data_26774 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26774 _Entry.Title ; 1H, 13C, and 15N Resonance Assignments for the Ribosomal Protein S1 280-438 from Mycobacterium tuberculosis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-04-11 _Entry.Accession_date 2016-04-11 _Entry.Last_release_date 2016-04-12 _Entry.Original_release_date 2016-04-12 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jinglin Fu . . . . 26774 2 Xinli Liao . . . . 26774 3 Biling Huang . . . . 26774 4 Donghai Lin . . . . 26774 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26774 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 662 26774 '15N chemical shifts' 157 26774 '1H chemical shifts' 1054 26774 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2018-05-25 2017-01-01 update BMRB 'update entry citation' 26774 1 . . 2017-08-24 2017-01-01 original author 'original release' 26774 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26774 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-017-9734-y _Citation.PubMed_ID 28258550 _Citation.Full_citation . _Citation.Title ; Chemical shift assignments of Ribosomal protein S1 from Mycobacterium tuberculosis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 11 _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 133 _Citation.Page_last 136 _Citation.Year 2017 _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 Jinglin Fu J. . . . 26774 1 2 Biling Huang B. . . . 26774 1 3 Donghai Lin D. . . . 26774 1 4 Xinli Liao X. . . . 26774 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26774 _Assembly.ID 1 _Assembly.Name 'ribosomal protein S1' _Assembly.BMRB_code . _Assembly.Number_of_components . _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 . _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 'S1-like domains' 1 $Mtb_ribosomal_S1 A . yes native no no . . . 26774 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Mtb_ribosomal_S1 _Entity.Sf_category entity _Entity.Sf_framecode Mtb_ribosomal_S1 _Entity.Entry_ID 26774 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Mtb_ribosomal_S1 _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 ; MQEDPWRHFARTHAIGQIVP GKVTKLVPFGAFVRVEEGIE GLVHISELAERHVEVPDQVV AVGDDAMVKVIDIDLERRRI SLSLKQANEDYTEEFDPAKY GMADSYDEQGNYIFPEGFDA ETNEWLEGFEKQRAEWEARY AEAERRHKMHTAQMEKFAAA LEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 168 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 0 MET . 26774 1 2 1 GLN . 26774 1 3 2 GLU . 26774 1 4 3 ASP . 26774 1 5 4 PRO . 26774 1 6 5 TRP . 26774 1 7 6 ARG . 26774 1 8 7 HIS . 26774 1 9 8 PHE . 26774 1 10 9 ALA . 26774 1 11 10 ARG . 26774 1 12 11 THR . 26774 1 13 12 HIS . 26774 1 14 13 ALA . 26774 1 15 14 ILE . 26774 1 16 15 GLY . 26774 1 17 16 GLN . 26774 1 18 17 ILE . 26774 1 19 18 VAL . 26774 1 20 19 PRO . 26774 1 21 20 GLY . 26774 1 22 21 LYS . 26774 1 23 22 VAL . 26774 1 24 23 THR . 26774 1 25 24 LYS . 26774 1 26 25 LEU . 26774 1 27 26 VAL . 26774 1 28 27 PRO . 26774 1 29 28 PHE . 26774 1 30 29 GLY . 26774 1 31 30 ALA . 26774 1 32 31 PHE . 26774 1 33 32 VAL . 26774 1 34 33 ARG . 26774 1 35 34 VAL . 26774 1 36 35 GLU . 26774 1 37 36 GLU . 26774 1 38 37 GLY . 26774 1 39 38 ILE . 26774 1 40 39 GLU . 26774 1 41 40 GLY . 26774 1 42 41 LEU . 26774 1 43 42 VAL . 26774 1 44 43 HIS . 26774 1 45 44 ILE . 26774 1 46 45 SER . 26774 1 47 46 GLU . 26774 1 48 47 LEU . 26774 1 49 48 ALA . 26774 1 50 49 GLU . 26774 1 51 50 ARG . 26774 1 52 51 HIS . 26774 1 53 52 VAL . 26774 1 54 53 GLU . 26774 1 55 54 VAL . 26774 1 56 55 PRO . 26774 1 57 56 ASP . 26774 1 58 57 GLN . 26774 1 59 58 VAL . 26774 1 60 59 VAL . 26774 1 61 60 ALA . 26774 1 62 61 VAL . 26774 1 63 62 GLY . 26774 1 64 63 ASP . 26774 1 65 64 ASP . 26774 1 66 65 ALA . 26774 1 67 66 MET . 26774 1 68 67 VAL . 26774 1 69 68 LYS . 26774 1 70 69 VAL . 26774 1 71 70 ILE . 26774 1 72 71 ASP . 26774 1 73 72 ILE . 26774 1 74 73 ASP . 26774 1 75 74 LEU . 26774 1 76 75 GLU . 26774 1 77 76 ARG . 26774 1 78 77 ARG . 26774 1 79 78 ARG . 26774 1 80 79 ILE . 26774 1 81 80 SER . 26774 1 82 81 LEU . 26774 1 83 82 SER . 26774 1 84 83 LEU . 26774 1 85 84 LYS . 26774 1 86 85 GLN . 26774 1 87 86 ALA . 26774 1 88 87 ASN . 26774 1 89 88 GLU . 26774 1 90 89 ASP . 26774 1 91 90 TYR . 26774 1 92 91 THR . 26774 1 93 92 GLU . 26774 1 94 93 GLU . 26774 1 95 94 PHE . 26774 1 96 95 ASP . 26774 1 97 96 PRO . 26774 1 98 97 ALA . 26774 1 99 98 LYS . 26774 1 100 99 TYR . 26774 1 101 100 GLY . 26774 1 102 101 MET . 26774 1 103 102 ALA . 26774 1 104 103 ASP . 26774 1 105 104 SER . 26774 1 106 105 TYR . 26774 1 107 106 ASP . 26774 1 108 107 GLU . 26774 1 109 108 GLN . 26774 1 110 109 GLY . 26774 1 111 110 ASN . 26774 1 112 111 TYR . 26774 1 113 112 ILE . 26774 1 114 113 PHE . 26774 1 115 114 PRO . 26774 1 116 115 GLU . 26774 1 117 116 GLY . 26774 1 118 117 PHE . 26774 1 119 118 ASP . 26774 1 120 119 ALA . 26774 1 121 120 GLU . 26774 1 122 121 THR . 26774 1 123 122 ASN . 26774 1 124 123 GLU . 26774 1 125 124 TRP . 26774 1 126 125 LEU . 26774 1 127 126 GLU . 26774 1 128 127 GLY . 26774 1 129 128 PHE . 26774 1 130 129 GLU . 26774 1 131 130 LYS . 26774 1 132 131 GLN . 26774 1 133 132 ARG . 26774 1 134 133 ALA . 26774 1 135 134 GLU . 26774 1 136 135 TRP . 26774 1 137 136 GLU . 26774 1 138 137 ALA . 26774 1 139 138 ARG . 26774 1 140 139 TYR . 26774 1 141 140 ALA . 26774 1 142 141 GLU . 26774 1 143 142 ALA . 26774 1 144 143 GLU . 26774 1 145 144 ARG . 26774 1 146 145 ARG . 26774 1 147 146 HIS . 26774 1 148 147 LYS . 26774 1 149 148 MET . 26774 1 150 149 HIS . 26774 1 151 150 THR . 26774 1 152 151 ALA . 26774 1 153 152 GLN . 26774 1 154 153 MET . 26774 1 155 154 GLU . 26774 1 156 155 LYS . 26774 1 157 156 PHE . 26774 1 158 157 ALA . 26774 1 159 158 ALA . 26774 1 160 159 ALA . 26774 1 161 160 LEU . 26774 1 162 161 GLU . 26774 1 163 162 HIS . 26774 1 164 163 HIS . 26774 1 165 164 HIS . 26774 1 166 165 HIS . 26774 1 167 166 HIS . 26774 1 168 167 HIS . 26774 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26774 1 . GLN 2 2 26774 1 . GLU 3 3 26774 1 . ASP 4 4 26774 1 . PRO 5 5 26774 1 . TRP 6 6 26774 1 . ARG 7 7 26774 1 . HIS 8 8 26774 1 . PHE 9 9 26774 1 . ALA 10 10 26774 1 . ARG 11 11 26774 1 . THR 12 12 26774 1 . HIS 13 13 26774 1 . ALA 14 14 26774 1 . ILE 15 15 26774 1 . GLY 16 16 26774 1 . GLN 17 17 26774 1 . ILE 18 18 26774 1 . VAL 19 19 26774 1 . PRO 20 20 26774 1 . GLY 21 21 26774 1 . LYS 22 22 26774 1 . VAL 23 23 26774 1 . THR 24 24 26774 1 . LYS 25 25 26774 1 . LEU 26 26 26774 1 . VAL 27 27 26774 1 . PRO 28 28 26774 1 . PHE 29 29 26774 1 . GLY 30 30 26774 1 . ALA 31 31 26774 1 . PHE 32 32 26774 1 . VAL 33 33 26774 1 . ARG 34 34 26774 1 . VAL 35 35 26774 1 . GLU 36 36 26774 1 . GLU 37 37 26774 1 . GLY 38 38 26774 1 . ILE 39 39 26774 1 . GLU 40 40 26774 1 . GLY 41 41 26774 1 . LEU 42 42 26774 1 . VAL 43 43 26774 1 . HIS 44 44 26774 1 . ILE 45 45 26774 1 . SER 46 46 26774 1 . GLU 47 47 26774 1 . LEU 48 48 26774 1 . ALA 49 49 26774 1 . GLU 50 50 26774 1 . ARG 51 51 26774 1 . HIS 52 52 26774 1 . VAL 53 53 26774 1 . GLU 54 54 26774 1 . VAL 55 55 26774 1 . PRO 56 56 26774 1 . ASP 57 57 26774 1 . GLN 58 58 26774 1 . VAL 59 59 26774 1 . VAL 60 60 26774 1 . ALA 61 61 26774 1 . VAL 62 62 26774 1 . GLY 63 63 26774 1 . ASP 64 64 26774 1 . ASP 65 65 26774 1 . ALA 66 66 26774 1 . MET 67 67 26774 1 . VAL 68 68 26774 1 . LYS 69 69 26774 1 . VAL 70 70 26774 1 . ILE 71 71 26774 1 . ASP 72 72 26774 1 . ILE 73 73 26774 1 . ASP 74 74 26774 1 . LEU 75 75 26774 1 . GLU 76 76 26774 1 . ARG 77 77 26774 1 . ARG 78 78 26774 1 . ARG 79 79 26774 1 . ILE 80 80 26774 1 . SER 81 81 26774 1 . LEU 82 82 26774 1 . SER 83 83 26774 1 . LEU 84 84 26774 1 . LYS 85 85 26774 1 . GLN 86 86 26774 1 . ALA 87 87 26774 1 . ASN 88 88 26774 1 . GLU 89 89 26774 1 . ASP 90 90 26774 1 . TYR 91 91 26774 1 . THR 92 92 26774 1 . GLU 93 93 26774 1 . GLU 94 94 26774 1 . PHE 95 95 26774 1 . ASP 96 96 26774 1 . PRO 97 97 26774 1 . ALA 98 98 26774 1 . LYS 99 99 26774 1 . TYR 100 100 26774 1 . GLY 101 101 26774 1 . MET 102 102 26774 1 . ALA 103 103 26774 1 . ASP 104 104 26774 1 . SER 105 105 26774 1 . TYR 106 106 26774 1 . ASP 107 107 26774 1 . GLU 108 108 26774 1 . GLN 109 109 26774 1 . GLY 110 110 26774 1 . ASN 111 111 26774 1 . TYR 112 112 26774 1 . ILE 113 113 26774 1 . PHE 114 114 26774 1 . PRO 115 115 26774 1 . GLU 116 116 26774 1 . GLY 117 117 26774 1 . PHE 118 118 26774 1 . ASP 119 119 26774 1 . ALA 120 120 26774 1 . GLU 121 121 26774 1 . THR 122 122 26774 1 . ASN 123 123 26774 1 . GLU 124 124 26774 1 . TRP 125 125 26774 1 . LEU 126 126 26774 1 . GLU 127 127 26774 1 . GLY 128 128 26774 1 . PHE 129 129 26774 1 . GLU 130 130 26774 1 . LYS 131 131 26774 1 . GLN 132 132 26774 1 . ARG 133 133 26774 1 . ALA 134 134 26774 1 . GLU 135 135 26774 1 . TRP 136 136 26774 1 . GLU 137 137 26774 1 . ALA 138 138 26774 1 . ARG 139 139 26774 1 . TYR 140 140 26774 1 . ALA 141 141 26774 1 . GLU 142 142 26774 1 . ALA 143 143 26774 1 . GLU 144 144 26774 1 . ARG 145 145 26774 1 . ARG 146 146 26774 1 . HIS 147 147 26774 1 . LYS 148 148 26774 1 . MET 149 149 26774 1 . HIS 150 150 26774 1 . THR 151 151 26774 1 . ALA 152 152 26774 1 . GLN 153 153 26774 1 . MET 154 154 26774 1 . GLU 155 155 26774 1 . LYS 156 156 26774 1 . PHE 157 157 26774 1 . ALA 158 158 26774 1 . ALA 159 159 26774 1 . ALA 160 160 26774 1 . LEU 161 161 26774 1 . GLU 162 162 26774 1 . HIS 163 163 26774 1 . HIS 164 164 26774 1 . HIS 165 165 26774 1 . HIS 166 166 26774 1 . HIS 167 167 26774 1 . HIS 168 168 26774 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 26774 _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 $Mtb_ribosomal_S1 . 83332 organism . 'Mycobacterium tuberculosis' 'high GC Gram+' . . . . Mycobacterium tuberculosis H37Rv . . . . . . . . . . . . 26774 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 26774 _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 $Mtb_ribosomal_S1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-22b . . . 26774 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26774 _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 'Mtb ribosomal S1' '[U-13C; U-15N]' . . 1 $Mtb_ribosomal_S1 . . 0.5 . . mM . . . . 26774 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26774 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26774 1 4 Na2HPO4 'natural abundance' . . . . . . 20 . . mM . . . . 26774 1 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 26774 1 6 PMSF 'natural abundance' . . . . . . 1 . . mM . . . . 26774 1 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 26774 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 26774 _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' 150 . mM 26774 1 pH 6.3 . pH 26774 1 pressure 1 . atm 26774 1 temperature 298 . K 26774 1 stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 26774 _Software.ID 1 _Software.Type . _Software.Name CCPN _Software.Version V2.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 26774 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26774 1 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 26774 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 26774 _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 . 850 . . . 26774 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 26774 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 2 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 3 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 5 '3D HCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 8 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 9 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 10 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 13 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 1 14 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26774 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 26774 _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 . . . . . 26774 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26774 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26774 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . 26774 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 26774 _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' . . . 26774 1 2 '3D H(CCO)NH' . . . 26774 1 3 '3D C(CO)NH' . . . 26774 1 4 '3D HNCO' . . . 26774 1 5 '3D HCACO' . . . 26774 1 6 '3D HNCACB' . . . 26774 1 7 '3D CBCA(CO)NH' . . . 26774 1 8 '3D HN(CO)CA' . . . 26774 1 9 '3D HNCA' . . . 26774 1 11 '3D 1H-15N NOESY' . . . 26774 1 12 '3D HCCH-TOCSY' . . . 26774 1 14 '2D 1H-13C HSQC' . . . 26774 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLN H H 1 6.798 0.02 . 1 . . 279 . . 1 GLN H1 . 26774 1 2 . 1 1 2 2 GLN HA H 1 4.296 . . 1 . . 935 . . 1 GLN HA . 26774 1 3 . 1 1 2 2 GLN HB2 H 1 2.011 . . 2 . . 937 . . 1 GLN HB2 . 26774 1 4 . 1 1 2 2 GLN HB3 H 1 1.913 . . 2 . . 938 . . 1 GLN HB3 . 26774 1 5 . 1 1 2 2 GLN HG2 H 1 2.300 0.011 . 1 . . 936 . . 1 GLN HG2 . 26774 1 6 . 1 1 2 2 GLN C C 13 175.334 . . 1 . . 1752 . . 1 GLN C . 26774 1 7 . 1 1 2 2 GLN CA C 13 52.846 . . 1 . . 931 . . 1 GLN CA . 26774 1 8 . 1 1 2 2 GLN CB C 13 26.966 . . 1 . . 934 . . 1 GLN CB . 26774 1 9 . 1 1 2 2 GLN CG C 13 33.558 . . 1 . . 743 . . 1 GLN CG . 26774 1 10 . 1 1 2 2 GLN N N 15 114.136 0.24 . 1 . . 280 . . 1 GLN N . 26774 1 11 . 1 1 3 3 GLU H H 1 8.461 0.011 . 1 . . 257 . . 2 GLU H . 26774 1 12 . 1 1 3 3 GLU HA H 1 4.256 . . 1 . . 1934 . . 2 GLU HA . 26774 1 13 . 1 1 3 3 GLU HB2 H 1 1.888 . . 2 . . 915 . . 2 GLU HB2 . 26774 1 14 . 1 1 3 3 GLU HB3 H 1 1.847 0.016 . 2 . . 918 . . 2 GLU HB3 . 26774 1 15 . 1 1 3 3 GLU HG2 H 1 2.266 0.022 . 2 . . 916 . . 2 GLU HG2 . 26774 1 16 . 1 1 3 3 GLU HG3 H 1 2.217 0.0 . 2 . . 917 . . 2 GLU HG3 . 26774 1 17 . 1 1 3 3 GLU C C 13 175.610 0.002 . 1 . . 1753 . . 2 GLU C . 26774 1 18 . 1 1 3 3 GLU CA C 13 56.272 . . 1 . . 921 . . 2 GLU CA . 26774 1 19 . 1 1 3 3 GLU CB C 13 30.840 . . 1 . . 624 . . 2 GLU CB . 26774 1 20 . 1 1 3 3 GLU CG C 13 36.262 . . 1 . . 920 . . 2 GLU CG . 26774 1 21 . 1 1 3 3 GLU N N 15 123.748 0.111 . 1 . . 258 . . 2 GLU N . 26774 1 22 . 1 1 4 4 ASP H H 1 8.533 0.02 . 1 . . 205 . . 3 ASP H . 26774 1 23 . 1 1 4 4 ASP HA H 1 4.184 . . 1 . . 1928 . . 3 ASP HA . 26774 1 24 . 1 1 4 4 ASP HB2 H 1 2.726 . . 2 . . 1935 . . 3 ASP HB2 . 26774 1 25 . 1 1 4 4 ASP HB3 H 1 2.207 0.02 . 2 . . 1936 . . 3 ASP HB3 . 26774 1 26 . 1 1 4 4 ASP C C 13 175.247 0.004 . 1 . . 1754 . . 3 ASP C . 26774 1 27 . 1 1 4 4 ASP CA C 13 52.226 . . 1 . . 492 . . 3 ASP CA . 26774 1 28 . 1 1 4 4 ASP CB C 13 42.034 . . 1 . . 493 . . 3 ASP CB . 26774 1 29 . 1 1 4 4 ASP N N 15 124.492 0.229 . 1 . . 206 . . 3 ASP N . 26774 1 30 . 1 1 5 5 PRO HA H 1 4.506 0.007 . 1 . . 924 . . 4 PRO HA . 26774 1 31 . 1 1 5 5 PRO HB2 H 1 2.667 . . 1 . . 927 . . 4 PRO HB2 . 26774 1 32 . 1 1 5 5 PRO HD2 H 1 3.348 . . 2 . . 925 . . 4 PRO HD2 . 26774 1 33 . 1 1 5 5 PRO HD3 H 1 3.038 . . 2 . . 926 . . 4 PRO HD3 . 26774 1 34 . 1 1 5 5 PRO C C 13 173.914 . . 1 . . 1756 . . 4 PRO C . 26774 1 35 . 1 1 5 5 PRO CA C 13 59.434 . . 1 . . 2254 . . 4 PRO CA . 26774 1 36 . 1 1 5 5 PRO CB C 13 30.061 . . 1 . . 1824 . . 4 PRO CB . 26774 1 37 . 1 1 6 6 TRP H H 1 8.001 0.014 . 1 . . 19 . . 5 TRP H . 26774 1 38 . 1 1 6 6 TRP HA H 1 4.570 . . 1 . . 1937 . . 5 TRP HA . 26774 1 39 . 1 1 6 6 TRP HB2 H 1 3.075 . . 2 . . 922 . . 5 TRP HB2 . 26774 1 40 . 1 1 6 6 TRP HB3 H 1 2.960 0.007 . 2 . . 923 . . 5 TRP HB3 . 26774 1 41 . 1 1 6 6 TRP HE1 H 1 10.006 0.022 . 1 . . 275 . . 5 TRP HE1 . 26774 1 42 . 1 1 6 6 TRP HE3 H 1 7.224 0.025 . 1 . . 1907 . . 5 TRP HE3 . 26774 1 43 . 1 1 6 6 TRP C C 13 179.150 . . 1 . . 1755 . . 5 TRP C . 26774 1 44 . 1 1 6 6 TRP CA C 13 57.176 . . 1 . . 487 . . 5 TRP CA . 26774 1 45 . 1 1 6 6 TRP CB C 13 30.176 . . 1 . . 488 . . 5 TRP CB . 26774 1 46 . 1 1 6 6 TRP N N 15 125.332 0.234 . 1 . . 20 . . 5 TRP N . 26774 1 47 . 1 1 6 6 TRP NE1 N 15 128.758 0.122 . 1 . . 276 . . 5 TRP NE1 . 26774 1 48 . 1 1 7 7 ARG HA H 1 3.952 0.002 . 1 . . 2231 . . 6 ARG HA . 26774 1 49 . 1 1 7 7 ARG C C 13 178.497 . . 1 . . 2234 . . 6 ARG C . 26774 1 50 . 1 1 7 7 ARG CA C 13 59.111 0.014 . 1 . . 2232 . . 6 ARG CA . 26774 1 51 . 1 1 7 7 ARG CB C 13 29.617 . . 1 . . 2233 . . 6 ARG CB . 26774 1 52 . 1 1 8 8 HIS H H 1 8.327 0.012 . 1 . . 99 . . 7 HIS H . 26774 1 53 . 1 1 8 8 HIS HA H 1 4.324 . . 1 . . 1910 . . 7 HIS HA . 26774 1 54 . 1 1 8 8 HIS HB2 H 1 2.985 . . 2 . . 1908 . . 7 HIS HB2 . 26774 1 55 . 1 1 8 8 HIS HB3 H 1 3.159 . . 2 . . 1909 . . 7 HIS HB3 . 26774 1 56 . 1 1 8 8 HIS HD2 H 1 7.180 . . 1 . . 2069 . . 7 HIS HD2 . 26774 1 57 . 1 1 8 8 HIS HE1 H 1 7.913 0.001 . 1 . . 2068 . . 7 HIS HE1 . 26774 1 58 . 1 1 8 8 HIS C C 13 177.818 . . 1 . . 1757 . . 7 HIS C . 26774 1 59 . 1 1 8 8 HIS CA C 13 59.708 . . 1 . . 445 . . 7 HIS CA . 26774 1 60 . 1 1 8 8 HIS CB C 13 29.639 . . 1 . . 517 . . 7 HIS CB . 26774 1 61 . 1 1 8 8 HIS CE1 C 13 135.671 . . 1 . . 2070 . . 7 HIS CE1 . 26774 1 62 . 1 1 8 8 HIS N N 15 117.883 0.14 . 1 . . 100 . . 7 HIS N . 26774 1 63 . 1 1 9 9 PHE H H 1 8.466 0.01 . 1 . . 183 . . 8 PHE H . 26774 1 64 . 1 1 9 9 PHE HA H 1 5.026 0.016 . 1 . . 1818 . . 8 PHE HA . 26774 1 65 . 1 1 9 9 PHE HB2 H 1 3.162 . . 2 . . 1913 . . 8 PHE HB2 . 26774 1 66 . 1 1 9 9 PHE HB3 H 1 2.828 0.021 . 2 . . 1914 . . 8 PHE HB3 . 26774 1 67 . 1 1 9 9 PHE HD1 H 1 7.051 0.016 . 1 . . 1915 . . 8 PHE HD1 . 26774 1 68 . 1 1 9 9 PHE HD2 H 1 7.051 0.016 . 1 . . 1915 . . 8 PHE HD2 . 26774 1 69 . 1 1 9 9 PHE HE1 H 1 7.437 0.014 . 1 . . 1916 . . 8 PHE HE1 . 26774 1 70 . 1 1 9 9 PHE HE2 H 1 7.437 0.014 . 1 . . 1916 . . 8 PHE HE2 . 26774 1 71 . 1 1 9 9 PHE HZ H 1 8.079 0.001 . 1 . . 1975 . . 8 PHE HZ . 26774 1 72 . 1 1 9 9 PHE C C 13 177.958 . . 1 . . 1819 . . 8 PHE C . 26774 1 73 . 1 1 9 9 PHE CA C 13 62.193 . . 1 . . 736 . . 8 PHE CA . 26774 1 74 . 1 1 9 9 PHE CB C 13 39.228 . . 1 . . 737 . . 8 PHE CB . 26774 1 75 . 1 1 9 9 PHE CD1 C 13 132.012 . . 1 . . 2076 . . 8 PHE CD1 . 26774 1 76 . 1 1 9 9 PHE CD2 C 13 132.012 . . 1 . . 2076 . . 8 PHE CD2 . 26774 1 77 . 1 1 9 9 PHE CE1 C 13 131.303 . . 1 . . 2078 . . 8 PHE CE1 . 26774 1 78 . 1 1 9 9 PHE CE2 C 13 131.303 . . 1 . . 2078 . . 8 PHE CE2 . 26774 1 79 . 1 1 9 9 PHE CZ C 13 136.652 . . 1 . . 2077 . . 8 PHE CZ . 26774 1 80 . 1 1 9 9 PHE N N 15 120.645 0.073 . 1 . . 184 . . 8 PHE N . 26774 1 81 . 1 1 11 11 ARG H H 1 7.605 0.015 . 1 . . 127 . . 10 ARG H . 26774 1 82 . 1 1 11 11 ARG C C 13 177.576 . . 1 . . 1760 . . 10 ARG C . 26774 1 83 . 1 1 11 11 ARG CA C 13 58.067 . . 1 . . 546 . . 10 ARG CA . 26774 1 84 . 1 1 11 11 ARG CB C 13 30.322 . . 1 . . 547 . . 10 ARG CB . 26774 1 85 . 1 1 11 11 ARG N N 15 119.313 0.111 . 1 . . 128 . . 10 ARG N . 26774 1 86 . 1 1 12 12 THR H H 1 7.057 0.023 . 1 . . 115 . . 11 THR H . 26774 1 87 . 1 1 12 12 THR HA H 1 4.100 0.021 . 1 . . 873 . . 11 THR HA . 26774 1 88 . 1 1 12 12 THR HB H 1 4.053 . . 1 . . 1918 . . 11 THR HB . 26774 1 89 . 1 1 12 12 THR HG1 H 1 3.813 . . 1 . . 1917 . . 11 THR HG1 . 26774 1 90 . 1 1 12 12 THR HG21 H 1 1.682 0.02 . 1 . . 875 . . 11 THR HG21 . 26774 1 91 . 1 1 12 12 THR HG22 H 1 1.682 0.02 . 1 . . 875 . . 11 THR HG22 . 26774 1 92 . 1 1 12 12 THR HG23 H 1 1.682 0.02 . 1 . . 875 . . 11 THR HG23 . 26774 1 93 . 1 1 12 12 THR C C 13 173.698 . . 1 . . 1231 . . 11 THR C . 26774 1 94 . 1 1 12 12 THR CA C 13 61.553 . . 1 . . 543 . . 11 THR CA . 26774 1 95 . 1 1 12 12 THR CB C 13 70.400 . . 1 . . 430 . . 11 THR CB . 26774 1 96 . 1 1 12 12 THR CG2 C 13 19.907 . . 1 . . 744 . . 11 THR CG2 . 26774 1 97 . 1 1 12 12 THR N N 15 105.879 0.109 . 1 . . 116 . . 11 THR N . 26774 1 98 . 1 1 13 13 HIS H H 1 7.200 0.016 . 1 . . 244 . . 12 HIS H . 26774 1 99 . 1 1 13 13 HIS HA H 1 4.346 . . 1 . . 890 . . 12 HIS HA . 26774 1 100 . 1 1 13 13 HIS HB2 H 1 3.107 . . 2 . . 891 . . 12 HIS HB2 . 26774 1 101 . 1 1 13 13 HIS HB3 H 1 3.022 . . 2 . . 892 . . 12 HIS HB3 . 26774 1 102 . 1 1 13 13 HIS HD1 H 1 9.759 . . 1 . . 2071 . . 12 HIS HD1 . 26774 1 103 . 1 1 13 13 HIS HD2 H 1 7.056 0.001 . 1 . . 2039 . . 12 HIS HD2 . 26774 1 104 . 1 1 13 13 HIS HE1 H 1 8.087 0.0 . 1 . . 2040 . . 12 HIS HE1 . 26774 1 105 . 1 1 13 13 HIS C C 13 171.679 . . 1 . . 1232 . . 12 HIS C . 26774 1 106 . 1 1 13 13 HIS CA C 13 54.848 . . 1 . . 455 . . 12 HIS CA . 26774 1 107 . 1 1 13 13 HIS CB C 13 29.881 . . 1 . . 621 . . 12 HIS CB . 26774 1 108 . 1 1 13 13 HIS CD2 C 13 120.195 . . 1 . . 2043 . . 12 HIS CD2 . 26774 1 109 . 1 1 13 13 HIS CE1 C 13 137.531 . . 1 . . 2041 . . 12 HIS CE1 . 26774 1 110 . 1 1 13 13 HIS N N 15 119.435 0.108 . 1 . . 245 . . 12 HIS N . 26774 1 111 . 1 1 14 14 ALA H H 1 7.363 0.013 . 1 . . 193 . . 13 ALA H . 26774 1 112 . 1 1 14 14 ALA HA H 1 4.322 0.008 . 1 . . 893 . . 13 ALA HA . 26774 1 113 . 1 1 14 14 ALA HB1 H 1 1.159 . . 1 . . 1939 . . 13 ALA HB1 . 26774 1 114 . 1 1 14 14 ALA HB2 H 1 1.159 . . 1 . . 1939 . . 13 ALA HB2 . 26774 1 115 . 1 1 14 14 ALA HB3 H 1 1.159 . . 1 . . 1939 . . 13 ALA HB3 . 26774 1 116 . 1 1 14 14 ALA C C 13 176.747 . . 1 . . 1233 . . 13 ALA C . 26774 1 117 . 1 1 14 14 ALA CA C 13 50.553 . . 1 . . 680 . . 13 ALA CA . 26774 1 118 . 1 1 14 14 ALA CB C 13 21.391 . . 1 . . 681 . . 13 ALA CB . 26774 1 119 . 1 1 14 14 ALA N N 15 120.877 0.117 . 1 . . 194 . . 13 ALA N . 26774 1 120 . 1 1 15 15 ILE H H 1 8.167 0.017 . 1 . . 574 . . 14 ILE H . 26774 1 121 . 1 1 15 15 ILE HA H 1 4.268 . . 1 . . 1940 . . 14 ILE HA . 26774 1 122 . 1 1 15 15 ILE HB H 1 2.295 0.02 . 1 . . 899 . . 14 ILE HB . 26774 1 123 . 1 1 15 15 ILE HG12 H 1 1.901 . . 2 . . 900 . . 14 ILE HG12 . 26774 1 124 . 1 1 15 15 ILE HG13 H 1 2.122 . . 2 . . 1944 . . 14 ILE HG13 . 26774 1 125 . 1 1 15 15 ILE HG21 H 1 0.832 0.014 . 1 . . 1941 . . 14 ILE HG21 . 26774 1 126 . 1 1 15 15 ILE HG22 H 1 0.832 0.014 . 1 . . 1941 . . 14 ILE HG22 . 26774 1 127 . 1 1 15 15 ILE HG23 H 1 0.832 0.014 . 1 . . 1941 . . 14 ILE HG23 . 26774 1 128 . 1 1 15 15 ILE HD11 H 1 0.902 . . 1 . . 2147 . . 14 ILE HD11 . 26774 1 129 . 1 1 15 15 ILE HD12 H 1 0.902 . . 1 . . 2147 . . 14 ILE HD12 . 26774 1 130 . 1 1 15 15 ILE HD13 H 1 0.902 . . 1 . . 2147 . . 14 ILE HD13 . 26774 1 131 . 1 1 15 15 ILE C C 13 177.389 . . 1 . . 1234 . . 14 ILE C . 26774 1 132 . 1 1 15 15 ILE CA C 13 63.374 . . 1 . . 895 . . 14 ILE CA . 26774 1 133 . 1 1 15 15 ILE CB C 13 37.218 . . 1 . . 689 . . 14 ILE CB . 26774 1 134 . 1 1 15 15 ILE CG1 C 13 28.896 . . 1 . . 2145 . . 14 ILE CG1 . 26774 1 135 . 1 1 15 15 ILE CG2 C 13 17.569 0.063 . 1 . . 2144 . . 14 ILE CG2 . 26774 1 136 . 1 1 15 15 ILE CD1 C 13 12.891 . . 1 . . 2146 . . 14 ILE CD1 . 26774 1 137 . 1 1 15 15 ILE N N 15 118.750 0.137 . 1 . . 575 . . 14 ILE N . 26774 1 138 . 1 1 16 16 GLY H H 1 9.158 0.015 . 1 . . 285 . . 15 GLY H . 26774 1 139 . 1 1 16 16 GLY HA2 H 1 3.864 0.011 . 2 . . 903 . . 15 GLY HA2 . 26774 1 140 . 1 1 16 16 GLY HA3 H 1 3.959 0.015 . 2 . . 905 . . 15 GLY HA3 . 26774 1 141 . 1 1 16 16 GLY C C 13 173.456 . . 1 . . 1816 . . 15 GLY C . 26774 1 142 . 1 1 16 16 GLY CA C 13 44.579 . . 1 . . 530 . . 15 GLY CA . 26774 1 143 . 1 1 16 16 GLY N N 15 116.627 0.089 . 1 . . 286 . . 15 GLY N . 26774 1 144 . 1 1 17 17 GLN H H 1 7.580 0.011 . 1 . . 568 . . 16 GLN H . 26774 1 145 . 1 1 17 17 GLN HA H 1 4.026 0.029 . 1 . . 948 . . 16 GLN HA . 26774 1 146 . 1 1 17 17 GLN HB2 H 1 2.053 0.019 . 2 . . 951 . . 16 GLN HB2 . 26774 1 147 . 1 1 17 17 GLN HB3 H 1 1.967 . . 2 . . 952 . . 16 GLN HB3 . 26774 1 148 . 1 1 17 17 GLN HG2 H 1 2.244 0.012 . 2 . . 950 . . 16 GLN HG2 . 26774 1 149 . 1 1 17 17 GLN HG3 H 1 2.265 0.018 . 2 . . 1945 . . 16 GLN HG3 . 26774 1 150 . 1 1 17 17 GLN HE21 H 1 6.788 0.012 . 1 . . 97 . . 16 GLN HE21 . 26774 1 151 . 1 1 17 17 GLN HE22 H 1 7.698 0.004 . 1 . . 1923 . . 16 GLN HE22 . 26774 1 152 . 1 1 17 17 GLN C C 13 174.768 . . 1 . . 1815 . . 16 GLN C . 26774 1 153 . 1 1 17 17 GLN CA C 13 55.947 . . 1 . . 625 . . 16 GLN CA . 26774 1 154 . 1 1 17 17 GLN CB C 13 30.229 . . 1 . . 626 . . 16 GLN CB . 26774 1 155 . 1 1 17 17 GLN CG C 13 34.881 . . 1 . . 955 . . 16 GLN CG . 26774 1 156 . 1 1 17 17 GLN N N 15 119.359 0.091 . 1 . . 569 . . 16 GLN N . 26774 1 157 . 1 1 17 17 GLN NE2 N 15 111.334 0.127 . 1 . . 98 . . 16 GLN NE2 . 26774 1 158 . 1 1 18 18 ILE H H 1 8.157 0.014 . 1 . . 335 . . 17 ILE H . 26774 1 159 . 1 1 18 18 ILE HA H 1 4.370 0.012 . 1 . . 957 . . 17 ILE HA . 26774 1 160 . 1 1 18 18 ILE HB H 1 1.745 . . 1 . . 1947 . . 17 ILE HB . 26774 1 161 . 1 1 18 18 ILE HG12 H 1 1.510 0.018 . 2 . . 1826 . . 17 ILE HG12 . 26774 1 162 . 1 1 18 18 ILE HG13 H 1 1.035 0.02 . 2 . . 1830 . . 17 ILE HG13 . 26774 1 163 . 1 1 18 18 ILE HG21 H 1 0.446 0.019 . 1 . . 1832 . . 17 ILE HG21 . 26774 1 164 . 1 1 18 18 ILE HG22 H 1 0.446 0.019 . 1 . . 1832 . . 17 ILE HG22 . 26774 1 165 . 1 1 18 18 ILE HG23 H 1 0.446 0.019 . 1 . . 1832 . . 17 ILE HG23 . 26774 1 166 . 1 1 18 18 ILE HD11 H 1 0.885 0.016 . 1 . . 1831 . . 17 ILE HD11 . 26774 1 167 . 1 1 18 18 ILE HD12 H 1 0.885 0.016 . 1 . . 1831 . . 17 ILE HD12 . 26774 1 168 . 1 1 18 18 ILE HD13 H 1 0.885 0.016 . 1 . . 1831 . . 17 ILE HD13 . 26774 1 169 . 1 1 18 18 ILE C C 13 175.327 . . 1 . . 1834 . . 17 ILE C . 26774 1 170 . 1 1 18 18 ILE CA C 13 60.647 . . 1 . . 627 . . 17 ILE CA . 26774 1 171 . 1 1 18 18 ILE CB C 13 37.363 0.057 . 1 . . 628 . . 17 ILE CB . 26774 1 172 . 1 1 18 18 ILE CG1 C 13 28.056 . . 1 . . 1827 . . 17 ILE CG1 . 26774 1 173 . 1 1 18 18 ILE CG2 C 13 18.426 0.037 . 1 . . 1828 . . 17 ILE CG2 . 26774 1 174 . 1 1 18 18 ILE CD1 C 13 13.551 0.024 . 1 . . 1829 . . 17 ILE CD1 . 26774 1 175 . 1 1 18 18 ILE N N 15 122.423 0.11 . 1 . . 336 . . 17 ILE N . 26774 1 176 . 1 1 19 19 VAL H H 1 9.173 0.011 . 1 . . 325 . . 18 VAL H . 26774 1 177 . 1 1 19 19 VAL HA H 1 4.123 0.024 . 1 . . 1948 . . 18 VAL HA . 26774 1 178 . 1 1 19 19 VAL HB H 1 1.995 . . 1 . . 1840 . . 18 VAL HB . 26774 1 179 . 1 1 19 19 VAL HG11 H 1 0.630 0.007 . 2 . . 1839 . . 18 VAL HG11 . 26774 1 180 . 1 1 19 19 VAL HG12 H 1 0.630 0.007 . 2 . . 1839 . . 18 VAL HG12 . 26774 1 181 . 1 1 19 19 VAL HG13 H 1 0.630 0.007 . 2 . . 1839 . . 18 VAL HG13 . 26774 1 182 . 1 1 19 19 VAL HG21 H 1 0.815 0.006 . 2 . . 1841 . . 18 VAL HG21 . 26774 1 183 . 1 1 19 19 VAL HG22 H 1 0.815 0.006 . 2 . . 1841 . . 18 VAL HG22 . 26774 1 184 . 1 1 19 19 VAL HG23 H 1 0.815 0.006 . 2 . . 1841 . . 18 VAL HG23 . 26774 1 185 . 1 1 19 19 VAL C C 13 172.384 . . 1 . . 1817 . . 18 VAL C . 26774 1 186 . 1 1 19 19 VAL CA C 13 56.787 0.05 . 1 . . 703 . . 18 VAL CA . 26774 1 187 . 1 1 19 19 VAL CB C 13 33.251 . . 1 . . 704 . . 18 VAL CB . 26774 1 188 . 1 1 19 19 VAL CG1 C 13 19.252 0.005 . 2 . . 1837 . . 18 VAL CG1 . 26774 1 189 . 1 1 19 19 VAL CG2 C 13 22.488 . . 2 . . 1838 . . 18 VAL CG2 . 26774 1 190 . 1 1 19 19 VAL N N 15 119.533 0.054 . 1 . . 326 . . 18 VAL N . 26774 1 191 . 1 1 20 20 PRO HA H 1 5.403 0.013 . 1 . . 1580 . . 19 PRO HA . 26774 1 192 . 1 1 20 20 PRO HB2 H 1 2.152 . . 2 . . 1582 . . 19 PRO HB2 . 26774 1 193 . 1 1 20 20 PRO HB3 H 1 2.548 0.01 . 2 . . 1583 . . 19 PRO HB3 . 26774 1 194 . 1 1 20 20 PRO HG2 H 1 2.020 . . 2 . . 1584 . . 19 PRO HG2 . 26774 1 195 . 1 1 20 20 PRO HG3 H 1 1.831 0.016 . 2 . . 1585 . . 19 PRO HG3 . 26774 1 196 . 1 1 20 20 PRO HD2 H 1 4.037 . . 2 . . 1581 . . 19 PRO HD2 . 26774 1 197 . 1 1 20 20 PRO HD3 H 1 3.082 0.014 . 2 . . 1586 . . 19 PRO HD3 . 26774 1 198 . 1 1 20 20 PRO C C 13 177.159 . . 1 . . 1579 . . 19 PRO C . 26774 1 199 . 1 1 20 20 PRO CA C 13 61.949 0.003 . 1 . . 707 . . 19 PRO CA . 26774 1 200 . 1 1 20 20 PRO CB C 13 32.325 . . 1 . . 533 . . 19 PRO CB . 26774 1 201 . 1 1 20 20 PRO CG C 13 27.746 . . 1 . . 1587 . . 19 PRO CG . 26774 1 202 . 1 1 21 21 GLY H H 1 8.792 0.011 . 1 . . 300 . . 20 GLY H . 26774 1 203 . 1 1 21 21 GLY HA2 H 1 3.924 0.022 . 2 . . 959 . . 20 GLY HA2 . 26774 1 204 . 1 1 21 21 GLY HA3 H 1 4.750 0.019 . 2 . . 1949 . . 20 GLY HA3 . 26774 1 205 . 1 1 21 21 GLY C C 13 172.255 . . 1 . . 1578 . . 20 GLY C . 26774 1 206 . 1 1 21 21 GLY CA C 13 44.860 0.054 . 1 . . 436 . . 20 GLY CA . 26774 1 207 . 1 1 21 21 GLY N N 15 108.109 0.129 . 1 . . 301 . . 20 GLY N . 26774 1 208 . 1 1 22 22 LYS H H 1 8.057 0.02 . 1 . . 709 . . 21 LYS H . 26774 1 209 . 1 1 22 22 LYS HA H 1 5.231 0.009 . 1 . . 1588 . . 21 LYS HA . 26774 1 210 . 1 1 22 22 LYS HB2 H 1 2.543 . . 2 . . 1589 . . 21 LYS HB2 . 26774 1 211 . 1 1 22 22 LYS HB3 H 1 1.986 0.003 . 2 . . 1590 . . 21 LYS HB3 . 26774 1 212 . 1 1 22 22 LYS HG2 H 1 1.088 0.02 . 2 . . 1596 . . 21 LYS HG2 . 26774 1 213 . 1 1 22 22 LYS HG3 H 1 1.313 0.005 . 2 . . 1968 . . 21 LYS HG3 . 26774 1 214 . 1 1 22 22 LYS HD2 H 1 1.671 . . 2 . . 1954 . . 21 LYS HD2 . 26774 1 215 . 1 1 22 22 LYS HD3 H 1 1.546 . . 2 . . 1955 . . 21 LYS HD3 . 26774 1 216 . 1 1 22 22 LYS HE2 H 1 2.895 . . 2 . . 1597 . . 21 LYS HE2 . 26774 1 217 . 1 1 22 22 LYS HE3 H 1 2.730 . . 2 . . 1951 . . 21 LYS HE3 . 26774 1 218 . 1 1 22 22 LYS HZ1 H 1 7.716 . . 1 . . 1953 . . 21 LYS HZ1 . 26774 1 219 . 1 1 22 22 LYS HZ2 H 1 7.716 . . 1 . . 1953 . . 21 LYS HZ2 . 26774 1 220 . 1 1 22 22 LYS HZ3 H 1 7.716 . . 1 . . 1953 . . 21 LYS HZ3 . 26774 1 221 . 1 1 22 22 LYS C C 13 175.979 . . 1 . . 1577 . . 21 LYS C . 26774 1 222 . 1 1 22 22 LYS CA C 13 53.323 0.013 . 1 . . 711 . . 21 LYS CA . 26774 1 223 . 1 1 22 22 LYS CB C 13 36.052 . . 1 . . 712 . . 21 LYS CB . 26774 1 224 . 1 1 22 22 LYS CG C 13 23.875 0.03 . 1 . . 1598 . . 21 LYS CG . 26774 1 225 . 1 1 22 22 LYS CD C 13 29.084 . . 1 . . 1600 . . 21 LYS CD . 26774 1 226 . 1 1 22 22 LYS CE C 13 42.036 . . 1 . . 1601 . . 21 LYS CE . 26774 1 227 . 1 1 22 22 LYS N N 15 120.910 0.158 . 1 . . 710 . . 21 LYS N . 26774 1 228 . 1 1 23 23 VAL H H 1 8.938 0.022 . 1 . . 49 . . 22 VAL H . 26774 1 229 . 1 1 23 23 VAL HA H 1 4.281 . . 1 . . 1957 . . 22 VAL HA . 26774 1 230 . 1 1 23 23 VAL HB H 1 2.001 . . 1 . . 1960 . . 22 VAL HB . 26774 1 231 . 1 1 23 23 VAL HG11 H 1 0.828 0.022 . 2 . . 962 . . 22 VAL HG11 . 26774 1 232 . 1 1 23 23 VAL HG12 H 1 0.828 0.022 . 2 . . 962 . . 22 VAL HG12 . 26774 1 233 . 1 1 23 23 VAL HG13 H 1 0.828 0.022 . 2 . . 962 . . 22 VAL HG13 . 26774 1 234 . 1 1 23 23 VAL HG21 H 1 0.805 0.016 . 2 . . 963 . . 22 VAL HG21 . 26774 1 235 . 1 1 23 23 VAL HG22 H 1 0.805 0.016 . 2 . . 963 . . 22 VAL HG22 . 26774 1 236 . 1 1 23 23 VAL HG23 H 1 0.805 0.016 . 2 . . 963 . . 22 VAL HG23 . 26774 1 237 . 1 1 23 23 VAL C C 13 177.824 . . 1 . . 1575 . . 22 VAL C . 26774 1 238 . 1 1 23 23 VAL CA C 13 63.012 0.027 . 1 . . 469 . . 22 VAL CA . 26774 1 239 . 1 1 23 23 VAL CB C 13 30.926 0.075 . 1 . . 966 . . 22 VAL CB . 26774 1 240 . 1 1 23 23 VAL CG1 C 13 23.021 . . 2 . . 1622 . . 22 VAL CG1 . 26774 1 241 . 1 1 23 23 VAL CG2 C 13 21.304 . . 2 . . 1623 . . 22 VAL CG2 . 26774 1 242 . 1 1 23 23 VAL N N 15 125.655 0.112 . 1 . . 50 . . 22 VAL N . 26774 1 243 . 1 1 24 24 THR H H 1 9.076 0.012 . 1 . . 101 . . 23 THR H . 26774 1 244 . 1 1 24 24 THR HA H 1 4.420 0.014 . 1 . . 880 . . 23 THR HA . 26774 1 245 . 1 1 24 24 THR HB H 1 4.318 0.02 . 1 . . 883 . . 23 THR HB . 26774 1 246 . 1 1 24 24 THR HG1 H 1 4.466 . . 1 . . 882 . . 23 THR HG1 . 26774 1 247 . 1 1 24 24 THR HG21 H 1 1.005 . . 1 . . 1961 . . 23 THR HG21 . 26774 1 248 . 1 1 24 24 THR HG22 H 1 1.005 . . 1 . . 1961 . . 23 THR HG22 . 26774 1 249 . 1 1 24 24 THR HG23 H 1 1.005 . . 1 . . 1961 . . 23 THR HG23 . 26774 1 250 . 1 1 24 24 THR C C 13 175.736 . . 1 . . 1576 . . 23 THR C . 26774 1 251 . 1 1 24 24 THR CA C 13 62.504 . . 1 . . 544 . . 23 THR CA . 26774 1 252 . 1 1 24 24 THR CB C 13 69.070 . . 1 . . 545 . . 23 THR CB . 26774 1 253 . 1 1 24 24 THR CG2 C 13 17.179 . . 1 . . 881 . . 23 THR CG2 . 26774 1 254 . 1 1 24 24 THR N N 15 121.247 0.089 . 1 . . 102 . . 23 THR N . 26774 1 255 . 1 1 25 25 LYS H H 1 7.147 0.016 . 1 . . 211 . . 24 LYS H . 26774 1 256 . 1 1 25 25 LYS HA H 1 4.352 . . 1 . . 974 . . 24 LYS HA . 26774 1 257 . 1 1 25 25 LYS HB2 H 1 1.812 0.008 . 2 . . 970 . . 24 LYS HB2 . 26774 1 258 . 1 1 25 25 LYS HB3 H 1 1.814 0.011 . 2 . . 971 . . 24 LYS HB3 . 26774 1 259 . 1 1 25 25 LYS HG2 H 1 1.589 . . 2 . . 1965 . . 24 LYS HG2 . 26774 1 260 . 1 1 25 25 LYS HG3 H 1 1.534 . . 2 . . 1967 . . 24 LYS HG3 . 26774 1 261 . 1 1 25 25 LYS HD2 H 1 1.567 0.007 . 2 . . 972 . . 24 LYS HD2 . 26774 1 262 . 1 1 25 25 LYS HD3 H 1 1.586 . . 2 . . 973 . . 24 LYS HD3 . 26774 1 263 . 1 1 25 25 LYS HE2 H 1 2.643 . . 2 . . 1962 . . 24 LYS HE2 . 26774 1 264 . 1 1 25 25 LYS HE3 H 1 2.846 . . 2 . . 1963 . . 24 LYS HE3 . 26774 1 265 . 1 1 25 25 LYS HZ1 H 1 7.501 . . 1 . . 1964 . . 24 LYS HZ1 . 26774 1 266 . 1 1 25 25 LYS HZ2 H 1 7.501 . . 1 . . 1964 . . 24 LYS HZ2 . 26774 1 267 . 1 1 25 25 LYS HZ3 H 1 7.501 . . 1 . . 1964 . . 24 LYS HZ3 . 26774 1 268 . 1 1 25 25 LYS C C 13 173.200 . . 1 . . 1574 . . 24 LYS C . 26774 1 269 . 1 1 25 25 LYS CA C 13 56.898 . . 1 . . 454 . . 24 LYS CA . 26774 1 270 . 1 1 25 25 LYS CB C 13 35.664 . . 1 . . 969 . . 24 LYS CB . 26774 1 271 . 1 1 25 25 LYS CG C 13 25.024 . . 1 . . 968 . . 24 LYS CG . 26774 1 272 . 1 1 25 25 LYS CD C 13 29.598 . . 1 . . 967 . . 24 LYS CD . 26774 1 273 . 1 1 25 25 LYS CE C 13 43.839 . . 1 . . 828 . . 24 LYS CE . 26774 1 274 . 1 1 25 25 LYS N N 15 120.537 0.089 . 1 . . 212 . . 24 LYS N . 26774 1 275 . 1 1 26 26 LEU H H 1 8.914 0.01 . 1 . . 273 . . 25 LEU H . 26774 1 276 . 1 1 26 26 LEU HA H 1 4.287 . . 1 . . 1971 . . 25 LEU HA . 26774 1 277 . 1 1 26 26 LEU HB2 H 1 1.717 0.005 . 2 . . 1605 . . 25 LEU HB2 . 26774 1 278 . 1 1 26 26 LEU HB3 H 1 1.678 . . 2 . . 1610 . . 25 LEU HB3 . 26774 1 279 . 1 1 26 26 LEU HG H 1 1.491 . . 1 . . 1604 . . 25 LEU HG . 26774 1 280 . 1 1 26 26 LEU HD11 H 1 0.866 . . 2 . . 1613 . . 25 LEU HD11 . 26774 1 281 . 1 1 26 26 LEU HD12 H 1 0.866 . . 2 . . 1613 . . 25 LEU HD12 . 26774 1 282 . 1 1 26 26 LEU HD13 H 1 0.866 . . 2 . . 1613 . . 25 LEU HD13 . 26774 1 283 . 1 1 26 26 LEU HD21 H 1 0.791 . . 2 . . 1969 . . 25 LEU HD21 . 26774 1 284 . 1 1 26 26 LEU HD22 H 1 0.791 . . 2 . . 1969 . . 25 LEU HD22 . 26774 1 285 . 1 1 26 26 LEU HD23 H 1 0.791 . . 2 . . 1969 . . 25 LEU HD23 . 26774 1 286 . 1 1 26 26 LEU C C 13 175.386 . . 1 . . 1573 . . 25 LEU C . 26774 1 287 . 1 1 26 26 LEU CA C 13 54.279 0.049 . 1 . . 355 . . 25 LEU CA . 26774 1 288 . 1 1 26 26 LEU CB C 13 42.700 . . 1 . . 356 . . 25 LEU CB . 26774 1 289 . 1 1 26 26 LEU CG C 13 26.947 0.018 . 1 . . 1603 . . 25 LEU CG . 26774 1 290 . 1 1 26 26 LEU CD1 C 13 23.173 . . 2 . . 1611 . . 25 LEU CD1 . 26774 1 291 . 1 1 26 26 LEU CD2 C 13 25.055 . . 2 . . 1612 . . 25 LEU CD2 . 26774 1 292 . 1 1 26 26 LEU N N 15 126.598 0.181 . 1 . . 274 . . 25 LEU N . 26774 1 293 . 1 1 27 27 VAL H H 1 8.287 0.017 . 1 . . 240 . . 26 VAL H . 26774 1 294 . 1 1 27 27 VAL HA H 1 4.243 . . 1 . . 1972 . . 26 VAL HA . 26774 1 295 . 1 1 27 27 VAL HB H 1 2.126 0.011 . 1 . . 982 . . 26 VAL HB . 26774 1 296 . 1 1 27 27 VAL HG11 H 1 0.824 . . 2 . . 1973 . . 26 VAL HG11 . 26774 1 297 . 1 1 27 27 VAL HG12 H 1 0.824 . . 2 . . 1973 . . 26 VAL HG12 . 26774 1 298 . 1 1 27 27 VAL HG13 H 1 0.824 . . 2 . . 1973 . . 26 VAL HG13 . 26774 1 299 . 1 1 27 27 VAL HG21 H 1 0.431 . . 2 . . 1974 . . 26 VAL HG21 . 26774 1 300 . 1 1 27 27 VAL HG22 H 1 0.431 . . 2 . . 1974 . . 26 VAL HG22 . 26774 1 301 . 1 1 27 27 VAL HG23 H 1 0.431 . . 2 . . 1974 . . 26 VAL HG23 . 26774 1 302 . 1 1 27 27 VAL C C 13 174.964 . . 1 . . 1572 . . 26 VAL C . 26774 1 303 . 1 1 27 27 VAL CA C 13 58.531 0.037 . 1 . . 447 . . 26 VAL CA . 26774 1 304 . 1 1 27 27 VAL CB C 13 32.802 . . 1 . . 780 . . 26 VAL CB . 26774 1 305 . 1 1 27 27 VAL CG1 C 13 22.421 . . 2 . . 978 . . 26 VAL CG1 . 26774 1 306 . 1 1 27 27 VAL CG2 C 13 19.555 . . 2 . . 979 . . 26 VAL CG2 . 26774 1 307 . 1 1 27 27 VAL N N 15 116.038 0.17 . 1 . . 241 . . 26 VAL N . 26774 1 308 . 1 1 29 29 PHE C C 13 174.931 . . 1 . . 2235 . . 28 PHE C . 26774 1 309 . 1 1 29 29 PHE CA C 13 54.644 . . 1 . . 2236 . . 28 PHE CA . 26774 1 310 . 1 1 29 29 PHE CB C 13 37.679 . . 1 . . 2237 . . 28 PHE CB . 26774 1 311 . 1 1 30 30 GLY H H 1 7.490 0.014 . 1 . . 61 . . 29 GLY H . 26774 1 312 . 1 1 30 30 GLY HA2 H 1 4.521 . . 2 . . 985 . . 29 GLY HA2 . 26774 1 313 . 1 1 30 30 GLY HA3 H 1 4.544 0.023 . 2 . . 986 . . 29 GLY HA3 . 26774 1 314 . 1 1 30 30 GLY C C 13 176.781 . . 1 . . 2255 . . 29 GLY C . 26774 1 315 . 1 1 30 30 GLY CA C 13 46.032 . . 1 . . 438 . . 29 GLY CA . 26774 1 316 . 1 1 30 30 GLY N N 15 108.792 0.122 . 1 . . 62 . . 29 GLY N . 26774 1 317 . 1 1 31 31 ALA H H 1 8.447 0.011 . 1 . . 145 . . 30 ALA H . 26774 1 318 . 1 1 31 31 ALA HA H 1 4.374 . . 1 . . 987 . . 30 ALA HA . 26774 1 319 . 1 1 31 31 ALA HB1 H 1 1.161 . . 1 . . 1976 . . 30 ALA HB1 . 26774 1 320 . 1 1 31 31 ALA HB2 H 1 1.161 . . 1 . . 1976 . . 30 ALA HB2 . 26774 1 321 . 1 1 31 31 ALA HB3 H 1 1.161 . . 1 . . 1976 . . 30 ALA HB3 . 26774 1 322 . 1 1 31 31 ALA C C 13 175.636 . . 1 . . 1533 . . 30 ALA C . 26774 1 323 . 1 1 31 31 ALA CA C 13 49.544 . . 1 . . 589 . . 30 ALA CA . 26774 1 324 . 1 1 31 31 ALA CB C 13 22.653 . . 1 . . 590 . . 30 ALA CB . 26774 1 325 . 1 1 31 31 ALA N N 15 120.005 0.089 . 1 . . 146 . . 30 ALA N . 26774 1 326 . 1 1 32 32 PHE H H 1 9.101 0.012 . 1 . . 209 . . 31 PHE H . 26774 1 327 . 1 1 32 32 PHE HA H 1 4.934 0.021 . 1 . . 1978 . . 31 PHE HA . 26774 1 328 . 1 1 32 32 PHE HB2 H 1 3.152 . . 2 . . 991 . . 31 PHE HB2 . 26774 1 329 . 1 1 32 32 PHE HB3 H 1 2.693 0.003 . 2 . . 1981 . . 31 PHE HB3 . 26774 1 330 . 1 1 32 32 PHE HD1 H 1 6.811 0.0 . 1 . . 2072 . . 31 PHE HD1 . 26774 1 331 . 1 1 32 32 PHE HD2 H 1 6.811 0.0 . 1 . . 2072 . . 31 PHE HD2 . 26774 1 332 . 1 1 32 32 PHE HE1 H 1 7.154 0.0 . 1 . . 1979 . . 31 PHE HE1 . 26774 1 333 . 1 1 32 32 PHE HE2 H 1 7.154 0.0 . 1 . . 1979 . . 31 PHE HE2 . 26774 1 334 . 1 1 32 32 PHE HZ H 1 6.759 0.0 . 1 . . 1977 . . 31 PHE HZ . 26774 1 335 . 1 1 32 32 PHE C C 13 175.772 . . 1 . . 1532 . . 31 PHE C . 26774 1 336 . 1 1 32 32 PHE CA C 13 58.360 . . 1 . . 591 . . 31 PHE CA . 26774 1 337 . 1 1 32 32 PHE CB C 13 40.358 . . 1 . . 592 . . 31 PHE CB . 26774 1 338 . 1 1 32 32 PHE CD1 C 13 132.069 . . 1 . . 2075 . . 31 PHE CD1 . 26774 1 339 . 1 1 32 32 PHE CD2 C 13 132.069 . . 1 . . 2075 . . 31 PHE CD2 . 26774 1 340 . 1 1 32 32 PHE CE1 C 13 133.490 . . 1 . . 2074 . . 31 PHE CE1 . 26774 1 341 . 1 1 32 32 PHE CE2 C 13 133.490 . . 1 . . 2074 . . 31 PHE CE2 . 26774 1 342 . 1 1 32 32 PHE CZ C 13 133.474 . . 1 . . 2073 . . 31 PHE CZ . 26774 1 343 . 1 1 32 32 PHE N N 15 122.227 0.135 . 1 . . 210 . . 31 PHE N . 26774 1 344 . 1 1 33 33 VAL H H 1 8.900 0.011 . 1 . . 171 . . 32 VAL H . 26774 1 345 . 1 1 33 33 VAL HA H 1 4.677 0.01 . 1 . . 1568 . . 32 VAL HA . 26774 1 346 . 1 1 33 33 VAL HB H 1 1.697 . . 1 . . 995 . . 32 VAL HB . 26774 1 347 . 1 1 33 33 VAL HG11 H 1 0.600 . . 2 . . 1982 . . 32 VAL HG11 . 26774 1 348 . 1 1 33 33 VAL HG12 H 1 0.600 . . 2 . . 1982 . . 32 VAL HG12 . 26774 1 349 . 1 1 33 33 VAL HG13 H 1 0.600 . . 2 . . 1982 . . 32 VAL HG13 . 26774 1 350 . 1 1 33 33 VAL HG21 H 1 0.921 . . 2 . . 1983 . . 32 VAL HG21 . 26774 1 351 . 1 1 33 33 VAL HG22 H 1 0.921 . . 2 . . 1983 . . 32 VAL HG22 . 26774 1 352 . 1 1 33 33 VAL HG23 H 1 0.921 . . 2 . . 1983 . . 32 VAL HG23 . 26774 1 353 . 1 1 33 33 VAL C C 13 174.279 . . 1 . . 1531 . . 32 VAL C . 26774 1 354 . 1 1 33 33 VAL CA C 13 60.271 0.063 . 1 . . 593 . . 32 VAL CA . 26774 1 355 . 1 1 33 33 VAL CB C 13 35.159 . . 1 . . 442 . . 32 VAL CB . 26774 1 356 . 1 1 33 33 VAL CG1 C 13 21.532 . . 2 . . 993 . . 32 VAL CG1 . 26774 1 357 . 1 1 33 33 VAL CG2 C 13 17.361 . . 2 . . 1569 . . 32 VAL CG2 . 26774 1 358 . 1 1 33 33 VAL N N 15 120.945 0.085 . 1 . . 172 . . 32 VAL N . 26774 1 359 . 1 1 34 34 ARG H H 1 9.256 0.011 . 1 . . 41 . . 33 ARG H . 26774 1 360 . 1 1 34 34 ARG HA H 1 4.284 . . 1 . . 1992 . . 33 ARG HA . 26774 1 361 . 1 1 34 34 ARG HB2 H 1 1.907 0.021 . 2 . . 1561 . . 33 ARG HB2 . 26774 1 362 . 1 1 34 34 ARG HB3 H 1 2.090 . . 2 . . 1562 . . 33 ARG HB3 . 26774 1 363 . 1 1 34 34 ARG HG2 H 1 1.590 0.0 . 2 . . 1989 . . 33 ARG HG2 . 26774 1 364 . 1 1 34 34 ARG HG3 H 1 1.667 . . 2 . . 1990 . . 33 ARG HG3 . 26774 1 365 . 1 1 34 34 ARG HD2 H 1 3.040 . . 2 . . 1567 . . 33 ARG HD2 . 26774 1 366 . 1 1 34 34 ARG HD3 H 1 3.240 . . 2 . . 1991 . . 33 ARG HD3 . 26774 1 367 . 1 1 34 34 ARG HH11 H 1 6.737 . . 1 . . 1984 . . 33 ARG HH11 . 26774 1 368 . 1 1 34 34 ARG HH12 H 1 6.769 . . 1 . . 1985 . . 33 ARG HH12 . 26774 1 369 . 1 1 34 34 ARG HH21 H 1 8.089 . . 1 . . 1986 . . 33 ARG HH21 . 26774 1 370 . 1 1 34 34 ARG HH22 H 1 8.133 . . 1 . . 1987 . . 33 ARG HH22 . 26774 1 371 . 1 1 34 34 ARG C C 13 176.977 . . 1 . . 1570 . . 33 ARG C . 26774 1 372 . 1 1 34 34 ARG CA C 13 55.478 . . 1 . . 595 . . 33 ARG CA . 26774 1 373 . 1 1 34 34 ARG CB C 13 32.129 . . 1 . . 594 . . 33 ARG CB . 26774 1 374 . 1 1 34 34 ARG N N 15 128.331 0.059 . 1 . . 42 . . 33 ARG N . 26774 1 375 . 1 1 35 35 VAL H H 1 8.476 0.011 . 1 . . 998 . . 34 VAL H . 26774 1 376 . 1 1 35 35 VAL HA H 1 4.640 0.001 . 1 . . 1553 . . 34 VAL HA . 26774 1 377 . 1 1 35 35 VAL HB H 1 1.604 0.014 . 1 . . 1555 . . 34 VAL HB . 26774 1 378 . 1 1 35 35 VAL HG11 H 1 0.791 0.001 . 2 . . 1556 . . 34 VAL HG11 . 26774 1 379 . 1 1 35 35 VAL HG12 H 1 0.791 0.001 . 2 . . 1556 . . 34 VAL HG12 . 26774 1 380 . 1 1 35 35 VAL HG13 H 1 0.791 0.001 . 2 . . 1556 . . 34 VAL HG13 . 26774 1 381 . 1 1 35 35 VAL HG21 H 1 0.838 0.015 . 2 . . 1557 . . 34 VAL HG21 . 26774 1 382 . 1 1 35 35 VAL HG22 H 1 0.838 0.015 . 2 . . 1557 . . 34 VAL HG22 . 26774 1 383 . 1 1 35 35 VAL HG23 H 1 0.838 0.015 . 2 . . 1557 . . 34 VAL HG23 . 26774 1 384 . 1 1 35 35 VAL C C 13 174.609 . . 1 . . 1548 . . 34 VAL C . 26774 1 385 . 1 1 35 35 VAL CA C 13 61.231 . . 1 . . 1546 . . 34 VAL CA . 26774 1 386 . 1 1 35 35 VAL CB C 13 30.493 . . 1 . . 1547 . . 34 VAL CB . 26774 1 387 . 1 1 35 35 VAL CG1 C 13 22.625 . . 2 . . 1558 . . 34 VAL CG1 . 26774 1 388 . 1 1 35 35 VAL CG2 C 13 18.055 . . 2 . . 1559 . . 34 VAL CG2 . 26774 1 389 . 1 1 35 35 VAL N N 15 121.817 0.087 . 1 . . 999 . . 34 VAL N . 26774 1 390 . 1 1 36 36 GLU H H 1 8.060 0.018 . 1 . . 71 . . 35 GLU H . 26774 1 391 . 1 1 36 36 GLU HA H 1 4.220 0.017 . 1 . . 1027 . . 35 GLU HA . 26774 1 392 . 1 1 36 36 GLU HB2 H 1 1.831 0.012 . 2 . . 1549 . . 35 GLU HB2 . 26774 1 393 . 1 1 36 36 GLU HB3 H 1 1.933 . . 2 . . 1550 . . 35 GLU HB3 . 26774 1 394 . 1 1 36 36 GLU HG2 H 1 2.159 . . 2 . . 1551 . . 35 GLU HG2 . 26774 1 395 . 1 1 36 36 GLU HG3 H 1 2.400 0.002 . 2 . . 1552 . . 35 GLU HG3 . 26774 1 396 . 1 1 36 36 GLU C C 13 174.981 . . 1 . . 1544 . . 35 GLU C . 26774 1 397 . 1 1 36 36 GLU CA C 13 55.527 . . 1 . . 1001 . . 35 GLU CA . 26774 1 398 . 1 1 36 36 GLU CB C 13 32.939 . . 1 . . 1000 . . 35 GLU CB . 26774 1 399 . 1 1 36 36 GLU CG C 13 36.337 . . 1 . . 1026 . . 35 GLU CG . 26774 1 400 . 1 1 36 36 GLU N N 15 121.211 0.166 . 1 . . 72 . . 35 GLU N . 26774 1 401 . 1 1 37 37 GLU H H 1 9.185 0.014 . 1 . . 187 . . 36 GLU H . 26774 1 402 . 1 1 37 37 GLU HA H 1 3.823 0.01 . 1 . . 1021 . . 36 GLU HA . 26774 1 403 . 1 1 37 37 GLU HB2 H 1 1.932 . . 2 . . 1023 . . 36 GLU HB2 . 26774 1 404 . 1 1 37 37 GLU HB3 H 1 1.919 0.024 . 2 . . 1024 . . 36 GLU HB3 . 26774 1 405 . 1 1 37 37 GLU HG2 H 1 2.160 . . 2 . . 1022 . . 36 GLU HG2 . 26774 1 406 . 1 1 37 37 GLU HG3 H 1 2.157 0.005 . 2 . . 1025 . . 36 GLU HG3 . 26774 1 407 . 1 1 37 37 GLU C C 13 177.115 . . 1 . . 1543 . . 36 GLU C . 26774 1 408 . 1 1 37 37 GLU CA C 13 58.571 . . 1 . . 719 . . 36 GLU CA . 26774 1 409 . 1 1 37 37 GLU CB C 13 28.552 . . 1 . . 720 . . 36 GLU CB . 26774 1 410 . 1 1 37 37 GLU CG C 13 36.035 . . 1 . . 1020 . . 36 GLU CG . 26774 1 411 . 1 1 37 37 GLU N N 15 122.379 0.066 . 1 . . 188 . . 36 GLU N . 26774 1 412 . 1 1 38 38 GLY H H 1 8.501 0.01 . 1 . . 181 . . 37 GLY H . 26774 1 413 . 1 1 38 38 GLY HA2 H 1 3.944 . . 2 . . 1002 . . 37 GLY HA2 . 26774 1 414 . 1 1 38 38 GLY HA3 H 1 4.061 0.019 . 2 . . 1003 . . 37 GLY HA3 . 26774 1 415 . 1 1 38 38 GLY C C 13 174.061 . . 1 . . 1542 . . 37 GLY C . 26774 1 416 . 1 1 38 38 GLY CA C 13 45.277 . . 1 . . 439 . . 37 GLY CA . 26774 1 417 . 1 1 38 38 GLY N N 15 112.867 0.132 . 1 . . 182 . . 37 GLY N . 26774 1 418 . 1 1 39 39 ILE H H 1 7.939 0.01 . 1 . . 155 . . 38 ILE H . 26774 1 419 . 1 1 39 39 ILE HA H 1 4.300 0.004 . 1 . . 1005 . . 38 ILE HA . 26774 1 420 . 1 1 39 39 ILE HB H 1 1.684 . . 1 . . 1006 . . 38 ILE HB . 26774 1 421 . 1 1 39 39 ILE HG12 H 1 1.192 . . 2 . . 2124 . . 38 ILE HG12 . 26774 1 422 . 1 1 39 39 ILE HG13 H 1 0.638 . . 2 . . 2125 . . 38 ILE HG13 . 26774 1 423 . 1 1 39 39 ILE HG21 H 1 0.716 . . 1 . . 2123 . . 38 ILE HG21 . 26774 1 424 . 1 1 39 39 ILE HG22 H 1 0.716 . . 1 . . 2123 . . 38 ILE HG22 . 26774 1 425 . 1 1 39 39 ILE HG23 H 1 0.716 . . 1 . . 2123 . . 38 ILE HG23 . 26774 1 426 . 1 1 39 39 ILE HD11 H 1 0.757 . . 1 . . 1009 . . 38 ILE HD11 . 26774 1 427 . 1 1 39 39 ILE HD12 H 1 0.757 . . 1 . . 1009 . . 38 ILE HD12 . 26774 1 428 . 1 1 39 39 ILE HD13 H 1 0.757 . . 1 . . 1009 . . 38 ILE HD13 . 26774 1 429 . 1 1 39 39 ILE C C 13 173.277 . . 1 . . 1540 . . 38 ILE C . 26774 1 430 . 1 1 39 39 ILE CA C 13 60.355 0.055 . 1 . . 789 . . 38 ILE CA . 26774 1 431 . 1 1 39 39 ILE CB C 13 37.469 . . 1 . . 896 . . 38 ILE CB . 26774 1 432 . 1 1 39 39 ILE CG1 C 13 31.551 . . 1 . . 1012 . . 38 ILE CG1 . 26774 1 433 . 1 1 39 39 ILE CG2 C 13 22.483 . . 1 . . 1014 . . 38 ILE CG2 . 26774 1 434 . 1 1 39 39 ILE CD1 C 13 13.573 . . 1 . . 1857 . . 38 ILE CD1 . 26774 1 435 . 1 1 39 39 ILE N N 15 121.153 0.124 . 1 . . 156 . . 38 ILE N . 26774 1 436 . 1 1 40 40 GLU H H 1 8.454 0.009 . 1 . . 333 . . 39 GLU H . 26774 1 437 . 1 1 40 40 GLU HA H 1 5.255 0.022 . 1 . . 1018 . . 39 GLU HA . 26774 1 438 . 1 1 40 40 GLU HB2 H 1 1.836 0.006 . 2 . . 2119 . . 39 GLU HB2 . 26774 1 439 . 1 1 40 40 GLU HB3 H 1 1.979 . . 2 . . 2120 . . 39 GLU HB3 . 26774 1 440 . 1 1 40 40 GLU HG2 H 1 2.240 . . 2 . . 2121 . . 39 GLU HG2 . 26774 1 441 . 1 1 40 40 GLU HG3 H 1 2.492 . . 2 . . 2122 . . 39 GLU HG3 . 26774 1 442 . 1 1 40 40 GLU C C 13 175.738 . . 1 . . 1539 . . 39 GLU C . 26774 1 443 . 1 1 40 40 GLU CA C 13 53.926 . . 1 . . 713 . . 39 GLU CA . 26774 1 444 . 1 1 40 40 GLU CB C 13 33.469 . . 1 . . 714 . . 39 GLU CB . 26774 1 445 . 1 1 40 40 GLU CG C 13 36.289 . . 1 . . 1017 . . 39 GLU CG . 26774 1 446 . 1 1 40 40 GLU N N 15 126.682 0.185 . 1 . . 334 . . 39 GLU N . 26774 1 447 . 1 1 41 41 GLY H H 1 8.652 0.012 . 1 . . 147 . . 40 GLY H . 26774 1 448 . 1 1 41 41 GLY HA2 H 1 4.050 0.023 . 2 . . 1015 . . 40 GLY HA2 . 26774 1 449 . 1 1 41 41 GLY HA3 H 1 4.023 0.022 . 2 . . 1016 . . 40 GLY HA3 . 26774 1 450 . 1 1 41 41 GLY C C 13 170.661 . . 1 . . 1538 . . 40 GLY C . 26774 1 451 . 1 1 41 41 GLY CA C 13 44.169 . . 1 . . 437 . . 40 GLY CA . 26774 1 452 . 1 1 41 41 GLY N N 15 108.793 0.15 . 1 . . 148 . . 40 GLY N . 26774 1 453 . 1 1 42 42 LEU H H 1 8.202 0.014 . 1 . . 201 . . 41 LEU H . 26774 1 454 . 1 1 42 42 LEU HA H 1 4.119 0.011 . 1 . . 1624 . . 41 LEU HA . 26774 1 455 . 1 1 42 42 LEU HB2 H 1 1.523 . . 2 . . 1618 . . 41 LEU HB2 . 26774 1 456 . 1 1 42 42 LEU HB3 H 1 1.311 0.006 . 2 . . 1625 . . 41 LEU HB3 . 26774 1 457 . 1 1 42 42 LEU HG H 1 1.417 . . 1 . . 1619 . . 41 LEU HG . 26774 1 458 . 1 1 42 42 LEU HD11 H 1 0.413 . . 2 . . 1620 . . 41 LEU HD11 . 26774 1 459 . 1 1 42 42 LEU HD12 H 1 0.413 . . 2 . . 1620 . . 41 LEU HD12 . 26774 1 460 . 1 1 42 42 LEU HD13 H 1 0.413 . . 2 . . 1620 . . 41 LEU HD13 . 26774 1 461 . 1 1 42 42 LEU HD21 H 1 0.487 . . 2 . . 1621 . . 41 LEU HD21 . 26774 1 462 . 1 1 42 42 LEU HD22 H 1 0.487 . . 2 . . 1621 . . 41 LEU HD22 . 26774 1 463 . 1 1 42 42 LEU HD23 H 1 0.487 . . 2 . . 1621 . . 41 LEU HD23 . 26774 1 464 . 1 1 42 42 LEU C C 13 176.380 . . 1 . . 1537 . . 41 LEU C . 26774 1 465 . 1 1 42 42 LEU CA C 13 54.298 . . 1 . . 644 . . 41 LEU CA . 26774 1 466 . 1 1 42 42 LEU CB C 13 43.084 . . 1 . . 645 . . 41 LEU CB . 26774 1 467 . 1 1 42 42 LEU CG C 13 26.738 0.092 . 1 . . 1626 . . 41 LEU CG . 26774 1 468 . 1 1 42 42 LEU CD1 C 13 25.113 . . 2 . . 1628 . . 41 LEU CD1 . 26774 1 469 . 1 1 42 42 LEU CD2 C 13 22.960 . . 2 . . 1629 . . 41 LEU CD2 . 26774 1 470 . 1 1 42 42 LEU N N 15 122.426 0.144 . 1 . . 202 . . 41 LEU N . 26774 1 471 . 1 1 43 43 VAL H H 1 9.123 0.014 . 1 . . 105 . . 42 VAL H . 26774 1 472 . 1 1 43 43 VAL HA H 1 4.066 . . 1 . . 2126 . . 42 VAL HA . 26774 1 473 . 1 1 43 43 VAL HB H 1 2.046 . . 1 . . 2127 . . 42 VAL HB . 26774 1 474 . 1 1 43 43 VAL HG11 H 1 0.922 . . 2 . . 2128 . . 42 VAL HG11 . 26774 1 475 . 1 1 43 43 VAL HG12 H 1 0.922 . . 2 . . 2128 . . 42 VAL HG12 . 26774 1 476 . 1 1 43 43 VAL HG13 H 1 0.922 . . 2 . . 2128 . . 42 VAL HG13 . 26774 1 477 . 1 1 43 43 VAL HG21 H 1 0.675 0.009 . 2 . . 2129 . . 42 VAL HG21 . 26774 1 478 . 1 1 43 43 VAL HG22 H 1 0.675 0.009 . 2 . . 2129 . . 42 VAL HG22 . 26774 1 479 . 1 1 43 43 VAL HG23 H 1 0.675 0.009 . 2 . . 2129 . . 42 VAL HG23 . 26774 1 480 . 1 1 43 43 VAL C C 13 174.634 . . 1 . . 1536 . . 42 VAL C . 26774 1 481 . 1 1 43 43 VAL CA C 13 60.378 0.082 . 1 . . 340 . . 42 VAL CA . 26774 1 482 . 1 1 43 43 VAL CB C 13 33.408 . . 1 . . 1035 . . 42 VAL CB . 26774 1 483 . 1 1 43 43 VAL CG1 C 13 24.463 . . 2 . . 1036 . . 42 VAL CG1 . 26774 1 484 . 1 1 43 43 VAL CG2 C 13 20.273 . . 2 . . 2130 . . 42 VAL CG2 . 26774 1 485 . 1 1 43 43 VAL N N 15 129.096 0.127 . 1 . . 106 . . 42 VAL N . 26774 1 486 . 1 1 44 44 HIS H H 1 9.087 0.02 . 1 . . 53 . . 43 HIS H . 26774 1 487 . 1 1 44 44 HIS HA H 1 4.428 . . 1 . . 1850 . . 43 HIS HA . 26774 1 488 . 1 1 44 44 HIS HB2 H 1 3.242 . . 2 . . 2045 . . 43 HIS HB2 . 26774 1 489 . 1 1 44 44 HIS HB3 H 1 3.556 . . 2 . . 2046 . . 43 HIS HB3 . 26774 1 490 . 1 1 44 44 HIS HD1 H 1 9.340 . . 1 . . 2134 . . 43 HIS HD1 . 26774 1 491 . 1 1 44 44 HIS HD2 H 1 7.132 0.001 . 1 . . 2047 . . 43 HIS HD2 . 26774 1 492 . 1 1 44 44 HIS HE1 H 1 7.940 0.0 . 1 . . 2048 . . 43 HIS HE1 . 26774 1 493 . 1 1 44 44 HIS C C 13 177.006 . . 1 . . 1228 . . 43 HIS C . 26774 1 494 . 1 1 44 44 HIS CA C 13 58.880 0.044 . 1 . . 341 . . 43 HIS CA . 26774 1 495 . 1 1 44 44 HIS CB C 13 31.522 0.05 . 1 . . 794 . . 43 HIS CB . 26774 1 496 . 1 1 44 44 HIS CD2 C 13 119.664 . . 1 . . 2049 . . 43 HIS CD2 . 26774 1 497 . 1 1 44 44 HIS CE1 C 13 136.780 . . 1 . . 2050 . . 43 HIS CE1 . 26774 1 498 . 1 1 44 44 HIS N N 15 127.501 0.183 . 1 . . 54 . . 43 HIS N . 26774 1 499 . 1 1 45 45 ILE H H 1 7.601 0.025 . 1 . . 35 . . 44 ILE H . 26774 1 500 . 1 1 45 45 ILE HA H 1 3.684 0.014 . 1 . . 1848 . . 44 ILE HA . 26774 1 501 . 1 1 45 45 ILE HB H 1 1.177 . . 1 . . 1844 . . 44 ILE HB . 26774 1 502 . 1 1 45 45 ILE HG12 H 1 1.392 . . 2 . . 2131 . . 44 ILE HG12 . 26774 1 503 . 1 1 45 45 ILE HG13 H 1 1.133 . . 2 . . 2132 . . 44 ILE HG13 . 26774 1 504 . 1 1 45 45 ILE HG21 H 1 0.622 0.005 . 1 . . 1847 . . 44 ILE HG21 . 26774 1 505 . 1 1 45 45 ILE HG22 H 1 0.622 0.005 . 1 . . 1847 . . 44 ILE HG22 . 26774 1 506 . 1 1 45 45 ILE HG23 H 1 0.622 0.005 . 1 . . 1847 . . 44 ILE HG23 . 26774 1 507 . 1 1 45 45 ILE HD11 H 1 0.510 . . 1 . . 2133 . . 44 ILE HD11 . 26774 1 508 . 1 1 45 45 ILE HD12 H 1 0.510 . . 1 . . 2133 . . 44 ILE HD12 . 26774 1 509 . 1 1 45 45 ILE HD13 H 1 0.510 . . 1 . . 2133 . . 44 ILE HD13 . 26774 1 510 . 1 1 45 45 ILE C C 13 176.036 . . 1 . . 1229 . . 44 ILE C . 26774 1 511 . 1 1 45 45 ILE CA C 13 64.083 0.06 . 1 . . 449 . . 44 ILE CA . 26774 1 512 . 1 1 45 45 ILE CB C 13 38.832 0.03 . 1 . . 793 . . 44 ILE CB . 26774 1 513 . 1 1 45 45 ILE CG1 C 13 28.274 0.063 . 1 . . 1843 . . 44 ILE CG1 . 26774 1 514 . 1 1 45 45 ILE CG2 C 13 16.257 . . 1 . . 1846 . . 44 ILE CG2 . 26774 1 515 . 1 1 45 45 ILE CD1 C 13 14.290 . . 1 . . 1845 . . 44 ILE CD1 . 26774 1 516 . 1 1 45 45 ILE N N 15 125.568 0.195 . 1 . . 36 . . 44 ILE N . 26774 1 517 . 1 1 46 46 SER H H 1 8.703 0.016 . 1 . . 238 . . 45 SER H . 26774 1 518 . 1 1 46 46 SER HA H 1 4.355 . . 1 . . 1482 . . 45 SER HA . 26774 1 519 . 1 1 46 46 SER HB2 H 1 4.029 . . 2 . . 863 . . 45 SER HB2 . 26774 1 520 . 1 1 46 46 SER HB3 H 1 3.524 . . 2 . . 1484 . . 45 SER HB3 . 26774 1 521 . 1 1 46 46 SER HG H 1 4.575 . . 1 . . 1485 . . 45 SER HG . 26774 1 522 . 1 1 46 46 SER C C 13 175.140 . . 1 . . 1486 . . 45 SER C . 26774 1 523 . 1 1 46 46 SER CA C 13 61.100 . . 1 . . 477 . . 45 SER CA . 26774 1 524 . 1 1 46 46 SER CB C 13 63.146 . . 1 . . 478 . . 45 SER CB . 26774 1 525 . 1 1 46 46 SER N N 15 119.173 0.169 . 1 . . 239 . . 45 SER N . 26774 1 526 . 1 1 47 47 GLU H H 1 8.351 0.018 . 1 . . 783 . . 46 GLU H . 26774 1 527 . 1 1 47 47 GLU HA H 1 4.479 0.0 . 1 . . 1489 . . 46 GLU HA . 26774 1 528 . 1 1 47 47 GLU HB2 H 1 2.061 . . 2 . . 1493 . . 46 GLU HB2 . 26774 1 529 . 1 1 47 47 GLU HB3 H 1 2.121 . . 2 . . 1494 . . 46 GLU HB3 . 26774 1 530 . 1 1 47 47 GLU HG2 H 1 2.310 . . 2 . . 1491 . . 46 GLU HG2 . 26774 1 531 . 1 1 47 47 GLU HG3 H 1 2.523 . . 2 . . 1492 . . 46 GLU HG3 . 26774 1 532 . 1 1 47 47 GLU C C 13 177.109 0.016 . 1 . . 1487 . . 46 GLU C . 26774 1 533 . 1 1 47 47 GLU CA C 13 55.219 0.003 . 1 . . 1037 . . 46 GLU CA . 26774 1 534 . 1 1 47 47 GLU CB C 13 29.634 . . 1 . . 1038 . . 46 GLU CB . 26774 1 535 . 1 1 47 47 GLU CG C 13 34.074 . . 1 . . 1495 . . 46 GLU CG . 26774 1 536 . 1 1 47 47 GLU N N 15 119.440 0.172 . 1 . . 784 . . 46 GLU N . 26774 1 537 . 1 1 48 48 LEU H H 1 7.652 0.02 . 1 . . 224 . . 47 LEU H . 26774 1 538 . 1 1 48 48 LEU HA H 1 4.221 0.001 . 1 . . 1497 . . 47 LEU HA . 26774 1 539 . 1 1 48 48 LEU HB2 H 1 2.507 . . 2 . . 1499 . . 47 LEU HB2 . 26774 1 540 . 1 1 48 48 LEU HB3 H 1 1.722 . . 2 . . 2218 . . 47 LEU HB3 . 26774 1 541 . 1 1 48 48 LEU HG H 1 1.424 0.002 . 1 . . 2148 . . 47 LEU HG . 26774 1 542 . 1 1 48 48 LEU HD11 H 1 0.871 . . 2 . . 1501 . . 47 LEU HD11 . 26774 1 543 . 1 1 48 48 LEU HD12 H 1 0.871 . . 2 . . 1501 . . 47 LEU HD12 . 26774 1 544 . 1 1 48 48 LEU HD13 H 1 0.871 . . 2 . . 1501 . . 47 LEU HD13 . 26774 1 545 . 1 1 48 48 LEU HD21 H 1 0.595 . . 2 . . 2149 . . 47 LEU HD21 . 26774 1 546 . 1 1 48 48 LEU HD22 H 1 0.595 . . 2 . . 2149 . . 47 LEU HD22 . 26774 1 547 . 1 1 48 48 LEU HD23 H 1 0.595 . . 2 . . 2149 . . 47 LEU HD23 . 26774 1 548 . 1 1 48 48 LEU C C 13 173.885 . . 1 . . 2257 . . 47 LEU C . 26774 1 549 . 1 1 48 48 LEU CA C 13 56.776 0.01 . 1 . . 450 . . 47 LEU CA . 26774 1 550 . 1 1 48 48 LEU CB C 13 38.813 . . 1 . . 1039 . . 47 LEU CB . 26774 1 551 . 1 1 48 48 LEU CG C 13 26.275 . . 1 . . 1504 . . 47 LEU CG . 26774 1 552 . 1 1 48 48 LEU CD1 C 13 24.316 . . 2 . . 2151 . . 47 LEU CD1 . 26774 1 553 . 1 1 48 48 LEU CD2 C 13 23.787 . . 2 . . 2152 . . 47 LEU CD2 . 26774 1 554 . 1 1 48 48 LEU N N 15 124.021 0.111 . 1 . . 225 . . 47 LEU N . 26774 1 555 . 1 1 49 49 ALA H H 1 7.510 0.014 . 1 . . 169 . . 48 ALA H . 26774 1 556 . 1 1 49 49 ALA HA H 1 4.412 0.022 . 1 . . 1506 . . 48 ALA HA . 26774 1 557 . 1 1 49 49 ALA HB1 H 1 1.386 0.002 . 1 . . 1507 . . 48 ALA HB1 . 26774 1 558 . 1 1 49 49 ALA HB2 H 1 1.386 0.002 . 1 . . 1507 . . 48 ALA HB2 . 26774 1 559 . 1 1 49 49 ALA HB3 H 1 1.386 0.002 . 1 . . 1507 . . 48 ALA HB3 . 26774 1 560 . 1 1 49 49 ALA C C 13 175.305 . . 1 . . 1496 . . 48 ALA C . 26774 1 561 . 1 1 49 49 ALA CA C 13 50.841 . . 1 . . 734 . . 48 ALA CA . 26774 1 562 . 1 1 49 49 ALA CB C 13 22.031 . . 1 . . 735 . . 48 ALA CB . 26774 1 563 . 1 1 49 49 ALA N N 15 114.088 0.104 . 1 . . 170 . . 48 ALA N . 26774 1 564 . 1 1 50 50 GLU H H 1 9.149 0.023 . 1 . . 756 . . 49 GLU H . 26774 1 565 . 1 1 50 50 GLU HA H 1 4.058 0.001 . 1 . . 1073 . . 49 GLU HA . 26774 1 566 . 1 1 50 50 GLU HB2 H 1 2.018 . . 2 . . 1077 . . 49 GLU HB2 . 26774 1 567 . 1 1 50 50 GLU HB3 H 1 1.995 . . 2 . . 1078 . . 49 GLU HB3 . 26774 1 568 . 1 1 50 50 GLU HG2 H 1 2.212 . . 2 . . 1076 . . 49 GLU HG2 . 26774 1 569 . 1 1 50 50 GLU HG3 H 1 2.187 . . 2 . . 1079 . . 49 GLU HG3 . 26774 1 570 . 1 1 50 50 GLU C C 13 176.300 . . 1 . . 1080 . . 49 GLU C . 26774 1 571 . 1 1 50 50 GLU CA C 13 57.868 0.035 . 1 . . 786 . . 49 GLU CA . 26774 1 572 . 1 1 50 50 GLU CB C 13 29.677 . . 1 . . 787 . . 49 GLU CB . 26774 1 573 . 1 1 50 50 GLU CG C 13 36.396 . . 1 . . 1081 . . 49 GLU CG . 26774 1 574 . 1 1 50 50 GLU N N 15 119.595 0.123 . 1 . . 757 . . 49 GLU N . 26774 1 575 . 1 1 51 51 ARG H H 1 7.350 0.012 . 1 . . 259 . . 50 ARG H . 26774 1 576 . 1 1 51 51 ARG HA H 1 4.358 . . 1 . . 849 . . 50 ARG HA . 26774 1 577 . 1 1 51 51 ARG HB2 H 1 2.274 . . 2 . . 853 . . 50 ARG HB2 . 26774 1 578 . 1 1 51 51 ARG HB3 H 1 2.252 . . 2 . . 854 . . 50 ARG HB3 . 26774 1 579 . 1 1 51 51 ARG HG2 H 1 1.931 0.013 . 2 . . 845 . . 50 ARG HG2 . 26774 1 580 . 1 1 51 51 ARG HG3 H 1 2.008 . . 2 . . 855 . . 50 ARG HG3 . 26774 1 581 . 1 1 51 51 ARG HD2 H 1 3.105 . . 2 . . 851 . . 50 ARG HD2 . 26774 1 582 . 1 1 51 51 ARG HD3 H 1 3.032 . . 2 . . 852 . . 50 ARG HD3 . 26774 1 583 . 1 1 51 51 ARG C C 13 174.306 . . 1 . . 1737 . . 50 ARG C . 26774 1 584 . 1 1 51 51 ARG CA C 13 54.385 . . 1 . . 584 . . 50 ARG CA . 26774 1 585 . 1 1 51 51 ARG CB C 13 31.338 . . 1 . . 585 . . 50 ARG CB . 26774 1 586 . 1 1 51 51 ARG CG C 13 26.551 . . 1 . . 857 . . 50 ARG CG . 26774 1 587 . 1 1 51 51 ARG CD C 13 43.226 . . 1 . . 856 . . 50 ARG CD . 26774 1 588 . 1 1 51 51 ARG N N 15 116.722 0.14 . 1 . . 260 . . 50 ARG N . 26774 1 589 . 1 1 52 52 HIS H H 1 8.305 0.022 . 1 . . 11 . . 51 HIS H . 26774 1 590 . 1 1 52 52 HIS HA H 1 4.290 0.01 . 1 . . 1056 . . 51 HIS HA . 26774 1 591 . 1 1 52 52 HIS HB2 H 1 3.011 . . 2 . . 1057 . . 51 HIS HB2 . 26774 1 592 . 1 1 52 52 HIS HB3 H 1 2.955 0.001 . 2 . . 1058 . . 51 HIS HB3 . 26774 1 593 . 1 1 52 52 HIS HD2 H 1 7.181 0.001 . 1 . . 2052 . . 51 HIS HD2 . 26774 1 594 . 1 1 52 52 HIS HE1 H 1 7.982 0.0 . 1 . . 2051 . . 51 HIS HE1 . 26774 1 595 . 1 1 52 52 HIS C C 13 174.933 . . 1 . . 1508 . . 51 HIS C . 26774 1 596 . 1 1 52 52 HIS CA C 13 57.152 0.062 . 1 . . 499 . . 51 HIS CA . 26774 1 597 . 1 1 52 52 HIS CB C 13 29.396 . . 1 . . 587 . . 51 HIS CB . 26774 1 598 . 1 1 52 52 HIS CD2 C 13 119.102 . . 1 . . 2053 . . 51 HIS CD2 . 26774 1 599 . 1 1 52 52 HIS CE1 C 13 137.516 . . 1 . . 2054 . . 51 HIS CE1 . 26774 1 600 . 1 1 52 52 HIS N N 15 118.437 0.21 . 1 . . 12 . . 51 HIS N . 26774 1 601 . 1 1 53 53 VAL H H 1 7.681 0.015 . 1 . . 203 . . 52 VAL H . 26774 1 602 . 1 1 53 53 VAL HA H 1 4.045 0.02 . 1 . . 833 . . 52 VAL HA . 26774 1 603 . 1 1 53 53 VAL HB H 1 1.683 . . 1 . . 836 . . 52 VAL HB . 26774 1 604 . 1 1 53 53 VAL HG11 H 1 0.665 0.007 . 2 . . 837 . . 52 VAL HG11 . 26774 1 605 . 1 1 53 53 VAL HG12 H 1 0.665 0.007 . 2 . . 837 . . 52 VAL HG12 . 26774 1 606 . 1 1 53 53 VAL HG13 H 1 0.665 0.007 . 2 . . 837 . . 52 VAL HG13 . 26774 1 607 . 1 1 53 53 VAL HG21 H 1 0.616 0.013 . 2 . . 838 . . 52 VAL HG21 . 26774 1 608 . 1 1 53 53 VAL HG22 H 1 0.616 0.013 . 2 . . 838 . . 52 VAL HG22 . 26774 1 609 . 1 1 53 53 VAL HG23 H 1 0.616 0.013 . 2 . . 838 . . 52 VAL HG23 . 26774 1 610 . 1 1 53 53 VAL C C 13 174.284 . . 1 . . 1509 . . 52 VAL C . 26774 1 611 . 1 1 53 53 VAL CA C 13 60.593 0.074 . 1 . . 452 . . 52 VAL CA . 26774 1 612 . 1 1 53 53 VAL CB C 13 33.660 . . 1 . . 453 . . 52 VAL CB . 26774 1 613 . 1 1 53 53 VAL CG1 C 13 22.272 . . 2 . . 840 . . 52 VAL CG1 . 26774 1 614 . 1 1 53 53 VAL CG2 C 13 20.205 . . 2 . . 841 . . 52 VAL CG2 . 26774 1 615 . 1 1 53 53 VAL N N 15 123.198 0.137 . 1 . . 204 . . 52 VAL N . 26774 1 616 . 1 1 54 54 GLU H H 1 8.478 0.013 . 1 . . 191 . . 53 GLU H . 26774 1 617 . 1 1 54 54 GLU HA H 1 4.090 0.001 . 1 . . 1059 . . 53 GLU HA . 26774 1 618 . 1 1 54 54 GLU HB2 H 1 1.960 . . 2 . . 1061 . . 53 GLU HB2 . 26774 1 619 . 1 1 54 54 GLU HB3 H 1 1.893 0.0 . 2 . . 1062 . . 53 GLU HB3 . 26774 1 620 . 1 1 54 54 GLU HG2 H 1 2.253 . . 2 . . 1063 . . 53 GLU HG2 . 26774 1 621 . 1 1 54 54 GLU HG3 H 1 2.229 0.018 . 2 . . 1064 . . 53 GLU HG3 . 26774 1 622 . 1 1 54 54 GLU C C 13 176.693 . . 1 . . 1510 . . 53 GLU C . 26774 1 623 . 1 1 54 54 GLU CA C 13 57.790 0.039 . 1 . . 500 . . 53 GLU CA . 26774 1 624 . 1 1 54 54 GLU CB C 13 31.232 . . 1 . . 501 . . 53 GLU CB . 26774 1 625 . 1 1 54 54 GLU CG C 13 36.479 . . 1 . . 1060 . . 53 GLU CG . 26774 1 626 . 1 1 54 54 GLU N N 15 121.906 0.196 . 1 . . 192 . . 53 GLU N . 26774 1 627 . 1 1 55 55 VAL H H 1 7.462 0.022 . 1 . . 119 . . 54 VAL H . 26774 1 628 . 1 1 55 55 VAL HA H 1 4.635 0.0 . 1 . . 1067 . . 54 VAL HA . 26774 1 629 . 1 1 55 55 VAL HB H 1 1.890 . . 1 . . 1070 . . 54 VAL HB . 26774 1 630 . 1 1 55 55 VAL HG11 H 1 0.510 . . 2 . . 1071 . . 54 VAL HG11 . 26774 1 631 . 1 1 55 55 VAL HG12 H 1 0.510 . . 2 . . 1071 . . 54 VAL HG12 . 26774 1 632 . 1 1 55 55 VAL HG13 H 1 0.510 . . 2 . . 1071 . . 54 VAL HG13 . 26774 1 633 . 1 1 55 55 VAL HG21 H 1 0.628 0.003 . 2 . . 1072 . . 54 VAL HG21 . 26774 1 634 . 1 1 55 55 VAL HG22 H 1 0.628 0.003 . 2 . . 1072 . . 54 VAL HG22 . 26774 1 635 . 1 1 55 55 VAL HG23 H 1 0.628 0.003 . 2 . . 1072 . . 54 VAL HG23 . 26774 1 636 . 1 1 55 55 VAL C C 13 174.325 . . 1 . . 1511 . . 54 VAL C . 26774 1 637 . 1 1 55 55 VAL CA C 13 57.913 . . 1 . . 502 . . 54 VAL CA . 26774 1 638 . 1 1 55 55 VAL CB C 13 34.237 . . 1 . . 503 . . 54 VAL CB . 26774 1 639 . 1 1 55 55 VAL CG1 C 13 22.507 . . 2 . . 1068 . . 54 VAL CG1 . 26774 1 640 . 1 1 55 55 VAL CG2 C 13 19.302 . . 2 . . 1069 . . 54 VAL CG2 . 26774 1 641 . 1 1 55 55 VAL N N 15 112.565 0.09 . 1 . . 120 . . 54 VAL N . 26774 1 642 . 1 1 56 56 PRO HA H 1 3.861 0.001 . 1 . . 1082 . . 55 PRO HA . 26774 1 643 . 1 1 56 56 PRO HB2 H 1 2.063 0.002 . 2 . . 1086 . . 55 PRO HB2 . 26774 1 644 . 1 1 56 56 PRO HB3 H 1 2.044 0.022 . 2 . . 1087 . . 55 PRO HB3 . 26774 1 645 . 1 1 56 56 PRO HG2 H 1 1.728 . . 2 . . 1088 . . 55 PRO HG2 . 26774 1 646 . 1 1 56 56 PRO HG3 H 1 1.677 . . 2 . . 1089 . . 55 PRO HG3 . 26774 1 647 . 1 1 56 56 PRO C C 13 176.286 . . 1 . . 1513 . . 55 PRO C . 26774 1 648 . 1 1 56 56 PRO CA C 13 65.273 0.022 . 1 . . 1084 . . 55 PRO CA . 26774 1 649 . 1 1 56 56 PRO CB C 13 32.352 . . 1 . . 1085 . . 55 PRO CB . 26774 1 650 . 1 1 56 56 PRO CG C 13 27.468 . . 1 . . 1083 . . 55 PRO CG . 26774 1 651 . 1 1 57 57 ASP H H 1 8.854 0.021 . 1 . . 143 . . 56 ASP H . 26774 1 652 . 1 1 57 57 ASP HA H 1 4.835 . . 1 . . 1090 . . 56 ASP HA . 26774 1 653 . 1 1 57 57 ASP HB2 H 1 2.424 0.025 . 2 . . 1091 . . 56 ASP HB2 . 26774 1 654 . 1 1 57 57 ASP HB3 H 1 2.409 0.011 . 2 . . 1092 . . 56 ASP HB3 . 26774 1 655 . 1 1 57 57 ASP C C 13 176.716 . . 1 . . 1512 . . 56 ASP C . 26774 1 656 . 1 1 57 57 ASP CA C 13 53.725 . . 1 . . 504 . . 56 ASP CA . 26774 1 657 . 1 1 57 57 ASP CB C 13 38.725 . . 1 . . 505 . . 56 ASP CB . 26774 1 658 . 1 1 57 57 ASP N N 15 113.332 0.16 . 1 . . 144 . . 56 ASP N . 26774 1 659 . 1 1 58 58 GLN H H 1 7.472 0.015 . 1 . . 207 . . 57 GLN H . 26774 1 660 . 1 1 58 58 GLN HA H 1 3.994 0.001 . 1 . . 1094 . . 57 GLN HA . 26774 1 661 . 1 1 58 58 GLN HB2 H 1 2.004 0.008 . 2 . . 1096 . . 57 GLN HB2 . 26774 1 662 . 1 1 58 58 GLN HB3 H 1 1.898 . . 2 . . 1097 . . 57 GLN HB3 . 26774 1 663 . 1 1 58 58 GLN HG2 H 1 2.347 0.014 . 2 . . 1095 . . 57 GLN HG2 . 26774 1 664 . 1 1 58 58 GLN HG3 H 1 2.210 . . 2 . . 1099 . . 57 GLN HG3 . 26774 1 665 . 1 1 58 58 GLN HE21 H 1 7.490 0.022 . 1 . . 149 . . 57 GLN HE21 . 26774 1 666 . 1 1 58 58 GLN HE22 H 1 7.062 0.014 . 1 . . 267 . . 57 GLN HE22 . 26774 1 667 . 1 1 58 58 GLN C C 13 176.522 . . 1 . . 1514 . . 57 GLN C . 26774 1 668 . 1 1 58 58 GLN CA C 13 57.790 0.029 . 1 . . 458 . . 57 GLN CA . 26774 1 669 . 1 1 58 58 GLN CB C 13 30.056 . . 1 . . 1093 . . 57 GLN CB . 26774 1 670 . 1 1 58 58 GLN CG C 13 35.429 . . 1 . . 1101 . . 57 GLN CG . 26774 1 671 . 1 1 58 58 GLN N N 15 111.561 0.265 . 1 . . 150 . . 57 GLN N . 26774 1 672 . 1 1 58 58 GLN NE2 N 15 111.617 0.195 . 1 . . 268 . . 57 GLN NE2 . 26774 1 673 . 1 1 59 59 VAL H H 1 7.893 0.02 . 1 . . 109 . . 58 VAL H . 26774 1 674 . 1 1 59 59 VAL HA H 1 4.107 0.005 . 1 . . 1102 . . 58 VAL HA . 26774 1 675 . 1 1 59 59 VAL HB H 1 1.712 . . 1 . . 1105 . . 58 VAL HB . 26774 1 676 . 1 1 59 59 VAL HG11 H 1 0.674 . . 2 . . 1106 . . 58 VAL HG11 . 26774 1 677 . 1 1 59 59 VAL HG12 H 1 0.674 . . 2 . . 1106 . . 58 VAL HG12 . 26774 1 678 . 1 1 59 59 VAL HG13 H 1 0.674 . . 2 . . 1106 . . 58 VAL HG13 . 26774 1 679 . 1 1 59 59 VAL HG21 H 1 0.631 . . 2 . . 1107 . . 58 VAL HG21 . 26774 1 680 . 1 1 59 59 VAL HG22 H 1 0.631 . . 2 . . 1107 . . 58 VAL HG22 . 26774 1 681 . 1 1 59 59 VAL HG23 H 1 0.631 . . 2 . . 1107 . . 58 VAL HG23 . 26774 1 682 . 1 1 59 59 VAL C C 13 174.515 . . 1 . . 1515 . . 58 VAL C . 26774 1 683 . 1 1 59 59 VAL CA C 13 62.626 0.033 . 1 . . 683 . . 58 VAL CA . 26774 1 684 . 1 1 59 59 VAL CB C 13 34.801 . . 1 . . 684 . . 58 VAL CB . 26774 1 685 . 1 1 59 59 VAL CG1 C 13 22.096 . . 2 . . 1103 . . 58 VAL CG1 . 26774 1 686 . 1 1 59 59 VAL CG2 C 13 21.367 . . 2 . . 1104 . . 58 VAL CG2 . 26774 1 687 . 1 1 59 59 VAL N N 15 112.403 0.097 . 1 . . 110 . . 58 VAL N . 26774 1 688 . 1 1 60 60 VAL H H 1 7.566 0.023 . 1 . . 269 . . 59 VAL H . 26774 1 689 . 1 1 60 60 VAL HA H 1 4.635 0.004 . 1 . . 1108 . . 59 VAL HA . 26774 1 690 . 1 1 60 60 VAL HB H 1 1.971 0.004 . 1 . . 1109 . . 59 VAL HB . 26774 1 691 . 1 1 60 60 VAL HG11 H 1 0.779 0.023 . 2 . . 1110 . . 59 VAL HG11 . 26774 1 692 . 1 1 60 60 VAL HG12 H 1 0.779 0.023 . 2 . . 1110 . . 59 VAL HG12 . 26774 1 693 . 1 1 60 60 VAL HG13 H 1 0.779 0.023 . 2 . . 1110 . . 59 VAL HG13 . 26774 1 694 . 1 1 60 60 VAL HG21 H 1 0.554 0.009 . 2 . . 1111 . . 59 VAL HG21 . 26774 1 695 . 1 1 60 60 VAL HG22 H 1 0.554 0.009 . 2 . . 1111 . . 59 VAL HG22 . 26774 1 696 . 1 1 60 60 VAL HG23 H 1 0.554 0.009 . 2 . . 1111 . . 59 VAL HG23 . 26774 1 697 . 1 1 60 60 VAL C C 13 172.270 . . 1 . . 1517 . . 59 VAL C . 26774 1 698 . 1 1 60 60 VAL CA C 13 58.719 0.08 . 1 . . 479 . . 59 VAL CA . 26774 1 699 . 1 1 60 60 VAL CB C 13 36.904 . . 1 . . 480 . . 59 VAL CB . 26774 1 700 . 1 1 60 60 VAL CG1 C 13 22.507 . . 2 . . 1112 . . 59 VAL CG1 . 26774 1 701 . 1 1 60 60 VAL CG2 C 13 19.299 . . 2 . . 1113 . . 59 VAL CG2 . 26774 1 702 . 1 1 60 60 VAL N N 15 110.873 0.183 . 1 . . 270 . . 59 VAL N . 26774 1 703 . 1 1 61 61 ALA H H 1 8.029 0.021 . 1 . . 566 . . 60 ALA H . 26774 1 704 . 1 1 61 61 ALA HA H 1 4.522 . . 1 . . 1114 . . 60 ALA HA . 26774 1 705 . 1 1 61 61 ALA HB1 H 1 1.185 0.008 . 1 . . 1115 . . 60 ALA HB1 . 26774 1 706 . 1 1 61 61 ALA HB2 H 1 1.185 0.008 . 1 . . 1115 . . 60 ALA HB2 . 26774 1 707 . 1 1 61 61 ALA HB3 H 1 1.185 0.008 . 1 . . 1115 . . 60 ALA HB3 . 26774 1 708 . 1 1 61 61 ALA C C 13 177.198 . . 1 . . 1516 . . 60 ALA C . 26774 1 709 . 1 1 61 61 ALA CA C 13 49.552 . . 1 . . 685 . . 60 ALA CA . 26774 1 710 . 1 1 61 61 ALA CB C 13 22.134 . . 1 . . 686 . . 60 ALA CB . 26774 1 711 . 1 1 61 61 ALA N N 15 120.967 0.219 . 1 . . 567 . . 60 ALA N . 26774 1 712 . 1 1 62 62 VAL H H 1 8.427 0.012 . 1 . . 3 . . 61 VAL H . 26774 1 713 . 1 1 62 62 VAL HA H 1 3.055 0.011 . 1 . . 1116 . . 61 VAL HA . 26774 1 714 . 1 1 62 62 VAL HB H 1 1.990 . . 1 . . 2192 . . 61 VAL HB . 26774 1 715 . 1 1 62 62 VAL HG11 H 1 0.879 0.007 . 2 . . 1119 . . 61 VAL HG11 . 26774 1 716 . 1 1 62 62 VAL HG12 H 1 0.879 0.007 . 2 . . 1119 . . 61 VAL HG12 . 26774 1 717 . 1 1 62 62 VAL HG13 H 1 0.879 0.007 . 2 . . 1119 . . 61 VAL HG13 . 26774 1 718 . 1 1 62 62 VAL HG21 H 1 0.834 0.015 . 2 . . 1120 . . 61 VAL HG21 . 26774 1 719 . 1 1 62 62 VAL HG22 H 1 0.834 0.015 . 2 . . 1120 . . 61 VAL HG22 . 26774 1 720 . 1 1 62 62 VAL HG23 H 1 0.834 0.015 . 2 . . 1120 . . 61 VAL HG23 . 26774 1 721 . 1 1 62 62 VAL C C 13 177.488 . . 1 . . 1519 . . 61 VAL C . 26774 1 722 . 1 1 62 62 VAL CA C 13 65.761 0.037 . 1 . . 692 . . 61 VAL CA . 26774 1 723 . 1 1 62 62 VAL CB C 13 30.807 . . 1 . . 693 . . 61 VAL CB . 26774 1 724 . 1 1 62 62 VAL CG1 C 13 23.080 . . 2 . . 1117 . . 61 VAL CG1 . 26774 1 725 . 1 1 62 62 VAL CG2 C 13 21.434 . . 2 . . 1118 . . 61 VAL CG2 . 26774 1 726 . 1 1 62 62 VAL N N 15 119.761 0.083 . 1 . . 4 . . 61 VAL N . 26774 1 727 . 1 1 63 63 GLY H H 1 9.103 . . 1 . . 179 . . 62 GLY H . 26774 1 728 . 1 1 63 63 GLY HA2 H 1 3.945 . . 2 . . 1121 . . 62 GLY HA2 . 26774 1 729 . 1 1 63 63 GLY HA3 H 1 3.795 0.02 . 2 . . 1122 . . 62 GLY HA3 . 26774 1 730 . 1 1 63 63 GLY C C 13 174.318 . . 1 . . 1520 . . 62 GLY C . 26774 1 731 . 1 1 63 63 GLY CA C 13 44.235 . . 1 . . 506 . . 62 GLY CA . 26774 1 732 . 1 1 63 63 GLY N N 15 116.693 0.079 . 1 . . 292 . . 62 GLY N . 26774 1 733 . 1 1 64 64 ASP H H 1 8.004 0.021 . 1 . . 121 . . 63 ASP H . 26774 1 734 . 1 1 64 64 ASP HA H 1 4.471 0.019 . 1 . . 1124 . . 63 ASP HA . 26774 1 735 . 1 1 64 64 ASP HB2 H 1 2.751 . . 2 . . 1125 . . 63 ASP HB2 . 26774 1 736 . 1 1 64 64 ASP HB3 H 1 2.702 0.013 . 2 . . 1126 . . 63 ASP HB3 . 26774 1 737 . 1 1 64 64 ASP C C 13 176.673 . . 1 . . 1521 . . 63 ASP C . 26774 1 738 . 1 1 64 64 ASP CA C 13 55.177 . . 1 . . 527 . . 63 ASP CA . 26774 1 739 . 1 1 64 64 ASP CB C 13 40.588 . . 1 . . 528 . . 63 ASP CB . 26774 1 740 . 1 1 64 64 ASP N N 15 121.717 0.15 . 1 . . 122 . . 63 ASP N . 26774 1 741 . 1 1 65 65 ASP H H 1 8.315 0.013 . 1 . . 576 . . 64 ASP H . 26774 1 742 . 1 1 65 65 ASP HA H 1 5.061 0.021 . 1 . . 1127 . . 64 ASP HA . 26774 1 743 . 1 1 65 65 ASP HB2 H 1 2.563 0.003 . 2 . . 1128 . . 64 ASP HB2 . 26774 1 744 . 1 1 65 65 ASP HB3 H 1 2.365 0.021 . 2 . . 1129 . . 64 ASP HB3 . 26774 1 745 . 1 1 65 65 ASP C C 13 175.503 . . 1 . . 1522 . . 64 ASP C . 26774 1 746 . 1 1 65 65 ASP CA C 13 54.636 . . 1 . . 767 . . 64 ASP CA . 26774 1 747 . 1 1 65 65 ASP CB C 13 42.346 . . 1 . . 580 . . 64 ASP CB . 26774 1 748 . 1 1 65 65 ASP N N 15 119.536 0.084 . 1 . . 577 . . 64 ASP N . 26774 1 749 . 1 1 66 66 ALA H H 1 8.425 0.019 . 1 . . 87 . . 65 ALA H . 26774 1 750 . 1 1 66 66 ALA HA H 1 4.535 0.004 . 1 . . 1130 . . 65 ALA HA . 26774 1 751 . 1 1 66 66 ALA HB1 H 1 0.937 0.006 . 1 . . 1131 . . 65 ALA HB1 . 26774 1 752 . 1 1 66 66 ALA HB2 H 1 0.937 0.006 . 1 . . 1131 . . 65 ALA HB2 . 26774 1 753 . 1 1 66 66 ALA HB3 H 1 0.937 0.006 . 1 . . 1131 . . 65 ALA HB3 . 26774 1 754 . 1 1 66 66 ALA C C 13 174.808 . . 1 . . 1523 . . 65 ALA C . 26774 1 755 . 1 1 66 66 ALA CA C 13 50.805 . . 1 . . 433 . . 65 ALA CA . 26774 1 756 . 1 1 66 66 ALA CB C 13 21.503 . . 1 . . 581 . . 65 ALA CB . 26774 1 757 . 1 1 66 66 ALA N N 15 122.875 0.155 . 1 . . 88 . . 65 ALA N . 26774 1 758 . 1 1 67 67 MET H H 1 9.077 0.014 . 1 . . 163 . . 66 MET H . 26774 1 759 . 1 1 67 67 MET HA H 1 5.130 0.011 . 1 . . 1132 . . 66 MET HA . 26774 1 760 . 1 1 67 67 MET HB2 H 1 2.139 0.024 . 2 . . 1135 . . 66 MET HB2 . 26774 1 761 . 1 1 67 67 MET HB3 H 1 1.985 0.02 . 2 . . 2162 . . 66 MET HB3 . 26774 1 762 . 1 1 67 67 MET HG2 H 1 2.447 . . 2 . . 1134 . . 66 MET HG2 . 26774 1 763 . 1 1 67 67 MET HG3 H 1 2.385 0.003 . 2 . . 2161 . . 66 MET HG3 . 26774 1 764 . 1 1 67 67 MET HE1 H 1 1.794 0.016 . 1 . . 2163 . . 66 MET HE1 . 26774 1 765 . 1 1 67 67 MET HE2 H 1 1.794 0.016 . 1 . . 2163 . . 66 MET HE2 . 26774 1 766 . 1 1 67 67 MET HE3 H 1 1.794 0.016 . 1 . . 2163 . . 66 MET HE3 . 26774 1 767 . 1 1 67 67 MET C C 13 175.314 . . 1 . . 1524 . . 66 MET C . 26774 1 768 . 1 1 67 67 MET CA C 13 51.915 0.024 . 1 . . 726 . . 66 MET CA . 26774 1 769 . 1 1 67 67 MET CB C 13 28.926 . . 1 . . 728 . . 66 MET CB . 26774 1 770 . 1 1 67 67 MET CG C 13 30.903 . . 1 . . 1136 . . 66 MET CG . 26774 1 771 . 1 1 67 67 MET N N 15 120.618 0.068 . 1 . . 164 . . 66 MET N . 26774 1 772 . 1 1 68 68 VAL H H 1 8.601 0.015 . 1 . . 337 . . 67 VAL H . 26774 1 773 . 1 1 68 68 VAL HA H 1 4.630 0.003 . 1 . . 1142 . . 67 VAL HA . 26774 1 774 . 1 1 68 68 VAL HB H 1 1.781 . . 1 . . 1145 . . 67 VAL HB . 26774 1 775 . 1 1 68 68 VAL HG11 H 1 0.730 . . 2 . . 1146 . . 67 VAL HG11 . 26774 1 776 . 1 1 68 68 VAL HG12 H 1 0.730 . . 2 . . 1146 . . 67 VAL HG12 . 26774 1 777 . 1 1 68 68 VAL HG13 H 1 0.730 . . 2 . . 1146 . . 67 VAL HG13 . 26774 1 778 . 1 1 68 68 VAL HG21 H 1 0.378 . . 2 . . 1147 . . 67 VAL HG21 . 26774 1 779 . 1 1 68 68 VAL HG22 H 1 0.378 . . 2 . . 1147 . . 67 VAL HG22 . 26774 1 780 . 1 1 68 68 VAL HG23 H 1 0.378 . . 2 . . 1147 . . 67 VAL HG23 . 26774 1 781 . 1 1 68 68 VAL C C 13 172.936 . . 1 . . 1525 . . 67 VAL C . 26774 1 782 . 1 1 68 68 VAL CA C 13 57.481 0.044 . 1 . . 515 . . 67 VAL CA . 26774 1 783 . 1 1 68 68 VAL CB C 13 35.430 . . 1 . . 516 . . 67 VAL CB . 26774 1 784 . 1 1 68 68 VAL CG1 C 13 22.491 . . 2 . . 1143 . . 67 VAL CG1 . 26774 1 785 . 1 1 68 68 VAL CG2 C 13 19.629 . . 2 . . 1144 . . 67 VAL CG2 . 26774 1 786 . 1 1 68 68 VAL N N 15 112.046 0.112 . 1 . . 338 . . 67 VAL N . 26774 1 787 . 1 1 69 69 LYS H H 1 8.625 0.009 . 1 . . 1051 . . 68 LYS H . 26774 1 788 . 1 1 69 69 LYS HA H 1 4.612 0.011 . 1 . . 1148 . . 68 LYS HA . 26774 1 789 . 1 1 69 69 LYS HB2 H 1 1.710 0.013 . 2 . . 1155 . . 68 LYS HB2 . 26774 1 790 . 1 1 69 69 LYS HB3 H 1 1.668 . . 2 . . 1157 . . 68 LYS HB3 . 26774 1 791 . 1 1 69 69 LYS HG2 H 1 1.290 0.006 . 2 . . 1154 . . 68 LYS HG2 . 26774 1 792 . 1 1 69 69 LYS HG3 H 1 1.406 . . 2 . . 1156 . . 68 LYS HG3 . 26774 1 793 . 1 1 69 69 LYS HD2 H 1 1.560 . . 2 . . 2164 . . 68 LYS HD2 . 26774 1 794 . 1 1 69 69 LYS HD3 H 1 1.610 . . 2 . . 2165 . . 68 LYS HD3 . 26774 1 795 . 1 1 69 69 LYS HE2 H 1 3.235 0.006 . 2 . . 1152 . . 68 LYS HE2 . 26774 1 796 . 1 1 69 69 LYS HE3 H 1 3.171 . . 2 . . 1153 . . 68 LYS HE3 . 26774 1 797 . 1 1 69 69 LYS HZ1 H 1 7.712 . . 1 . . 2166 . . 68 LYS HZ1 . 26774 1 798 . 1 1 69 69 LYS HZ2 H 1 7.712 . . 1 . . 2166 . . 68 LYS HZ2 . 26774 1 799 . 1 1 69 69 LYS HZ3 H 1 7.712 . . 1 . . 2166 . . 68 LYS HZ3 . 26774 1 800 . 1 1 69 69 LYS C C 13 176.281 . . 1 . . 1526 . . 68 LYS C . 26774 1 801 . 1 1 69 69 LYS CA C 13 54.436 0.031 . 1 . . 1138 . . 68 LYS CA . 26774 1 802 . 1 1 69 69 LYS CB C 13 29.763 . . 1 . . 1139 . . 68 LYS CB . 26774 1 803 . 1 1 69 69 LYS CG C 13 24.534 . . 1 . . 1149 . . 68 LYS CG . 26774 1 804 . 1 1 69 69 LYS CD C 13 26.960 . . 1 . . 1158 . . 68 LYS CD . 26774 1 805 . 1 1 69 69 LYS CE C 13 41.708 . . 1 . . 1151 . . 68 LYS CE . 26774 1 806 . 1 1 69 69 LYS N N 15 123.070 0.081 . 1 . . 1052 . . 68 LYS N . 26774 1 807 . 1 1 70 70 VAL H H 1 8.774 0.015 . 1 . . 632 . . 69 VAL H . 26774 1 808 . 1 1 70 70 VAL HA H 1 3.976 0.013 . 1 . . 2157 . . 69 VAL HA . 26774 1 809 . 1 1 70 70 VAL HB H 1 1.683 . . 1 . . 2155 . . 69 VAL HB . 26774 1 810 . 1 1 70 70 VAL HG11 H 1 0.855 . . 2 . . 2153 . . 69 VAL HG11 . 26774 1 811 . 1 1 70 70 VAL HG12 H 1 0.855 . . 2 . . 2153 . . 69 VAL HG12 . 26774 1 812 . 1 1 70 70 VAL HG13 H 1 0.855 . . 2 . . 2153 . . 69 VAL HG13 . 26774 1 813 . 1 1 70 70 VAL HG21 H 1 1.001 0.007 . 2 . . 2154 . . 69 VAL HG21 . 26774 1 814 . 1 1 70 70 VAL HG22 H 1 1.001 0.007 . 2 . . 2154 . . 69 VAL HG22 . 26774 1 815 . 1 1 70 70 VAL HG23 H 1 1.001 0.007 . 2 . . 2154 . . 69 VAL HG23 . 26774 1 816 . 1 1 70 70 VAL C C 13 179.073 . . 1 . . 1527 . . 69 VAL C . 26774 1 817 . 1 1 70 70 VAL CA C 13 62.939 0.019 . 1 . . 2159 . . 69 VAL CA . 26774 1 818 . 1 1 70 70 VAL CB C 13 31.168 . . 1 . . 636 . . 69 VAL CB . 26774 1 819 . 1 1 70 70 VAL CG1 C 13 21.585 . . 2 . . 2158 . . 69 VAL CG1 . 26774 1 820 . 1 1 70 70 VAL CG2 C 13 20.834 . . 2 . . 2160 . . 69 VAL CG2 . 26774 1 821 . 1 1 70 70 VAL N N 15 127.422 0.13 . 1 . . 633 . . 69 VAL N . 26774 1 822 . 1 1 71 71 ILE HA H 1 4.222 0.003 . 1 . . 2241 . . 70 ILE HA . 26774 1 823 . 1 1 71 71 ILE HB H 1 1.834 . . 1 . . 2244 . . 70 ILE HB . 26774 1 824 . 1 1 71 71 ILE HG12 H 1 1.219 . . 1 . . 2248 . . 70 ILE HG12 . 26774 1 825 . 1 1 71 71 ILE HG21 H 1 0.673 0.017 . 1 . . 2245 . . 70 ILE HG21 . 26774 1 826 . 1 1 71 71 ILE HG22 H 1 0.673 0.017 . 1 . . 2245 . . 70 ILE HG22 . 26774 1 827 . 1 1 71 71 ILE HG23 H 1 0.673 0.017 . 1 . . 2245 . . 70 ILE HG23 . 26774 1 828 . 1 1 71 71 ILE HD11 H 1 0.627 . . 1 . . 2249 . . 70 ILE HD11 . 26774 1 829 . 1 1 71 71 ILE HD12 H 1 0.627 . . 1 . . 2249 . . 70 ILE HD12 . 26774 1 830 . 1 1 71 71 ILE HD13 H 1 0.627 . . 1 . . 2249 . . 70 ILE HD13 . 26774 1 831 . 1 1 71 71 ILE C C 13 175.722 . . 1 . . 2240 . . 70 ILE C . 26774 1 832 . 1 1 71 71 ILE CA C 13 61.301 0.011 . 1 . . 2239 . . 70 ILE CA . 26774 1 833 . 1 1 71 71 ILE CB C 13 37.918 . . 1 . . 2238 . . 70 ILE CB . 26774 1 834 . 1 1 71 71 ILE CG1 C 13 32.126 . . 1 . . 2242 . . 70 ILE CG1 . 26774 1 835 . 1 1 71 71 ILE CG2 C 13 17.761 0.016 . 1 . . 2246 . . 70 ILE CG2 . 26774 1 836 . 1 1 71 71 ILE CD1 C 13 12.417 . . 1 . . 2247 . . 70 ILE CD1 . 26774 1 837 . 1 1 72 72 ASP H H 1 7.611 0.013 . 1 . . 318 . . 71 ASP H . 26774 1 838 . 1 1 72 72 ASP HA H 1 4.202 . . 1 . . 1161 . . 71 ASP HA . 26774 1 839 . 1 1 72 72 ASP HB2 H 1 3.151 . . 2 . . 1162 . . 71 ASP HB2 . 26774 1 840 . 1 1 72 72 ASP HB3 H 1 3.105 . . 2 . . 1163 . . 71 ASP HB3 . 26774 1 841 . 1 1 72 72 ASP C C 13 174.099 . . 1 . . 1739 . . 71 ASP C . 26774 1 842 . 1 1 72 72 ASP CA C 13 54.619 . . 1 . . 1159 . . 71 ASP CA . 26774 1 843 . 1 1 72 72 ASP CB C 13 43.717 . . 1 . . 1160 . . 71 ASP CB . 26774 1 844 . 1 1 72 72 ASP N N 15 117.028 0.251 . 1 . . 319 . . 71 ASP N . 26774 1 845 . 1 1 73 73 ILE H H 1 8.018 0.021 . 1 . . 125 . . 72 ILE H . 26774 1 846 . 1 1 73 73 ILE HA H 1 4.336 0.014 . 1 . . 1164 . . 72 ILE HA . 26774 1 847 . 1 1 73 73 ILE HB H 1 2.261 0.024 . 1 . . 1167 . . 72 ILE HB . 26774 1 848 . 1 1 73 73 ILE HG12 H 1 1.248 . . 2 . . 1165 . . 72 ILE HG12 . 26774 1 849 . 1 1 73 73 ILE HG13 H 1 1.308 . . 2 . . 1166 . . 72 ILE HG13 . 26774 1 850 . 1 1 73 73 ILE HG21 H 1 0.919 0.014 . 1 . . 1168 . . 72 ILE HG21 . 26774 1 851 . 1 1 73 73 ILE HG22 H 1 0.919 0.014 . 1 . . 1168 . . 72 ILE HG22 . 26774 1 852 . 1 1 73 73 ILE HG23 H 1 0.919 0.014 . 1 . . 1168 . . 72 ILE HG23 . 26774 1 853 . 1 1 73 73 ILE HD11 H 1 0.803 . . 1 . . 1169 . . 72 ILE HD11 . 26774 1 854 . 1 1 73 73 ILE HD12 H 1 0.803 . . 1 . . 1169 . . 72 ILE HD12 . 26774 1 855 . 1 1 73 73 ILE HD13 H 1 0.803 . . 1 . . 1169 . . 72 ILE HD13 . 26774 1 856 . 1 1 73 73 ILE C C 13 173.128 . . 1 . . 1633 . . 72 ILE C . 26774 1 857 . 1 1 73 73 ILE CA C 13 61.991 0.034 . 1 . . 701 . . 72 ILE CA . 26774 1 858 . 1 1 73 73 ILE CB C 13 41.938 . . 1 . . 702 . . 72 ILE CB . 26774 1 859 . 1 1 73 73 ILE CG1 C 13 28.283 . . 1 . . 1170 . . 72 ILE CG1 . 26774 1 860 . 1 1 73 73 ILE CG2 C 13 17.473 . . 1 . . 1171 . . 72 ILE CG2 . 26774 1 861 . 1 1 73 73 ILE N N 15 122.288 0.163 . 1 . . 126 . . 72 ILE N . 26774 1 862 . 1 1 74 74 ASP H H 1 8.756 0.011 . 1 . . 51 . . 73 ASP H . 26774 1 863 . 1 1 74 74 ASP HA H 1 4.910 0.019 . 1 . . 1172 . . 73 ASP HA . 26774 1 864 . 1 1 74 74 ASP HB2 H 1 2.801 . . 2 . . 1173 . . 73 ASP HB2 . 26774 1 865 . 1 1 74 74 ASP HB3 H 1 2.430 0.019 . 2 . . 1174 . . 73 ASP HB3 . 26774 1 866 . 1 1 74 74 ASP C C 13 176.727 . . 1 . . 1632 . . 73 ASP C . 26774 1 867 . 1 1 74 74 ASP CA C 13 51.834 . . 1 . . 699 . . 73 ASP CA . 26774 1 868 . 1 1 74 74 ASP CB C 13 41.717 . . 1 . . 700 . . 73 ASP CB . 26774 1 869 . 1 1 74 74 ASP N N 15 127.338 0.053 . 1 . . 52 . . 73 ASP N . 26774 1 870 . 1 1 75 75 LEU H H 1 8.869 0.01 . 1 . . 83 . . 74 LEU H . 26774 1 871 . 1 1 75 75 LEU HA H 1 4.008 0.007 . 1 . . 1176 . . 74 LEU HA . 26774 1 872 . 1 1 75 75 LEU HB2 H 1 1.790 . . 2 . . 1177 . . 74 LEU HB2 . 26774 1 873 . 1 1 75 75 LEU HB3 H 1 1.683 0.012 . 2 . . 1178 . . 74 LEU HB3 . 26774 1 874 . 1 1 75 75 LEU HG H 1 1.627 . . 1 . . 1179 . . 74 LEU HG . 26774 1 875 . 1 1 75 75 LEU HD11 H 1 0.628 0.011 . 2 . . 1180 . . 74 LEU HD11 . 26774 1 876 . 1 1 75 75 LEU HD12 H 1 0.628 0.011 . 2 . . 1180 . . 74 LEU HD12 . 26774 1 877 . 1 1 75 75 LEU HD13 H 1 0.628 0.011 . 2 . . 1180 . . 74 LEU HD13 . 26774 1 878 . 1 1 75 75 LEU HD21 H 1 0.895 . . 2 . . 2167 . . 74 LEU HD21 . 26774 1 879 . 1 1 75 75 LEU HD22 H 1 0.895 . . 2 . . 2167 . . 74 LEU HD22 . 26774 1 880 . 1 1 75 75 LEU HD23 H 1 0.895 . . 2 . . 2167 . . 74 LEU HD23 . 26774 1 881 . 1 1 75 75 LEU C C 13 178.524 . . 1 . . 1738 . . 74 LEU C . 26774 1 882 . 1 1 75 75 LEU CA C 13 57.627 0.096 . 1 . . 463 . . 74 LEU CA . 26774 1 883 . 1 1 75 75 LEU CB C 13 41.838 . . 1 . . 464 . . 74 LEU CB . 26774 1 884 . 1 1 75 75 LEU CG C 13 30.210 . . 1 . . 801 . . 74 LEU CG . 26774 1 885 . 1 1 75 75 LEU CD1 C 13 24.116 . . 2 . . 802 . . 74 LEU CD1 . 26774 1 886 . 1 1 75 75 LEU CD2 C 13 27.157 . . 2 . . 1175 . . 74 LEU CD2 . 26774 1 887 . 1 1 75 75 LEU N N 15 125.119 0.106 . 1 . . 84 . . 74 LEU N . 26774 1 888 . 1 1 76 76 GLU H H 1 8.189 0.011 . 1 . . 59 . . 75 GLU H . 26774 1 889 . 1 1 76 76 GLU HA H 1 3.978 0.003 . 1 . . 1181 . . 75 GLU HA . 26774 1 890 . 1 1 76 76 GLU HB2 H 1 2.081 0.019 . 2 . . 1184 . . 75 GLU HB2 . 26774 1 891 . 1 1 76 76 GLU HB3 H 1 1.910 . . 2 . . 1185 . . 75 GLU HB3 . 26774 1 892 . 1 1 76 76 GLU HG2 H 1 2.220 . . 2 . . 1182 . . 75 GLU HG2 . 26774 1 893 . 1 1 76 76 GLU HG3 H 1 2.203 0.03 . 2 . . 1183 . . 75 GLU HG3 . 26774 1 894 . 1 1 76 76 GLU C C 13 178.335 . . 1 . . 1634 . . 75 GLU C . 26774 1 895 . 1 1 76 76 GLU CA C 13 58.941 0.059 . 1 . . 470 . . 75 GLU CA . 26774 1 896 . 1 1 76 76 GLU CB C 13 29.535 . . 1 . . 472 . . 75 GLU CB . 26774 1 897 . 1 1 76 76 GLU CG C 13 36.436 . . 1 . . 1186 . . 75 GLU CG . 26774 1 898 . 1 1 76 76 GLU N N 15 118.662 0.096 . 1 . . 60 . . 75 GLU N . 26774 1 899 . 1 1 77 77 ARG H H 1 7.615 0.015 . 1 . . 255 . . 76 ARG H . 26774 1 900 . 1 1 77 77 ARG HA H 1 4.042 0.009 . 1 . . 1187 . . 76 ARG HA . 26774 1 901 . 1 1 77 77 ARG HB2 H 1 1.671 0.002 . 2 . . 1188 . . 76 ARG HB2 . 26774 1 902 . 1 1 77 77 ARG HB3 H 1 1.696 . . 2 . . 1189 . . 76 ARG HB3 . 26774 1 903 . 1 1 77 77 ARG HG2 H 1 1.599 . . 2 . . 1190 . . 76 ARG HG2 . 26774 1 904 . 1 1 77 77 ARG HG3 H 1 1.440 0.018 . 2 . . 1191 . . 76 ARG HG3 . 26774 1 905 . 1 1 77 77 ARG HD2 H 1 3.119 . . 2 . . 1192 . . 76 ARG HD2 . 26774 1 906 . 1 1 77 77 ARG HD3 H 1 2.997 0.007 . 2 . . 1193 . . 76 ARG HD3 . 26774 1 907 . 1 1 77 77 ARG C C 13 174.820 . . 1 . . 1636 . . 76 ARG C . 26774 1 908 . 1 1 77 77 ARG CA C 13 55.355 0.058 . 1 . . 460 . . 76 ARG CA . 26774 1 909 . 1 1 77 77 ARG CB C 13 30.056 . . 1 . . 729 . . 76 ARG CB . 26774 1 910 . 1 1 77 77 ARG CG C 13 28.070 . . 1 . . 1195 . . 76 ARG CG . 26774 1 911 . 1 1 77 77 ARG CD C 13 43.391 . . 1 . . 1194 . . 76 ARG CD . 26774 1 912 . 1 1 77 77 ARG N N 15 115.373 0.191 . 1 . . 256 . . 76 ARG N . 26774 1 913 . 1 1 78 78 ARG H H 1 7.330 0.016 . 1 . . 410 . . 77 ARG H . 26774 1 914 . 1 1 78 78 ARG HA H 1 4.451 0.001 . 1 . . 1196 . . 77 ARG HA . 26774 1 915 . 1 1 78 78 ARG HB2 H 1 1.922 0.017 . 2 . . 1199 . . 77 ARG HB2 . 26774 1 916 . 1 1 78 78 ARG HB3 H 1 1.883 0.024 . 2 . . 1200 . . 77 ARG HB3 . 26774 1 917 . 1 1 78 78 ARG HG2 H 1 1.212 . . 1 . . 1201 . . 77 ARG HG2 . 26774 1 918 . 1 1 78 78 ARG HD2 H 1 3.053 . . 2 . . 1197 . . 77 ARG HD2 . 26774 1 919 . 1 1 78 78 ARG HD3 H 1 3.224 . . 2 . . 1198 . . 77 ARG HD3 . 26774 1 920 . 1 1 78 78 ARG C C 13 174.141 . . 1 . . 1637 . . 77 ARG C . 26774 1 921 . 1 1 78 78 ARG CA C 13 56.331 0.08 . 1 . . 456 . . 77 ARG CA . 26774 1 922 . 1 1 78 78 ARG CB C 13 26.152 . . 1 . . 730 . . 77 ARG CB . 26774 1 923 . 1 1 78 78 ARG CD C 13 41.486 . . 1 . . 1204 . . 77 ARG CD . 26774 1 924 . 1 1 78 78 ARG N N 15 117.422 0.053 . 1 . . 411 . . 77 ARG N . 26774 1 925 . 1 1 79 79 ARG H H 1 7.625 0.016 . 1 . . 137 . . 78 ARG H . 26774 1 926 . 1 1 79 79 ARG HA H 1 4.852 0.0 . 1 . . 1205 . . 78 ARG HA . 26774 1 927 . 1 1 79 79 ARG HB2 H 1 1.741 . . 2 . . 1208 . . 78 ARG HB2 . 26774 1 928 . 1 1 79 79 ARG HB3 H 1 1.718 0.004 . 2 . . 1209 . . 78 ARG HB3 . 26774 1 929 . 1 1 79 79 ARG HG2 H 1 1.501 . . 2 . . 1210 . . 78 ARG HG2 . 26774 1 930 . 1 1 79 79 ARG HG3 H 1 1.473 . . 2 . . 1211 . . 78 ARG HG3 . 26774 1 931 . 1 1 79 79 ARG HD2 H 1 3.205 . . 2 . . 1206 . . 78 ARG HD2 . 26774 1 932 . 1 1 79 79 ARG HD3 H 1 3.048 0.021 . 2 . . 1207 . . 78 ARG HD3 . 26774 1 933 . 1 1 79 79 ARG C C 13 174.659 . . 1 . . 1638 . . 78 ARG C . 26774 1 934 . 1 1 79 79 ARG CA C 13 54.186 0.017 . 1 . . 774 . . 78 ARG CA . 26774 1 935 . 1 1 79 79 ARG CB C 13 34.422 . . 1 . . 775 . . 78 ARG CB . 26774 1 936 . 1 1 79 79 ARG CG C 13 26.814 . . 1 . . 1213 . . 78 ARG CG . 26774 1 937 . 1 1 79 79 ARG CD C 13 43.561 . . 1 . . 1212 . . 78 ARG CD . 26774 1 938 . 1 1 79 79 ARG N N 15 117.206 0.146 . 1 . . 138 . . 78 ARG N . 26774 1 939 . 1 1 80 80 ILE H H 1 9.000 0.013 . 1 . . 55 . . 79 ILE H . 26774 1 940 . 1 1 80 80 ILE HA H 1 4.847 0.006 . 1 . . 906 . . 79 ILE HA . 26774 1 941 . 1 1 80 80 ILE HB H 1 1.612 0.018 . 1 . . 912 . . 79 ILE HB . 26774 1 942 . 1 1 80 80 ILE HG12 H 1 1.167 0.004 . 2 . . 1215 . . 79 ILE HG12 . 26774 1 943 . 1 1 80 80 ILE HG13 H 1 1.071 0.025 . 2 . . 1216 . . 79 ILE HG13 . 26774 1 944 . 1 1 80 80 ILE HG21 H 1 0.770 0.019 . 1 . . 1217 . . 79 ILE HG21 . 26774 1 945 . 1 1 80 80 ILE HG22 H 1 0.770 0.019 . 1 . . 1217 . . 79 ILE HG22 . 26774 1 946 . 1 1 80 80 ILE HG23 H 1 0.770 0.019 . 1 . . 1217 . . 79 ILE HG23 . 26774 1 947 . 1 1 80 80 ILE HD11 H 1 0.629 0.019 . 1 . . 1218 . . 79 ILE HD11 . 26774 1 948 . 1 1 80 80 ILE HD12 H 1 0.629 0.019 . 1 . . 1218 . . 79 ILE HD12 . 26774 1 949 . 1 1 80 80 ILE HD13 H 1 0.629 0.019 . 1 . . 1218 . . 79 ILE HD13 . 26774 1 950 . 1 1 80 80 ILE C C 13 173.735 . . 1 . . 1639 . . 79 ILE C . 26774 1 951 . 1 1 80 80 ILE CA C 13 59.651 0.014 . 1 . . 675 . . 79 ILE CA . 26774 1 952 . 1 1 80 80 ILE CB C 13 41.626 . . 1 . . 676 . . 79 ILE CB . 26774 1 953 . 1 1 80 80 ILE CG1 C 13 27.985 . . 1 . . 907 . . 79 ILE CG1 . 26774 1 954 . 1 1 80 80 ILE CG2 C 13 16.677 . . 1 . . 908 . . 79 ILE CG2 . 26774 1 955 . 1 1 80 80 ILE CD1 C 13 15.156 . . 1 . . 910 . . 79 ILE CD1 . 26774 1 956 . 1 1 80 80 ILE N N 15 123.110 0.106 . 1 . . 56 . . 79 ILE N . 26774 1 957 . 1 1 81 81 SER H H 1 8.448 0.008 . 1 . . 89 . . 80 SER H . 26774 1 958 . 1 1 81 81 SER HA H 1 4.426 . . 1 . . 1221 . . 80 SER HA . 26774 1 959 . 1 1 81 81 SER HB2 H 1 3.579 . . 2 . . 1219 . . 80 SER HB2 . 26774 1 960 . 1 1 81 81 SER HB3 H 1 3.734 . . 2 . . 1220 . . 80 SER HB3 . 26774 1 961 . 1 1 81 81 SER HG H 1 5.162 . . 1 . . 1222 . . 80 SER HG . 26774 1 962 . 1 1 81 81 SER C C 13 173.294 . . 1 . . 1640 . . 80 SER C . 26774 1 963 . 1 1 81 81 SER CA C 13 57.140 . . 1 . . 418 . . 80 SER CA . 26774 1 964 . 1 1 81 81 SER CB C 13 64.293 . . 1 . . 721 . . 80 SER CB . 26774 1 965 . 1 1 81 81 SER N N 15 121.231 0.079 . 1 . . 90 . . 80 SER N . 26774 1 966 . 1 1 82 82 LEU H H 1 8.343 0.018 . 1 . . 93 . . 81 LEU H . 26774 1 967 . 1 1 82 82 LEU HA H 1 4.514 0.009 . 1 . . 2168 . . 81 LEU HA . 26774 1 968 . 1 1 82 82 LEU HB2 H 1 1.586 . . 2 . . 2173 . . 81 LEU HB2 . 26774 1 969 . 1 1 82 82 LEU HB3 H 1 1.494 . . 2 . . 2174 . . 81 LEU HB3 . 26774 1 970 . 1 1 82 82 LEU HG H 1 1.360 . . 1 . . 2171 . . 81 LEU HG . 26774 1 971 . 1 1 82 82 LEU HD11 H 1 0.861 0.013 . 2 . . 2169 . . 81 LEU HD11 . 26774 1 972 . 1 1 82 82 LEU HD12 H 1 0.861 0.013 . 2 . . 2169 . . 81 LEU HD12 . 26774 1 973 . 1 1 82 82 LEU HD13 H 1 0.861 0.013 . 2 . . 2169 . . 81 LEU HD13 . 26774 1 974 . 1 1 82 82 LEU HD21 H 1 0.663 . . 2 . . 2170 . . 81 LEU HD21 . 26774 1 975 . 1 1 82 82 LEU HD22 H 1 0.663 . . 2 . . 2170 . . 81 LEU HD22 . 26774 1 976 . 1 1 82 82 LEU HD23 H 1 0.663 . . 2 . . 2170 . . 81 LEU HD23 . 26774 1 977 . 1 1 82 82 LEU C C 13 176.310 . . 1 . . 1641 . . 81 LEU C . 26774 1 978 . 1 1 82 82 LEU CA C 13 52.580 . . 1 . . 654 . . 81 LEU CA . 26774 1 979 . 1 1 82 82 LEU CB C 13 37.421 . . 1 . . 655 . . 81 LEU CB . 26774 1 980 . 1 1 82 82 LEU CG C 13 29.249 . . 1 . . 804 . . 81 LEU CG . 26774 1 981 . 1 1 82 82 LEU N N 15 125.553 0.175 . 1 . . 94 . . 81 LEU N . 26774 1 982 . 1 1 83 83 SER H H 1 8.583 0.015 . 1 . . 310 . . 82 SER H . 26774 1 983 . 1 1 83 83 SER HA H 1 5.088 . . 1 . . 2177 . . 82 SER HA . 26774 1 984 . 1 1 83 83 SER HB2 H 1 3.856 . . 2 . . 2175 . . 82 SER HB2 . 26774 1 985 . 1 1 83 83 SER HB3 H 1 3.645 0.002 . 2 . . 2176 . . 82 SER HB3 . 26774 1 986 . 1 1 83 83 SER HG H 1 5.409 . . 1 . . 2178 . . 82 SER HG . 26774 1 987 . 1 1 83 83 SER C C 13 173.504 . . 1 . . 1732 . . 82 SER C . 26774 1 988 . 1 1 83 83 SER CA C 13 57.904 . . 1 . . 682 . . 82 SER CA . 26774 1 989 . 1 1 83 83 SER CB C 13 64.593 . . 1 . . 431 . . 82 SER CB . 26774 1 990 . 1 1 83 83 SER N N 15 110.050 0.136 . 1 . . 311 . . 82 SER N . 26774 1 991 . 1 1 84 84 LEU H H 1 7.725 . . 1 . . 2219 . . 83 LEU H . 26774 1 992 . 1 1 84 84 LEU HA H 1 3.979 0.014 . 1 . . 2225 . . 83 LEU HA . 26774 1 993 . 1 1 84 84 LEU HB2 H 1 1.905 0.0 . 1 . . 2221 . . 83 LEU HB2 . 26774 1 994 . 1 1 84 84 LEU HD11 H 1 0.845 0.007 . 2 . . 2223 . . 83 LEU HD11 . 26774 1 995 . 1 1 84 84 LEU HD12 H 1 0.845 0.007 . 2 . . 2223 . . 83 LEU HD12 . 26774 1 996 . 1 1 84 84 LEU HD13 H 1 0.845 0.007 . 2 . . 2223 . . 83 LEU HD13 . 26774 1 997 . 1 1 84 84 LEU HD21 H 1 0.675 . . 2 . . 2224 . . 83 LEU HD21 . 26774 1 998 . 1 1 84 84 LEU HD22 H 1 0.675 . . 2 . . 2224 . . 83 LEU HD22 . 26774 1 999 . 1 1 84 84 LEU HD23 H 1 0.675 . . 2 . . 2224 . . 83 LEU HD23 . 26774 1 1000 . 1 1 84 84 LEU C C 13 177.082 . . 1 . . 2230 . . 83 LEU C . 26774 1 1001 . 1 1 84 84 LEU CA C 13 58.680 0.04 . 1 . . 2222 . . 83 LEU CA . 26774 1 1002 . 1 1 84 84 LEU CB C 13 38.732 . . 1 . . 2227 . . 83 LEU CB . 26774 1 1003 . 1 1 84 84 LEU CG C 13 27.756 . . 1 . . 2229 . . 83 LEU CG . 26774 1 1004 . 1 1 84 84 LEU CD1 C 13 24.892 . . 1 . . 2228 . . 83 LEU CD1 . 26774 1 1005 . 1 1 85 85 LYS H H 1 8.247 0.016 . 1 . . 572 . . 84 LYS H . 26774 1 1006 . 1 1 85 85 LYS HA H 1 4.210 . . 1 . . 2212 . . 84 LYS HA . 26774 1 1007 . 1 1 85 85 LYS HB2 H 1 1.826 0.022 . 2 . . 2210 . . 84 LYS HB2 . 26774 1 1008 . 1 1 85 85 LYS HB3 H 1 1.743 . . 2 . . 2211 . . 84 LYS HB3 . 26774 1 1009 . 1 1 85 85 LYS HG2 H 1 1.368 0.019 . 2 . . 2207 . . 84 LYS HG2 . 26774 1 1010 . 1 1 85 85 LYS HG3 H 1 1.476 . . 2 . . 2208 . . 84 LYS HG3 . 26774 1 1011 . 1 1 85 85 LYS HD2 H 1 1.606 . . 1 . . 2209 . . 84 LYS HD2 . 26774 1 1012 . 1 1 85 85 LYS C C 13 179.446 . . 1 . . 1672 . . 84 LYS C . 26774 1 1013 . 1 1 85 85 LYS CA C 13 59.652 . . 1 . . 1670 . . 84 LYS CA . 26774 1 1014 . 1 1 85 85 LYS CB C 13 33.384 0.023 . 1 . . 1671 . . 84 LYS CB . 26774 1 1015 . 1 1 85 85 LYS CG C 13 25.141 . . 1 . . 2216 . . 84 LYS CG . 26774 1 1016 . 1 1 85 85 LYS CD C 13 29.611 . . 1 . . 2215 . . 84 LYS CD . 26774 1 1017 . 1 1 85 85 LYS CE C 13 42.212 . . 1 . . 2214 . . 84 LYS CE . 26774 1 1018 . 1 1 85 85 LYS N N 15 120.993 0.109 . 1 . . 573 . . 84 LYS N . 26774 1 1019 . 1 1 86 86 GLN C C 13 178.150 . . 1 . . 2252 . . 85 GLN C . 26774 1 1020 . 1 1 86 86 GLN CA C 13 58.426 . . 1 . . 344 . . 85 GLN CA . 26774 1 1021 . 1 1 86 86 GLN CB C 13 30.165 . . 1 . . 2251 . . 85 GLN CB . 26774 1 1022 . 1 1 87 87 ALA H H 1 6.543 0.015 . 1 . . 226 . . 86 ALA H . 26774 1 1023 . 1 1 87 87 ALA HA H 1 3.769 . . 1 . . 2206 . . 86 ALA HA . 26774 1 1024 . 1 1 87 87 ALA HB1 H 1 1.295 . . 1 . . 2205 . . 86 ALA HB1 . 26774 1 1025 . 1 1 87 87 ALA HB2 H 1 1.295 . . 1 . . 2205 . . 86 ALA HB2 . 26774 1 1026 . 1 1 87 87 ALA HB3 H 1 1.295 . . 1 . . 2205 . . 86 ALA HB3 . 26774 1 1027 . 1 1 87 87 ALA C C 13 179.086 . . 1 . . 1238 . . 86 ALA C . 26774 1 1028 . 1 1 87 87 ALA CA C 13 55.133 . . 1 . . 482 . . 86 ALA CA . 26774 1 1029 . 1 1 87 87 ALA CB C 13 17.448 . . 1 . . 483 . . 86 ALA CB . 26774 1 1030 . 1 1 87 87 ALA N N 15 119.077 0.074 . 1 . . 227 . . 86 ALA N . 26774 1 1031 . 1 1 88 88 ASN H H 1 7.712 0.015 . 1 . . 25 . . 87 ASN H . 26774 1 1032 . 1 1 88 88 ASN HA H 1 4.095 0.008 . 1 . . 2202 . . 87 ASN HA . 26774 1 1033 . 1 1 88 88 ASN HB2 H 1 3.047 . . 2 . . 2203 . . 87 ASN HB2 . 26774 1 1034 . 1 1 88 88 ASN HB3 H 1 2.831 . . 2 . . 2204 . . 87 ASN HB3 . 26774 1 1035 . 1 1 88 88 ASN HD21 H 1 7.256 0.02 . 1 . . 57 . . 87 ASN HD21 . 26774 1 1036 . 1 1 88 88 ASN HD22 H 1 7.524 0.024 . 1 . . 91 . . 87 ASN HD22 . 26774 1 1037 . 1 1 88 88 ASN C C 13 178.064 . . 1 . . 1814 . . 87 ASN C . 26774 1 1038 . 1 1 88 88 ASN CA C 13 55.381 . . 1 . . 461 . . 87 ASN CA . 26774 1 1039 . 1 1 88 88 ASN CB C 13 36.578 . . 1 . . 462 . . 87 ASN CB . 26774 1 1040 . 1 1 88 88 ASN N N 15 117.264 0.121 . 1 . . 26 . . 87 ASN N . 26774 1 1041 . 1 1 88 88 ASN ND2 N 15 113.346 0.277 . 1 . . 58 . . 87 ASN ND2 . 26774 1 1042 . 1 1 89 89 GLU H H 1 8.058 0.021 . 1 . . 722 . . 88 GLU H . 26774 1 1043 . 1 1 89 89 GLU C C 13 177.294 . . 1 . . 1735 . . 88 GLU C . 26774 1 1044 . 1 1 89 89 GLU CA C 13 58.821 . . 1 . . 1733 . . 88 GLU CA . 26774 1 1045 . 1 1 89 89 GLU CB C 13 29.724 . . 1 . . 1734 . . 88 GLU CB . 26774 1 1046 . 1 1 89 89 GLU N N 15 121.320 0.282 . 1 . . 723 . . 88 GLU N . 26774 1 1047 . 1 1 90 90 ASP H H 1 7.175 0.011 . 1 . . 63 . . 89 ASP H . 26774 1 1048 . 1 1 90 90 ASP HA H 1 5.083 . . 1 . . 1242 . . 89 ASP HA . 26774 1 1049 . 1 1 90 90 ASP HB2 H 1 2.741 0.001 . 2 . . 1243 . . 89 ASP HB2 . 26774 1 1050 . 1 1 90 90 ASP HB3 H 1 2.714 . . 2 . . 1244 . . 89 ASP HB3 . 26774 1 1051 . 1 1 90 90 ASP C C 13 176.188 . . 1 . . 1237 . . 89 ASP C . 26774 1 1052 . 1 1 90 90 ASP CA C 13 53.780 . . 1 . . 769 . . 89 ASP CA . 26774 1 1053 . 1 1 90 90 ASP CB C 13 41.340 . . 1 . . 696 . . 89 ASP CB . 26774 1 1054 . 1 1 90 90 ASP N N 15 117.541 0.071 . 1 . . 64 . . 89 ASP N . 26774 1 1055 . 1 1 91 91 TYR H H 1 7.357 0.018 . 1 . . 141 . . 90 TYR H . 26774 1 1056 . 1 1 91 91 TYR HA H 1 4.149 0.002 . 1 . . 1239 . . 90 TYR HA . 26774 1 1057 . 1 1 91 91 TYR HB2 H 1 2.751 . . 2 . . 2010 . . 90 TYR HB2 . 26774 1 1058 . 1 1 91 91 TYR HB3 H 1 2.522 0.002 . 2 . . 2011 . . 90 TYR HB3 . 26774 1 1059 . 1 1 91 91 TYR HD1 H 1 7.228 0.005 . 1 . . 2012 . . 90 TYR HD1 . 26774 1 1060 . 1 1 91 91 TYR HD2 H 1 7.228 0.005 . 1 . . 2012 . . 90 TYR HD2 . 26774 1 1061 . 1 1 91 91 TYR HE1 H 1 6.420 . . 1 . . 2017 . . 90 TYR HE1 . 26774 1 1062 . 1 1 91 91 TYR HE2 H 1 6.420 . . 1 . . 2017 . . 90 TYR HE2 . 26774 1 1063 . 1 1 91 91 TYR HH H 1 8.916 . . 1 . . 2016 . . 90 TYR HH . 26774 1 1064 . 1 1 91 91 TYR C C 13 175.285 . . 1 . . 1236 . . 90 TYR C . 26774 1 1065 . 1 1 91 91 TYR CA C 13 59.932 . . 1 . . 771 . . 90 TYR CA . 26774 1 1066 . 1 1 91 91 TYR CB C 13 38.908 . . 1 . . 772 . . 90 TYR CB . 26774 1 1067 . 1 1 91 91 TYR CD1 C 13 131.891 . . 1 . . 2015 . . 90 TYR CD1 . 26774 1 1068 . 1 1 91 91 TYR CD2 C 13 131.891 . . 1 . . 2015 . . 90 TYR CD2 . 26774 1 1069 . 1 1 91 91 TYR N N 15 121.744 0.105 . 1 . . 142 . . 90 TYR N . 26774 1 1070 . 1 1 92 92 THR H H 1 7.433 0.01 . 1 . . 157 . . 91 THR H . 26774 1 1071 . 1 1 92 92 THR HA H 1 4.157 . . 1 . . 864 . . 91 THR HA . 26774 1 1072 . 1 1 92 92 THR HB H 1 3.891 . . 1 . . 869 . . 91 THR HB . 26774 1 1073 . 1 1 92 92 THR HG1 H 1 4.078 . . 1 . . 872 . . 91 THR HG1 . 26774 1 1074 . 1 1 92 92 THR HG21 H 1 1.692 . . 1 . . 871 . . 91 THR HG21 . 26774 1 1075 . 1 1 92 92 THR HG22 H 1 1.692 . . 1 . . 871 . . 91 THR HG22 . 26774 1 1076 . 1 1 92 92 THR HG23 H 1 1.692 . . 1 . . 871 . . 91 THR HG23 . 26774 1 1077 . 1 1 92 92 THR C C 13 172.129 . . 1 . . 1235 . . 91 THR C . 26774 1 1078 . 1 1 92 92 THR CA C 13 59.545 . . 1 . . 417 . . 91 THR CA . 26774 1 1079 . 1 1 92 92 THR CB C 13 71.092 . . 1 . . 416 . . 91 THR CB . 26774 1 1080 . 1 1 92 92 THR N N 15 119.840 0.053 . 1 . . 158 . . 91 THR N . 26774 1 1081 . 1 1 93 93 GLU H H 1 8.620 0.013 . 1 . . 230 . . 92 GLU H . 26774 1 1082 . 1 1 93 93 GLU HA H 1 3.929 0.003 . 1 . . 1246 . . 92 GLU HA . 26774 1 1083 . 1 1 93 93 GLU HB2 H 1 1.833 . . 2 . . 1249 . . 92 GLU HB2 . 26774 1 1084 . 1 1 93 93 GLU HB3 H 1 1.976 . . 2 . . 1250 . . 92 GLU HB3 . 26774 1 1085 . 1 1 93 93 GLU HG2 H 1 2.361 . . 2 . . 1247 . . 92 GLU HG2 . 26774 1 1086 . 1 1 93 93 GLU HG3 H 1 2.296 0.007 . 2 . . 1248 . . 92 GLU HG3 . 26774 1 1087 . 1 1 93 93 GLU C C 13 178.008 . . 1 . . 1245 . . 92 GLU C . 26774 1 1088 . 1 1 93 93 GLU CA C 13 58.376 . . 1 . . 582 . . 92 GLU CA . 26774 1 1089 . 1 1 93 93 GLU CB C 13 29.578 . . 1 . . 583 . . 92 GLU CB . 26774 1 1090 . 1 1 93 93 GLU CG C 13 36.593 . . 1 . . 1251 . . 92 GLU CG . 26774 1 1091 . 1 1 93 93 GLU N N 15 123.496 0.165 . 1 . . 231 . . 92 GLU N . 26774 1 1092 . 1 1 94 94 GLU H H 1 8.019 0.018 . 1 . . 329 . . 93 GLU H . 26774 1 1093 . 1 1 94 94 GLU HA H 1 4.116 0.007 . 1 . . 1254 . . 93 GLU HA . 26774 1 1094 . 1 1 94 94 GLU HB2 H 1 1.758 . . 2 . . 1257 . . 93 GLU HB2 . 26774 1 1095 . 1 1 94 94 GLU HB3 H 1 1.778 0.007 . 2 . . 1258 . . 93 GLU HB3 . 26774 1 1096 . 1 1 94 94 GLU HG2 H 1 2.117 . . 2 . . 1255 . . 93 GLU HG2 . 26774 1 1097 . 1 1 94 94 GLU HG3 H 1 2.141 . . 2 . . 1256 . . 93 GLU HG3 . 26774 1 1098 . 1 1 94 94 GLU C C 13 176.124 . . 1 . . 1252 . . 93 GLU C . 26774 1 1099 . 1 1 94 94 GLU CA C 13 55.961 . . 1 . . 687 . . 93 GLU CA . 26774 1 1100 . 1 1 94 94 GLU CB C 13 29.258 . . 1 . . 698 . . 93 GLU CB . 26774 1 1101 . 1 1 94 94 GLU CG C 13 36.492 . . 1 . . 1259 . . 93 GLU CG . 26774 1 1102 . 1 1 94 94 GLU N N 15 117.159 0.186 . 1 . . 330 . . 93 GLU N . 26774 1 1103 . 1 1 95 95 PHE H H 1 8.646 0.01 . 1 . . 103 . . 94 PHE H . 26774 1 1104 . 1 1 95 95 PHE HA H 1 4.099 . . 1 . . 2082 . . 94 PHE HA . 26774 1 1105 . 1 1 95 95 PHE HB2 H 1 2.668 . . 2 . . 2083 . . 94 PHE HB2 . 26774 1 1106 . 1 1 95 95 PHE HB3 H 1 2.790 0.017 . 2 . . 2084 . . 94 PHE HB3 . 26774 1 1107 . 1 1 95 95 PHE HD1 H 1 6.796 0.0 . 1 . . 2263 . . 94 PHE HD1 . 26774 1 1108 . 1 1 95 95 PHE HD2 H 1 6.796 0.0 . 1 . . 2263 . . 94 PHE HD2 . 26774 1 1109 . 1 1 95 95 PHE HE1 H 1 7.444 0.001 . 1 . . 2081 . . 94 PHE HE1 . 26774 1 1110 . 1 1 95 95 PHE HE2 H 1 7.444 0.001 . 1 . . 2081 . . 94 PHE HE2 . 26774 1 1111 . 1 1 95 95 PHE HZ H 1 6.723 0.019 . 1 . . 2080 . . 94 PHE HZ . 26774 1 1112 . 1 1 95 95 PHE C C 13 173.326 . . 1 . . 1253 . . 94 PHE C . 26774 1 1113 . 1 1 95 95 PHE CA C 13 56.095 . . 1 . . 466 . . 94 PHE CA . 26774 1 1114 . 1 1 95 95 PHE CB C 13 38.998 . . 1 . . 697 . . 94 PHE CB . 26774 1 1115 . 1 1 95 95 PHE CD1 C 13 133.097 . . 1 . . 2264 . . 94 PHE CD1 . 26774 1 1116 . 1 1 95 95 PHE CD2 C 13 133.097 . . 1 . . 2264 . . 94 PHE CD2 . 26774 1 1117 . 1 1 95 95 PHE CE1 C 13 130.703 . . 1 . . 2087 . . 94 PHE CE1 . 26774 1 1118 . 1 1 95 95 PHE CE2 C 13 130.703 . . 1 . . 2087 . . 94 PHE CE2 . 26774 1 1119 . 1 1 95 95 PHE CZ C 13 131.041 . . 1 . . 2085 . . 94 PHE CZ . 26774 1 1120 . 1 1 95 95 PHE N N 15 127.392 0.204 . 1 . . 104 . . 94 PHE N . 26774 1 1121 . 1 1 96 96 ASP H H 1 7.780 0.015 . 1 . . 218 . . 95 ASP H . 26774 1 1122 . 1 1 96 96 ASP HA H 1 4.625 0.003 . 1 . . 1528 . . 95 ASP HA . 26774 1 1123 . 1 1 96 96 ASP HB2 H 1 3.289 . . 2 . . 1529 . . 95 ASP HB2 . 26774 1 1124 . 1 1 96 96 ASP HB3 H 1 2.521 . . 2 . . 1530 . . 95 ASP HB3 . 26774 1 1125 . 1 1 96 96 ASP C C 13 174.333 . . 1 . . 1260 . . 95 ASP C . 26774 1 1126 . 1 1 96 96 ASP CA C 13 49.397 0.043 . 1 . . 695 . . 95 ASP CA . 26774 1 1127 . 1 1 96 96 ASP CB C 13 41.440 . . 1 . . 1261 . . 95 ASP CB . 26774 1 1128 . 1 1 96 96 ASP N N 15 130.598 0.114 . 1 . . 219 . . 95 ASP N . 26774 1 1129 . 1 1 97 97 PRO HA H 1 3.655 0.001 . 1 . . 1269 . . 96 PRO HA . 26774 1 1130 . 1 1 97 97 PRO HB2 H 1 2.011 . . 1 . . 1275 . . 96 PRO HB2 . 26774 1 1131 . 1 1 97 97 PRO HG2 H 1 1.863 . . 1 . . 1274 . . 96 PRO HG2 . 26774 1 1132 . 1 1 97 97 PRO C C 13 177.977 . . 1 . . 1265 . . 96 PRO C . 26774 1 1133 . 1 1 97 97 PRO CA C 13 63.956 0.011 . 1 . . 1267 . . 96 PRO CA . 26774 1 1134 . 1 1 97 97 PRO CB C 13 31.885 . . 1 . . 1268 . . 96 PRO CB . 26774 1 1135 . 1 1 97 97 PRO CG C 13 26.365 . . 1 . . 1272 . . 96 PRO CG . 26774 1 1136 . 1 1 98 98 ALA H H 1 7.614 0.016 . 1 . . 139 . . 97 ALA H . 26774 1 1137 . 1 1 98 98 ALA HA H 1 3.555 0.005 . 1 . . 1276 . . 97 ALA HA . 26774 1 1138 . 1 1 98 98 ALA HB1 H 1 1.124 0.002 . 1 . . 1277 . . 97 ALA HB1 . 26774 1 1139 . 1 1 98 98 ALA HB2 H 1 1.124 0.002 . 1 . . 1277 . . 97 ALA HB2 . 26774 1 1140 . 1 1 98 98 ALA HB3 H 1 1.124 0.002 . 1 . . 1277 . . 97 ALA HB3 . 26774 1 1141 . 1 1 98 98 ALA C C 13 179.249 . . 1 . . 1630 . . 97 ALA C . 26774 1 1142 . 1 1 98 98 ALA CA C 13 54.532 . . 1 . . 616 . . 97 ALA CA . 26774 1 1143 . 1 1 98 98 ALA CB C 13 18.601 . . 1 . . 617 . . 97 ALA CB . 26774 1 1144 . 1 1 98 98 ALA N N 15 118.119 0.115 . 1 . . 140 . . 97 ALA N . 26774 1 1145 . 1 1 99 99 LYS H H 1 7.171 0.018 . 1 . . 228 . . 98 LYS H . 26774 1 1146 . 1 1 99 99 LYS HA H 1 3.978 0.014 . 1 . . 1281 . . 98 LYS HA . 26774 1 1147 . 1 1 99 99 LYS HB2 H 1 1.870 0.015 . 2 . . 1288 . . 98 LYS HB2 . 26774 1 1148 . 1 1 99 99 LYS HB3 H 1 1.714 . . 2 . . 1289 . . 98 LYS HB3 . 26774 1 1149 . 1 1 99 99 LYS HG2 H 1 1.026 . . 2 . . 1284 . . 98 LYS HG2 . 26774 1 1150 . 1 1 99 99 LYS HG3 H 1 1.174 . . 2 . . 1285 . . 98 LYS HG3 . 26774 1 1151 . 1 1 99 99 LYS HD2 H 1 1.439 0.021 . 2 . . 1286 . . 98 LYS HD2 . 26774 1 1152 . 1 1 99 99 LYS HD3 H 1 1.358 0.013 . 2 . . 1287 . . 98 LYS HD3 . 26774 1 1153 . 1 1 99 99 LYS HE2 H 1 2.962 . . 2 . . 1282 . . 98 LYS HE2 . 26774 1 1154 . 1 1 99 99 LYS HE3 H 1 2.912 . . 2 . . 1283 . . 98 LYS HE3 . 26774 1 1155 . 1 1 99 99 LYS C C 13 175.288 . . 1 . . 1278 . . 98 LYS C . 26774 1 1156 . 1 1 99 99 LYS CA C 13 57.160 . . 1 . . 614 . . 98 LYS CA . 26774 1 1157 . 1 1 99 99 LYS CB C 13 33.329 . . 1 . . 615 . . 98 LYS CB . 26774 1 1158 . 1 1 99 99 LYS CG C 13 24.758 . . 1 . . 2179 . . 98 LYS CG . 26774 1 1159 . 1 1 99 99 LYS CD C 13 30.214 . . 1 . . 2181 . . 98 LYS CD . 26774 1 1160 . 1 1 99 99 LYS CE C 13 42.290 . . 1 . . 1279 . . 98 LYS CE . 26774 1 1161 . 1 1 99 99 LYS N N 15 115.184 0.182 . 1 . . 229 . . 98 LYS N . 26774 1 1162 . 1 1 100 100 TYR H H 1 6.836 0.025 . 1 . . 312 . . 99 TYR H . 26774 1 1163 . 1 1 100 100 TYR HA H 1 3.962 0.009 . 1 . . 1293 . . 99 TYR HA . 26774 1 1164 . 1 1 100 100 TYR HB2 H 1 3.098 . . 2 . . 1292 . . 99 TYR HB2 . 26774 1 1165 . 1 1 100 100 TYR HB3 H 1 2.960 0.004 . 2 . . 1294 . . 99 TYR HB3 . 26774 1 1166 . 1 1 100 100 TYR HD1 H 1 7.160 0.0 . 1 . . 2019 . . 99 TYR HD1 . 26774 1 1167 . 1 1 100 100 TYR HD2 H 1 7.160 0.0 . 1 . . 2019 . . 99 TYR HD2 . 26774 1 1168 . 1 1 100 100 TYR HE1 H 1 6.738 0.01 . 1 . . 2021 . . 99 TYR HE1 . 26774 1 1169 . 1 1 100 100 TYR HE2 H 1 6.738 0.01 . 1 . . 2021 . . 99 TYR HE2 . 26774 1 1170 . 1 1 100 100 TYR C C 13 176.569 . . 1 . . 1290 . . 99 TYR C . 26774 1 1171 . 1 1 100 100 TYR CA C 13 57.130 . . 1 . . 612 . . 99 TYR CA . 26774 1 1172 . 1 1 100 100 TYR CB C 13 41.090 . . 1 . . 613 . . 99 TYR CB . 26774 1 1173 . 1 1 100 100 TYR CD1 C 13 131.119 . . 1 . . 2020 . . 99 TYR CD1 . 26774 1 1174 . 1 1 100 100 TYR CD2 C 13 131.119 . . 1 . . 2020 . . 99 TYR CD2 . 26774 1 1175 . 1 1 100 100 TYR CE1 C 13 117.545 . . 1 . . 2022 . . 99 TYR CE1 . 26774 1 1176 . 1 1 100 100 TYR CE2 C 13 117.545 . . 1 . . 2022 . . 99 TYR CE2 . 26774 1 1177 . 1 1 100 100 TYR N N 15 113.075 0.177 . 1 . . 313 . . 99 TYR N . 26774 1 1178 . 1 1 101 101 GLY H H 1 7.781 0.019 . 1 . . 23 . . 100 GLY H . 26774 1 1179 . 1 1 101 101 GLY HA2 H 1 4.185 . . 2 . . 1295 . . 100 GLY HA2 . 26774 1 1180 . 1 1 101 101 GLY HA3 H 1 4.160 . . 2 . . 1296 . . 100 GLY HA3 . 26774 1 1181 . 1 1 101 101 GLY C C 13 174.903 . . 1 . . 1297 . . 100 GLY C . 26774 1 1182 . 1 1 101 101 GLY CA C 13 45.690 . . 1 . . 434 . . 100 GLY CA . 26774 1 1183 . 1 1 101 101 GLY N N 15 106.355 0.099 . 1 . . 24 . . 100 GLY N . 26774 1 1184 . 1 1 102 102 MET H H 1 7.669 0.016 . 1 . . 306 . . 101 MET H . 26774 1 1185 . 1 1 102 102 MET HA H 1 4.798 0.003 . 1 . . 1300 . . 101 MET HA . 26774 1 1186 . 1 1 102 102 MET HB2 H 1 2.274 . . 2 . . 1303 . . 101 MET HB2 . 26774 1 1187 . 1 1 102 102 MET HB3 H 1 2.234 . . 2 . . 1304 . . 101 MET HB3 . 26774 1 1188 . 1 1 102 102 MET HG2 H 1 2.370 . . 2 . . 1301 . . 101 MET HG2 . 26774 1 1189 . 1 1 102 102 MET HG3 H 1 2.728 . . 2 . . 1302 . . 101 MET HG3 . 26774 1 1190 . 1 1 102 102 MET HE1 H 1 1.863 . . 1 . . 1305 . . 101 MET HE1 . 26774 1 1191 . 1 1 102 102 MET HE2 H 1 1.863 . . 1 . . 1305 . . 101 MET HE2 . 26774 1 1192 . 1 1 102 102 MET HE3 H 1 1.863 . . 1 . . 1305 . . 101 MET HE3 . 26774 1 1193 . 1 1 102 102 MET C C 13 176.049 . . 1 . . 1309 . . 101 MET C . 26774 1 1194 . 1 1 102 102 MET CA C 13 53.860 0.048 . 1 . . 606 . . 101 MET CA . 26774 1 1195 . 1 1 102 102 MET CB C 13 31.309 . . 1 . . 607 . . 101 MET CB . 26774 1 1196 . 1 1 102 102 MET CG C 13 32.701 . . 1 . . 1307 . . 101 MET CG . 26774 1 1197 . 1 1 102 102 MET CE C 13 18.087 . . 1 . . 1308 . . 101 MET CE . 26774 1 1198 . 1 1 102 102 MET N N 15 117.628 0.149 . 1 . . 307 . . 101 MET N . 26774 1 1199 . 1 1 103 103 ALA H H 1 8.054 0.023 . 1 . . 302 . . 102 ALA H . 26774 1 1200 . 1 1 103 103 ALA HA H 1 4.022 0.014 . 1 . . 1311 . . 102 ALA HA . 26774 1 1201 . 1 1 103 103 ALA HB1 H 1 1.367 0.005 . 1 . . 1312 . . 102 ALA HB1 . 26774 1 1202 . 1 1 103 103 ALA HB2 H 1 1.367 0.005 . 1 . . 1312 . . 102 ALA HB2 . 26774 1 1203 . 1 1 103 103 ALA HB3 H 1 1.367 0.005 . 1 . . 1312 . . 102 ALA HB3 . 26774 1 1204 . 1 1 103 103 ALA C C 13 178.149 . . 1 . . 1299 . . 102 ALA C . 26774 1 1205 . 1 1 103 103 ALA CA C 13 54.982 . . 1 . . 542 . . 102 ALA CA . 26774 1 1206 . 1 1 103 103 ALA CB C 13 18.548 . . 1 . . 608 . . 102 ALA CB . 26774 1 1207 . 1 1 103 103 ALA N N 15 124.182 0.164 . 1 . . 303 . . 102 ALA N . 26774 1 1208 . 1 1 104 104 ASP H H 1 8.585 0.016 . 1 . . 408 . . 103 ASP H . 26774 1 1209 . 1 1 104 104 ASP HA H 1 4.450 0.007 . 1 . . 1313 . . 103 ASP HA . 26774 1 1210 . 1 1 104 104 ASP HB2 H 1 2.676 0.009 . 2 . . 1314 . . 103 ASP HB2 . 26774 1 1211 . 1 1 104 104 ASP HB3 H 1 2.602 0.02 . 2 . . 1315 . . 103 ASP HB3 . 26774 1 1212 . 1 1 104 104 ASP C C 13 176.490 . . 1 . . 1310 . . 103 ASP C . 26774 1 1213 . 1 1 104 104 ASP CA C 13 54.525 . . 1 . . 766 . . 103 ASP CA . 26774 1 1214 . 1 1 104 104 ASP CB C 13 39.703 . . 1 . . 610 . . 103 ASP CB . 26774 1 1215 . 1 1 104 104 ASP N N 15 114.578 0.173 . 1 . . 409 . . 103 ASP N . 26774 1 1216 . 1 1 105 105 SER H H 1 7.854 0.014 . 1 . . 222 . . 104 SER H . 26774 1 1217 . 1 1 105 105 SER HA H 1 4.300 0.009 . 1 . . 1318 . . 104 SER HA . 26774 1 1218 . 1 1 105 105 SER HB2 H 1 3.777 . . 2 . . 1319 . . 104 SER HB2 . 26774 1 1219 . 1 1 105 105 SER HB3 H 1 3.740 0.002 . 2 . . 1320 . . 104 SER HB3 . 26774 1 1220 . 1 1 105 105 SER HG H 1 5.340 0.001 . 1 . . 1321 . . 104 SER HG . 26774 1 1221 . 1 1 105 105 SER C C 13 170.426 . . 1 . . 1317 . . 104 SER C . 26774 1 1222 . 1 1 105 105 SER CA C 13 58.978 . . 1 . . 367 . . 104 SER CA . 26774 1 1223 . 1 1 105 105 SER CB C 13 64.284 . . 1 . . 366 . . 104 SER CB . 26774 1 1224 . 1 1 105 105 SER N N 15 115.712 0.182 . 1 . . 223 . . 104 SER N . 26774 1 1225 . 1 1 106 106 TYR H H 1 7.412 0.02 . 1 . . 85 . . 105 TYR H . 26774 1 1226 . 1 1 106 106 TYR HA H 1 5.052 0.001 . 1 . . 1323 . . 105 TYR HA . 26774 1 1227 . 1 1 106 106 TYR HB2 H 1 2.540 0.016 . 2 . . 1324 . . 105 TYR HB2 . 26774 1 1228 . 1 1 106 106 TYR HB3 H 1 2.590 . . 2 . . 1325 . . 105 TYR HB3 . 26774 1 1229 . 1 1 106 106 TYR HD1 H 1 7.870 0.0 . 1 . . 2024 . . 105 TYR HD1 . 26774 1 1230 . 1 1 106 106 TYR HD2 H 1 7.870 0.0 . 1 . . 2024 . . 105 TYR HD2 . 26774 1 1231 . 1 1 106 106 TYR HE1 H 1 6.845 0.01 . 1 . . 2023 . . 105 TYR HE1 . 26774 1 1232 . 1 1 106 106 TYR HE2 H 1 6.845 0.01 . 1 . . 2023 . . 105 TYR HE2 . 26774 1 1233 . 1 1 106 106 TYR HH H 1 8.583 . . 1 . . 2026 . . 105 TYR HH . 26774 1 1234 . 1 1 106 106 TYR C C 13 175.703 . . 1 . . 1316 . . 105 TYR C . 26774 1 1235 . 1 1 106 106 TYR CA C 13 55.997 . . 1 . . 559 . . 105 TYR CA . 26774 1 1236 . 1 1 106 106 TYR CB C 13 42.184 . . 1 . . 560 . . 105 TYR CB . 26774 1 1237 . 1 1 106 106 TYR CD1 C 13 137.621 . . 1 . . 2025 . . 105 TYR CD1 . 26774 1 1238 . 1 1 106 106 TYR CD2 C 13 137.621 . . 1 . . 2025 . . 105 TYR CD2 . 26774 1 1239 . 1 1 106 106 TYR CE1 C 13 120.181 . . 1 . . 2027 . . 105 TYR CE1 . 26774 1 1240 . 1 1 106 106 TYR CE2 C 13 120.181 . . 1 . . 2027 . . 105 TYR CE2 . 26774 1 1241 . 1 1 106 106 TYR N N 15 116.790 0.295 . 1 . . 86 . . 105 TYR N . 26774 1 1242 . 1 1 107 107 ASP H H 1 8.643 0.009 . 1 . . 248 . . 106 ASP H . 26774 1 1243 . 1 1 107 107 ASP HA H 1 4.607 . . 1 . . 1328 . . 106 ASP HA . 26774 1 1244 . 1 1 107 107 ASP HB2 H 1 3.268 0.021 . 2 . . 1329 . . 106 ASP HB2 . 26774 1 1245 . 1 1 107 107 ASP HB3 H 1 2.518 0.003 . 2 . . 1330 . . 106 ASP HB3 . 26774 1 1246 . 1 1 107 107 ASP C C 13 178.379 . . 1 . . 1322 . . 106 ASP C . 26774 1 1247 . 1 1 107 107 ASP CA C 13 51.860 . . 1 . . 561 . . 106 ASP CA . 26774 1 1248 . 1 1 107 107 ASP CB C 13 41.059 . . 1 . . 562 . . 106 ASP CB . 26774 1 1249 . 1 1 107 107 ASP N N 15 120.966 0.156 . 1 . . 249 . . 106 ASP N . 26774 1 1250 . 1 1 108 108 GLU H H 1 8.789 0.011 . 1 . . 308 . . 107 GLU H . 26774 1 1251 . 1 1 108 108 GLU HA H 1 4.006 0.013 . 1 . . 1933 . . 107 GLU HA . 26774 1 1252 . 1 1 108 108 GLU HB2 H 1 2.002 . . 2 . . 1336 . . 107 GLU HB2 . 26774 1 1253 . 1 1 108 108 GLU HB3 H 1 1.992 0.016 . 2 . . 1932 . . 107 GLU HB3 . 26774 1 1254 . 1 1 108 108 GLU HG2 H 1 2.256 0.011 . 2 . . 1334 . . 107 GLU HG2 . 26774 1 1255 . 1 1 108 108 GLU HG3 H 1 2.474 0.011 . 2 . . 1931 . . 107 GLU HG3 . 26774 1 1256 . 1 1 108 108 GLU C C 13 177.435 . . 1 . . 1326 . . 107 GLU C . 26774 1 1257 . 1 1 108 108 GLU CA C 13 58.854 0.054 . 1 . . 563 . . 107 GLU CA . 26774 1 1258 . 1 1 108 108 GLU CB C 13 28.986 . . 1 . . 564 . . 107 GLU CB . 26774 1 1259 . 1 1 108 108 GLU CG C 13 36.473 . . 1 . . 1337 . . 107 GLU CG . 26774 1 1260 . 1 1 108 108 GLU N N 15 117.440 0.193 . 1 . . 309 . . 107 GLU N . 26774 1 1261 . 1 1 109 109 GLN H H 1 7.943 0.017 . 1 . . 185 . . 108 GLN H . 26774 1 1262 . 1 1 109 109 GLN HA H 1 4.343 . . 1 . . 1339 . . 108 GLN HA . 26774 1 1263 . 1 1 109 109 GLN HB2 H 1 1.939 0.003 . 2 . . 1342 . . 108 GLN HB2 . 26774 1 1264 . 1 1 109 109 GLN HB3 H 1 1.950 0.012 . 2 . . 1343 . . 108 GLN HB3 . 26774 1 1265 . 1 1 109 109 GLN HG2 H 1 2.273 0.008 . 2 . . 1340 . . 108 GLN HG2 . 26774 1 1266 . 1 1 109 109 GLN HG3 H 1 2.237 0.008 . 2 . . 1341 . . 108 GLN HG3 . 26774 1 1267 . 1 1 109 109 GLN HE21 H 1 7.489 0.022 . 1 . . 167 . . 108 GLN HE21 . 26774 1 1268 . 1 1 109 109 GLN HE22 H 1 6.750 0.018 . 1 . . 281 . . 108 GLN HE22 . 26774 1 1269 . 1 1 109 109 GLN C C 13 175.916 . . 1 . . 1331 . . 108 GLN C . 26774 1 1270 . 1 1 109 109 GLN CA C 13 55.571 . . 1 . . 531 . . 108 GLN CA . 26774 1 1271 . 1 1 109 109 GLN CB C 13 29.113 . . 1 . . 619 . . 108 GLN CB . 26774 1 1272 . 1 1 109 109 GLN CG C 13 34.588 . . 1 . . 746 . . 108 GLN CG . 26774 1 1273 . 1 1 109 109 GLN N N 15 117.217 0.217 . 1 . . 186 . . 108 GLN N . 26774 1 1274 . 1 1 109 109 GLN NE2 N 15 112.377 0.216 . 1 . . 168 . . 108 GLN NE2 . 26774 1 1275 . 1 1 110 110 GLY H H 1 8.088 0.011 . 1 . . 69 . . 109 GLY H . 26774 1 1276 . 1 1 110 110 GLY HA2 H 1 4.110 0.007 . 2 . . 1345 . . 109 GLY HA2 . 26774 1 1277 . 1 1 110 110 GLY HA3 H 1 3.527 0.009 . 2 . . 1346 . . 109 GLY HA3 . 26774 1 1278 . 1 1 110 110 GLY C C 13 174.384 . . 1 . . 1338 . . 109 GLY C . 26774 1 1279 . 1 1 110 110 GLY CA C 13 45.278 . . 1 . . 435 . . 109 GLY CA . 26774 1 1280 . 1 1 110 110 GLY N N 15 108.162 0.186 . 1 . . 70 . . 109 GLY N . 26774 1 1281 . 1 1 111 111 ASN H H 1 8.636 0.011 . 1 . . 175 . . 110 ASN H . 26774 1 1282 . 1 1 111 111 ASN HA H 1 4.690 0.019 . 1 . . 1347 . . 110 ASN HA . 26774 1 1283 . 1 1 111 111 ASN HB2 H 1 2.875 0.009 . 2 . . 1348 . . 110 ASN HB2 . 26774 1 1284 . 1 1 111 111 ASN HB3 H 1 2.514 0.015 . 2 . . 1349 . . 110 ASN HB3 . 26774 1 1285 . 1 1 111 111 ASN HD21 H 1 7.007 0.011 . 1 . . 45 . . 110 ASN HD21 . 26774 1 1286 . 1 1 111 111 ASN HD22 H 1 8.457 0.016 . 1 . . 1921 . . 110 ASN HD22 . 26774 1 1287 . 1 1 111 111 ASN C C 13 174.731 . . 1 . . 1344 . . 110 ASN C . 26774 1 1288 . 1 1 111 111 ASN CA C 13 52.945 . . 1 . . 520 . . 110 ASN CA . 26774 1 1289 . 1 1 111 111 ASN CB C 13 38.692 . . 1 . . 521 . . 110 ASN CB . 26774 1 1290 . 1 1 111 111 ASN N N 15 120.240 0.115 . 1 . . 176 . . 110 ASN N . 26774 1 1291 . 1 1 111 111 ASN ND2 N 15 118.515 0.077 . 1 . . 46 . . 110 ASN ND2 . 26774 1 1292 . 1 1 112 112 TYR H H 1 8.553 0.01 . 1 . . 246 . . 111 TYR H . 26774 1 1293 . 1 1 112 112 TYR HA H 1 3.915 0.0 . 1 . . 1350 . . 111 TYR HA . 26774 1 1294 . 1 1 112 112 TYR HB2 H 1 2.730 0.013 . 2 . . 1351 . . 111 TYR HB2 . 26774 1 1295 . 1 1 112 112 TYR HB3 H 1 2.273 . . 2 . . 1352 . . 111 TYR HB3 . 26774 1 1296 . 1 1 112 112 TYR HD1 H 1 7.775 0.001 . 1 . . 2028 . . 111 TYR HD1 . 26774 1 1297 . 1 1 112 112 TYR HD2 H 1 7.775 0.001 . 1 . . 2028 . . 111 TYR HD2 . 26774 1 1298 . 1 1 112 112 TYR HE1 H 1 6.817 0.0 . 1 . . 2030 . . 111 TYR HE1 . 26774 1 1299 . 1 1 112 112 TYR HE2 H 1 6.817 0.0 . 1 . . 2030 . . 111 TYR HE2 . 26774 1 1300 . 1 1 112 112 TYR HH H 1 9.019 . . 1 . . 2032 . . 111 TYR HH . 26774 1 1301 . 1 1 112 112 TYR C C 13 174.723 . . 1 . . 1631 . . 111 TYR C . 26774 1 1302 . 1 1 112 112 TYR CA C 13 58.321 . . 1 . . 522 . . 111 TYR CA . 26774 1 1303 . 1 1 112 112 TYR CB C 13 38.627 . . 1 . . 524 . . 111 TYR CB . 26774 1 1304 . 1 1 112 112 TYR CD1 C 13 137.651 . . 1 . . 2029 . . 111 TYR CD1 . 26774 1 1305 . 1 1 112 112 TYR CD2 C 13 137.651 . . 1 . . 2029 . . 111 TYR CD2 . 26774 1 1306 . 1 1 112 112 TYR CE1 C 13 118.976 . . 1 . . 2031 . . 111 TYR CE1 . 26774 1 1307 . 1 1 112 112 TYR CE2 C 13 118.976 . . 1 . . 2031 . . 111 TYR CE2 . 26774 1 1308 . 1 1 112 112 TYR N N 15 123.653 0.099 . 1 . . 247 . . 111 TYR N . 26774 1 1309 . 1 1 113 113 ILE H H 1 7.636 0.014 . 1 . . 113 . . 112 ILE H . 26774 1 1310 . 1 1 113 113 ILE HA H 1 3.701 0.014 . 1 . . 1355 . . 112 ILE HA . 26774 1 1311 . 1 1 113 113 ILE HB H 1 1.810 . . 1 . . 1356 . . 112 ILE HB . 26774 1 1312 . 1 1 113 113 ILE HG12 H 1 1.157 . . 2 . . 1357 . . 112 ILE HG12 . 26774 1 1313 . 1 1 113 113 ILE HG13 H 1 1.128 0.008 . 2 . . 1358 . . 112 ILE HG13 . 26774 1 1314 . 1 1 113 113 ILE HG21 H 1 0.603 0.012 . 1 . . 1360 . . 112 ILE HG21 . 26774 1 1315 . 1 1 113 113 ILE HG22 H 1 0.603 0.012 . 1 . . 1360 . . 112 ILE HG22 . 26774 1 1316 . 1 1 113 113 ILE HG23 H 1 0.603 0.012 . 1 . . 1360 . . 112 ILE HG23 . 26774 1 1317 . 1 1 113 113 ILE HD11 H 1 0.574 . . 1 . . 1359 . . 112 ILE HD11 . 26774 1 1318 . 1 1 113 113 ILE HD12 H 1 0.574 . . 1 . . 1359 . . 112 ILE HD12 . 26774 1 1319 . 1 1 113 113 ILE HD13 H 1 0.574 . . 1 . . 1359 . . 112 ILE HD13 . 26774 1 1320 . 1 1 113 113 ILE C C 13 174.280 . . 1 . . 1354 . . 112 ILE C . 26774 1 1321 . 1 1 113 113 ILE CA C 13 59.447 0.053 . 1 . . 525 . . 112 ILE CA . 26774 1 1322 . 1 1 113 113 ILE CB C 13 38.662 . . 1 . . 526 . . 112 ILE CB . 26774 1 1323 . 1 1 113 113 ILE CG1 C 13 26.544 . . 1 . . 1361 . . 112 ILE CG1 . 26774 1 1324 . 1 1 113 113 ILE CG2 C 13 17.147 . . 1 . . 1362 . . 112 ILE CG2 . 26774 1 1325 . 1 1 113 113 ILE CD1 C 13 13.200 . . 1 . . 1363 . . 112 ILE CD1 . 26774 1 1326 . 1 1 113 113 ILE N N 15 129.526 0.166 . 1 . . 114 . . 112 ILE N . 26774 1 1327 . 1 1 114 114 PHE H H 1 7.812 0.016 . 1 . . 81 . . 113 PHE H . 26774 1 1328 . 1 1 114 114 PHE HA H 1 3.964 . . 1 . . 1364 . . 113 PHE HA . 26774 1 1329 . 1 1 114 114 PHE HB2 H 1 2.502 . . 2 . . 1365 . . 113 PHE HB2 . 26774 1 1330 . 1 1 114 114 PHE HB3 H 1 2.274 . . 2 . . 1366 . . 113 PHE HB3 . 26774 1 1331 . 1 1 114 114 PHE HD1 H 1 6.831 0.01 . 1 . . 2088 . . 113 PHE HD1 . 26774 1 1332 . 1 1 114 114 PHE HD2 H 1 6.831 0.01 . 1 . . 2088 . . 113 PHE HD2 . 26774 1 1333 . 1 1 114 114 PHE C C 13 173.909 . . 1 . . 1353 . . 113 PHE C . 26774 1 1334 . 1 1 114 114 PHE CA C 13 56.907 . . 1 . . 451 . . 113 PHE CA . 26774 1 1335 . 1 1 114 114 PHE CB C 13 38.286 . . 1 . . 611 . . 113 PHE CB . 26774 1 1336 . 1 1 114 114 PHE CD1 C 13 133.499 . . 1 . . 2089 . . 113 PHE CD1 . 26774 1 1337 . 1 1 114 114 PHE CD2 C 13 133.499 . . 1 . . 2089 . . 113 PHE CD2 . 26774 1 1338 . 1 1 114 114 PHE N N 15 125.068 0.187 . 1 . . 82 . . 113 PHE N . 26774 1 1339 . 1 1 115 115 PRO HA H 1 4.231 0.001 . 1 . . 1371 . . 114 PRO HA . 26774 1 1340 . 1 1 115 115 PRO HB2 H 1 2.454 . . 2 . . 1374 . . 114 PRO HB2 . 26774 1 1341 . 1 1 115 115 PRO HB3 H 1 2.070 . . 2 . . 1375 . . 114 PRO HB3 . 26774 1 1342 . 1 1 115 115 PRO HG2 H 1 1.690 . . 2 . . 1376 . . 114 PRO HG2 . 26774 1 1343 . 1 1 115 115 PRO HG3 H 1 1.654 0.011 . 2 . . 1377 . . 114 PRO HG3 . 26774 1 1344 . 1 1 115 115 PRO HD2 H 1 3.719 . . 2 . . 1372 . . 114 PRO HD2 . 26774 1 1345 . 1 1 115 115 PRO HD3 H 1 3.275 . . 2 . . 1373 . . 114 PRO HD3 . 26774 1 1346 . 1 1 115 115 PRO C C 13 176.291 . . 1 . . 1369 . . 114 PRO C . 26774 1 1347 . 1 1 115 115 PRO CA C 13 62.129 . . 1 . . 1367 . . 114 PRO CA . 26774 1 1348 . 1 1 115 115 PRO CB C 13 32.084 . . 1 . . 1368 . . 114 PRO CB . 26774 1 1349 . 1 1 115 115 PRO CG C 13 26.228 . . 1 . . 1378 . . 114 PRO CG . 26774 1 1350 . 1 1 116 116 GLU H H 1 8.236 0.013 . 1 . . 195 . . 115 GLU H . 26774 1 1351 . 1 1 116 116 GLU HA H 1 3.818 . . 1 . . 944 . . 115 GLU HA . 26774 1 1352 . 1 1 116 116 GLU HB2 H 1 1.933 . . 2 . . 941 . . 115 GLU HB2 . 26774 1 1353 . 1 1 116 116 GLU HB3 H 1 2.109 . . 2 . . 943 . . 115 GLU HB3 . 26774 1 1354 . 1 1 116 116 GLU HG2 H 1 2.130 0.001 . 2 . . 940 . . 115 GLU HG2 . 26774 1 1355 . 1 1 116 116 GLU HG3 H 1 1.886 . . 2 . . 942 . . 115 GLU HG3 . 26774 1 1356 . 1 1 116 116 GLU C C 13 175.837 . . 1 . . 1370 . . 115 GLU C . 26774 1 1357 . 1 1 116 116 GLU CA C 13 58.015 . . 1 . . 353 . . 115 GLU CA . 26774 1 1358 . 1 1 116 116 GLU CB C 13 29.581 . . 1 . . 859 . . 115 GLU CB . 26774 1 1359 . 1 1 116 116 GLU CG C 13 36.357 . . 1 . . 939 . . 115 GLU CG . 26774 1 1360 . 1 1 116 116 GLU N N 15 122.941 0.137 . 1 . . 196 . . 115 GLU N . 26774 1 1361 . 1 1 117 117 GLY H H 1 8.102 0.006 . 1 . . 27 . . 116 GLY H . 26774 1 1362 . 1 1 117 117 GLY HA2 H 1 3.604 . . 2 . . 1384 . . 116 GLY HA2 . 26774 1 1363 . 1 1 117 117 GLY HA3 H 1 3.884 . . 2 . . 1385 . . 116 GLY HA3 . 26774 1 1364 . 1 1 117 117 GLY C C 13 170.908 . . 1 . . 1382 . . 116 GLY C . 26774 1 1365 . 1 1 117 117 GLY CA C 13 44.097 . . 1 . . 643 . . 116 GLY CA . 26774 1 1366 . 1 1 117 117 GLY N N 15 111.433 0.09 . 1 . . 28 . . 116 GLY N . 26774 1 1367 . 1 1 118 118 PHE H H 1 7.208 0.019 . 1 . . 133 . . 117 PHE H . 26774 1 1368 . 1 1 118 118 PHE HA H 1 3.637 0.002 . 1 . . 1387 . . 117 PHE HA . 26774 1 1369 . 1 1 118 118 PHE HB2 H 1 2.168 . . 2 . . 1388 . . 117 PHE HB2 . 26774 1 1370 . 1 1 118 118 PHE HB3 H 1 2.591 . . 2 . . 1389 . . 117 PHE HB3 . 26774 1 1371 . 1 1 118 118 PHE HD1 H 1 6.546 0.0 . 1 . . 2090 . . 117 PHE HD1 . 26774 1 1372 . 1 1 118 118 PHE HD2 H 1 6.546 0.0 . 1 . . 2090 . . 117 PHE HD2 . 26774 1 1373 . 1 1 118 118 PHE HE1 H 1 7.050 0.017 . 1 . . 2093 . . 117 PHE HE1 . 26774 1 1374 . 1 1 118 118 PHE HE2 H 1 7.050 0.017 . 1 . . 2093 . . 117 PHE HE2 . 26774 1 1375 . 1 1 118 118 PHE HZ H 1 7.105 0.0 . 1 . . 2096 . . 117 PHE HZ . 26774 1 1376 . 1 1 118 118 PHE C C 13 173.564 . . 1 . . 1383 . . 117 PHE C . 26774 1 1377 . 1 1 118 118 PHE CA C 13 56.396 . . 1 . . 508 . . 117 PHE CA . 26774 1 1378 . 1 1 118 118 PHE CB C 13 40.378 . . 1 . . 509 . . 117 PHE CB . 26774 1 1379 . 1 1 118 118 PHE CD1 C 13 130.707 . . 1 . . 2095 . . 117 PHE CD1 . 26774 1 1380 . 1 1 118 118 PHE CD2 C 13 130.707 . . 1 . . 2095 . . 117 PHE CD2 . 26774 1 1381 . 1 1 118 118 PHE CE1 C 13 132.944 . . 1 . . 2094 . . 117 PHE CE1 . 26774 1 1382 . 1 1 118 118 PHE CE2 C 13 132.944 . . 1 . . 2094 . . 117 PHE CE2 . 26774 1 1383 . 1 1 118 118 PHE CZ C 13 132.094 . . 1 . . 2097 . . 117 PHE CZ . 26774 1 1384 . 1 1 118 118 PHE N N 15 120.506 0.151 . 1 . . 134 . . 117 PHE N . 26774 1 1385 . 1 1 119 119 ASP H H 1 7.612 0.016 . 1 . . 21 . . 118 ASP H . 26774 1 1386 . 1 1 119 119 ASP HA H 1 4.196 0.01 . 1 . . 1391 . . 118 ASP HA . 26774 1 1387 . 1 1 119 119 ASP HB2 H 1 1.869 0.015 . 2 . . 1392 . . 118 ASP HB2 . 26774 1 1388 . 1 1 119 119 ASP HB3 H 1 2.650 0.01 . 2 . . 1393 . . 118 ASP HB3 . 26774 1 1389 . 1 1 119 119 ASP C C 13 174.547 . . 1 . . 1386 . . 118 ASP C . 26774 1 1390 . 1 1 119 119 ASP CA C 13 52.084 . . 1 . . 510 . . 118 ASP CA . 26774 1 1391 . 1 1 119 119 ASP CB C 13 41.668 . . 1 . . 511 . . 118 ASP CB . 26774 1 1392 . 1 1 119 119 ASP N N 15 127.914 0.194 . 1 . . 22 . . 118 ASP N . 26774 1 1393 . 1 1 120 120 ALA H H 1 8.094 0.013 . 1 . . 5 . . 119 ALA H . 26774 1 1394 . 1 1 120 120 ALA HA H 1 3.280 0.009 . 1 . . 1395 . . 119 ALA HA . 26774 1 1395 . 1 1 120 120 ALA HB1 H 1 0.525 0.019 . 1 . . 1396 . . 119 ALA HB1 . 26774 1 1396 . 1 1 120 120 ALA HB2 H 1 0.525 0.019 . 1 . . 1396 . . 119 ALA HB2 . 26774 1 1397 . 1 1 120 120 ALA HB3 H 1 0.525 0.019 . 1 . . 1396 . . 119 ALA HB3 . 26774 1 1398 . 1 1 120 120 ALA C C 13 178.725 . . 1 . . 1390 . . 119 ALA C . 26774 1 1399 . 1 1 120 120 ALA CA C 13 53.715 . . 1 . . 491 . . 119 ALA CA . 26774 1 1400 . 1 1 120 120 ALA CB C 13 17.985 . . 1 . . 512 . . 119 ALA CB . 26774 1 1401 . 1 1 120 120 ALA N N 15 127.822 0.158 . 1 . . 6 . . 119 ALA N . 26774 1 1402 . 1 1 121 121 GLU H H 1 7.972 0.018 . 1 . . 29 . . 120 GLU H . 26774 1 1403 . 1 1 121 121 GLU HA H 1 3.885 . . 1 . . 1398 . . 120 GLU HA . 26774 1 1404 . 1 1 121 121 GLU HB2 H 1 2.008 0.002 . 2 . . 1401 . . 120 GLU HB2 . 26774 1 1405 . 1 1 121 121 GLU HB3 H 1 1.922 0.005 . 2 . . 1402 . . 120 GLU HB3 . 26774 1 1406 . 1 1 121 121 GLU HG2 H 1 2.119 0.012 . 2 . . 1399 . . 120 GLU HG2 . 26774 1 1407 . 1 1 121 121 GLU HG3 H 1 2.366 . . 2 . . 1400 . . 120 GLU HG3 . 26774 1 1408 . 1 1 121 121 GLU C C 13 178.183 . . 1 . . 1394 . . 120 GLU C . 26774 1 1409 . 1 1 121 121 GLU CA C 13 58.581 . . 1 . . 497 . . 120 GLU CA . 26774 1 1410 . 1 1 121 121 GLU CB C 13 29.422 . . 1 . . 765 . . 120 GLU CB . 26774 1 1411 . 1 1 121 121 GLU CG C 13 36.193 . . 1 . . 762 . . 120 GLU CG . 26774 1 1412 . 1 1 121 121 GLU N N 15 115.709 0.209 . 1 . . 30 . . 120 GLU N . 26774 1 1413 . 1 1 122 122 THR H H 1 6.989 0.017 . 1 . . 251 . . 121 THR H . 26774 1 1414 . 1 1 122 122 THR HA H 1 4.059 0.005 . 1 . . 1404 . . 121 THR HA . 26774 1 1415 . 1 1 122 122 THR HB H 1 3.417 . . 1 . . 1405 . . 121 THR HB . 26774 1 1416 . 1 1 122 122 THR HG1 H 1 4.443 . . 1 . . 1406 . . 121 THR HG1 . 26774 1 1417 . 1 1 122 122 THR HG21 H 1 1.245 . . 1 . . 1407 . . 121 THR HG21 . 26774 1 1418 . 1 1 122 122 THR HG22 H 1 1.245 . . 1 . . 1407 . . 121 THR HG22 . 26774 1 1419 . 1 1 122 122 THR HG23 H 1 1.245 . . 1 . . 1407 . . 121 THR HG23 . 26774 1 1420 . 1 1 122 122 THR C C 13 175.003 . . 1 . . 1397 . . 121 THR C . 26774 1 1421 . 1 1 122 122 THR CA C 13 61.121 0.001 . 1 . . 414 . . 121 THR CA . 26774 1 1422 . 1 1 122 122 THR CB C 13 69.802 . . 1 . . 413 . . 121 THR CB . 26774 1 1423 . 1 1 122 122 THR CG2 C 13 22.258 . . 1 . . 1408 . . 121 THR CG2 . 26774 1 1424 . 1 1 122 122 THR N N 15 106.466 0.137 . 1 . . 252 . . 121 THR N . 26774 1 1425 . 1 1 123 123 ASN H H 1 7.862 0.015 . 1 . . 555 . . 122 ASN H . 26774 1 1426 . 1 1 123 123 ASN HA H 1 3.795 0.008 . 1 . . 1045 . . 122 ASN HA . 26774 1 1427 . 1 1 123 123 ASN HB2 H 1 3.083 0.005 . 2 . . 1046 . . 122 ASN HB2 . 26774 1 1428 . 1 1 123 123 ASN HB3 H 1 2.484 . . 2 . . 1047 . . 122 ASN HB3 . 26774 1 1429 . 1 1 123 123 ASN HD21 H 1 6.786 0.017 . 1 . . 111 . . 122 ASN HD21 . 26774 1 1430 . 1 1 123 123 ASN C C 13 173.360 . . 1 . . 1403 . . 122 ASN C . 26774 1 1431 . 1 1 123 123 ASN CA C 13 54.295 . . 1 . . 668 . . 122 ASN CA . 26774 1 1432 . 1 1 123 123 ASN CB C 13 37.697 . . 1 . . 669 . . 122 ASN CB . 26774 1 1433 . 1 1 123 123 ASN N N 15 119.891 0.098 . 1 . . 556 . . 122 ASN N . 26774 1 1434 . 1 1 123 123 ASN ND2 N 15 112.335 0.175 . 1 . . 112 . . 122 ASN ND2 . 26774 1 1435 . 1 1 124 124 GLU H H 1 6.611 0.019 . 1 . . 67 . . 123 GLU H . 26774 1 1436 . 1 1 124 124 GLU HA H 1 4.450 0.002 . 1 . . 1411 . . 123 GLU HA . 26774 1 1437 . 1 1 124 124 GLU HB2 H 1 2.084 0.003 . 2 . . 1414 . . 123 GLU HB2 . 26774 1 1438 . 1 1 124 124 GLU HB3 H 1 2.042 . . 2 . . 1415 . . 123 GLU HB3 . 26774 1 1439 . 1 1 124 124 GLU HG2 H 1 2.546 0.009 . 2 . . 1412 . . 123 GLU HG2 . 26774 1 1440 . 1 1 124 124 GLU HG3 H 1 2.262 . . 2 . . 1413 . . 123 GLU HG3 . 26774 1 1441 . 1 1 124 124 GLU C C 13 174.522 . . 1 . . 1409 . . 123 GLU C . 26774 1 1442 . 1 1 124 124 GLU CA C 13 54.185 0.019 . 1 . . 671 . . 123 GLU CA . 26774 1 1443 . 1 1 124 124 GLU CB C 13 33.642 . . 1 . . 672 . . 123 GLU CB . 26774 1 1444 . 1 1 124 124 GLU CG C 13 35.409 . . 1 . . 1417 . . 123 GLU CG . 26774 1 1445 . 1 1 124 124 GLU N N 15 115.424 0.167 . 1 . . 68 . . 123 GLU N . 26774 1 1446 . 1 1 125 125 TRP H H 1 8.663 0.01 . 1 . . 570 . . 124 TRP H . 26774 1 1447 . 1 1 125 125 TRP HA H 1 4.467 . . 1 . . 1048 . . 124 TRP HA . 26774 1 1448 . 1 1 125 125 TRP HB2 H 1 3.197 0.007 . 2 . . 1049 . . 124 TRP HB2 . 26774 1 1449 . 1 1 125 125 TRP HB3 H 1 2.938 . . 2 . . 1050 . . 124 TRP HB3 . 26774 1 1450 . 1 1 125 125 TRP HD1 H 1 7.244 0.006 . 1 . . 1993 . . 124 TRP HD1 . 26774 1 1451 . 1 1 125 125 TRP HE1 H 1 9.906 0.017 . 1 . . 65 . . 124 TRP HE1 . 26774 1 1452 . 1 1 125 125 TRP HE3 H 1 7.290 0.009 . 1 . . 1925 . . 124 TRP HE3 . 26774 1 1453 . 1 1 125 125 TRP HZ3 H 1 6.548 . . 1 . . 2006 . . 124 TRP HZ3 . 26774 1 1454 . 1 1 125 125 TRP HH2 H 1 6.783 0.001 . 1 . . 2000 . . 124 TRP HH2 . 26774 1 1455 . 1 1 125 125 TRP C C 13 177.304 . . 1 . . 1410 . . 124 TRP C . 26774 1 1456 . 1 1 125 125 TRP CA C 13 57.583 . . 1 . . 673 . . 124 TRP CA . 26774 1 1457 . 1 1 125 125 TRP CB C 13 29.538 . . 1 . . 674 . . 124 TRP CB . 26774 1 1458 . 1 1 125 125 TRP CD1 C 13 126.646 . . 1 . . 2014 . . 124 TRP CD1 . 26774 1 1459 . 1 1 125 125 TRP CD2 C 13 122.506 . . 1 . . 2001 . . 124 TRP CD2 . 26774 1 1460 . 1 1 125 125 TRP CE2 C 13 136.722 . . 1 . . 1997 . . 124 TRP CE2 . 26774 1 1461 . 1 1 125 125 TRP CE3 C 13 122.469 . . 1 . . 2117 . . 124 TRP CE3 . 26774 1 1462 . 1 1 125 125 TRP CH2 C 13 130.943 . . 1 . . 2007 . . 124 TRP CH2 . 26774 1 1463 . 1 1 125 125 TRP N N 15 121.764 0.103 . 1 . . 571 . . 124 TRP N . 26774 1 1464 . 1 1 125 125 TRP NE1 N 15 128.792 0.178 . 1 . . 66 . . 124 TRP NE1 . 26774 1 1465 . 1 1 126 126 LEU H H 1 8.968 0.007 . 1 . . 253 . . 125 LEU H . 26774 1 1466 . 1 1 126 126 LEU HA H 1 4.359 0.002 . 1 . . 1418 . . 125 LEU HA . 26774 1 1467 . 1 1 126 126 LEU HB2 H 1 1.715 . . 2 . . 1419 . . 125 LEU HB2 . 26774 1 1468 . 1 1 126 126 LEU HB3 H 1 1.610 . . 2 . . 1420 . . 125 LEU HB3 . 26774 1 1469 . 1 1 126 126 LEU HG H 1 1.573 . . 1 . . 1421 . . 125 LEU HG . 26774 1 1470 . 1 1 126 126 LEU HD11 H 1 1.052 . . 2 . . 1422 . . 125 LEU HD11 . 26774 1 1471 . 1 1 126 126 LEU HD12 H 1 1.052 . . 2 . . 1422 . . 125 LEU HD12 . 26774 1 1472 . 1 1 126 126 LEU HD13 H 1 1.052 . . 2 . . 1422 . . 125 LEU HD13 . 26774 1 1473 . 1 1 126 126 LEU HD21 H 1 1.229 . . 2 . . 1423 . . 125 LEU HD21 . 26774 1 1474 . 1 1 126 126 LEU HD22 H 1 1.229 . . 2 . . 1423 . . 125 LEU HD22 . 26774 1 1475 . 1 1 126 126 LEU HD23 H 1 1.229 . . 2 . . 1423 . . 125 LEU HD23 . 26774 1 1476 . 1 1 126 126 LEU C C 13 172.136 . . 1 . . 1430 . . 125 LEU C . 26774 1 1477 . 1 1 126 126 LEU CA C 13 54.397 0.1 . 1 . . 467 . . 125 LEU CA . 26774 1 1478 . 1 1 126 126 LEU CB C 13 43.062 . . 1 . . 494 . . 125 LEU CB . 26774 1 1479 . 1 1 126 126 LEU CG C 13 29.038 . . 1 . . 1428 . . 125 LEU CG . 26774 1 1480 . 1 1 126 126 LEU CD1 C 13 25.782 . . 1 . . 1426 . . 125 LEU CD1 . 26774 1 1481 . 1 1 126 126 LEU N N 15 124.342 0.131 . 1 . . 254 . . 125 LEU N . 26774 1 1482 . 1 1 127 127 GLU H H 1 8.630 0.011 . 1 . . 677 . . 126 GLU H . 26774 1 1483 . 1 1 127 127 GLU HA H 1 4.139 . . 1 . . 1434 . . 126 GLU HA . 26774 1 1484 . 1 1 127 127 GLU HB2 H 1 1.958 0.007 . 2 . . 1437 . . 126 GLU HB2 . 26774 1 1485 . 1 1 127 127 GLU HB3 H 1 1.997 . . 2 . . 1438 . . 126 GLU HB3 . 26774 1 1486 . 1 1 127 127 GLU HG2 H 1 2.281 0.006 . 2 . . 1435 . . 126 GLU HG2 . 26774 1 1487 . 1 1 127 127 GLU HG3 H 1 2.314 . . 2 . . 1436 . . 126 GLU HG3 . 26774 1 1488 . 1 1 127 127 GLU C C 13 177.188 . . 1 . . 1433 . . 126 GLU C . 26774 1 1489 . 1 1 127 127 GLU CA C 13 58.743 . . 1 . . 679 . . 126 GLU CA . 26774 1 1490 . 1 1 127 127 GLU CB C 13 29.829 . . 1 . . 773 . . 126 GLU CB . 26774 1 1491 . 1 1 127 127 GLU CG C 13 36.466 . . 1 . . 1439 . . 126 GLU CG . 26774 1 1492 . 1 1 127 127 GLU N N 15 123.348 0.173 . 1 . . 678 . . 126 GLU N . 26774 1 1493 . 1 1 128 128 GLY H H 1 9.315 0.009 . 1 . . 13 . . 127 GLY H . 26774 1 1494 . 1 1 128 128 GLY HA2 H 1 4.127 . . 2 . . 1444 . . 127 GLY HA2 . 26774 1 1495 . 1 1 128 128 GLY HA3 H 1 3.750 0.017 . 2 . . 1445 . . 127 GLY HA3 . 26774 1 1496 . 1 1 128 128 GLY C C 13 175.783 . . 1 . . 1442 . . 127 GLY C . 26774 1 1497 . 1 1 128 128 GLY CA C 13 45.123 . . 1 . . 535 . . 127 GLY CA . 26774 1 1498 . 1 1 128 128 GLY N N 15 113.488 0.106 . 1 . . 14 . . 127 GLY N . 26774 1 1499 . 1 1 129 129 PHE H H 1 7.667 0.017 . 1 . . 39 . . 128 PHE H . 26774 1 1500 . 1 1 129 129 PHE HA H 1 5.021 0.022 . 1 . . 1447 . . 128 PHE HA . 26774 1 1501 . 1 1 129 129 PHE HB2 H 1 3.330 . . 2 . . 1448 . . 128 PHE HB2 . 26774 1 1502 . 1 1 129 129 PHE HB3 H 1 3.156 0.003 . 2 . . 1449 . . 128 PHE HB3 . 26774 1 1503 . 1 1 129 129 PHE HD1 H 1 7.049 0.012 . 1 . . 2098 . . 128 PHE HD1 . 26774 1 1504 . 1 1 129 129 PHE HD2 H 1 7.049 0.012 . 1 . . 2098 . . 128 PHE HD2 . 26774 1 1505 . 1 1 129 129 PHE HE1 H 1 7.207 0.0 . 1 . . 2099 . . 128 PHE HE1 . 26774 1 1506 . 1 1 129 129 PHE HE2 H 1 7.207 0.0 . 1 . . 2099 . . 128 PHE HE2 . 26774 1 1507 . 1 1 129 129 PHE HZ H 1 7.286 0.019 . 1 . . 2100 . . 128 PHE HZ . 26774 1 1508 . 1 1 129 129 PHE C C 13 175.524 . . 1 . . 1441 . . 128 PHE C . 26774 1 1509 . 1 1 129 129 PHE CA C 13 57.445 . . 1 . . 647 . . 128 PHE CA . 26774 1 1510 . 1 1 129 129 PHE CB C 13 37.658 . . 1 . . 648 . . 128 PHE CB . 26774 1 1511 . 1 1 129 129 PHE CD1 C 13 132.198 . . 1 . . 2103 . . 128 PHE CD1 . 26774 1 1512 . 1 1 129 129 PHE CD2 C 13 132.198 . . 1 . . 2103 . . 128 PHE CD2 . 26774 1 1513 . 1 1 129 129 PHE CE1 C 13 130.908 . . 1 . . 2102 . . 128 PHE CE1 . 26774 1 1514 . 1 1 129 129 PHE CE2 C 13 130.908 . . 1 . . 2102 . . 128 PHE CE2 . 26774 1 1515 . 1 1 129 129 PHE CZ C 13 129.886 . . 1 . . 2101 . . 128 PHE CZ . 26774 1 1516 . 1 1 129 129 PHE N N 15 119.874 0.06 . 1 . . 40 . . 128 PHE N . 26774 1 1517 . 1 1 130 130 GLU H H 1 8.735 0.012 . 1 . . 314 . . 129 GLU H . 26774 1 1518 . 1 1 130 130 GLU HA H 1 3.684 0.009 . 1 . . 1451 . . 129 GLU HA . 26774 1 1519 . 1 1 130 130 GLU HB2 H 1 1.875 . . 2 . . 1454 . . 129 GLU HB2 . 26774 1 1520 . 1 1 130 130 GLU HB3 H 1 1.680 . . 2 . . 1455 . . 129 GLU HB3 . 26774 1 1521 . 1 1 130 130 GLU HG2 H 1 2.515 0.018 . 2 . . 1452 . . 129 GLU HG2 . 26774 1 1522 . 1 1 130 130 GLU HG3 H 1 2.363 . . 2 . . 1453 . . 129 GLU HG3 . 26774 1 1523 . 1 1 130 130 GLU C C 13 179.822 . . 1 . . 1446 . . 129 GLU C . 26774 1 1524 . 1 1 130 130 GLU CA C 13 61.667 . . 1 . . 649 . . 129 GLU CA . 26774 1 1525 . 1 1 130 130 GLU CB C 13 28.260 . . 1 . . 650 . . 129 GLU CB . 26774 1 1526 . 1 1 130 130 GLU CG C 13 37.450 . . 1 . . 1456 . . 129 GLU CG . 26774 1 1527 . 1 1 130 130 GLU N N 15 120.961 0.139 . 1 . . 315 . . 129 GLU N . 26774 1 1528 . 1 1 131 131 LYS H H 1 8.757 0.016 . 1 . . 9 . . 130 LYS H . 26774 1 1529 . 1 1 131 131 LYS HA H 1 3.987 0.005 . 1 . . 1458 . . 130 LYS HA . 26774 1 1530 . 1 1 131 131 LYS HB2 H 1 1.738 0.002 . 2 . . 1459 . . 130 LYS HB2 . 26774 1 1531 . 1 1 131 131 LYS HB3 H 1 1.791 0.011 . 2 . . 1461 . . 130 LYS HB3 . 26774 1 1532 . 1 1 131 131 LYS HG2 H 1 1.176 . . 2 . . 1464 . . 130 LYS HG2 . 26774 1 1533 . 1 1 131 131 LYS HG3 H 1 1.284 . . 2 . . 1465 . . 130 LYS HG3 . 26774 1 1534 . 1 1 131 131 LYS HD2 H 1 1.638 0.001 . 2 . . 1462 . . 130 LYS HD2 . 26774 1 1535 . 1 1 131 131 LYS HD3 H 1 1.460 . . 2 . . 1463 . . 130 LYS HD3 . 26774 1 1536 . 1 1 131 131 LYS HE2 H 1 2.967 . . 2 . . 1466 . . 130 LYS HE2 . 26774 1 1537 . 1 1 131 131 LYS HE3 H 1 3.536 . . 2 . . 1467 . . 130 LYS HE3 . 26774 1 1538 . 1 1 131 131 LYS C C 13 178.534 . . 1 . . 1450 . . 130 LYS C . 26774 1 1539 . 1 1 131 131 LYS CA C 13 59.548 0.055 . 1 . . 651 . . 130 LYS CA . 26774 1 1540 . 1 1 131 131 LYS CB C 13 31.811 . . 1 . . 652 . . 130 LYS CB . 26774 1 1541 . 1 1 131 131 LYS CG C 13 24.973 . . 1 . . 1469 . . 130 LYS CG . 26774 1 1542 . 1 1 131 131 LYS CD C 13 27.787 . . 1 . . 1468 . . 130 LYS CD . 26774 1 1543 . 1 1 131 131 LYS CE C 13 42.004 . . 1 . . 1470 . . 130 LYS CE . 26774 1 1544 . 1 1 131 131 LYS N N 15 121.497 0.036 . 1 . . 10 . . 130 LYS N . 26774 1 1545 . 1 1 132 132 GLN H H 1 8.657 0.011 . 1 . . 316 . . 131 GLN H . 26774 1 1546 . 1 1 132 132 GLN HA H 1 4.008 0.018 . 1 . . 1474 . . 131 GLN HA . 26774 1 1547 . 1 1 132 132 GLN HB2 H 1 2.115 . . 2 . . 1477 . . 131 GLN HB2 . 26774 1 1548 . 1 1 132 132 GLN HB3 H 1 2.018 0.015 . 2 . . 1478 . . 131 GLN HB3 . 26774 1 1549 . 1 1 132 132 GLN HG2 H 1 2.441 . . 2 . . 1475 . . 131 GLN HG2 . 26774 1 1550 . 1 1 132 132 GLN HG3 H 1 2.254 . . 2 . . 1476 . . 131 GLN HG3 . 26774 1 1551 . 1 1 132 132 GLN HE21 H 1 7.745 0.013 . 1 . . 7 . . 131 GLN HE21 . 26774 1 1552 . 1 1 132 132 GLN HE22 H 1 7.244 0.031 . 1 . . 177 . . 131 GLN HE22 . 26774 1 1553 . 1 1 132 132 GLN C C 13 179.188 . . 1 . . 1457 . . 131 GLN C . 26774 1 1554 . 1 1 132 132 GLN CA C 13 60.562 0.064 . 1 . . 598 . . 131 GLN CA . 26774 1 1555 . 1 1 132 132 GLN CB C 13 26.969 . . 1 . . 599 . . 131 GLN CB . 26774 1 1556 . 1 1 132 132 GLN CG C 13 36.748 . . 1 . . 1479 . . 131 GLN CG . 26774 1 1557 . 1 1 132 132 GLN N N 15 114.975 0.235 . 1 . . 178 . . 131 GLN N . 26774 1 1558 . 1 1 132 132 GLN NE2 N 15 114.912 0.177 . 1 . . 8 . . 131 GLN NE2 . 26774 1 1559 . 1 1 133 133 ARG H H 1 8.257 0.016 . 1 . . 216 . . 132 ARG H . 26774 1 1560 . 1 1 133 133 ARG HA H 1 3.788 . . 1 . . 2189 . . 132 ARG HA . 26774 1 1561 . 1 1 133 133 ARG HB2 H 1 1.871 . . 2 . . 2187 . . 132 ARG HB2 . 26774 1 1562 . 1 1 133 133 ARG HB3 H 1 1.982 . . 2 . . 2188 . . 132 ARG HB3 . 26774 1 1563 . 1 1 133 133 ARG HG2 H 1 1.276 . . 2 . . 2183 . . 132 ARG HG2 . 26774 1 1564 . 1 1 133 133 ARG HG3 H 1 1.388 0.013 . 2 . . 2184 . . 132 ARG HG3 . 26774 1 1565 . 1 1 133 133 ARG HD2 H 1 2.892 0.005 . 2 . . 2185 . . 132 ARG HD2 . 26774 1 1566 . 1 1 133 133 ARG HD3 H 1 3.097 . . 2 . . 2186 . . 132 ARG HD3 . 26774 1 1567 . 1 1 133 133 ARG C C 13 177.284 . . 1 . . 1473 . . 132 ARG C . 26774 1 1568 . 1 1 133 133 ARG CA C 13 58.681 . . 1 . . 1471 . . 132 ARG CA . 26774 1 1569 . 1 1 133 133 ARG CB C 13 29.551 . . 1 . . 1472 . . 132 ARG CB . 26774 1 1570 . 1 1 133 133 ARG N N 15 122.452 0.15 . 1 . . 217 . . 132 ARG N . 26774 1 1571 . 1 1 134 134 ALA H H 1 7.605 0.017 . 1 . . 95 . . 133 ALA H . 26774 1 1572 . 1 1 134 134 ALA HA H 1 4.011 0.004 . 1 . . 1861 . . 133 ALA HA . 26774 1 1573 . 1 1 134 134 ALA HB1 H 1 1.426 0.007 . 1 . . 1862 . . 133 ALA HB1 . 26774 1 1574 . 1 1 134 134 ALA HB2 H 1 1.426 0.007 . 1 . . 1862 . . 133 ALA HB2 . 26774 1 1575 . 1 1 134 134 ALA HB3 H 1 1.426 0.007 . 1 . . 1862 . . 133 ALA HB3 . 26774 1 1576 . 1 1 134 134 ALA C C 13 181.382 . . 1 . . 1481 . . 133 ALA C . 26774 1 1577 . 1 1 134 134 ALA CA C 13 54.749 . . 1 . . 629 . . 133 ALA CA . 26774 1 1578 . 1 1 134 134 ALA CB C 13 17.803 . . 1 . . 630 . . 133 ALA CB . 26774 1 1579 . 1 1 134 134 ALA N N 15 120.036 0.112 . 1 . . 96 . . 133 ALA N . 26774 1 1580 . 1 1 135 135 GLU H H 1 8.012 0.015 . 1 . . 173 . . 134 GLU H . 26774 1 1581 . 1 1 135 135 GLU HA H 1 4.031 0.007 . 1 . . 1903 . . 134 GLU HA . 26774 1 1582 . 1 1 135 135 GLU HB2 H 1 2.163 . . 2 . . 2195 . . 134 GLU HB2 . 26774 1 1583 . 1 1 135 135 GLU HB3 H 1 2.102 . . 2 . . 2196 . . 134 GLU HB3 . 26774 1 1584 . 1 1 135 135 GLU HG2 H 1 2.424 0.017 . 2 . . 2193 . . 134 GLU HG2 . 26774 1 1585 . 1 1 135 135 GLU HG3 H 1 2.375 . . 2 . . 2194 . . 134 GLU HG3 . 26774 1 1586 . 1 1 135 135 GLU C C 13 178.652 . . 1 . . 1749 . . 134 GLU C . 26774 1 1587 . 1 1 135 135 GLU CA C 13 59.477 . . 1 . . 540 . . 134 GLU CA . 26774 1 1588 . 1 1 135 135 GLU CB C 13 29.426 . . 1 . . 541 . . 134 GLU CB . 26774 1 1589 . 1 1 135 135 GLU CG C 13 36.563 . . 1 . . 1902 . . 134 GLU CG . 26774 1 1590 . 1 1 135 135 GLU N N 15 118.990 0.178 . 1 . . 174 . . 134 GLU N . 26774 1 1591 . 1 1 136 136 TRP H H 1 8.259 0.018 . 1 . . 790 . . 135 TRP H . 26774 1 1592 . 1 1 136 136 TRP HA H 1 4.045 . . 1 . . 1899 . . 135 TRP HA . 26774 1 1593 . 1 1 136 136 TRP HB2 H 1 3.509 . . 2 . . 1900 . . 135 TRP HB2 . 26774 1 1594 . 1 1 136 136 TRP HB3 H 1 3.438 . . 2 . . 1901 . . 135 TRP HB3 . 26774 1 1595 . 1 1 136 136 TRP HD1 H 1 7.266 0.0 . 1 . . 2110 . . 135 TRP HD1 . 26774 1 1596 . 1 1 136 136 TRP HE1 H 1 10.014 0.017 . 1 . . 73 . . 135 TRP HE1 . 26774 1 1597 . 1 1 136 136 TRP HE3 H 1 7.197 0.0 . 1 . . 1924 . . 135 TRP HE3 . 26774 1 1598 . 1 1 136 136 TRP HZ2 H 1 7.578 0.001 . 1 . . 2109 . . 135 TRP HZ2 . 26774 1 1599 . 1 1 136 136 TRP C C 13 178.491 . . 1 . . 1898 . . 135 TRP C . 26774 1 1600 . 1 1 136 136 TRP CA C 13 62.901 . . 1 . . 1896 . . 135 TRP CA . 26774 1 1601 . 1 1 136 136 TRP CB C 13 29.292 . . 1 . . 1897 . . 135 TRP CB . 26774 1 1602 . 1 1 136 136 TRP CD1 C 13 129.602 . . 1 . . 2114 . . 135 TRP CD1 . 26774 1 1603 . 1 1 136 136 TRP CD2 C 13 127.088 . . 1 . . 2115 . . 135 TRP CD2 . 26774 1 1604 . 1 1 136 136 TRP CZ2 C 13 119.741 . . 1 . . 2116 . . 135 TRP CZ2 . 26774 1 1605 . 1 1 136 136 TRP CZ3 C 13 119.771 . . 1 . . 2113 . . 135 TRP CZ3 . 26774 1 1606 . 1 1 136 136 TRP N N 15 122.454 0.158 . 1 . . 791 . . 135 TRP N . 26774 1 1607 . 1 1 136 136 TRP NE1 N 15 130.510 0.142 . 1 . . 74 . . 135 TRP NE1 . 26774 1 1608 . 1 1 137 137 GLU H H 1 9.087 0.018 . 1 . . 640 . . 136 GLU H . 26774 1 1609 . 1 1 137 137 GLU HA H 1 3.827 . . 1 . . 1891 . . 136 GLU HA . 26774 1 1610 . 1 1 137 137 GLU HB2 H 1 2.148 . . 2 . . 1892 . . 136 GLU HB2 . 26774 1 1611 . 1 1 137 137 GLU HB3 H 1 1.537 . . 2 . . 1893 . . 136 GLU HB3 . 26774 1 1612 . 1 1 137 137 GLU HG2 H 1 2.535 . . 2 . . 1894 . . 136 GLU HG2 . 26774 1 1613 . 1 1 137 137 GLU HG3 H 1 2.770 . . 2 . . 1895 . . 136 GLU HG3 . 26774 1 1614 . 1 1 137 137 GLU C C 13 180.038 . . 1 . . 1744 . . 136 GLU C . 26774 1 1615 . 1 1 137 137 GLU CA C 13 59.857 . . 1 . . 1743 . . 136 GLU CA . 26774 1 1616 . 1 1 137 137 GLU CB C 13 29.286 . . 1 . . 1742 . . 136 GLU CB . 26774 1 1617 . 1 1 137 137 GLU CG C 13 37.785 . . 1 . . 1890 . . 136 GLU CG . 26774 1 1618 . 1 1 137 137 GLU N N 15 117.148 0.153 . 1 . . 278 . . 136 GLU N . 26774 1 1619 . 1 1 138 138 ALA H H 1 7.958 0.011 . 1 . . 189 . . 137 ALA H . 26774 1 1620 . 1 1 138 138 ALA HA H 1 4.234 . . 1 . . 1812 . . 137 ALA HA . 26774 1 1621 . 1 1 138 138 ALA HB1 H 1 1.493 . . 1 . . 1813 . . 137 ALA HB1 . 26774 1 1622 . 1 1 138 138 ALA HB2 H 1 1.493 . . 1 . . 1813 . . 137 ALA HB2 . 26774 1 1623 . 1 1 138 138 ALA HB3 H 1 1.493 . . 1 . . 1813 . . 137 ALA HB3 . 26774 1 1624 . 1 1 138 138 ALA C C 13 181.044 . . 1 . . 1729 . . 137 ALA C . 26774 1 1625 . 1 1 138 138 ALA CA C 13 54.967 . . 1 . . 831 . . 137 ALA CA . 26774 1 1626 . 1 1 138 138 ALA CB C 13 18.189 . . 1 . . 832 . . 137 ALA CB . 26774 1 1627 . 1 1 138 138 ALA N N 15 122.023 0.135 . 1 . . 190 . . 137 ALA N . 26774 1 1628 . 1 1 139 139 ARG H H 1 7.838 0.017 . 1 . . 15 . . 138 ARG H . 26774 1 1629 . 1 1 139 139 ARG HA H 1 3.950 0.005 . 1 . . 1801 . . 138 ARG HA . 26774 1 1630 . 1 1 139 139 ARG HB2 H 1 1.749 . . 2 . . 1807 . . 138 ARG HB2 . 26774 1 1631 . 1 1 139 139 ARG HB3 H 1 1.859 . . 2 . . 1809 . . 138 ARG HB3 . 26774 1 1632 . 1 1 139 139 ARG HG2 H 1 1.306 . . 2 . . 1811 . . 138 ARG HG2 . 26774 1 1633 . 1 1 139 139 ARG HG3 H 1 1.471 0.007 . 2 . . 2267 . . 138 ARG HG3 . 26774 1 1634 . 1 1 139 139 ARG HD2 H 1 3.234 0.0 . 2 . . 1805 . . 138 ARG HD2 . 26774 1 1635 . 1 1 139 139 ARG HD3 H 1 3.181 . . 2 . . 1810 . . 138 ARG HD3 . 26774 1 1636 . 1 1 139 139 ARG C C 13 178.981 . . 1 . . 1746 . . 138 ARG C . 26774 1 1637 . 1 1 139 139 ARG CA C 13 59.750 0.07 . 1 . . 519 . . 138 ARG CA . 26774 1 1638 . 1 1 139 139 ARG CB C 13 30.082 . . 1 . . 631 . . 138 ARG CB . 26774 1 1639 . 1 1 139 139 ARG CG C 13 27.783 0.043 . 1 . . 1803 . . 138 ARG CG . 26774 1 1640 . 1 1 139 139 ARG CD C 13 43.215 0.034 . 1 . . 1806 . . 138 ARG CD . 26774 1 1641 . 1 1 139 139 ARG N N 15 121.128 0.133 . 1 . . 16 . . 138 ARG N . 26774 1 1642 . 1 1 140 140 TYR H H 1 8.531 0.017 . 1 . . 600 . . 139 TYR H . 26774 1 1643 . 1 1 140 140 TYR HA H 1 3.915 0.013 . 1 . . 1798 . . 139 TYR HA . 26774 1 1644 . 1 1 140 140 TYR HB2 H 1 2.603 . . 2 . . 1799 . . 139 TYR HB2 . 26774 1 1645 . 1 1 140 140 TYR HB3 H 1 2.765 0.001 . 2 . . 1800 . . 139 TYR HB3 . 26774 1 1646 . 1 1 140 140 TYR HD1 H 1 7.935 0.006 . 1 . . 2037 . . 139 TYR HD1 . 26774 1 1647 . 1 1 140 140 TYR HD2 H 1 7.935 0.006 . 1 . . 2037 . . 139 TYR HD2 . 26774 1 1648 . 1 1 140 140 TYR HH H 1 9.232 . . 1 . . 2036 . . 139 TYR HH . 26774 1 1649 . 1 1 140 140 TYR C C 13 177.290 . . 1 . . 2258 . . 139 TYR C . 26774 1 1650 . 1 1 140 140 TYR CA C 13 62.255 . . 1 . . 602 . . 139 TYR CA . 26774 1 1651 . 1 1 140 140 TYR CB C 13 38.422 . . 1 . . 603 . . 139 TYR CB . 26774 1 1652 . 1 1 140 140 TYR CD1 C 13 137.538 . . 1 . . 2038 . . 139 TYR CD1 . 26774 1 1653 . 1 1 140 140 TYR CD2 C 13 137.538 . . 1 . . 2038 . . 139 TYR CD2 . 26774 1 1654 . 1 1 140 140 TYR N N 15 123.984 0.156 . 1 . . 601 . . 139 TYR N . 26774 1 1655 . 1 1 141 141 ALA H H 1 8.246 0.019 . 1 . . 131 . . 140 ALA H . 26774 1 1656 . 1 1 141 141 ALA HA H 1 4.216 0.002 . 1 . . 1796 . . 140 ALA HA . 26774 1 1657 . 1 1 141 141 ALA HB1 H 1 1.499 . . 1 . . 1797 . . 140 ALA HB1 . 26774 1 1658 . 1 1 141 141 ALA HB2 H 1 1.499 . . 1 . . 1797 . . 140 ALA HB2 . 26774 1 1659 . 1 1 141 141 ALA HB3 H 1 1.499 . . 1 . . 1797 . . 140 ALA HB3 . 26774 1 1660 . 1 1 141 141 ALA C C 13 181.169 . . 1 . . 1758 . . 140 ALA C . 26774 1 1661 . 1 1 141 141 ALA CA C 13 54.600 . . 1 . . 534 . . 140 ALA CA . 26774 1 1662 . 1 1 141 141 ALA CB C 13 18.035 . . 1 . . 646 . . 140 ALA CB . 26774 1 1663 . 1 1 141 141 ALA N N 15 120.033 0.143 . 1 . . 132 . . 140 ALA N . 26774 1 1664 . 1 1 142 142 GLU H H 1 7.751 0.021 . 1 . . 242 . . 141 GLU H . 26774 1 1665 . 1 1 142 142 GLU HA H 1 4.351 . . 1 . . 1791 . . 141 GLU HA . 26774 1 1666 . 1 1 142 142 GLU HB2 H 1 2.031 . . 2 . . 1793 . . 141 GLU HB2 . 26774 1 1667 . 1 1 142 142 GLU HB3 H 1 1.936 0.007 . 2 . . 1795 . . 141 GLU HB3 . 26774 1 1668 . 1 1 142 142 GLU HG2 H 1 2.392 0.009 . 2 . . 1792 . . 141 GLU HG2 . 26774 1 1669 . 1 1 142 142 GLU HG3 H 1 2.278 . . 2 . . 1794 . . 141 GLU HG3 . 26774 1 1670 . 1 1 142 142 GLU C C 13 177.769 . . 1 . . 1759 . . 141 GLU C . 26774 1 1671 . 1 1 142 142 GLU CA C 13 58.053 . . 1 . . 1731 . . 141 GLU CA . 26774 1 1672 . 1 1 142 142 GLU CB C 13 28.105 . . 1 . . 1730 . . 141 GLU CB . 26774 1 1673 . 1 1 142 142 GLU N N 15 120.075 0.203 . 1 . . 243 . . 141 GLU N . 26774 1 1674 . 1 1 143 143 ALA H H 1 7.919 0.02 . 1 . . 271 . . 142 ALA H . 26774 1 1675 . 1 1 143 143 ALA HA H 1 4.324 . . 1 . . 1786 . . 142 ALA HA . 26774 1 1676 . 1 1 143 143 ALA HB1 H 1 1.451 . . 1 . . 1785 . . 142 ALA HB1 . 26774 1 1677 . 1 1 143 143 ALA HB2 H 1 1.451 . . 1 . . 1785 . . 142 ALA HB2 . 26774 1 1678 . 1 1 143 143 ALA HB3 H 1 1.451 . . 1 . . 1785 . . 142 ALA HB3 . 26774 1 1679 . 1 1 143 143 ALA C C 13 178.845 . . 1 . . 1745 . . 142 ALA C . 26774 1 1680 . 1 1 143 143 ALA CA C 13 55.387 . . 1 . . 656 . . 142 ALA CA . 26774 1 1681 . 1 1 143 143 ALA CB C 13 17.833 . . 1 . . 659 . . 142 ALA CB . 26774 1 1682 . 1 1 143 143 ALA N N 15 123.903 0.206 . 1 . . 272 . . 142 ALA N . 26774 1 1683 . 1 1 144 144 GLU H H 1 8.279 0.012 . 1 . . 117 . . 143 GLU H . 26774 1 1684 . 1 1 144 144 GLU HA H 1 3.966 0.005 . 1 . . 1787 . . 143 GLU HA . 26774 1 1685 . 1 1 144 144 GLU HB2 H 1 2.098 . . 2 . . 1789 . . 143 GLU HB2 . 26774 1 1686 . 1 1 144 144 GLU HB3 H 1 1.976 . . 2 . . 2190 . . 143 GLU HB3 . 26774 1 1687 . 1 1 144 144 GLU HG2 H 1 2.599 . . 2 . . 1790 . . 143 GLU HG2 . 26774 1 1688 . 1 1 144 144 GLU HG3 H 1 2.734 . . 2 . . 2191 . . 143 GLU HG3 . 26774 1 1689 . 1 1 144 144 GLU C C 13 178.719 0.084 . 1 . . 1747 . . 143 GLU C . 26774 1 1690 . 1 1 144 144 GLU CA C 13 59.549 . . 1 . . 653 . . 143 GLU CA . 26774 1 1691 . 1 1 144 144 GLU CB C 13 29.355 . . 1 . . 485 . . 143 GLU CB . 26774 1 1692 . 1 1 144 144 GLU CG C 13 36.570 . . 1 . . 1788 . . 143 GLU CG . 26774 1 1693 . 1 1 144 144 GLU N N 15 119.034 0.151 . 1 . . 118 . . 143 GLU N . 26774 1 1694 . 1 1 145 145 ARG H H 1 8.866 0.014 . 1 . . 37 . . 144 ARG H . 26774 1 1695 . 1 1 145 145 ARG HB2 H 1 1.612 . . 2 . . 2197 . . 144 ARG HB2 . 26774 1 1696 . 1 1 145 145 ARG HB3 H 1 1.684 . . 2 . . 2200 . . 144 ARG HB3 . 26774 1 1697 . 1 1 145 145 ARG HG2 H 1 1.308 . . 2 . . 2198 . . 144 ARG HG2 . 26774 1 1698 . 1 1 145 145 ARG HG3 H 1 1.399 0.002 . 2 . . 2199 . . 144 ARG HG3 . 26774 1 1699 . 1 1 145 145 ARG HD2 H 1 2.959 . . 1 . . 2201 . . 144 ARG HD2 . 26774 1 1700 . 1 1 145 145 ARG C C 13 178.112 . . 1 . . 1750 . . 144 ARG C . 26774 1 1701 . 1 1 145 145 ARG CA C 13 58.753 . . 1 . . 663 . . 144 ARG CA . 26774 1 1702 . 1 1 145 145 ARG CB C 13 30.096 . . 1 . . 664 . . 144 ARG CB . 26774 1 1703 . 1 1 145 145 ARG N N 15 114.721 0.109 . 1 . . 38 . . 144 ARG N . 26774 1 1704 . 1 1 146 146 ARG H H 1 8.344 0.016 . 1 . . 304 . . 145 ARG H . 26774 1 1705 . 1 1 146 146 ARG C C 13 178.633 . . 1 . . 2256 . . 145 ARG C . 26774 1 1706 . 1 1 146 146 ARG CA C 13 60.872 . . 1 . . 690 . . 145 ARG CA . 26774 1 1707 . 1 1 146 146 ARG CB C 13 28.294 . . 1 . . 691 . . 145 ARG CB . 26774 1 1708 . 1 1 146 146 ARG N N 15 119.602 0.147 . 1 . . 305 . . 145 ARG N . 26774 1 1709 . 1 1 147 147 HIS H H 1 7.763 0.017 . 1 . . 129 . . 146 HIS H . 26774 1 1710 . 1 1 147 147 HIS HA H 1 4.224 . . 1 . . 1784 . . 146 HIS HA . 26774 1 1711 . 1 1 147 147 HIS HB2 H 1 3.646 . . 2 . . 2061 . . 146 HIS HB2 . 26774 1 1712 . 1 1 147 147 HIS HB3 H 1 3.340 . . 2 . . 2062 . . 146 HIS HB3 . 26774 1 1713 . 1 1 147 147 HIS HD1 H 1 10.046 . . 1 . . 2058 . . 146 HIS HD1 . 26774 1 1714 . 1 1 147 147 HIS HD2 H 1 6.749 0.0 . 1 . . 2055 . . 146 HIS HD2 . 26774 1 1715 . 1 1 147 147 HIS HE1 H 1 8.122 . . 1 . . 2056 . . 146 HIS HE1 . 26774 1 1716 . 1 1 147 147 HIS HE2 H 1 10.398 . . 1 . . 2057 . . 146 HIS HE2 . 26774 1 1717 . 1 1 147 147 HIS C C 13 177.588 . . 1 . . 1761 . . 146 HIS C . 26774 1 1718 . 1 1 147 147 HIS CA C 13 60.971 . . 1 . . 518 . . 146 HIS CA . 26774 1 1719 . 1 1 147 147 HIS CB C 13 31.304 . . 1 . . 733 . . 146 HIS CB . 26774 1 1720 . 1 1 147 147 HIS CD2 C 13 118.169 . . 1 . . 2059 . . 146 HIS CD2 . 26774 1 1721 . 1 1 147 147 HIS CE1 C 13 137.109 . . 1 . . 2060 . . 146 HIS CE1 . 26774 1 1722 . 1 1 147 147 HIS N N 15 121.572 0.223 . 1 . . 130 . . 146 HIS N . 26774 1 1723 . 1 1 148 148 LYS H H 1 8.082 0.027 . 1 . . 107 . . 147 LYS H . 26774 1 1724 . 1 1 148 148 LYS HA H 1 3.855 0.001 . 1 . . 1771 . . 147 LYS HA . 26774 1 1725 . 1 1 148 148 LYS HB2 H 1 1.745 . . 2 . . 1774 . . 147 LYS HB2 . 26774 1 1726 . 1 1 148 148 LYS HB3 H 1 1.706 . . 2 . . 1781 . . 147 LYS HB3 . 26774 1 1727 . 1 1 148 148 LYS HG2 H 1 1.489 0.004 . 2 . . 1776 . . 147 LYS HG2 . 26774 1 1728 . 1 1 148 148 LYS HG3 H 1 1.293 . . 2 . . 1780 . . 147 LYS HG3 . 26774 1 1729 . 1 1 148 148 LYS HD2 H 1 1.557 . . 2 . . 1775 . . 147 LYS HD2 . 26774 1 1730 . 1 1 148 148 LYS HD3 H 1 1.634 . . 2 . . 1778 . . 147 LYS HD3 . 26774 1 1731 . 1 1 148 148 LYS HE2 H 1 2.795 0.002 . 1 . . 1772 . . 147 LYS HE2 . 26774 1 1732 . 1 1 148 148 LYS C C 13 180.654 . . 1 . . 1741 . . 147 LYS C . 26774 1 1733 . 1 1 148 148 LYS CA C 13 59.990 0.089 . 1 . . 596 . . 147 LYS CA . 26774 1 1734 . 1 1 148 148 LYS CB C 13 31.806 . . 1 . . 597 . . 147 LYS CB . 26774 1 1735 . 1 1 148 148 LYS CG C 13 25.755 . . 1 . . 1773 . . 147 LYS CG . 26774 1 1736 . 1 1 148 148 LYS CD C 13 28.745 0.056 . 1 . . 1777 . . 147 LYS CD . 26774 1 1737 . 1 1 148 148 LYS CE C 13 42.064 0.013 . 1 . . 1779 . . 147 LYS CE . 26774 1 1738 . 1 1 148 148 LYS N N 15 120.277 0.197 . 1 . . 108 . . 147 LYS N . 26774 1 1739 . 1 1 149 149 MET H H 1 8.278 0.024 . 1 . . 77 . . 148 MET H . 26774 1 1740 . 1 1 149 149 MET HA H 1 4.032 0.018 . 1 . . 1762 . . 148 MET HA . 26774 1 1741 . 1 1 149 149 MET HB2 H 1 2.093 0.003 . 2 . . 1763 . . 148 MET HB2 . 26774 1 1742 . 1 1 149 149 MET HB3 H 1 2.146 . . 2 . . 1764 . . 148 MET HB3 . 26774 1 1743 . 1 1 149 149 MET HG2 H 1 2.398 0.019 . 2 . . 1765 . . 148 MET HG2 . 26774 1 1744 . 1 1 149 149 MET HG3 H 1 2.625 . . 2 . . 1769 . . 148 MET HG3 . 26774 1 1745 . 1 1 149 149 MET HE1 H 1 1.788 0.003 . 1 . . 1768 . . 148 MET HE1 . 26774 1 1746 . 1 1 149 149 MET HE2 H 1 1.788 0.003 . 1 . . 1768 . . 148 MET HE2 . 26774 1 1747 . 1 1 149 149 MET HE3 H 1 1.788 0.003 . 1 . . 1768 . . 148 MET HE3 . 26774 1 1748 . 1 1 149 149 MET C C 13 179.419 . . 1 . . 1736 . . 148 MET C . 26774 1 1749 . 1 1 149 149 MET CA C 13 59.246 0.007 . 1 . . 496 . . 148 MET CA . 26774 1 1750 . 1 1 149 149 MET CB C 13 33.642 . . 1 . . 1075 . . 148 MET CB . 26774 1 1751 . 1 1 149 149 MET CG C 13 29.325 . . 1 . . 1766 . . 148 MET CG . 26774 1 1752 . 1 1 149 149 MET CE C 13 17.007 . . 1 . . 1767 . . 148 MET CE . 26774 1 1753 . 1 1 149 149 MET N N 15 120.938 0.21 . 1 . . 78 . . 148 MET N . 26774 1 1754 . 1 1 150 150 HIS H H 1 8.582 0.02 . 1 . . 760 . . 149 HIS H . 26774 1 1755 . 1 1 150 150 HIS HA H 1 4.259 . . 1 . . 1724 . . 149 HIS HA . 26774 1 1756 . 1 1 150 150 HIS HB2 H 1 3.138 . . 2 . . 1725 . . 149 HIS HB2 . 26774 1 1757 . 1 1 150 150 HIS HB3 H 1 3.277 . . 2 . . 1727 . . 149 HIS HB3 . 26774 1 1758 . 1 1 150 150 HIS HD1 H 1 9.787 . . 1 . . 2065 . . 149 HIS HD1 . 26774 1 1759 . 1 1 150 150 HIS HD2 H 1 7.040 0.014 . 1 . . 2064 . . 149 HIS HD2 . 26774 1 1760 . 1 1 150 150 HIS HE1 H 1 7.764 0.014 . 1 . . 2063 . . 149 HIS HE1 . 26774 1 1761 . 1 1 150 150 HIS C C 13 177.470 . . 1 . . 1669 . . 149 HIS C . 26774 1 1762 . 1 1 150 150 HIS CA C 13 57.093 . . 1 . . 1666 . . 149 HIS CA . 26774 1 1763 . 1 1 150 150 HIS CB C 13 30.967 . . 1 . . 1668 . . 149 HIS CB . 26774 1 1764 . 1 1 150 150 HIS CD2 C 13 119.275 . . 1 . . 2066 . . 149 HIS CD2 . 26774 1 1765 . 1 1 150 150 HIS CE1 C 13 137.337 . . 1 . . 2067 . . 149 HIS CE1 . 26774 1 1766 . 1 1 150 150 HIS N N 15 123.854 0.163 . 1 . . 761 . . 149 HIS N . 26774 1 1767 . 1 1 151 151 THR H H 1 9.048 0.006 . 1 . . 331 . . 150 THR H . 26774 1 1768 . 1 1 151 151 THR HA H 1 3.910 . . 1 . . 887 . . 150 THR HA . 26774 1 1769 . 1 1 151 151 THR HB H 1 3.620 . . 1 . . 1722 . . 150 THR HB . 26774 1 1770 . 1 1 151 151 THR HG1 H 1 4.208 0.003 . 1 . . 1721 . . 150 THR HG1 . 26774 1 1771 . 1 1 151 151 THR HG21 H 1 1.086 0.011 . 1 . . 1718 . . 150 THR HG21 . 26774 1 1772 . 1 1 151 151 THR HG22 H 1 1.086 0.011 . 1 . . 1718 . . 150 THR HG22 . 26774 1 1773 . 1 1 151 151 THR HG23 H 1 1.086 0.011 . 1 . . 1718 . . 150 THR HG23 . 26774 1 1774 . 1 1 151 151 THR C C 13 175.378 . . 1 . . 1480 . . 150 THR C . 26774 1 1775 . 1 1 151 151 THR CA C 13 66.937 . . 1 . . 424 . . 150 THR CA . 26774 1 1776 . 1 1 151 151 THR CB C 13 68.322 . . 1 . . 423 . . 150 THR CB . 26774 1 1777 . 1 1 151 151 THR CG2 C 13 18.364 . . 1 . . 1719 . . 150 THR CG2 . 26774 1 1778 . 1 1 151 151 THR N N 15 119.619 0.042 . 1 . . 332 . . 150 THR N . 26774 1 1779 . 1 1 152 152 ALA H H 1 7.497 0.01 . 1 . . 234 . . 151 ALA H . 26774 1 1780 . 1 1 152 152 ALA HA H 1 4.072 0.006 . 1 . . 1716 . . 151 ALA HA . 26774 1 1781 . 1 1 152 152 ALA HB1 H 1 1.427 . . 1 . . 1717 . . 151 ALA HB1 . 26774 1 1782 . 1 1 152 152 ALA HB2 H 1 1.427 . . 1 . . 1717 . . 151 ALA HB2 . 26774 1 1783 . 1 1 152 152 ALA HB3 H 1 1.427 . . 1 . . 1717 . . 151 ALA HB3 . 26774 1 1784 . 1 1 152 152 ALA C C 13 180.212 . . 1 . . 1661 . . 151 ALA C . 26774 1 1785 . 1 1 152 152 ALA CA C 13 54.988 . . 1 . . 538 . . 151 ALA CA . 26774 1 1786 . 1 1 152 152 ALA CB C 13 17.406 . . 1 . . 539 . . 151 ALA CB . 26774 1 1787 . 1 1 152 152 ALA N N 15 122.631 0.079 . 1 . . 235 . . 151 ALA N . 26774 1 1788 . 1 1 153 153 GLN H H 1 7.775 0.016 . 1 . . 151 . . 152 GLN H . 26774 1 1789 . 1 1 153 153 GLN HA H 1 4.145 . . 1 . . 1708 . . 152 GLN HA . 26774 1 1790 . 1 1 153 153 GLN HB2 H 1 2.136 . . 2 . . 1712 . . 152 GLN HB2 . 26774 1 1791 . 1 1 153 153 GLN HB3 H 1 2.148 . . 2 . . 1714 . . 152 GLN HB3 . 26774 1 1792 . 1 1 153 153 GLN HG2 H 1 2.268 . . 2 . . 1711 . . 152 GLN HG2 . 26774 1 1793 . 1 1 153 153 GLN HG3 H 1 2.231 . . 2 . . 1715 . . 152 GLN HG3 . 26774 1 1794 . 1 1 153 153 GLN HE21 H 1 6.566 0.021 . 1 . . 161 . . 152 GLN HE21 . 26774 1 1795 . 1 1 153 153 GLN HE22 H 1 7.305 0.027 . 1 . . 282 . . 152 GLN HE22 . 26774 1 1796 . 1 1 153 153 GLN C C 13 177.402 . . 1 . . 1665 . . 152 GLN C . 26774 1 1797 . 1 1 153 153 GLN CA C 13 59.167 . . 1 . . 588 . . 152 GLN CA . 26774 1 1798 . 1 1 153 153 GLN CB C 13 30.056 . . 1 . . 662 . . 152 GLN CB . 26774 1 1799 . 1 1 153 153 GLN CG C 13 36.107 . . 1 . . 1713 . . 152 GLN CG . 26774 1 1800 . 1 1 153 153 GLN N N 15 120.690 0.153 . 1 . . 152 . . 152 GLN N . 26774 1 1801 . 1 1 153 153 GLN NE2 N 15 111.847 0.23 . 1 . . 162 . . 152 GLN NE2 . 26774 1 1802 . 1 1 154 154 MET H H 1 8.195 0.013 . 1 . . 799 . . 153 MET H . 26774 1 1803 . 1 1 154 154 MET HA H 1 4.051 . . 1 . . 1702 . . 153 MET HA . 26774 1 1804 . 1 1 154 154 MET HB2 H 1 2.001 . . 2 . . 1701 . . 153 MET HB2 . 26774 1 1805 . 1 1 154 154 MET HB3 H 1 2.054 . . 2 . . 1704 . . 153 MET HB3 . 26774 1 1806 . 1 1 154 154 MET HG2 H 1 2.506 . . 2 . . 1705 . . 153 MET HG2 . 26774 1 1807 . 1 1 154 154 MET HG3 H 1 2.652 . . 2 . . 1706 . . 153 MET HG3 . 26774 1 1808 . 1 1 154 154 MET HE1 H 1 1.705 . . 1 . . 1707 . . 153 MET HE1 . 26774 1 1809 . 1 1 154 154 MET HE2 H 1 1.705 . . 1 . . 1707 . . 153 MET HE2 . 26774 1 1810 . 1 1 154 154 MET HE3 H 1 1.705 . . 1 . . 1707 . . 153 MET HE3 . 26774 1 1811 . 1 1 154 154 MET C C 13 180.096 0.034 . 1 . . 1664 . . 153 MET C . 26774 1 1812 . 1 1 154 154 MET CA C 13 56.082 . . 1 . . 1662 . . 153 MET CA . 26774 1 1813 . 1 1 154 154 MET CB C 13 28.757 . . 1 . . 1663 . . 153 MET CB . 26774 1 1814 . 1 1 154 154 MET CG C 13 33.658 . . 1 . . 1703 . . 153 MET CG . 26774 1 1815 . 1 1 154 154 MET N N 15 118.720 0.126 . 1 . . 800 . . 153 MET N . 26774 1 1816 . 1 1 155 155 GLU H H 1 7.877 0.017 . 1 . . 123 . . 154 GLU H . 26774 1 1817 . 1 1 155 155 GLU HA H 1 3.948 0.001 . 1 . . 1694 . . 154 GLU HA . 26774 1 1818 . 1 1 155 155 GLU HB2 H 1 2.129 . . 2 . . 1698 . . 154 GLU HB2 . 26774 1 1819 . 1 1 155 155 GLU HB3 H 1 1.981 0.019 . 2 . . 1699 . . 154 GLU HB3 . 26774 1 1820 . 1 1 155 155 GLU HG2 H 1 2.437 . . 2 . . 1696 . . 154 GLU HG2 . 26774 1 1821 . 1 1 155 155 GLU HG3 H 1 2.340 . . 2 . . 1697 . . 154 GLU HG3 . 26774 1 1822 . 1 1 155 155 GLU C C 13 179.142 . . 1 . . 1658 . . 154 GLU C . 26774 1 1823 . 1 1 155 155 GLU CA C 13 58.951 . . 1 . . 552 . . 154 GLU CA . 26774 1 1824 . 1 1 155 155 GLU CB C 13 29.269 0.067 . 1 . . 553 . . 154 GLU CB . 26774 1 1825 . 1 1 155 155 GLU CG C 13 36.629 . . 1 . . 1695 . . 154 GLU CG . 26774 1 1826 . 1 1 155 155 GLU N N 15 120.023 0.147 . 1 . . 124 . . 154 GLU N . 26774 1 1827 . 1 1 156 156 LYS H H 1 7.956 0.012 . 1 . . 758 . . 155 LYS H . 26774 1 1828 . 1 1 156 156 LYS HA H 1 4.017 0.009 . 1 . . 1681 . . 155 LYS HA . 26774 1 1829 . 1 1 156 156 LYS HB2 H 1 1.970 . . 2 . . 1682 . . 155 LYS HB2 . 26774 1 1830 . 1 1 156 156 LYS HB3 H 1 1.785 . . 2 . . 1683 . . 155 LYS HB3 . 26774 1 1831 . 1 1 156 156 LYS HG2 H 1 1.062 0.003 . 2 . . 1685 . . 155 LYS HG2 . 26774 1 1832 . 1 1 156 156 LYS HG3 H 1 1.030 . . 2 . . 1693 . . 155 LYS HG3 . 26774 1 1833 . 1 1 156 156 LYS HD2 H 1 1.460 0.005 . 2 . . 1684 . . 155 LYS HD2 . 26774 1 1834 . 1 1 156 156 LYS HD3 H 1 1.669 . . 2 . . 1689 . . 155 LYS HD3 . 26774 1 1835 . 1 1 156 156 LYS HE2 H 1 2.876 . . 2 . . 1691 . . 155 LYS HE2 . 26774 1 1836 . 1 1 156 156 LYS HE3 H 1 2.901 . . 2 . . 1692 . . 155 LYS HE3 . 26774 1 1837 . 1 1 156 156 LYS C C 13 179.179 . . 1 . . 1655 . . 155 LYS C . 26774 1 1838 . 1 1 156 156 LYS CA C 13 59.192 0.004 . 1 . . 897 . . 155 LYS CA . 26774 1 1839 . 1 1 156 156 LYS CB C 13 32.530 . . 1 . . 1659 . . 155 LYS CB . 26774 1 1840 . 1 1 156 156 LYS CG C 13 24.479 0.041 . 1 . . 1686 . . 155 LYS CG . 26774 1 1841 . 1 1 156 156 LYS CD C 13 29.682 . . 1 . . 1688 . . 155 LYS CD . 26774 1 1842 . 1 1 156 156 LYS CE C 13 42.117 . . 1 . . 1687 . . 155 LYS CE . 26774 1 1843 . 1 1 156 156 LYS N N 15 121.373 0.176 . 1 . . 759 . . 155 LYS N . 26774 1 1844 . 1 1 157 157 PHE H H 1 8.519 0.01 . 1 . . 232 . . 156 PHE H . 26774 1 1845 . 1 1 157 157 PHE HA H 1 4.164 0.005 . 1 . . 2104 . . 156 PHE HA . 26774 1 1846 . 1 1 157 157 PHE HB2 H 1 2.688 . . 2 . . 1679 . . 156 PHE HB2 . 26774 1 1847 . 1 1 157 157 PHE HB3 H 1 3.099 . . 2 . . 2105 . . 156 PHE HB3 . 26774 1 1848 . 1 1 157 157 PHE HD1 H 1 7.328 0.0 . 1 . . 2265 . . 156 PHE HD1 . 26774 1 1849 . 1 1 157 157 PHE HD2 H 1 7.328 0.0 . 1 . . 2265 . . 156 PHE HD2 . 26774 1 1850 . 1 1 157 157 PHE C C 13 177.526 . . 1 . . 1656 . . 156 PHE C . 26774 1 1851 . 1 1 157 157 PHE CA C 13 60.346 . . 1 . . 498 . . 156 PHE CA . 26774 1 1852 . 1 1 157 157 PHE CB C 13 38.020 . . 1 . . 717 . . 156 PHE CB . 26774 1 1853 . 1 1 157 157 PHE CD1 C 13 129.997 . . 1 . . 2266 . . 156 PHE CD1 . 26774 1 1854 . 1 1 157 157 PHE CD2 C 13 129.997 . . 1 . . 2266 . . 156 PHE CD2 . 26774 1 1855 . 1 1 157 157 PHE N N 15 119.856 0.065 . 1 . . 233 . . 156 PHE N . 26774 1 1856 . 1 1 158 158 ALA H H 1 7.972 0.015 . 1 . . 320 . . 157 ALA H . 26774 1 1857 . 1 1 158 158 ALA HA H 1 4.106 0.002 . 1 . . 1673 . . 157 ALA HA . 26774 1 1858 . 1 1 158 158 ALA HB1 H 1 1.412 . . 1 . . 1674 . . 157 ALA HB1 . 26774 1 1859 . 1 1 158 158 ALA HB2 H 1 1.412 . . 1 . . 1674 . . 157 ALA HB2 . 26774 1 1860 . 1 1 158 158 ALA HB3 H 1 1.412 . . 1 . . 1674 . . 157 ALA HB3 . 26774 1 1861 . 1 1 158 158 ALA C C 13 179.581 . . 1 . . 1657 . . 157 ALA C . 26774 1 1862 . 1 1 158 158 ALA CA C 13 54.555 . . 1 . . 548 . . 157 ALA CA . 26774 1 1863 . 1 1 158 158 ALA CB C 13 18.143 . . 1 . . 660 . . 157 ALA CB . 26774 1 1864 . 1 1 158 158 ALA N N 15 122.411 0.207 . 1 . . 321 . . 157 ALA N . 26774 1 1865 . 1 1 159 159 ALA H H 1 7.719 0.018 . 1 . . 159 . . 158 ALA H . 26774 1 1866 . 1 1 159 159 ALA HA H 1 4.245 . . 1 . . 1675 . . 158 ALA HA . 26774 1 1867 . 1 1 159 159 ALA HB1 H 1 1.380 0.006 . 1 . . 1676 . . 158 ALA HB1 . 26774 1 1868 . 1 1 159 159 ALA HB2 H 1 1.380 0.006 . 1 . . 1676 . . 158 ALA HB2 . 26774 1 1869 . 1 1 159 159 ALA HB3 H 1 1.380 0.006 . 1 . . 1676 . . 158 ALA HB3 . 26774 1 1870 . 1 1 159 159 ALA C C 13 179.599 . . 1 . . 1654 . . 158 ALA C . 26774 1 1871 . 1 1 159 159 ALA CA C 13 53.706 . . 1 . . 667 . . 158 ALA CA . 26774 1 1872 . 1 1 159 159 ALA CB C 13 18.529 . . 1 . . 666 . . 158 ALA CB . 26774 1 1873 . 1 1 159 159 ALA N N 15 120.314 0.139 . 1 . . 160 . . 158 ALA N . 26774 1 stop_ save_