data_27279 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27279 _Entry.Title ; Backbone 1H, 13C, 15N chemical shift assignments for T cell receptor N30 beta subunit C domain mutant c1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-10-11 _Entry.Accession_date 2017-10-11 _Entry.Last_release_date 2015-07-14 _Entry.Original_release_date 2015-07-14 _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 ; Backbone 1H, 13C, 15N chemical shift assignments for T cell receptor N30 beta subunit C domain mutant c1 (F128R/V144Q/L146Q) ; 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 Robert Mallis . J. . . 27279 2 Haribabu Arthanari . . . . 27279 3 Ellis Reinherz . L. . . 27279 4 Gerhard Wagner . . . . 27279 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 27279 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27279 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 610 27279 '15N chemical shifts' 213 27279 '1H chemical shifts' 213 27279 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-11-14 . original BMRB . 27279 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26601 ; Backbone 1H, 13C, 15N chemical shift assignments for T cell receptor N30 beta subunit ; 27279 BMRB 27278 'T cell receptor N15 beta subunit C domain mutant c1 (F128R/V144Q/L146Q)' 27279 BMRB 27280 ; T cell receptor N15 beta subunit C domain mutant m22 (Y50A/E51A/F128R/V144Q/L146Q) ; 27279 BMRB 27281 ; T cell receptor N15 beta subunit C domain mutant m23 (Q48A/Y50A/E51A/F128R/V144Q/L146Q) ; 27279 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27279 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 'doi: 10.1073/pnas.1504971112' _Citation.PubMed_ID 26056289 _Citation.Full_citation . _Citation.Title ; Pre-TCR ligand binding impacts thymocyte development before TCR expression. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 112 _Citation.Journal_issue 27 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 8373 _Citation.Page_last 8378 _Citation.Year 2015 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Robert Mallis . J. . . 27279 1 2 Ke Bai . . . . 27279 1 3 Haribabu Arthanari . . . . 27279 1 4 Rebecca Hussey . E. . . 27279 1 5 Zhenhai Li . . . . 27279 1 6 Loice Chingozha . . . . 27279 1 7 Jonathan Duke-Cohan . S. . . 27279 1 8 Hang Lu . . . . 27279 1 9 Jia-Huai Wang . . . . 27279 1 10 Cheng Zhu . . . . 27279 1 11 Gerhard Wagner . . . . 27279 1 12 Ellis Reinherz . L. . . 27279 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR spectroscopy' 27279 1 'biomembrane force probe' 27279 1 'pre T-cell receptor' 27279 1 'repertoire selection' 27279 1 'thymic development' 27279 1 stop_ save_ save_reference_citation _Citation.Sf_category citations _Citation.Sf_framecode reference_citation _Citation.Entry_ID 27279 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26275917 _Citation.Full_citation . _Citation.Title ; Backbone Resonance Assignment of N15, N30 and D10 T cell Receptor beta subunits ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 10 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 35 _Citation.Page_last 39 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Robert Mallis . J. . . 27279 2 2 Ellis Reinherz . L. . . 27279 2 3 Gerhard Wagner . . . . 27279 2 4 Haribabu Arthanari . . . . 27279 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID MHC 27279 2 'NMR spectroscopy' 27279 2 'T-cell Receptor (TCR)' 27279 2 'biomembrane force probe' 27279 2 immunology 27279 2 'pre T-cell receptor' 27279 2 'protein refolding' 27279 2 'repertoire selection' 27279 2 'thymic development' 27279 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27279 _Assembly.ID 1 _Assembly.Name 'N30alphabetaTCR, pTalpha/N30beta' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds yes _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 'N30 beta subunit C domain mutant c1 (F128R/V144Q/L146Q)' 1 $N30b-c1 A . yes native no no . . . 27279 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 24 24 SG . 1 . 1 CYS 93 93 SG . 'beta subunit' . 23 CYS SG . 'beta subunit' . 92 CYS SG 27279 1 2 disulfide single . 1 . 1 CYS 145 145 SG . 1 . 1 CYS 206 206 SG . 'beta subunit' . 144 CYS SG . 'beta subunit' . 205 CYS SG 27279 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 3Q5T . . X-ray 2.01 'WT of same molecule' . 27279 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_N30b-c1 _Entity.Sf_category entity _Entity.Sf_framecode N30b-c1 _Entity.Entry_ID 27279 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name N30b-c1 _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 ; MEAGVTQSPRYAVLQEGQSV SFWCDPISGHDTLYWYQQPR DQGPQLLVYFRDEAVIDNSQ LPSDRFSAVRPKGTNSTLKI QSAKQGDTATYLCASSSGVG TEVFFGKGTRLTVVEDLRNV TPPKVSLREPSKAEIANKQK ATLQCQARGFFPDHVELSWW VNGKEVHSGVSTDPQAYKES NYSYSLSSRLRVSATFWHNP RNHFRCQVQFHGLSEEDKWP EGSPKPVTQNISAEAWGRAD S ; _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 241 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Extracellular domain' _Entity.Mutation ; C240S F129R V145Q L147Q ; _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 27003.96 _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 . MET . 27279 1 2 . GLU . 27279 1 3 . ALA . 27279 1 4 . GLY . 27279 1 5 . VAL . 27279 1 6 . THR . 27279 1 7 . GLN . 27279 1 8 . SER . 27279 1 9 . PRO . 27279 1 10 . ARG . 27279 1 11 . TYR . 27279 1 12 . ALA . 27279 1 13 . VAL . 27279 1 14 . LEU . 27279 1 15 . GLN . 27279 1 16 . GLU . 27279 1 17 . GLY . 27279 1 18 . GLN . 27279 1 19 . SER . 27279 1 20 . VAL . 27279 1 21 . SER . 27279 1 22 . PHE . 27279 1 23 . TRP . 27279 1 24 . CYS . 27279 1 25 . ASP . 27279 1 26 . PRO . 27279 1 27 . ILE . 27279 1 28 . SER . 27279 1 29 . GLY . 27279 1 30 . HIS . 27279 1 31 . ASP . 27279 1 32 . THR . 27279 1 33 . LEU . 27279 1 34 . TYR . 27279 1 35 . TRP . 27279 1 36 . TYR . 27279 1 37 . GLN . 27279 1 38 . GLN . 27279 1 39 . PRO . 27279 1 40 . ARG . 27279 1 41 . ASP . 27279 1 42 . GLN . 27279 1 43 . GLY . 27279 1 44 . PRO . 27279 1 45 . GLN . 27279 1 46 . LEU . 27279 1 47 . LEU . 27279 1 48 . VAL . 27279 1 49 . TYR . 27279 1 50 . PHE . 27279 1 51 . ARG . 27279 1 52 . ASP . 27279 1 53 . GLU . 27279 1 54 . ALA . 27279 1 55 . VAL . 27279 1 56 . ILE . 27279 1 57 . ASP . 27279 1 58 . ASN . 27279 1 59 . SER . 27279 1 60 . GLN . 27279 1 61 . LEU . 27279 1 62 . PRO . 27279 1 63 . SER . 27279 1 64 . ASP . 27279 1 65 . ARG . 27279 1 66 . PHE . 27279 1 67 . SER . 27279 1 68 . ALA . 27279 1 69 . VAL . 27279 1 70 . ARG . 27279 1 71 . PRO . 27279 1 72 . LYS . 27279 1 73 . GLY . 27279 1 74 . THR . 27279 1 75 . ASN . 27279 1 76 . SER . 27279 1 77 . THR . 27279 1 78 . LEU . 27279 1 79 . LYS . 27279 1 80 . ILE . 27279 1 81 . GLN . 27279 1 82 . SER . 27279 1 83 . ALA . 27279 1 84 . LYS . 27279 1 85 . GLN . 27279 1 86 . GLY . 27279 1 87 . ASP . 27279 1 88 . THR . 27279 1 89 . ALA . 27279 1 90 . THR . 27279 1 91 . TYR . 27279 1 92 . LEU . 27279 1 93 . CYS . 27279 1 94 . ALA . 27279 1 95 . SER . 27279 1 96 . SER . 27279 1 97 . SER . 27279 1 98 . GLY . 27279 1 99 . VAL . 27279 1 100 . GLY . 27279 1 101 . THR . 27279 1 102 . GLU . 27279 1 103 . VAL . 27279 1 104 . PHE . 27279 1 105 . PHE . 27279 1 106 . GLY . 27279 1 107 . LYS . 27279 1 108 . GLY . 27279 1 109 . THR . 27279 1 110 . ARG . 27279 1 111 . LEU . 27279 1 112 . THR . 27279 1 113 . VAL . 27279 1 114 . VAL . 27279 1 115 . GLU . 27279 1 116 . ASP . 27279 1 117 . LEU . 27279 1 118 . ARG . 27279 1 119 . ASN . 27279 1 120 . VAL . 27279 1 121 . THR . 27279 1 122 . PRO . 27279 1 123 . PRO . 27279 1 124 . LYS . 27279 1 125 . VAL . 27279 1 126 . SER . 27279 1 127 . LEU . 27279 1 128 . ARG . 27279 1 129 . GLU . 27279 1 130 . PRO . 27279 1 131 . SER . 27279 1 132 . LYS . 27279 1 133 . ALA . 27279 1 134 . GLU . 27279 1 135 . ILE . 27279 1 136 . ALA . 27279 1 137 . ASN . 27279 1 138 . LYS . 27279 1 139 . GLN . 27279 1 140 . LYS . 27279 1 141 . ALA . 27279 1 142 . THR . 27279 1 143 . LEU . 27279 1 144 . GLN . 27279 1 145 . CYS . 27279 1 146 . GLN . 27279 1 147 . ALA . 27279 1 148 . ARG . 27279 1 149 . GLY . 27279 1 150 . PHE . 27279 1 151 . PHE . 27279 1 152 . PRO . 27279 1 153 . ASP . 27279 1 154 . HIS . 27279 1 155 . VAL . 27279 1 156 . GLU . 27279 1 157 . LEU . 27279 1 158 . SER . 27279 1 159 . TRP . 27279 1 160 . TRP . 27279 1 161 . VAL . 27279 1 162 . ASN . 27279 1 163 . GLY . 27279 1 164 . LYS . 27279 1 165 . GLU . 27279 1 166 . VAL . 27279 1 167 . HIS . 27279 1 168 . SER . 27279 1 169 . GLY . 27279 1 170 . VAL . 27279 1 171 . SER . 27279 1 172 . THR . 27279 1 173 . ASP . 27279 1 174 . PRO . 27279 1 175 . GLN . 27279 1 176 . ALA . 27279 1 177 . TYR . 27279 1 178 . LYS . 27279 1 179 . GLU . 27279 1 180 . SER . 27279 1 181 . ASN . 27279 1 182 . TYR . 27279 1 183 . SER . 27279 1 184 . TYR . 27279 1 185 . SER . 27279 1 186 . LEU . 27279 1 187 . SER . 27279 1 188 . SER . 27279 1 189 . ARG . 27279 1 190 . LEU . 27279 1 191 . ARG . 27279 1 192 . VAL . 27279 1 193 . SER . 27279 1 194 . ALA . 27279 1 195 . THR . 27279 1 196 . PHE . 27279 1 197 . TRP . 27279 1 198 . HIS . 27279 1 199 . ASN . 27279 1 200 . PRO . 27279 1 201 . ARG . 27279 1 202 . ASN . 27279 1 203 . HIS . 27279 1 204 . PHE . 27279 1 205 . ARG . 27279 1 206 . CYS . 27279 1 207 . GLN . 27279 1 208 . VAL . 27279 1 209 . GLN . 27279 1 210 . PHE . 27279 1 211 . HIS . 27279 1 212 . GLY . 27279 1 213 . LEU . 27279 1 214 . SER . 27279 1 215 . GLU . 27279 1 216 . GLU . 27279 1 217 . ASP . 27279 1 218 . LYS . 27279 1 219 . TRP . 27279 1 220 . PRO . 27279 1 221 . GLU . 27279 1 222 . GLY . 27279 1 223 . SER . 27279 1 224 . PRO . 27279 1 225 . LYS . 27279 1 226 . PRO . 27279 1 227 . VAL . 27279 1 228 . THR . 27279 1 229 . GLN . 27279 1 230 . ASN . 27279 1 231 . ILE . 27279 1 232 . SER . 27279 1 233 . ALA . 27279 1 234 . GLU . 27279 1 235 . ALA . 27279 1 236 . TRP . 27279 1 237 . GLY . 27279 1 238 . ARG . 27279 1 239 . ALA . 27279 1 240 . ASP . 27279 1 241 . SER . 27279 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 27279 1 . GLU 2 2 27279 1 . ALA 3 3 27279 1 . GLY 4 4 27279 1 . VAL 5 5 27279 1 . THR 6 6 27279 1 . GLN 7 7 27279 1 . SER 8 8 27279 1 . PRO 9 9 27279 1 . ARG 10 10 27279 1 . TYR 11 11 27279 1 . ALA 12 12 27279 1 . VAL 13 13 27279 1 . LEU 14 14 27279 1 . GLN 15 15 27279 1 . GLU 16 16 27279 1 . GLY 17 17 27279 1 . GLN 18 18 27279 1 . SER 19 19 27279 1 . VAL 20 20 27279 1 . SER 21 21 27279 1 . PHE 22 22 27279 1 . TRP 23 23 27279 1 . CYS 24 24 27279 1 . ASP 25 25 27279 1 . PRO 26 26 27279 1 . ILE 27 27 27279 1 . SER 28 28 27279 1 . GLY 29 29 27279 1 . HIS 30 30 27279 1 . ASP 31 31 27279 1 . THR 32 32 27279 1 . LEU 33 33 27279 1 . TYR 34 34 27279 1 . TRP 35 35 27279 1 . TYR 36 36 27279 1 . GLN 37 37 27279 1 . GLN 38 38 27279 1 . PRO 39 39 27279 1 . ARG 40 40 27279 1 . ASP 41 41 27279 1 . GLN 42 42 27279 1 . GLY 43 43 27279 1 . PRO 44 44 27279 1 . GLN 45 45 27279 1 . LEU 46 46 27279 1 . LEU 47 47 27279 1 . VAL 48 48 27279 1 . TYR 49 49 27279 1 . PHE 50 50 27279 1 . ARG 51 51 27279 1 . ASP 52 52 27279 1 . GLU 53 53 27279 1 . ALA 54 54 27279 1 . VAL 55 55 27279 1 . ILE 56 56 27279 1 . ASP 57 57 27279 1 . ASN 58 58 27279 1 . SER 59 59 27279 1 . GLN 60 60 27279 1 . LEU 61 61 27279 1 . PRO 62 62 27279 1 . SER 63 63 27279 1 . ASP 64 64 27279 1 . ARG 65 65 27279 1 . PHE 66 66 27279 1 . SER 67 67 27279 1 . ALA 68 68 27279 1 . VAL 69 69 27279 1 . ARG 70 70 27279 1 . PRO 71 71 27279 1 . LYS 72 72 27279 1 . GLY 73 73 27279 1 . THR 74 74 27279 1 . ASN 75 75 27279 1 . SER 76 76 27279 1 . THR 77 77 27279 1 . LEU 78 78 27279 1 . LYS 79 79 27279 1 . ILE 80 80 27279 1 . GLN 81 81 27279 1 . SER 82 82 27279 1 . ALA 83 83 27279 1 . LYS 84 84 27279 1 . GLN 85 85 27279 1 . GLY 86 86 27279 1 . ASP 87 87 27279 1 . THR 88 88 27279 1 . ALA 89 89 27279 1 . THR 90 90 27279 1 . TYR 91 91 27279 1 . LEU 92 92 27279 1 . CYS 93 93 27279 1 . ALA 94 94 27279 1 . SER 95 95 27279 1 . SER 96 96 27279 1 . SER 97 97 27279 1 . GLY 98 98 27279 1 . VAL 99 99 27279 1 . GLY 100 100 27279 1 . THR 101 101 27279 1 . GLU 102 102 27279 1 . VAL 103 103 27279 1 . PHE 104 104 27279 1 . PHE 105 105 27279 1 . GLY 106 106 27279 1 . LYS 107 107 27279 1 . GLY 108 108 27279 1 . THR 109 109 27279 1 . ARG 110 110 27279 1 . LEU 111 111 27279 1 . THR 112 112 27279 1 . VAL 113 113 27279 1 . VAL 114 114 27279 1 . GLU 115 115 27279 1 . ASP 116 116 27279 1 . LEU 117 117 27279 1 . ARG 118 118 27279 1 . ASN 119 119 27279 1 . VAL 120 120 27279 1 . THR 121 121 27279 1 . PRO 122 122 27279 1 . PRO 123 123 27279 1 . LYS 124 124 27279 1 . VAL 125 125 27279 1 . SER 126 126 27279 1 . LEU 127 127 27279 1 . ARG 128 128 27279 1 . GLU 129 129 27279 1 . PRO 130 130 27279 1 . SER 131 131 27279 1 . LYS 132 132 27279 1 . ALA 133 133 27279 1 . GLU 134 134 27279 1 . ILE 135 135 27279 1 . ALA 136 136 27279 1 . ASN 137 137 27279 1 . LYS 138 138 27279 1 . GLN 139 139 27279 1 . LYS 140 140 27279 1 . ALA 141 141 27279 1 . THR 142 142 27279 1 . LEU 143 143 27279 1 . GLN 144 144 27279 1 . CYS 145 145 27279 1 . GLN 146 146 27279 1 . ALA 147 147 27279 1 . ARG 148 148 27279 1 . GLY 149 149 27279 1 . PHE 150 150 27279 1 . PHE 151 151 27279 1 . PRO 152 152 27279 1 . ASP 153 153 27279 1 . HIS 154 154 27279 1 . VAL 155 155 27279 1 . GLU 156 156 27279 1 . LEU 157 157 27279 1 . SER 158 158 27279 1 . TRP 159 159 27279 1 . TRP 160 160 27279 1 . VAL 161 161 27279 1 . ASN 162 162 27279 1 . GLY 163 163 27279 1 . LYS 164 164 27279 1 . GLU 165 165 27279 1 . VAL 166 166 27279 1 . HIS 167 167 27279 1 . SER 168 168 27279 1 . GLY 169 169 27279 1 . VAL 170 170 27279 1 . SER 171 171 27279 1 . THR 172 172 27279 1 . ASP 173 173 27279 1 . PRO 174 174 27279 1 . GLN 175 175 27279 1 . ALA 176 176 27279 1 . TYR 177 177 27279 1 . LYS 178 178 27279 1 . GLU 179 179 27279 1 . SER 180 180 27279 1 . ASN 181 181 27279 1 . TYR 182 182 27279 1 . SER 183 183 27279 1 . TYR 184 184 27279 1 . SER 185 185 27279 1 . LEU 186 186 27279 1 . SER 187 187 27279 1 . SER 188 188 27279 1 . ARG 189 189 27279 1 . LEU 190 190 27279 1 . ARG 191 191 27279 1 . VAL 192 192 27279 1 . SER 193 193 27279 1 . ALA 194 194 27279 1 . THR 195 195 27279 1 . PHE 196 196 27279 1 . TRP 197 197 27279 1 . HIS 198 198 27279 1 . ASN 199 199 27279 1 . PRO 200 200 27279 1 . ARG 201 201 27279 1 . ASN 202 202 27279 1 . HIS 203 203 27279 1 . PHE 204 204 27279 1 . ARG 205 205 27279 1 . CYS 206 206 27279 1 . GLN 207 207 27279 1 . VAL 208 208 27279 1 . GLN 209 209 27279 1 . PHE 210 210 27279 1 . HIS 211 211 27279 1 . GLY 212 212 27279 1 . LEU 213 213 27279 1 . SER 214 214 27279 1 . GLU 215 215 27279 1 . GLU 216 216 27279 1 . ASP 217 217 27279 1 . LYS 218 218 27279 1 . TRP 219 219 27279 1 . PRO 220 220 27279 1 . GLU 221 221 27279 1 . GLY 222 222 27279 1 . SER 223 223 27279 1 . PRO 224 224 27279 1 . LYS 225 225 27279 1 . PRO 226 226 27279 1 . VAL 227 227 27279 1 . THR 228 228 27279 1 . GLN 229 229 27279 1 . ASN 230 230 27279 1 . ILE 231 231 27279 1 . SER 232 232 27279 1 . ALA 233 233 27279 1 . GLU 234 234 27279 1 . ALA 235 235 27279 1 . TRP 236 236 27279 1 . GLY 237 237 27279 1 . ARG 238 238 27279 1 . ALA 239 239 27279 1 . ASP 240 240 27279 1 . SER 241 241 27279 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 27279 _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 $N30b-c1 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus B6 . . . . . . . . . . . . 27279 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 27279 _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 $N30b-c1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21-DE3 . . . . . pet11d . . . 27279 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27279 _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 N30b-c1 '[U-13C; U-15N; U-2H]' . . 1 $N30b-c1 . . 0.4 . . mM . . . . 27279 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 27279 1 3 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27279 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 27279 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 27279 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 27279 _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' 250 . mM 27279 1 pH 7 . pH 27279 1 pressure 1 . atm 27279 1 temperature 298 . K 27279 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 27279 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version 1.90 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 27279 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27279 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27279 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27279 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27279 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27279 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 27279 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 27279 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27279 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 750 . . . 27279 1 2 spectrometer_2 Bruker Avance . 600 . . . 27279 1 3 spectrometer_3 Varian INOVA . 600 . . . 27279 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 27279 _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 . . . . . . . . . . . . . . . . 27279 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 27279 _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 water protons . . . . ppm 4.7 internal indirect . . . . . . 27279 1 H 1 water protons . . . . ppm 4.7 internal indirect 1 . . . . . 27279 1 N 15 water protons . . . . ppm 4.7 internal indirect . . . . . . 27279 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 27279 _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' . . . 27279 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CARA . . 27279 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 3 3 ALA H H 1 8.295 0.020 . 1 . . . . . 3 ALA H . 27279 1 2 . 1 1 3 3 ALA C C 13 177.314 0.3 . 1 . . . . . 3 ALA C . 27279 1 3 . 1 1 3 3 ALA CA C 13 51.688 0.3 . 1 . . . . . 3 ALA CA . 27279 1 4 . 1 1 3 3 ALA CB C 13 18.674 0.3 . 1 . . . . . 3 ALA CB . 27279 1 5 . 1 1 3 3 ALA N N 15 125.902 0.3 . 1 . . . . . 3 ALA N . 27279 1 6 . 1 1 4 4 GLY H H 1 7.937 0.020 . 1 . . . . . 4 GLY H . 27279 1 7 . 1 1 4 4 GLY C C 13 172.491 0.3 . 1 . . . . . 4 GLY C . 27279 1 8 . 1 1 4 4 GLY CA C 13 43.971 0.3 . 1 . . . . . 4 GLY CA . 27279 1 9 . 1 1 4 4 GLY N N 15 107.993 0.3 . 1 . . . . . 4 GLY N . 27279 1 10 . 1 1 5 5 VAL H H 1 8.330 0.020 . 1 . . . . . 5 VAL H . 27279 1 11 . 1 1 5 5 VAL C C 13 176.967 0.3 . 1 . . . . . 5 VAL C . 27279 1 12 . 1 1 5 5 VAL CA C 13 62.298 0.3 . 1 . . . . . 5 VAL CA . 27279 1 13 . 1 1 5 5 VAL CB C 13 31.464 0.3 . 1 . . . . . 5 VAL CB . 27279 1 14 . 1 1 5 5 VAL N N 15 123.755 0.3 . 1 . . . . . 5 VAL N . 27279 1 15 . 1 1 6 6 THR H H 1 8.681 0.020 . 1 . . . . . 6 THR H . 27279 1 16 . 1 1 6 6 THR C C 13 172.536 0.3 . 1 . . . . . 6 THR C . 27279 1 17 . 1 1 6 6 THR CA C 13 61.663 0.3 . 1 . . . . . 6 THR CA . 27279 1 18 . 1 1 6 6 THR CB C 13 69.625 0.3 . 1 . . . . . 6 THR CB . 27279 1 19 . 1 1 6 6 THR N N 15 126.067 0.3 . 1 . . . . . 6 THR N . 27279 1 20 . 1 1 11 11 TYR H H 1 7.735 0.020 . 1 . . . . . 11 TYR H . 27279 1 21 . 1 1 11 11 TYR C C 13 174.631 0.3 . 1 . . . . . 11 TYR C . 27279 1 22 . 1 1 11 11 TYR CA C 13 55.678 0.3 . 1 . . . . . 11 TYR CA . 27279 1 23 . 1 1 11 11 TYR CB C 13 42.456 0.3 . 1 . . . . . 11 TYR CB . 27279 1 24 . 1 1 11 11 TYR N N 15 116.692 0.3 . 1 . . . . . 11 TYR N . 27279 1 25 . 1 1 12 12 ALA H H 1 8.840 0.020 . 1 . . . . . 12 ALA H . 27279 1 26 . 1 1 12 12 ALA C C 13 174.556 0.3 . 1 . . . . . 12 ALA C . 27279 1 27 . 1 1 12 12 ALA CA C 13 51.605 0.3 . 1 . . . . . 12 ALA CA . 27279 1 28 . 1 1 12 12 ALA CB C 13 20.886 0.3 . 1 . . . . . 12 ALA CB . 27279 1 29 . 1 1 12 12 ALA N N 15 122.440 0.3 . 1 . . . . . 12 ALA N . 27279 1 30 . 1 1 13 13 VAL H H 1 8.585 0.020 . 1 . . . . . 13 VAL H . 27279 1 31 . 1 1 13 13 VAL C C 13 172.401 0.3 . 1 . . . . . 13 VAL C . 27279 1 32 . 1 1 13 13 VAL CA C 13 58.425 0.3 . 1 . . . . . 13 VAL CA . 27279 1 33 . 1 1 13 13 VAL CB C 13 33.123 0.3 . 1 . . . . . 13 VAL CB . 27279 1 34 . 1 1 13 13 VAL N N 15 123.469 0.3 . 1 . . . . . 13 VAL N . 27279 1 35 . 1 1 14 14 LEU H H 1 8.189 0.020 . 1 . . . . . 14 LEU H . 27279 1 36 . 1 1 14 14 LEU C C 13 175.068 0.3 . 1 . . . . . 14 LEU C . 27279 1 37 . 1 1 14 14 LEU CA C 13 52.279 0.3 . 1 . . . . . 14 LEU CA . 27279 1 38 . 1 1 14 14 LEU CB C 13 46.327 0.3 . 1 . . . . . 14 LEU CB . 27279 1 39 . 1 1 14 14 LEU N N 15 126.683 0.3 . 1 . . . . . 14 LEU N . 27279 1 40 . 1 1 15 15 GLN H H 1 8.627 0.020 . 1 . . . . . 15 GLN H . 27279 1 41 . 1 1 15 15 GLN C C 13 175.295 0.3 . 1 . . . . . 15 GLN C . 27279 1 42 . 1 1 15 15 GLN CA C 13 53.914 0.3 . 1 . . . . . 15 GLN CA . 27279 1 43 . 1 1 15 15 GLN CB C 13 29.666 0.3 . 1 . . . . . 15 GLN CB . 27279 1 44 . 1 1 15 15 GLN N N 15 122.576 0.3 . 1 . . . . . 15 GLN N . 27279 1 45 . 1 1 16 16 GLU H H 1 7.875 0.020 . 1 . . . . . 16 GLU H . 27279 1 46 . 1 1 16 16 GLU C C 13 176.952 0.3 . 1 . . . . . 16 GLU C . 27279 1 47 . 1 1 16 16 GLU CA C 13 57.451 0.3 . 1 . . . . . 16 GLU CA . 27279 1 48 . 1 1 16 16 GLU CB C 13 29.085 0.3 . 1 . . . . . 16 GLU CB . 27279 1 49 . 1 1 16 16 GLU N N 15 123.001 0.3 . 1 . . . . . 16 GLU N . 27279 1 50 . 1 1 17 17 GLY H H 1 9.674 0.020 . 1 . . . . . 17 GLY H . 27279 1 51 . 1 1 17 17 GLY C C 13 175.159 0.3 . 1 . . . . . 17 GLY C . 27279 1 52 . 1 1 17 17 GLY CA C 13 44.327 0.3 . 1 . . . . . 17 GLY CA . 27279 1 53 . 1 1 17 17 GLY N N 15 113.660 0.3 . 1 . . . . . 17 GLY N . 27279 1 54 . 1 1 18 18 GLN H H 1 7.710 0.020 . 1 . . . . . 18 GLN H . 27279 1 55 . 1 1 18 18 GLN C C 13 173.712 0.3 . 1 . . . . . 18 GLN C . 27279 1 56 . 1 1 18 18 GLN CA C 13 55.254 0.3 . 1 . . . . . 18 GLN CA . 27279 1 57 . 1 1 18 18 GLN CB C 13 29.459 0.3 . 1 . . . . . 18 GLN CB . 27279 1 58 . 1 1 18 18 GLN N N 15 120.832 0.3 . 1 . . . . . 18 GLN N . 27279 1 59 . 1 1 19 19 SER H H 1 8.113 0.020 . 1 . . . . . 19 SER H . 27279 1 60 . 1 1 19 19 SER C C 13 172.732 0.3 . 1 . . . . . 19 SER C . 27279 1 61 . 1 1 19 19 SER CA C 13 56.047 0.3 . 1 . . . . . 19 SER CA . 27279 1 62 . 1 1 19 19 SER CB C 13 65.062 0.3 . 1 . . . . . 19 SER CB . 27279 1 63 . 1 1 19 19 SER N N 15 113.708 0.3 . 1 . . . . . 19 SER N . 27279 1 64 . 1 1 20 20 VAL H H 1 8.405 0.020 . 1 . . . . . 20 VAL H . 27279 1 65 . 1 1 20 20 VAL C C 13 170.652 0.3 . 1 . . . . . 20 VAL C . 27279 1 66 . 1 1 20 20 VAL CA C 13 59.743 0.3 . 1 . . . . . 20 VAL CA . 27279 1 67 . 1 1 20 20 VAL CB C 13 33.261 0.3 . 1 . . . . . 20 VAL CB . 27279 1 68 . 1 1 20 20 VAL N N 15 121.152 0.3 . 1 . . . . . 20 VAL N . 27279 1 69 . 1 1 21 21 SER H H 1 7.415 0.020 . 1 . . . . . 21 SER H . 27279 1 70 . 1 1 21 21 SER C C 13 171.813 0.3 . 1 . . . . . 21 SER C . 27279 1 71 . 1 1 21 21 SER CA C 13 56.133 0.3 . 1 . . . . . 21 SER CA . 27279 1 72 . 1 1 21 21 SER CB C 13 64.647 0.3 . 1 . . . . . 21 SER CB . 27279 1 73 . 1 1 21 21 SER N N 15 119.503 0.3 . 1 . . . . . 21 SER N . 27279 1 74 . 1 1 22 22 PHE H H 1 9.144 0.020 . 1 . . . . . 22 PHE H . 27279 1 75 . 1 1 22 22 PHE C C 13 174.209 0.3 . 1 . . . . . 22 PHE C . 27279 1 76 . 1 1 22 22 PHE CA C 13 52.905 0.3 . 1 . . . . . 22 PHE CA . 27279 1 77 . 1 1 22 22 PHE CB C 13 39.760 0.3 . 1 . . . . . 22 PHE CB . 27279 1 78 . 1 1 22 22 PHE N N 15 124.262 0.3 . 1 . . . . . 22 PHE N . 27279 1 79 . 1 1 23 23 TRP H H 1 9.235 0.020 . 1 . . . . . 23 TRP H . 27279 1 80 . 1 1 23 23 TRP C C 13 175.822 0.3 . 1 . . . . . 23 TRP C . 27279 1 81 . 1 1 23 23 TRP CA C 13 56.964 0.3 . 1 . . . . . 23 TRP CA . 27279 1 82 . 1 1 23 23 TRP CB C 13 31.602 0.3 . 1 . . . . . 23 TRP CB . 27279 1 83 . 1 1 23 23 TRP N N 15 122.760 0.3 . 1 . . . . . 23 TRP N . 27279 1 84 . 1 1 24 24 CYS H H 1 8.861 0.020 . 1 . . . . . 24 CYS H . 27279 1 85 . 1 1 24 24 CYS C C 13 170.954 0.3 . 1 . . . . . 24 CYS C . 27279 1 86 . 1 1 24 24 CYS CA C 13 52.670 0.3 . 1 . . . . . 24 CYS CA . 27279 1 87 . 1 1 24 24 CYS CB C 13 43.769 0.3 . 1 . . . . . 24 CYS CB . 27279 1 88 . 1 1 24 24 CYS N N 15 125.325 0.3 . 1 . . . . . 24 CYS N . 27279 1 89 . 1 1 25 25 ASP H H 1 8.837 0.020 . 1 . . . . . 25 ASP H . 27279 1 90 . 1 1 25 25 ASP C C 13 173.501 0.3 . 1 . . . . . 25 ASP C . 27279 1 91 . 1 1 25 25 ASP CA C 13 49.265 0.3 . 1 . . . . . 25 ASP CA . 27279 1 92 . 1 1 25 25 ASP CB C 13 42.524 0.3 . 1 . . . . . 25 ASP CB . 27279 1 93 . 1 1 25 25 ASP N N 15 128.593 0.3 . 1 . . . . . 25 ASP N . 27279 1 94 . 1 1 27 27 ILE H H 1 6.506 0.020 . 1 . . . . . 27 ILE H . 27279 1 95 . 1 1 27 27 ILE C C 13 176.259 0.3 . 1 . . . . . 27 ILE C . 27279 1 96 . 1 1 27 27 ILE CA C 13 62.064 0.3 . 1 . . . . . 27 ILE CA . 27279 1 97 . 1 1 27 27 ILE CB C 13 35.335 0.3 . 1 . . . . . 27 ILE CB . 27279 1 98 . 1 1 27 27 ILE N N 15 121.402 0.3 . 1 . . . . . 27 ILE N . 27279 1 99 . 1 1 28 28 SER H H 1 7.944 0.020 . 1 . . . . . 28 SER H . 27279 1 100 . 1 1 28 28 SER C C 13 175.626 0.3 . 1 . . . . . 28 SER C . 27279 1 101 . 1 1 28 28 SER CA C 13 59.084 0.3 . 1 . . . . . 28 SER CA . 27279 1 102 . 1 1 28 28 SER CB C 13 61.882 0.3 . 1 . . . . . 28 SER CB . 27279 1 103 . 1 1 28 28 SER N N 15 121.574 0.3 . 1 . . . . . 28 SER N . 27279 1 104 . 1 1 29 29 GLY H H 1 8.741 0.020 . 1 . . . . . 29 GLY H . 27279 1 105 . 1 1 29 29 GLY C C 13 175.325 0.3 . 1 . . . . . 29 GLY C . 27279 1 106 . 1 1 29 29 GLY CA C 13 44.525 0.3 . 1 . . . . . 29 GLY CA . 27279 1 107 . 1 1 29 29 GLY N N 15 114.524 0.3 . 1 . . . . . 29 GLY N . 27279 1 108 . 1 1 30 30 HIS H H 1 7.958 0.020 . 1 . . . . . 30 HIS H . 27279 1 109 . 1 1 30 30 HIS C C 13 176.018 0.3 . 1 . . . . . 30 HIS C . 27279 1 110 . 1 1 30 30 HIS CA C 13 56.060 0.3 . 1 . . . . . 30 HIS CA . 27279 1 111 . 1 1 30 30 HIS CB C 13 30.772 0.3 . 1 . . . . . 30 HIS CB . 27279 1 112 . 1 1 30 30 HIS N N 15 121.818 0.3 . 1 . . . . . 30 HIS N . 27279 1 113 . 1 1 31 31 ASP H H 1 8.703 0.020 . 1 . . . . . 31 ASP H . 27279 1 114 . 1 1 31 31 ASP C C 13 177.857 0.3 . 1 . . . . . 31 ASP C . 27279 1 115 . 1 1 31 31 ASP CA C 13 54.197 0.3 . 1 . . . . . 31 ASP CA . 27279 1 116 . 1 1 31 31 ASP CB C 13 39.760 0.3 . 1 . . . . . 31 ASP CB . 27279 1 117 . 1 1 31 31 ASP N N 15 125.486 0.3 . 1 . . . . . 31 ASP N . 27279 1 118 . 1 1 32 32 THR H H 1 8.758 0.020 . 1 . . . . . 32 THR H . 27279 1 119 . 1 1 32 32 THR C C 13 171.677 0.3 . 1 . . . . . 32 THR C . 27279 1 120 . 1 1 32 32 THR CA C 13 62.093 0.3 . 1 . . . . . 32 THR CA . 27279 1 121 . 1 1 32 32 THR CB C 13 68.865 0.3 . 1 . . . . . 32 THR CB . 27279 1 122 . 1 1 32 32 THR N N 15 126.212 0.3 . 1 . . . . . 32 THR N . 27279 1 123 . 1 1 33 33 LEU H H 1 7.852 0.020 . 1 . . . . . 33 LEU H . 27279 1 124 . 1 1 33 33 LEU C C 13 173.757 0.3 . 1 . . . . . 33 LEU C . 27279 1 125 . 1 1 33 33 LEU CA C 13 53.554 0.3 . 1 . . . . . 33 LEU CA . 27279 1 126 . 1 1 33 33 LEU CB C 13 44.599 0.3 . 1 . . . . . 33 LEU CB . 27279 1 127 . 1 1 33 33 LEU N N 15 127.548 0.3 . 1 . . . . . 33 LEU N . 27279 1 128 . 1 1 34 34 TYR H H 1 9.379 0.020 . 1 . . . . . 34 TYR H . 27279 1 129 . 1 1 34 34 TYR C C 13 174.752 0.3 . 1 . . . . . 34 TYR C . 27279 1 130 . 1 1 34 34 TYR CA C 13 54.815 0.3 . 1 . . . . . 34 TYR CA . 27279 1 131 . 1 1 34 34 TYR CB C 13 41.903 0.3 . 1 . . . . . 34 TYR CB . 27279 1 132 . 1 1 34 34 TYR N N 15 124.904 0.3 . 1 . . . . . 34 TYR N . 27279 1 133 . 1 1 35 35 TRP H H 1 8.576 0.020 . 1 . . . . . 35 TRP H . 27279 1 134 . 1 1 35 35 TRP C C 13 175.536 0.3 . 1 . . . . . 35 TRP C . 27279 1 135 . 1 1 35 35 TRP CA C 13 55.875 0.3 . 1 . . . . . 35 TRP CA . 27279 1 136 . 1 1 35 35 TRP CB C 13 32.293 0.3 . 1 . . . . . 35 TRP CB . 27279 1 137 . 1 1 35 35 TRP N N 15 117.945 0.3 . 1 . . . . . 35 TRP N . 27279 1 138 . 1 1 36 36 TYR H H 1 9.993 0.020 . 1 . . . . . 36 TYR H . 27279 1 139 . 1 1 36 36 TYR C C 13 174.827 0.3 . 1 . . . . . 36 TYR C . 27279 1 140 . 1 1 36 36 TYR CA C 13 56.091 0.3 . 1 . . . . . 36 TYR CA . 27279 1 141 . 1 1 36 36 TYR CB C 13 42.594 0.3 . 1 . . . . . 36 TYR CB . 27279 1 142 . 1 1 36 36 TYR N N 15 119.921 0.3 . 1 . . . . . 36 TYR N . 27279 1 143 . 1 1 37 37 GLN H H 1 9.430 0.020 . 1 . . . . . 37 GLN H . 27279 1 144 . 1 1 37 37 GLN C C 13 173.968 0.3 . 1 . . . . . 37 GLN C . 27279 1 145 . 1 1 37 37 GLN CA C 13 53.697 0.3 . 1 . . . . . 37 GLN CA . 27279 1 146 . 1 1 37 37 GLN CB C 13 32.501 0.3 . 1 . . . . . 37 GLN CB . 27279 1 147 . 1 1 37 37 GLN N N 15 122.100 0.3 . 1 . . . . . 37 GLN N . 27279 1 148 . 1 1 38 38 GLN H H 1 9.433 0.020 . 1 . . . . . 38 GLN H . 27279 1 149 . 1 1 38 38 GLN C C 13 172.612 0.3 . 1 . . . . . 38 GLN C . 27279 1 150 . 1 1 38 38 GLN CA C 13 52.064 0.3 . 1 . . . . . 38 GLN CA . 27279 1 151 . 1 1 38 38 GLN CB C 13 29.528 0.3 . 1 . . . . . 38 GLN CB . 27279 1 152 . 1 1 38 38 GLN N N 15 129.336 0.3 . 1 . . . . . 38 GLN N . 27279 1 153 . 1 1 40 40 ARG H H 1 8.451 0.020 . 1 . . . . . 40 ARG H . 27279 1 154 . 1 1 40 40 ARG C C 13 176.576 0.3 . 1 . . . . . 40 ARG C . 27279 1 155 . 1 1 40 40 ARG CA C 13 57.131 0.3 . 1 . . . . . 40 ARG CA . 27279 1 156 . 1 1 40 40 ARG CB C 13 29.044 0.3 . 1 . . . . . 40 ARG CB . 27279 1 157 . 1 1 40 40 ARG N N 15 121.300 0.3 . 1 . . . . . 40 ARG N . 27279 1 158 . 1 1 41 41 ASP H H 1 8.729 0.020 . 1 . . . . . 41 ASP H . 27279 1 159 . 1 1 41 41 ASP C C 13 174.571 0.3 . 1 . . . . . 41 ASP C . 27279 1 160 . 1 1 41 41 ASP CA C 13 55.442 0.3 . 1 . . . . . 41 ASP CA . 27279 1 161 . 1 1 41 41 ASP CB C 13 38.999 0.3 . 1 . . . . . 41 ASP CB . 27279 1 162 . 1 1 41 41 ASP N N 15 119.069 0.3 . 1 . . . . . 41 ASP N . 27279 1 163 . 1 1 42 42 GLN H H 1 7.620 0.020 . 1 . . . . . 42 GLN H . 27279 1 164 . 1 1 42 42 GLN C C 13 175.264 0.3 . 1 . . . . . 42 GLN C . 27279 1 165 . 1 1 42 42 GLN CA C 13 53.531 0.3 . 1 . . . . . 42 GLN CA . 27279 1 166 . 1 1 42 42 GLN CB C 13 31.879 0.3 . 1 . . . . . 42 GLN CB . 27279 1 167 . 1 1 42 42 GLN N N 15 117.547 0.3 . 1 . . . . . 42 GLN N . 27279 1 168 . 1 1 43 43 GLY H H 1 8.220 0.020 . 1 . . . . . 43 GLY H . 27279 1 169 . 1 1 43 43 GLY C C 13 171.542 0.3 . 1 . . . . . 43 GLY C . 27279 1 170 . 1 1 43 43 GLY CA C 13 43.677 0.3 . 1 . . . . . 43 GLY CA . 27279 1 171 . 1 1 43 43 GLY N N 15 106.584 0.3 . 1 . . . . . 43 GLY N . 27279 1 172 . 1 1 45 45 GLN H H 1 9.021 0.020 . 1 . . . . . 45 GLN H . 27279 1 173 . 1 1 45 45 GLN C C 13 175.144 0.3 . 1 . . . . . 45 GLN C . 27279 1 174 . 1 1 45 45 GLN CA C 13 53.257 0.3 . 1 . . . . . 45 GLN CA . 27279 1 175 . 1 1 45 45 GLN CB C 13 29.805 0.3 . 1 . . . . . 45 GLN CB . 27279 1 176 . 1 1 45 45 GLN N N 15 123.933 0.3 . 1 . . . . . 45 GLN N . 27279 1 177 . 1 1 46 46 LEU H H 1 8.864 0.020 . 1 . . . . . 46 LEU H . 27279 1 178 . 1 1 46 46 LEU C C 13 175.611 0.3 . 1 . . . . . 46 LEU C . 27279 1 179 . 1 1 46 46 LEU CA C 13 55.904 0.3 . 1 . . . . . 46 LEU CA . 27279 1 180 . 1 1 46 46 LEU CB C 13 40.728 0.3 . 1 . . . . . 46 LEU CB . 27279 1 181 . 1 1 46 46 LEU N N 15 129.975 0.3 . 1 . . . . . 46 LEU N . 27279 1 182 . 1 1 47 47 LEU H H 1 9.091 0.020 . 1 . . . . . 47 LEU H . 27279 1 183 . 1 1 47 47 LEU C C 13 175.626 0.3 . 1 . . . . . 47 LEU C . 27279 1 184 . 1 1 47 47 LEU CA C 13 55.216 0.3 . 1 . . . . . 47 LEU CA . 27279 1 185 . 1 1 47 47 LEU CB C 13 43.216 0.3 . 1 . . . . . 47 LEU CB . 27279 1 186 . 1 1 47 47 LEU N N 15 125.333 0.3 . 1 . . . . . 47 LEU N . 27279 1 187 . 1 1 49 49 TYR H H 1 7.588 0.020 . 1 . . . . . 49 TYR H . 27279 1 188 . 1 1 49 49 TYR C C 13 172.205 0.3 . 1 . . . . . 49 TYR C . 27279 1 189 . 1 1 49 49 TYR CA C 13 55.015 0.3 . 1 . . . . . 49 TYR CA . 27279 1 190 . 1 1 49 49 TYR CB C 13 41.142 0.3 . 1 . . . . . 49 TYR CB . 27279 1 191 . 1 1 49 49 TYR N N 15 121.674 0.3 . 1 . . . . . 49 TYR N . 27279 1 192 . 1 1 50 50 PHE H H 1 9.258 0.020 . 1 . . . . . 50 PHE H . 27279 1 193 . 1 1 50 50 PHE C C 13 175.279 0.3 . 1 . . . . . 50 PHE C . 27279 1 194 . 1 1 50 50 PHE CA C 13 56.075 0.3 . 1 . . . . . 50 PHE CA . 27279 1 195 . 1 1 50 50 PHE CB C 13 44.253 0.3 . 1 . . . . . 50 PHE CB . 27279 1 196 . 1 1 50 50 PHE N N 15 119.920 0.3 . 1 . . . . . 50 PHE N . 27279 1 197 . 1 1 51 51 ARG H H 1 8.357 0.020 . 1 . . . . . 51 ARG H . 27279 1 198 . 1 1 51 51 ARG C C 13 176.545 0.3 . 1 . . . . . 51 ARG C . 27279 1 199 . 1 1 51 51 ARG CA C 13 55.019 0.3 . 1 . . . . . 51 ARG CA . 27279 1 200 . 1 1 51 51 ARG CB C 13 30.219 0.3 . 1 . . . . . 51 ARG CB . 27279 1 201 . 1 1 51 51 ARG N N 15 120.087 0.3 . 1 . . . . . 51 ARG N . 27279 1 202 . 1 1 52 52 ASP H H 1 9.506 0.020 . 1 . . . . . 52 ASP H . 27279 1 203 . 1 1 52 52 ASP C C 13 175.430 0.3 . 1 . . . . . 52 ASP C . 27279 1 204 . 1 1 52 52 ASP CA C 13 56.534 0.3 . 1 . . . . . 52 ASP CA . 27279 1 205 . 1 1 52 52 ASP CB C 13 39.276 0.3 . 1 . . . . . 52 ASP CB . 27279 1 206 . 1 1 52 52 ASP N N 15 126.531 0.3 . 1 . . . . . 52 ASP N . 27279 1 207 . 1 1 53 53 GLU H H 1 9.646 0.020 . 1 . . . . . 53 GLU H . 27279 1 208 . 1 1 53 53 GLU C C 13 175.279 0.3 . 1 . . . . . 53 GLU C . 27279 1 209 . 1 1 53 53 GLU CA C 13 56.276 0.3 . 1 . . . . . 53 GLU CA . 27279 1 210 . 1 1 53 53 GLU CB C 13 28.560 0.3 . 1 . . . . . 53 GLU CB . 27279 1 211 . 1 1 53 53 GLU N N 15 126.116 0.3 . 1 . . . . . 53 GLU N . 27279 1 212 . 1 1 54 54 ALA H H 1 7.928 0.020 . 1 . . . . . 54 ALA H . 27279 1 213 . 1 1 54 54 ALA C C 13 176.651 0.3 . 1 . . . . . 54 ALA C . 27279 1 214 . 1 1 54 54 ALA CA C 13 50.948 0.3 . 1 . . . . . 54 ALA CA . 27279 1 215 . 1 1 54 54 ALA CB C 13 19.573 0.3 . 1 . . . . . 54 ALA CB . 27279 1 216 . 1 1 54 54 ALA N N 15 125.051 0.3 . 1 . . . . . 54 ALA N . 27279 1 217 . 1 1 55 55 VAL H H 1 8.355 0.020 . 1 . . . . . 55 VAL H . 27279 1 218 . 1 1 55 55 VAL C C 13 176.334 0.3 . 1 . . . . . 55 VAL C . 27279 1 219 . 1 1 55 55 VAL CA C 13 61.864 0.3 . 1 . . . . . 55 VAL CA . 27279 1 220 . 1 1 55 55 VAL CB C 13 31.187 0.3 . 1 . . . . . 55 VAL CB . 27279 1 221 . 1 1 55 55 VAL N N 15 123.245 0.3 . 1 . . . . . 55 VAL N . 27279 1 222 . 1 1 56 56 ILE H H 1 8.319 0.020 . 1 . . . . . 56 ILE H . 27279 1 223 . 1 1 56 56 ILE C C 13 175.792 0.3 . 1 . . . . . 56 ILE C . 27279 1 224 . 1 1 56 56 ILE CA C 13 59.514 0.3 . 1 . . . . . 56 ILE CA . 27279 1 225 . 1 1 56 56 ILE CB C 13 34.644 0.3 . 1 . . . . . 56 ILE CB . 27279 1 226 . 1 1 56 56 ILE N N 15 129.678 0.3 . 1 . . . . . 56 ILE N . 27279 1 227 . 1 1 57 57 ASP H H 1 6.337 0.020 . 1 . . . . . 57 ASP H . 27279 1 228 . 1 1 57 57 ASP C C 13 174.933 0.3 . 1 . . . . . 57 ASP C . 27279 1 229 . 1 1 57 57 ASP CA C 13 53.067 0.3 . 1 . . . . . 57 ASP CA . 27279 1 230 . 1 1 57 57 ASP CB C 13 42.732 0.3 . 1 . . . . . 57 ASP CB . 27279 1 231 . 1 1 57 57 ASP N N 15 117.218 0.3 . 1 . . . . . 57 ASP N . 27279 1 232 . 1 1 58 58 ASN H H 1 8.486 0.020 . 1 . . . . . 58 ASN H . 27279 1 233 . 1 1 58 58 ASN CA C 13 51.603 0.3 . 1 . . . . . 58 ASN CA . 27279 1 234 . 1 1 58 58 ASN CB C 13 37.850 0.3 . 1 . . . . . 58 ASN CB . 27279 1 235 . 1 1 58 58 ASN N N 15 124.239 0.3 . 1 . . . . . 58 ASN N . 27279 1 236 . 1 1 59 59 SER H H 1 8.650 0.020 . 1 . . . . . 59 SER H . 27279 1 237 . 1 1 59 59 SER C C 13 175.686 0.3 . 1 . . . . . 59 SER C . 27279 1 238 . 1 1 59 59 SER CA C 13 60.889 0.3 . 1 . . . . . 59 SER CA . 27279 1 239 . 1 1 59 59 SER CB C 13 62.297 0.3 . 1 . . . . . 59 SER CB . 27279 1 240 . 1 1 59 59 SER N N 15 118.781 0.3 . 1 . . . . . 59 SER N . 27279 1 241 . 1 1 60 60 GLN H H 1 8.551 0.020 . 1 . . . . . 60 GLN H . 27279 1 242 . 1 1 60 60 GLN C C 13 175.430 0.3 . 1 . . . . . 60 GLN C . 27279 1 243 . 1 1 60 60 GLN CA C 13 54.127 0.3 . 1 . . . . . 60 GLN CA . 27279 1 244 . 1 1 60 60 GLN CB C 13 27.454 0.3 . 1 . . . . . 60 GLN CB . 27279 1 245 . 1 1 60 60 GLN N N 15 119.910 0.3 . 1 . . . . . 60 GLN N . 27279 1 246 . 1 1 61 61 LEU H H 1 7.326 0.020 . 1 . . . . . 61 LEU H . 27279 1 247 . 1 1 61 61 LEU C C 13 176.259 0.3 . 1 . . . . . 61 LEU C . 27279 1 248 . 1 1 61 61 LEU CA C 13 52.465 0.3 . 1 . . . . . 61 LEU CA . 27279 1 249 . 1 1 61 61 LEU CB C 13 41.004 0.3 . 1 . . . . . 61 LEU CB . 27279 1 250 . 1 1 61 61 LEU N N 15 123.364 0.3 . 1 . . . . . 61 LEU N . 27279 1 251 . 1 1 63 63 SER H H 1 7.625 0.020 . 1 . . . . . 63 SER H . 27279 1 252 . 1 1 63 63 SER C C 13 174.390 0.3 . 1 . . . . . 63 SER C . 27279 1 253 . 1 1 63 63 SER CA C 13 58.024 0.3 . 1 . . . . . 63 SER CA . 27279 1 254 . 1 1 63 63 SER CB C 13 63.190 0.3 . 1 . . . . . 63 SER CB . 27279 1 255 . 1 1 63 63 SER N N 15 115.660 0.3 . 1 . . . . . 63 SER N . 27279 1 256 . 1 1 64 64 ASP H H 1 8.688 0.020 . 1 . . . . . 64 ASP H . 27279 1 257 . 1 1 64 64 ASP CA C 13 54.915 0.3 . 1 . . . . . 64 ASP CA . 27279 1 258 . 1 1 64 64 ASP N N 15 121.309 0.3 . 1 . . . . . 64 ASP N . 27279 1 259 . 1 1 65 65 ARG H H 1 7.759 0.020 . 1 . . . . . 65 ARG H . 27279 1 260 . 1 1 65 65 ARG C C 13 175.415 0.3 . 1 . . . . . 65 ARG C . 27279 1 261 . 1 1 65 65 ARG CA C 13 56.935 0.3 . 1 . . . . . 65 ARG CA . 27279 1 262 . 1 1 65 65 ARG CB C 13 30.012 0.3 . 1 . . . . . 65 ARG CB . 27279 1 263 . 1 1 65 65 ARG N N 15 117.041 0.3 . 1 . . . . . 65 ARG N . 27279 1 264 . 1 1 66 66 PHE H H 1 7.973 0.020 . 1 . . . . . 66 PHE H . 27279 1 265 . 1 1 66 66 PHE C C 13 174.873 0.3 . 1 . . . . . 66 PHE C . 27279 1 266 . 1 1 66 66 PHE CA C 13 55.332 0.3 . 1 . . . . . 66 PHE CA . 27279 1 267 . 1 1 66 66 PHE CB C 13 41.004 0.3 . 1 . . . . . 66 PHE CB . 27279 1 268 . 1 1 66 66 PHE N N 15 119.795 0.3 . 1 . . . . . 66 PHE N . 27279 1 269 . 1 1 67 67 SER H H 1 8.740 0.020 . 1 . . . . . 67 SER H . 27279 1 270 . 1 1 67 67 SER C C 13 171.858 0.3 . 1 . . . . . 67 SER C . 27279 1 271 . 1 1 67 67 SER CA C 13 56.569 0.3 . 1 . . . . . 67 SER CA . 27279 1 272 . 1 1 67 67 SER CB C 13 64.717 0.3 . 1 . . . . . 67 SER CB . 27279 1 273 . 1 1 67 67 SER N N 15 113.214 0.3 . 1 . . . . . 67 SER N . 27279 1 274 . 1 1 68 68 ALA H H 1 8.669 0.020 . 1 . . . . . 68 ALA H . 27279 1 275 . 1 1 68 68 ALA C C 13 175.355 0.3 . 1 . . . . . 68 ALA C . 27279 1 276 . 1 1 68 68 ALA CA C 13 50.316 0.3 . 1 . . . . . 68 ALA CA . 27279 1 277 . 1 1 68 68 ALA CB C 13 22.615 0.3 . 1 . . . . . 68 ALA CB . 27279 1 278 . 1 1 68 68 ALA N N 15 124.513 0.3 . 1 . . . . . 68 ALA N . 27279 1 279 . 1 1 69 69 VAL H H 1 8.432 0.020 . 1 . . . . . 69 VAL H . 27279 1 280 . 1 1 69 69 VAL C C 13 175.445 0.3 . 1 . . . . . 69 VAL C . 27279 1 281 . 1 1 69 69 VAL CA C 13 58.884 0.3 . 1 . . . . . 69 VAL CA . 27279 1 282 . 1 1 69 69 VAL CB C 13 35.957 0.3 . 1 . . . . . 69 VAL CB . 27279 1 283 . 1 1 69 69 VAL N N 15 113.686 0.3 . 1 . . . . . 69 VAL N . 27279 1 284 . 1 1 70 70 ARG H H 1 9.335 0.020 . 1 . . . . . 70 ARG H . 27279 1 285 . 1 1 70 70 ARG C C 13 173.983 0.3 . 1 . . . . . 70 ARG C . 27279 1 286 . 1 1 70 70 ARG CA C 13 53.414 0.3 . 1 . . . . . 70 ARG CA . 27279 1 287 . 1 1 70 70 ARG CB C 13 28.698 0.3 . 1 . . . . . 70 ARG CB . 27279 1 288 . 1 1 70 70 ARG N N 15 128.434 0.3 . 1 . . . . . 70 ARG N . 27279 1 289 . 1 1 72 72 LYS H H 1 8.723 0.020 . 1 . . . . . 72 LYS H . 27279 1 290 . 1 1 72 72 LYS C C 13 176.734 0.3 . 1 . . . . . 72 LYS C . 27279 1 291 . 1 1 72 72 LYS CA C 13 53.492 0.3 . 1 . . . . . 72 LYS CA . 27279 1 292 . 1 1 72 72 LYS CB C 13 31.256 0.3 . 1 . . . . . 72 LYS CB . 27279 1 293 . 1 1 72 72 LYS N N 15 115.852 0.3 . 1 . . . . . 72 LYS N . 27279 1 294 . 1 1 73 73 GLY H H 1 7.736 0.020 . 1 . . . . . 73 GLY H . 27279 1 295 . 1 1 73 73 GLY C C 13 173.118 0.3 . 1 . . . . . 73 GLY C . 27279 1 296 . 1 1 73 73 GLY CA C 13 45.075 0.3 . 1 . . . . . 73 GLY CA . 27279 1 297 . 1 1 73 73 GLY N N 15 105.856 0.3 . 1 . . . . . 73 GLY N . 27279 1 298 . 1 1 74 74 THR H H 1 7.852 0.020 . 1 . . . . . 74 THR H . 27279 1 299 . 1 1 74 74 THR C C 13 174.556 0.3 . 1 . . . . . 74 THR C . 27279 1 300 . 1 1 74 74 THR CA C 13 58.241 0.3 . 1 . . . . . 74 THR CA . 27279 1 301 . 1 1 74 74 THR CB C 13 68.104 0.3 . 1 . . . . . 74 THR CB . 27279 1 302 . 1 1 74 74 THR N N 15 110.280 0.3 . 1 . . . . . 74 THR N . 27279 1 303 . 1 1 75 75 ASN H H 1 8.959 0.020 . 1 . . . . . 75 ASN H . 27279 1 304 . 1 1 75 75 ASN C C 13 173.682 0.3 . 1 . . . . . 75 ASN C . 27279 1 305 . 1 1 75 75 ASN CA C 13 52.878 0.3 . 1 . . . . . 75 ASN CA . 27279 1 306 . 1 1 75 75 ASN CB C 13 38.723 0.3 . 1 . . . . . 75 ASN CB . 27279 1 307 . 1 1 75 75 ASN N N 15 123.088 0.3 . 1 . . . . . 75 ASN N . 27279 1 308 . 1 1 76 76 SER H H 1 8.708 0.020 . 1 . . . . . 76 SER H . 27279 1 309 . 1 1 76 76 SER C C 13 172.763 0.3 . 1 . . . . . 76 SER C . 27279 1 310 . 1 1 76 76 SER CA C 13 54.598 0.3 . 1 . . . . . 76 SER CA . 27279 1 311 . 1 1 76 76 SER CB C 13 67.205 0.3 . 1 . . . . . 76 SER CB . 27279 1 312 . 1 1 76 76 SER N N 15 111.614 0.3 . 1 . . . . . 76 SER N . 27279 1 313 . 1 1 77 77 THR H H 1 7.804 0.020 . 1 . . . . . 77 THR H . 27279 1 314 . 1 1 77 77 THR C C 13 172.762 0.3 . 1 . . . . . 77 THR C . 27279 1 315 . 1 1 77 77 THR CA C 13 60.030 0.3 . 1 . . . . . 77 THR CA . 27279 1 316 . 1 1 77 77 THR CB C 13 70.662 0.3 . 1 . . . . . 77 THR CB . 27279 1 317 . 1 1 77 77 THR N N 15 122.448 0.3 . 1 . . . . . 77 THR N . 27279 1 318 . 1 1 78 78 LEU H H 1 8.564 0.020 . 1 . . . . . 78 LEU H . 27279 1 319 . 1 1 78 78 LEU C C 13 172.808 0.3 . 1 . . . . . 78 LEU C . 27279 1 320 . 1 1 78 78 LEU CA C 13 52.670 0.3 . 1 . . . . . 78 LEU CA . 27279 1 321 . 1 1 78 78 LEU CB C 13 41.142 0.3 . 1 . . . . . 78 LEU CB . 27279 1 322 . 1 1 78 78 LEU N N 15 130.959 0.3 . 1 . . . . . 78 LEU N . 27279 1 323 . 1 1 79 79 LYS H H 1 9.014 0.020 . 1 . . . . . 79 LYS H . 27279 1 324 . 1 1 79 79 LYS C C 13 174.496 0.3 . 1 . . . . . 79 LYS C . 27279 1 325 . 1 1 79 79 LYS CA C 13 53.754 0.3 . 1 . . . . . 79 LYS CA . 27279 1 326 . 1 1 79 79 LYS CB C 13 34.436 0.3 . 1 . . . . . 79 LYS CB . 27279 1 327 . 1 1 79 79 LYS N N 15 127.716 0.3 . 1 . . . . . 79 LYS N . 27279 1 328 . 1 1 80 80 ILE H H 1 8.113 0.020 . 1 . . . . . 80 ILE H . 27279 1 329 . 1 1 80 80 ILE C C 13 175.264 0.3 . 1 . . . . . 80 ILE C . 27279 1 330 . 1 1 80 80 ILE CA C 13 59.743 0.3 . 1 . . . . . 80 ILE CA . 27279 1 331 . 1 1 80 80 ILE CB C 13 38.792 0.3 . 1 . . . . . 80 ILE CB . 27279 1 332 . 1 1 80 80 ILE N N 15 124.288 0.3 . 1 . . . . . 80 ILE N . 27279 1 333 . 1 1 81 81 GLN H H 1 8.445 0.020 . 1 . . . . . 81 GLN H . 27279 1 334 . 1 1 81 81 GLN C C 13 174.677 0.3 . 1 . . . . . 81 GLN C . 27279 1 335 . 1 1 81 81 GLN CA C 13 53.525 0.3 . 1 . . . . . 81 GLN CA . 27279 1 336 . 1 1 81 81 GLN CB C 13 30.012 0.3 . 1 . . . . . 81 GLN CB . 27279 1 337 . 1 1 81 81 GLN N N 15 125.406 0.3 . 1 . . . . . 81 GLN N . 27279 1 338 . 1 1 82 82 SER H H 1 7.739 0.020 . 1 . . . . . 82 SER H . 27279 1 339 . 1 1 82 82 SER C C 13 173.938 0.3 . 1 . . . . . 82 SER C . 27279 1 340 . 1 1 82 82 SER CA C 13 56.563 0.3 . 1 . . . . . 82 SER CA . 27279 1 341 . 1 1 82 82 SER CB C 13 60.983 0.3 . 1 . . . . . 82 SER CB . 27279 1 342 . 1 1 82 82 SER N N 15 115.070 0.3 . 1 . . . . . 82 SER N . 27279 1 343 . 1 1 83 83 ALA H H 1 8.467 0.020 . 1 . . . . . 83 ALA H . 27279 1 344 . 1 1 83 83 ALA C C 13 177.028 0.3 . 1 . . . . . 83 ALA C . 27279 1 345 . 1 1 83 83 ALA CA C 13 52.465 0.3 . 1 . . . . . 83 ALA CA . 27279 1 346 . 1 1 83 83 ALA CB C 13 18.882 0.3 . 1 . . . . . 83 ALA CB . 27279 1 347 . 1 1 83 83 ALA N N 15 121.706 0.3 . 1 . . . . . 83 ALA N . 27279 1 348 . 1 1 84 84 LYS H H 1 8.998 0.020 . 1 . . . . . 84 LYS H . 27279 1 349 . 1 1 84 84 LYS C C 13 177.992 0.3 . 1 . . . . . 84 LYS C . 27279 1 350 . 1 1 84 84 LYS CA C 13 53.095 0.3 . 1 . . . . . 84 LYS CA . 27279 1 351 . 1 1 84 84 LYS CB C 13 35.266 0.3 . 1 . . . . . 84 LYS CB . 27279 1 352 . 1 1 84 84 LYS N N 15 121.485 0.3 . 1 . . . . . 84 LYS N . 27279 1 353 . 1 1 85 85 GLN H H 1 9.616 0.020 . 1 . . . . . 85 GLN H . 27279 1 354 . 1 1 85 85 GLN C C 13 179.062 0.3 . 1 . . . . . 85 GLN C . 27279 1 355 . 1 1 85 85 GLN CA C 13 59.743 0.3 . 1 . . . . . 85 GLN CA . 27279 1 356 . 1 1 85 85 GLN CB C 13 28.353 0.3 . 1 . . . . . 85 GLN CB . 27279 1 357 . 1 1 85 85 GLN N N 15 123.203 0.3 . 1 . . . . . 85 GLN N . 27279 1 358 . 1 1 87 87 ASP H H 1 8.325 0.020 . 1 . . . . . 87 ASP H . 27279 1 359 . 1 1 87 87 ASP C C 13 177.224 0.3 . 1 . . . . . 87 ASP C . 27279 1 360 . 1 1 87 87 ASP CA C 13 54.156 0.3 . 1 . . . . . 87 ASP CA . 27279 1 361 . 1 1 87 87 ASP CB C 13 40.036 0.3 . 1 . . . . . 87 ASP CB . 27279 1 362 . 1 1 87 87 ASP N N 15 120.274 0.3 . 1 . . . . . 87 ASP N . 27279 1 363 . 1 1 88 88 THR H H 1 7.801 0.020 . 1 . . . . . 88 THR H . 27279 1 364 . 1 1 88 88 THR C C 13 174.104 0.3 . 1 . . . . . 88 THR C . 27279 1 365 . 1 1 88 88 THR CA C 13 64.586 0.3 . 1 . . . . . 88 THR CA . 27279 1 366 . 1 1 88 88 THR CB C 13 69.999 0.3 . 1 . . . . . 88 THR CB . 27279 1 367 . 1 1 88 88 THR N N 15 120.361 0.3 . 1 . . . . . 88 THR N . 27279 1 368 . 1 1 89 89 ALA H H 1 8.943 0.020 . 1 . . . . . 89 ALA H . 27279 1 369 . 1 1 89 89 ALA C C 13 175.114 0.3 . 1 . . . . . 89 ALA C . 27279 1 370 . 1 1 89 89 ALA CA C 13 51.864 0.3 . 1 . . . . . 89 ALA CA . 27279 1 371 . 1 1 89 89 ALA CB C 13 18.674 0.3 . 1 . . . . . 89 ALA CB . 27279 1 372 . 1 1 89 89 ALA N N 15 130.751 0.3 . 1 . . . . . 89 ALA N . 27279 1 373 . 1 1 90 90 THR H H 1 7.525 0.020 . 1 . . . . . 90 THR H . 27279 1 374 . 1 1 90 90 THR C C 13 173.215 0.3 . 1 . . . . . 90 THR C . 27279 1 375 . 1 1 90 90 THR CA C 13 61.892 0.3 . 1 . . . . . 90 THR CA . 27279 1 376 . 1 1 90 90 THR CB C 13 68.173 0.3 . 1 . . . . . 90 THR CB . 27279 1 377 . 1 1 90 90 THR N N 15 115.207 0.3 . 1 . . . . . 90 THR N . 27279 1 378 . 1 1 91 91 TYR H H 1 9.449 0.020 . 1 . . . . . 91 TYR H . 27279 1 379 . 1 1 91 91 TYR C C 13 176.018 0.3 . 1 . . . . . 91 TYR C . 27279 1 380 . 1 1 91 91 TYR CA C 13 57.290 0.3 . 1 . . . . . 91 TYR CA . 27279 1 381 . 1 1 91 91 TYR CB C 13 38.170 0.3 . 1 . . . . . 91 TYR CB . 27279 1 382 . 1 1 91 91 TYR N N 15 127.728 0.3 . 1 . . . . . 91 TYR N . 27279 1 383 . 1 1 92 92 LEU H H 1 9.294 0.020 . 1 . . . . . 92 LEU H . 27279 1 384 . 1 1 92 92 LEU C C 13 173.290 0.3 . 1 . . . . . 92 LEU C . 27279 1 385 . 1 1 92 92 LEU CA C 13 53.649 0.3 . 1 . . . . . 92 LEU CA . 27279 1 386 . 1 1 92 92 LEU CB C 13 44.876 0.3 . 1 . . . . . 92 LEU CB . 27279 1 387 . 1 1 92 92 LEU N N 15 127.920 0.3 . 1 . . . . . 92 LEU N . 27279 1 388 . 1 1 93 93 CYS H H 1 7.938 0.020 . 1 . . . . . 93 CYS H . 27279 1 389 . 1 1 93 93 CYS C C 13 171.120 0.3 . 1 . . . . . 93 CYS C . 27279 1 390 . 1 1 93 93 CYS CA C 13 50.976 0.3 . 1 . . . . . 93 CYS CA . 27279 1 391 . 1 1 93 93 CYS CB C 13 43.424 0.3 . 1 . . . . . 93 CYS CB . 27279 1 392 . 1 1 93 93 CYS N N 15 121.999 0.3 . 1 . . . . . 93 CYS N . 27279 1 393 . 1 1 94 94 ALA H H 1 8.908 0.020 . 1 . . . . . 94 ALA H . 27279 1 394 . 1 1 94 94 ALA C C 13 175.084 0.3 . 1 . . . . . 94 ALA C . 27279 1 395 . 1 1 94 94 ALA CA C 13 49.265 0.3 . 1 . . . . . 94 ALA CA . 27279 1 396 . 1 1 94 94 ALA CB C 13 22.822 0.3 . 1 . . . . . 94 ALA CB . 27279 1 397 . 1 1 94 94 ALA N N 15 129.938 0.3 . 1 . . . . . 94 ALA N . 27279 1 398 . 1 1 95 95 SER H H 1 9.289 0.020 . 1 . . . . . 95 SER H . 27279 1 399 . 1 1 95 95 SER C C 13 172.205 0.3 . 1 . . . . . 95 SER C . 27279 1 400 . 1 1 95 95 SER CA C 13 57.394 0.3 . 1 . . . . . 95 SER CA . 27279 1 401 . 1 1 95 95 SER CB C 13 67.413 0.3 . 1 . . . . . 95 SER CB . 27279 1 402 . 1 1 95 95 SER N N 15 116.091 0.3 . 1 . . . . . 95 SER N . 27279 1 403 . 1 1 96 96 SER H H 1 9.013 0.020 . 1 . . . . . 96 SER H . 27279 1 404 . 1 1 96 96 SER C C 13 171.512 0.3 . 1 . . . . . 96 SER C . 27279 1 405 . 1 1 96 96 SER CA C 13 57.164 0.3 . 1 . . . . . 96 SER CA . 27279 1 406 . 1 1 96 96 SER CB C 13 66.583 0.3 . 1 . . . . . 96 SER CB . 27279 1 407 . 1 1 96 96 SER N N 15 114.258 0.3 . 1 . . . . . 96 SER N . 27279 1 408 . 1 1 97 97 SER H H 1 8.290 0.020 . 1 . . . . . 97 SER H . 27279 1 409 . 1 1 97 97 SER C C 13 175.807 0.3 . 1 . . . . . 97 SER C . 27279 1 410 . 1 1 97 97 SER CA C 13 55.273 0.3 . 1 . . . . . 97 SER CA . 27279 1 411 . 1 1 97 97 SER CB C 13 61.398 0.3 . 1 . . . . . 97 SER CB . 27279 1 412 . 1 1 97 97 SER N N 15 114.341 0.3 . 1 . . . . . 97 SER N . 27279 1 413 . 1 1 98 98 GLY H H 1 9.157 0.020 . 1 . . . . . 98 GLY H . 27279 1 414 . 1 1 98 98 GLY C C 13 173.456 0.3 . 1 . . . . . 98 GLY C . 27279 1 415 . 1 1 98 98 GLY CA C 13 43.639 0.3 . 1 . . . . . 98 GLY CA . 27279 1 416 . 1 1 98 98 GLY N N 15 117.892 0.3 . 1 . . . . . 98 GLY N . 27279 1 417 . 1 1 99 99 VAL H H 1 8.196 0.020 . 1 . . . . . 99 VAL H . 27279 1 418 . 1 1 99 99 VAL C C 13 177.374 0.3 . 1 . . . . . 99 VAL C . 27279 1 419 . 1 1 99 99 VAL CA C 13 61.663 0.3 . 1 . . . . . 99 VAL CA . 27279 1 420 . 1 1 99 99 VAL CB C 13 31.395 0.3 . 1 . . . . . 99 VAL CB . 27279 1 421 . 1 1 99 99 VAL N N 15 120.261 0.3 . 1 . . . . . 99 VAL N . 27279 1 422 . 1 1 100 100 GLY H H 1 8.560 0.020 . 1 . . . . . 100 GLY H . 27279 1 423 . 1 1 100 100 GLY C C 13 174.330 0.3 . 1 . . . . . 100 GLY C . 27279 1 424 . 1 1 100 100 GLY CA C 13 45.172 0.3 . 1 . . . . . 100 GLY CA . 27279 1 425 . 1 1 100 100 GLY N N 15 113.661 0.3 . 1 . . . . . 100 GLY N . 27279 1 426 . 1 1 101 101 THR H H 1 7.170 0.020 . 1 . . . . . 101 THR H . 27279 1 427 . 1 1 101 101 THR C C 13 173.561 0.3 . 1 . . . . . 101 THR C . 27279 1 428 . 1 1 101 101 THR CA C 13 59.411 0.3 . 1 . . . . . 101 THR CA . 27279 1 429 . 1 1 101 101 THR CB C 13 68.657 0.3 . 1 . . . . . 101 THR CB . 27279 1 430 . 1 1 101 101 THR N N 15 110.563 0.3 . 1 . . . . . 101 THR N . 27279 1 431 . 1 1 102 102 GLU H H 1 8.071 0.020 . 1 . . . . . 102 GLU H . 27279 1 432 . 1 1 102 102 GLU C C 13 174.435 0.3 . 1 . . . . . 102 GLU C . 27279 1 433 . 1 1 102 102 GLU CA C 13 56.906 0.3 . 1 . . . . . 102 GLU CA . 27279 1 434 . 1 1 102 102 GLU CB C 13 28.870 0.3 . 1 . . . . . 102 GLU CB . 27279 1 435 . 1 1 102 102 GLU N N 15 121.269 0.3 . 1 . . . . . 102 GLU N . 27279 1 436 . 1 1 103 103 VAL H H 1 7.810 0.020 . 1 . . . . . 103 VAL H . 27279 1 437 . 1 1 103 103 VAL C C 13 175.159 0.3 . 1 . . . . . 103 VAL C . 27279 1 438 . 1 1 103 103 VAL CA C 13 60.790 0.3 . 1 . . . . . 103 VAL CA . 27279 1 439 . 1 1 103 103 VAL CB C 13 31.602 0.3 . 1 . . . . . 103 VAL CB . 27279 1 440 . 1 1 103 103 VAL N N 15 125.102 0.3 . 1 . . . . . 103 VAL N . 27279 1 441 . 1 1 104 104 PHE H H 1 8.995 0.020 . 1 . . . . . 104 PHE H . 27279 1 442 . 1 1 104 104 PHE C C 13 174.511 0.3 . 1 . . . . . 104 PHE C . 27279 1 443 . 1 1 104 104 PHE CA C 13 56.333 0.3 . 1 . . . . . 104 PHE CA . 27279 1 444 . 1 1 104 104 PHE CB C 13 39.621 0.3 . 1 . . . . . 104 PHE CB . 27279 1 445 . 1 1 104 104 PHE N N 15 128.244 0.3 . 1 . . . . . 104 PHE N . 27279 1 446 . 1 1 105 105 PHE H H 1 8.897 0.020 . 1 . . . . . 105 PHE H . 27279 1 447 . 1 1 105 105 PHE C C 13 178.821 0.3 . 1 . . . . . 105 PHE C . 27279 1 448 . 1 1 105 105 PHE CA C 13 57.808 0.3 . 1 . . . . . 105 PHE CA . 27279 1 449 . 1 1 105 105 PHE CB C 13 41.281 0.3 . 1 . . . . . 105 PHE CB . 27279 1 450 . 1 1 105 105 PHE N N 15 120.308 0.3 . 1 . . . . . 105 PHE N . 27279 1 451 . 1 1 106 106 GLY H H 1 9.124 0.020 . 1 . . . . . 106 GLY H . 27279 1 452 . 1 1 106 106 GLY C C 13 172.687 0.3 . 1 . . . . . 106 GLY C . 27279 1 453 . 1 1 106 106 GLY CA C 13 43.446 0.3 . 1 . . . . . 106 GLY CA . 27279 1 454 . 1 1 106 106 GLY N N 15 109.263 0.3 . 1 . . . . . 106 GLY N . 27279 1 455 . 1 1 107 107 LYS H H 1 8.850 0.020 . 1 . . . . . 107 LYS H . 27279 1 456 . 1 1 107 107 LYS C C 13 177.932 0.3 . 1 . . . . . 107 LYS C . 27279 1 457 . 1 1 107 107 LYS CA C 13 55.956 0.3 . 1 . . . . . 107 LYS CA . 27279 1 458 . 1 1 107 107 LYS CB C 13 31.612 0.3 . 1 . . . . . 107 LYS CB . 27279 1 459 . 1 1 107 107 LYS N N 15 115.329 0.3 . 1 . . . . . 107 LYS N . 27279 1 460 . 1 1 108 108 GLY H H 1 7.099 0.020 . 1 . . . . . 108 GLY H . 27279 1 461 . 1 1 108 108 GLY C C 13 172.114 0.3 . 1 . . . . . 108 GLY C . 27279 1 462 . 1 1 108 108 GLY CA C 13 44.325 0.3 . 1 . . . . . 108 GLY CA . 27279 1 463 . 1 1 108 108 GLY N N 15 105.021 0.3 . 1 . . . . . 108 GLY N . 27279 1 464 . 1 1 109 109 THR H H 1 8.200 0.020 . 1 . . . . . 109 THR H . 27279 1 465 . 1 1 109 109 THR C C 13 174.240 0.3 . 1 . . . . . 109 THR C . 27279 1 466 . 1 1 109 109 THR CA C 13 60.832 0.3 . 1 . . . . . 109 THR CA . 27279 1 467 . 1 1 109 109 THR CB C 13 71.233 0.3 . 1 . . . . . 109 THR CB . 27279 1 468 . 1 1 109 109 THR N N 15 118.228 0.3 . 1 . . . . . 109 THR N . 27279 1 469 . 1 1 110 110 ARG H H 1 7.971 0.020 . 1 . . . . . 110 ARG H . 27279 1 470 . 1 1 110 110 ARG C C 13 172.054 0.3 . 1 . . . . . 110 ARG C . 27279 1 471 . 1 1 110 110 ARG CA C 13 55.445 0.3 . 1 . . . . . 110 ARG CA . 27279 1 472 . 1 1 110 110 ARG CB C 13 28.560 0.3 . 1 . . . . . 110 ARG CB . 27279 1 473 . 1 1 110 110 ARG N N 15 129.177 0.3 . 1 . . . . . 110 ARG N . 27279 1 474 . 1 1 111 111 LEU H H 1 8.570 0.020 . 1 . . . . . 111 LEU H . 27279 1 475 . 1 1 111 111 LEU C C 13 177.194 0.3 . 1 . . . . . 111 LEU C . 27279 1 476 . 1 1 111 111 LEU CA C 13 52.465 0.3 . 1 . . . . . 111 LEU CA . 27279 1 477 . 1 1 111 111 LEU CB C 13 43.908 0.3 . 1 . . . . . 111 LEU CB . 27279 1 478 . 1 1 111 111 LEU N N 15 127.664 0.3 . 1 . . . . . 111 LEU N . 27279 1 479 . 1 1 112 112 THR H H 1 8.772 0.020 . 1 . . . . . 112 THR H . 27279 1 480 . 1 1 112 112 THR C C 13 171.934 0.3 . 1 . . . . . 112 THR C . 27279 1 481 . 1 1 112 112 THR CA C 13 62.551 0.3 . 1 . . . . . 112 THR CA . 27279 1 482 . 1 1 112 112 THR CB C 13 68.865 0.3 . 1 . . . . . 112 THR CB . 27279 1 483 . 1 1 112 112 THR N N 15 123.990 0.3 . 1 . . . . . 112 THR N . 27279 1 484 . 1 1 113 113 VAL H H 1 8.260 0.020 . 1 . . . . . 113 VAL H . 27279 1 485 . 1 1 113 113 VAL C C 13 175.279 0.3 . 1 . . . . . 113 VAL C . 27279 1 486 . 1 1 113 113 VAL CA C 13 59.342 0.3 . 1 . . . . . 113 VAL CA . 27279 1 487 . 1 1 113 113 VAL CB C 13 31.326 0.3 . 1 . . . . . 113 VAL CB . 27279 1 488 . 1 1 113 113 VAL N N 15 128.796 0.3 . 1 . . . . . 113 VAL N . 27279 1 489 . 1 1 114 114 VAL H H 1 8.916 0.020 . 1 . . . . . 114 VAL H . 27279 1 490 . 1 1 114 114 VAL C C 13 175.279 0.3 . 1 . . . . . 114 VAL C . 27279 1 491 . 1 1 114 114 VAL CA C 13 57.607 0.3 . 1 . . . . . 114 VAL CA . 27279 1 492 . 1 1 114 114 VAL CB C 13 33.192 0.3 . 1 . . . . . 114 VAL CB . 27279 1 493 . 1 1 114 114 VAL N N 15 119.627 0.3 . 1 . . . . . 114 VAL N . 27279 1 494 . 1 1 115 115 GLU H H 1 8.954 0.020 . 1 . . . . . 115 GLU H . 27279 1 495 . 1 1 115 115 GLU C C 13 176.591 0.3 . 1 . . . . . 115 GLU C . 27279 1 496 . 1 1 115 115 GLU CA C 13 58.263 0.3 . 1 . . . . . 115 GLU CA . 27279 1 497 . 1 1 115 115 GLU CB C 13 29.182 0.3 . 1 . . . . . 115 GLU CB . 27279 1 498 . 1 1 115 115 GLU N N 15 122.955 0.3 . 1 . . . . . 115 GLU N . 27279 1 499 . 1 1 116 116 ASP H H 1 7.777 0.020 . 1 . . . . . 116 ASP H . 27279 1 500 . 1 1 116 116 ASP C C 13 176.425 0.3 . 1 . . . . . 116 ASP C . 27279 1 501 . 1 1 116 116 ASP CA C 13 52.300 0.3 . 1 . . . . . 116 ASP CA . 27279 1 502 . 1 1 116 116 ASP CB C 13 42.525 0.3 . 1 . . . . . 116 ASP CB . 27279 1 503 . 1 1 116 116 ASP N N 15 116.757 0.3 . 1 . . . . . 116 ASP N . 27279 1 504 . 1 1 117 117 LEU H H 1 8.801 0.020 . 1 . . . . . 117 LEU H . 27279 1 505 . 1 1 117 117 LEU C C 13 177.721 0.3 . 1 . . . . . 117 LEU C . 27279 1 506 . 1 1 117 117 LEU CA C 13 56.534 0.3 . 1 . . . . . 117 LEU CA . 27279 1 507 . 1 1 117 117 LEU CB C 13 41.142 0.3 . 1 . . . . . 117 LEU CB . 27279 1 508 . 1 1 117 117 LEU N N 15 127.619 0.3 . 1 . . . . . 117 LEU N . 27279 1 509 . 1 1 118 118 ARG H H 1 8.582 0.020 . 1 . . . . . 118 ARG H . 27279 1 510 . 1 1 118 118 ARG C C 13 177.058 0.3 . 1 . . . . . 118 ARG C . 27279 1 511 . 1 1 118 118 ARG CA C 13 57.365 0.3 . 1 . . . . . 118 ARG CA . 27279 1 512 . 1 1 118 118 ARG CB C 13 28.215 0.3 . 1 . . . . . 118 ARG CB . 27279 1 513 . 1 1 118 118 ARG N N 15 116.002 0.3 . 1 . . . . . 118 ARG N . 27279 1 514 . 1 1 119 119 ASN H H 1 7.576 0.020 . 1 . . . . . 119 ASN H . 27279 1 515 . 1 1 119 119 ASN C C 13 175.837 0.3 . 1 . . . . . 119 ASN C . 27279 1 516 . 1 1 119 119 ASN CA C 13 53.926 0.3 . 1 . . . . . 119 ASN CA . 27279 1 517 . 1 1 119 119 ASN CB C 13 38.878 0.3 . 1 . . . . . 119 ASN CB . 27279 1 518 . 1 1 119 119 ASN N N 15 113.648 0.3 . 1 . . . . . 119 ASN N . 27279 1 519 . 1 1 120 120 VAL H H 1 8.083 0.020 . 1 . . . . . 120 VAL H . 27279 1 520 . 1 1 120 120 VAL C C 13 174.993 0.3 . 1 . . . . . 120 VAL C . 27279 1 521 . 1 1 120 120 VAL CA C 13 63.822 0.3 . 1 . . . . . 120 VAL CA . 27279 1 522 . 1 1 120 120 VAL CB C 13 29.898 0.3 . 1 . . . . . 120 VAL CB . 27279 1 523 . 1 1 120 120 VAL N N 15 124.091 0.3 . 1 . . . . . 120 VAL N . 27279 1 524 . 1 1 121 121 THR H H 1 9.388 0.020 . 1 . . . . . 121 THR H . 27279 1 525 . 1 1 121 121 THR C C 13 174.918 0.3 . 1 . . . . . 121 THR C . 27279 1 526 . 1 1 121 121 THR CA C 13 58.454 0.3 . 1 . . . . . 121 THR CA . 27279 1 527 . 1 1 121 121 THR CB C 13 72.467 0.3 . 1 . . . . . 121 THR CB . 27279 1 528 . 1 1 121 121 THR N N 15 123.707 0.3 . 1 . . . . . 121 THR N . 27279 1 529 . 1 1 124 124 LYS H H 1 8.558 0.020 . 1 . . . . . 124 LYS H . 27279 1 530 . 1 1 124 124 LYS C C 13 176.696 0.3 . 1 . . . . . 124 LYS C . 27279 1 531 . 1 1 124 124 LYS CA C 13 55.159 0.3 . 1 . . . . . 124 LYS CA . 27279 1 532 . 1 1 124 124 LYS CB C 13 31.681 0.3 . 1 . . . . . 124 LYS CB . 27279 1 533 . 1 1 124 124 LYS N N 15 119.180 0.3 . 1 . . . . . 124 LYS N . 27279 1 534 . 1 1 125 125 VAL H H 1 8.741 0.020 . 1 . . . . . 125 VAL H . 27279 1 535 . 1 1 125 125 VAL C C 13 174.511 0.3 . 1 . . . . . 125 VAL C . 27279 1 536 . 1 1 125 125 VAL CA C 13 60.603 0.3 . 1 . . . . . 125 VAL CA . 27279 1 537 . 1 1 125 125 VAL CB C 13 33.326 0.3 . 1 . . . . . 125 VAL CB . 27279 1 538 . 1 1 125 125 VAL N N 15 126.301 0.3 . 1 . . . . . 125 VAL N . 27279 1 539 . 1 1 126 126 SER H H 1 8.814 0.020 . 1 . . . . . 126 SER H . 27279 1 540 . 1 1 126 126 SER C C 13 169.959 0.3 . 1 . . . . . 126 SER C . 27279 1 541 . 1 1 126 126 SER CA C 13 56.105 0.3 . 1 . . . . . 126 SER CA . 27279 1 542 . 1 1 126 126 SER CB C 13 65.612 0.3 . 1 . . . . . 126 SER CB . 27279 1 543 . 1 1 126 126 SER N N 15 121.139 0.3 . 1 . . . . . 126 SER N . 27279 1 544 . 1 1 127 127 LEU H H 1 8.685 0.020 . 1 . . . . . 127 LEU H . 27279 1 545 . 1 1 127 127 LEU C C 13 175.355 0.3 . 1 . . . . . 127 LEU C . 27279 1 546 . 1 1 127 127 LEU CA C 13 52.895 0.3 . 1 . . . . . 127 LEU CA . 27279 1 547 . 1 1 127 127 LEU CB C 13 44.294 0.3 . 1 . . . . . 127 LEU CB . 27279 1 548 . 1 1 127 127 LEU N N 15 124.073 0.3 . 1 . . . . . 127 LEU N . 27279 1 549 . 1 1 128 128 ARG H H 1 9.151 0.020 . 1 . . . . . 128 ARG H . 27279 1 550 . 1 1 128 128 ARG C C 13 174.888 0.3 . 1 . . . . . 128 ARG C . 27279 1 551 . 1 1 128 128 ARG CA C 13 54.161 0.3 . 1 . . . . . 128 ARG CA . 27279 1 552 . 1 1 128 128 ARG CB C 13 39.084 0.3 . 1 . . . . . 128 ARG CB . 27279 1 553 . 1 1 128 128 ARG N N 15 126.531 0.3 . 1 . . . . . 128 ARG N . 27279 1 554 . 1 1 129 129 GLU H H 1 8.639 0.020 . 1 . . . . . 129 GLU H . 27279 1 555 . 1 1 129 129 GLU C C 13 173.456 0.3 . 1 . . . . . 129 GLU C . 27279 1 556 . 1 1 129 129 GLU CA C 13 54.233 0.3 . 1 . . . . . 129 GLU CA . 27279 1 557 . 1 1 129 129 GLU CB C 13 27.705 0.3 . 1 . . . . . 129 GLU CB . 27279 1 558 . 1 1 129 129 GLU N N 15 125.693 0.3 . 1 . . . . . 129 GLU N . 27279 1 559 . 1 1 131 131 SER H H 1 8.571 0.020 . 1 . . . . . 131 SER H . 27279 1 560 . 1 1 131 131 SER C C 13 175.400 0.3 . 1 . . . . . 131 SER C . 27279 1 561 . 1 1 131 131 SER CA C 13 56.305 0.3 . 1 . . . . . 131 SER CA . 27279 1 562 . 1 1 131 131 SER CB C 13 63.749 0.3 . 1 . . . . . 131 SER CB . 27279 1 563 . 1 1 131 131 SER N N 15 118.866 0.3 . 1 . . . . . 131 SER N . 27279 1 564 . 1 1 132 132 LYS H H 1 8.770 0.020 . 1 . . . . . 132 LYS H . 27279 1 565 . 1 1 132 132 LYS C C 13 178.931 0.3 . 1 . . . . . 132 LYS C . 27279 1 566 . 1 1 132 132 LYS CA C 13 58.867 0.3 . 1 . . . . . 132 LYS CA . 27279 1 567 . 1 1 132 132 LYS CB C 13 30.995 0.3 . 1 . . . . . 132 LYS CB . 27279 1 568 . 1 1 132 132 LYS N N 15 124.993 0.3 . 1 . . . . . 132 LYS N . 27279 1 569 . 1 1 133 133 ALA H H 1 8.232 0.020 . 1 . . . . . 133 ALA H . 27279 1 570 . 1 1 133 133 ALA C C 13 179.560 0.3 . 1 . . . . . 133 ALA C . 27279 1 571 . 1 1 133 133 ALA CA C 13 53.946 0.3 . 1 . . . . . 133 ALA CA . 27279 1 572 . 1 1 133 133 ALA CB C 13 17.354 0.3 . 1 . . . . . 133 ALA CB . 27279 1 573 . 1 1 133 133 ALA N N 15 121.182 0.3 . 1 . . . . . 133 ALA N . 27279 1 574 . 1 1 134 134 GLU H H 1 7.484 0.020 . 1 . . . . . 134 GLU H . 27279 1 575 . 1 1 134 134 GLU C C 13 179.243 0.3 . 1 . . . . . 134 GLU C . 27279 1 576 . 1 1 134 134 GLU CA C 13 58.024 0.3 . 1 . . . . . 134 GLU CA . 27279 1 577 . 1 1 134 134 GLU CB C 13 28.802 0.3 . 1 . . . . . 134 GLU CB . 27279 1 578 . 1 1 134 134 GLU N N 15 119.439 0.3 . 1 . . . . . 134 GLU N . 27279 1 579 . 1 1 135 135 ILE H H 1 7.631 0.020 . 1 . . . . . 135 ILE H . 27279 1 580 . 1 1 135 135 ILE C C 13 178.731 0.3 . 1 . . . . . 135 ILE C . 27279 1 581 . 1 1 135 135 ILE CA C 13 62.959 0.3 . 1 . . . . . 135 ILE CA . 27279 1 582 . 1 1 135 135 ILE CB C 13 28.733 0.3 . 1 . . . . . 135 ILE CB . 27279 1 583 . 1 1 135 135 ILE N N 15 119.729 0.3 . 1 . . . . . 135 ILE N . 27279 1 584 . 1 1 136 136 ALA H H 1 7.892 0.020 . 1 . . . . . 136 ALA H . 27279 1 585 . 1 1 136 136 ALA C C 13 178.836 0.3 . 1 . . . . . 136 ALA C . 27279 1 586 . 1 1 136 136 ALA CA C 13 53.731 0.3 . 1 . . . . . 136 ALA CA . 27279 1 587 . 1 1 136 136 ALA CB C 13 17.697 0.3 . 1 . . . . . 136 ALA CB . 27279 1 588 . 1 1 136 136 ALA N N 15 122.436 0.3 . 1 . . . . . 136 ALA N . 27279 1 589 . 1 1 137 137 ASN H H 1 8.047 0.020 . 1 . . . . . 137 ASN H . 27279 1 590 . 1 1 137 137 ASN C C 13 176.184 0.3 . 1 . . . . . 137 ASN C . 27279 1 591 . 1 1 137 137 ASN CA C 13 53.963 0.3 . 1 . . . . . 137 ASN CA . 27279 1 592 . 1 1 137 137 ASN CB C 13 38.604 0.3 . 1 . . . . . 137 ASN CB . 27279 1 593 . 1 1 137 137 ASN N N 15 114.363 0.3 . 1 . . . . . 137 ASN N . 27279 1 594 . 1 1 138 138 LYS H H 1 8.185 0.020 . 1 . . . . . 138 LYS H . 27279 1 595 . 1 1 138 138 LYS C C 13 175.958 0.3 . 1 . . . . . 138 LYS C . 27279 1 596 . 1 1 138 138 LYS CA C 13 55.244 0.3 . 1 . . . . . 138 LYS CA . 27279 1 597 . 1 1 138 138 LYS N N 15 116.242 0.3 . 1 . . . . . 138 LYS N . 27279 1 598 . 1 1 140 140 LYS H H 1 8.913 0.020 . 1 . . . . . 140 LYS H . 27279 1 599 . 1 1 140 140 LYS CA C 13 53.955 0.3 . 1 . . . . . 140 LYS CA . 27279 1 600 . 1 1 140 140 LYS N N 15 125.407 0.3 . 1 . . . . . 140 LYS N . 27279 1 601 . 1 1 141 141 ALA H H 1 8.658 0.020 . 1 . . . . . 141 ALA H . 27279 1 602 . 1 1 141 141 ALA C C 13 174.782 0.3 . 1 . . . . . 141 ALA C . 27279 1 603 . 1 1 141 141 ALA CA C 13 49.773 0.3 . 1 . . . . . 141 ALA CA . 27279 1 604 . 1 1 141 141 ALA CB C 13 20.850 0.3 . 1 . . . . . 141 ALA CB . 27279 1 605 . 1 1 141 141 ALA N N 15 122.954 0.3 . 1 . . . . . 141 ALA N . 27279 1 606 . 1 1 142 142 THR H H 1 8.708 0.020 . 1 . . . . . 142 THR H . 27279 1 607 . 1 1 142 142 THR C C 13 174.255 0.3 . 1 . . . . . 142 THR C . 27279 1 608 . 1 1 142 142 THR CA C 13 60.814 0.3 . 1 . . . . . 142 THR CA . 27279 1 609 . 1 1 142 142 THR CB C 13 67.326 0.3 . 1 . . . . . 142 THR CB . 27279 1 610 . 1 1 142 142 THR N N 15 119.648 0.3 . 1 . . . . . 142 THR N . 27279 1 611 . 1 1 143 143 LEU H H 1 8.871 0.020 . 1 . . . . . 143 LEU H . 27279 1 612 . 1 1 143 143 LEU C C 13 175.355 0.3 . 1 . . . . . 143 LEU C . 27279 1 613 . 1 1 143 143 LEU CA C 13 54.385 0.3 . 1 . . . . . 143 LEU CA . 27279 1 614 . 1 1 143 143 LEU CB C 13 42.648 0.3 . 1 . . . . . 143 LEU CB . 27279 1 615 . 1 1 143 143 LEU N N 15 129.790 0.3 . 1 . . . . . 143 LEU N . 27279 1 616 . 1 1 144 144 GLN H H 1 7.799 0.020 . 1 . . . . . 144 GLN H . 27279 1 617 . 1 1 144 144 GLN C C 13 174.044 0.3 . 1 . . . . . 144 GLN C . 27279 1 618 . 1 1 144 144 GLN CA C 13 55.015 0.3 . 1 . . . . . 144 GLN CA . 27279 1 619 . 1 1 144 144 GLN CB C 13 33.806 0.3 . 1 . . . . . 144 GLN CB . 27279 1 620 . 1 1 144 144 GLN N N 15 117.104 0.3 . 1 . . . . . 144 GLN N . 27279 1 621 . 1 1 147 147 ALA H H 1 9.189 0.020 . 1 . . . . . 147 ALA H . 27279 1 622 . 1 1 147 147 ALA C C 13 175.611 0.3 . 1 . . . . . 147 ALA C . 27279 1 623 . 1 1 147 147 ALA CA C 13 48.683 0.3 . 1 . . . . . 147 ALA CA . 27279 1 624 . 1 1 147 147 ALA CB C 13 20.096 0.3 . 1 . . . . . 147 ALA CB . 27279 1 625 . 1 1 147 147 ALA N N 15 128.724 0.3 . 1 . . . . . 147 ALA N . 27279 1 626 . 1 1 148 148 ARG H H 1 9.225 0.020 . 1 . . . . . 148 ARG H . 27279 1 627 . 1 1 148 148 ARG C C 13 176.048 0.3 . 1 . . . . . 148 ARG C . 27279 1 628 . 1 1 148 148 ARG CA C 13 54.784 0.3 . 1 . . . . . 148 ARG CA . 27279 1 629 . 1 1 148 148 ARG CB C 13 32.640 0.3 . 1 . . . . . 148 ARG CB . 27279 1 630 . 1 1 148 148 ARG N N 15 121.112 0.3 . 1 . . . . . 148 ARG N . 27279 1 631 . 1 1 149 149 GLY H H 1 8.105 0.020 . 1 . . . . . 149 GLY H . 27279 1 632 . 1 1 149 149 GLY C C 13 174.089 0.3 . 1 . . . . . 149 GLY C . 27279 1 633 . 1 1 149 149 GLY CA C 13 46.045 0.3 . 1 . . . . . 149 GLY CA . 27279 1 634 . 1 1 149 149 GLY N N 15 110.568 0.3 . 1 . . . . . 149 GLY N . 27279 1 635 . 1 1 150 150 PHE H H 1 7.327 0.020 . 1 . . . . . 150 PHE H . 27279 1 636 . 1 1 150 150 PHE C C 13 174.194 0.3 . 1 . . . . . 150 PHE C . 27279 1 637 . 1 1 150 150 PHE CA C 13 52.883 0.3 . 1 . . . . . 150 PHE CA . 27279 1 638 . 1 1 150 150 PHE CB C 13 40.866 0.3 . 1 . . . . . 150 PHE CB . 27279 1 639 . 1 1 150 150 PHE N N 15 112.492 0.3 . 1 . . . . . 150 PHE N . 27279 1 640 . 1 1 151 151 PHE H H 1 9.144 0.020 . 1 . . . . . 151 PHE H . 27279 1 641 . 1 1 151 151 PHE C C 13 174.194 0.3 . 1 . . . . . 151 PHE C . 27279 1 642 . 1 1 151 151 PHE CA C 13 57.365 0.3 . 1 . . . . . 151 PHE CA . 27279 1 643 . 1 1 151 151 PHE CB C 13 41.689 0.3 . 1 . . . . . 151 PHE CB . 27279 1 644 . 1 1 151 151 PHE N N 15 120.264 0.3 . 1 . . . . . 151 PHE N . 27279 1 645 . 1 1 153 153 ASP H H 1 8.346 0.020 . 1 . . . . . 153 ASP H . 27279 1 646 . 1 1 153 153 ASP C C 13 175.671 0.3 . 1 . . . . . 153 ASP C . 27279 1 647 . 1 1 153 153 ASP CA C 13 52.895 0.3 . 1 . . . . . 153 ASP CA . 27279 1 648 . 1 1 153 153 ASP CB C 13 35.543 0.3 . 1 . . . . . 153 ASP CB . 27279 1 649 . 1 1 153 153 ASP N N 15 116.940 0.3 . 1 . . . . . 153 ASP N . 27279 1 650 . 1 1 154 154 HIS H H 1 7.438 0.020 . 1 . . . . . 154 HIS H . 27279 1 651 . 1 1 154 154 HIS C C 13 173.049 0.3 . 1 . . . . . 154 HIS C . 27279 1 652 . 1 1 154 154 HIS CA C 13 51.577 0.3 . 1 . . . . . 154 HIS CA . 27279 1 653 . 1 1 154 154 HIS CB C 13 28.422 0.3 . 1 . . . . . 154 HIS CB . 27279 1 654 . 1 1 154 154 HIS N N 15 124.291 0.3 . 1 . . . . . 154 HIS N . 27279 1 655 . 1 1 155 155 VAL H H 1 7.308 0.020 . 1 . . . . . 155 VAL H . 27279 1 656 . 1 1 155 155 VAL C C 13 174.948 0.3 . 1 . . . . . 155 VAL C . 27279 1 657 . 1 1 155 155 VAL CA C 13 57.365 0.3 . 1 . . . . . 155 VAL CA . 27279 1 658 . 1 1 155 155 VAL CB C 13 35.039 0.3 . 1 . . . . . 155 VAL CB . 27279 1 659 . 1 1 155 155 VAL N N 15 112.606 0.3 . 1 . . . . . 155 VAL N . 27279 1 660 . 1 1 156 156 GLU H H 1 8.245 0.020 . 1 . . . . . 156 GLU H . 27279 1 661 . 1 1 156 156 GLU C C 13 174.451 0.3 . 1 . . . . . 156 GLU C . 27279 1 662 . 1 1 156 156 GLU CA C 13 54.416 0.3 . 1 . . . . . 156 GLU CA . 27279 1 663 . 1 1 156 156 GLU CB C 13 32.503 0.3 . 1 . . . . . 156 GLU CB . 27279 1 664 . 1 1 156 156 GLU N N 15 120.292 0.3 . 1 . . . . . 156 GLU N . 27279 1 665 . 1 1 157 157 LEU H H 1 9.237 0.020 . 1 . . . . . 157 LEU H . 27279 1 666 . 1 1 157 157 LEU C C 13 175.641 0.3 . 1 . . . . . 157 LEU C . 27279 1 667 . 1 1 157 157 LEU CA C 13 54.385 0.3 . 1 . . . . . 157 LEU CA . 27279 1 668 . 1 1 157 157 LEU CB C 13 44.431 0.3 . 1 . . . . . 157 LEU CB . 27279 1 669 . 1 1 157 157 LEU N N 15 131.329 0.3 . 1 . . . . . 157 LEU N . 27279 1 670 . 1 1 158 158 SER H H 1 9.708 0.020 . 1 . . . . . 158 SER H . 27279 1 671 . 1 1 158 158 SER C C 13 171.331 0.3 . 1 . . . . . 158 SER C . 27279 1 672 . 1 1 158 158 SER CA C 13 56.276 0.3 . 1 . . . . . 158 SER CA . 27279 1 673 . 1 1 158 158 SER CB C 13 65.955 0.3 . 1 . . . . . 158 SER CB . 27279 1 674 . 1 1 158 158 SER N N 15 122.567 0.3 . 1 . . . . . 158 SER N . 27279 1 675 . 1 1 159 159 TRP H H 1 8.858 0.020 . 1 . . . . . 159 TRP H . 27279 1 676 . 1 1 159 159 TRP C C 13 175.204 0.3 . 1 . . . . . 159 TRP C . 27279 1 677 . 1 1 159 159 TRP CA C 13 55.875 0.3 . 1 . . . . . 159 TRP CA . 27279 1 678 . 1 1 159 159 TRP CB C 13 32.298 0.3 . 1 . . . . . 159 TRP CB . 27279 1 679 . 1 1 159 159 TRP N N 15 120.915 0.3 . 1 . . . . . 159 TRP N . 27279 1 680 . 1 1 160 160 TRP H H 1 9.381 0.020 . 1 . . . . . 160 TRP H . 27279 1 681 . 1 1 160 160 TRP C C 13 176.787 0.3 . 1 . . . . . 160 TRP C . 27279 1 682 . 1 1 160 160 TRP CA C 13 54.823 0.3 . 1 . . . . . 160 TRP CA . 27279 1 683 . 1 1 160 160 TRP CB C 13 29.624 0.3 . 1 . . . . . 160 TRP CB . 27279 1 684 . 1 1 160 160 TRP N N 15 121.246 0.3 . 1 . . . . . 160 TRP N . 27279 1 685 . 1 1 161 161 VAL H H 1 9.233 0.020 . 1 . . . . . 161 VAL H . 27279 1 686 . 1 1 161 161 VAL C C 13 176.440 0.3 . 1 . . . . . 161 VAL C . 27279 1 687 . 1 1 161 161 VAL CA C 13 59.743 0.3 . 1 . . . . . 161 VAL CA . 27279 1 688 . 1 1 161 161 VAL CB C 13 32.366 0.3 . 1 . . . . . 161 VAL CB . 27279 1 689 . 1 1 161 161 VAL N N 15 127.233 0.3 . 1 . . . . . 161 VAL N . 27279 1 690 . 1 1 162 162 ASN H H 1 9.733 0.020 . 1 . . . . . 162 ASN H . 27279 1 691 . 1 1 162 162 ASN C C 13 175.897 0.3 . 1 . . . . . 162 ASN C . 27279 1 692 . 1 1 162 162 ASN CA C 13 54.156 0.3 . 1 . . . . . 162 ASN CA . 27279 1 693 . 1 1 162 162 ASN CB C 13 36.136 0.3 . 1 . . . . . 162 ASN CB . 27279 1 694 . 1 1 162 162 ASN N N 15 129.115 0.3 . 1 . . . . . 162 ASN N . 27279 1 695 . 1 1 163 163 GLY H H 1 8.911 0.020 . 1 . . . . . 163 GLY H . 27279 1 696 . 1 1 163 163 GLY C C 13 173.607 0.3 . 1 . . . . . 163 GLY C . 27279 1 697 . 1 1 163 163 GLY CA C 13 45.172 0.3 . 1 . . . . . 163 GLY CA . 27279 1 698 . 1 1 163 163 GLY N N 15 102.690 0.3 . 1 . . . . . 163 GLY N . 27279 1 699 . 1 1 164 164 LYS H H 1 7.753 0.020 . 1 . . . . . 164 LYS H . 27279 1 700 . 1 1 164 164 LYS C C 13 174.104 0.3 . 1 . . . . . 164 LYS C . 27279 1 701 . 1 1 164 164 LYS CA C 13 53.726 0.3 . 1 . . . . . 164 LYS CA . 27279 1 702 . 1 1 164 164 LYS CB C 13 34.080 0.3 . 1 . . . . . 164 LYS CB . 27279 1 703 . 1 1 164 164 LYS N N 15 121.415 0.3 . 1 . . . . . 164 LYS N . 27279 1 704 . 1 1 165 165 GLU H H 1 8.080 0.020 . 1 . . . . . 165 GLU H . 27279 1 705 . 1 1 165 165 GLU C C 13 176.726 0.3 . 1 . . . . . 165 GLU C . 27279 1 706 . 1 1 165 165 GLU CA C 13 55.674 0.3 . 1 . . . . . 165 GLU CA . 27279 1 707 . 1 1 165 165 GLU CB C 13 27.431 0.3 . 1 . . . . . 165 GLU CB . 27279 1 708 . 1 1 165 165 GLU N N 15 128.133 0.3 . 1 . . . . . 165 GLU N . 27279 1 709 . 1 1 166 166 VAL H H 1 7.996 0.020 . 1 . . . . . 166 VAL H . 27279 1 710 . 1 1 166 166 VAL C C 13 173.622 0.3 . 1 . . . . . 166 VAL C . 27279 1 711 . 1 1 166 166 VAL CA C 13 59.514 0.3 . 1 . . . . . 166 VAL CA . 27279 1 712 . 1 1 166 166 VAL CB C 13 33.806 0.3 . 1 . . . . . 166 VAL CB . 27279 1 713 . 1 1 166 166 VAL N N 15 123.083 0.3 . 1 . . . . . 166 VAL N . 27279 1 714 . 1 1 167 167 HIS H H 1 8.297 0.020 . 1 . . . . . 167 HIS H . 27279 1 715 . 1 1 167 167 HIS CA C 13 55.006 0.3 . 1 . . . . . 167 HIS CA . 27279 1 716 . 1 1 167 167 HIS N N 15 125.447 0.3 . 1 . . . . . 167 HIS N . 27279 1 717 . 1 1 168 168 SER H H 1 7.682 0.020 . 1 . . . . . 168 SER H . 27279 1 718 . 1 1 168 168 SER CA C 13 57.422 0.3 . 1 . . . . . 168 SER CA . 27279 1 719 . 1 1 168 168 SER N N 15 120.610 0.3 . 1 . . . . . 168 SER N . 27279 1 720 . 1 1 170 170 VAL H H 1 7.221 0.020 . 1 . . . . . 170 VAL H . 27279 1 721 . 1 1 170 170 VAL C C 13 176.772 0.3 . 1 . . . . . 170 VAL C . 27279 1 722 . 1 1 170 170 VAL CA C 13 60.803 0.3 . 1 . . . . . 170 VAL CA . 27279 1 723 . 1 1 170 170 VAL CB C 13 32.572 0.3 . 1 . . . . . 170 VAL CB . 27279 1 724 . 1 1 170 170 VAL N N 15 121.536 0.3 . 1 . . . . . 170 VAL N . 27279 1 725 . 1 1 171 171 SER H H 1 9.000 0.020 . 1 . . . . . 171 SER H . 27279 1 726 . 1 1 171 171 SER C C 13 173.297 0.3 . 1 . . . . . 171 SER C . 27279 1 727 . 1 1 171 171 SER CA C 13 56.115 0.3 . 1 . . . . . 171 SER CA . 27279 1 728 . 1 1 171 171 SER CB C 13 63.282 0.3 . 1 . . . . . 171 SER CB . 27279 1 729 . 1 1 171 171 SER N N 15 123.636 0.3 . 1 . . . . . 171 SER N . 27279 1 730 . 1 1 172 172 THR H H 1 9.195 0.020 . 1 . . . . . 172 THR H . 27279 1 731 . 1 1 172 172 THR C C 13 173.715 0.3 . 1 . . . . . 172 THR C . 27279 1 732 . 1 1 172 172 THR CA C 13 60.374 0.3 . 1 . . . . . 172 THR CA . 27279 1 733 . 1 1 172 172 THR CB C 13 69.314 0.3 . 1 . . . . . 172 THR CB . 27279 1 734 . 1 1 172 172 THR N N 15 127.676 0.3 . 1 . . . . . 172 THR N . 27279 1 735 . 1 1 173 173 ASP H H 1 8.437 0.020 . 1 . . . . . 173 ASP H . 27279 1 736 . 1 1 173 173 ASP C C 13 174.433 0.3 . 1 . . . . . 173 ASP C . 27279 1 737 . 1 1 173 173 ASP CA C 13 53.325 0.3 . 1 . . . . . 173 ASP CA . 27279 1 738 . 1 1 173 173 ASP CB C 13 39.564 0.3 . 1 . . . . . 173 ASP CB . 27279 1 739 . 1 1 173 173 ASP N N 15 130.584 0.3 . 1 . . . . . 173 ASP N . 27279 1 740 . 1 1 175 175 GLN H H 1 7.299 0.020 . 1 . . . . . 175 GLN H . 27279 1 741 . 1 1 175 175 GLN C C 13 174.014 0.3 . 1 . . . . . 175 GLN C . 27279 1 742 . 1 1 175 175 GLN CA C 13 53.309 0.3 . 1 . . . . . 175 GLN CA . 27279 1 743 . 1 1 175 175 GLN CB C 13 31.269 0.3 . 1 . . . . . 175 GLN CB . 27279 1 744 . 1 1 175 175 GLN N N 15 112.826 0.3 . 1 . . . . . 175 GLN N . 27279 1 745 . 1 1 176 176 ALA H H 1 9.047 0.020 . 1 . . . . . 176 ALA H . 27279 1 746 . 1 1 176 176 ALA C C 13 176.420 0.3 . 1 . . . . . 176 ALA C . 27279 1 747 . 1 1 176 176 ALA CA C 13 51.605 0.3 . 1 . . . . . 176 ALA CA . 27279 1 748 . 1 1 176 176 ALA CB C 13 18.999 0.3 . 1 . . . . . 176 ALA CB . 27279 1 749 . 1 1 176 176 ALA N N 15 125.308 0.3 . 1 . . . . . 176 ALA N . 27279 1 750 . 1 1 177 177 TYR H H 1 9.260 0.020 . 1 . . . . . 177 TYR H . 27279 1 751 . 1 1 177 177 TYR C C 13 174.567 0.3 . 1 . . . . . 177 TYR C . 27279 1 752 . 1 1 177 177 TYR CA C 13 56.115 0.3 . 1 . . . . . 177 TYR CA . 27279 1 753 . 1 1 177 177 TYR CB C 13 39.289 0.3 . 1 . . . . . 177 TYR CB . 27279 1 754 . 1 1 177 177 TYR N N 15 124.456 0.3 . 1 . . . . . 177 TYR N . 27279 1 755 . 1 1 178 178 LYS H H 1 8.373 0.020 . 1 . . . . . 178 LYS H . 27279 1 756 . 1 1 178 178 LYS C C 13 175.240 0.3 . 1 . . . . . 178 LYS C . 27279 1 757 . 1 1 178 178 LYS CA C 13 55.746 0.3 . 1 . . . . . 178 LYS CA . 27279 1 758 . 1 1 178 178 LYS CB C 13 31.064 0.3 . 1 . . . . . 178 LYS CB . 27279 1 759 . 1 1 178 178 LYS N N 15 127.574 0.3 . 1 . . . . . 178 LYS N . 27279 1 760 . 1 1 179 179 GLU H H 1 8.331 0.020 . 1 . . . . . 179 GLU H . 27279 1 761 . 1 1 179 179 GLU C C 13 176.376 0.3 . 1 . . . . . 179 GLU C . 27279 1 762 . 1 1 179 179 GLU CA C 13 56.776 0.3 . 1 . . . . . 179 GLU CA . 27279 1 763 . 1 1 179 179 GLU CB C 13 29.967 0.3 . 1 . . . . . 179 GLU CB . 27279 1 764 . 1 1 179 179 GLU N N 15 128.475 0.3 . 1 . . . . . 179 GLU N . 27279 1 765 . 1 1 180 180 SER H H 1 7.976 0.020 . 1 . . . . . 180 SER H . 27279 1 766 . 1 1 180 180 SER C C 13 173.611 0.3 . 1 . . . . . 180 SER C . 27279 1 767 . 1 1 180 180 SER CA C 13 56.533 0.3 . 1 . . . . . 180 SER CA . 27279 1 768 . 1 1 180 180 SER CB C 13 62.596 0.3 . 1 . . . . . 180 SER CB . 27279 1 769 . 1 1 180 180 SER N N 15 112.440 0.3 . 1 . . . . . 180 SER N . 27279 1 770 . 1 1 182 182 TYR H H 1 7.745 0.020 . 1 . . . . . 182 TYR H . 27279 1 771 . 1 1 182 182 TYR C C 13 174.074 0.3 . 1 . . . . . 182 TYR C . 27279 1 772 . 1 1 182 182 TYR CA C 13 54.177 0.3 . 1 . . . . . 182 TYR CA . 27279 1 773 . 1 1 182 182 TYR CB C 13 37.027 0.3 . 1 . . . . . 182 TYR CB . 27279 1 774 . 1 1 182 182 TYR N N 15 113.414 0.3 . 1 . . . . . 182 TYR N . 27279 1 775 . 1 1 183 183 SER H H 1 6.744 0.020 . 1 . . . . . 183 SER H . 27279 1 776 . 1 1 183 183 SER C C 13 172.206 0.3 . 1 . . . . . 183 SER C . 27279 1 777 . 1 1 183 183 SER CA C 13 58.003 0.3 . 1 . . . . . 183 SER CA . 27279 1 778 . 1 1 183 183 SER CB C 13 63.761 0.3 . 1 . . . . . 183 SER CB . 27279 1 779 . 1 1 183 183 SER N N 15 112.178 0.3 . 1 . . . . . 183 SER N . 27279 1 780 . 1 1 184 184 TYR H H 1 8.590 0.020 . 1 . . . . . 184 TYR H . 27279 1 781 . 1 1 184 184 TYR C C 13 173.820 0.3 . 1 . . . . . 184 TYR C . 27279 1 782 . 1 1 184 184 TYR CA C 13 56.585 0.3 . 1 . . . . . 184 TYR CA . 27279 1 783 . 1 1 184 184 TYR CB C 13 42.169 0.3 . 1 . . . . . 184 TYR CB . 27279 1 784 . 1 1 184 184 TYR N N 15 126.184 0.3 . 1 . . . . . 184 TYR N . 27279 1 785 . 1 1 185 185 SER H H 1 8.948 0.020 . 1 . . . . . 185 SER H . 27279 1 786 . 1 1 185 185 SER C C 13 172.654 0.3 . 1 . . . . . 185 SER C . 27279 1 787 . 1 1 185 185 SER CA C 13 56.104 0.3 . 1 . . . . . 185 SER CA . 27279 1 788 . 1 1 185 185 SER CB C 13 66.366 0.3 . 1 . . . . . 185 SER CB . 27279 1 789 . 1 1 185 185 SER N N 15 111.026 0.3 . 1 . . . . . 185 SER N . 27279 1 790 . 1 1 186 186 LEU H H 1 9.289 0.020 . 1 . . . . . 186 LEU H . 27279 1 791 . 1 1 186 186 LEU C C 13 173.491 0.3 . 1 . . . . . 186 LEU C . 27279 1 792 . 1 1 186 186 LEU CA C 13 55.159 0.3 . 1 . . . . . 186 LEU CA . 27279 1 793 . 1 1 186 186 LEU CB C 13 46.898 0.3 . 1 . . . . . 186 LEU CB . 27279 1 794 . 1 1 186 186 LEU N N 15 123.838 0.3 . 1 . . . . . 186 LEU N . 27279 1 795 . 1 1 187 187 SER H H 1 8.409 0.020 . 1 . . . . . 187 SER H . 27279 1 796 . 1 1 187 187 SER C C 13 172.475 0.3 . 1 . . . . . 187 SER C . 27279 1 797 . 1 1 187 187 SER CA C 13 56.342 0.3 . 1 . . . . . 187 SER CA . 27279 1 798 . 1 1 187 187 SER CB C 13 67.394 0.3 . 1 . . . . . 187 SER CB . 27279 1 799 . 1 1 187 187 SER N N 15 121.271 0.3 . 1 . . . . . 187 SER N . 27279 1 800 . 1 1 188 188 SER H H 1 8.791 0.020 . 1 . . . . . 188 SER H . 27279 1 801 . 1 1 188 188 SER C C 13 172.550 0.3 . 1 . . . . . 188 SER C . 27279 1 802 . 1 1 188 188 SER CA C 13 55.921 0.3 . 1 . . . . . 188 SER CA . 27279 1 803 . 1 1 188 188 SER CB C 13 63.898 0.3 . 1 . . . . . 188 SER CB . 27279 1 804 . 1 1 188 188 SER N N 15 113.613 0.3 . 1 . . . . . 188 SER N . 27279 1 805 . 1 1 189 189 ARG H H 1 8.792 0.020 . 1 . . . . . 189 ARG H . 27279 1 806 . 1 1 189 189 ARG C C 13 173.431 0.3 . 1 . . . . . 189 ARG C . 27279 1 807 . 1 1 189 189 ARG CA C 13 54.156 0.3 . 1 . . . . . 189 ARG CA . 27279 1 808 . 1 1 189 189 ARG CB C 13 32.092 0.3 . 1 . . . . . 189 ARG CB . 27279 1 809 . 1 1 189 189 ARG N N 15 128.472 0.3 . 1 . . . . . 189 ARG N . 27279 1 810 . 1 1 190 190 LEU H H 1 8.032 0.020 . 1 . . . . . 190 LEU H . 27279 1 811 . 1 1 190 190 LEU C C 13 173.514 0.3 . 1 . . . . . 190 LEU C . 27279 1 812 . 1 1 190 190 LEU CA C 13 52.322 0.3 . 1 . . . . . 190 LEU CA . 27279 1 813 . 1 1 190 190 LEU CB C 13 39.906 0.3 . 1 . . . . . 190 LEU CB . 27279 1 814 . 1 1 190 190 LEU N N 15 123.860 0.3 . 1 . . . . . 190 LEU N . 27279 1 815 . 1 1 191 191 ARG H H 1 8.286 0.020 . 1 . . . . . 191 ARG H . 27279 1 816 . 1 1 191 191 ARG C C 13 175.763 0.3 . 1 . . . . . 191 ARG C . 27279 1 817 . 1 1 191 191 ARG CA C 13 53.955 0.3 . 1 . . . . . 191 ARG CA . 27279 1 818 . 1 1 191 191 ARG CB C 13 30.652 0.3 . 1 . . . . . 191 ARG CB . 27279 1 819 . 1 1 191 191 ARG N N 15 127.940 0.3 . 1 . . . . . 191 ARG N . 27279 1 820 . 1 1 192 192 VAL H H 1 8.671 0.020 . 1 . . . . . 192 VAL H . 27279 1 821 . 1 1 192 192 VAL C C 13 174.597 0.3 . 1 . . . . . 192 VAL C . 27279 1 822 . 1 1 192 192 VAL CA C 13 57.623 0.3 . 1 . . . . . 192 VAL CA . 27279 1 823 . 1 1 192 192 VAL CB C 13 34.902 0.3 . 1 . . . . . 192 VAL CB . 27279 1 824 . 1 1 192 192 VAL N N 15 119.433 0.3 . 1 . . . . . 192 VAL N . 27279 1 825 . 1 1 193 193 SER H H 1 8.672 0.020 . 1 . . . . . 193 SER H . 27279 1 826 . 1 1 193 193 SER C C 13 175.539 0.3 . 1 . . . . . 193 SER C . 27279 1 827 . 1 1 193 193 SER CA C 13 57.795 0.3 . 1 . . . . . 193 SER CA . 27279 1 828 . 1 1 193 193 SER CB C 13 63.007 0.3 . 1 . . . . . 193 SER CB . 27279 1 829 . 1 1 193 193 SER N N 15 116.907 0.3 . 1 . . . . . 193 SER N . 27279 1 830 . 1 1 194 194 ALA H H 1 8.349 0.020 . 1 . . . . . 194 ALA H . 27279 1 831 . 1 1 194 194 ALA C C 13 178.318 0.3 . 1 . . . . . 194 ALA C . 27279 1 832 . 1 1 194 194 ALA CA C 13 55.330 0.3 . 1 . . . . . 194 ALA CA . 27279 1 833 . 1 1 194 194 ALA CB C 13 16.874 0.3 . 1 . . . . . 194 ALA CB . 27279 1 834 . 1 1 194 194 ALA N N 15 126.855 0.3 . 1 . . . . . 194 ALA N . 27279 1 835 . 1 1 195 195 THR H H 1 7.967 0.020 . 1 . . . . . 195 THR H . 27279 1 836 . 1 1 195 195 THR C C 13 176.048 0.3 . 1 . . . . . 195 THR C . 27279 1 837 . 1 1 195 195 THR CA C 13 64.357 0.3 . 1 . . . . . 195 THR CA . 27279 1 838 . 1 1 195 195 THR CB C 13 68.011 0.3 . 1 . . . . . 195 THR CB . 27279 1 839 . 1 1 195 195 THR N N 15 108.615 0.3 . 1 . . . . . 195 THR N . 27279 1 840 . 1 1 196 196 PHE H H 1 7.658 0.020 . 1 . . . . . 196 PHE H . 27279 1 841 . 1 1 196 196 PHE C C 13 178.169 0.3 . 1 . . . . . 196 PHE C . 27279 1 842 . 1 1 196 196 PHE CA C 13 60.517 0.3 . 1 . . . . . 196 PHE CA . 27279 1 843 . 1 1 196 196 PHE CB C 13 39.906 0.3 . 1 . . . . . 196 PHE CB . 27279 1 844 . 1 1 196 196 PHE N N 15 124.846 0.3 . 1 . . . . . 196 PHE N . 27279 1 845 . 1 1 197 197 TRP H H 1 7.760 0.020 . 1 . . . . . 197 TRP H . 27279 1 846 . 1 1 197 197 TRP C C 13 173.999 0.3 . 1 . . . . . 197 TRP C . 27279 1 847 . 1 1 197 197 TRP CA C 13 58.225 0.3 . 1 . . . . . 197 TRP CA . 27279 1 848 . 1 1 197 197 TRP CB C 13 29.144 0.3 . 1 . . . . . 197 TRP CB . 27279 1 849 . 1 1 197 197 TRP N N 15 119.644 0.3 . 1 . . . . . 197 TRP N . 27279 1 850 . 1 1 198 198 HIS H H 1 7.595 0.020 . 1 . . . . . 198 HIS H . 27279 1 851 . 1 1 198 198 HIS C C 13 174.209 0.3 . 1 . . . . . 198 HIS C . 27279 1 852 . 1 1 198 198 HIS CA C 13 53.955 0.3 . 1 . . . . . 198 HIS CA . 27279 1 853 . 1 1 198 198 HIS CB C 13 27.705 0.3 . 1 . . . . . 198 HIS CB . 27279 1 854 . 1 1 198 198 HIS N N 15 112.272 0.3 . 1 . . . . . 198 HIS N . 27279 1 855 . 1 1 199 199 ASN H H 1 6.885 0.020 . 1 . . . . . 199 ASN H . 27279 1 856 . 1 1 199 199 ASN C C 13 174.164 0.3 . 1 . . . . . 199 ASN C . 27279 1 857 . 1 1 199 199 ASN CA C 13 49.026 0.3 . 1 . . . . . 199 ASN CA . 27279 1 858 . 1 1 199 199 ASN CB C 13 38.261 0.3 . 1 . . . . . 199 ASN CB . 27279 1 859 . 1 1 199 199 ASN N N 15 118.657 0.3 . 1 . . . . . 199 ASN N . 27279 1 860 . 1 1 201 201 ARG H H 1 7.628 0.020 . 1 . . . . . 201 ARG H . 27279 1 861 . 1 1 201 201 ARG C C 13 176.914 0.3 . 1 . . . . . 201 ARG C . 27279 1 862 . 1 1 201 201 ARG CA C 13 55.359 0.3 . 1 . . . . . 201 ARG CA . 27279 1 863 . 1 1 201 201 ARG CB C 13 28.733 0.3 . 1 . . . . . 201 ARG CB . 27279 1 864 . 1 1 201 201 ARG N N 15 115.495 0.3 . 1 . . . . . 201 ARG N . 27279 1 865 . 1 1 202 202 ASN H H 1 7.668 0.020 . 1 . . . . . 202 ASN H . 27279 1 866 . 1 1 202 202 ASN C C 13 171.967 0.3 . 1 . . . . . 202 ASN C . 27279 1 867 . 1 1 202 202 ASN CA C 13 51.887 0.3 . 1 . . . . . 202 ASN CA . 27279 1 868 . 1 1 202 202 ASN CB C 13 37.850 0.3 . 1 . . . . . 202 ASN CB . 27279 1 869 . 1 1 202 202 ASN N N 15 118.220 0.3 . 1 . . . . . 202 ASN N . 27279 1 870 . 1 1 203 203 HIS H H 1 8.212 0.020 . 1 . . . . . 203 HIS H . 27279 1 871 . 1 1 203 203 HIS C C 13 173.013 0.3 . 1 . . . . . 203 HIS C . 27279 1 872 . 1 1 203 203 HIS CA C 13 55.136 0.3 . 1 . . . . . 203 HIS CA . 27279 1 873 . 1 1 203 203 HIS CB C 13 33.874 0.3 . 1 . . . . . 203 HIS CB . 27279 1 874 . 1 1 203 203 HIS N N 15 122.805 0.3 . 1 . . . . . 203 HIS N . 27279 1 875 . 1 1 204 204 PHE H H 1 8.460 0.020 . 1 . . . . . 204 PHE H . 27279 1 876 . 1 1 204 204 PHE C C 13 173.581 0.3 . 1 . . . . . 204 PHE C . 27279 1 877 . 1 1 204 204 PHE CA C 13 55.802 0.3 . 1 . . . . . 204 PHE CA . 27279 1 878 . 1 1 204 204 PHE CB C 13 41.277 0.3 . 1 . . . . . 204 PHE CB . 27279 1 879 . 1 1 204 204 PHE N N 15 124.652 0.3 . 1 . . . . . 204 PHE N . 27279 1 880 . 1 1 205 205 ARG H H 1 9.180 0.020 . 1 . . . . . 205 ARG H . 27279 1 881 . 1 1 205 205 ARG C C 13 173.402 0.3 . 1 . . . . . 205 ARG C . 27279 1 882 . 1 1 205 205 ARG CA C 13 54.156 0.3 . 1 . . . . . 205 ARG CA . 27279 1 883 . 1 1 205 205 ARG CB C 13 34.423 0.3 . 1 . . . . . 205 ARG CB . 27279 1 884 . 1 1 205 205 ARG N N 15 121.827 0.3 . 1 . . . . . 205 ARG N . 27279 1 885 . 1 1 206 206 CYS H H 1 8.859 0.020 . 1 . . . . . 206 CYS H . 27279 1 886 . 1 1 206 206 CYS C C 13 171.474 0.3 . 1 . . . . . 206 CYS C . 27279 1 887 . 1 1 206 206 CYS CA C 13 51.974 0.3 . 1 . . . . . 206 CYS CA . 27279 1 888 . 1 1 206 206 CYS CB C 13 42.511 0.3 . 1 . . . . . 206 CYS CB . 27279 1 889 . 1 1 206 206 CYS N N 15 127.600 0.3 . 1 . . . . . 206 CYS N . 27279 1 890 . 1 1 207 207 GLN H H 1 9.246 0.020 . 1 . . . . . 207 GLN H . 27279 1 891 . 1 1 207 207 GLN C C 13 173.432 0.3 . 1 . . . . . 207 GLN C . 27279 1 892 . 1 1 207 207 GLN CA C 13 53.766 0.3 . 1 . . . . . 207 GLN CA . 27279 1 893 . 1 1 207 207 GLN CB C 13 32.160 0.3 . 1 . . . . . 207 GLN CB . 27279 1 894 . 1 1 207 207 GLN N N 15 128.165 0.3 . 1 . . . . . 207 GLN N . 27279 1 895 . 1 1 208 208 VAL H H 1 9.123 0.020 . 1 . . . . . 208 VAL H . 27279 1 896 . 1 1 208 208 VAL C C 13 174.164 0.3 . 1 . . . . . 208 VAL C . 27279 1 897 . 1 1 208 208 VAL CA C 13 59.968 0.3 . 1 . . . . . 208 VAL CA . 27279 1 898 . 1 1 208 208 VAL CB C 13 31.475 0.3 . 1 . . . . . 208 VAL CB . 27279 1 899 . 1 1 208 208 VAL N N 15 127.654 0.3 . 1 . . . . . 208 VAL N . 27279 1 900 . 1 1 209 209 GLN H H 1 8.886 0.020 . 1 . . . . . 209 GLN H . 27279 1 901 . 1 1 209 209 GLN C C 13 173.820 0.3 . 1 . . . . . 209 GLN C . 27279 1 902 . 1 1 209 209 GLN CA C 13 54.385 0.3 . 1 . . . . . 209 GLN CA . 27279 1 903 . 1 1 209 209 GLN CB C 13 29.281 0.3 . 1 . . . . . 209 GLN CB . 27279 1 904 . 1 1 209 209 GLN N N 15 128.601 0.3 . 1 . . . . . 209 GLN N . 27279 1 905 . 1 1 210 210 PHE H H 1 8.835 0.020 . 1 . . . . . 210 PHE H . 27279 1 906 . 1 1 210 210 PHE C C 13 172.610 0.3 . 1 . . . . . 210 PHE C . 27279 1 907 . 1 1 210 210 PHE CA C 13 54.920 0.3 . 1 . . . . . 210 PHE CA . 27279 1 908 . 1 1 210 210 PHE CB C 13 40.935 0.3 . 1 . . . . . 210 PHE CB . 27279 1 909 . 1 1 210 210 PHE N N 15 128.404 0.3 . 1 . . . . . 210 PHE N . 27279 1 910 . 1 1 211 211 HIS H H 1 7.415 0.020 . 1 . . . . . 211 HIS H . 27279 1 911 . 1 1 211 211 HIS C C 13 174.119 0.3 . 1 . . . . . 211 HIS C . 27279 1 912 . 1 1 211 211 HIS CA C 13 55.136 0.3 . 1 . . . . . 211 HIS CA . 27279 1 913 . 1 1 211 211 HIS CB C 13 29.350 0.3 . 1 . . . . . 211 HIS CB . 27279 1 914 . 1 1 211 211 HIS N N 15 128.286 0.3 . 1 . . . . . 211 HIS N . 27279 1 915 . 1 1 212 212 GLY H H 1 7.761 0.020 . 1 . . . . . 212 GLY H . 27279 1 916 . 1 1 212 212 GLY C C 13 173.521 0.3 . 1 . . . . . 212 GLY C . 27279 1 917 . 1 1 212 212 GLY CA C 13 42.995 0.3 . 1 . . . . . 212 GLY CA . 27279 1 918 . 1 1 212 212 GLY N N 15 112.682 0.3 . 1 . . . . . 212 GLY N . 27279 1 919 . 1 1 213 213 LEU H H 1 8.248 0.020 . 1 . . . . . 213 LEU H . 27279 1 920 . 1 1 213 213 LEU C C 13 176.121 0.3 . 1 . . . . . 213 LEU C . 27279 1 921 . 1 1 213 213 LEU CA C 13 54.158 0.3 . 1 . . . . . 213 LEU CA . 27279 1 922 . 1 1 213 213 LEU CB C 13 41.346 0.3 . 1 . . . . . 213 LEU CB . 27279 1 923 . 1 1 213 213 LEU N N 15 124.508 0.3 . 1 . . . . . 213 LEU N . 27279 1 924 . 1 1 214 214 SER H H 1 9.259 0.020 . 1 . . . . . 214 SER H . 27279 1 925 . 1 1 214 214 SER C C 13 176.062 0.3 . 1 . . . . . 214 SER C . 27279 1 926 . 1 1 214 214 SER CA C 13 56.505 0.3 . 1 . . . . . 214 SER CA . 27279 1 927 . 1 1 214 214 SER CB C 13 64.653 0.3 . 1 . . . . . 214 SER CB . 27279 1 928 . 1 1 214 214 SER N N 15 116.777 0.3 . 1 . . . . . 214 SER N . 27279 1 929 . 1 1 215 215 GLU H H 1 8.576 0.020 . 1 . . . . . 215 GLU H . 27279 1 930 . 1 1 215 215 GLU CA C 13 58.712 0.3 . 1 . . . . . 215 GLU CA . 27279 1 931 . 1 1 215 215 GLU N N 15 116.566 0.3 . 1 . . . . . 215 GLU N . 27279 1 932 . 1 1 216 216 GLU H H 1 8.282 0.020 . 1 . . . . . 216 GLU H . 27279 1 933 . 1 1 216 216 GLU C C 13 177.093 0.3 . 1 . . . . . 216 GLU C . 27279 1 934 . 1 1 216 216 GLU CA C 13 56.563 0.3 . 1 . . . . . 216 GLU CA . 27279 1 935 . 1 1 216 216 GLU CB C 13 28.802 0.3 . 1 . . . . . 216 GLU CB . 27279 1 936 . 1 1 216 216 GLU N N 15 115.905 0.3 . 1 . . . . . 216 GLU N . 27279 1 937 . 1 1 217 217 ASP H H 1 7.294 0.020 . 1 . . . . . 217 ASP H . 27279 1 938 . 1 1 217 217 ASP C C 13 175.897 0.3 . 1 . . . . . 217 ASP C . 27279 1 939 . 1 1 217 217 ASP CA C 13 54.823 0.3 . 1 . . . . . 217 ASP CA . 27279 1 940 . 1 1 217 217 ASP CB C 13 41.277 0.3 . 1 . . . . . 217 ASP CB . 27279 1 941 . 1 1 217 217 ASP N N 15 120.822 0.3 . 1 . . . . . 217 ASP N . 27279 1 942 . 1 1 218 218 LYS H H 1 8.443 0.020 . 1 . . . . . 218 LYS H . 27279 1 943 . 1 1 218 218 LYS C C 13 175.793 0.3 . 1 . . . . . 218 LYS C . 27279 1 944 . 1 1 218 218 LYS CA C 13 55.768 0.3 . 1 . . . . . 218 LYS CA . 27279 1 945 . 1 1 218 218 LYS CB C 13 31.886 0.3 . 1 . . . . . 218 LYS CB . 27279 1 946 . 1 1 218 218 LYS N N 15 122.946 0.3 . 1 . . . . . 218 LYS N . 27279 1 947 . 1 1 219 219 TRP H H 1 8.251 0.020 . 1 . . . . . 219 TRP H . 27279 1 948 . 1 1 219 219 TRP C C 13 173.727 0.3 . 1 . . . . . 219 TRP C . 27279 1 949 . 1 1 219 219 TRP CA C 13 53.336 0.3 . 1 . . . . . 219 TRP CA . 27279 1 950 . 1 1 219 219 TRP CB C 13 32.023 0.3 . 1 . . . . . 219 TRP CB . 27279 1 951 . 1 1 219 219 TRP N N 15 123.647 0.3 . 1 . . . . . 219 TRP N . 27279 1 952 . 1 1 221 221 GLU H H 1 8.599 0.020 . 1 . . . . . 221 GLU H . 27279 1 953 . 1 1 221 221 GLU CA C 13 58.192 0.3 . 1 . . . . . 221 GLU CA . 27279 1 954 . 1 1 221 221 GLU N N 15 123.465 0.3 . 1 . . . . . 221 GLU N . 27279 1 955 . 1 1 222 222 GLY H H 1 7.911 0.020 . 1 . . . . . 222 GLY H . 27279 1 956 . 1 1 222 222 GLY CA C 13 45.158 0.3 . 1 . . . . . 222 GLY CA . 27279 1 957 . 1 1 222 222 GLY N N 15 112.868 0.3 . 1 . . . . . 222 GLY N . 27279 1 958 . 1 1 223 223 SER H H 1 7.688 0.020 . 1 . . . . . 223 SER H . 27279 1 959 . 1 1 223 223 SER C C 13 172.161 0.3 . 1 . . . . . 223 SER C . 27279 1 960 . 1 1 223 223 SER CA C 13 55.560 0.3 . 1 . . . . . 223 SER CA . 27279 1 961 . 1 1 223 223 SER CB C 13 62.870 0.3 . 1 . . . . . 223 SER CB . 27279 1 962 . 1 1 223 223 SER N N 15 116.191 0.3 . 1 . . . . . 223 SER N . 27279 1 963 . 1 1 227 227 VAL H H 1 7.588 0.020 . 1 . . . . . 227 VAL H . 27279 1 964 . 1 1 227 227 VAL C C 13 175.718 0.3 . 1 . . . . . 227 VAL C . 27279 1 965 . 1 1 227 227 VAL CA C 13 59.571 0.3 . 1 . . . . . 227 VAL CA . 27279 1 966 . 1 1 227 227 VAL CB C 13 32.435 0.3 . 1 . . . . . 227 VAL CB . 27279 1 967 . 1 1 227 227 VAL N N 15 118.051 0.3 . 1 . . . . . 227 VAL N . 27279 1 968 . 1 1 228 228 THR H H 1 7.733 0.020 . 1 . . . . . 228 THR H . 27279 1 969 . 1 1 228 228 THR C C 13 174.522 0.3 . 1 . . . . . 228 THR C . 27279 1 970 . 1 1 228 228 THR CA C 13 62.523 0.3 . 1 . . . . . 228 THR CA . 27279 1 971 . 1 1 228 228 THR CB C 13 68.628 0.3 . 1 . . . . . 228 THR CB . 27279 1 972 . 1 1 228 228 THR N N 15 118.839 0.3 . 1 . . . . . 228 THR N . 27279 1 973 . 1 1 229 229 GLN H H 1 8.767 0.020 . 1 . . . . . 229 GLN H . 27279 1 974 . 1 1 229 229 GLN C C 13 172.087 0.3 . 1 . . . . . 229 GLN C . 27279 1 975 . 1 1 229 229 GLN CA C 13 54.156 0.3 . 1 . . . . . 229 GLN CA . 27279 1 976 . 1 1 229 229 GLN CB C 13 31.201 0.3 . 1 . . . . . 229 GLN CB . 27279 1 977 . 1 1 229 229 GLN N N 15 122.751 0.3 . 1 . . . . . 229 GLN N . 27279 1 978 . 1 1 230 230 ASN H H 1 8.586 0.020 . 1 . . . . . 230 ASN H . 27279 1 979 . 1 1 230 230 ASN C C 13 174.582 0.3 . 1 . . . . . 230 ASN C . 27279 1 980 . 1 1 230 230 ASN CA C 13 51.176 0.3 . 1 . . . . . 230 ASN CA . 27279 1 981 . 1 1 230 230 ASN CB C 13 39.289 0.3 . 1 . . . . . 230 ASN CB . 27279 1 982 . 1 1 230 230 ASN N N 15 120.131 0.3 . 1 . . . . . 230 ASN N . 27279 1 983 . 1 1 231 231 ILE H H 1 8.956 0.020 . 1 . . . . . 231 ILE H . 27279 1 984 . 1 1 231 231 ILE C C 13 174.552 0.3 . 1 . . . . . 231 ILE C . 27279 1 985 . 1 1 231 231 ILE CA C 13 59.944 0.3 . 1 . . . . . 231 ILE CA . 27279 1 986 . 1 1 231 231 ILE CB C 13 39.632 0.3 . 1 . . . . . 231 ILE CB . 27279 1 987 . 1 1 231 231 ILE N N 15 127.022 0.3 . 1 . . . . . 231 ILE N . 27279 1 988 . 1 1 232 232 SER H H 1 8.520 0.020 . 1 . . . . . 232 SER H . 27279 1 989 . 1 1 232 232 SER C C 13 172.983 0.3 . 1 . . . . . 232 SER C . 27279 1 990 . 1 1 232 232 SER CA C 13 56.534 0.3 . 1 . . . . . 232 SER CA . 27279 1 991 . 1 1 232 232 SER CB C 13 66.435 0.3 . 1 . . . . . 232 SER CB . 27279 1 992 . 1 1 232 232 SER N N 15 120.795 0.3 . 1 . . . . . 232 SER N . 27279 1 993 . 1 1 233 233 ALA H H 1 8.530 0.020 . 1 . . . . . 233 ALA H . 27279 1 994 . 1 1 233 233 ALA C C 13 175.031 0.3 . 1 . . . . . 233 ALA C . 27279 1 995 . 1 1 233 233 ALA CA C 13 50.746 0.3 . 1 . . . . . 233 ALA CA . 27279 1 996 . 1 1 233 233 ALA CB C 13 22.427 0.3 . 1 . . . . . 233 ALA CB . 27279 1 997 . 1 1 233 233 ALA N N 15 123.956 0.3 . 1 . . . . . 233 ALA N . 27279 1 998 . 1 1 234 234 GLU H H 1 8.739 0.020 . 1 . . . . . 234 GLU H . 27279 1 999 . 1 1 234 234 GLU C C 13 174.448 0.3 . 1 . . . . . 234 GLU C . 27279 1 1000 . 1 1 234 234 GLU CA C 13 53.551 0.3 . 1 . . . . . 234 GLU CA . 27279 1 1001 . 1 1 234 234 GLU CB C 13 33.874 0.3 . 1 . . . . . 234 GLU CB . 27279 1 1002 . 1 1 234 234 GLU N N 15 118.816 0.3 . 1 . . . . . 234 GLU N . 27279 1 1003 . 1 1 235 235 ALA H H 1 8.967 0.020 . 1 . . . . . 235 ALA H . 27279 1 1004 . 1 1 235 235 ALA C C 13 174.762 0.3 . 1 . . . . . 235 ALA C . 27279 1 1005 . 1 1 235 235 ALA CA C 13 51.405 0.3 . 1 . . . . . 235 ALA CA . 27279 1 1006 . 1 1 235 235 ALA CB C 13 21.672 0.3 . 1 . . . . . 235 ALA CB . 27279 1 1007 . 1 1 235 235 ALA N N 15 122.158 0.3 . 1 . . . . . 235 ALA N . 27279 1 1008 . 1 1 236 236 TRP H H 1 8.474 0.020 . 1 . . . . . 236 TRP H . 27279 1 1009 . 1 1 236 236 TRP C C 13 176.211 0.3 . 1 . . . . . 236 TRP C . 27279 1 1010 . 1 1 236 236 TRP CA C 13 56.035 0.3 . 1 . . . . . 236 TRP CA . 27279 1 1011 . 1 1 236 236 TRP CB C 13 31.201 0.3 . 1 . . . . . 236 TRP CB . 27279 1 1012 . 1 1 236 236 TRP N N 15 121.760 0.3 . 1 . . . . . 236 TRP N . 27279 1 1013 . 1 1 237 237 GLY H H 1 8.541 0.020 . 1 . . . . . 237 GLY H . 27279 1 1014 . 1 1 237 237 GLY C C 13 171.997 0.3 . 1 . . . . . 237 GLY C . 27279 1 1015 . 1 1 237 237 GLY CA C 13 45.172 0.3 . 1 . . . . . 237 GLY CA . 27279 1 1016 . 1 1 237 237 GLY N N 15 105.509 0.3 . 1 . . . . . 237 GLY N . 27279 1 1017 . 1 1 238 238 ARG H H 1 6.079 0.020 . 1 . . . . . 238 ARG H . 27279 1 1018 . 1 1 238 238 ARG C C 13 174.493 0.3 . 1 . . . . . 238 ARG C . 27279 1 1019 . 1 1 238 238 ARG CA C 13 53.751 0.3 . 1 . . . . . 238 ARG CA . 27279 1 1020 . 1 1 238 238 ARG CB C 13 31.475 0.3 . 1 . . . . . 238 ARG CB . 27279 1 1021 . 1 1 238 238 ARG N N 15 117.125 0.3 . 1 . . . . . 238 ARG N . 27279 1 1022 . 1 1 239 239 ALA H H 1 8.443 0.020 . 1 . . . . . 239 ALA H . 27279 1 1023 . 1 1 239 239 ALA C C 13 177.452 0.3 . 1 . . . . . 239 ALA C . 27279 1 1024 . 1 1 239 239 ALA CA C 13 51.770 0.3 . 1 . . . . . 239 ALA CA . 27279 1 1025 . 1 1 239 239 ALA CB C 13 18.176 0.3 . 1 . . . . . 239 ALA CB . 27279 1 1026 . 1 1 239 239 ALA N N 15 126.442 0.3 . 1 . . . . . 239 ALA N . 27279 1 1027 . 1 1 240 240 ASP H H 1 8.257 0.020 . 1 . . . . . 240 ASP H . 27279 1 1028 . 1 1 240 240 ASP C C 13 174.986 0.3 . 1 . . . . . 240 ASP C . 27279 1 1029 . 1 1 240 240 ASP CA C 13 53.418 0.3 . 1 . . . . . 240 ASP CA . 27279 1 1030 . 1 1 240 240 ASP CB C 13 39.975 0.3 . 1 . . . . . 240 ASP CB . 27279 1 1031 . 1 1 240 240 ASP N N 15 120.680 0.3 . 1 . . . . . 240 ASP N . 27279 1 1032 . 1 1 241 241 SER H H 1 7.644 0.020 . 1 . . . . . 241 SER H . 27279 1 1033 . 1 1 241 241 SER C C 13 178.513 0.3 . 1 . . . . . 241 SER C . 27279 1 1034 . 1 1 241 241 SER CA C 13 59.085 0.3 . 1 . . . . . 241 SER CA . 27279 1 1035 . 1 1 241 241 SER CB C 13 63.967 0.3 . 1 . . . . . 241 SER CB . 27279 1 1036 . 1 1 241 241 SER N N 15 121.423 0.3 . 1 . . . . . 241 SER N . 27279 1 stop_ save_