data_50139 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50139 _Entry.Title ; Backbone 1H,13C, and 15N Chemical Shift Assignments for the S. typhimurium tryptophan synthase alpha subunit ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-12-20 _Entry.Accession_date 2019-12-20 _Entry.Last_release_date 2019-12-23 _Entry.Original_release_date 2019-12-23 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Leonard Mueller . J. . 0000-0002-2607-9875 50139 2 Varun Sakhrani . V. . 0000-0002-6525-5050 50139 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50139 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 634 50139 '15N chemical shifts' 233 50139 '1H chemical shifts' 233 50139 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2021-06-29 2019-12-20 update BMRB 'update entry citation' 50139 1 . . 2020-06-09 2019-12-20 original author 'original release' 50139 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50139 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32415580 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone Assignments and Conformational Dynamics in the S. Typhimurium Tryptophan Synthase alpha-Subunit From Solution-State NMR ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 74 _Citation.Journal_issue 6-7 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1573-5001 _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 341 _Citation.Page_last 354 _Citation.Year 2020 _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 Varun Sakhrani . V. . . 50139 1 2 Eduardo Hilario . . . . 50139 1 3 Bethany Caulkins . G. . . 50139 1 4 Mary Hatcher-Skeers . E. . . 50139 1 5 Li Fan . . . . 50139 1 6 Michael Dunn . F. . . 50139 1 7 Leonard Mueller . J. . . 50139 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'S.typhimurium, tryptophan synthase, alpha-subunit' 50139 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50139 _Assembly.ID 1 _Assembly.Name TS_alpha_subunit _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 28500 _Assembly.Enzyme_commission_number . _Assembly.Details 'single chain polymer' _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 TS_alpha_subunit 1 $entity_1 . . yes native no no . . . 50139 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 6OSO . . . . . . 50139 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50139 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; MERYENLFAQLNDRREGAFV PFVTLGDPGIEQSLKIIDTL IDAGADALELGVPFSDPLAD GPTIQNANLRAFAAGVTPAQ CFEMLALIREKHPTIPIGLL MYANLVFNNGIDAFYARCEQ VGVDSVLVADVPVEESAPFR QAALRHNIAPIFICPPNADD DLLRQVASYGRGYTYLLSRS GVTGAENRGALPLHHLIEKL KEYHAAPALQGFGISSPEQV SAAVRAGAAGAISGSAIVKI IEKNLASPKQMLAELRSFVS AMKAASRA ; _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 268 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 28500 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PDB 6OSO . . . . . . . . . . . . . . . . 50139 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 50139 1 2 . GLU . 50139 1 3 . ARG . 50139 1 4 . TYR . 50139 1 5 . GLU . 50139 1 6 . ASN . 50139 1 7 . LEU . 50139 1 8 . PHE . 50139 1 9 . ALA . 50139 1 10 . GLN . 50139 1 11 . LEU . 50139 1 12 . ASN . 50139 1 13 . ASP . 50139 1 14 . ARG . 50139 1 15 . ARG . 50139 1 16 . GLU . 50139 1 17 . GLY . 50139 1 18 . ALA . 50139 1 19 . PHE . 50139 1 20 . VAL . 50139 1 21 . PRO . 50139 1 22 . PHE . 50139 1 23 . VAL . 50139 1 24 . THR . 50139 1 25 . LEU . 50139 1 26 . GLY . 50139 1 27 . ASP . 50139 1 28 . PRO . 50139 1 29 . GLY . 50139 1 30 . ILE . 50139 1 31 . GLU . 50139 1 32 . GLN . 50139 1 33 . SER . 50139 1 34 . LEU . 50139 1 35 . LYS . 50139 1 36 . ILE . 50139 1 37 . ILE . 50139 1 38 . ASP . 50139 1 39 . THR . 50139 1 40 . LEU . 50139 1 41 . ILE . 50139 1 42 . ASP . 50139 1 43 . ALA . 50139 1 44 . GLY . 50139 1 45 . ALA . 50139 1 46 . ASP . 50139 1 47 . ALA . 50139 1 48 . LEU . 50139 1 49 . GLU . 50139 1 50 . LEU . 50139 1 51 . GLY . 50139 1 52 . VAL . 50139 1 53 . PRO . 50139 1 54 . PHE . 50139 1 55 . SER . 50139 1 56 . ASP . 50139 1 57 . PRO . 50139 1 58 . LEU . 50139 1 59 . ALA . 50139 1 60 . ASP . 50139 1 61 . GLY . 50139 1 62 . PRO . 50139 1 63 . THR . 50139 1 64 . ILE . 50139 1 65 . GLN . 50139 1 66 . ASN . 50139 1 67 . ALA . 50139 1 68 . ASN . 50139 1 69 . LEU . 50139 1 70 . ARG . 50139 1 71 . ALA . 50139 1 72 . PHE . 50139 1 73 . ALA . 50139 1 74 . ALA . 50139 1 75 . GLY . 50139 1 76 . VAL . 50139 1 77 . THR . 50139 1 78 . PRO . 50139 1 79 . ALA . 50139 1 80 . GLN . 50139 1 81 . CYS . 50139 1 82 . PHE . 50139 1 83 . GLU . 50139 1 84 . MET . 50139 1 85 . LEU . 50139 1 86 . ALA . 50139 1 87 . LEU . 50139 1 88 . ILE . 50139 1 89 . ARG . 50139 1 90 . GLU . 50139 1 91 . LYS . 50139 1 92 . HIS . 50139 1 93 . PRO . 50139 1 94 . THR . 50139 1 95 . ILE . 50139 1 96 . PRO . 50139 1 97 . ILE . 50139 1 98 . GLY . 50139 1 99 . LEU . 50139 1 100 . LEU . 50139 1 101 . MET . 50139 1 102 . TYR . 50139 1 103 . ALA . 50139 1 104 . ASN . 50139 1 105 . LEU . 50139 1 106 . VAL . 50139 1 107 . PHE . 50139 1 108 . ASN . 50139 1 109 . ASN . 50139 1 110 . GLY . 50139 1 111 . ILE . 50139 1 112 . ASP . 50139 1 113 . ALA . 50139 1 114 . PHE . 50139 1 115 . TYR . 50139 1 116 . ALA . 50139 1 117 . ARG . 50139 1 118 . CYS . 50139 1 119 . GLU . 50139 1 120 . GLN . 50139 1 121 . VAL . 50139 1 122 . GLY . 50139 1 123 . VAL . 50139 1 124 . ASP . 50139 1 125 . SER . 50139 1 126 . VAL . 50139 1 127 . LEU . 50139 1 128 . VAL . 50139 1 129 . ALA . 50139 1 130 . ASP . 50139 1 131 . VAL . 50139 1 132 . PRO . 50139 1 133 . VAL . 50139 1 134 . GLU . 50139 1 135 . GLU . 50139 1 136 . SER . 50139 1 137 . ALA . 50139 1 138 . PRO . 50139 1 139 . PHE . 50139 1 140 . ARG . 50139 1 141 . GLN . 50139 1 142 . ALA . 50139 1 143 . ALA . 50139 1 144 . LEU . 50139 1 145 . ARG . 50139 1 146 . HIS . 50139 1 147 . ASN . 50139 1 148 . ILE . 50139 1 149 . ALA . 50139 1 150 . PRO . 50139 1 151 . ILE . 50139 1 152 . PHE . 50139 1 153 . ILE . 50139 1 154 . CYS . 50139 1 155 . PRO . 50139 1 156 . PRO . 50139 1 157 . ASN . 50139 1 158 . ALA . 50139 1 159 . ASP . 50139 1 160 . ASP . 50139 1 161 . ASP . 50139 1 162 . LEU . 50139 1 163 . LEU . 50139 1 164 . ARG . 50139 1 165 . GLN . 50139 1 166 . VAL . 50139 1 167 . ALA . 50139 1 168 . SER . 50139 1 169 . TYR . 50139 1 170 . GLY . 50139 1 171 . ARG . 50139 1 172 . GLY . 50139 1 173 . TYR . 50139 1 174 . THR . 50139 1 175 . TYR . 50139 1 176 . LEU . 50139 1 177 . LEU . 50139 1 178 . SER . 50139 1 179 . ARG . 50139 1 180 . SER . 50139 1 181 . GLY . 50139 1 182 . VAL . 50139 1 183 . THR . 50139 1 184 . GLY . 50139 1 185 . ALA . 50139 1 186 . GLU . 50139 1 187 . ASN . 50139 1 188 . ARG . 50139 1 189 . GLY . 50139 1 190 . ALA . 50139 1 191 . LEU . 50139 1 192 . PRO . 50139 1 193 . LEU . 50139 1 194 . HIS . 50139 1 195 . HIS . 50139 1 196 . LEU . 50139 1 197 . ILE . 50139 1 198 . GLU . 50139 1 199 . LYS . 50139 1 200 . LEU . 50139 1 201 . LYS . 50139 1 202 . GLU . 50139 1 203 . TYR . 50139 1 204 . HIS . 50139 1 205 . ALA . 50139 1 206 . ALA . 50139 1 207 . PRO . 50139 1 208 . ALA . 50139 1 209 . LEU . 50139 1 210 . GLN . 50139 1 211 . GLY . 50139 1 212 . PHE . 50139 1 213 . GLY . 50139 1 214 . ILE . 50139 1 215 . SER . 50139 1 216 . SER . 50139 1 217 . PRO . 50139 1 218 . GLU . 50139 1 219 . GLN . 50139 1 220 . VAL . 50139 1 221 . SER . 50139 1 222 . ALA . 50139 1 223 . ALA . 50139 1 224 . VAL . 50139 1 225 . ARG . 50139 1 226 . ALA . 50139 1 227 . GLY . 50139 1 228 . ALA . 50139 1 229 . ALA . 50139 1 230 . GLY . 50139 1 231 . ALA . 50139 1 232 . ILE . 50139 1 233 . SER . 50139 1 234 . GLY . 50139 1 235 . SER . 50139 1 236 . ALA . 50139 1 237 . ILE . 50139 1 238 . VAL . 50139 1 239 . LYS . 50139 1 240 . ILE . 50139 1 241 . ILE . 50139 1 242 . GLU . 50139 1 243 . LYS . 50139 1 244 . ASN . 50139 1 245 . LEU . 50139 1 246 . ALA . 50139 1 247 . SER . 50139 1 248 . PRO . 50139 1 249 . LYS . 50139 1 250 . GLN . 50139 1 251 . MET . 50139 1 252 . LEU . 50139 1 253 . ALA . 50139 1 254 . GLU . 50139 1 255 . LEU . 50139 1 256 . ARG . 50139 1 257 . SER . 50139 1 258 . PHE . 50139 1 259 . VAL . 50139 1 260 . SER . 50139 1 261 . ALA . 50139 1 262 . MET . 50139 1 263 . LYS . 50139 1 264 . ALA . 50139 1 265 . ALA . 50139 1 266 . SER . 50139 1 267 . ARG . 50139 1 268 . ALA . 50139 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 50139 1 . GLU 2 2 50139 1 . ARG 3 3 50139 1 . TYR 4 4 50139 1 . GLU 5 5 50139 1 . ASN 6 6 50139 1 . LEU 7 7 50139 1 . PHE 8 8 50139 1 . ALA 9 9 50139 1 . GLN 10 10 50139 1 . LEU 11 11 50139 1 . ASN 12 12 50139 1 . ASP 13 13 50139 1 . ARG 14 14 50139 1 . ARG 15 15 50139 1 . GLU 16 16 50139 1 . GLY 17 17 50139 1 . ALA 18 18 50139 1 . PHE 19 19 50139 1 . VAL 20 20 50139 1 . PRO 21 21 50139 1 . PHE 22 22 50139 1 . VAL 23 23 50139 1 . THR 24 24 50139 1 . LEU 25 25 50139 1 . GLY 26 26 50139 1 . ASP 27 27 50139 1 . PRO 28 28 50139 1 . GLY 29 29 50139 1 . ILE 30 30 50139 1 . GLU 31 31 50139 1 . GLN 32 32 50139 1 . SER 33 33 50139 1 . LEU 34 34 50139 1 . LYS 35 35 50139 1 . ILE 36 36 50139 1 . ILE 37 37 50139 1 . ASP 38 38 50139 1 . THR 39 39 50139 1 . LEU 40 40 50139 1 . ILE 41 41 50139 1 . ASP 42 42 50139 1 . ALA 43 43 50139 1 . GLY 44 44 50139 1 . ALA 45 45 50139 1 . ASP 46 46 50139 1 . ALA 47 47 50139 1 . LEU 48 48 50139 1 . GLU 49 49 50139 1 . LEU 50 50 50139 1 . GLY 51 51 50139 1 . VAL 52 52 50139 1 . PRO 53 53 50139 1 . PHE 54 54 50139 1 . SER 55 55 50139 1 . ASP 56 56 50139 1 . PRO 57 57 50139 1 . LEU 58 58 50139 1 . ALA 59 59 50139 1 . ASP 60 60 50139 1 . GLY 61 61 50139 1 . PRO 62 62 50139 1 . THR 63 63 50139 1 . ILE 64 64 50139 1 . GLN 65 65 50139 1 . ASN 66 66 50139 1 . ALA 67 67 50139 1 . ASN 68 68 50139 1 . LEU 69 69 50139 1 . ARG 70 70 50139 1 . ALA 71 71 50139 1 . PHE 72 72 50139 1 . ALA 73 73 50139 1 . ALA 74 74 50139 1 . GLY 75 75 50139 1 . VAL 76 76 50139 1 . THR 77 77 50139 1 . PRO 78 78 50139 1 . ALA 79 79 50139 1 . GLN 80 80 50139 1 . CYS 81 81 50139 1 . PHE 82 82 50139 1 . GLU 83 83 50139 1 . MET 84 84 50139 1 . LEU 85 85 50139 1 . ALA 86 86 50139 1 . LEU 87 87 50139 1 . ILE 88 88 50139 1 . ARG 89 89 50139 1 . GLU 90 90 50139 1 . LYS 91 91 50139 1 . HIS 92 92 50139 1 . PRO 93 93 50139 1 . THR 94 94 50139 1 . ILE 95 95 50139 1 . PRO 96 96 50139 1 . ILE 97 97 50139 1 . GLY 98 98 50139 1 . LEU 99 99 50139 1 . LEU 100 100 50139 1 . MET 101 101 50139 1 . TYR 102 102 50139 1 . ALA 103 103 50139 1 . ASN 104 104 50139 1 . LEU 105 105 50139 1 . VAL 106 106 50139 1 . PHE 107 107 50139 1 . ASN 108 108 50139 1 . ASN 109 109 50139 1 . GLY 110 110 50139 1 . ILE 111 111 50139 1 . ASP 112 112 50139 1 . ALA 113 113 50139 1 . PHE 114 114 50139 1 . TYR 115 115 50139 1 . ALA 116 116 50139 1 . ARG 117 117 50139 1 . CYS 118 118 50139 1 . GLU 119 119 50139 1 . GLN 120 120 50139 1 . VAL 121 121 50139 1 . GLY 122 122 50139 1 . VAL 123 123 50139 1 . ASP 124 124 50139 1 . SER 125 125 50139 1 . VAL 126 126 50139 1 . LEU 127 127 50139 1 . VAL 128 128 50139 1 . ALA 129 129 50139 1 . ASP 130 130 50139 1 . VAL 131 131 50139 1 . PRO 132 132 50139 1 . VAL 133 133 50139 1 . GLU 134 134 50139 1 . GLU 135 135 50139 1 . SER 136 136 50139 1 . ALA 137 137 50139 1 . PRO 138 138 50139 1 . PHE 139 139 50139 1 . ARG 140 140 50139 1 . GLN 141 141 50139 1 . ALA 142 142 50139 1 . ALA 143 143 50139 1 . LEU 144 144 50139 1 . ARG 145 145 50139 1 . HIS 146 146 50139 1 . ASN 147 147 50139 1 . ILE 148 148 50139 1 . ALA 149 149 50139 1 . PRO 150 150 50139 1 . ILE 151 151 50139 1 . PHE 152 152 50139 1 . ILE 153 153 50139 1 . CYS 154 154 50139 1 . PRO 155 155 50139 1 . PRO 156 156 50139 1 . ASN 157 157 50139 1 . ALA 158 158 50139 1 . ASP 159 159 50139 1 . ASP 160 160 50139 1 . ASP 161 161 50139 1 . LEU 162 162 50139 1 . LEU 163 163 50139 1 . ARG 164 164 50139 1 . GLN 165 165 50139 1 . VAL 166 166 50139 1 . ALA 167 167 50139 1 . SER 168 168 50139 1 . TYR 169 169 50139 1 . GLY 170 170 50139 1 . ARG 171 171 50139 1 . GLY 172 172 50139 1 . TYR 173 173 50139 1 . THR 174 174 50139 1 . TYR 175 175 50139 1 . LEU 176 176 50139 1 . LEU 177 177 50139 1 . SER 178 178 50139 1 . ARG 179 179 50139 1 . SER 180 180 50139 1 . GLY 181 181 50139 1 . VAL 182 182 50139 1 . THR 183 183 50139 1 . GLY 184 184 50139 1 . ALA 185 185 50139 1 . GLU 186 186 50139 1 . ASN 187 187 50139 1 . ARG 188 188 50139 1 . GLY 189 189 50139 1 . ALA 190 190 50139 1 . LEU 191 191 50139 1 . PRO 192 192 50139 1 . LEU 193 193 50139 1 . HIS 194 194 50139 1 . HIS 195 195 50139 1 . LEU 196 196 50139 1 . ILE 197 197 50139 1 . GLU 198 198 50139 1 . LYS 199 199 50139 1 . LEU 200 200 50139 1 . LYS 201 201 50139 1 . GLU 202 202 50139 1 . TYR 203 203 50139 1 . HIS 204 204 50139 1 . ALA 205 205 50139 1 . ALA 206 206 50139 1 . PRO 207 207 50139 1 . ALA 208 208 50139 1 . LEU 209 209 50139 1 . GLN 210 210 50139 1 . GLY 211 211 50139 1 . PHE 212 212 50139 1 . GLY 213 213 50139 1 . ILE 214 214 50139 1 . SER 215 215 50139 1 . SER 216 216 50139 1 . PRO 217 217 50139 1 . GLU 218 218 50139 1 . GLN 219 219 50139 1 . VAL 220 220 50139 1 . SER 221 221 50139 1 . ALA 222 222 50139 1 . ALA 223 223 50139 1 . VAL 224 224 50139 1 . ARG 225 225 50139 1 . ALA 226 226 50139 1 . GLY 227 227 50139 1 . ALA 228 228 50139 1 . ALA 229 229 50139 1 . GLY 230 230 50139 1 . ALA 231 231 50139 1 . ILE 232 232 50139 1 . SER 233 233 50139 1 . GLY 234 234 50139 1 . SER 235 235 50139 1 . ALA 236 236 50139 1 . ILE 237 237 50139 1 . VAL 238 238 50139 1 . LYS 239 239 50139 1 . ILE 240 240 50139 1 . ILE 241 241 50139 1 . GLU 242 242 50139 1 . LYS 243 243 50139 1 . ASN 244 244 50139 1 . LEU 245 245 50139 1 . ALA 246 246 50139 1 . SER 247 247 50139 1 . PRO 248 248 50139 1 . LYS 249 249 50139 1 . GLN 250 250 50139 1 . MET 251 251 50139 1 . LEU 252 252 50139 1 . ALA 253 253 50139 1 . GLU 254 254 50139 1 . LEU 255 255 50139 1 . ARG 256 256 50139 1 . SER 257 257 50139 1 . PHE 258 258 50139 1 . VAL 259 259 50139 1 . SER 260 260 50139 1 . ALA 261 261 50139 1 . MET 262 262 50139 1 . LYS 263 263 50139 1 . ALA 264 264 50139 1 . ALA 265 265 50139 1 . SER 266 266 50139 1 . ARG 267 267 50139 1 . ALA 268 268 50139 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50139 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 28901 organism . 'Salmonella typhimurium' 'Salmonella typhimurium' . . Bacteria . Salmonella enterica . . . . . . . . . . . . . 50139 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50139 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pEBA-10 . . . 50139 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50139 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '2H 13C 15N sample' _Sample.Aggregate_sample_number 1 _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 entity_1 '[U-2H; U-13C; U-15N]' . . 1 $entity_1 . . 750 . . uM . . . . 50139 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM 0 . . . 50139 1 3 EDTA 'natural abundance' . . . . . . 1 . . mM 0 . . . 50139 1 4 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % 0 . . . 50139 1 5 DTT 'natural abundance' . . . . . . 1 . . mM 0 . . . 50139 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 50139 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details ; The protein concentration was 750uM in a 50 mM sodium phosphate buffer, pH 6.5, containing 1mM DTT, 1mM Na 2 EDTA, 0.05% NaN3, and 10% (v/v) D2O. ; 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' 50 . mM 50139 1 pH 6.5 . pH 50139 1 pressure 1 . atm 50139 1 temperature 298 . K 50139 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50139 _Software.ID 1 _Software.Type . _Software.Name PINE _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 50139 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50139 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50139 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 50139 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 50139 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50139 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'Bruker Avance III 700' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50139 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50139 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50139 1 3 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50139 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50139 1 5 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50139 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50139 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.251449530 . . . . . 50139 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50139 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.101329118 . . . . . 50139 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50139 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'TROSY offset: amide protons and nitrogens.' _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' . . . 50139 1 2 '3D HNCO' . . . 50139 1 3 '3D HN(CA)CO' . . . 50139 1 4 '3D HNCACB' . . . 50139 1 5 '3D HN(CO)CACB' . . . 50139 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50139 1 2 $software_2 . . 50139 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 MET C C 13 175.030 . . 1 . . . . . 1 M C . 50139 1 2 . 1 . 1 2 2 GLU H H 1 7.679 . . 1 . . . . . 2 E H . 50139 1 3 . 1 . 1 2 2 GLU C C 13 177.180 . . 1 . . . . . 2 E C . 50139 1 4 . 1 . 1 2 2 GLU CA C 13 56.634 . . 1 . . . . . 2 E CA . 50139 1 5 . 1 . 1 2 2 GLU CB C 13 28.689 . . 1 . . . . . 2 E CB . 50139 1 6 . 1 . 1 2 2 GLU N N 15 121.161 . . 1 . . . . . 2 E N . 50139 1 7 . 1 . 1 3 3 ARG H H 1 9.116 . . 1 . . . . . 3 R H . 50139 1 8 . 1 . 1 3 3 ARG C C 13 181.030 . . 1 . . . . . 3 R C . 50139 1 9 . 1 . 1 3 3 ARG CA C 13 61.069 . . 1 . . . . . 3 R CA . 50139 1 10 . 1 . 1 3 3 ARG N N 15 120.721 . . 1 . . . . . 3 R N . 50139 1 11 . 1 . 1 4 4 TYR H H 1 8.819 . . 1 . . . . . 4 Y H . 50139 1 12 . 1 . 1 4 4 TYR C C 13 176.602 . . 1 . . . . . 4 Y C . 50139 1 13 . 1 . 1 4 4 TYR CA C 13 63.247 . . 1 . . . . . 4 Y CA . 50139 1 14 . 1 . 1 4 4 TYR CB C 13 36.322 . . 1 . . . . . 4 Y CB . 50139 1 15 . 1 . 1 4 4 TYR N N 15 118.056 . . 1 . . . . . 4 Y N . 50139 1 16 . 1 . 1 5 5 GLU H H 1 8.614 . . 1 . . . . . 5 E H . 50139 1 17 . 1 . 1 5 5 GLU C C 13 180.348 . . 1 . . . . . 5 E C . 50139 1 18 . 1 . 1 5 5 GLU CA C 13 59.979 . . 1 . . . . . 5 E CA . 50139 1 19 . 1 . 1 5 5 GLU CB C 13 28.204 . . 1 . . . . . 5 E CB . 50139 1 20 . 1 . 1 5 5 GLU N N 15 121.475 . . 1 . . . . . 5 E N . 50139 1 21 . 1 . 1 6 6 ASN H H 1 8.198 . . 1 . . . . . 6 N H . 50139 1 22 . 1 . 1 6 6 ASN C C 13 177.069 . . 1 . . . . . 6 N C . 50139 1 23 . 1 . 1 6 6 ASN CA C 13 55.849 . . 1 . . . . . 6 N CA . 50139 1 24 . 1 . 1 6 6 ASN CB C 13 38.160 . . 1 . . . . . 6 N CB . 50139 1 25 . 1 . 1 6 6 ASN N N 15 117.225 . . 1 . . . . . 6 N N . 50139 1 26 . 1 . 1 7 7 LEU H H 1 7.519 . . 1 . . . . . 7 L H . 50139 1 27 . 1 . 1 7 7 LEU C C 13 178.416 . . 1 . . . . . 7 L C . 50139 1 28 . 1 . 1 7 7 LEU CA C 13 57.858 . . 1 . . . . . 7 L CA . 50139 1 29 . 1 . 1 7 7 LEU CB C 13 40.172 . . 1 . . . . . 7 L CB . 50139 1 30 . 1 . 1 7 7 LEU N N 15 121.428 . . 1 . . . . . 7 L N . 50139 1 31 . 1 . 1 8 8 PHE H H 1 8.772 . . 1 . . . . . 8 F H . 50139 1 32 . 1 . 1 8 8 PHE C C 13 178.873 . . 1 . . . . . 8 F C . 50139 1 33 . 1 . 1 8 8 PHE CA C 13 62.181 . . 1 . . . . . 8 F CA . 50139 1 34 . 1 . 1 8 8 PHE CB C 13 36.679 . . 1 . . . . . 8 F CB . 50139 1 35 . 1 . 1 8 8 PHE N N 15 116.044 . . 1 . . . . . 8 F N . 50139 1 36 . 1 . 1 9 9 ALA H H 1 8.018 . . 1 . . . . . 9 A H . 50139 1 37 . 1 . 1 9 9 ALA C C 13 180.555 . . 1 . . . . . 9 A C . 50139 1 38 . 1 . 1 9 9 ALA CA C 13 55.217 . . 1 . . . . . 9 A CA . 50139 1 39 . 1 . 1 9 9 ALA CB C 13 17.299 . . 1 . . . . . 9 A CB . 50139 1 40 . 1 . 1 9 9 ALA N N 15 123.317 . . 1 . . . . . 9 A N . 50139 1 41 . 1 . 1 10 10 GLN H H 1 7.800 . . 1 . . . . . 10 Q H . 50139 1 42 . 1 . 1 10 10 GLN C C 13 179.535 . . 1 . . . . . 10 Q C . 50139 1 43 . 1 . 1 10 10 GLN CA C 13 58.445 . . 1 . . . . . 10 Q CA . 50139 1 44 . 1 . 1 10 10 GLN CB C 13 27.695 . . 1 . . . . . 10 Q CB . 50139 1 45 . 1 . 1 10 10 GLN N N 15 119.414 . . 1 . . . . . 10 Q N . 50139 1 46 . 1 . 1 11 11 LEU H H 1 8.730 . . 1 . . . . . 11 L H . 50139 1 47 . 1 . 1 11 11 LEU C C 13 180.101 . . 1 . . . . . 11 L C . 50139 1 48 . 1 . 1 11 11 LEU CA C 13 57.733 . . 1 . . . . . 11 L CA . 50139 1 49 . 1 . 1 11 11 LEU CB C 13 38.752 . . 1 . . . . . 11 L CB . 50139 1 50 . 1 . 1 11 11 LEU N N 15 119.627 . . 1 . . . . . 11 L N . 50139 1 51 . 1 . 1 12 12 ASN H H 1 8.337 . . 1 . . . . . 12 N H . 50139 1 52 . 1 . 1 12 12 ASN C C 13 179.136 . . 1 . . . . . 12 N C . 50139 1 53 . 1 . 1 12 12 ASN CA C 13 56.369 . . 1 . . . . . 12 N CA . 50139 1 54 . 1 . 1 12 12 ASN CB C 13 38.213 . . 1 . . . . . 12 N CB . 50139 1 55 . 1 . 1 12 12 ASN N N 15 118.330 . . 1 . . . . . 12 N N . 50139 1 56 . 1 . 1 13 13 ASP H H 1 7.661 . . 1 . . . . . 13 D H . 50139 1 57 . 1 . 1 13 13 ASP C C 13 177.678 . . 1 . . . . . 13 D C . 50139 1 58 . 1 . 1 13 13 ASP CA C 13 57.026 . . 1 . . . . . 13 D CA . 50139 1 59 . 1 . 1 13 13 ASP CB C 13 40.312 . . 1 . . . . . 13 D CB . 50139 1 60 . 1 . 1 13 13 ASP N N 15 120.971 . . 1 . . . . . 13 D N . 50139 1 61 . 1 . 1 14 14 ARG H H 1 7.542 . . 1 . . . . . 14 R H . 50139 1 62 . 1 . 1 14 14 ARG C C 13 175.039 . . 1 . . . . . 14 R C . 50139 1 63 . 1 . 1 14 14 ARG CA C 13 56.065 . . 1 . . . . . 14 R CA . 50139 1 64 . 1 . 1 14 14 ARG CB C 13 30.458 . . 1 . . . . . 14 R CB . 50139 1 65 . 1 . 1 14 14 ARG N N 15 116.417 . . 1 . . . . . 14 R N . 50139 1 66 . 1 . 1 15 15 ARG H H 1 7.920 . . 1 . . . . . 15 R H . 50139 1 67 . 1 . 1 15 15 ARG C C 13 174.659 . . 1 . . . . . 15 R C . 50139 1 68 . 1 . 1 15 15 ARG CA C 13 56.417 . . 1 . . . . . 15 R CA . 50139 1 69 . 1 . 1 15 15 ARG CB C 13 25.863 . . 1 . . . . . 15 R CB . 50139 1 70 . 1 . 1 15 15 ARG N N 15 118.550 . . 1 . . . . . 15 R N . 50139 1 71 . 1 . 1 16 16 GLU H H 1 7.990 . . 1 . . . . . 16 E H . 50139 1 72 . 1 . 1 16 16 GLU C C 13 175.153 . . 1 . . . . . 16 E C . 50139 1 73 . 1 . 1 16 16 GLU CA C 13 54.052 . . 1 . . . . . 16 E CA . 50139 1 74 . 1 . 1 16 16 GLU CB C 13 34.248 . . 1 . . . . . 16 E CB . 50139 1 75 . 1 . 1 16 16 GLU N N 15 117.976 . . 1 . . . . . 16 E N . 50139 1 76 . 1 . 1 17 17 GLY H H 1 8.406 . . 1 . . . . . 17 G H . 50139 1 77 . 1 . 1 17 17 GLY C C 13 171.240 . . 1 . . . . . 17 G C . 50139 1 78 . 1 . 1 17 17 GLY CA C 13 43.451 . . 1 . . . . . 17 G CA . 50139 1 79 . 1 . 1 17 17 GLY N N 15 107.936 . . 1 . . . . . 17 G N . 50139 1 80 . 1 . 1 18 18 ALA H H 1 8.925 . . 1 . . . . . 18 A H . 50139 1 81 . 1 . 1 18 18 ALA C C 13 177.526 . . 1 . . . . . 18 A C . 50139 1 82 . 1 . 1 18 18 ALA CA C 13 49.960 . . 1 . . . . . 18 A CA . 50139 1 83 . 1 . 1 18 18 ALA CB C 13 19.186 . . 1 . . . . . 18 A CB . 50139 1 84 . 1 . 1 18 18 ALA N N 15 121.442 . . 1 . . . . . 18 A N . 50139 1 85 . 1 . 1 19 19 PHE H H 1 10.238 . . 1 . . . . . 19 F H . 50139 1 86 . 1 . 1 19 19 PHE C C 13 173.319 . . 1 . . . . . 19 F C . 50139 1 87 . 1 . 1 19 19 PHE CA C 13 57.932 . . 1 . . . . . 19 F CA . 50139 1 88 . 1 . 1 19 19 PHE CB C 13 40.844 . . 1 . . . . . 19 F CB . 50139 1 89 . 1 . 1 19 19 PHE N N 15 122.632 . . 1 . . . . . 19 F N . 50139 1 90 . 1 . 1 20 20 VAL H H 1 7.637 . . 1 . . . . . 20 V H . 50139 1 91 . 1 . 1 20 20 VAL CB C 13 32.998 . . 1 . . . . . 20 V CB . 50139 1 92 . 1 . 1 20 20 VAL N N 15 129.233 . . 1 . . . . . 20 V N . 50139 1 93 . 1 . 1 21 21 PRO C C 13 172.320 . . 1 . . . . . 21 P C . 50139 1 94 . 1 . 1 21 21 PRO CA C 13 64.287 . . 1 . . . . . 21 P CA . 50139 1 95 . 1 . 1 21 21 PRO CB C 13 30.583 . . 1 . . . . . 21 P CB . 50139 1 96 . 1 . 1 22 22 PHE H H 1 7.383 . . 1 . . . . . 22 F H . 50139 1 97 . 1 . 1 22 22 PHE C C 13 175.347 . . 1 . . . . . 22 F C . 50139 1 98 . 1 . 1 22 22 PHE CB C 13 38.856 . . 1 . . . . . 22 F CB . 50139 1 99 . 1 . 1 22 22 PHE N N 15 118.232 . . 1 . . . . . 22 F N . 50139 1 100 . 1 . 1 23 23 VAL H H 1 6.596 . . 1 . . . . . 23 V H . 50139 1 101 . 1 . 1 23 23 VAL C C 13 177.121 . . 1 . . . . . 23 V C . 50139 1 102 . 1 . 1 23 23 VAL CA C 13 58.650 . . 1 . . . . . 23 V CA . 50139 1 103 . 1 . 1 23 23 VAL N N 15 120.884 . . 1 . . . . . 23 V N . 50139 1 104 . 1 . 1 24 24 THR H H 1 7.526 . . 1 . . . . . 24 T H . 50139 1 105 . 1 . 1 24 24 THR C C 13 175.312 . . 1 . . . . . 24 T C . 50139 1 106 . 1 . 1 24 24 THR CA C 13 63.379 . . 1 . . . . . 24 T CA . 50139 1 107 . 1 . 1 24 24 THR CB C 13 68.654 . . 1 . . . . . 24 T CB . 50139 1 108 . 1 . 1 24 24 THR N N 15 115.657 . . 1 . . . . . 24 T N . 50139 1 109 . 1 . 1 25 25 LEU H H 1 9.156 . . 1 . . . . . 25 L H . 50139 1 110 . 1 . 1 25 25 LEU C C 13 174.617 . . 1 . . . . . 25 L C . 50139 1 111 . 1 . 1 25 25 LEU CA C 13 56.246 . . 1 . . . . . 25 L CA . 50139 1 112 . 1 . 1 25 25 LEU CB C 13 41.824 . . 1 . . . . . 25 L CB . 50139 1 113 . 1 . 1 25 25 LEU N N 15 131.548 . . 1 . . . . . 25 L N . 50139 1 114 . 1 . 1 26 26 GLY H H 1 7.784 . . 1 . . . . . 26 G H . 50139 1 115 . 1 . 1 26 26 GLY C C 13 170.115 . . 1 . . . . . 26 G C . 50139 1 116 . 1 . 1 26 26 GLY CA C 13 44.928 . . 1 . . . . . 26 G CA . 50139 1 117 . 1 . 1 26 26 GLY N N 15 104.945 . . 1 . . . . . 26 G N . 50139 1 118 . 1 . 1 27 27 ASP H H 1 6.892 . . 1 . . . . . 27 D H . 50139 1 119 . 1 . 1 27 27 ASP N N 15 114.828 . . 1 . . . . . 27 D N . 50139 1 120 . 1 . 1 28 28 PRO C C 13 176.594 . . 1 . . . . . 28 P C . 50139 1 121 . 1 . 1 28 28 PRO CA C 13 64.500 . . 1 . . . . . 28 P CA . 50139 1 122 . 1 . 1 28 28 PRO CB C 13 32.258 . . 1 . . . . . 28 P CB . 50139 1 123 . 1 . 1 29 29 GLY H H 1 7.076 . . 1 . . . . . 29 G H . 50139 1 124 . 1 . 1 29 29 GLY C C 13 173.308 . . 1 . . . . . 29 G C . 50139 1 125 . 1 . 1 29 29 GLY CA C 13 47.131 . . 1 . . . . . 29 G CA . 50139 1 126 . 1 . 1 29 29 GLY N N 15 111.459 . . 1 . . . . . 29 G N . 50139 1 127 . 1 . 1 30 30 ILE H H 1 8.859 . . 1 . . . . . 30 I H . 50139 1 128 . 1 . 1 30 30 ILE C C 13 176.969 . . 1 . . . . . 30 I C . 50139 1 129 . 1 . 1 30 30 ILE CA C 13 66.600 . . 1 . . . . . 30 I CA . 50139 1 130 . 1 . 1 30 30 ILE CB C 13 36.817 . . 1 . . . . . 30 I CB . 50139 1 131 . 1 . 1 30 30 ILE N N 15 122.039 . . 1 . . . . . 30 I N . 50139 1 132 . 1 . 1 31 31 GLU H H 1 8.463 . . 1 . . . . . 31 E H . 50139 1 133 . 1 . 1 31 31 GLU C C 13 180.101 . . 1 . . . . . 31 E C . 50139 1 134 . 1 . 1 31 31 GLU CA C 13 59.757 . . 1 . . . . . 31 E CA . 50139 1 135 . 1 . 1 31 31 GLU CB C 13 28.183 . . 1 . . . . . 31 E CB . 50139 1 136 . 1 . 1 31 31 GLU N N 15 118.403 . . 1 . . . . . 31 E N . 50139 1 137 . 1 . 1 32 32 GLN H H 1 8.809 . . 1 . . . . . 32 Q H . 50139 1 138 . 1 . 1 32 32 GLN C C 13 177.870 . . 1 . . . . . 32 Q C . 50139 1 139 . 1 . 1 32 32 GLN CA C 13 57.411 . . 1 . . . . . 32 Q CA . 50139 1 140 . 1 . 1 32 32 GLN CB C 13 26.728 . . 1 . . . . . 32 Q CB . 50139 1 141 . 1 . 1 32 32 GLN N N 15 118.863 . . 1 . . . . . 32 Q N . 50139 1 142 . 1 . 1 33 33 SER H H 1 8.151 . . 1 . . . . . 33 S H . 50139 1 143 . 1 . 1 33 33 SER C C 13 173.555 . . 1 . . . . . 33 S C . 50139 1 144 . 1 . 1 33 33 SER CB C 13 62.648 . . 1 . . . . . 33 S CB . 50139 1 145 . 1 . 1 33 33 SER N N 15 114.945 . . 1 . . . . . 33 S N . 50139 1 146 . 1 . 1 34 34 LEU H H 1 7.556 . . 1 . . . . . 34 L H . 50139 1 147 . 1 . 1 34 34 LEU C C 13 179.824 . . 1 . . . . . 34 L C . 50139 1 148 . 1 . 1 34 34 LEU CA C 13 58.369 . . 1 . . . . . 34 L CA . 50139 1 149 . 1 . 1 34 34 LEU CB C 13 40.228 . . 1 . . . . . 34 L CB . 50139 1 150 . 1 . 1 34 34 LEU N N 15 123.716 . . 1 . . . . . 34 L N . 50139 1 151 . 1 . 1 35 35 LYS H H 1 7.447 . . 1 . . . . . 35 K H . 50139 1 152 . 1 . 1 35 35 LYS C C 13 180.714 . . 1 . . . . . 35 K C . 50139 1 153 . 1 . 1 35 35 LYS CA C 13 59.015 . . 1 . . . . . 35 K CA . 50139 1 154 . 1 . 1 35 35 LYS CB C 13 31.572 . . 1 . . . . . 35 K CB . 50139 1 155 . 1 . 1 35 35 LYS N N 15 118.950 . . 1 . . . . . 35 K N . 50139 1 156 . 1 . 1 36 36 ILE H H 1 8.918 . . 1 . . . . . 36 I H . 50139 1 157 . 1 . 1 36 36 ILE C C 13 177.528 . . 1 . . . . . 36 I C . 50139 1 158 . 1 . 1 36 36 ILE CA C 13 65.759 . . 1 . . . . . 36 I CA . 50139 1 159 . 1 . 1 36 36 ILE CB C 13 36.939 . . 1 . . . . . 36 I CB . 50139 1 160 . 1 . 1 36 36 ILE N N 15 125.710 . . 1 . . . . . 36 I N . 50139 1 161 . 1 . 1 37 37 ILE H H 1 8.454 . . 1 . . . . . 37 I H . 50139 1 162 . 1 . 1 37 37 ILE CB C 13 36.700 . . 1 . . . . . 37 I CB . 50139 1 163 . 1 . 1 37 37 ILE N N 15 121.735 . . 1 . . . . . 37 I N . 50139 1 164 . 1 . 1 38 38 ASP H H 1 7.850 . . 1 . . . . . 38 D H . 50139 1 165 . 1 . 1 38 38 ASP CA C 13 51.616 . . 1 . . . . . 38 D CA . 50139 1 166 . 1 . 1 38 38 ASP CB C 13 40.106 . . 1 . . . . . 38 D CB . 50139 1 167 . 1 . 1 38 38 ASP N N 15 122.293 . . 1 . . . . . 38 D N . 50139 1 168 . 1 . 1 39 39 THR H H 1 8.476 . . 1 . . . . . 39 T H . 50139 1 169 . 1 . 1 39 39 THR C C 13 175.623 . . 1 . . . . . 39 T C . 50139 1 170 . 1 . 1 39 39 THR CB C 13 67.646 . . 1 . . . . . 39 T CB . 50139 1 171 . 1 . 1 39 39 THR N N 15 119.145 . . 1 . . . . . 39 T N . 50139 1 172 . 1 . 1 40 40 LEU H H 1 8.593 . . 1 . . . . . 40 L H . 50139 1 173 . 1 . 1 40 40 LEU N N 15 121.128 . . 1 . . . . . 40 L N . 50139 1 174 . 1 . 1 41 41 ILE H H 1 8.026 . . 1 . . . . . 41 I H . 50139 1 175 . 1 . 1 41 41 ILE C C 13 179.779 . . 1 . . . . . 41 I C . 50139 1 176 . 1 . 1 41 41 ILE CA C 13 65.111 . . 1 . . . . . 41 I CA . 50139 1 177 . 1 . 1 41 41 ILE CB C 13 37.445 . . 1 . . . . . 41 I CB . 50139 1 178 . 1 . 1 41 41 ILE N N 15 122.289 . . 1 . . . . . 41 I N . 50139 1 179 . 1 . 1 42 42 ASP H H 1 8.447 . . 1 . . . . . 42 D H . 50139 1 180 . 1 . 1 42 42 ASP C C 13 177.530 . . 1 . . . . . 42 D C . 50139 1 181 . 1 . 1 42 42 ASP CA C 13 57.064 . . 1 . . . . . 42 D CA . 50139 1 182 . 1 . 1 42 42 ASP CB C 13 41.017 . . 1 . . . . . 42 D CB . 50139 1 183 . 1 . 1 42 42 ASP N N 15 122.834 . . 1 . . . . . 42 D N . 50139 1 184 . 1 . 1 43 43 ALA H H 1 8.032 . . 1 . . . . . 43 A H . 50139 1 185 . 1 . 1 43 43 ALA C C 13 176.894 . . 1 . . . . . 43 A C . 50139 1 186 . 1 . 1 43 43 ALA CA C 13 52.073 . . 1 . . . . . 43 A CA . 50139 1 187 . 1 . 1 43 43 ALA CB C 13 19.896 . . 1 . . . . . 43 A CB . 50139 1 188 . 1 . 1 43 43 ALA N N 15 117.435 . . 1 . . . . . 43 A N . 50139 1 189 . 1 . 1 44 44 GLY H H 1 7.444 . . 1 . . . . . 44 G H . 50139 1 190 . 1 . 1 44 44 GLY C C 13 173.922 . . 1 . . . . . 44 G C . 50139 1 191 . 1 . 1 44 44 GLY CA C 13 44.076 . . 1 . . . . . 44 G CA . 50139 1 192 . 1 . 1 44 44 GLY N N 15 103.038 . . 1 . . . . . 44 G N . 50139 1 193 . 1 . 1 45 45 ALA H H 1 8.041 . . 1 . . . . . 45 A H . 50139 1 194 . 1 . 1 45 45 ALA C C 13 171.109 . . 1 . . . . . 45 A C . 50139 1 195 . 1 . 1 45 45 ALA CA C 13 53.278 . . 1 . . . . . 45 A CA . 50139 1 196 . 1 . 1 45 45 ALA CB C 13 18.253 . . 1 . . . . . 45 A CB . 50139 1 197 . 1 . 1 45 45 ALA N N 15 121.279 . . 1 . . . . . 45 A N . 50139 1 198 . 1 . 1 46 46 ASP H H 1 8.462 . . 1 . . . . . 46 D H . 50139 1 199 . 1 . 1 46 46 ASP CA C 13 56.408 . . 1 . . . . . 46 D CA . 50139 1 200 . 1 . 1 46 46 ASP CB C 13 43.601 . . 1 . . . . . 46 D CB . 50139 1 201 . 1 . 1 46 46 ASP N N 15 117.580 . . 1 . . . . . 46 D N . 50139 1 202 . 1 . 1 47 47 ALA H H 1 7.718 . . 1 . . . . . 47 A H . 50139 1 203 . 1 . 1 47 47 ALA C C 13 173.890 . . 1 . . . . . 47 A C . 50139 1 204 . 1 . 1 47 47 ALA CA C 13 49.183 . . 1 . . . . . 47 A CA . 50139 1 205 . 1 . 1 47 47 ALA CB C 13 19.917 . . 1 . . . . . 47 A CB . 50139 1 206 . 1 . 1 47 47 ALA N N 15 113.939 . . 1 . . . . . 47 A N . 50139 1 207 . 1 . 1 48 48 LEU H H 1 8.049 . . 1 . . . . . 48 L H . 50139 1 208 . 1 . 1 48 48 LEU C C 13 176.587 . . 1 . . . . . 48 L C . 50139 1 209 . 1 . 1 48 48 LEU CA C 13 53.060 . . 1 . . . . . 48 L CA . 50139 1 210 . 1 . 1 48 48 LEU CB C 13 45.333 . . 1 . . . . . 48 L CB . 50139 1 211 . 1 . 1 48 48 LEU N N 15 114.406 . . 1 . . . . . 48 L N . 50139 1 212 . 1 . 1 49 49 GLU H H 1 8.275 . . 1 . . . . . 49 E H . 50139 1 213 . 1 . 1 49 49 GLU C C 13 172.386 . . 1 . . . . . 49 E C . 50139 1 214 . 1 . 1 49 49 GLU CA C 13 53.996 . . 1 . . . . . 49 E CA . 50139 1 215 . 1 . 1 49 49 GLU CB C 13 28.512 . . 1 . . . . . 49 E CB . 50139 1 216 . 1 . 1 49 49 GLU N N 15 127.676 . . 1 . . . . . 49 E N . 50139 1 217 . 1 . 1 50 50 LEU H H 1 9.164 . . 1 . . . . . 50 L H . 50139 1 218 . 1 . 1 50 50 LEU C C 13 176.147 . . 1 . . . . . 50 L C . 50139 1 219 . 1 . 1 50 50 LEU CA C 13 51.921 . . 1 . . . . . 50 L CA . 50139 1 220 . 1 . 1 50 50 LEU CB C 13 42.795 . . 1 . . . . . 50 L CB . 50139 1 221 . 1 . 1 50 50 LEU N N 15 125.905 . . 1 . . . . . 50 L N . 50139 1 222 . 1 . 1 51 51 GLY H H 1 8.912 . . 1 . . . . . 51 G H . 50139 1 223 . 1 . 1 51 51 GLY CA C 13 44.280 . . 1 . . . . . 51 G CA . 50139 1 224 . 1 . 1 51 51 GLY N N 15 110.790 . . 1 . . . . . 51 G N . 50139 1 225 . 1 . 1 53 53 PRO C C 13 178.098 . . 1 . . . . . 53 P C . 50139 1 226 . 1 . 1 54 54 PHE H H 1 7.503 . . 1 . . . . . 54 F H . 50139 1 227 . 1 . 1 54 54 PHE CA C 13 62.046 . . 1 . . . . . 54 F CA . 50139 1 228 . 1 . 1 54 54 PHE N N 15 119.926 . . 1 . . . . . 54 F N . 50139 1 229 . 1 . 1 55 55 SER H H 1 8.248 . . 1 . . . . . 55 S H . 50139 1 230 . 1 . 1 55 55 SER N N 15 117.227 . . 1 . . . . . 55 S N . 50139 1 231 . 1 . 1 57 57 PRO C C 13 176.783 . . 1 . . . . . 57 P C . 50139 1 232 . 1 . 1 57 57 PRO CA C 13 63.016 . . 1 . . . . . 57 P CA . 50139 1 233 . 1 . 1 57 57 PRO CB C 13 30.895 . . 1 . . . . . 57 P CB . 50139 1 234 . 1 . 1 58 58 LEU H H 1 8.091 . . 1 . . . . . 58 L H . 50139 1 235 . 1 . 1 58 58 LEU C C 13 177.006 . . 1 . . . . . 58 L C . 50139 1 236 . 1 . 1 58 58 LEU CA C 13 54.168 . . 1 . . . . . 58 L CA . 50139 1 237 . 1 . 1 58 58 LEU CB C 13 41.320 . . 1 . . . . . 58 L CB . 50139 1 238 . 1 . 1 58 58 LEU N N 15 120.912 . . 1 . . . . . 58 L N . 50139 1 239 . 1 . 1 59 59 ALA H H 1 7.846 . . 1 . . . . . 59 A H . 50139 1 240 . 1 . 1 59 59 ALA CA C 13 52.418 . . 1 . . . . . 59 A CA . 50139 1 241 . 1 . 1 59 59 ALA CB C 13 18.923 . . 1 . . . . . 59 A CB . 50139 1 242 . 1 . 1 59 59 ALA N N 15 124.222 . . 1 . . . . . 59 A N . 50139 1 243 . 1 . 1 60 60 ASP H H 1 8.152 . . 1 . . . . . 60 D H . 50139 1 244 . 1 . 1 60 60 ASP C C 13 176.157 . . 1 . . . . . 60 D C . 50139 1 245 . 1 . 1 60 60 ASP CA C 13 54.348 . . 1 . . . . . 60 D CA . 50139 1 246 . 1 . 1 60 60 ASP CB C 13 41.164 . . 1 . . . . . 60 D CB . 50139 1 247 . 1 . 1 60 60 ASP N N 15 117.424 . . 1 . . . . . 60 D N . 50139 1 248 . 1 . 1 61 61 GLY H H 1 7.912 . . 1 . . . . . 61 G H . 50139 1 249 . 1 . 1 61 61 GLY CA C 13 45.000 . . 1 . . . . . 61 G CA . 50139 1 250 . 1 . 1 61 61 GLY N N 15 108.551 . . 1 . . . . . 61 G N . 50139 1 251 . 1 . 1 62 62 PRO C C 13 178.101 . . 1 . . . . . 62 P C . 50139 1 252 . 1 . 1 62 62 PRO CA C 13 64.566 . . 1 . . . . . 62 P CA . 50139 1 253 . 1 . 1 62 62 PRO CB C 13 31.104 . . 1 . . . . . 62 P CB . 50139 1 254 . 1 . 1 63 63 THR H H 1 8.001 . . 1 . . . . . 63 T H . 50139 1 255 . 1 . 1 63 63 THR C C 13 177.156 . . 1 . . . . . 63 T C . 50139 1 256 . 1 . 1 63 63 THR CA C 13 67.894 . . 1 . . . . . 63 T CA . 50139 1 257 . 1 . 1 63 63 THR CB C 13 67.894 . . 1 . . . . . 63 T CB . 50139 1 258 . 1 . 1 63 63 THR N N 15 114.969 . . 1 . . . . . 63 T N . 50139 1 259 . 1 . 1 64 64 ILE H H 1 7.850 . . 1 . . . . . 64 I H . 50139 1 260 . 1 . 1 64 64 ILE C C 13 178.001 . . 1 . . . . . 64 I C . 50139 1 261 . 1 . 1 64 64 ILE CA C 13 62.181 . . 1 . . . . . 64 I CA . 50139 1 262 . 1 . 1 64 64 ILE CB C 13 35.587 . . 1 . . . . . 64 I CB . 50139 1 263 . 1 . 1 64 64 ILE N N 15 122.293 . . 1 . . . . . 64 I N . 50139 1 264 . 1 . 1 65 65 GLN H H 1 8.201 . . 1 . . . . . 65 Q H . 50139 1 265 . 1 . 1 65 65 GLN C C 13 178.829 . . 1 . . . . . 65 Q C . 50139 1 266 . 1 . 1 65 65 GLN CA C 13 58.940 . . 1 . . . . . 65 Q CA . 50139 1 267 . 1 . 1 65 65 GLN CB C 13 27.531 . . 1 . . . . . 65 Q CB . 50139 1 268 . 1 . 1 65 65 GLN N N 15 121.960 . . 1 . . . . . 65 Q N . 50139 1 269 . 1 . 1 66 66 ASN H H 1 8.430 . . 1 . . . . . 66 N H . 50139 1 270 . 1 . 1 66 66 ASN C C 13 177.368 . . 1 . . . . . 66 N C . 50139 1 271 . 1 . 1 66 66 ASN CA C 13 55.242 . . 1 . . . . . 66 N CA . 50139 1 272 . 1 . 1 66 66 ASN CB C 13 37.013 . . 1 . . . . . 66 N CB . 50139 1 273 . 1 . 1 66 66 ASN N N 15 117.220 . . 1 . . . . . 66 N N . 50139 1 274 . 1 . 1 67 67 ALA H H 1 7.361 . . 1 . . . . . 67 A H . 50139 1 275 . 1 . 1 67 67 ALA C C 13 176.286 . . 1 . . . . . 67 A C . 50139 1 276 . 1 . 1 67 67 ALA CA C 13 55.038 . . 1 . . . . . 67 A CA . 50139 1 277 . 1 . 1 67 67 ALA CB C 13 18.941 . . 1 . . . . . 67 A CB . 50139 1 278 . 1 . 1 67 67 ALA N N 15 125.436 . . 1 . . . . . 67 A N . 50139 1 279 . 1 . 1 68 68 ASN H H 1 7.632 . . 1 . . . . . 68 N H . 50139 1 280 . 1 . 1 68 68 ASN C C 13 177.039 . . 1 . . . . . 68 N C . 50139 1 281 . 1 . 1 68 68 ASN CA C 13 56.000 . . 1 . . . . . 68 N CA . 50139 1 282 . 1 . 1 68 68 ASN CB C 13 37.966 . . 1 . . . . . 68 N CB . 50139 1 283 . 1 . 1 68 68 ASN N N 15 116.158 . . 1 . . . . . 68 N N . 50139 1 284 . 1 . 1 69 69 LEU H H 1 7.895 . . 1 . . . . . 69 L H . 50139 1 285 . 1 . 1 69 69 LEU C C 13 180.593 . . 1 . . . . . 69 L C . 50139 1 286 . 1 . 1 69 69 LEU CA C 13 57.896 . . 1 . . . . . 69 L CA . 50139 1 287 . 1 . 1 69 69 LEU CB C 13 40.310 . . 1 . . . . . 69 L CB . 50139 1 288 . 1 . 1 69 69 LEU N N 15 118.574 . . 1 . . . . . 69 L N . 50139 1 289 . 1 . 1 70 70 ARG H H 1 8.139 . . 1 . . . . . 70 R H . 50139 1 290 . 1 . 1 70 70 ARG C C 13 179.905 . . 1 . . . . . 70 R C . 50139 1 291 . 1 . 1 70 70 ARG CA C 13 60.542 . . 1 . . . . . 70 R CA . 50139 1 292 . 1 . 1 70 70 ARG CB C 13 30.979 . . 1 . . . . . 70 R CB . 50139 1 293 . 1 . 1 70 70 ARG N N 15 121.366 . . 1 . . . . . 70 R N . 50139 1 294 . 1 . 1 71 71 ALA H H 1 7.773 . . 1 . . . . . 71 A H . 50139 1 295 . 1 . 1 71 71 ALA C C 13 180.063 . . 1 . . . . . 71 A C . 50139 1 296 . 1 . 1 71 71 ALA CA C 13 54.655 . . 1 . . . . . 71 A CA . 50139 1 297 . 1 . 1 71 71 ALA CB C 13 17.236 . . 1 . . . . . 71 A CB . 50139 1 298 . 1 . 1 71 71 ALA N N 15 123.476 . . 1 . . . . . 71 A N . 50139 1 299 . 1 . 1 72 72 PHE H H 1 8.457 . . 1 . . . . . 72 F H . 50139 1 300 . 1 . 1 72 72 PHE C C 13 181.061 . . 1 . . . . . 72 F C . 50139 1 301 . 1 . 1 72 72 PHE CA C 13 60.257 . . 1 . . . . . 72 F CA . 50139 1 302 . 1 . 1 72 72 PHE CB C 13 37.747 . . 1 . . . . . 72 F CB . 50139 1 303 . 1 . 1 72 72 PHE N N 15 117.665 . . 1 . . . . . 72 F N . 50139 1 304 . 1 . 1 73 73 ALA H H 1 8.553 . . 1 . . . . . 73 A H . 50139 1 305 . 1 . 1 73 73 ALA C C 13 179.090 . . 1 . . . . . 73 A C . 50139 1 306 . 1 . 1 73 73 ALA CA C 13 54.324 . . 1 . . . . . 73 A CA . 50139 1 307 . 1 . 1 73 73 ALA CB C 13 16.931 . . 1 . . . . . 73 A CB . 50139 1 308 . 1 . 1 73 73 ALA N N 15 125.027 . . 1 . . . . . 73 A N . 50139 1 309 . 1 . 1 74 74 ALA H H 1 7.572 . . 1 . . . . . 74 A H . 50139 1 310 . 1 . 1 74 74 ALA C C 13 177.896 . . 1 . . . . . 74 A C . 50139 1 311 . 1 . 1 74 74 ALA CA C 13 51.974 . . 1 . . . . . 74 A CA . 50139 1 312 . 1 . 1 74 74 ALA CB C 13 18.127 . . 1 . . . . . 74 A CB . 50139 1 313 . 1 . 1 74 74 ALA N N 15 120.152 . . 1 . . . . . 74 A N . 50139 1 314 . 1 . 1 75 75 GLY H H 1 7.971 . . 1 . . . . . 75 G H . 50139 1 315 . 1 . 1 75 75 GLY C C 13 174.467 . . 1 . . . . . 75 G C . 50139 1 316 . 1 . 1 75 75 GLY CA C 13 45.087 . . 1 . . . . . 75 G CA . 50139 1 317 . 1 . 1 75 75 GLY N N 15 107.970 . . 1 . . . . . 75 G N . 50139 1 318 . 1 . 1 76 76 VAL H H 1 7.469 . . 1 . . . . . 76 V H . 50139 1 319 . 1 . 1 76 76 VAL C C 13 175.869 . . 1 . . . . . 76 V C . 50139 1 320 . 1 . 1 76 76 VAL CA C 13 64.026 . . 1 . . . . . 76 V CA . 50139 1 321 . 1 . 1 76 76 VAL CB C 13 30.427 . . 1 . . . . . 76 V CB . 50139 1 322 . 1 . 1 76 76 VAL N N 15 120.536 . . 1 . . . . . 76 V N . 50139 1 323 . 1 . 1 77 77 THR H H 1 7.565 . . 1 . . . . . 77 T H . 50139 1 324 . 1 . 1 77 77 THR CA C 13 58.500 . . 1 . . . . . 77 T CA . 50139 1 325 . 1 . 1 77 77 THR N N 15 119.085 . . 1 . . . . . 77 T N . 50139 1 326 . 1 . 1 78 78 PRO C C 13 177.965 . . 1 . . . . . 78 P C . 50139 1 327 . 1 . 1 78 78 PRO CA C 13 66.443 . . 1 . . . . . 78 P CA . 50139 1 328 . 1 . 1 78 78 PRO CB C 13 30.707 . . 1 . . . . . 78 P CB . 50139 1 329 . 1 . 1 79 79 ALA H H 1 8.190 . . 1 . . . . . 79 A H . 50139 1 330 . 1 . 1 79 79 ALA C C 13 181.599 . . 1 . . . . . 79 A C . 50139 1 331 . 1 . 1 79 79 ALA CA C 13 55.425 . . 1 . . . . . 79 A CA . 50139 1 332 . 1 . 1 79 79 ALA CB C 13 17.473 . . 1 . . . . . 79 A CB . 50139 1 333 . 1 . 1 79 79 ALA N N 15 117.936 . . 1 . . . . . 79 A N . 50139 1 334 . 1 . 1 80 80 GLN H H 1 7.761 . . 1 . . . . . 80 Q H . 50139 1 335 . 1 . 1 80 80 GLN C C 13 179.568 . . 1 . . . . . 80 Q C . 50139 1 336 . 1 . 1 80 80 GLN CA C 13 58.474 . . 1 . . . . . 80 Q CA . 50139 1 337 . 1 . 1 80 80 GLN CB C 13 27.895 . . 1 . . . . . 80 Q CB . 50139 1 338 . 1 . 1 80 80 GLN N N 15 118.577 . . 1 . . . . . 80 Q N . 50139 1 339 . 1 . 1 81 81 CYS H H 1 8.151 . . 1 . . . . . 81 C H . 50139 1 340 . 1 . 1 81 81 CYS C C 13 176.820 . . 1 . . . . . 81 C C . 50139 1 341 . 1 . 1 81 81 CYS CA C 13 55.553 . . 1 . . . . . 81 C CA . 50139 1 342 . 1 . 1 81 81 CYS CB C 13 25.011 . . 1 . . . . . 81 C CB . 50139 1 343 . 1 . 1 81 81 CYS N N 15 118.954 . . 1 . . . . . 81 C N . 50139 1 344 . 1 . 1 82 82 PHE H H 1 7.963 . . 1 . . . . . 82 F H . 50139 1 345 . 1 . 1 82 82 PHE C C 13 178.136 . . 1 . . . . . 82 F C . 50139 1 346 . 1 . 1 82 82 PHE CA C 13 62.810 . . 1 . . . . . 82 F CA . 50139 1 347 . 1 . 1 82 82 PHE CB C 13 37.709 . . 1 . . . . . 82 F CB . 50139 1 348 . 1 . 1 82 82 PHE N N 15 117.872 . . 1 . . . . . 82 F N . 50139 1 349 . 1 . 1 83 83 GLU H H 1 7.611 . . 1 . . . . . 83 E H . 50139 1 350 . 1 . 1 83 83 GLU C C 13 180.031 . . 1 . . . . . 83 E C . 50139 1 351 . 1 . 1 83 83 GLU CA C 13 59.254 . . 1 . . . . . 83 E CA . 50139 1 352 . 1 . 1 83 83 GLU CB C 13 28.347 . . 1 . . . . . 83 E CB . 50139 1 353 . 1 . 1 83 83 GLU N N 15 120.738 . . 1 . . . . . 83 E N . 50139 1 354 . 1 . 1 84 84 MET H H 1 8.223 . . 1 . . . . . 84 M H . 50139 1 355 . 1 . 1 84 84 MET CA C 13 56.549 . . 1 . . . . . 84 M CA . 50139 1 356 . 1 . 1 84 84 MET CB C 13 33.615 . . 1 . . . . . 84 M CB . 50139 1 357 . 1 . 1 84 84 MET N N 15 118.995 . . 1 . . . . . 84 M N . 50139 1 358 . 1 . 1 85 85 LEU H H 1 8.388 . . 1 . . . . . 85 L H . 50139 1 359 . 1 . 1 85 85 LEU C C 13 178.029 . . 1 . . . . . 85 L C . 50139 1 360 . 1 . 1 85 85 LEU CA C 13 57.753 . . 1 . . . . . 85 L CA . 50139 1 361 . 1 . 1 85 85 LEU CB C 13 41.104 . . 1 . . . . . 85 L CB . 50139 1 362 . 1 . 1 85 85 LEU N N 15 117.037 . . 1 . . . . . 85 L N . 50139 1 363 . 1 . 1 86 86 ALA H H 1 7.660 . . 1 . . . . . 86 A H . 50139 1 364 . 1 . 1 86 86 ALA C C 13 180.431 . . 1 . . . . . 86 A C . 50139 1 365 . 1 . 1 86 86 ALA CA C 13 54.791 . . 1 . . . . . 86 A CA . 50139 1 366 . 1 . 1 86 86 ALA CB C 13 17.081 . . 1 . . . . . 86 A CB . 50139 1 367 . 1 . 1 86 86 ALA N N 15 120.106 . . 1 . . . . . 86 A N . 50139 1 368 . 1 . 1 87 87 LEU H H 1 7.346 . . 1 . . . . . 87 L H . 50139 1 369 . 1 . 1 87 87 LEU C C 13 180.015 . . 1 . . . . . 87 L C . 50139 1 370 . 1 . 1 87 87 LEU CA C 13 57.524 . . 1 . . . . . 87 L CA . 50139 1 371 . 1 . 1 87 87 LEU CB C 13 40.989 . . 1 . . . . . 87 L CB . 50139 1 372 . 1 . 1 87 87 LEU N N 15 119.985 . . 1 . . . . . 87 L N . 50139 1 373 . 1 . 1 88 88 ILE H H 1 8.506 . . 1 . . . . . 88 I H . 50139 1 374 . 1 . 1 88 88 ILE C C 13 177.760 . . 1 . . . . . 88 I C . 50139 1 375 . 1 . 1 88 88 ILE CA C 13 65.240 . . 1 . . . . . 88 I CA . 50139 1 376 . 1 . 1 88 88 ILE CB C 13 37.775 . . 1 . . . . . 88 I CB . 50139 1 377 . 1 . 1 88 88 ILE N N 15 121.444 . . 1 . . . . . 88 I N . 50139 1 378 . 1 . 1 89 89 ARG H H 1 8.269 . . 1 . . . . . 89 R H . 50139 1 379 . 1 . 1 89 89 ARG C C 13 178.010 . . 1 . . . . . 89 R C . 50139 1 380 . 1 . 1 89 89 ARG CA C 13 56.529 . . 1 . . . . . 89 R CA . 50139 1 381 . 1 . 1 89 89 ARG CB C 13 26.880 . . 1 . . . . . 89 R CB . 50139 1 382 . 1 . 1 89 89 ARG N N 15 118.768 . . 1 . . . . . 89 R N . 50139 1 383 . 1 . 1 90 90 GLU H H 1 7.762 . . 1 . . . . . 90 E H . 50139 1 384 . 1 . 1 90 90 GLU C C 13 178.056 . . 1 . . . . . 90 E C . 50139 1 385 . 1 . 1 90 90 GLU CA C 13 58.495 . . 1 . . . . . 90 E CA . 50139 1 386 . 1 . 1 90 90 GLU CB C 13 28.815 . . 1 . . . . . 90 E CB . 50139 1 387 . 1 . 1 90 90 GLU N N 15 119.282 . . 1 . . . . . 90 E N . 50139 1 388 . 1 . 1 91 91 LYS H H 1 7.356 . . 1 . . . . . 91 K H . 50139 1 389 . 1 . 1 91 91 LYS C C 13 176.294 . . 1 . . . . . 91 K C . 50139 1 390 . 1 . 1 91 91 LYS CA C 13 57.474 . . 1 . . . . . 91 K CA . 50139 1 391 . 1 . 1 91 91 LYS CB C 13 32.971 . . 1 . . . . . 91 K CB . 50139 1 392 . 1 . 1 91 91 LYS N N 15 116.598 . . 1 . . . . . 91 K N . 50139 1 393 . 1 . 1 92 92 HIS H H 1 7.905 . . 1 . . . . . 92 H H . 50139 1 394 . 1 . 1 92 92 HIS CA C 13 52.100 . . 1 . . . . . 92 H CA . 50139 1 395 . 1 . 1 92 92 HIS CB C 13 28.962 . . 1 . . . . . 92 H CB . 50139 1 396 . 1 . 1 92 92 HIS N N 15 116.686 . . 1 . . . . . 92 H N . 50139 1 397 . 1 . 1 93 93 PRO C C 13 177.806 . . 1 . . . . . 93 P C . 50139 1 398 . 1 . 1 93 93 PRO CA C 13 64.879 . . 1 . . . . . 93 P CA . 50139 1 399 . 1 . 1 93 93 PRO CB C 13 32.412 . . 1 . . . . . 93 P CB . 50139 1 400 . 1 . 1 94 94 THR H H 1 8.197 . . 1 . . . . . 94 T H . 50139 1 401 . 1 . 1 94 94 THR C C 13 175.311 . . 1 . . . . . 94 T C . 50139 1 402 . 1 . 1 94 94 THR CA C 13 61.514 . . 1 . . . . . 94 T CA . 50139 1 403 . 1 . 1 94 94 THR CB C 13 69.629 . . 1 . . . . . 94 T CB . 50139 1 404 . 1 . 1 94 94 THR N N 15 105.988 . . 1 . . . . . 94 T N . 50139 1 405 . 1 . 1 95 95 ILE H H 1 6.886 . . 1 . . . . . 95 I H . 50139 1 406 . 1 . 1 95 95 ILE CA C 13 58.025 . . 1 . . . . . 95 I CA . 50139 1 407 . 1 . 1 95 95 ILE CB C 13 38.623 . . 1 . . . . . 95 I CB . 50139 1 408 . 1 . 1 95 95 ILE N N 15 124.550 . . 1 . . . . . 95 I N . 50139 1 409 . 1 . 1 96 96 PRO C C 13 176.015 . . 1 . . . . . 96 P C . 50139 1 410 . 1 . 1 96 96 PRO CA C 13 61.903 . . 1 . . . . . 96 P CA . 50139 1 411 . 1 . 1 96 96 PRO CB C 13 29.566 . . 1 . . . . . 96 P CB . 50139 1 412 . 1 . 1 97 97 ILE H H 1 10.425 . . 1 . . . . . 97 I H . 50139 1 413 . 1 . 1 97 97 ILE C C 13 174.371 . . 1 . . . . . 97 I C . 50139 1 414 . 1 . 1 97 97 ILE CA C 13 61.256 . . 1 . . . . . 97 I CA . 50139 1 415 . 1 . 1 97 97 ILE CB C 13 40.416 . . 1 . . . . . 97 I CB . 50139 1 416 . 1 . 1 97 97 ILE N N 15 125.728 . . 1 . . . . . 97 I N . 50139 1 417 . 1 . 1 98 98 GLY H H 1 8.420 . . 1 . . . . . 98 G H . 50139 1 418 . 1 . 1 98 98 GLY C C 13 172.316 . . 1 . . . . . 98 G C . 50139 1 419 . 1 . 1 98 98 GLY CA C 13 43.794 . . 1 . . . . . 98 G CA . 50139 1 420 . 1 . 1 98 98 GLY N N 15 116.261 . . 1 . . . . . 98 G N . 50139 1 421 . 1 . 1 99 99 LEU H H 1 8.477 . . 1 . . . . . 99 L H . 50139 1 422 . 1 . 1 99 99 LEU C C 13 174.177 . . 1 . . . . . 99 L C . 50139 1 423 . 1 . 1 99 99 LEU CA C 13 52.485 . . 1 . . . . . 99 L CA . 50139 1 424 . 1 . 1 99 99 LEU CB C 13 45.088 . . 1 . . . . . 99 L CB . 50139 1 425 . 1 . 1 99 99 LEU N N 15 123.030 . . 1 . . . . . 99 L N . 50139 1 426 . 1 . 1 100 100 LEU H H 1 8.760 . . 1 . . . . . 100 L H . 50139 1 427 . 1 . 1 100 100 LEU CA C 13 54.655 . . 1 . . . . . 100 L CA . 50139 1 428 . 1 . 1 100 100 LEU N N 15 129.668 . . 1 . . . . . 100 L N . 50139 1 429 . 1 . 1 101 101 MET H H 1 6.566 . . 1 . . . . . 101 M H . 50139 1 430 . 1 . 1 101 101 MET CA C 13 56.369 . . 1 . . . . . 101 M CA . 50139 1 431 . 1 . 1 101 101 MET N N 15 120.867 . . 1 . . . . . 101 M N . 50139 1 432 . 1 . 1 102 102 TYR H H 1 7.661 . . 1 . . . . . 102 Y H . 50139 1 433 . 1 . 1 102 102 TYR C C 13 177.069 . . 1 . . . . . 102 Y C . 50139 1 434 . 1 . 1 102 102 TYR CA C 13 56.483 . . 1 . . . . . 102 Y CA . 50139 1 435 . 1 . 1 102 102 TYR CB C 13 39.310 . . 1 . . . . . 102 Y CB . 50139 1 436 . 1 . 1 102 102 TYR N N 15 120.971 . . 1 . . . . . 102 Y N . 50139 1 437 . 1 . 1 103 103 ALA H H 1 10.787 . . 1 . . . . . 103 A H . 50139 1 438 . 1 . 1 103 103 ALA C C 13 179.068 . . 1 . . . . . 103 A C . 50139 1 439 . 1 . 1 103 103 ALA CA C 13 55.581 . . 1 . . . . . 103 A CA . 50139 1 440 . 1 . 1 103 103 ALA CB C 13 17.461 . . 1 . . . . . 103 A CB . 50139 1 441 . 1 . 1 103 103 ALA N N 15 127.495 . . 1 . . . . . 103 A N . 50139 1 442 . 1 . 1 104 104 ASN H H 1 9.416 . . 1 . . . . . 104 N H . 50139 1 443 . 1 . 1 104 104 ASN C C 13 177.449 . . 1 . . . . . 104 N C . 50139 1 444 . 1 . 1 104 104 ASN CA C 13 56.222 . . 1 . . . . . 104 N CA . 50139 1 445 . 1 . 1 104 104 ASN CB C 13 37.297 . . 1 . . . . . 104 N CB . 50139 1 446 . 1 . 1 104 104 ASN N N 15 115.640 . . 1 . . . . . 104 N N . 50139 1 447 . 1 . 1 105 105 LEU H H 1 7.348 . . 1 . . . . . 105 L H . 50139 1 448 . 1 . 1 105 105 LEU C C 13 178.841 . . 1 . . . . . 105 L C . 50139 1 449 . 1 . 1 105 105 LEU CA C 13 56.758 . . 1 . . . . . 105 L CA . 50139 1 450 . 1 . 1 105 105 LEU CB C 13 41.342 . . 1 . . . . . 105 L CB . 50139 1 451 . 1 . 1 105 105 LEU N N 15 118.814 . . 1 . . . . . 105 L N . 50139 1 452 . 1 . 1 106 106 VAL H H 1 7.083 . . 1 . . . . . 106 V H . 50139 1 453 . 1 . 1 106 106 VAL C C 13 177.719 . . 1 . . . . . 106 V C . 50139 1 454 . 1 . 1 106 106 VAL CA C 13 64.658 . . 1 . . . . . 106 V CA . 50139 1 455 . 1 . 1 106 106 VAL CB C 13 30.284 . . 1 . . . . . 106 V CB . 50139 1 456 . 1 . 1 106 106 VAL N N 15 118.580 . . 1 . . . . . 106 V N . 50139 1 457 . 1 . 1 107 107 PHE H H 1 8.321 . . 1 . . . . . 107 F H . 50139 1 458 . 1 . 1 107 107 PHE C C 13 174.242 . . 1 . . . . . 107 F C . 50139 1 459 . 1 . 1 107 107 PHE CA C 13 59.609 . . 1 . . . . . 107 F CA . 50139 1 460 . 1 . 1 107 107 PHE CB C 13 37.922 . . 1 . . . . . 107 F CB . 50139 1 461 . 1 . 1 107 107 PHE N N 15 117.703 . . 1 . . . . . 107 F N . 50139 1 462 . 1 . 1 108 108 ASN H H 1 8.062 . . 1 . . . . . 108 N H . 50139 1 463 . 1 . 1 108 108 ASN C C 13 176.273 . . 1 . . . . . 108 N C . 50139 1 464 . 1 . 1 108 108 ASN CA C 13 55.902 . . 1 . . . . . 108 N CA . 50139 1 465 . 1 . 1 108 108 ASN CB C 13 38.090 . . 1 . . . . . 108 N CB . 50139 1 466 . 1 . 1 108 108 ASN N N 15 117.429 . . 1 . . . . . 108 N N . 50139 1 467 . 1 . 1 109 109 ASN H H 1 7.713 . . 1 . . . . . 109 N H . 50139 1 468 . 1 . 1 109 109 ASN C C 13 175.452 . . 1 . . . . . 109 N C . 50139 1 469 . 1 . 1 109 109 ASN CA C 13 54.167 . . 1 . . . . . 109 N CA . 50139 1 470 . 1 . 1 109 109 ASN CB C 13 40.186 . . 1 . . . . . 109 N CB . 50139 1 471 . 1 . 1 109 109 ASN N N 15 116.193 . . 1 . . . . . 109 N N . 50139 1 472 . 1 . 1 110 110 GLY H H 1 7.680 . . 1 . . . . . 110 G H . 50139 1 473 . 1 . 1 110 110 GLY C C 13 173.885 . . 1 . . . . . 110 G C . 50139 1 474 . 1 . 1 110 110 GLY CA C 13 43.540 . . 1 . . . . . 110 G CA . 50139 1 475 . 1 . 1 110 110 GLY N N 15 110.146 . . 1 . . . . . 110 G N . 50139 1 476 . 1 . 1 111 111 ILE H H 1 8.496 . . 1 . . . . . 111 I H . 50139 1 477 . 1 . 1 111 111 ILE C C 13 177.569 . . 1 . . . . . 111 I C . 50139 1 478 . 1 . 1 111 111 ILE CA C 13 66.156 . . 1 . . . . . 111 I CA . 50139 1 479 . 1 . 1 111 111 ILE CB C 13 37.167 . . 1 . . . . . 111 I CB . 50139 1 480 . 1 . 1 111 111 ILE N N 15 125.085 . . 1 . . . . . 111 I N . 50139 1 481 . 1 . 1 112 112 ASP H H 1 8.398 . . 1 . . . . . 112 D H . 50139 1 482 . 1 . 1 112 112 ASP C C 13 177.721 . . 1 . . . . . 112 D C . 50139 1 483 . 1 . 1 112 112 ASP CA C 13 59.077 . . 1 . . . . . 112 D CA . 50139 1 484 . 1 . 1 112 112 ASP CB C 13 41.475 . . 1 . . . . . 112 D CB . 50139 1 485 . 1 . 1 112 112 ASP N N 15 119.399 . . 1 . . . . . 112 D N . 50139 1 486 . 1 . 1 113 113 ALA H H 1 8.066 . . 1 . . . . . 113 A H . 50139 1 487 . 1 . 1 113 113 ALA C C 13 180.635 . . 1 . . . . . 113 A C . 50139 1 488 . 1 . 1 113 113 ALA CA C 13 54.270 . . 1 . . . . . 113 A CA . 50139 1 489 . 1 . 1 113 113 ALA CB C 13 17.075 . . 1 . . . . . 113 A CB . 50139 1 490 . 1 . 1 113 113 ALA N N 15 119.796 . . 1 . . . . . 113 A N . 50139 1 491 . 1 . 1 114 114 PHE H H 1 8.427 . . 1 . . . . . 114 F H . 50139 1 492 . 1 . 1 114 114 PHE C C 13 177.760 . . 1 . . . . . 114 F C . 50139 1 493 . 1 . 1 114 114 PHE CA C 13 61.734 . . 1 . . . . . 114 F CA . 50139 1 494 . 1 . 1 114 114 PHE CB C 13 38.645 . . 1 . . . . . 114 F CB . 50139 1 495 . 1 . 1 114 114 PHE N N 15 120.386 . . 1 . . . . . 114 F N . 50139 1 496 . 1 . 1 115 115 TYR H H 1 7.932 . . 1 . . . . . 115 Y H . 50139 1 497 . 1 . 1 115 115 TYR C C 13 177.720 . . 1 . . . . . 115 Y C . 50139 1 498 . 1 . 1 115 115 TYR CA C 13 63.505 . . 1 . . . . . 115 Y CA . 50139 1 499 . 1 . 1 115 115 TYR CB C 13 37.662 . . 1 . . . . . 115 Y CB . 50139 1 500 . 1 . 1 115 115 TYR N N 15 119.210 . . 1 . . . . . 115 Y N . 50139 1 501 . 1 . 1 116 116 ALA H H 1 8.323 . . 1 . . . . . 116 A H . 50139 1 502 . 1 . 1 116 116 ALA C C 13 180.177 . . 1 . . . . . 116 A C . 50139 1 503 . 1 . 1 116 116 ALA CA C 13 54.457 . . 1 . . . . . 116 A CA . 50139 1 504 . 1 . 1 116 116 ALA CB C 13 16.849 . . 1 . . . . . 116 A CB . 50139 1 505 . 1 . 1 116 116 ALA N N 15 122.508 . . 1 . . . . . 116 A N . 50139 1 506 . 1 . 1 117 117 ARG H H 1 7.537 . . 1 . . . . . 117 R H . 50139 1 507 . 1 . 1 117 117 ARG C C 13 178.715 . . 1 . . . . . 117 R C . 50139 1 508 . 1 . 1 117 117 ARG CA C 13 57.717 . . 1 . . . . . 117 R CA . 50139 1 509 . 1 . 1 117 117 ARG CB C 13 27.734 . . 1 . . . . . 117 R CB . 50139 1 510 . 1 . 1 117 117 ARG N N 15 121.117 . . 1 . . . . . 117 R N . 50139 1 511 . 1 . 1 118 118 CYS H H 1 7.436 . . 1 . . . . . 118 C H . 50139 1 512 . 1 . 1 118 118 CYS C C 13 176.169 . . 1 . . . . . 118 C C . 50139 1 513 . 1 . 1 118 118 CYS CA C 13 64.190 . . 1 . . . . . 118 C CA . 50139 1 514 . 1 . 1 118 118 CYS CB C 13 25.943 . . 1 . . . . . 118 C CB . 50139 1 515 . 1 . 1 118 118 CYS N N 15 116.354 . . 1 . . . . . 118 C N . 50139 1 516 . 1 . 1 119 119 GLU H H 1 8.026 . . 1 . . . . . 119 E H . 50139 1 517 . 1 . 1 119 119 GLU C C 13 179.513 . . 1 . . . . . 119 E C . 50139 1 518 . 1 . 1 119 119 GLU CA C 13 58.485 . . 1 . . . . . 119 E CA . 50139 1 519 . 1 . 1 119 119 GLU CB C 13 28.922 . . 1 . . . . . 119 E CB . 50139 1 520 . 1 . 1 119 119 GLU N N 15 122.289 . . 1 . . . . . 119 E N . 50139 1 521 . 1 . 1 120 120 GLN H H 1 7.943 . . 1 . . . . . 120 Q H . 50139 1 522 . 1 . 1 120 120 GLN C C 13 178.454 . . 1 . . . . . 120 Q C . 50139 1 523 . 1 . 1 120 120 GLN CA C 13 58.435 . . 1 . . . . . 120 Q CA . 50139 1 524 . 1 . 1 120 120 GLN CB C 13 27.926 . . 1 . . . . . 120 Q CB . 50139 1 525 . 1 . 1 120 120 GLN N N 15 119.761 . . 1 . . . . . 120 Q N . 50139 1 526 . 1 . 1 121 121 VAL H H 1 7.685 . . 1 . . . . . 121 V H . 50139 1 527 . 1 . 1 121 121 VAL C C 13 175.332 . . 1 . . . . . 121 V C . 50139 1 528 . 1 . 1 121 121 VAL CA C 13 61.582 . . 1 . . . . . 121 V CA . 50139 1 529 . 1 . 1 121 121 VAL CB C 13 30.854 . . 1 . . . . . 121 V CB . 50139 1 530 . 1 . 1 121 121 VAL N N 15 110.539 . . 1 . . . . . 121 V N . 50139 1 531 . 1 . 1 122 122 GLY H H 1 7.438 . . 1 . . . . . 122 G H . 50139 1 532 . 1 . 1 122 122 GLY C C 13 175.075 . . 1 . . . . . 122 G C . 50139 1 533 . 1 . 1 122 122 GLY CA C 13 46.464 . . 1 . . . . . 122 G CA . 50139 1 534 . 1 . 1 122 122 GLY N N 15 106.780 . . 1 . . . . . 122 G N . 50139 1 535 . 1 . 1 123 123 VAL H H 1 7.673 . . 1 . . . . . 123 V H . 50139 1 536 . 1 . 1 123 123 VAL C C 13 174.310 . . 1 . . . . . 123 V C . 50139 1 537 . 1 . 1 123 123 VAL CA C 13 63.150 . . 1 . . . . . 123 V CA . 50139 1 538 . 1 . 1 123 123 VAL CB C 13 32.133 . . 1 . . . . . 123 V CB . 50139 1 539 . 1 . 1 123 123 VAL N N 15 119.501 . . 1 . . . . . 123 V N . 50139 1 540 . 1 . 1 124 124 ASP H H 1 8.854 . . 1 . . . . . 124 D H . 50139 1 541 . 1 . 1 124 124 ASP C C 13 177.565 . . 1 . . . . . 124 D C . 50139 1 542 . 1 . 1 124 124 ASP CA C 13 56.437 . . 1 . . . . . 124 D CA . 50139 1 543 . 1 . 1 124 124 ASP CB C 13 45.489 . . 1 . . . . . 124 D CB . 50139 1 544 . 1 . 1 124 124 ASP N N 15 121.478 . . 1 . . . . . 124 D N . 50139 1 545 . 1 . 1 125 125 SER H H 1 8.390 . . 1 . . . . . 125 S H . 50139 1 546 . 1 . 1 125 125 SER CA C 13 56.408 . . 1 . . . . . 125 S CA . 50139 1 547 . 1 . 1 125 125 SER N N 15 113.173 . . 1 . . . . . 125 S N . 50139 1 548 . 1 . 1 126 126 VAL H H 1 7.718 . . 1 . . . . . 126 V H . 50139 1 549 . 1 . 1 126 126 VAL C C 13 173.537 . . 1 . . . . . 126 V C . 50139 1 550 . 1 . 1 126 126 VAL CA C 13 61.668 . . 1 . . . . . 126 V CA . 50139 1 551 . 1 . 1 126 126 VAL CB C 13 36.328 . . 1 . . . . . 126 V CB . 50139 1 552 . 1 . 1 126 126 VAL N N 15 113.939 . . 1 . . . . . 126 V N . 50139 1 553 . 1 . 1 127 127 LEU H H 1 8.699 . . 1 . . . . . 127 L H . 50139 1 554 . 1 . 1 127 127 LEU C C 13 173.925 . . 1 . . . . . 127 L C . 50139 1 555 . 1 . 1 127 127 LEU CA C 13 53.280 . . 1 . . . . . 127 L CA . 50139 1 556 . 1 . 1 127 127 LEU CB C 13 42.672 . . 1 . . . . . 127 L CB . 50139 1 557 . 1 . 1 127 127 LEU N N 15 134.598 . . 1 . . . . . 127 L N . 50139 1 558 . 1 . 1 128 128 VAL H H 1 8.668 . . 1 . . . . . 128 V H . 50139 1 559 . 1 . 1 128 128 VAL C C 13 176.916 . . 1 . . . . . 128 V C . 50139 1 560 . 1 . 1 128 128 VAL CA C 13 60.579 . . 1 . . . . . 128 V CA . 50139 1 561 . 1 . 1 128 128 VAL CB C 13 27.991 . . 1 . . . . . 128 V CB . 50139 1 562 . 1 . 1 128 128 VAL N N 15 128.372 . . 1 . . . . . 128 V N . 50139 1 563 . 1 . 1 129 129 ALA H H 1 8.160 . . 1 . . . . . 129 A H . 50139 1 564 . 1 . 1 129 129 ALA C C 13 176.833 . . 1 . . . . . 129 A C . 50139 1 565 . 1 . 1 129 129 ALA CA C 13 54.931 . . 1 . . . . . 129 A CA . 50139 1 566 . 1 . 1 129 129 ALA CB C 13 17.583 . . 1 . . . . . 129 A CB . 50139 1 567 . 1 . 1 129 129 ALA N N 15 128.045 . . 1 . . . . . 129 A N . 50139 1 568 . 1 . 1 130 130 ASP H H 1 8.763 . . 1 . . . . . 130 D H . 50139 1 569 . 1 . 1 130 130 ASP C C 13 175.325 . . 1 . . . . . 130 D C . 50139 1 570 . 1 . 1 130 130 ASP CA C 13 52.122 . . 1 . . . . . 130 D CA . 50139 1 571 . 1 . 1 130 130 ASP CB C 13 38.591 . . 1 . . . . . 130 D CB . 50139 1 572 . 1 . 1 130 130 ASP N N 15 113.029 . . 1 . . . . . 130 D N . 50139 1 573 . 1 . 1 131 131 VAL H H 1 6.566 . . 1 . . . . . 131 V H . 50139 1 574 . 1 . 1 131 131 VAL CA C 13 58.630 . . 1 . . . . . 131 V CA . 50139 1 575 . 1 . 1 131 131 VAL CB C 13 33.226 . . 1 . . . . . 131 V CB . 50139 1 576 . 1 . 1 131 131 VAL N N 15 120.867 . . 1 . . . . . 131 V N . 50139 1 577 . 1 . 1 132 132 PRO C C 13 178.595 . . 1 . . . . . 132 P C . 50139 1 578 . 1 . 1 132 132 PRO CA C 13 62.032 . . 1 . . . . . 132 P CA . 50139 1 579 . 1 . 1 132 132 PRO CB C 13 31.941 . . 1 . . . . . 132 P CB . 50139 1 580 . 1 . 1 133 133 VAL H H 1 8.900 . . 1 . . . . . 133 V H . 50139 1 581 . 1 . 1 133 133 VAL C C 13 179.256 . . 1 . . . . . 133 V C . 50139 1 582 . 1 . 1 133 133 VAL CA C 13 66.093 . . 1 . . . . . 133 V CA . 50139 1 583 . 1 . 1 133 133 VAL CB C 13 30.595 . . 1 . . . . . 133 V CB . 50139 1 584 . 1 . 1 133 133 VAL N N 15 123.492 . . 1 . . . . . 133 V N . 50139 1 585 . 1 . 1 134 134 GLU H H 1 10.150 . . 1 . . . . . 134 E H . 50139 1 586 . 1 . 1 134 134 GLU C C 13 177.511 . . 1 . . . . . 134 E C . 50139 1 587 . 1 . 1 134 134 GLU CA C 13 58.909 . . 1 . . . . . 134 E CA . 50139 1 588 . 1 . 1 134 134 GLU CB C 13 27.781 . . 1 . . . . . 134 E CB . 50139 1 589 . 1 . 1 134 134 GLU N N 15 121.940 . . 1 . . . . . 134 E N . 50139 1 590 . 1 . 1 135 135 GLU H H 1 7.739 . . 1 . . . . . 135 E H . 50139 1 591 . 1 . 1 135 135 GLU CB C 13 32.815 . . 1 . . . . . 135 E CB . 50139 1 592 . 1 . 1 135 135 GLU N N 15 119.503 . . 1 . . . . . 135 E N . 50139 1 593 . 1 . 1 136 136 SER H H 1 7.927 . . 1 . . . . . 136 S H . 50139 1 594 . 1 . 1 136 136 SER N N 15 113.594 . . 1 . . . . . 136 S N . 50139 1 595 . 1 . 1 138 138 PRO C C 13 179.653 . . 1 . . . . . 138 P C . 50139 1 596 . 1 . 1 138 138 PRO CA C 13 65.739 . . 1 . . . . . 138 P CA . 50139 1 597 . 1 . 1 138 138 PRO CB C 13 30.181 . . 1 . . . . . 138 P CB . 50139 1 598 . 1 . 1 139 139 PHE H H 1 7.096 . . 1 . . . . . 139 F H . 50139 1 599 . 1 . 1 139 139 PHE C C 13 176.714 . . 1 . . . . . 139 F C . 50139 1 600 . 1 . 1 139 139 PHE CA C 13 60.233 . . 1 . . . . . 139 F CA . 50139 1 601 . 1 . 1 139 139 PHE CB C 13 37.328 . . 1 . . . . . 139 F CB . 50139 1 602 . 1 . 1 139 139 PHE N N 15 116.025 . . 1 . . . . . 139 F N . 50139 1 603 . 1 . 1 140 140 ARG H H 1 8.304 . . 1 . . . . . 140 R H . 50139 1 604 . 1 . 1 140 140 ARG C C 13 175.916 . . 1 . . . . . 140 R C . 50139 1 605 . 1 . 1 140 140 ARG CA C 13 59.362 . . 1 . . . . . 140 R CA . 50139 1 606 . 1 . 1 140 140 ARG CB C 13 28.959 . . 1 . . . . . 140 R CB . 50139 1 607 . 1 . 1 140 140 ARG N N 15 117.381 . . 1 . . . . . 140 R N . 50139 1 608 . 1 . 1 141 141 GLN H H 1 8.280 . . 1 . . . . . 141 Q H . 50139 1 609 . 1 . 1 141 141 GLN C C 13 178.556 . . 1 . . . . . 141 Q C . 50139 1 610 . 1 . 1 141 141 GLN CA C 13 58.362 . . 1 . . . . . 141 Q CA . 50139 1 611 . 1 . 1 141 141 GLN CB C 13 27.503 . . 1 . . . . . 141 Q CB . 50139 1 612 . 1 . 1 141 141 GLN N N 15 116.912 . . 1 . . . . . 141 Q N . 50139 1 613 . 1 . 1 142 142 ALA H H 1 6.913 . . 1 . . . . . 142 A H . 50139 1 614 . 1 . 1 142 142 ALA C C 13 178.627 . . 1 . . . . . 142 A C . 50139 1 615 . 1 . 1 142 142 ALA CA C 13 54.489 . . 1 . . . . . 142 A CA . 50139 1 616 . 1 . 1 142 142 ALA CB C 13 18.823 . . 1 . . . . . 142 A CB . 50139 1 617 . 1 . 1 142 142 ALA N N 15 121.925 . . 1 . . . . . 142 A N . 50139 1 618 . 1 . 1 143 143 ALA H H 1 7.783 . . 1 . . . . . 143 A H . 50139 1 619 . 1 . 1 143 143 ALA CA C 13 55.539 . . 1 . . . . . 143 A CA . 50139 1 620 . 1 . 1 143 143 ALA CB C 13 16.104 . . 1 . . . . . 143 A CB . 50139 1 621 . 1 . 1 143 143 ALA N N 15 121.046 . . 1 . . . . . 143 A N . 50139 1 622 . 1 . 1 145 145 ARG H H 1 7.596 . . 1 . . . . . 145 R H . 50139 1 623 . 1 . 1 145 145 ARG C C 13 176.763 . . 1 . . . . . 145 R C . 50139 1 624 . 1 . 1 145 145 ARG CA C 13 58.019 . . 1 . . . . . 145 R CA . 50139 1 625 . 1 . 1 145 145 ARG CB C 13 29.588 . . 1 . . . . . 145 R CB . 50139 1 626 . 1 . 1 145 145 ARG N N 15 118.759 . . 1 . . . . . 145 R N . 50139 1 627 . 1 . 1 146 146 HIS H H 1 7.343 . . 1 . . . . . 146 H H . 50139 1 628 . 1 . 1 146 146 HIS C C 13 171.165 . . 1 . . . . . 146 H C . 50139 1 629 . 1 . 1 146 146 HIS CA C 13 54.883 . . 1 . . . . . 146 H CA . 50139 1 630 . 1 . 1 146 146 HIS CB C 13 28.432 . . 1 . . . . . 146 H CB . 50139 1 631 . 1 . 1 146 146 HIS N N 15 115.327 . . 1 . . . . . 146 H N . 50139 1 632 . 1 . 1 147 147 ASN H H 1 7.539 . . 1 . . . . . 147 N H . 50139 1 633 . 1 . 1 147 147 ASN C C 13 173.784 . . 1 . . . . . 147 N C . 50139 1 634 . 1 . 1 147 147 ASN CA C 13 58.698 . . 1 . . . . . 147 N CA . 50139 1 635 . 1 . 1 147 147 ASN CB C 13 36.713 . . 1 . . . . . 147 N CB . 50139 1 636 . 1 . 1 147 147 ASN N N 15 111.356 . . 1 . . . . . 147 N N . 50139 1 637 . 1 . 1 148 148 ILE H H 1 8.459 . . 1 . . . . . 148 I H . 50139 1 638 . 1 . 1 148 148 ILE C C 13 174.938 . . 1 . . . . . 148 I C . 50139 1 639 . 1 . 1 148 148 ILE CA C 13 57.624 . . 1 . . . . . 148 I CA . 50139 1 640 . 1 . 1 148 148 ILE CB C 13 38.576 . . 1 . . . . . 148 I CB . 50139 1 641 . 1 . 1 148 148 ILE N N 15 119.773 . . 1 . . . . . 148 I N . 50139 1 642 . 1 . 1 149 149 ALA H H 1 8.311 . . 1 . . . . . 149 A H . 50139 1 643 . 1 . 1 149 149 ALA CA C 13 49.373 . . 1 . . . . . 149 A CA . 50139 1 644 . 1 . 1 149 149 ALA CB C 13 17.132 . . 1 . . . . . 149 A CB . 50139 1 645 . 1 . 1 149 149 ALA N N 15 129.207 . . 1 . . . . . 149 A N . 50139 1 646 . 1 . 1 150 150 PRO C C 13 173.848 . . 1 . . . . . 150 P C . 50139 1 647 . 1 . 1 150 150 PRO CA C 13 61.238 . . 1 . . . . . 150 P CA . 50139 1 648 . 1 . 1 150 150 PRO CB C 13 29.897 . . 1 . . . . . 150 P CB . 50139 1 649 . 1 . 1 151 151 ILE H H 1 7.166 . . 1 . . . . . 151 I H . 50139 1 650 . 1 . 1 151 151 ILE C C 13 174.553 . . 1 . . . . . 151 I C . 50139 1 651 . 1 . 1 151 151 ILE CA C 13 56.640 . . 1 . . . . . 151 I CA . 50139 1 652 . 1 . 1 151 151 ILE CB C 13 36.091 . . 1 . . . . . 151 I CB . 50139 1 653 . 1 . 1 151 151 ILE N N 15 123.472 . . 1 . . . . . 151 I N . 50139 1 654 . 1 . 1 152 152 PHE H H 1 8.906 . . 1 . . . . . 152 F H . 50139 1 655 . 1 . 1 152 152 PHE C C 13 174.215 . . 1 . . . . . 152 F C . 50139 1 656 . 1 . 1 152 152 PHE CA C 13 56.463 . . 1 . . . . . 152 F CA . 50139 1 657 . 1 . 1 152 152 PHE N N 15 123.694 . . 1 . . . . . 152 F N . 50139 1 658 . 1 . 1 153 153 ILE H H 1 8.412 . . 1 . . . . . 153 I H . 50139 1 659 . 1 . 1 153 153 ILE CA C 13 59.839 . . 1 . . . . . 153 I CA . 50139 1 660 . 1 . 1 153 153 ILE N N 15 120.143 . . 1 . . . . . 153 I N . 50139 1 661 . 1 . 1 156 156 PRO CA C 13 62.604 . . 1 . . . . . 156 P CA . 50139 1 662 . 1 . 1 156 156 PRO CB C 13 33.622 . . 1 . . . . . 156 P CB . 50139 1 663 . 1 . 1 157 157 ASN H H 1 7.982 . . 1 . . . . . 157 N H . 50139 1 664 . 1 . 1 157 157 ASN C C 13 174.674 . . 1 . . . . . 157 N C . 50139 1 665 . 1 . 1 157 157 ASN CA C 13 51.213 . . 1 . . . . . 157 N CA . 50139 1 666 . 1 . 1 157 157 ASN CB C 13 36.793 . . 1 . . . . . 157 N CB . 50139 1 667 . 1 . 1 157 157 ASN N N 15 118.945 . . 1 . . . . . 157 N N . 50139 1 668 . 1 . 1 158 158 ALA H H 1 6.962 . . 1 . . . . . 158 A H . 50139 1 669 . 1 . 1 158 158 ALA C C 13 176.049 . . 1 . . . . . 158 A C . 50139 1 670 . 1 . 1 158 158 ALA CA C 13 53.023 . . 1 . . . . . 158 A CA . 50139 1 671 . 1 . 1 158 158 ALA CB C 13 19.814 . . 1 . . . . . 158 A CB . 50139 1 672 . 1 . 1 158 158 ALA N N 15 121.973 . . 1 . . . . . 158 A N . 50139 1 673 . 1 . 1 159 159 ASP H H 1 7.874 . . 1 . . . . . 159 D H . 50139 1 674 . 1 . 1 159 159 ASP C C 13 171.704 . . 1 . . . . . 159 D C . 50139 1 675 . 1 . 1 159 159 ASP CA C 13 53.278 . . 1 . . . . . 159 D CA . 50139 1 676 . 1 . 1 159 159 ASP CB C 13 40.077 . . 1 . . . . . 159 D CB . 50139 1 677 . 1 . 1 159 159 ASP N N 15 120.793 . . 1 . . . . . 159 D N . 50139 1 678 . 1 . 1 160 160 ASP H H 1 8.466 . . 1 . . . . . 160 D H . 50139 1 679 . 1 . 1 160 160 ASP C C 13 177.681 . . 1 . . . . . 160 D C . 50139 1 680 . 1 . 1 160 160 ASP CA C 13 58.211 . . 1 . . . . . 160 D CA . 50139 1 681 . 1 . 1 160 160 ASP CB C 13 41.019 . . 1 . . . . . 160 D CB . 50139 1 682 . 1 . 1 160 160 ASP N N 15 119.490 . . 1 . . . . . 160 D N . 50139 1 683 . 1 . 1 161 161 ASP H H 1 7.991 . . 1 . . . . . 161 D H . 50139 1 684 . 1 . 1 161 161 ASP C C 13 178.796 . . 1 . . . . . 161 D C . 50139 1 685 . 1 . 1 161 161 ASP CA C 13 57.109 . . 1 . . . . . 161 D CA . 50139 1 686 . 1 . 1 161 161 ASP CB C 13 39.828 . . 1 . . . . . 161 D CB . 50139 1 687 . 1 . 1 161 161 ASP N N 15 117.018 . . 1 . . . . . 161 D N . 50139 1 688 . 1 . 1 162 162 LEU H H 1 7.878 . . 1 . . . . . 162 L H . 50139 1 689 . 1 . 1 162 162 LEU C C 13 179.318 . . 1 . . . . . 162 L C . 50139 1 690 . 1 . 1 162 162 LEU CA C 13 57.830 . . 1 . . . . . 162 L CA . 50139 1 691 . 1 . 1 162 162 LEU CB C 13 40.267 . . 1 . . . . . 162 L CB . 50139 1 692 . 1 . 1 162 162 LEU N N 15 123.683 . . 1 . . . . . 162 L N . 50139 1 693 . 1 . 1 163 163 LEU H H 1 8.279 . . 1 . . . . . 163 L H . 50139 1 694 . 1 . 1 163 163 LEU C C 13 179.194 . . 1 . . . . . 163 L C . 50139 1 695 . 1 . 1 163 163 LEU CA C 13 58.037 . . 1 . . . . . 163 L CA . 50139 1 696 . 1 . 1 163 163 LEU N N 15 119.203 . . 1 . . . . . 163 L N . 50139 1 697 . 1 . 1 164 164 ARG H H 1 7.474 . . 1 . . . . . 164 R H . 50139 1 698 . 1 . 1 164 164 ARG CA C 13 59.210 . . 1 . . . . . 164 R CA . 50139 1 699 . 1 . 1 164 164 ARG CB C 13 28.951 . . 1 . . . . . 164 R CB . 50139 1 700 . 1 . 1 164 164 ARG N N 15 111.493 . . 1 . . . . . 164 R N . 50139 1 701 . 1 . 1 165 165 GLN H H 1 7.594 . . 1 . . . . . 165 Q H . 50139 1 702 . 1 . 1 165 165 GLN CA C 13 58.962 . . 1 . . . . . 165 Q CA . 50139 1 703 . 1 . 1 165 165 GLN CB C 13 28.917 . . 1 . . . . . 165 Q CB . 50139 1 704 . 1 . 1 165 165 GLN N N 15 120.463 . . 1 . . . . . 165 Q N . 50139 1 705 . 1 . 1 166 166 VAL H H 1 8.565 . . 1 . . . . . 166 V H . 50139 1 706 . 1 . 1 166 166 VAL C C 13 179.142 . . 1 . . . . . 166 V C . 50139 1 707 . 1 . 1 166 166 VAL CA C 13 66.363 . . 1 . . . . . 166 V CA . 50139 1 708 . 1 . 1 166 166 VAL CB C 13 30.568 . . 1 . . . . . 166 V CB . 50139 1 709 . 1 . 1 166 166 VAL N N 15 118.628 . . 1 . . . . . 166 V N . 50139 1 710 . 1 . 1 167 167 ALA H H 1 8.253 . . 1 . . . . . 167 A H . 50139 1 711 . 1 . 1 167 167 ALA C C 13 178.946 . . 1 . . . . . 167 A C . 50139 1 712 . 1 . 1 167 167 ALA CA C 13 54.335 . . 1 . . . . . 167 A CA . 50139 1 713 . 1 . 1 167 167 ALA CB C 13 18.993 . . 1 . . . . . 167 A CB . 50139 1 714 . 1 . 1 167 167 ALA N N 15 121.484 . . 1 . . . . . 167 A N . 50139 1 715 . 1 . 1 168 168 SER H H 1 7.564 . . 1 . . . . . 168 S H . 50139 1 716 . 1 . 1 168 168 SER C C 13 176.849 . . 1 . . . . . 168 S C . 50139 1 717 . 1 . 1 168 168 SER CA C 13 60.185 . . 1 . . . . . 168 S CA . 50139 1 718 . 1 . 1 168 168 SER CB C 13 62.839 . . 1 . . . . . 168 S CB . 50139 1 719 . 1 . 1 168 168 SER N N 15 111.741 . . 1 . . . . . 168 S N . 50139 1 720 . 1 . 1 169 169 TYR H H 1 8.092 . . 1 . . . . . 169 Y H . 50139 1 721 . 1 . 1 169 169 TYR C C 13 177.746 . . 1 . . . . . 169 Y C . 50139 1 722 . 1 . 1 169 169 TYR CA C 13 55.956 . . 1 . . . . . 169 Y CA . 50139 1 723 . 1 . 1 169 169 TYR CB C 13 38.569 . . 1 . . . . . 169 Y CB . 50139 1 724 . 1 . 1 169 169 TYR N N 15 118.682 . . 1 . . . . . 169 Y N . 50139 1 725 . 1 . 1 170 170 GLY H H 1 7.933 . . 1 . . . . . 170 G H . 50139 1 726 . 1 . 1 170 170 GLY CA C 13 46.300 . . 1 . . . . . 170 G CA . 50139 1 727 . 1 . 1 170 170 GLY N N 15 106.163 . . 1 . . . . . 170 G N . 50139 1 728 . 1 . 1 171 171 ARG H H 1 7.182 . . 1 . . . . . 171 R H . 50139 1 729 . 1 . 1 171 171 ARG C C 13 173.725 . . 1 . . . . . 171 R C . 50139 1 730 . 1 . 1 171 171 ARG CA C 13 53.432 . . 1 . . . . . 171 R CA . 50139 1 731 . 1 . 1 171 171 ARG CB C 13 33.800 . . 1 . . . . . 171 R CB . 50139 1 732 . 1 . 1 171 171 ARG N N 15 119.947 . . 1 . . . . . 171 R N . 50139 1 733 . 1 . 1 172 172 GLY H H 1 8.630 . . 1 . . . . . 172 G H . 50139 1 734 . 1 . 1 172 172 GLY C C 13 172.288 . . 1 . . . . . 172 G C . 50139 1 735 . 1 . 1 172 172 GLY CA C 13 45.872 . . 1 . . . . . 172 G CA . 50139 1 736 . 1 . 1 172 172 GLY N N 15 106.997 . . 1 . . . . . 172 G N . 50139 1 737 . 1 . 1 173 173 TYR H H 1 7.449 . . 1 . . . . . 173 Y H . 50139 1 738 . 1 . 1 173 173 TYR C C 13 172.541 . . 1 . . . . . 173 Y C . 50139 1 739 . 1 . 1 173 173 TYR CA C 13 56.846 . . 1 . . . . . 173 Y CA . 50139 1 740 . 1 . 1 173 173 TYR CB C 13 38.777 . . 1 . . . . . 173 Y CB . 50139 1 741 . 1 . 1 173 173 TYR N N 15 118.556 . . 1 . . . . . 173 Y N . 50139 1 742 . 1 . 1 174 174 THR H H 1 8.803 . . 1 . . . . . 174 T H . 50139 1 743 . 1 . 1 174 174 THR C C 13 172.869 . . 1 . . . . . 174 T C . 50139 1 744 . 1 . 1 174 174 THR CA C 13 62.457 . . 1 . . . . . 174 T CA . 50139 1 745 . 1 . 1 174 174 THR CB C 13 69.181 . . 1 . . . . . 174 T CB . 50139 1 746 . 1 . 1 174 174 THR N N 15 117.785 . . 1 . . . . . 174 T N . 50139 1 747 . 1 . 1 175 175 TYR H H 1 8.030 . . 1 . . . . . 175 Y H . 50139 1 748 . 1 . 1 175 175 TYR C C 13 175.915 . . 1 . . . . . 175 Y C . 50139 1 749 . 1 . 1 175 175 TYR N N 15 131.527 . . 1 . . . . . 175 Y N . 50139 1 750 . 1 . 1 177 177 LEU H H 1 8.809 . . 1 . . . . . 177 L H . 50139 1 751 . 1 . 1 177 177 LEU C C 13 179.125 . . 1 . . . . . 177 L C . 50139 1 752 . 1 . 1 177 177 LEU N N 15 118.863 . . 1 . . . . . 177 L N . 50139 1 753 . 1 . 1 178 178 SER H H 1 7.203 . . 1 . . . . . 178 S H . 50139 1 754 . 1 . 1 178 178 SER CA C 13 54.489 . . 1 . . . . . 178 S CA . 50139 1 755 . 1 . 1 178 178 SER N N 15 115.649 . . 1 . . . . . 178 S N . 50139 1 756 . 1 . 1 179 179 ARG H H 1 7.783 . . 1 . . . . . 179 R H . 50139 1 757 . 1 . 1 179 179 ARG N N 15 121.046 . . 1 . . . . . 179 R N . 50139 1 758 . 1 . 1 180 180 SER H H 1 7.680 . . 1 . . . . . 180 S H . 50139 1 759 . 1 . 1 180 180 SER N N 15 110.146 . . 1 . . . . . 180 S N . 50139 1 760 . 1 . 1 181 181 GLY C C 13 174.310 . . 1 . . . . . 181 G C . 50139 1 761 . 1 . 1 181 181 GLY CA C 13 45.014 . . 1 . . . . . 181 G CA . 50139 1 762 . 1 . 1 182 182 VAL H H 1 7.970 . . 1 . . . . . 182 V H . 50139 1 763 . 1 . 1 182 182 VAL C C 13 176.714 . . 1 . . . . . 182 V C . 50139 1 764 . 1 . 1 182 182 VAL CA C 13 62.046 . . 1 . . . . . 182 V CA . 50139 1 765 . 1 . 1 182 182 VAL CB C 13 31.752 . . 1 . . . . . 182 V CB . 50139 1 766 . 1 . 1 182 182 VAL N N 15 119.256 . . 1 . . . . . 182 V N . 50139 1 767 . 1 . 1 183 183 THR H H 1 8.248 . . 1 . . . . . 183 T H . 50139 1 768 . 1 . 1 183 183 THR C C 13 175.284 . . 1 . . . . . 183 T C . 50139 1 769 . 1 . 1 183 183 THR CA C 13 61.786 . . 1 . . . . . 183 T CA . 50139 1 770 . 1 . 1 183 183 THR CB C 13 69.401 . . 1 . . . . . 183 T CB . 50139 1 771 . 1 . 1 183 183 THR N N 15 117.227 . . 1 . . . . . 183 T N . 50139 1 772 . 1 . 1 184 184 GLY H H 1 8.428 . . 1 . . . . . 184 G H . 50139 1 773 . 1 . 1 184 184 GLY C C 13 174.276 . . 1 . . . . . 184 G C . 50139 1 774 . 1 . 1 184 184 GLY CA C 13 45.012 . . 1 . . . . . 184 G CA . 50139 1 775 . 1 . 1 184 184 GLY N N 15 112.070 . . 1 . . . . . 184 G N . 50139 1 776 . 1 . 1 185 185 ALA H H 1 8.152 . . 1 . . . . . 185 A H . 50139 1 777 . 1 . 1 185 185 ALA C C 13 177.046 . . 1 . . . . . 185 A C . 50139 1 778 . 1 . 1 185 185 ALA CA C 13 52.452 . . 1 . . . . . 185 A CA . 50139 1 779 . 1 . 1 185 185 ALA CB C 13 18.394 . . 1 . . . . . 185 A CB . 50139 1 780 . 1 . 1 185 185 ALA N N 15 124.210 . . 1 . . . . . 185 A N . 50139 1 781 . 1 . 1 186 186 GLU H H 1 8.540 . . 1 . . . . . 186 E H . 50139 1 782 . 1 . 1 186 186 GLU C C 13 176.535 . . 1 . . . . . 186 E C . 50139 1 783 . 1 . 1 186 186 GLU CA C 13 56.774 . . 1 . . . . . 186 E CA . 50139 1 784 . 1 . 1 186 186 GLU CB C 13 28.914 . . 1 . . . . . 186 E CB . 50139 1 785 . 1 . 1 186 186 GLU N N 15 119.605 . . 1 . . . . . 186 E N . 50139 1 786 . 1 . 1 187 187 ASN H H 1 8.260 . . 1 . . . . . 187 N H . 50139 1 787 . 1 . 1 187 187 ASN C C 13 175.392 . . 1 . . . . . 187 N C . 50139 1 788 . 1 . 1 187 187 ASN CA C 13 53.066 . . 1 . . . . . 187 N CA . 50139 1 789 . 1 . 1 187 187 ASN CB C 13 38.247 . . 1 . . . . . 187 N CB . 50139 1 790 . 1 . 1 187 187 ASN N N 15 119.377 . . 1 . . . . . 187 N N . 50139 1 791 . 1 . 1 188 188 ARG H H 1 8.186 . . 1 . . . . . 188 R H . 50139 1 792 . 1 . 1 188 188 ARG C C 13 176.925 . . 1 . . . . . 188 R C . 50139 1 793 . 1 . 1 188 188 ARG CA C 13 56.334 . . 1 . . . . . 188 R CA . 50139 1 794 . 1 . 1 188 188 ARG CB C 13 29.376 . . 1 . . . . . 188 R CB . 50139 1 795 . 1 . 1 188 188 ARG N N 15 121.585 . . 1 . . . . . 188 R N . 50139 1 796 . 1 . 1 189 189 GLY H H 1 8.415 . . 1 . . . . . 189 G H . 50139 1 797 . 1 . 1 189 189 GLY C C 13 173.756 . . 1 . . . . . 189 G C . 50139 1 798 . 1 . 1 189 189 GLY CA C 13 44.834 . . 1 . . . . . 189 G CA . 50139 1 799 . 1 . 1 189 189 GLY N N 15 110.277 . . 1 . . . . . 189 G N . 50139 1 800 . 1 . 1 190 190 ALA H H 1 7.805 . . 1 . . . . . 190 A H . 50139 1 801 . 1 . 1 190 190 ALA C C 13 177.596 . . 1 . . . . . 190 A C . 50139 1 802 . 1 . 1 190 190 ALA CA C 13 51.845 . . 1 . . . . . 190 A CA . 50139 1 803 . 1 . 1 190 190 ALA CB C 13 18.739 . . 1 . . . . . 190 A CB . 50139 1 804 . 1 . 1 190 190 ALA N N 15 123.148 . . 1 . . . . . 190 A N . 50139 1 805 . 1 . 1 191 191 LEU H H 1 8.266 . . 1 . . . . . 191 L H . 50139 1 806 . 1 . 1 191 191 LEU CA C 13 52.959 . . 1 . . . . . 191 L CA . 50139 1 807 . 1 . 1 191 191 LEU CB C 13 40.986 . . 1 . . . . . 191 L CB . 50139 1 808 . 1 . 1 191 191 LEU N N 15 123.776 . . 1 . . . . . 191 L N . 50139 1 809 . 1 . 1 193 193 LEU H H 1 7.834 . . 1 . . . . . 193 L H . 50139 1 810 . 1 . 1 193 193 LEU C C 13 178.186 . . 1 . . . . . 193 L C . 50139 1 811 . 1 . 1 193 193 LEU CA C 13 57.831 . . 1 . . . . . 193 L CA . 50139 1 812 . 1 . 1 193 193 LEU CB C 13 40.791 . . 1 . . . . . 193 L CB . 50139 1 813 . 1 . 1 193 193 LEU N N 15 119.279 . . 1 . . . . . 193 L N . 50139 1 814 . 1 . 1 194 194 HIS H H 1 8.639 . . 1 . . . . . 194 H H . 50139 1 815 . 1 . 1 194 194 HIS C C 13 177.281 . . 1 . . . . . 194 H C . 50139 1 816 . 1 . 1 194 194 HIS CA C 13 59.148 . . 1 . . . . . 194 H CA . 50139 1 817 . 1 . 1 194 194 HIS CB C 13 28.478 . . 1 . . . . . 194 H CB . 50139 1 818 . 1 . 1 194 194 HIS N N 15 114.675 . . 1 . . . . . 194 H N . 50139 1 819 . 1 . 1 195 195 HIS H H 1 7.214 . . 1 . . . . . 195 H H . 50139 1 820 . 1 . 1 195 195 HIS C C 13 177.013 . . 1 . . . . . 195 H C . 50139 1 821 . 1 . 1 195 195 HIS CA C 13 57.967 . . 1 . . . . . 195 H CA . 50139 1 822 . 1 . 1 195 195 HIS CB C 13 29.600 . . 1 . . . . . 195 H CB . 50139 1 823 . 1 . 1 195 195 HIS N N 15 118.800 . . 1 . . . . . 195 H N . 50139 1 824 . 1 . 1 196 196 LEU H H 1 7.685 . . 1 . . . . . 196 L H . 50139 1 825 . 1 . 1 196 196 LEU C C 13 178.307 . . 1 . . . . . 196 L C . 50139 1 826 . 1 . 1 196 196 LEU CA C 13 58.094 . . 1 . . . . . 196 L CA . 50139 1 827 . 1 . 1 196 196 LEU CB C 13 40.947 . . 1 . . . . . 196 L CB . 50139 1 828 . 1 . 1 196 196 LEU N N 15 121.856 . . 1 . . . . . 196 L N . 50139 1 829 . 1 . 1 197 197 ILE H H 1 8.123 . . 1 . . . . . 197 I H . 50139 1 830 . 1 . 1 197 197 ILE CB C 13 36.793 . . 1 . . . . . 197 I CB . 50139 1 831 . 1 . 1 197 197 ILE N N 15 117.898 . . 1 . . . . . 197 I N . 50139 1 832 . 1 . 1 198 198 GLU H H 1 6.962 . . 1 . . . . . 198 E H . 50139 1 833 . 1 . 1 198 198 GLU C C 13 179.584 . . 1 . . . . . 198 E C . 50139 1 834 . 1 . 1 198 198 GLU CA C 13 59.069 . . 1 . . . . . 198 E CA . 50139 1 835 . 1 . 1 198 198 GLU CB C 13 28.573 . . 1 . . . . . 198 E CB . 50139 1 836 . 1 . 1 198 198 GLU N N 15 121.973 . . 1 . . . . . 198 E N . 50139 1 837 . 1 . 1 199 199 LYS H H 1 7.936 . . 1 . . . . . 199 K H . 50139 1 838 . 1 . 1 199 199 LYS C C 13 177.976 . . 1 . . . . . 199 K C . 50139 1 839 . 1 . 1 199 199 LYS CA C 13 57.257 . . 1 . . . . . 199 K CA . 50139 1 840 . 1 . 1 199 199 LYS CB C 13 30.428 . . 1 . . . . . 199 K CB . 50139 1 841 . 1 . 1 199 199 LYS N N 15 121.316 . . 1 . . . . . 199 K N . 50139 1 842 . 1 . 1 200 200 LEU H H 1 8.080 . . 1 . . . . . 200 L H . 50139 1 843 . 1 . 1 200 200 LEU C C 13 179.271 . . 1 . . . . . 200 L C . 50139 1 844 . 1 . 1 200 200 LEU CA C 13 58.133 . . 1 . . . . . 200 L CA . 50139 1 845 . 1 . 1 200 200 LEU CB C 13 39.808 . . 1 . . . . . 200 L CB . 50139 1 846 . 1 . 1 200 200 LEU N N 15 118.778 . . 1 . . . . . 200 L N . 50139 1 847 . 1 . 1 201 201 LYS H H 1 7.764 . . 1 . . . . . 201 K H . 50139 1 848 . 1 . 1 201 201 LYS C C 13 181.389 . . 1 . . . . . 201 K C . 50139 1 849 . 1 . 1 201 201 LYS CA C 13 59.104 . . 1 . . . . . 201 K CA . 50139 1 850 . 1 . 1 201 201 LYS CB C 13 31.389 . . 1 . . . . . 201 K CB . 50139 1 851 . 1 . 1 201 201 LYS N N 15 118.260 . . 1 . . . . . 201 K N . 50139 1 852 . 1 . 1 202 202 GLU H H 1 8.037 . . 1 . . . . . 202 E H . 50139 1 853 . 1 . 1 202 202 GLU C C 13 178.317 . . 1 . . . . . 202 E C . 50139 1 854 . 1 . 1 202 202 GLU CA C 13 58.584 . . 1 . . . . . 202 E CA . 50139 1 855 . 1 . 1 202 202 GLU CB C 13 28.038 . . 1 . . . . . 202 E CB . 50139 1 856 . 1 . 1 202 202 GLU N N 15 124.906 . . 1 . . . . . 202 E N . 50139 1 857 . 1 . 1 203 203 TYR H H 1 7.528 . . 1 . . . . . 203 Y H . 50139 1 858 . 1 . 1 203 203 TYR C C 13 174.518 . . 1 . . . . . 203 Y C . 50139 1 859 . 1 . 1 203 203 TYR CA C 13 54.636 . . 1 . . . . . 203 Y CA . 50139 1 860 . 1 . 1 203 203 TYR CB C 13 36.193 . . 1 . . . . . 203 Y CB . 50139 1 861 . 1 . 1 203 203 TYR N N 15 115.953 . . 1 . . . . . 203 Y N . 50139 1 862 . 1 . 1 204 204 HIS H H 1 7.829 . . 1 . . . . . 204 H H . 50139 1 863 . 1 . 1 204 204 HIS C C 13 174.455 . . 1 . . . . . 204 H C . 50139 1 864 . 1 . 1 204 204 HIS CA C 13 55.715 . . 1 . . . . . 204 H CA . 50139 1 865 . 1 . 1 204 204 HIS CB C 13 24.779 . . 1 . . . . . 204 H CB . 50139 1 866 . 1 . 1 204 204 HIS N N 15 114.406 . . 1 . . . . . 204 H N . 50139 1 867 . 1 . 1 205 205 ALA H H 1 8.151 . . 1 . . . . . 205 A H . 50139 1 868 . 1 . 1 205 205 ALA C C 13 177.144 . . 1 . . . . . 205 A C . 50139 1 869 . 1 . 1 205 205 ALA CA C 13 51.094 . . 1 . . . . . 205 A CA . 50139 1 870 . 1 . 1 205 205 ALA CB C 13 20.100 . . 1 . . . . . 205 A CB . 50139 1 871 . 1 . 1 205 205 ALA N N 15 119.247 . . 1 . . . . . 205 A N . 50139 1 872 . 1 . 1 206 206 ALA H H 1 8.418 . . 1 . . . . . 206 A H . 50139 1 873 . 1 . 1 206 206 ALA N N 15 125.179 . . 1 . . . . . 206 A N . 50139 1 874 . 1 . 1 207 207 PRO C C 13 175.018 . . 1 . . . . . 207 P C . 50139 1 875 . 1 . 1 207 207 PRO CA C 13 63.324 . . 1 . . . . . 207 P CA . 50139 1 876 . 1 . 1 207 207 PRO CB C 13 30.851 . . 1 . . . . . 207 P CB . 50139 1 877 . 1 . 1 208 208 ALA H H 1 8.274 . . 1 . . . . . 208 A H . 50139 1 878 . 1 . 1 208 208 ALA C C 13 176.320 . . 1 . . . . . 208 A C . 50139 1 879 . 1 . 1 208 208 ALA CA C 13 51.307 . . 1 . . . . . 208 A CA . 50139 1 880 . 1 . 1 208 208 ALA CB C 13 19.072 . . 1 . . . . . 208 A CB . 50139 1 881 . 1 . 1 208 208 ALA N N 15 125.428 . . 1 . . . . . 208 A N . 50139 1 882 . 1 . 1 209 209 LEU H H 1 8.706 . . 1 . . . . . 209 L H . 50139 1 883 . 1 . 1 209 209 LEU C C 13 175.649 . . 1 . . . . . 209 L C . 50139 1 884 . 1 . 1 209 209 LEU CA C 13 52.094 . . 1 . . . . . 209 L CA . 50139 1 885 . 1 . 1 209 209 LEU CB C 13 41.386 . . 1 . . . . . 209 L CB . 50139 1 886 . 1 . 1 209 209 LEU N N 15 120.991 . . 1 . . . . . 209 L N . 50139 1 887 . 1 . 1 210 210 GLN H H 1 8.084 . . 1 . . . . . 210 Q H . 50139 1 888 . 1 . 1 210 210 GLN N N 15 123.718 . . 1 . . . . . 210 Q N . 50139 1 889 . 1 . 1 211 211 GLY C C 13 175.878 . . 1 . . . . . 211 G C . 50139 1 890 . 1 . 1 212 212 PHE H H 1 7.688 . . 1 . . . . . 212 F H . 50139 1 891 . 1 . 1 212 212 PHE CA C 13 55.901 . . 1 . . . . . 212 F CA . 50139 1 892 . 1 . 1 212 212 PHE CB C 13 38.126 . . 1 . . . . . 212 F CB . 50139 1 893 . 1 . 1 212 212 PHE N N 15 112.952 . . 1 . . . . . 212 F N . 50139 1 894 . 1 . 1 213 213 GLY H H 1 7.580 . . 1 . . . . . 213 G H . 50139 1 895 . 1 . 1 213 213 GLY C C 13 173.715 . . 1 . . . . . 213 G C . 50139 1 896 . 1 . 1 213 213 GLY N N 15 112.126 . . 1 . . . . . 213 G N . 50139 1 897 . 1 . 1 214 214 ILE H H 1 7.845 . . 1 . . . . . 214 I H . 50139 1 898 . 1 . 1 214 214 ILE N N 15 122.083 . . 1 . . . . . 214 I N . 50139 1 899 . 1 . 1 215 215 SER H H 1 8.593 . . 1 . . . . . 215 S H . 50139 1 900 . 1 . 1 215 215 SER N N 15 121.128 . . 1 . . . . . 215 S N . 50139 1 901 . 1 . 1 217 217 PRO C C 13 177.765 . . 1 . . . . . 217 P C . 50139 1 902 . 1 . 1 217 217 PRO CA C 13 65.687 . . 1 . . . . . 217 P CA . 50139 1 903 . 1 . 1 217 217 PRO CB C 13 31.383 . . 1 . . . . . 217 P CB . 50139 1 904 . 1 . 1 218 218 GLU H H 1 8.826 . . 1 . . . . . 218 E H . 50139 1 905 . 1 . 1 218 218 GLU C C 13 179.503 . . 1 . . . . . 218 E C . 50139 1 906 . 1 . 1 218 218 GLU CA C 13 59.273 . . 1 . . . . . 218 E CA . 50139 1 907 . 1 . 1 218 218 GLU CB C 13 27.729 . . 1 . . . . . 218 E CB . 50139 1 908 . 1 . 1 218 218 GLU N N 15 116.501 . . 1 . . . . . 218 E N . 50139 1 909 . 1 . 1 219 219 GLN H H 1 7.622 . . 1 . . . . . 219 Q H . 50139 1 910 . 1 . 1 219 219 GLN C C 13 179.310 . . 1 . . . . . 219 Q C . 50139 1 911 . 1 . 1 219 219 GLN CA C 13 58.020 . . 1 . . . . . 219 Q CA . 50139 1 912 . 1 . 1 219 219 GLN CB C 13 28.558 . . 1 . . . . . 219 Q CB . 50139 1 913 . 1 . 1 219 219 GLN N N 15 117.680 . . 1 . . . . . 219 Q N . 50139 1 914 . 1 . 1 220 220 VAL H H 1 7.449 . . 1 . . . . . 220 V H . 50139 1 915 . 1 . 1 220 220 VAL C C 13 177.448 . . 1 . . . . . 220 V C . 50139 1 916 . 1 . 1 220 220 VAL CA C 13 66.517 . . 1 . . . . . 220 V CA . 50139 1 917 . 1 . 1 220 220 VAL CB C 13 30.242 . . 1 . . . . . 220 V CB . 50139 1 918 . 1 . 1 220 220 VAL N N 15 122.364 . . 1 . . . . . 220 V N . 50139 1 919 . 1 . 1 221 221 SER H H 1 7.906 . . 1 . . . . . 221 S H . 50139 1 920 . 1 . 1 221 221 SER C C 13 177.105 . . 1 . . . . . 221 S C . 50139 1 921 . 1 . 1 221 221 SER CA C 13 60.884 . . 1 . . . . . 221 S CA . 50139 1 922 . 1 . 1 221 221 SER CB C 13 61.953 . . 1 . . . . . 221 S CB . 50139 1 923 . 1 . 1 221 221 SER N N 15 113.660 . . 1 . . . . . 221 S N . 50139 1 924 . 1 . 1 222 222 ALA H H 1 7.929 . . 1 . . . . . 222 A H . 50139 1 925 . 1 . 1 222 222 ALA C C 13 180.149 . . 1 . . . . . 222 A C . 50139 1 926 . 1 . 1 222 222 ALA CA C 13 54.706 . . 1 . . . . . 222 A CA . 50139 1 927 . 1 . 1 222 222 ALA CB C 13 17.469 . . 1 . . . . . 222 A CB . 50139 1 928 . 1 . 1 222 222 ALA N N 15 121.668 . . 1 . . . . . 222 A N . 50139 1 929 . 1 . 1 223 223 ALA H H 1 7.500 . . 1 . . . . . 223 A H . 50139 1 930 . 1 . 1 223 223 ALA C C 13 178.309 . . 1 . . . . . 223 A C . 50139 1 931 . 1 . 1 223 223 ALA CA C 13 54.945 . . 1 . . . . . 223 A CA . 50139 1 932 . 1 . 1 223 223 ALA CB C 13 16.229 . . 1 . . . . . 223 A CB . 50139 1 933 . 1 . 1 223 223 ALA N N 15 121.972 . . 1 . . . . . 223 A N . 50139 1 934 . 1 . 1 224 224 VAL H H 1 7.620 . . 1 . . . . . 224 V H . 50139 1 935 . 1 . 1 224 224 VAL C C 13 181.212 . . 1 . . . . . 224 V C . 50139 1 936 . 1 . 1 224 224 VAL CA C 13 64.790 . . 1 . . . . . 224 V CA . 50139 1 937 . 1 . 1 224 224 VAL CB C 13 30.857 . . 1 . . . . . 224 V CB . 50139 1 938 . 1 . 1 224 224 VAL N N 15 117.584 . . 1 . . . . . 224 V N . 50139 1 939 . 1 . 1 225 225 ARG H H 1 8.579 . . 1 . . . . . 225 R H . 50139 1 940 . 1 . 1 225 225 ARG C C 13 177.084 . . 1 . . . . . 225 R C . 50139 1 941 . 1 . 1 225 225 ARG CA C 13 58.786 . . 1 . . . . . 225 R CA . 50139 1 942 . 1 . 1 225 225 ARG CB C 13 29.016 . . 1 . . . . . 225 R CB . 50139 1 943 . 1 . 1 225 225 ARG N N 15 122.763 . . 1 . . . . . 225 R N . 50139 1 944 . 1 . 1 226 226 ALA H H 1 7.507 . . 1 . . . . . 226 A H . 50139 1 945 . 1 . 1 226 226 ALA C C 13 176.687 . . 1 . . . . . 226 A C . 50139 1 946 . 1 . 1 226 226 ALA CA C 13 52.422 . . 1 . . . . . 226 A CA . 50139 1 947 . 1 . 1 226 226 ALA CB C 13 17.915 . . 1 . . . . . 226 A CB . 50139 1 948 . 1 . 1 226 226 ALA N N 15 119.897 . . 1 . . . . . 226 A N . 50139 1 949 . 1 . 1 227 227 GLY H H 1 7.719 . . 1 . . . . . 227 G H . 50139 1 950 . 1 . 1 227 227 GLY C C 13 175.396 . . 1 . . . . . 227 G C . 50139 1 951 . 1 . 1 227 227 GLY CA C 13 44.045 . . 1 . . . . . 227 G CA . 50139 1 952 . 1 . 1 227 227 GLY N N 15 103.688 . . 1 . . . . . 227 G N . 50139 1 953 . 1 . 1 228 228 ALA H H 1 7.965 . . 1 . . . . . 228 A H . 50139 1 954 . 1 . 1 228 228 ALA C C 13 175.914 . . 1 . . . . . 228 A C . 50139 1 955 . 1 . 1 228 228 ALA CA C 13 52.066 . . 1 . . . . . 228 A CA . 50139 1 956 . 1 . 1 228 228 ALA CB C 13 17.219 . . 1 . . . . . 228 A CB . 50139 1 957 . 1 . 1 228 228 ALA N N 15 123.169 . . 1 . . . . . 228 A N . 50139 1 958 . 1 . 1 229 229 ALA H H 1 8.827 . . 1 . . . . . 229 A H . 50139 1 959 . 1 . 1 229 229 ALA C C 13 177.810 . . 1 . . . . . 229 A C . 50139 1 960 . 1 . 1 229 229 ALA CA C 13 51.817 . . 1 . . . . . 229 A CA . 50139 1 961 . 1 . 1 229 229 ALA CB C 13 18.231 . . 1 . . . . . 229 A CB . 50139 1 962 . 1 . 1 229 229 ALA N N 15 121.797 . . 1 . . . . . 229 A N . 50139 1 963 . 1 . 1 230 230 GLY H H 1 7.378 . . 1 . . . . . 230 G H . 50139 1 964 . 1 . 1 230 230 GLY C C 13 170.112 . . 1 . . . . . 230 G C . 50139 1 965 . 1 . 1 230 230 GLY CA C 13 46.178 . . 1 . . . . . 230 G CA . 50139 1 966 . 1 . 1 230 230 GLY N N 15 103.184 . . 1 . . . . . 230 G N . 50139 1 967 . 1 . 1 231 231 ALA H H 1 8.785 . . 1 . . . . . 231 A H . 50139 1 968 . 1 . 1 231 231 ALA C C 13 173.639 . . 1 . . . . . 231 A C . 50139 1 969 . 1 . 1 231 231 ALA CA C 13 50.140 . . 1 . . . . . 231 A CA . 50139 1 970 . 1 . 1 231 231 ALA CB C 13 22.927 . . 1 . . . . . 231 A CB . 50139 1 971 . 1 . 1 231 231 ALA N N 15 122.356 . . 1 . . . . . 231 A N . 50139 1 972 . 1 . 1 232 232 ILE H H 1 8.400 . . 1 . . . . . 232 I H . 50139 1 973 . 1 . 1 232 232 ILE CB C 13 40.308 . . 1 . . . . . 232 I CB . 50139 1 974 . 1 . 1 232 232 ILE N N 15 121.313 . . 1 . . . . . 232 I N . 50139 1 975 . 1 . 1 233 233 SER H H 1 6.991 . . 1 . . . . . 233 S H . 50139 1 976 . 1 . 1 233 233 SER N N 15 120.924 . . 1 . . . . . 233 S N . 50139 1 977 . 1 . 1 240 240 ILE H H 1 7.970 . . 1 . . . . . 240 I H . 50139 1 978 . 1 . 1 240 240 ILE C C 13 177.442 . . 1 . . . . . 240 I C . 50139 1 979 . 1 . 1 240 240 ILE CA C 13 64.190 . . 1 . . . . . 240 I CA . 50139 1 980 . 1 . 1 240 240 ILE N N 15 119.256 . . 1 . . . . . 240 I N . 50139 1 981 . 1 . 1 241 241 ILE H H 1 8.036 . . 1 . . . . . 241 I H . 50139 1 982 . 1 . 1 241 241 ILE C C 13 177.684 . . 1 . . . . . 241 I C . 50139 1 983 . 1 . 1 241 241 ILE CA C 13 61.804 . . 1 . . . . . 241 I CA . 50139 1 984 . 1 . 1 241 241 ILE N N 15 121.968 . . 1 . . . . . 241 I N . 50139 1 985 . 1 . 1 242 242 GLU H H 1 7.875 . . 1 . . . . . 242 E H . 50139 1 986 . 1 . 1 242 242 GLU C C 13 178.729 . . 1 . . . . . 242 E C . 50139 1 987 . 1 . 1 242 242 GLU CA C 13 58.972 . . 1 . . . . . 242 E CA . 50139 1 988 . 1 . 1 242 242 GLU CB C 13 29.479 . . 1 . . . . . 242 E CB . 50139 1 989 . 1 . 1 242 242 GLU N N 15 120.394 . . 1 . . . . . 242 E N . 50139 1 990 . 1 . 1 243 243 LYS H H 1 8.137 . . 1 . . . . . 243 K H . 50139 1 991 . 1 . 1 243 243 LYS C C 13 177.444 . . 1 . . . . . 243 K C . 50139 1 992 . 1 . 1 243 243 LYS CA C 13 57.746 . . 1 . . . . . 243 K CA . 50139 1 993 . 1 . 1 243 243 LYS CB C 13 32.061 . . 1 . . . . . 243 K CB . 50139 1 994 . 1 . 1 243 243 LYS N N 15 116.711 . . 1 . . . . . 243 K N . 50139 1 995 . 1 . 1 244 244 ASN H H 1 7.233 . . 1 . . . . . 244 N H . 50139 1 996 . 1 . 1 244 244 ASN C C 13 175.043 . . 1 . . . . . 244 N C . 50139 1 997 . 1 . 1 244 244 ASN CA C 13 52.996 . . 1 . . . . . 244 N CA . 50139 1 998 . 1 . 1 244 244 ASN CB C 13 40.289 . . 1 . . . . . 244 N CB . 50139 1 999 . 1 . 1 244 244 ASN N N 15 114.611 . . 1 . . . . . 244 N N . 50139 1 1000 . 1 . 1 245 245 LEU H H 1 6.996 . . 1 . . . . . 245 L H . 50139 1 1001 . 1 . 1 245 245 LEU C C 13 178.273 . . 1 . . . . . 245 L C . 50139 1 1002 . 1 . 1 245 245 LEU CA C 13 58.068 . . 1 . . . . . 245 L CA . 50139 1 1003 . 1 . 1 245 245 LEU CB C 13 41.354 . . 1 . . . . . 245 L CB . 50139 1 1004 . 1 . 1 245 245 LEU N N 15 121.137 . . 1 . . . . . 245 L N . 50139 1 1005 . 1 . 1 246 246 ALA H H 1 8.297 . . 1 . . . . . 246 A H . 50139 1 1006 . 1 . 1 246 246 ALA CA C 13 51.986 . . 1 . . . . . 246 A CA . 50139 1 1007 . 1 . 1 246 246 ALA CB C 13 18.042 . . 1 . . . . . 246 A CB . 50139 1 1008 . 1 . 1 246 246 ALA N N 15 116.619 . . 1 . . . . . 246 A N . 50139 1 1009 . 1 . 1 248 248 PRO C C 13 178.233 . . 1 . . . . . 248 P C . 50139 1 1010 . 1 . 1 248 248 PRO CA C 13 65.295 . . 1 . . . . . 248 P CA . 50139 1 1011 . 1 . 1 248 248 PRO CB C 13 31.328 . . 1 . . . . . 248 P CB . 50139 1 1012 . 1 . 1 249 249 LYS H H 1 8.340 . . 1 . . . . . 249 K H . 50139 1 1013 . 1 . 1 249 249 LYS C C 13 179.976 . . 1 . . . . . 249 K C . 50139 1 1014 . 1 . 1 249 249 LYS CA C 13 59.476 . . 1 . . . . . 249 K CA . 50139 1 1015 . 1 . 1 249 249 LYS CB C 13 31.204 . . 1 . . . . . 249 K CB . 50139 1 1016 . 1 . 1 249 249 LYS N N 15 116.962 . . 1 . . . . . 249 K N . 50139 1 1017 . 1 . 1 250 250 GLN H H 1 7.610 . . 1 . . . . . 250 Q H . 50139 1 1018 . 1 . 1 250 250 GLN C C 13 177.973 . . 1 . . . . . 250 Q C . 50139 1 1019 . 1 . 1 250 250 GLN CA C 13 57.861 . . 1 . . . . . 250 Q CA . 50139 1 1020 . 1 . 1 250 250 GLN CB C 13 27.045 . . 1 . . . . . 250 Q CB . 50139 1 1021 . 1 . 1 250 250 GLN N N 15 122.947 . . 1 . . . . . 250 Q N . 50139 1 1022 . 1 . 1 251 251 MET H H 1 8.571 . . 1 . . . . . 251 M H . 50139 1 1023 . 1 . 1 251 251 MET C C 13 177.641 . . 1 . . . . . 251 M C . 50139 1 1024 . 1 . 1 251 251 MET CA C 13 58.982 . . 1 . . . . . 251 M CA . 50139 1 1025 . 1 . 1 251 251 MET CB C 13 33.812 . . 1 . . . . . 251 M CB . 50139 1 1026 . 1 . 1 251 251 MET N N 15 118.336 . . 1 . . . . . 251 M N . 50139 1 1027 . 1 . 1 252 252 LEU H H 1 7.452 . . 1 . . . . . 252 L H . 50139 1 1028 . 1 . 1 252 252 LEU C C 13 178.914 . . 1 . . . . . 252 L C . 50139 1 1029 . 1 . 1 252 252 LEU CA C 13 57.485 . . 1 . . . . . 252 L CA . 50139 1 1030 . 1 . 1 252 252 LEU CB C 13 39.101 . . 1 . . . . . 252 L CB . 50139 1 1031 . 1 . 1 252 252 LEU N N 15 114.830 . . 1 . . . . . 252 L N . 50139 1 1032 . 1 . 1 253 253 ALA H H 1 7.527 . . 1 . . . . . 253 A H . 50139 1 1033 . 1 . 1 253 253 ALA C C 13 180.950 . . 1 . . . . . 253 A C . 50139 1 1034 . 1 . 1 253 253 ALA CA C 13 54.983 . . 1 . . . . . 253 A CA . 50139 1 1035 . 1 . 1 253 253 ALA CB C 13 17.321 . . 1 . . . . . 253 A CB . 50139 1 1036 . 1 . 1 253 253 ALA N N 15 122.770 . . 1 . . . . . 253 A N . 50139 1 1037 . 1 . 1 254 254 GLU H H 1 8.576 . . 1 . . . . . 254 E H . 50139 1 1038 . 1 . 1 254 254 GLU C C 13 173.780 . . 1 . . . . . 254 E C . 50139 1 1039 . 1 . 1 254 254 GLU CA C 13 59.098 . . 1 . . . . . 254 E CA . 50139 1 1040 . 1 . 1 254 254 GLU CB C 13 28.453 . . 1 . . . . . 254 E CB . 50139 1 1041 . 1 . 1 254 254 GLU N N 15 119.720 . . 1 . . . . . 254 E N . 50139 1 1042 . 1 . 1 255 255 LEU H H 1 8.267 . . 1 . . . . . 255 L H . 50139 1 1043 . 1 . 1 255 255 LEU N N 15 121.394 . . 1 . . . . . 255 L N . 50139 1 1044 . 1 . 1 256 256 ARG H H 1 7.601 . . 1 . . . . . 256 R H . 50139 1 1045 . 1 . 1 256 256 ARG C C 13 178.707 . . 1 . . . . . 256 R C . 50139 1 1046 . 1 . 1 256 256 ARG CA C 13 59.232 . . 1 . . . . . 256 R CA . 50139 1 1047 . 1 . 1 256 256 ARG CB C 13 28.958 . . 1 . . . . . 256 R CB . 50139 1 1048 . 1 . 1 256 256 ARG N N 15 111.753 . . 1 . . . . . 256 R N . 50139 1 1049 . 1 . 1 257 257 SER H H 1 7.973 . . 1 . . . . . 257 S H . 50139 1 1050 . 1 . 1 257 257 SER C C 13 176.887 . . 1 . . . . . 257 S C . 50139 1 1051 . 1 . 1 257 257 SER CA C 13 61.117 . . 1 . . . . . 257 S CA . 50139 1 1052 . 1 . 1 257 257 SER CB C 13 62.099 . . 1 . . . . . 257 S CB . 50139 1 1053 . 1 . 1 257 257 SER N N 15 114.472 . . 1 . . . . . 257 S N . 50139 1 1054 . 1 . 1 258 258 PHE H H 1 8.274 . . 1 . . . . . 258 F H . 50139 1 1055 . 1 . 1 258 258 PHE C C 13 177.193 . . 1 . . . . . 258 F C . 50139 1 1056 . 1 . 1 258 258 PHE CA C 13 61.155 . . 1 . . . . . 258 F CA . 50139 1 1057 . 1 . 1 258 258 PHE CB C 13 39.646 . . 1 . . . . . 258 F CB . 50139 1 1058 . 1 . 1 258 258 PHE N N 15 123.000 . . 1 . . . . . 258 F N . 50139 1 1059 . 1 . 1 259 259 VAL H H 1 8.755 . . 1 . . . . . 259 V H . 50139 1 1060 . 1 . 1 259 259 VAL C C 13 177.127 . . 1 . . . . . 259 V C . 50139 1 1061 . 1 . 1 259 259 VAL CA C 13 66.723 . . 1 . . . . . 259 V CA . 50139 1 1062 . 1 . 1 259 259 VAL CB C 13 29.512 . . 1 . . . . . 259 V CB . 50139 1 1063 . 1 . 1 259 259 VAL N N 15 118.499 . . 1 . . . . . 259 V N . 50139 1 1064 . 1 . 1 260 260 SER H H 1 8.114 . . 1 . . . . . 260 S H . 50139 1 1065 . 1 . 1 260 260 SER CA C 13 62.196 . . 1 . . . . . 260 S CA . 50139 1 1066 . 1 . 1 260 260 SER N N 15 113.788 . . 1 . . . . . 260 S N . 50139 1 1067 . 1 . 1 261 261 ALA C C 13 180.904 . . 1 . . . . . 261 A C . 50139 1 1068 . 1 . 1 261 261 ALA CA C 13 54.549 . . 1 . . . . . 261 A CA . 50139 1 1069 . 1 . 1 261 261 ALA CB C 13 17.377 . . 1 . . . . . 261 A CB . 50139 1 1070 . 1 . 1 262 262 MET H H 1 7.744 . . 1 . . . . . 262 M H . 50139 1 1071 . 1 . 1 262 262 MET C C 13 177.863 . . 1 . . . . . 262 M C . 50139 1 1072 . 1 . 1 262 262 MET CA C 13 56.503 . . 1 . . . . . 262 M CA . 50139 1 1073 . 1 . 1 262 262 MET N N 15 119.105 . . 1 . . . . . 262 M N . 50139 1 1074 . 1 . 1 263 263 LYS H H 1 8.388 . . 1 . . . . . 263 K H . 50139 1 1075 . 1 . 1 263 263 LYS C C 13 181.284 . . 1 . . . . . 263 K C . 50139 1 1076 . 1 . 1 263 263 LYS CA C 13 56.142 . . 1 . . . . . 263 K CA . 50139 1 1077 . 1 . 1 263 263 LYS CB C 13 29.024 . . 1 . . . . . 263 K CB . 50139 1 1078 . 1 . 1 263 263 LYS N N 15 117.037 . . 1 . . . . . 263 K N . 50139 1 1079 . 1 . 1 264 264 ALA H H 1 8.207 . . 1 . . . . . 264 A H . 50139 1 1080 . 1 . 1 264 264 ALA C C 13 179.794 . . 1 . . . . . 264 A C . 50139 1 1081 . 1 . 1 264 264 ALA CA C 13 55.089 . . 1 . . . . . 264 A CA . 50139 1 1082 . 1 . 1 264 264 ALA CB C 13 16.645 . . 1 . . . . . 264 A CB . 50139 1 1083 . 1 . 1 264 264 ALA N N 15 125.690 . . 1 . . . . . 264 A N . 50139 1 1084 . 1 . 1 265 265 ALA H H 1 6.957 . . 1 . . . . . 265 A H . 50139 1 1085 . 1 . 1 265 265 ALA C C 13 177.768 . . 1 . . . . . 265 A C . 50139 1 1086 . 1 . 1 265 265 ALA CA C 13 52.901 . . 1 . . . . . 265 A CA . 50139 1 1087 . 1 . 1 265 265 ALA CB C 13 19.052 . . 1 . . . . . 265 A CB . 50139 1 1088 . 1 . 1 265 265 ALA N N 15 118.733 . . 1 . . . . . 265 A N . 50139 1 1089 . 1 . 1 266 266 SER H H 1 7.682 . . 1 . . . . . 266 S H . 50139 1 1090 . 1 . 1 266 266 SER C C 13 173.530 . . 1 . . . . . 266 S C . 50139 1 1091 . 1 . 1 266 266 SER CA C 13 59.571 . . 1 . . . . . 266 S CA . 50139 1 1092 . 1 . 1 266 266 SER CB C 13 62.556 . . 1 . . . . . 266 S CB . 50139 1 1093 . 1 . 1 266 266 SER N N 15 113.597 . . 1 . . . . . 266 S N . 50139 1 1094 . 1 . 1 267 267 ARG H H 1 7.211 . . 1 . . . . . 267 R H . 50139 1 1095 . 1 . 1 267 267 ARG C C 13 174.711 . . 1 . . . . . 267 R C . 50139 1 1096 . 1 . 1 267 267 ARG CA C 13 56.136 . . 1 . . . . . 267 R CA . 50139 1 1097 . 1 . 1 267 267 ARG CB C 13 29.799 . . 1 . . . . . 267 R CB . 50139 1 1098 . 1 . 1 267 267 ARG N N 15 122.978 . . 1 . . . . . 267 R N . 50139 1 1099 . 1 . 1 268 268 ALA H H 1 7.969 . . 1 . . . . . 268 A H . 50139 1 1100 . 1 . 1 268 268 ALA N N 15 131.112 . . 1 . . . . . 268 A N . 50139 1 stop_ save_