 . 26780 1 926 . 1 1 81 81 LYS HG2 H 1 0.544 0.020 . 2 . . . . 78 LYS HG2 . 26780 1 927 . 1 1 81 81 LYS HG3 H 1 0.699 0.020 . 2 . . . . 78 LYS HG3 . 26780 1 928 . 1 1 81 81 LYS HD2 H 1 1.346 0.020 . 2 . . . . 78 LYS HD2 . 26780 1 929 . 1 1 81 81 LYS HE2 H 1 2.617 0.020 . 2 . . . . 78 LYS HE2 . 26780 1 930 . 1 1 81 81 LYS C C 13 175.753 0.300 . 1 . . . . 78 LYS C . 26780 1 931 . 1 1 81 81 LYS CA C 13 56.695 0.300 . 1 . . . . 78 LYS CA . 26780 1 932 . 1 1 81 81 LYS CB C 13 32.932 0.300 . 1 . . . . 78 LYS CB . 26780 1 933 . 1 1 81 81 LYS CG C 13 25.703 0.300 . 1 . . . . 78 LYS CG . 26780 1 934 . 1 1 81 81 LYS CD C 13 29.248 0.300 . 1 . . . . 78 LYS CD . 26780 1 935 . 1 1 81 81 LYS CE C 13 41.387 0.300 . 1 . . . . 78 LYS CE . 26780 1 936 . 1 1 81 81 LYS N N 15 122.051 0.200 . 1 . . . . 78 LYS N . 26780 1 937 . 1 1 82 82 VAL H H 1 7.885 0.020 . 1 . . . . 79 VAL H . 26780 1 938 . 1 1 82 82 VAL HA H 1 3.869 0.020 . 1 . . . . 79 VAL HA . 26780 1 939 . 1 1 82 82 VAL HB H 1 1.818 0.020 . 1 . . . . 79 VAL HB . 26780 1 940 . 1 1 82 82 VAL HG11 H 1 0.718 0.020 . 2 . . . . 79 VAL QG1 . 26780 1 941 . 1 1 82 82 VAL HG12 H 1 0.718 0.020 . 2 . . . . 79 VAL QG1 . 26780 1 942 . 1 1 82 82 VAL HG13 H 1 0.718 0.020 . 2 . . . . 79 VAL QG1 . 26780 1 943 . 1 1 82 82 VAL HG21 H 1 0.624 0.020 . 2 . . . . 79 VAL QG2 . 26780 1 944 . 1 1 82 82 VAL HG22 H 1 0.624 0.020 . 2 . . . . 79 VAL QG2 . 26780 1 945 . 1 1 82 82 VAL HG23 H 1 0.624 0.020 . 2 . . . . 79 VAL QG2 . 26780 1 946 . 1 1 82 82 VAL C C 13 176.960 0.300 . 1 . . . . 79 VAL C . 26780 1 947 . 1 1 82 82 VAL CA C 13 62.403 0.300 . 1 . . . . 79 VAL CA . 26780 1 948 . 1 1 82 82 VAL CB C 13 32.412 0.300 . 1 . . . . 79 VAL CB . 26780 1 949 . 1 1 82 82 VAL CG1 C 13 20.523 0.300 . 1 . . . . 79 VAL CG1 . 26780 1 950 . 1 1 82 82 VAL CG2 C 13 20.403 0.300 . 1 . . . . 79 VAL CG2 . 26780 1 951 . 1 1 82 82 VAL N N 15 127.503 0.200 . 1 . . . . 79 VAL N . 26780 1 952 . 1 1 83 83 GLY H H 1 8.758 0.020 . 1 . . . . 80 GLY H . 26780 1 953 . 1 1 83 83 GLY HA2 H 1 3.849 0.020 . 2 . . . . 80 GLY HA2 . 26780 1 954 . 1 1 83 83 GLY HA3 H 1 3.553 0.020 . 2 . . . . 80 GLY HA3 . 26780 1 955 . 1 1 83 83 GLY C C 13 174.214 0.300 . 1 . . . . 80 GLY C . 26780 1 956 . 1 1 83 83 GLY CA C 13 46.559 0.300 . 1 . . . . 80 GLY CA . 26780 1 957 . 1 1 83 83 GLY N N 15 118.478 0.200 . 1 . . . . 80 GLY N . 26780 1 958 . 1 1 84 84 ASP H H 1 8.641 0.020 . 1 . . . . 81 ASP H . 26780 1 959 . 1 1 84 84 ASP HA H 1 4.425 0.020 . 1 . . . . 81 ASP HA . 26780 1 960 . 1 1 84 84 ASP HB2 H 1 2.664 0.020 . 2 . . . . 81 ASP HB2 . 26780 1 961 . 1 1 84 84 ASP HB3 H 1 2.470 0.020 . 2 . . . . 81 ASP HB3 . 26780 1 962 . 1 1 84 84 ASP C C 13 175.347 0.300 . 1 . . . . 81 ASP C . 26780 1 963 . 1 1 84 84 ASP CA C 13 54.634 0.300 . 1 . . . . 81 ASP CA . 26780 1 964 . 1 1 84 84 ASP CB C 13 41.447 0.300 . 1 . . . . 81 ASP CB . 26780 1 965 . 1 1 84 84 ASP N N 15 123.170 0.200 . 1 . . . . 81 ASP N . 26780 1 966 . 1 1 85 85 GLN H H 1 7.532 0.020 . 1 . . . . 82 GLN H . 26780 1 967 . 1 1 85 85 GLN HA H 1 4.418 0.020 . 1 . . . . 82 GLN HA . 26780 1 968 . 1 1 85 85 GLN HB2 H 1 1.889 0.020 . 2 . . . . 82 GLN HB2 . 26780 1 969 . 1 1 85 85 GLN HB3 H 1 1.679 0.020 . 2 . . . . 82 GLN HB3 . 26780 1 970 . 1 1 85 85 GLN HG2 H 1 2.210 0.020 . 2 . . . . 82 GLN HG2 . 26780 1 971 . 1 1 85 85 GLN HG3 H 1 2.210 0.020 . 2 . . . . 82 GLN HG3 . 26780 1 972 . 1 1 85 85 GLN CA C 13 52.678 0.300 . 1 . . . . 82 GLN CA . 26780 1 973 . 1 1 85 85 GLN CB C 13 30.869 0.300 . 1 . . . . 82 GLN CB . 26780 1 974 . 1 1 85 85 GLN CG C 13 32.804 0.300 . 1 . . . . 82 GLN CG . 26780 1 975 . 1 1 85 85 GLN N N 15 118.752 0.200 . 1 . . . . 82 GLN N . 26780 1 976 . 1 1 86 86 PRO HA H 1 3.177 0.020 . 1 . . . . 83 PRO HA . 26780 1 977 . 1 1 86 86 PRO HB2 H 1 0.198 0.020 . 2 . . . . 83 PRO HB2 . 26780 1 978 . 1 1 86 86 PRO HB3 H 1 0.087 0.020 . 2 . . . . 83 PRO HB3 . 26780 1 979 . 1 1 86 86 PRO HG2 H 1 -0.313 0.020 . 2 . . . . 83 PRO HG2 . 26780 1 980 . 1 1 86 86 PRO HG3 H 1 -0.070 0.020 . 2 . . . . 83 PRO HG3 . 26780 1 981 . 1 1 86 86 PRO HD2 H 1 3.020 0.020 . 2 . . . . 83 PRO HD2 . 26780 1 982 . 1 1 86 86 PRO HD3 H 1 3.020 0.020 . 2 . . . . 83 PRO HD3 . 26780 1 983 . 1 1 86 86 PRO C C 13 174.297 0.300 . 1 . . . . 83 PRO C . 26780 1 984 . 1 1 86 86 PRO CA C 13 62.761 0.300 . 1 . . . . 83 PRO CA . 26780 1 985 . 1 1 86 86 PRO CB C 13 30.922 0.300 . 1 . . . . 83 PRO CB . 26780 1 986 . 1 1 86 86 PRO CG C 13 26.565 0.300 . 1 . . . . 83 PRO CG . 26780 1 987 . 1 1 86 86 PRO CD C 13 50.427 0.300 . 1 . . . . 83 PRO CD . 26780 1 988 . 1 1 87 87 THR H H 1 8.393 0.020 . 1 . . . . 84 THR H . 26780 1 989 . 1 1 87 87 THR HA H 1 4.408 0.020 . 1 . . . . 84 THR HA . 26780 1 990 . 1 1 87 87 THR HB H 1 3.875 0.020 . 1 . . . . 84 THR HB . 26780 1 991 . 1 1 87 87 THR HG21 H 1 1.017 0.020 . 1 . . . . 84 THR QG2 . 26780 1 992 . 1 1 87 87 THR HG22 H 1 1.017 0.020 . 1 . . . . 84 THR QG2 . 26780 1 993 . 1 1 87 87 THR HG23 H 1 1.017 0.020 . 1 . . . . 84 THR QG2 . 26780 1 994 . 1 1 87 87 THR C C 13 171.963 0.300 . 1 . . . . 84 THR C . 26780 1 995 . 1 1 87 87 THR CA C 13 60.960 0.300 . 1 . . . . 84 THR CA . 26780 1 996 . 1 1 87 87 THR CB C 13 72.369 0.300 . 1 . . . . 84 THR CB . 26780 1 997 . 1 1 87 87 THR CG2 C 13 20.696 0.300 . 1 . . . . 84 THR CG2 . 26780 1 998 . 1 1 87 87 THR N N 15 117.931 0.200 . 1 . . . . 84 THR N . 26780 1 999 . 1 1 88 88 LEU H H 1 8.308 0.020 . 1 . . . . 85 LEU H . 26780 1 1000 . 1 1 88 88 LEU HA H 1 4.749 0.020 . 1 . . . . 85 LEU HA . 26780 1 1001 . 1 1 88 88 LEU HB2 H 1 1.602 0.020 . 2 . . . . 85 LEU HB2 . 26780 1 1002 . 1 1 88 88 LEU HB3 H 1 1.158 0.020 . 2 . . . . 85 LEU HB3 . 26780 1 1003 . 1 1 88 88 LEU HG H 1 1.110 0.020 . 1 . . . . 85 LEU HG . 26780 1 1004 . 1 1 88 88 LEU HD11 H 1 0.447 0.020 . 2 . . . . 85 LEU QD1 . 26780 1 1005 . 1 1 88 88 LEU HD12 H 1 0.447 0.020 . 2 . . . . 85 LEU QD1 . 26780 1 1006 . 1 1 88 88 LEU HD13 H 1 0.447 0.020 . 2 . . . . 85 LEU QD1 . 26780 1 1007 . 1 1 88 88 LEU HD21 H 1 0.429 0.020 . 2 . . . . 85 LEU QD2 . 26780 1 1008 . 1 1 88 88 LEU HD22 H 1 0.429 0.020 . 2 . . . . 85 LEU QD2 . 26780 1 1009 . 1 1 88 88 LEU HD23 H 1 0.429 0.020 . 2 . . . . 85 LEU QD2 . 26780 1 1010 . 1 1 88 88 LEU C C 13 175.809 0.300 . 1 . . . . 85 LEU C . 26780 1 1011 . 1 1 88 88 LEU CA C 13 54.015 0.300 . 1 . . . . 85 LEU CA . 26780 1 1012 . 1 1 88 88 LEU CB C 13 43.699 0.300 . 1 . . . . 85 LEU CB . 26780 1 1013 . 1 1 88 88 LEU CG C 13 26.031 0.300 . 1 . . . . 85 LEU CG . 26780 1 1014 . 1 1 88 88 LEU CD1 C 13 24.076 0.300 . 1 . . . . 85 LEU CD1 . 26780 1 1015 . 1 1 88 88 LEU CD2 C 13 23.840 0.300 . 1 . . . . 85 LEU CD2 . 26780 1 1016 . 1 1 88 88 LEU N N 15 125.961 0.200 . 1 . . . . 85 LEU N . 26780 1 1017 . 1 1 89 89 GLN H H 1 9.370 0.020 . 1 . . . . 86 GLN H . 26780 1 1018 . 1 1 89 89 GLN HA H 1 4.542 0.020 . 1 . . . . 86 GLN HA . 26780 1 1019 . 1 1 89 89 GLN HB2 H 1 2.055 0.020 . 2 . . . . 86 GLN HB2 . 26780 1 1020 . 1 1 89 89 GLN HB3 H 1 1.905 0.020 . 2 . . . . 86 GLN HB3 . 26780 1 1021 . 1 1 89 89 GLN HG2 H 1 2.023 0.020 . 2 . . . . 86 GLN HG2 . 26780 1 1022 . 1 1 89 89 GLN C C 13 173.413 0.300 . 1 . . . . 86 GLN C . 26780 1 1023 . 1 1 89 89 GLN CA C 13 53.882 0.300 . 1 . . . . 86 GLN CA . 26780 1 1024 . 1 1 89 89 GLN CB C 13 32.938 0.300 . 1 . . . . 86 GLN CB . 26780 1 1025 . 1 1 89 89 GLN CG C 13 33.774 0.300 . 1 . . . . 86 GLN CG . 26780 1 1026 . 1 1 89 89 GLN N N 15 125.897 0.200 . 1 . . . . 86 GLN N . 26780 1 1027 . 1 1 90 90 LEU H H 1 8.343 0.020 . 1 . . . . 87 LEU H . 26780 1 1028 . 1 1 90 90 LEU HA H 1 4.839 0.020 . 1 . . . . 87 LEU HA . 26780 1 1029 . 1 1 90 90 LEU HB2 H 1 1.143 0.020 . 2 . . . . 87 LEU HB2 . 26780 1 1030 . 1 1 90 90 LEU HB3 H 1 0.974 0.020 . 2 . . . . 87 LEU HB3 . 26780 1 1031 . 1 1 90 90 LEU HG H 1 1.562 0.020 . 1 . . . . 87 LEU HG . 26780 1 1032 . 1 1 90 90 LEU HD11 H 1 0.566 0.020 . 2 . . . . 87 LEU QD1 . 26780 1 1033 . 1 1 90 90 LEU HD12 H 1 0.566 0.020 . 2 . . . . 87 LEU QD1 . 26780 1 1034 . 1 1 90 90 LEU HD13 H 1 0.566 0.020 . 2 . . . . 87 LEU QD1 . 26780 1 1035 . 1 1 90 90 LEU HD21 H 1 0.511 0.020 . 2 . . . . 87 LEU QD2 . 26780 1 1036 . 1 1 90 90 LEU HD22 H 1 0.511 0.020 . 2 . . . . 87 LEU QD2 . 26780 1 1037 . 1 1 90 90 LEU HD23 H 1 0.511 0.020 . 2 . . . . 87 LEU QD2 . 26780 1 1038 . 1 1 90 90 LEU C C 13 176.576 0.300 . 1 . . . . 87 LEU C . 26780 1 1039 . 1 1 90 90 LEU CA C 13 53.489 0.300 . 1 . . . . 87 LEU CA . 26780 1 1040 . 1 1 90 90 LEU CB C 13 43.598 0.300 . 1 . . . . 87 LEU CB . 26780 1 1041 . 1 1 90 90 LEU CG C 13 25.524 0.300 . 1 . . . . 87 LEU CG . 26780 1 1042 . 1 1 90 90 LEU CD1 C 13 24.994 0.300 . 1 . . . . 87 LEU CD1 . 26780 1 1043 . 1 1 90 90 LEU CD2 C 13 24.989 0.300 . 1 . . . . 87 LEU CD2 . 26780 1 1044 . 1 1 90 90 LEU N N 15 120.195 0.200 . 1 . . . . 87 LEU N . 26780 1 1045 . 1 1 91 91 LYS H H 1 8.650 0.020 . 1 . . . . 88 LYS H . 26780 1 1046 . 1 1 91 91 LYS HA H 1 4.598 0.020 . 1 . . . . 88 LYS HA . 26780 1 1047 . 1 1 91 91 LYS HB2 H 1 1.589 0.020 . 2 . . . . 88 LYS HB2 . 26780 1 1048 . 1 1 91 91 LYS HB3 H 1 1.841 0.020 . 2 . . . . 88 LYS HB3 . 26780 1 1049 . 1 1 91 91 LYS HG2 H 1 1.873 0.020 . 2 . . . . 88 LYS HG2 . 26780 1 1050 . 1 1 91 91 LYS HG3 H 1 1.873 0.020 . 2 . . . . 88 LYS HG3 . 26780 1 1051 . 1 1 91 91 LYS HD2 H 1 1.538 0.020 . 2 . . . . 88 LYS HD2 . 26780 1 1052 . 1 1 91 91 LYS HD3 H 1 1.538 0.020 . 2 . . . . 88 LYS HD3 . 26780 1 1053 . 1 1 91 91 LYS HE2 H 1 2.873 0.020 . 2 . . . . 88 LYS HE2 . 26780 1 1054 . 1 1 91 91 LYS HE3 H 1 2.873 0.020 . 2 . . . . 88 LYS HE3 . 26780 1 1055 . 1 1 91 91 LYS C C 13 175.327 0.300 . 1 . . . . 88 LYS C . 26780 1 1056 . 1 1 91 91 LYS CA C 13 52.647 0.300 . 1 . . . . 88 LYS CA . 26780 1 1057 . 1 1 91 91 LYS CB C 13 36.697 0.300 . 1 . . . . 88 LYS CB . 26780 1 1058 . 1 1 91 91 LYS CG C 13 24.926 0.300 . 1 . . . . 88 LYS CG . 26780 1 1059 . 1 1 91 91 LYS CD C 13 27.947 0.300 . 1 . . . . 88 LYS CD . 26780 1 1060 . 1 1 91 91 LYS CE C 13 42.208 0.300 . 1 . . . . 88 LYS CE . 26780 1 1061 . 1 1 91 91 LYS N N 15 122.182 0.200 . 1 . . . . 88 LYS N . 26780 1 1062 . 1 1 92 92 GLU H H 1 8.698 0.020 . 1 . . . . 89 GLU H . 26780 1 1063 . 1 1 92 92 GLU HA H 1 4.765 0.020 . 1 . . . . 89 GLU HA . 26780 1 1064 . 1 1 92 92 GLU HB2 H 1 1.873 0.020 . 2 . . . . 89 GLU HB2 . 26780 1 1065 . 1 1 92 92 GLU HB3 H 1 1.873 0.020 . 2 . . . . 89 GLU HB3 . 26780 1 1066 . 1 1 92 92 GLU HG2 H 1 2.281 0.020 . 2 . . . . 89 GLU HG2 . 26780 1 1067 . 1 1 92 92 GLU HG3 H 1 2.130 0.020 . 2 . . . . 89 GLU HG3 . 26780 1 1068 . 1 1 92 92 GLU C C 13 175.162 0.300 . 1 . . . . 89 GLU C . 26780 1 1069 . 1 1 92 92 GLU CA C 13 56.790 0.300 . 1 . . . . 89 GLU CA . 26780 1 1070 . 1 1 92 92 GLU CB C 13 28.579 0.300 . 1 . . . . 89 GLU CB . 26780 1 1071 . 1 1 92 92 GLU CG C 13 36.173 0.300 . 1 . . . . 89 GLU CG . 26780 1 1072 . 1 1 92 92 GLU N N 15 123.982 0.200 . 1 . . . . 89 GLU N . 26780 1 1073 . 1 1 93 93 LYS H H 1 7.895 0.020 . 1 . . . . 90 LYS H . 26780 1 1074 . 1 1 93 93 LYS HA H 1 3.989 0.020 . 1 . . . . 90 LYS HA . 26780 1 1075 . 1 1 93 93 LYS HB2 H 1 1.641 0.020 . 2 . . . . 90 LYS HB2 . 26780 1 1076 . 1 1 93 93 LYS HB3 H 1 1.248 0.020 . 2 . . . . 90 LYS HB3 . 26780 1 1077 . 1 1 93 93 LYS HG2 H 1 0.904 0.020 . 2 . . . . 90 LYS HG2 . 26780 1 1078 . 1 1 93 93 LYS HG3 H 1 0.521 0.020 . 2 . . . . 90 LYS HG3 . 26780 1 1079 . 1 1 93 93 LYS HD2 H 1 1.919 0.020 . 2 . . . . 90 LYS HD2 . 26780 1 1080 . 1 1 93 93 LYS C C 13 172.577 0.300 . 1 . . . . 90 LYS C . 26780 1 1081 . 1 1 93 93 LYS CA C 13 54.524 0.300 . 1 . . . . 90 LYS CA . 26780 1 1082 . 1 1 93 93 LYS CB C 13 33.090 0.300 . 1 . . . . 90 LYS CB . 26780 1 1083 . 1 1 93 93 LYS CG C 13 23.489 0.300 . 1 . . . . 90 LYS CG . 26780 1 1084 . 1 1 93 93 LYS CD C 13 27.043 0.300 . 1 . . . . 90 LYS CD . 26780 1 1085 . 1 1 93 93 LYS N N 15 130.176 0.200 . 1 . . . . 90 LYS N . 26780 1 1086 . 1 1 94 94 ASP H H 1 8.425 0.020 . 1 . . . . 91 ASP H . 26780 1 1087 . 1 1 94 94 ASP HA H 1 4.555 0.020 . 1 . . . . 91 ASP HA . 26780 1 1088 . 1 1 94 94 ASP HB2 H 1 2.613 0.020 . 2 . . . . 91 ASP HB2 . 26780 1 1089 . 1 1 94 94 ASP HB3 H 1 2.414 0.020 . 2 . . . . 91 ASP HB3 . 26780 1 1090 . 1 1 94 94 ASP C C 13 177.648 0.300 . 1 . . . . 91 ASP C . 26780 1 1091 . 1 1 94 94 ASP CA C 13 52.225 0.300 . 1 . . . . 91 ASP CA . 26780 1 1092 . 1 1 94 94 ASP CB C 13 41.654 0.300 . 1 . . . . 91 ASP CB . 26780 1 1093 . 1 1 94 94 ASP N N 15 126.349 0.200 . 1 . . . . 91 ASP N . 26780 1 1094 . 1 1 95 95 ILE H H 1 8.625 0.020 . 1 . . . . 92 ILE H . 26780 1 1095 . 1 1 95 95 ILE HA H 1 3.604 0.020 . 1 . . . . 92 ILE HA . 26780 1 1096 . 1 1 95 95 ILE HB H 1 1.625 0.020 . 1 . . . . 92 ILE HB . 26780 1 1097 . 1 1 95 95 ILE HG12 H 1 0.987 0.020 . 2 . . . . 92 ILE HG12 . 26780 1 1098 . 1 1 95 95 ILE HG13 H 1 1.337 0.020 . 2 . . . . 92 ILE HG13 . 26780 1 1099 . 1 1 95 95 ILE HG21 H 1 0.648 0.020 . 1 . . . . 92 ILE QG2 . 26780 1 1100 . 1 1 95 95 ILE HG22 H 1 0.648 0.020 . 1 . . . . 92 ILE QG2 . 26780 1 1101 . 1 1 95 95 ILE HG23 H 1 0.648 0.020 . 1 . . . . 92 ILE QG2 . 26780 1 1102 . 1 1 95 95 ILE HD11 H 1 0.574 0.020 . 1 . . . . 92 ILE QD1 . 26780 1 1103 . 1 1 95 95 ILE HD12 H 1 0.574 0.020 . 1 . . . . 92 ILE QD1 . 26780 1 1104 . 1 1 95 95 ILE HD13 H 1 0.574 0.020 . 1 . . . . 92 ILE QD1 . 26780 1 1105 . 1 1 95 95 ILE C C 13 175.822 0.300 . 1 . . . . 92 ILE C . 26780 1 1106 . 1 1 95 95 ILE CA C 13 64.846 0.300 . 1 . . . . 92 ILE CA . 26780 1 1107 . 1 1 95 95 ILE CB C 13 38.507 0.300 . 1 . . . . 92 ILE CB . 26780 1 1108 . 1 1 95 95 ILE CG1 C 13 29.468 0.300 . 1 . . . . 92 ILE CG1 . 26780 1 1109 . 1 1 95 95 ILE CG2 C 13 15.879 0.300 . 1 . . . . 92 ILE CG2 . 26780 1 1110 . 1 1 95 95 ILE CD1 C 13 14.216 0.300 . 1 . . . . 92 ILE CD1 . 26780 1 1111 . 1 1 95 95 ILE N N 15 131.012 0.200 . 1 . . . . 92 ILE N . 26780 1 1112 . 1 1 96 96 MET H H 1 8.151 0.020 . 1 . . . . 93 MET H . 26780 1 1113 . 1 1 96 96 MET HA H 1 4.536 0.020 . 1 . . . . 93 MET HA . 26780 1 1114 . 1 1 96 96 MET HB2 H 1 1.883 0.020 . 2 . . . . 93 MET HB2 . 26780 1 1115 . 1 1 96 96 MET HB3 H 1 1.883 0.020 . 2 . . . . 93 MET HB3 . 26780 1 1116 . 1 1 96 96 MET HG2 H 1 2.213 0.020 . 2 . . . . 93 MET HG2 . 26780 1 1117 . 1 1 96 96 MET HG3 H 1 2.213 0.020 . 2 . . . . 93 MET HG3 . 26780 1 1118 . 1 1 96 96 MET HE1 H 1 1.708 0.020 . 1 . . . . 93 MET QE . 26780 1 1119 . 1 1 96 96 MET HE2 H 1 1.708 0.020 . 1 . . . . 93 MET QE . 26780 1 1120 . 1 1 96 96 MET HE3 H 1 1.708 0.020 . 1 . . . . 93 MET QE . 26780 1 1121 . 1 1 96 96 MET C C 13 176.201 0.300 . 1 . . . . 93 MET C . 26780 1 1122 . 1 1 96 96 MET CA C 13 54.998 0.300 . 1 . . . . 93 MET CA . 26780 1 1123 . 1 1 96 96 MET CB C 13 27.923 0.300 . 1 . . . . 93 MET CB . 26780 1 1124 . 1 1 96 96 MET CG C 13 31.556 0.300 . 1 . . . . 93 MET CG . 26780 1 1125 . 1 1 96 96 MET CE C 13 15.188 0.300 . 1 . . . . 93 MET CE . 26780 1 1126 . 1 1 96 96 MET N N 15 118.545 0.200 . 1 . . . . 93 MET N . 26780 1 1127 . 1 1 97 97 ASP H H 1 7.438 0.020 . 1 . . . . 94 ASP H . 26780 1 1128 . 1 1 97 97 ASP HA H 1 4.306 0.020 . 1 . . . . 94 ASP HA . 26780 1 1129 . 1 1 97 97 ASP HB2 H 1 2.667 0.020 . 2 . . . . 94 ASP HB2 . 26780 1 1130 . 1 1 97 97 ASP C C 13 179.282 0.300 . 1 . . . . 94 ASP C . 26780 1 1131 . 1 1 97 97 ASP CA C 13 56.834 0.300 . 1 . . . . 94 ASP CA . 26780 1 1132 . 1 1 97 97 ASP CB C 13 40.302 0.300 . 1 . . . . 94 ASP CB . 26780 1 1133 . 1 1 97 97 ASP N N 15 120.554 0.200 . 1 . . . . 94 ASP N . 26780 1 1134 . 1 1 98 98 LEU H H 1 6.595 0.020 . 1 . . . . 95 LEU H . 26780 1 1135 . 1 1 98 98 LEU HA H 1 3.475 0.020 . 1 . . . . 95 LEU HA . 26780 1 1136 . 1 1 98 98 LEU HB2 H 1 1.216 0.020 . 2 . . . . 95 LEU HB2 . 26780 1 1137 . 1 1 98 98 LEU HB3 H 1 -0.509 0.020 . 2 . . . . 95 LEU HB3 . 26780 1 1138 . 1 1 98 98 LEU HG H 1 0.793 0.020 . 1 . . . . 95 LEU HG . 26780 1 1139 . 1 1 98 98 LEU HD11 H 1 0.793 0.020 . 2 . . . . 95 LEU QD1 . 26780 1 1140 . 1 1 98 98 LEU HD12 H 1 0.793 0.020 . 2 . . . . 95 LEU QD1 . 26780 1 1141 . 1 1 98 98 LEU HD13 H 1 0.793 0.020 . 2 . . . . 95 LEU QD1 . 26780 1 1142 . 1 1 98 98 LEU HD21 H 1 -0.123 0.020 . 2 . . . . 95 LEU QD2 . 26780 1 1143 . 1 1 98 98 LEU HD22 H 1 -0.123 0.020 . 2 . . . . 95 LEU QD2 . 26780 1 1144 . 1 1 98 98 LEU HD23 H 1 -0.123 0.020 . 2 . . . . 95 LEU QD2 . 26780 1 1145 . 1 1 98 98 LEU C C 13 178.988 0.300 . 1 . . . . 95 LEU C . 26780 1 1146 . 1 1 98 98 LEU CA C 13 57.315 0.300 . 1 . . . . 95 LEU CA . 26780 1 1147 . 1 1 98 98 LEU CB C 13 39.280 0.300 . 1 . . . . 95 LEU CB . 26780 1 1148 . 1 1 98 98 LEU CG C 13 25.161 0.300 . 1 . . . . 95 LEU CG . 26780 1 1149 . 1 1 98 98 LEU CD1 C 13 26.341 0.300 . 1 . . . . 95 LEU CD1 . 26780 1 1150 . 1 1 98 98 LEU CD2 C 13 21.606 0.300 . 1 . . . . 95 LEU CD2 . 26780 1 1151 . 1 1 98 98 LEU N N 15 117.527 0.200 . 1 . . . . 95 LEU N . 26780 1 1152 . 1 1 99 99 TYR H H 1 7.791 0.020 . 1 . . . . 96 TYR H . 26780 1 1153 . 1 1 99 99 TYR HA H 1 4.088 0.020 . 1 . . . . 96 TYR HA . 26780 1 1154 . 1 1 99 99 TYR HB2 H 1 2.970 0.020 . 2 . . . . 96 TYR HB2 . 26780 1 1155 . 1 1 99 99 TYR HB3 H 1 2.906 0.020 . 2 . . . . 96 TYR HB3 . 26780 1 1156 . 1 1 99 99 TYR C C 13 177.187 0.300 . 1 . . . . 96 TYR C . 26780 1 1157 . 1 1 99 99 TYR CA C 13 60.837 0.300 . 1 . . . . 96 TYR CA . 26780 1 1158 . 1 1 99 99 TYR CB C 13 39.378 0.300 . 1 . . . . 96 TYR CB . 26780 1 1159 . 1 1 99 99 TYR N N 15 119.664 0.200 . 1 . . . . 96 TYR N . 26780 1 1160 . 1 1 100 100 ASN H H 1 7.957 0.020 . 1 . . . . 97 ASN H . 26780 1 1161 . 1 1 100 100 ASN HA H 1 4.333 0.020 . 1 . . . . 97 ASN HA . 26780 1 1162 . 1 1 100 100 ASN HB2 H 1 2.783 0.020 . 2 . . . . 97 ASN HB2 . 26780 1 1163 . 1 1 100 100 ASN HB3 H 1 2.703 0.020 . 2 . . . . 97 ASN HB3 . 26780 1 1164 . 1 1 100 100 ASN C C 13 175.653 0.300 . 1 . . . . 97 ASN C . 26780 1 1165 . 1 1 100 100 ASN CA C 13 53.896 0.300 . 1 . . . . 97 ASN CA . 26780 1 1166 . 1 1 100 100 ASN CB C 13 38.934 0.300 . 1 . . . . 97 ASN CB . 26780 1 1167 . 1 1 100 100 ASN N N 15 113.991 0.200 . 1 . . . . 97 ASN N . 26780 1 1168 . 1 1 101 101 GLN H H 1 7.354 0.020 . 1 . . . . 98 GLN H . 26780 1 1169 . 1 1 101 101 GLN HA H 1 4.186 0.020 . 1 . . . . 98 GLN HA . 26780 1 1170 . 1 1 101 101 GLN HB2 H 1 2.019 0.020 . 2 . . . . 98 GLN HB2 . 26780 1 1171 . 1 1 101 101 GLN HB3 H 1 2.019 0.020 . 2 . . . . 98 GLN HB3 . 26780 1 1172 . 1 1 101 101 GLN HG2 H 1 2.730 0.020 . 2 . . . . 98 GLN HG2 . 26780 1 1173 . 1 1 101 101 GLN HG3 H 1 2.730 0.020 . 2 . . . . 98 GLN HG3 . 26780 1 1174 . 1 1 101 101 GLN CA C 13 54.957 0.300 . 1 . . . . 98 GLN CA . 26780 1 1175 . 1 1 101 101 GLN CB C 13 28.019 0.300 . 1 . . . . 98 GLN CB . 26780 1 1176 . 1 1 101 101 GLN CG C 13 33.567 0.300 . 1 . . . . 98 GLN CG . 26780 1 1177 . 1 1 101 101 GLN N N 15 122.519 0.200 . 1 . . . . 98 GLN N . 26780 1 1178 . 1 1 102 102 PRO HA H 1 4.417 0.020 . 1 . . . . 99 PRO HA . 26780 1 1179 . 1 1 102 102 PRO HB2 H 1 2.305 0.020 . 2 . . . . 99 PRO HB2 . 26780 1 1180 . 1 1 102 102 PRO HB3 H 1 1.760 0.020 . 2 . . . . 99 PRO HB3 . 26780 1 1181 . 1 1 102 102 PRO HG2 H 1 1.818 0.020 . 2 . . . . 99 PRO HG2 . 26780 1 1182 . 1 1 102 102 PRO HG3 H 1 1.505 0.020 . 2 . . . . 99 PRO HG3 . 26780 1 1183 . 1 1 102 102 PRO HD2 H 1 3.778 0.020 . 2 . . . . 99 PRO HD2 . 26780 1 1184 . 1 1 102 102 PRO HD3 H 1 3.543 0.020 . 2 . . . . 99 PRO HD3 . 26780 1 1185 . 1 1 102 102 PRO C C 13 176.847 0.300 . 1 . . . . 99 PRO C . 26780 1 1186 . 1 1 102 102 PRO CA C 13 63.132 0.300 . 1 . . . . 99 PRO CA . 26780 1 1187 . 1 1 102 102 PRO CB C 13 32.135 0.300 . 1 . . . . 99 PRO CB . 26780 1 1188 . 1 1 102 102 PRO CG C 13 27.939 0.300 . 1 . . . . 99 PRO CG . 26780 1 1189 . 1 1 102 102 PRO CD C 13 50.944 0.300 . 1 . . . . 99 PRO CD . 26780 1 1190 . 1 1 103 103 GLU H H 1 8.623 0.020 . 1 . . . . 100 GLU H . 26780 1 1191 . 1 1 103 103 GLU HA H 1 4.393 0.020 . 1 . . . . 100 GLU HA . 26780 1 1192 . 1 1 103 103 GLU HB2 H 1 1.800 0.020 . 2 . . . . 100 GLU HB2 . 26780 1 1193 . 1 1 103 103 GLU HB3 H 1 1.800 0.020 . 2 . . . . 100 GLU HB3 . 26780 1 1194 . 1 1 103 103 GLU HG2 H 1 2.177 0.020 . 2 . . . . 100 GLU HG2 . 26780 1 1195 . 1 1 103 103 GLU HG3 H 1 2.175 0.020 . 2 . . . . 100 GLU HG3 . 26780 1 1196 . 1 1 103 103 GLU CA C 13 58.050 0.300 . 1 . . . . 100 GLU CA . 26780 1 1197 . 1 1 103 103 GLU CB C 13 30.282 0.300 . 1 . . . . 100 GLU CB . 26780 1 1198 . 1 1 103 103 GLU CG C 13 27.916 0.300 . 1 . . . . 100 GLU CG . 26780 1 1199 . 1 1 103 103 GLU N N 15 123.358 0.200 . 1 . . . . 100 GLU N . 26780 1 1200 . 1 1 104 104 PRO HA H 1 4.139 0.020 . 1 . . . . 101 PRO HA . 26780 1 1201 . 1 1 104 104 PRO HB2 H 1 2.172 0.020 . 2 . . . . 101 PRO HB2 . 26780 1 1202 . 1 1 104 104 PRO HB3 H 1 1.528 0.020 . 2 . . . . 101 PRO HB3 . 26780 1 1203 . 1 1 104 104 PRO HG2 H 1 1.754 0.020 . 2 . . . . 101 PRO HG2 . 26780 1 1204 . 1 1 104 104 PRO HG3 H 1 1.961 0.020 . 2 . . . . 101 PRO HG3 . 26780 1 1205 . 1 1 104 104 PRO HD2 H 1 3.654 0.020 . 2 . . . . 101 PRO HD2 . 26780 1 1206 . 1 1 104 104 PRO HD3 H 1 3.654 0.020 . 2 . . . . 101 PRO HD3 . 26780 1 1207 . 1 1 104 104 PRO C C 13 175.654 0.300 . 1 . . . . 101 PRO C . 26780 1 1208 . 1 1 104 104 PRO CA C 13 62.862 0.300 . 1 . . . . 101 PRO CA . 26780 1 1209 . 1 1 104 104 PRO CB C 13 32.197 0.300 . 1 . . . . 101 PRO CB . 26780 1 1210 . 1 1 104 104 PRO CG C 13 26.916 0.300 . 1 . . . . 101 PRO CG . 26780 1 1211 . 1 1 104 104 PRO CD C 13 50.460 0.300 . 1 . . . . 101 PRO CD . 26780 1 1212 . 1 1 105 105 VAL H H 1 8.246 0.020 . 1 . . . . 102 VAL H . 26780 1 1213 . 1 1 105 105 VAL HA H 1 4.175 0.020 . 1 . . . . 102 VAL HA . 26780 1 1214 . 1 1 105 105 VAL HB H 1 2.360 0.020 . 1 . . . . 102 VAL HB . 26780 1 1215 . 1 1 105 105 VAL HG11 H 1 0.993 0.020 . 2 . . . . 102 VAL QG1 . 26780 1 1216 . 1 1 105 105 VAL HG12 H 1 0.993 0.020 . 2 . . . . 102 VAL QG1 . 26780 1 1217 . 1 1 105 105 VAL HG13 H 1 0.993 0.020 . 2 . . . . 102 VAL QG1 . 26780 1 1218 . 1 1 105 105 VAL HG21 H 1 0.825 0.020 . 2 . . . . 102 VAL QG2 . 26780 1 1219 . 1 1 105 105 VAL HG22 H 1 0.825 0.020 . 2 . . . . 102 VAL QG2 . 26780 1 1220 . 1 1 105 105 VAL HG23 H 1 0.825 0.020 . 2 . . . . 102 VAL QG2 . 26780 1 1221 . 1 1 105 105 VAL C C 13 177.064 0.300 . 1 . . . . 102 VAL C . 26780 1 1222 . 1 1 105 105 VAL CA C 13 61.526 0.300 . 1 . . . . 102 VAL CA . 26780 1 1223 . 1 1 105 105 VAL CB C 13 29.437 0.300 . 1 . . . . 102 VAL CB . 26780 1 1224 . 1 1 105 105 VAL CG1 C 13 22.983 0.300 . 1 . . . . 102 VAL CG1 . 26780 1 1225 . 1 1 105 105 VAL CG2 C 13 19.457 0.300 . 1 . . . . 102 VAL CG2 . 26780 1 1226 . 1 1 105 105 VAL N N 15 126.349 0.200 . 1 . . . . 102 VAL N . 26780 1 1227 . 1 1 106 106 LYS H H 1 8.259 0.020 . 1 . . . . 103 LYS H . 26780 1 1228 . 1 1 106 106 LYS HA H 1 4.480 0.020 . 1 . . . . 103 LYS HA . 26780 1 1229 . 1 1 106 106 LYS HB2 H 1 1.344 0.020 . 2 . . . . 103 LYS HB2 . 26780 1 1230 . 1 1 106 106 LYS HB3 H 1 1.344 0.020 . 2 . . . . 103 LYS HB3 . 26780 1 1231 . 1 1 106 106 LYS HG2 H 1 1.341 0.020 . 2 . . . . 103 LYS HG2 . 26780 1 1232 . 1 1 106 106 LYS HG3 H 1 1.341 0.020 . 2 . . . . 103 LYS HG3 . 26780 1 1233 . 1 1 106 106 LYS HD2 H 1 1.695 0.020 . 2 . . . . 103 LYS HD2 . 26780 1 1234 . 1 1 106 106 LYS HD3 H 1 2.867 0.020 . 2 . . . . 103 LYS HD3 . 26780 1 1235 . 1 1 106 106 LYS HE2 H 1 2.860 0.020 . 2 . . . . 103 LYS HE2 . 26780 1 1236 . 1 1 106 106 LYS HE3 H 1 2.860 0.020 . 2 . . . . 103 LYS HE3 . 26780 1 1237 . 1 1 106 106 LYS CA C 13 56.067 0.300 . 1 . . . . 103 LYS CA . 26780 1 1238 . 1 1 106 106 LYS CB C 13 32.716 0.300 . 1 . . . . 103 LYS CB . 26780 1 1239 . 1 1 106 106 LYS CG C 13 24.748 0.300 . 1 . . . . 103 LYS CG . 26780 1 1240 . 1 1 106 106 LYS CD C 13 28.808 0.300 . 1 . . . . 103 LYS CD . 26780 1 1241 . 1 1 106 106 LYS CE C 13 41.599 0.300 . 1 . . . . 103 LYS CE . 26780 1 1242 . 1 1 106 106 LYS N N 15 123.066 0.200 . 1 . . . . 103 LYS N . 26780 1 1243 . 1 1 107 107 SER HA H 1 3.719 0.020 . 1 . . . . 104 SER HA . 26780 1 1244 . 1 1 107 107 SER HB2 H 1 3.745 0.020 . 2 . . . . 104 SER HB2 . 26780 1 1245 . 1 1 107 107 SER C C 13 174.108 0.300 . 1 . . . . 104 SER C . 26780 1 1246 . 1 1 107 107 SER CA C 13 62.075 0.300 . 1 . . . . 104 SER CA . 26780 1 1247 . 1 1 107 107 SER CB C 13 62.287 0.300 . 1 . . . . 104 SER CB . 26780 1 1248 . 1 1 108 108 PHE H H 1 7.572 0.020 . 1 . . . . 105 PHE H . 26780 1 1249 . 1 1 108 108 PHE HA H 1 4.909 0.020 . 1 . . . . 105 PHE HA . 26780 1 1250 . 1 1 108 108 PHE HB2 H 1 4.068 0.020 . 2 . . . . 105 PHE HB2 . 26780 1 1251 . 1 1 108 108 PHE HB3 H 1 2.821 0.020 . 2 . . . . 105 PHE HB3 . 26780 1 1252 . 1 1 108 108 PHE C C 13 173.608 0.300 . 1 . . . . 105 PHE C . 26780 1 1253 . 1 1 108 108 PHE CA C 13 57.560 0.300 . 1 . . . . 105 PHE CA . 26780 1 1254 . 1 1 108 108 PHE CB C 13 41.081 0.300 . 1 . . . . 105 PHE CB . 26780 1 1255 . 1 1 108 108 PHE N N 15 117.500 0.200 . 1 . . . . 105 PHE N . 26780 1 1256 . 1 1 109 109 LEU H H 1 7.021 0.020 . 1 . . . . 106 LEU H . 26780 1 1257 . 1 1 109 109 LEU HA H 1 4.718 0.020 . 1 . . . . 106 LEU HA . 26780 1 1258 . 1 1 109 109 LEU HB2 H 1 1.333 0.020 . 2 . . . . 106 LEU HB2 . 26780 1 1259 . 1 1 109 109 LEU HB3 H 1 0.817 0.020 . 2 . . . . 106 LEU HB3 . 26780 1 1260 . 1 1 109 109 LEU HG H 1 0.424 0.020 . 1 . . . . 106 LEU HG . 26780 1 1261 . 1 1 109 109 LEU HD11 H 1 -0.147 0.020 . 2 . . . . 106 LEU QD1 . 26780 1 1262 . 1 1 109 109 LEU HD12 H 1 -0.147 0.020 . 2 . . . . 106 LEU QD1 . 26780 1 1263 . 1 1 109 109 LEU HD13 H 1 -0.147 0.020 . 2 . . . . 106 LEU QD1 . 26780 1 1264 . 1 1 109 109 LEU HD21 H 1 -0.135 0.020 . 2 . . . . 106 LEU QD2 . 26780 1 1265 . 1 1 109 109 LEU HD22 H 1 -0.135 0.020 . 2 . . . . 106 LEU QD2 . 26780 1 1266 . 1 1 109 109 LEU HD23 H 1 -0.135 0.020 . 2 . . . . 106 LEU QD2 . 26780 1 1267 . 1 1 109 109 LEU C C 13 176.342 0.300 . 1 . . . . 106 LEU C . 26780 1 1268 . 1 1 109 109 LEU CA C 13 53.799 0.300 . 1 . . . . 106 LEU CA . 26780 1 1269 . 1 1 109 109 LEU CB C 13 45.332 0.300 . 1 . . . . 106 LEU CB . 26780 1 1270 . 1 1 109 109 LEU CG C 13 27.798 0.300 . 1 . . . . 106 LEU CG . 26780 1 1271 . 1 1 109 109 LEU CD1 C 13 24.817 0.300 . 1 . . . . 106 LEU CD1 . 26780 1 1272 . 1 1 109 109 LEU CD2 C 13 24.417 0.300 . 1 . . . . 106 LEU CD2 . 26780 1 1273 . 1 1 109 109 LEU N N 15 119.249 0.200 . 1 . . . . 106 LEU N . 26780 1 1274 . 1 1 110 110 PHE H H 1 9.006 0.020 . 1 . . . . 107 PHE H . 26780 1 1275 . 1 1 110 110 PHE HA H 1 5.057 0.020 . 1 . . . . 107 PHE HA . 26780 1 1276 . 1 1 110 110 PHE HB2 H 1 2.675 0.020 . 2 . . . . 107 PHE HB2 . 26780 1 1277 . 1 1 110 110 PHE HB3 H 1 2.540 0.020 . 2 . . . . 107 PHE HB3 . 26780 1 1278 . 1 1 110 110 PHE C C 13 174.991 0.300 . 1 . . . . 107 PHE C . 26780 1 1279 . 1 1 110 110 PHE CA C 13 56.193 0.300 . 1 . . . . 107 PHE CA . 26780 1 1280 . 1 1 110 110 PHE CB C 13 42.777 0.300 . 1 . . . . 107 PHE CB . 26780 1 1281 . 1 1 110 110 PHE N N 15 119.352 0.200 . 1 . . . . 107 PHE N . 26780 1 1282 . 1 1 111 111 TYR H H 1 10.199 0.020 . 1 . . . . 108 TYR H . 26780 1 1283 . 1 1 111 111 TYR HA H 1 4.475 0.020 . 1 . . . . 108 TYR HA . 26780 1 1284 . 1 1 111 111 TYR HB2 H 1 2.783 0.020 . 2 . . . . 108 TYR HB2 . 26780 1 1285 . 1 1 111 111 TYR HB3 H 1 2.783 0.020 . 2 . . . . 108 TYR HB3 . 26780 1 1286 . 1 1 111 111 TYR C C 13 176.195 0.300 . 1 . . . . 108 TYR C . 26780 1 1287 . 1 1 111 111 TYR CA C 13 57.325 0.300 . 1 . . . . 108 TYR CA . 26780 1 1288 . 1 1 111 111 TYR CB C 13 38.783 0.300 . 1 . . . . 108 TYR CB . 26780 1 1289 . 1 1 111 111 TYR N N 15 120.635 0.200 . 1 . . . . 108 TYR N . 26780 1 1290 . 1 1 112 112 HIS H H 1 9.572 0.020 . 1 . . . . 109 HIS H . 26780 1 1291 . 1 1 112 112 HIS HA H 1 3.975 0.020 . 1 . . . . 109 HIS HA . 26780 1 1292 . 1 1 112 112 HIS HB2 H 1 1.652 0.020 . 2 . . . . 109 HIS HB2 . 26780 1 1293 . 1 1 112 112 HIS HB3 H 1 1.652 0.020 . 2 . . . . 109 HIS HB3 . 26780 1 1294 . 1 1 112 112 HIS C C 13 174.876 0.300 . 1 . . . . 109 HIS C . 26780 1 1295 . 1 1 112 112 HIS CA C 13 54.559 0.300 . 1 . . . . 109 HIS CA . 26780 1 1296 . 1 1 112 112 HIS CB C 13 33.106 0.300 . 1 . . . . 109 HIS CB . 26780 1 1297 . 1 1 112 112 HIS N N 15 128.333 0.200 . 1 . . . . 109 HIS N . 26780 1 1298 . 1 1 113 113 SER H H 1 8.482 0.020 . 1 . . . . 110 SER H . 26780 1 1299 . 1 1 113 113 SER HA H 1 4.625 0.020 . 1 . . . . 110 SER HA . 26780 1 1300 . 1 1 113 113 SER HB2 H 1 3.588 0.020 . 2 . . . . 110 SER HB2 . 26780 1 1301 . 1 1 113 113 SER HB3 H 1 3.588 0.020 . 2 . . . . 110 SER HB3 . 26780 1 1302 . 1 1 113 113 SER C C 13 172.538 0.300 . 1 . . . . 110 SER C . 26780 1 1303 . 1 1 113 113 SER CA C 13 56.455 0.300 . 1 . . . . 110 SER CA . 26780 1 1304 . 1 1 113 113 SER CB C 13 63.998 0.300 . 1 . . . . 110 SER CB . 26780 1 1305 . 1 1 113 113 SER N N 15 126.270 0.200 . 1 . . . . 110 SER N . 26780 1 1306 . 1 1 114 114 GLN H H 1 8.239 0.020 . 1 . . . . 111 GLN H . 26780 1 1307 . 1 1 114 114 GLN HA H 1 5.118 0.020 . 1 . . . . 111 GLN HA . 26780 1 1308 . 1 1 114 114 GLN HB2 H 1 1.755 0.020 . 2 . . . . 111 GLN HB2 . 26780 1 1309 . 1 1 114 114 GLN HB3 H 1 1.506 0.020 . 2 . . . . 111 GLN HB3 . 26780 1 1310 . 1 1 114 114 GLN HG2 H 1 2.037 0.020 . 2 . . . . 111 GLN HG2 . 26780 1 1311 . 1 1 114 114 GLN HG3 H 1 1.781 0.020 . 2 . . . . 111 GLN HG3 . 26780 1 1312 . 1 1 114 114 GLN C C 13 175.183 0.300 . 1 . . . . 111 GLN C . 26780 1 1313 . 1 1 114 114 GLN CA C 13 54.408 0.300 . 1 . . . . 111 GLN CA . 26780 1 1314 . 1 1 114 114 GLN CB C 13 31.896 0.300 . 1 . . . . 111 GLN CB . 26780 1 1315 . 1 1 114 114 GLN CG C 13 34.179 0.300 . 1 . . . . 111 GLN CG . 26780 1 1316 . 1 1 114 114 GLN N N 15 124.754 0.200 . 1 . . . . 111 GLN N . 26780 1 1317 . 1 1 115 115 SER H H 1 8.427 0.020 . 1 . . . . 112 SER H . 26780 1 1318 . 1 1 115 115 SER HA H 1 4.424 0.020 . 1 . . . . 112 SER HA . 26780 1 1319 . 1 1 115 115 SER HB2 H 1 3.540 0.020 . 2 . . . . 112 SER HB2 . 26780 1 1320 . 1 1 115 115 SER HB3 H 1 3.640 0.020 . 2 . . . . 112 SER HB3 . 26780 1 1321 . 1 1 115 115 SER C C 13 175.266 0.300 . 1 . . . . 112 SER C . 26780 1 1322 . 1 1 115 115 SER CA C 13 56.319 0.300 . 1 . . . . 112 SER CA . 26780 1 1323 . 1 1 115 115 SER CB C 13 62.966 0.300 . 1 . . . . 112 SER CB . 26780 1 1324 . 1 1 115 115 SER N N 15 120.217 0.200 . 1 . . . . 112 SER N . 26780 1 1325 . 1 1 116 116 GLY H H 1 8.966 0.020 . 1 . . . . 113 GLY H . 26780 1 1326 . 1 1 116 116 GLY HA2 H 1 3.602 0.020 . 2 . . . . 113 GLY HA2 . 26780 1 1327 . 1 1 116 116 GLY HA3 H 1 3.861 0.020 . 2 . . . . 113 GLY HA3 . 26780 1 1328 . 1 1 116 116 GLY C C 13 175.167 0.300 . 1 . . . . 113 GLY C . 26780 1 1329 . 1 1 116 116 GLY CA C 13 46.632 0.300 . 1 . . . . 113 GLY CA . 26780 1 1330 . 1 1 116 116 GLY N N 15 117.816 0.200 . 1 . . . . 113 GLY N . 26780 1 1331 . 1 1 117 117 ARG H H 1 8.877 0.020 . 1 . . . . 114 ARG H . 26780 1 1332 . 1 1 117 117 ARG HA H 1 4.213 0.020 . 1 . . . . 114 ARG HA . 26780 1 1333 . 1 1 117 117 ARG HB2 H 1 1.513 0.020 . 2 . . . . 114 ARG HB2 . 26780 1 1334 . 1 1 117 117 ARG HB3 H 1 1.868 0.020 . 2 . . . . 114 ARG HB3 . 26780 1 1335 . 1 1 117 117 ARG HG2 H 1 1.526 0.020 . 2 . . . . 114 ARG HG2 . 26780 1 1336 . 1 1 117 117 ARG HG3 H 1 1.526 0.020 . 2 . . . . 114 ARG HG3 . 26780 1 1337 . 1 1 117 117 ARG HD2 H 1 3.073 0.020 . 2 . . . . 114 ARG HD2 . 26780 1 1338 . 1 1 117 117 ARG C C 13 176.474 0.300 . 1 . . . . 114 ARG C . 26780 1 1339 . 1 1 117 117 ARG CA C 13 56.427 0.300 . 1 . . . . 114 ARG CA . 26780 1 1340 . 1 1 117 117 ARG CB C 13 30.161 0.300 . 1 . . . . 114 ARG CB . 26780 1 1341 . 1 1 117 117 ARG CG C 13 27.145 0.300 . 1 . . . . 114 ARG CG . 26780 1 1342 . 1 1 117 117 ARG CD C 13 43.040 0.300 . 1 . . . . 114 ARG CD . 26780 1 1343 . 1 1 117 117 ARG N N 15 125.338 0.200 . 1 . . . . 114 ARG N . 26780 1 1344 . 1 1 118 118 ASN H H 1 8.016 0.020 . 1 . . . . 115 ASN H . 26780 1 1345 . 1 1 118 118 ASN HA H 1 4.998 0.020 . 1 . . . . 115 ASN HA . 26780 1 1346 . 1 1 118 118 ASN HB2 H 1 2.797 0.020 . 2 . . . . 115 ASN HB2 . 26780 1 1347 . 1 1 118 118 ASN HB3 H 1 2.552 0.020 . 2 . . . . 115 ASN HB3 . 26780 1 1348 . 1 1 118 118 ASN CA C 13 53.126 0.300 . 1 . . . . 115 ASN CA . 26780 1 1349 . 1 1 118 118 ASN CB C 13 40.666 0.300 . 1 . . . . 115 ASN CB . 26780 1 1350 . 1 1 118 118 ASN N N 15 119.574 0.200 . 1 . . . . 115 ASN N . 26780 1 1351 . 1 1 119 119 SER HA H 1 5.431 0.020 . 1 . . . . 116 SER HA . 26780 1 1352 . 1 1 119 119 SER HB2 H 1 6.321 0.020 . 2 . . . . 116 SER HB2 . 26780 1 1353 . 1 1 119 119 SER HB3 H 1 6.321 0.020 . 2 . . . . 116 SER HB3 . 26780 1 1354 . 1 1 119 119 SER C C 13 172.550 0.300 . 1 . . . . 116 SER C . 26780 1 1355 . 1 1 119 119 SER CA C 13 59.183 0.300 . 1 . . . . 116 SER CA . 26780 1 1356 . 1 1 119 119 SER CB C 13 66.136 0.300 . 1 . . . . 116 SER CB . 26780 1 1357 . 1 1 120 120 THR H H 1 8.599 0.020 . 1 . . . . 117 THR H . 26780 1 1358 . 1 1 120 120 THR HA H 1 4.847 0.020 . 1 . . . . 117 THR HA . 26780 1 1359 . 1 1 120 120 THR HB H 1 4.441 0.020 . 1 . . . . 117 THR HB . 26780 1 1360 . 1 1 120 120 THR HG21 H 1 1.129 0.020 . 1 . . . . 117 THR QG2 . 26780 1 1361 . 1 1 120 120 THR HG22 H 1 1.129 0.020 . 1 . . . . 117 THR QG2 . 26780 1 1362 . 1 1 120 120 THR HG23 H 1 1.129 0.020 . 1 . . . . 117 THR QG2 . 26780 1 1363 . 1 1 120 120 THR C C 13 173.722 0.300 . 1 . . . . 117 THR C . 26780 1 1364 . 1 1 120 120 THR CA C 13 59.894 0.300 . 1 . . . . 117 THR CA . 26780 1 1365 . 1 1 120 120 THR CB C 13 72.802 0.300 . 1 . . . . 117 THR CB . 26780 1 1366 . 1 1 120 120 THR CG2 C 13 20.806 0.300 . 1 . . . . 117 THR CG2 . 26780 1 1367 . 1 1 120 120 THR N N 15 111.587 0.200 . 1 . . . . 117 THR N . 26780 1 1368 . 1 1 121 121 PHE H H 1 9.848 0.020 . 1 . . . . 118 PHE H . 26780 1 1369 . 1 1 121 121 PHE HA H 1 5.505 0.020 . 1 . . . . 118 PHE HA . 26780 1 1370 . 1 1 121 121 PHE HB2 H 1 2.760 0.020 . 2 . . . . 118 PHE HB2 . 26780 1 1371 . 1 1 121 121 PHE HB3 H 1 2.483 0.020 . 2 . . . . 118 PHE HB3 . 26780 1 1372 . 1 1 121 121 PHE C C 13 173.120 0.300 . 1 . . . . 118 PHE C . 26780 1 1373 . 1 1 121 121 PHE CA C 13 56.147 0.300 . 1 . . . . 118 PHE CA . 26780 1 1374 . 1 1 121 121 PHE CB C 13 42.876 0.300 . 1 . . . . 118 PHE CB . 26780 1 1375 . 1 1 121 121 PHE N N 15 119.342 0.200 . 1 . . . . 118 PHE N . 26780 1 1376 . 1 1 122 122 GLU H H 1 8.879 0.020 . 1 . . . . 119 GLU H . 26780 1 1377 . 1 1 122 122 GLU HA H 1 4.549 0.020 . 1 . . . . 119 GLU HA . 26780 1 1378 . 1 1 122 122 GLU HB2 H 1 1.722 0.020 . 2 . . . . 119 GLU HB2 . 26780 1 1379 . 1 1 122 122 GLU HB3 H 1 2.243 0.020 . 2 . . . . 119 GLU HB3 . 26780 1 1380 . 1 1 122 122 GLU HG2 H 1 1.137 0.020 . 2 . . . . 119 GLU HG2 . 26780 1 1381 . 1 1 122 122 GLU HG3 H 1 2.012 0.020 . 2 . . . . 119 GLU HG3 . 26780 1 1382 . 1 1 122 122 GLU C C 13 176.534 0.300 . 1 . . . . 119 GLU C . 26780 1 1383 . 1 1 122 122 GLU CA C 13 53.543 0.300 . 1 . . . . 119 GLU CA . 26780 1 1384 . 1 1 122 122 GLU CB C 13 33.035 0.300 . 1 . . . . 119 GLU CB . 26780 1 1385 . 1 1 122 122 GLU CG C 13 34.880 0.300 . 1 . . . . 119 GLU CG . 26780 1 1386 . 1 1 122 122 GLU N N 15 126.049 0.200 . 1 . . . . 119 GLU N . 26780 1 1387 . 1 1 123 123 SER H H 1 9.211 0.020 . 1 . . . . 120 SER H . 26780 1 1388 . 1 1 123 123 SER HA H 1 4.306 0.020 . 1 . . . . 120 SER HA . 26780 1 1389 . 1 1 123 123 SER HB2 H 1 4.005 0.020 . 2 . . . . 120 SER HB2 . 26780 1 1390 . 1 1 123 123 SER HB3 H 1 4.005 0.020 . 2 . . . . 120 SER HB3 . 26780 1 1391 . 1 1 123 123 SER C C 13 174.217 0.300 . 1 . . . . 120 SER C . 26780 1 1392 . 1 1 123 123 SER CA C 13 59.509 0.300 . 1 . . . . 120 SER CA . 26780 1 1393 . 1 1 123 123 SER CB C 13 63.363 0.300 . 1 . . . . 120 SER CB . 26780 1 1394 . 1 1 123 123 SER N N 15 120.934 0.200 . 1 . . . . 120 SER N . 26780 1 1395 . 1 1 124 124 VAL H H 1 7.209 0.020 . 1 . . . . 121 VAL H . 26780 1 1396 . 1 1 124 124 VAL HA H 1 3.414 0.020 . 1 . . . . 121 VAL HA . 26780 1 1397 . 1 1 124 124 VAL HB H 1 1.409 0.020 . 1 . . . . 121 VAL HB . 26780 1 1398 . 1 1 124 124 VAL HG11 H 1 0.487 0.020 . 2 . . . . 121 VAL QG1 . 26780 1 1399 . 1 1 124 124 VAL HG12 H 1 0.487 0.020 . 2 . . . . 121 VAL QG1 . 26780 1 1400 . 1 1 124 124 VAL HG13 H 1 0.487 0.020 . 2 . . . . 121 VAL QG1 . 26780 1 1401 . 1 1 124 124 VAL HG21 H 1 -0.435 0.020 . 2 . . . . 121 VAL QG2 . 26780 1 1402 . 1 1 124 124 VAL HG22 H 1 -0.435 0.020 . 2 . . . . 121 VAL QG2 . 26780 1 1403 . 1 1 124 124 VAL HG23 H 1 -0.435 0.020 . 2 . . . . 121 VAL QG2 . 26780 1 1404 . 1 1 124 124 VAL C C 13 177.495 0.300 . 1 . . . . 121 VAL C . 26780 1 1405 . 1 1 124 124 VAL CA C 13 63.939 0.300 . 1 . . . . 121 VAL CA . 26780 1 1406 . 1 1 124 124 VAL CB C 13 31.296 0.300 . 1 . . . . 121 VAL CB . 26780 1 1407 . 1 1 124 124 VAL CG1 C 13 21.198 0.300 . 1 . . . . 121 VAL CG1 . 26780 1 1408 . 1 1 124 124 VAL CG2 C 13 21.144 0.300 . 1 . . . . 121 VAL CG2 . 26780 1 1409 . 1 1 124 124 VAL N N 15 125.839 0.200 . 1 . . . . 121 VAL N . 26780 1 1410 . 1 1 125 125 ALA H H 1 7.395 0.020 . 1 . . . . 122 ALA H . 26780 1 1411 . 1 1 125 125 ALA HA H 1 3.447 0.020 . 1 . . . . 122 ALA HA . 26780 1 1412 . 1 1 125 125 ALA HB1 H 1 0.455 0.020 . 1 . . . . 122 ALA QB . 26780 1 1413 . 1 1 125 125 ALA HB2 H 1 0.455 0.020 . 1 . . . . 122 ALA QB . 26780 1 1414 . 1 1 125 125 ALA HB3 H 1 0.455 0.020 . 1 . . . . 122 ALA QB . 26780 1 1415 . 1 1 125 125 ALA C C 13 176.409 0.300 . 1 . . . . 122 ALA C . 26780 1 1416 . 1 1 125 125 ALA CA C 13 53.622 0.300 . 1 . . . . 122 ALA CA . 26780 1 1417 . 1 1 125 125 ALA CB C 13 18.615 0.300 . 1 . . . . 122 ALA CB . 26780 1 1418 . 1 1 125 125 ALA N N 15 120.476 0.200 . 1 . . . . 122 ALA N . 26780 1 1419 . 1 1 126 126 PHE H H 1 7.513 0.020 . 1 . . . . 123 PHE H . 26780 1 1420 . 1 1 126 126 PHE HA H 1 4.664 0.020 . 1 . . . . 123 PHE HA . 26780 1 1421 . 1 1 126 126 PHE HB2 H 1 2.619 0.020 . 2 . . . . 123 PHE HB2 . 26780 1 1422 . 1 1 126 126 PHE HB3 H 1 2.619 0.020 . 2 . . . . 123 PHE HB3 . 26780 1 1423 . 1 1 126 126 PHE CA C 13 53.748 0.300 . 1 . . . . 123 PHE CA . 26780 1 1424 . 1 1 126 126 PHE CB C 13 38.445 0.300 . 1 . . . . 123 PHE CB . 26780 1 1425 . 1 1 126 126 PHE N N 15 115.671 0.200 . 1 . . . . 123 PHE N . 26780 1 1426 . 1 1 127 127 PRO HA H 1 4.587 0.020 . 1 . . . . 124 PRO HA . 26780 1 1427 . 1 1 127 127 PRO HB2 H 1 2.219 0.020 . 2 . . . . 124 PRO HB2 . 26780 1 1428 . 1 1 127 127 PRO HB3 H 1 1.812 0.020 . 2 . . . . 124 PRO HB3 . 26780 1 1429 . 1 1 127 127 PRO HG2 H 1 1.983 0.020 . 2 . . . . 124 PRO HG2 . 26780 1 1430 . 1 1 127 127 PRO HG3 H 1 1.936 0.020 . 2 . . . . 124 PRO HG3 . 26780 1 1431 . 1 1 127 127 PRO HD2 H 1 3.250 0.020 . 2 . . . . 124 PRO HD2 . 26780 1 1432 . 1 1 127 127 PRO HD3 H 1 3.448 0.020 . 2 . . . . 124 PRO HD3 . 26780 1 1433 . 1 1 127 127 PRO C C 13 178.967 0.300 . 1 . . . . 124 PRO C . 26780 1 1434 . 1 1 127 127 PRO CA C 13 63.623 0.300 . 1 . . . . 124 PRO CA . 26780 1 1435 . 1 1 127 127 PRO CB C 13 31.692 0.300 . 1 . . . . 124 PRO CB . 26780 1 1436 . 1 1 127 127 PRO CG C 13 27.816 0.300 . 1 . . . . 124 PRO CG . 26780 1 1437 . 1 1 127 127 PRO CD C 13 49.730 0.300 . 1 . . . . 124 PRO CD . 26780 1 1438 . 1 1 128 128 GLY H H 1 10.586 0.020 . 1 . . . . 125 GLY H . 26780 1 1439 . 1 1 128 128 GLY HA2 H 1 3.448 0.020 . 2 . . . . 125 GLY HA2 . 26780 1 1440 . 1 1 128 128 GLY HA3 H 1 4.162 0.020 . 2 . . . . 125 GLY HA3 . 26780 1 1441 . 1 1 128 128 GLY C C 13 172.819 0.300 . 1 . . . . 125 GLY C . 26780 1 1442 . 1 1 128 128 GLY CA C 13 44.639 0.300 . 1 . . . . 125 GLY CA . 26780 1 1443 . 1 1 128 128 GLY N N 15 113.504 0.200 . 1 . . . . 125 GLY N . 26780 1 1444 . 1 1 129 129 TRP H H 1 7.986 0.020 . 1 . . . . 126 TRP H . 26780 1 1445 . 1 1 129 129 TRP HA H 1 4.746 0.020 . 1 . . . . 126 TRP HA . 26780 1 1446 . 1 1 129 129 TRP HB2 H 1 3.553 0.020 . 2 . . . . 126 TRP HB2 . 26780 1 1447 . 1 1 129 129 TRP HB3 H 1 2.816 0.020 . 2 . . . . 126 TRP HB3 . 26780 1 1448 . 1 1 129 129 TRP HE1 H 1 10.040 0.020 . 1 . . . . 126 TRP HE1 . 26780 1 1449 . 1 1 129 129 TRP C C 13 174.632 0.300 . 1 . . . . 126 TRP C . 26780 1 1450 . 1 1 129 129 TRP CA C 13 56.214 0.300 . 1 . . . . 126 TRP CA . 26780 1 1451 . 1 1 129 129 TRP CB C 13 28.887 0.300 . 1 . . . . 126 TRP CB . 26780 1 1452 . 1 1 129 129 TRP N N 15 120.242 0.200 . 1 . . . . 126 TRP N . 26780 1 1453 . 1 1 129 129 TRP NE1 N 15 129.550 0.200 . 1 . . . . 126 TRP NE1 . 26780 1 1454 . 1 1 130 130 PHE H H 1 9.589 0.020 . 1 . . . . 127 PHE H . 26780 1 1455 . 1 1 130 130 PHE HA H 1 5.597 0.020 . 1 . . . . 127 PHE HA . 26780 1 1456 . 1 1 130 130 PHE HB2 H 1 3.325 0.020 . 2 . . . . 127 PHE HB2 . 26780 1 1457 . 1 1 130 130 PHE HB3 H 1 2.633 0.020 . 2 . . . . 127 PHE HB3 . 26780 1 1458 . 1 1 130 130 PHE C C 13 177.167 0.300 . 1 . . . . 127 PHE C . 26780 1 1459 . 1 1 130 130 PHE CA C 13 56.279 0.300 . 1 . . . . 127 PHE CA . 26780 1 1460 . 1 1 130 130 PHE CB C 13 42.659 0.300 . 1 . . . . 127 PHE CB . 26780 1 1461 . 1 1 130 130 PHE N N 15 121.964 0.200 . 1 . . . . 127 PHE N . 26780 1 1462 . 1 1 131 131 ILE H H 1 8.782 0.020 . 1 . . . . 128 ILE H . 26780 1 1463 . 1 1 131 131 ILE HA H 1 4.338 0.020 . 1 . . . . 128 ILE HA . 26780 1 1464 . 1 1 131 131 ILE HB H 1 1.868 0.020 . 1 . . . . 128 ILE HB . 26780 1 1465 . 1 1 131 131 ILE HG12 H 1 0.726 0.020 . 2 . . . . 128 ILE HG12 . 26780 1 1466 . 1 1 131 131 ILE HG13 H 1 1.685 0.020 . 2 . . . . 128 ILE HG13 . 26780 1 1467 . 1 1 131 131 ILE HG21 H 1 0.604 0.020 . 1 . . . . 128 ILE QG2 . 26780 1 1468 . 1 1 131 131 ILE HG22 H 1 0.604 0.020 . 1 . . . . 128 ILE QG2 . 26780 1 1469 . 1 1 131 131 ILE HG23 H 1 0.604 0.020 . 1 . . . . 128 ILE QG2 . 26780 1 1470 . 1 1 131 131 ILE HD11 H 1 -0.244 0.020 . 1 . . . . 128 ILE QD1 . 26780 1 1471 . 1 1 131 131 ILE HD12 H 1 -0.244 0.020 . 1 . . . . 128 ILE QD1 . 26780 1 1472 . 1 1 131 131 ILE HD13 H 1 -0.244 0.020 . 1 . . . . 128 ILE QD1 . 26780 1 1473 . 1 1 131 131 ILE C C 13 175.181 0.300 . 1 . . . . 128 ILE C . 26780 1 1474 . 1 1 131 131 ILE CA C 13 64.426 0.300 . 1 . . . . 128 ILE CA . 26780 1 1475 . 1 1 131 131 ILE CB C 13 37.804 0.300 . 1 . . . . 128 ILE CB . 26780 1 1476 . 1 1 131 131 ILE CG1 C 13 28.093 0.300 . 1 . . . . 128 ILE CG1 . 26780 1 1477 . 1 1 131 131 ILE CG2 C 13 17.234 0.300 . 1 . . . . 128 ILE CG2 . 26780 1 1478 . 1 1 131 131 ILE CD1 C 13 12.185 0.300 . 1 . . . . 128 ILE CD1 . 26780 1 1479 . 1 1 131 131 ILE N N 15 120.322 0.200 . 1 . . . . 128 ILE N . 26780 1 1480 . 1 1 132 132 ALA H H 1 9.195 0.020 . 1 . . . . 129 ALA H . 26780 1 1481 . 1 1 132 132 ALA HA H 1 5.540 0.020 . 1 . . . . 129 ALA HA . 26780 1 1482 . 1 1 132 132 ALA HB1 H 1 0.980 0.020 . 1 . . . . 129 ALA QB . 26780 1 1483 . 1 1 132 132 ALA HB2 H 1 0.980 0.020 . 1 . . . . 129 ALA QB . 26780 1 1484 . 1 1 132 132 ALA HB3 H 1 0.980 0.020 . 1 . . . . 129 ALA QB . 26780 1 1485 . 1 1 132 132 ALA C C 13 175.644 0.300 . 1 . . . . 129 ALA C . 26780 1 1486 . 1 1 132 132 ALA CA C 13 49.551 0.300 . 1 . . . . 129 ALA CA . 26780 1 1487 . 1 1 132 132 ALA CB C 13 25.702 0.300 . 1 . . . . 129 ALA CB . 26780 1 1488 . 1 1 132 132 ALA N N 15 127.277 0.200 . 1 . . . . 129 ALA N . 26780 1 1489 . 1 1 133 133 VAL H H 1 8.624 0.020 . 1 . . . . 130 VAL H . 26780 1 1490 . 1 1 133 133 VAL HA H 1 4.005 0.020 . 1 . . . . 130 VAL HA . 26780 1 1491 . 1 1 133 133 VAL HB H 1 1.899 0.020 . 1 . . . . 130 VAL HB . 26780 1 1492 . 1 1 133 133 VAL HG11 H 1 1.128 0.020 . 2 . . . . 130 VAL QG1 . 26780 1 1493 . 1 1 133 133 VAL HG12 H 1 1.128 0.020 . 2 . . . . 130 VAL QG1 . 26780 1 1494 . 1 1 133 133 VAL HG13 H 1 1.128 0.020 . 2 . . . . 130 VAL QG1 . 26780 1 1495 . 1 1 133 133 VAL HG21 H 1 0.833 0.020 . 2 . . . . 130 VAL QG2 . 26780 1 1496 . 1 1 133 133 VAL HG22 H 1 0.833 0.020 . 2 . . . . 130 VAL QG2 . 26780 1 1497 . 1 1 133 133 VAL HG23 H 1 0.833 0.020 . 2 . . . . 130 VAL QG2 . 26780 1 1498 . 1 1 133 133 VAL C C 13 177.073 0.300 . 1 . . . . 130 VAL C . 26780 1 1499 . 1 1 133 133 VAL CA C 13 61.627 0.300 . 1 . . . . 130 VAL CA . 26780 1 1500 . 1 1 133 133 VAL CB C 13 33.308 0.300 . 1 . . . . 130 VAL CB . 26780 1 1501 . 1 1 133 133 VAL CG1 C 13 21.131 0.300 . 1 . . . . 130 VAL CG1 . 26780 1 1502 . 1 1 133 133 VAL CG2 C 13 22.452 0.300 . 1 . . . . 130 VAL CG2 . 26780 1 1503 . 1 1 133 133 VAL N N 15 118.552 0.200 . 1 . . . . 130 VAL N . 26780 1 1504 . 1 1 134 134 SER H H 1 8.494 0.020 . 1 . . . . 131 SER H . 26780 1 1505 . 1 1 134 134 SER HA H 1 4.405 0.020 . 1 . . . . 131 SER HA . 26780 1 1506 . 1 1 134 134 SER HB2 H 1 3.935 0.020 . 2 . . . . 131 SER HB2 . 26780 1 1507 . 1 1 134 134 SER HB3 H 1 3.797 0.020 . 2 . . . . 131 SER HB3 . 26780 1 1508 . 1 1 134 134 SER C C 13 174.950 0.300 . 1 . . . . 131 SER C . 26780 1 1509 . 1 1 134 134 SER CA C 13 57.889 0.300 . 1 . . . . 131 SER CA . 26780 1 1510 . 1 1 134 134 SER CB C 13 63.550 0.300 . 1 . . . . 131 SER CB . 26780 1 1511 . 1 1 134 134 SER N N 15 122.482 0.200 . 1 . . . . 131 SER N . 26780 1 1512 . 1 1 135 135 SER H H 1 8.231 0.020 . 1 . . . . 132 SER H . 26780 1 1513 . 1 1 135 135 SER HA H 1 4.341 0.020 . 1 . . . . 132 SER HA . 26780 1 1514 . 1 1 135 135 SER HB2 H 1 4.210 0.020 . 2 . . . . 132 SER HB2 . 26780 1 1515 . 1 1 135 135 SER HB3 H 1 4.210 0.020 . 2 . . . . 132 SER HB3 . 26780 1 1516 . 1 1 135 135 SER C C 13 175.166 0.300 . 1 . . . . 132 SER C . 26780 1 1517 . 1 1 135 135 SER CA C 13 59.352 0.300 . 1 . . . . 132 SER CA . 26780 1 1518 . 1 1 135 135 SER CB C 13 63.799 0.300 . 1 . . . . 132 SER CB . 26780 1 1519 . 1 1 135 135 SER N N 15 118.478 0.200 . 1 . . . . 132 SER N . 26780 1 1520 . 1 1 136 136 GLU H H 1 8.074 0.020 . 1 . . . . 133 GLU H . 26780 1 1521 . 1 1 136 136 GLU HA H 1 4.357 0.020 . 1 . . . . 133 GLU HA . 26780 1 1522 . 1 1 136 136 GLU HB2 H 1 1.775 0.020 . 2 . . . . 133 GLU HB2 . 26780 1 1523 . 1 1 136 136 GLU HB3 H 1 1.775 0.020 . 2 . . . . 133 GLU HB3 . 26780 1 1524 . 1 1 136 136 GLU HG2 H 1 2.047 0.020 . 2 . . . . 133 GLU HG2 . 26780 1 1525 . 1 1 136 136 GLU HG3 H 1 2.182 0.020 . 2 . . . . 133 GLU HG3 . 26780 1 1526 . 1 1 136 136 GLU C C 13 176.889 0.300 . 1 . . . . 133 GLU C . 26780 1 1527 . 1 1 136 136 GLU CA C 13 55.548 0.300 . 1 . . . . 133 GLU CA . 26780 1 1528 . 1 1 136 136 GLU CB C 13 31.584 0.300 . 1 . . . . 133 GLU CB . 26780 1 1529 . 1 1 136 136 GLU CG C 13 36.145 0.300 . 1 . . . . 133 GLU CG . 26780 1 1530 . 1 1 136 136 GLU N N 15 121.699 0.200 . 1 . . . . 133 GLU N . 26780 1 1531 . 1 1 137 137 GLY H H 1 8.565 0.020 . 1 . . . . 134 GLY H . 26780 1 1532 . 1 1 137 137 GLY HA2 H 1 3.732 0.020 . 2 . . . . 134 GLY HA2 . 26780 1 1533 . 1 1 137 137 GLY HA3 H 1 3.732 0.020 . 2 . . . . 134 GLY HA3 . 26780 1 1534 . 1 1 137 137 GLY C C 13 175.133 0.300 . 1 . . . . 134 GLY C . 26780 1 1535 . 1 1 137 137 GLY CA C 13 46.953 0.300 . 1 . . . . 134 GLY CA . 26780 1 1536 . 1 1 137 137 GLY N N 15 108.271 0.200 . 1 . . . . 134 GLY N . 26780 1 1537 . 1 1 138 138 GLY H H 1 8.755 0.020 . 1 . . . . 135 GLY H . 26780 1 1538 . 1 1 138 138 GLY HA2 H 1 3.911 0.020 . 2 . . . . 135 GLY HA2 . 26780 1 1539 . 1 1 138 138 GLY HA3 H 1 3.875 0.020 . 2 . . . . 135 GLY HA3 . 26780 1 1540 . 1 1 138 138 GLY C C 13 173.244 0.300 . 1 . . . . 135 GLY C . 26780 1 1541 . 1 1 138 138 GLY CA C 13 45.087 0.300 . 1 . . . . 135 GLY CA . 26780 1 1542 . 1 1 138 138 GLY N N 15 112.574 0.200 . 1 . . . . 135 GLY N . 26780 1 1543 . 1 1 139 139 CYS H H 1 8.084 0.020 . 1 . . . . 136 CYS H . 26780 1 1544 . 1 1 139 139 CYS HA H 1 4.276 0.020 . 1 . . . . 136 CYS HA . 26780 1 1545 . 1 1 139 139 CYS HB2 H 1 2.076 0.020 . 2 . . . . 136 CYS HB2 . 26780 1 1546 . 1 1 139 139 CYS HB3 H 1 2.076 0.020 . 2 . . . . 136 CYS HB3 . 26780 1 1547 . 1 1 139 139 CYS CA C 13 60.602 0.300 . 1 . . . . 136 CYS CA . 26780 1 1548 . 1 1 139 139 CYS CB C 13 38.839 0.300 . 1 . . . . 136 CYS CB . 26780 1 1549 . 1 1 139 139 CYS N N 15 113.691 0.200 . 1 . . . . 136 CYS N . 26780 1 1550 . 1 1 140 140 PRO HA H 1 4.752 0.020 . 1 . . . . 137 PRO HA . 26780 1 1551 . 1 1 140 140 PRO HB2 H 1 1.950 0.020 . 2 . . . . 137 PRO HB2 . 26780 1 1552 . 1 1 140 140 PRO HB3 H 1 1.787 0.020 . 2 . . . . 137 PRO HB3 . 26780 1 1553 . 1 1 140 140 PRO HG2 H 1 2.210 0.020 . 2 . . . . 137 PRO HG2 . 26780 1 1554 . 1 1 140 140 PRO HG3 H 1 1.798 0.020 . 2 . . . . 137 PRO HG3 . 26780 1 1555 . 1 1 140 140 PRO HD2 H 1 4.546 0.020 . 2 . . . . 137 PRO HD2 . 26780 1 1556 . 1 1 140 140 PRO HD3 H 1 4.546 0.020 . 2 . . . . 137 PRO HD3 . 26780 1 1557 . 1 1 140 140 PRO C C 13 179.593 0.300 . 1 . . . . 137 PRO C . 26780 1 1558 . 1 1 140 140 PRO CA C 13 62.752 0.300 . 1 . . . . 137 PRO CA . 26780 1 1559 . 1 1 140 140 PRO CB C 13 31.260 0.300 . 1 . . . . 137 PRO CB . 26780 1 1560 . 1 1 140 140 PRO CG C 13 27.066 0.300 . 1 . . . . 137 PRO CG . 26780 1 1561 . 1 1 140 140 PRO CD C 13 55.451 0.300 . 1 . . . . 137 PRO CD . 26780 1 1562 . 1 1 141 141 LEU H H 1 7.432 0.020 . 1 . . . . 138 LEU H . 26780 1 1563 . 1 1 141 141 LEU HA H 1 4.767 0.020 . 1 . . . . 138 LEU HA . 26780 1 1564 . 1 1 141 141 LEU HB2 H 1 0.823 0.020 . 2 . . . . 138 LEU HB2 . 26780 1 1565 . 1 1 141 141 LEU HB3 H 1 0.961 0.020 . 2 . . . . 138 LEU HB3 . 26780 1 1566 . 1 1 141 141 LEU HG H 1 0.497 0.020 . 1 . . . . 138 LEU HG . 26780 1 1567 . 1 1 141 141 LEU HD11 H 1 -0.427 0.020 . 2 . . . . 138 LEU QD1 . 26780 1 1568 . 1 1 141 141 LEU HD12 H 1 -0.427 0.020 . 2 . . . . 138 LEU QD1 . 26780 1 1569 . 1 1 141 141 LEU HD13 H 1 -0.427 0.020 . 2 . . . . 138 LEU QD1 . 26780 1 1570 . 1 1 141 141 LEU HD21 H 1 -0.267 0.020 . 2 . . . . 138 LEU QD2 . 26780 1 1571 . 1 1 141 141 LEU HD22 H 1 -0.267 0.020 . 2 . . . . 138 LEU QD2 . 26780 1 1572 . 1 1 141 141 LEU HD23 H 1 -0.267 0.020 . 2 . . . . 138 LEU QD2 . 26780 1 1573 . 1 1 141 141 LEU C C 13 177.339 0.300 . 1 . . . . 138 LEU C . 26780 1 1574 . 1 1 141 141 LEU CA C 13 53.943 0.300 . 1 . . . . 138 LEU CA . 26780 1 1575 . 1 1 141 141 LEU CB C 13 40.845 0.300 . 1 . . . . 138 LEU CB . 26780 1 1576 . 1 1 141 141 LEU CG C 13 27.623 0.300 . 1 . . . . 138 LEU CG . 26780 1 1577 . 1 1 141 141 LEU CD1 C 13 24.000 0.300 . 1 . . . . 138 LEU CD1 . 26780 1 1578 . 1 1 141 141 LEU CD2 C 13 22.825 0.300 . 1 . . . . 138 LEU CD2 . 26780 1 1579 . 1 1 141 141 LEU N N 15 120.666 0.200 . 1 . . . . 138 LEU N . 26780 1 1580 . 1 1 142 142 ILE H H 1 9.156 0.020 . 1 . . . . 139 ILE H . 26780 1 1581 . 1 1 142 142 ILE HA H 1 4.836 0.020 . 1 . . . . 139 ILE HA . 26780 1 1582 . 1 1 142 142 ILE HB H 1 2.014 0.020 . 1 . . . . 139 ILE HB . 26780 1 1583 . 1 1 142 142 ILE HG12 H 1 0.864 0.020 . 2 . . . . 139 ILE HG12 . 26780 1 1584 . 1 1 142 142 ILE HG13 H 1 0.864 0.020 . 2 . . . . 139 ILE HG13 . 26780 1 1585 . 1 1 142 142 ILE HG21 H 1 0.844 0.020 . 1 . . . . 139 ILE QG2 . 26780 1 1586 . 1 1 142 142 ILE HG22 H 1 0.844 0.020 . 1 . . . . 139 ILE QG2 . 26780 1 1587 . 1 1 142 142 ILE HG23 H 1 0.844 0.020 . 1 . . . . 139 ILE QG2 . 26780 1 1588 . 1 1 142 142 ILE HD11 H 1 0.827 0.020 . 1 . . . . 139 ILE QD1 . 26780 1 1589 . 1 1 142 142 ILE HD12 H 1 0.827 0.020 . 1 . . . . 139 ILE QD1 . 26780 1 1590 . 1 1 142 142 ILE HD13 H 1 0.827 0.020 . 1 . . . . 139 ILE QD1 . 26780 1 1591 . 1 1 142 142 ILE C C 13 174.585 0.300 . 1 . . . . 139 ILE C . 26780 1 1592 . 1 1 142 142 ILE CA C 13 59.592 0.300 . 1 . . . . 139 ILE CA . 26780 1 1593 . 1 1 142 142 ILE CB C 13 43.737 0.300 . 1 . . . . 139 ILE CB . 26780 1 1594 . 1 1 142 142 ILE CG1 C 13 25.891 0.300 . 1 . . . . 139 ILE CG1 . 26780 1 1595 . 1 1 142 142 ILE CG2 C 13 17.390 0.300 . 1 . . . . 139 ILE CG2 . 26780 1 1596 . 1 1 142 142 ILE CD1 C 13 17.591 0.300 . 1 . . . . 139 ILE CD1 . 26780 1 1597 . 1 1 142 142 ILE N N 15 117.783 0.200 . 1 . . . . 139 ILE N . 26780 1 1598 . 1 1 143 143 LEU H H 1 7.626 0.020 . 1 . . . . 140 LEU H . 26780 1 1599 . 1 1 143 143 LEU HA H 1 5.651 0.020 . 1 . . . . 140 LEU HA . 26780 1 1600 . 1 1 143 143 LEU HB2 H 1 1.638 0.020 . 2 . . . . 140 LEU HB2 . 26780 1 1601 . 1 1 143 143 LEU HB3 H 1 1.638 0.020 . 2 . . . . 140 LEU HB3 . 26780 1 1602 . 1 1 143 143 LEU HG H 1 1.697 0.020 . 1 . . . . 140 LEU HG . 26780 1 1603 . 1 1 143 143 LEU HD11 H 1 0.579 0.020 . 2 . . . . 140 LEU QD1 . 26780 1 1604 . 1 1 143 143 LEU HD12 H 1 0.579 0.020 . 2 . . . . 140 LEU QD1 . 26780 1 1605 . 1 1 143 143 LEU HD13 H 1 0.579 0.020 . 2 . . . . 140 LEU QD1 . 26780 1 1606 . 1 1 143 143 LEU HD21 H 1 0.823 0.020 . 2 . . . . 140 LEU QD2 . 26780 1 1607 . 1 1 143 143 LEU HD22 H 1 0.823 0.020 . 2 . . . . 140 LEU QD2 . 26780 1 1608 . 1 1 143 143 LEU HD23 H 1 0.823 0.020 . 2 . . . . 140 LEU QD2 . 26780 1 1609 . 1 1 143 143 LEU C C 13 177.415 0.300 . 1 . . . . 140 LEU C . 26780 1 1610 . 1 1 143 143 LEU CA C 13 53.292 0.300 . 1 . . . . 140 LEU CA . 26780 1 1611 . 1 1 143 143 LEU CB C 13 45.918 0.300 . 1 . . . . 140 LEU CB . 26780 1 1612 . 1 1 143 143 LEU CG C 13 27.426 0.300 . 1 . . . . 140 LEU CG . 26780 1 1613 . 1 1 143 143 LEU CD1 C 13 25.368 0.300 . 1 . . . . 140 LEU CD1 . 26780 1 1614 . 1 1 143 143 LEU CD2 C 13 23.421 0.300 . 1 . . . . 140 LEU CD2 . 26780 1 1615 . 1 1 143 143 LEU N N 15 115.674 0.200 . 1 . . . . 140 LEU N . 26780 1 1616 . 1 1 144 144 THR H H 1 9.533 0.020 . 1 . . . . 141 THR H . 26780 1 1617 . 1 1 144 144 THR HA H 1 4.930 0.020 . 1 . . . . 141 THR HA . 26780 1 1618 . 1 1 144 144 THR HB H 1 3.768 0.020 . 1 . . . . 141 THR HB . 26780 1 1619 . 1 1 144 144 THR HG21 H 1 0.963 0.020 . 1 . . . . 141 THR QG2 . 26780 1 1620 . 1 1 144 144 THR HG22 H 1 0.963 0.020 . 1 . . . . 141 THR QG2 . 26780 1 1621 . 1 1 144 144 THR HG23 H 1 0.963 0.020 . 1 . . . . 141 THR QG2 . 26780 1 1622 . 1 1 144 144 THR C C 13 171.200 0.300 . 1 . . . . 141 THR C . 26780 1 1623 . 1 1 144 144 THR CA C 13 60.572 0.300 . 1 . . . . 141 THR CA . 26780 1 1624 . 1 1 144 144 THR CB C 13 70.707 0.300 . 1 . . . . 141 THR CB . 26780 1 1625 . 1 1 144 144 THR CG2 C 13 20.687 0.300 . 1 . . . . 141 THR CG2 . 26780 1 1626 . 1 1 144 144 THR N N 15 116.846 0.200 . 1 . . . . 141 THR N . 26780 1 1627 . 1 1 145 145 GLN H H 1 8.060 0.020 . 1 . . . . 142 GLN H . 26780 1 1628 . 1 1 145 145 GLN HA H 1 4.799 0.020 . 1 . . . . 142 GLN HA . 26780 1 1629 . 1 1 145 145 GLN HB2 H 1 0.968 0.020 . 2 . . . . 142 GLN HB2 . 26780 1 1630 . 1 1 145 145 GLN HB3 H 1 1.074 0.020 . 2 . . . . 142 GLN HB3 . 26780 1 1631 . 1 1 145 145 GLN HG2 H 1 0.421 0.020 . 2 . . . . 142 GLN HG2 . 26780 1 1632 . 1 1 145 145 GLN HG3 H 1 0.942 0.020 . 2 . . . . 142 GLN HG3 . 26780 1 1633 . 1 1 145 145 GLN C C 13 176.104 0.300 . 1 . . . . 142 GLN C . 26780 1 1634 . 1 1 145 145 GLN CA C 13 54.771 0.300 . 1 . . . . 142 GLN CA . 26780 1 1635 . 1 1 145 145 GLN CB C 13 29.676 0.300 . 1 . . . . 142 GLN CB . 26780 1 1636 . 1 1 145 145 GLN CG C 13 32.680 0.300 . 1 . . . . 142 GLN CG . 26780 1 1637 . 1 1 145 145 GLN N N 15 123.591 0.200 . 1 . . . . 142 GLN N . 26780 1 1638 . 1 1 146 146 GLU H H 1 7.969 0.020 . 1 . . . . 143 GLU H . 26780 1 1639 . 1 1 146 146 GLU HA H 1 4.229 0.020 . 1 . . . . 143 GLU HA . 26780 1 1640 . 1 1 146 146 GLU HB2 H 1 1.727 0.020 . 2 . . . . 143 GLU HB2 . 26780 1 1641 . 1 1 146 146 GLU HB3 H 1 1.727 0.020 . 2 . . . . 143 GLU HB3 . 26780 1 1642 . 1 1 146 146 GLU HG2 H 1 1.921 0.020 . 2 . . . . 143 GLU HG2 . 26780 1 1643 . 1 1 146 146 GLU HG3 H 1 2.013 0.020 . 2 . . . . 143 GLU HG3 . 26780 1 1644 . 1 1 146 146 GLU C C 13 174.746 0.300 . 1 . . . . 143 GLU C . 26780 1 1645 . 1 1 146 146 GLU CA C 13 55.267 0.300 . 1 . . . . 143 GLU CA . 26780 1 1646 . 1 1 146 146 GLU CB C 13 30.462 0.300 . 1 . . . . 143 GLU CB . 26780 1 1647 . 1 1 146 146 GLU CG C 13 36.234 0.300 . 1 . . . . 143 GLU CG . 26780 1 1648 . 1 1 146 146 GLU N N 15 121.707 0.200 . 1 . . . . 143 GLU N . 26780 1 1649 . 1 1 147 147 LEU H H 1 8.125 0.020 . 1 . . . . 144 LEU H . 26780 1 1650 . 1 1 147 147 LEU HA H 1 4.157 0.020 . 1 . . . . 144 LEU HA . 26780 1 1651 . 1 1 147 147 LEU HB2 H 1 1.124 0.020 . 2 . . . . 144 LEU HB2 . 26780 1 1652 . 1 1 147 147 LEU HB3 H 1 1.261 0.020 . 2 . . . . 144 LEU HB3 . 26780 1 1653 . 1 1 147 147 LEU HG H 1 1.062 0.020 . 1 . . . . 144 LEU HG . 26780 1 1654 . 1 1 147 147 LEU HD11 H 1 -0.018 0.020 . 2 . . . . 144 LEU QD1 . 26780 1 1655 . 1 1 147 147 LEU HD12 H 1 -0.018 0.020 . 2 . . . . 144 LEU QD1 . 26780 1 1656 . 1 1 147 147 LEU HD13 H 1 -0.018 0.020 . 2 . . . . 144 LEU QD1 . 26780 1 1657 . 1 1 147 147 LEU HD21 H 1 0.284 0.020 . 2 . . . . 144 LEU QD2 . 26780 1 1658 . 1 1 147 147 LEU HD22 H 1 0.284 0.020 . 2 . . . . 144 LEU QD2 . 26780 1 1659 . 1 1 147 147 LEU HD23 H 1 0.284 0.020 . 2 . . . . 144 LEU QD2 . 26780 1 1660 . 1 1 147 147 LEU C C 13 178.332 0.300 . 1 . . . . 144 LEU C . 26780 1 1661 . 1 1 147 147 LEU CA C 13 54.567 0.300 . 1 . . . . 144 LEU CA . 26780 1 1662 . 1 1 147 147 LEU CB C 13 42.189 0.300 . 1 . . . . 144 LEU CB . 26780 1 1663 . 1 1 147 147 LEU CG C 13 27.083 0.300 . 1 . . . . 144 LEU CG . 26780 1 1664 . 1 1 147 147 LEU CD1 C 13 22.404 0.300 . 1 . . . . 144 LEU CD1 . 26780 1 1665 . 1 1 147 147 LEU CD2 C 13 24.106 0.300 . 1 . . . . 144 LEU CD2 . 26780 1 1666 . 1 1 147 147 LEU N N 15 125.523 0.200 . 1 . . . . 144 LEU N . 26780 1 1667 . 1 1 148 148 GLY H H 1 8.488 0.020 . 1 . . . . 145 GLY H . 26780 1 1668 . 1 1 148 148 GLY HA2 H 1 3.731 0.020 . 2 . . . . 145 GLY HA2 . 26780 1 1669 . 1 1 148 148 GLY HA3 H 1 3.731 0.020 . 2 . . . . 145 GLY HA3 . 26780 1 1670 . 1 1 148 148 GLY C C 13 174.729 0.300 . 1 . . . . 145 GLY C . 26780 1 1671 . 1 1 148 148 GLY CA C 13 46.256 0.300 . 1 . . . . 145 GLY CA . 26780 1 1672 . 1 1 148 148 GLY N N 15 109.353 0.200 . 1 . . . . 145 GLY N . 26780 1 1673 . 1 1 149 149 LYS H H 1 8.171 0.020 . 1 . . . . 146 LYS H . 26780 1 1674 . 1 1 149 149 LYS HA H 1 4.368 0.020 . 1 . . . . 146 LYS HA . 26780 1 1675 . 1 1 149 149 LYS HB2 H 1 1.579 0.020 . 2 . . . . 146 LYS HB2 . 26780 1 1676 . 1 1 149 149 LYS HB3 H 1 1.579 0.020 . 2 . . . . 146 LYS HB3 . 26780 1 1677 . 1 1 149 149 LYS HG2 H 1 1.107 0.020 . 2 . . . . 146 LYS HG2 . 26780 1 1678 . 1 1 149 149 LYS HG3 H 1 1.233 0.020 . 2 . . . . 146 LYS HG3 . 26780 1 1679 . 1 1 149 149 LYS HD2 H 1 1.810 0.020 . 2 . . . . 146 LYS HD2 . 26780 1 1680 . 1 1 149 149 LYS HD3 H 1 1.810 0.020 . 2 . . . . 146 LYS HD3 . 26780 1 1681 . 1 1 149 149 LYS HE2 H 1 2.805 0.020 . 2 . . . . 146 LYS HE2 . 26780 1 1682 . 1 1 149 149 LYS HE3 H 1 2.805 0.020 . 2 . . . . 146 LYS HE3 . 26780 1 1683 . 1 1 149 149 LYS C C 13 175.958 0.300 . 1 . . . . 146 LYS C . 26780 1 1684 . 1 1 149 149 LYS CA C 13 54.534 0.300 . 1 . . . . 146 LYS CA . 26780 1 1685 . 1 1 149 149 LYS CB C 13 31.059 0.300 . 1 . . . . 146 LYS CB . 26780 1 1686 . 1 1 149 149 LYS CG C 13 24.555 0.300 . 1 . . . . 146 LYS CG . 26780 1 1687 . 1 1 149 149 LYS CD C 13 28.493 0.300 . 1 . . . . 146 LYS CD . 26780 1 1688 . 1 1 149 149 LYS CE C 13 41.909 0.300 . 1 . . . . 146 LYS CE . 26780 1 1689 . 1 1 149 149 LYS N N 15 120.901 0.200 . 1 . . . . 146 LYS N . 26780 1 1690 . 1 1 150 150 ALA H H 1 7.854 0.020 . 1 . . . . 147 ALA H . 26780 1 1691 . 1 1 150 150 ALA HA H 1 4.016 0.020 . 1 . . . . 147 ALA HA . 26780 1 1692 . 1 1 150 150 ALA HB1 H 1 1.286 0.020 . 1 . . . . 147 ALA QB . 26780 1 1693 . 1 1 150 150 ALA HB2 H 1 1.286 0.020 . 1 . . . . 147 ALA QB . 26780 1 1694 . 1 1 150 150 ALA HB3 H 1 1.286 0.020 . 1 . . . . 147 ALA QB . 26780 1 1695 . 1 1 150 150 ALA C C 13 177.939 0.300 . 1 . . . . 147 ALA C . 26780 1 1696 . 1 1 150 150 ALA CA C 13 54.261 0.300 . 1 . . . . 147 ALA CA . 26780 1 1697 . 1 1 150 150 ALA CB C 13 18.850 0.300 . 1 . . . . 147 ALA CB . 26780 1 1698 . 1 1 150 150 ALA N N 15 122.558 0.200 . 1 . . . . 147 ALA N . 26780 1 1699 . 1 1 151 151 ASN H H 1 7.538 0.020 . 1 . . . . 148 ASN H . 26780 1 1700 . 1 1 151 151 ASN HA H 1 5.070 0.020 . 1 . . . . 148 ASN HA . 26780 1 1701 . 1 1 151 151 ASN HB2 H 1 2.619 0.020 . 2 . . . . 148 ASN HB2 . 26780 1 1702 . 1 1 151 151 ASN HB3 H 1 2.233 0.020 . 2 . . . . 148 ASN HB3 . 26780 1 1703 . 1 1 151 151 ASN C C 13 174.354 0.300 . 1 . . . . 148 ASN C . 26780 1 1704 . 1 1 151 151 ASN CA C 13 52.086 0.300 . 1 . . . . 148 ASN CA . 26780 1 1705 . 1 1 151 151 ASN CB C 13 38.892 0.300 . 1 . . . . 148 ASN CB . 26780 1 1706 . 1 1 151 151 ASN N N 15 114.424 0.200 . 1 . . . . 148 ASN N . 26780 1 1707 . 1 1 152 152 THR H H 1 8.058 0.020 . 1 . . . . 149 THR H . 26780 1 1708 . 1 1 152 152 THR HA H 1 4.009 0.020 . 1 . . . . 149 THR HA . 26780 1 1709 . 1 1 152 152 THR HB H 1 3.784 0.020 . 1 . . . . 149 THR HB . 26780 1 1710 . 1 1 152 152 THR HG21 H 1 1.105 0.020 . 1 . . . . 149 THR QG2 . 26780 1 1711 . 1 1 152 152 THR HG22 H 1 1.105 0.020 . 1 . . . . 149 THR QG2 . 26780 1 1712 . 1 1 152 152 THR HG23 H 1 1.105 0.020 . 1 . . . . 149 THR QG2 . 26780 1 1713 . 1 1 152 152 THR C C 13 173.923 0.300 . 1 . . . . 149 THR C . 26780 1 1714 . 1 1 152 152 THR CA C 13 63.919 0.300 . 1 . . . . 149 THR CA . 26780 1 1715 . 1 1 152 152 THR CB C 13 69.726 0.300 . 1 . . . . 149 THR CB . 26780 1 1716 . 1 1 152 152 THR CG2 C 13 22.293 0.300 . 1 . . . . 149 THR CG2 . 26780 1 1717 . 1 1 152 152 THR N N 15 120.738 0.200 . 1 . . . . 149 THR N . 26780 1 1718 . 1 1 153 153 THR H H 1 8.177 0.020 . 1 . . . . 150 THR H . 26780 1 1719 . 1 1 153 153 THR HA H 1 4.682 0.020 . 1 . . . . 150 THR HA . 26780 1 1720 . 1 1 153 153 THR HB H 1 4.355 0.020 . 1 . . . . 150 THR HB . 26780 1 1721 . 1 1 153 153 THR HG21 H 1 1.089 0.020 . 1 . . . . 150 THR QG2 . 26780 1 1722 . 1 1 153 153 THR HG22 H 1 1.089 0.020 . 1 . . . . 150 THR QG2 . 26780 1 1723 . 1 1 153 153 THR HG23 H 1 1.089 0.020 . 1 . . . . 150 THR QG2 . 26780 1 1724 . 1 1 153 153 THR C C 13 172.239 0.300 . 1 . . . . 150 THR C . 26780 1 1725 . 1 1 153 153 THR CA C 13 60.945 0.300 . 1 . . . . 150 THR CA . 26780 1 1726 . 1 1 153 153 THR CB C 13 69.979 0.300 . 1 . . . . 150 THR CB . 26780 1 1727 . 1 1 153 153 THR CG2 C 13 22.545 0.300 . 1 . . . . 150 THR CG2 . 26780 1 1728 . 1 1 153 153 THR N N 15 113.957 0.200 . 1 . . . . 150 THR N . 26780 1 1729 . 1 1 154 154 ASP H H 1 6.586 0.020 . 1 . . . . 151 ASP H . 26780 1 1730 . 1 1 154 154 ASP HA H 1 4.784 0.020 . 1 . . . . 151 ASP HA . 26780 1 1731 . 1 1 154 154 ASP HB2 H 1 2.144 0.020 . 2 . . . . 151 ASP HB2 . 26780 1 1732 . 1 1 154 154 ASP HB3 H 1 2.144 0.020 . 2 . . . . 151 ASP HB3 . 26780 1 1733 . 1 1 154 154 ASP C C 13 174.259 0.300 . 1 . . . . 151 ASP C . 26780 1 1734 . 1 1 154 154 ASP CA C 13 54.116 0.300 . 1 . . . . 151 ASP CA . 26780 1 1735 . 1 1 154 154 ASP CB C 13 43.659 0.300 . 1 . . . . 151 ASP CB . 26780 1 1736 . 1 1 154 154 ASP N N 15 119.872 0.200 . 1 . . . . 151 ASP N . 26780 1 1737 . 1 1 155 155 PHE H H 1 9.026 0.020 . 1 . . . . 152 PHE H . 26780 1 1738 . 1 1 155 155 PHE HA H 1 4.864 0.020 . 1 . . . . 152 PHE HA . 26780 1 1739 . 1 1 155 155 PHE HB2 H 1 2.892 0.020 . 2 . . . . 152 PHE HB2 . 26780 1 1740 . 1 1 155 155 PHE HB3 H 1 2.892 0.020 . 2 . . . . 152 PHE HB3 . 26780 1 1741 . 1 1 155 155 PHE C C 13 174.679 0.300 . 1 . . . . 152 PHE C . 26780 1 1742 . 1 1 155 155 PHE CA C 13 57.156 0.300 . 1 . . . . 152 PHE CA . 26780 1 1743 . 1 1 155 155 PHE CB C 13 42.826 0.300 . 1 . . . . 152 PHE CB . 26780 1 1744 . 1 1 155 155 PHE N N 15 118.605 0.200 . 1 . . . . 152 PHE N . 26780 1 1745 . 1 1 156 156 GLY H H 1 9.272 0.020 . 1 . . . . 153 GLY H . 26780 1 1746 . 1 1 156 156 GLY HA2 H 1 3.396 0.020 . 2 . . . . 153 GLY HA2 . 26780 1 1747 . 1 1 156 156 GLY HA3 H 1 3.396 0.020 . 2 . . . . 153 GLY HA3 . 26780 1 1748 . 1 1 156 156 GLY C C 13 176.781 0.300 . 1 . . . . 153 GLY C . 26780 1 1749 . 1 1 156 156 GLY CA C 13 45.486 0.300 . 1 . . . . 153 GLY CA . 26780 1 1750 . 1 1 156 156 GLY N N 15 109.787 0.200 . 1 . . . . 153 GLY N . 26780 1 1751 . 1 1 157 157 LEU H H 1 7.947 0.020 . 1 . . . . 154 LEU H . 26780 1 1752 . 1 1 157 157 LEU HA H 1 4.786 0.020 . 1 . . . . 154 LEU HA . 26780 1 1753 . 1 1 157 157 LEU HB2 H 1 1.113 0.020 . 2 . . . . 154 LEU HB2 . 26780 1 1754 . 1 1 157 157 LEU HB3 H 1 1.658 0.020 . 2 . . . . 154 LEU HB3 . 26780 1 1755 . 1 1 157 157 LEU HG H 1 1.253 0.020 . 1 . . . . 154 LEU HG . 26780 1 1756 . 1 1 157 157 LEU HD11 H 1 0.507 0.020 . 2 . . . . 154 LEU QD1 . 26780 1 1757 . 1 1 157 157 LEU HD12 H 1 0.507 0.020 . 2 . . . . 154 LEU QD1 . 26780 1 1758 . 1 1 157 157 LEU HD13 H 1 0.507 0.020 . 2 . . . . 154 LEU QD1 . 26780 1 1759 . 1 1 157 157 LEU HD21 H 1 0.528 0.020 . 2 . . . . 154 LEU QD2 . 26780 1 1760 . 1 1 157 157 LEU HD22 H 1 0.528 0.020 . 2 . . . . 154 LEU QD2 . 26780 1 1761 . 1 1 157 157 LEU HD23 H 1 0.528 0.020 . 2 . . . . 154 LEU QD2 . 26780 1 1762 . 1 1 157 157 LEU C C 13 176.334 0.300 . 1 . . . . 154 LEU C . 26780 1 1763 . 1 1 157 157 LEU CA C 13 53.956 0.300 . 1 . . . . 154 LEU CA . 26780 1 1764 . 1 1 157 157 LEU CB C 13 43.552 0.300 . 1 . . . . 154 LEU CB . 26780 1 1765 . 1 1 157 157 LEU CG C 13 27.726 0.300 . 1 . . . . 154 LEU CG . 26780 1 1766 . 1 1 157 157 LEU CD1 C 13 25.300 0.300 . 1 . . . . 154 LEU CD1 . 26780 1 1767 . 1 1 157 157 LEU CD2 C 13 23.901 0.300 . 1 . . . . 154 LEU CD2 . 26780 1 1768 . 1 1 157 157 LEU N N 15 121.685 0.200 . 1 . . . . 154 LEU N . 26780 1 1769 . 1 1 158 158 THR H H 1 8.743 0.020 . 1 . . . . 155 THR H . 26780 1 1770 . 1 1 158 158 THR HA H 1 4.333 0.020 . 1 . . . . 155 THR HA . 26780 1 1771 . 1 1 158 158 THR HB H 1 3.867 0.020 . 1 . . . . 155 THR HB . 26780 1 1772 . 1 1 158 158 THR HG21 H 1 1.025 0.020 . 1 . . . . 155 THR QG2 . 26780 1 1773 . 1 1 158 158 THR HG22 H 1 1.025 0.020 . 1 . . . . 155 THR QG2 . 26780 1 1774 . 1 1 158 158 THR HG23 H 1 1.025 0.020 . 1 . . . . 155 THR QG2 . 26780 1 1775 . 1 1 158 158 THR C C 13 173.621 0.300 . 1 . . . . 155 THR C . 26780 1 1776 . 1 1 158 158 THR CA C 13 61.504 0.300 . 1 . . . . 155 THR CA . 26780 1 1777 . 1 1 158 158 THR CB C 13 69.983 0.300 . 1 . . . . 155 THR CB . 26780 1 1778 . 1 1 158 158 THR CG2 C 13 20.880 0.300 . 1 . . . . 155 THR CG2 . 26780 1 1779 . 1 1 158 158 THR N N 15 123.826 0.200 . 1 . . . . 155 THR N . 26780 1 1780 . 1 1 159 159 MET H H 1 8.742 0.020 . 1 . . . . 156 MET H . 26780 1 1781 . 1 1 159 159 MET HA H 1 4.731 0.020 . 1 . . . . 156 MET HA . 26780 1 1782 . 1 1 159 159 MET HB2 H 1 1.845 0.020 . 2 . . . . 156 MET HB2 . 26780 1 1783 . 1 1 159 159 MET HB3 H 1 1.845 0.020 . 2 . . . . 156 MET HB3 . 26780 1 1784 . 1 1 159 159 MET HG2 H 1 2.389 0.020 . 2 . . . . 156 MET HG2 . 26780 1 1785 . 1 1 159 159 MET HG3 H 1 2.636 0.020 . 2 . . . . 156 MET HG3 . 26780 1 1786 . 1 1 159 159 MET HE1 H 1 1.952 0.020 . 1 . . . . 156 MET QE . 26780 1 1787 . 1 1 159 159 MET HE2 H 1 1.952 0.020 . 1 . . . . 156 MET QE . 26780 1 1788 . 1 1 159 159 MET HE3 H 1 1.952 0.020 . 1 . . . . 156 MET QE . 26780 1 1789 . 1 1 159 159 MET C C 13 176.361 0.300 . 1 . . . . 156 MET C . 26780 1 1790 . 1 1 159 159 MET CA C 13 54.138 0.300 . 1 . . . . 156 MET CA . 26780 1 1791 . 1 1 159 159 MET CB C 13 30.479 0.300 . 1 . . . . 156 MET CB . 26780 1 1792 . 1 1 159 159 MET CG C 13 32.168 0.300 . 1 . . . . 156 MET CG . 26780 1 1793 . 1 1 159 159 MET CE C 13 16.644 0.300 . 1 . . . . 156 MET CE . 26780 1 1794 . 1 1 159 159 MET N N 15 125.210 0.200 . 1 . . . . 156 MET N . 26780 1 1795 . 1 1 160 160 LEU H H 1 8.417 0.020 . 1 . . . . 157 LEU H . 26780 1 1796 . 1 1 160 160 LEU HA H 1 4.187 0.020 . 1 . . . . 157 LEU HA . 26780 1 1797 . 1 1 160 160 LEU HB2 H 1 1.276 0.020 . 2 . . . . 157 LEU HB2 . 26780 1 1798 . 1 1 160 160 LEU HB3 H 1 1.313 0.020 . 2 . . . . 157 LEU HB3 . 26780 1 1799 . 1 1 160 160 LEU HG H 1 1.349 0.020 . 1 . . . . 157 LEU HG . 26780 1 1800 . 1 1 160 160 LEU HD11 H 1 0.663 0.020 . 2 . . . . 157 LEU QD1 . 26780 1 1801 . 1 1 160 160 LEU HD12 H 1 0.663 0.020 . 2 . . . . 157 LEU QD1 . 26780 1 1802 . 1 1 160 160 LEU HD13 H 1 0.663 0.020 . 2 . . . . 157 LEU QD1 . 26780 1 1803 . 1 1 160 160 LEU HD21 H 1 0.693 0.020 . 2 . . . . 157 LEU QD2 . 26780 1 1804 . 1 1 160 160 LEU HD22 H 1 0.693 0.020 . 2 . . . . 157 LEU QD2 . 26780 1 1805 . 1 1 160 160 LEU HD23 H 1 0.693 0.020 . 2 . . . . 157 LEU QD2 . 26780 1 1806 . 1 1 160 160 LEU C C 13 175.724 0.300 . 1 . . . . 157 LEU C . 26780 1 1807 . 1 1 160 160 LEU CA C 13 54.929 0.300 . 1 . . . . 157 LEU CA . 26780 1 1808 . 1 1 160 160 LEU CB C 13 42.532 0.300 . 1 . . . . 157 LEU CB . 26780 1 1809 . 1 1 160 160 LEU CG C 13 27.211 0.300 . 1 . . . . 157 LEU CG . 26780 1 1810 . 1 1 160 160 LEU CD1 C 13 22.869 0.300 . 1 . . . . 157 LEU CD1 . 26780 1 1811 . 1 1 160 160 LEU CD2 C 13 25.108 0.300 . 1 . . . . 157 LEU CD2 . 26780 1 1812 . 1 1 160 160 LEU N N 15 123.861 0.200 . 1 . . . . 157 LEU N . 26780 1 1813 . 1 1 161 161 PHE H H 1 7.640 0.020 . 1 . . . . 158 PHE H . 26780 1 1814 . 1 1 161 161 PHE HA H 1 4.312 0.020 . 1 . . . . 158 PHE HA . 26780 1 1815 . 1 1 161 161 PHE HB2 H 1 2.813 0.020 . 2 . . . . 158 PHE HB2 . 26780 1 1816 . 1 1 161 161 PHE HB3 H 1 3.072 0.020 . 2 . . . . 158 PHE HB3 . 26780 1 1817 . 1 1 161 161 PHE CA C 13 58.755 0.300 . 1 . . . . 158 PHE CA . 26780 1 1818 . 1 1 161 161 PHE CB C 13 40.523 0.300 . 1 . . . . 158 PHE CB . 26780 1 1819 . 1 1 161 161 PHE N N 15 124.218 0.200 . 1 . . . . 158 PHE N . 26780 1 stop_ save_