data_15199 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15199 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for the PDZ2 PDZ3 tandemdomain of PTP-BL ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-03-30 _Entry.Accession_date 2007-03-30 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 'Christan P.' Fetzer . . . 15199 2 Janelle Sauvageau . . . 15199 3 Gerd Kock . . . 15199 4 Carsten Berghaus . . . 15199 5 Jan-A. Bangert . . . 15199 6 Rolf Heumann . . . 15199 7 Kai Erdmann . . . 15199 8 Raphael Stoll . . . 15199 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . 'Ruhr-Universit t Bochum, Department of Neurobiochemistry (Biochemistry II)' . 15199 1 . 'Ruhr-Universit t Bochum, Department of Biomolecular NMR' . 15199 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15199 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 505 15199 '15N chemical shifts' 181 15199 '1H chemical shifts' 181 15199 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 4 . . 2009-08-31 2007-03-30 update BMRB 'complete entry citation' 15199 3 . . 2008-01-29 2007-03-30 update BMRB 'update the entry citation' 15199 2 . . 2007-08-17 2007-03-30 update author 'update the entry citation' 15199 1 . . 2007-06-06 2007-03-30 original author 'original release' 15199 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15199 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636852 _Citation.Full_citation . _Citation.Title 'Sequence-specific (1)H, (13)C, and (15)N backbone assignment of the 28 kDa PDZ2/PDZ3 tandem domain of the protein tyrosine phosphatase PTP-BL' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 151 _Citation.Page_last 153 _Citation.Year 2007 _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.Entry_ID _Citation_author.Citation_ID 1 Christian Fetzer . P. . 15199 1 2 Janelle Sauvageau . . . 15199 1 3 Gerd Kock . . . 15199 1 4 Carsten Berghaus . . . 15199 1 5 Jan-Amade Bangert . . . 15199 1 6 Markus Dicks . . . 15199 1 7 Rolf Heumann . . . 15199 1 8 Kai Erdmann . S. . 15199 1 9 Raphael Stoll . . . 15199 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Backbone resonance assignments' 15199 1 PDZ2 15199 1 PDZ3 15199 1 'PDZ tandem domain' 15199 1 PTP-BL 15199 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15199 _Assembly.ID 1 _Assembly.Name 'pdz23 tandemdomain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 tandemdomain 1 $PDZ2_PDZ3_Tandemdomain A . yes native no no . . . 15199 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PDZ2_PDZ3_Tandemdomain _Entity.Sf_category entity _Entity.Sf_framecode PDZ2_PDZ3_Tandemdomain _Entity.Entry_ID 15199 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PDZ2/PDZ3_Tandemdomain _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 ; GSPGSASPPKPGDTFEVELA KTDGSLGISVTGGVNTSVRH GGIYVKAIIPKGAAESDGRI HKGDRVLAVNGVSLEGATHK QAVETLRNTGQVVHLLLEKG QVPTSRERDPAGPQSPPPDQ DAQRQAPEKVAKQTPHVKDY SFVTEDNTFEVKLFKNSSGL GFSFSREDNLIPEQINGSIV RVKKLFPGQPAAESGKIDVG DVILKVNGAPLKGLSQQDVI SALRGTAPEVSLLLCRPAPG VLPEIDTPGNSS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; We used the numbers 1-252 to address the aminoacid residus. Actually our number "13" corresponds to aminoacid residue "1354" of PTP-BL. ID:Q64512 ; _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 252 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 26416.7 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'protein-protein interaction domain' 15199 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 . GLY . 15199 1 2 . SER . 15199 1 3 . PRO . 15199 1 4 . GLY . 15199 1 5 . SER . 15199 1 6 . ALA . 15199 1 7 . SER . 15199 1 8 . PRO . 15199 1 9 . PRO . 15199 1 10 . LYS . 15199 1 11 . PRO . 15199 1 12 . GLY . 15199 1 13 . ASP . 15199 1 14 . THR . 15199 1 15 . PHE . 15199 1 16 . GLU . 15199 1 17 . VAL . 15199 1 18 . GLU . 15199 1 19 . LEU . 15199 1 20 . ALA . 15199 1 21 . LYS . 15199 1 22 . THR . 15199 1 23 . ASP . 15199 1 24 . GLY . 15199 1 25 . SER . 15199 1 26 . LEU . 15199 1 27 . GLY . 15199 1 28 . ILE . 15199 1 29 . SER . 15199 1 30 . VAL . 15199 1 31 . THR . 15199 1 32 . GLY . 15199 1 33 . GLY . 15199 1 34 . VAL . 15199 1 35 . ASN . 15199 1 36 . THR . 15199 1 37 . SER . 15199 1 38 . VAL . 15199 1 39 . ARG . 15199 1 40 . HIS . 15199 1 41 . GLY . 15199 1 42 . GLY . 15199 1 43 . ILE . 15199 1 44 . TYR . 15199 1 45 . VAL . 15199 1 46 . LYS . 15199 1 47 . ALA . 15199 1 48 . ILE . 15199 1 49 . ILE . 15199 1 50 . PRO . 15199 1 51 . LYS . 15199 1 52 . GLY . 15199 1 53 . ALA . 15199 1 54 . ALA . 15199 1 55 . GLU . 15199 1 56 . SER . 15199 1 57 . ASP . 15199 1 58 . GLY . 15199 1 59 . ARG . 15199 1 60 . ILE . 15199 1 61 . HIS . 15199 1 62 . LYS . 15199 1 63 . GLY . 15199 1 64 . ASP . 15199 1 65 . ARG . 15199 1 66 . VAL . 15199 1 67 . LEU . 15199 1 68 . ALA . 15199 1 69 . VAL . 15199 1 70 . ASN . 15199 1 71 . GLY . 15199 1 72 . VAL . 15199 1 73 . SER . 15199 1 74 . LEU . 15199 1 75 . GLU . 15199 1 76 . GLY . 15199 1 77 . ALA . 15199 1 78 . THR . 15199 1 79 . HIS . 15199 1 80 . LYS . 15199 1 81 . GLN . 15199 1 82 . ALA . 15199 1 83 . VAL . 15199 1 84 . GLU . 15199 1 85 . THR . 15199 1 86 . LEU . 15199 1 87 . ARG . 15199 1 88 . ASN . 15199 1 89 . THR . 15199 1 90 . GLY . 15199 1 91 . GLN . 15199 1 92 . VAL . 15199 1 93 . VAL . 15199 1 94 . HIS . 15199 1 95 . LEU . 15199 1 96 . LEU . 15199 1 97 . LEU . 15199 1 98 . GLU . 15199 1 99 . LYS . 15199 1 100 . GLY . 15199 1 101 . GLN . 15199 1 102 . VAL . 15199 1 103 . PRO . 15199 1 104 . THR . 15199 1 105 . SER . 15199 1 106 . ARG . 15199 1 107 . GLU . 15199 1 108 . ARG . 15199 1 109 . ASP . 15199 1 110 . PRO . 15199 1 111 . ALA . 15199 1 112 . GLY . 15199 1 113 . PRO . 15199 1 114 . GLN . 15199 1 115 . SER . 15199 1 116 . PRO . 15199 1 117 . PRO . 15199 1 118 . PRO . 15199 1 119 . ASP . 15199 1 120 . GLN . 15199 1 121 . ASP . 15199 1 122 . ALA . 15199 1 123 . GLN . 15199 1 124 . ARG . 15199 1 125 . GLN . 15199 1 126 . ALA . 15199 1 127 . PRO . 15199 1 128 . GLU . 15199 1 129 . LYS . 15199 1 130 . VAL . 15199 1 131 . ALA . 15199 1 132 . LYS . 15199 1 133 . GLN . 15199 1 134 . THR . 15199 1 135 . PRO . 15199 1 136 . HIS . 15199 1 137 . VAL . 15199 1 138 . LYS . 15199 1 139 . ASP . 15199 1 140 . TYR . 15199 1 141 . SER . 15199 1 142 . PHE . 15199 1 143 . VAL . 15199 1 144 . THR . 15199 1 145 . GLU . 15199 1 146 . ASP . 15199 1 147 . ASN . 15199 1 148 . THR . 15199 1 149 . PHE . 15199 1 150 . GLU . 15199 1 151 . VAL . 15199 1 152 . LYS . 15199 1 153 . LEU . 15199 1 154 . PHE . 15199 1 155 . LYS . 15199 1 156 . ASN . 15199 1 157 . SER . 15199 1 158 . SER . 15199 1 159 . GLY . 15199 1 160 . LEU . 15199 1 161 . GLY . 15199 1 162 . PHE . 15199 1 163 . SER . 15199 1 164 . PHE . 15199 1 165 . SER . 15199 1 166 . ARG . 15199 1 167 . GLU . 15199 1 168 . ASP . 15199 1 169 . ASN . 15199 1 170 . LEU . 15199 1 171 . ILE . 15199 1 172 . PRO . 15199 1 173 . GLU . 15199 1 174 . GLN . 15199 1 175 . ILE . 15199 1 176 . ASN . 15199 1 177 . GLY . 15199 1 178 . SER . 15199 1 179 . ILE . 15199 1 180 . VAL . 15199 1 181 . ARG . 15199 1 182 . VAL . 15199 1 183 . LYS . 15199 1 184 . LYS . 15199 1 185 . LEU . 15199 1 186 . PHE . 15199 1 187 . PRO . 15199 1 188 . GLY . 15199 1 189 . GLN . 15199 1 190 . PRO . 15199 1 191 . ALA . 15199 1 192 . ALA . 15199 1 193 . GLU . 15199 1 194 . SER . 15199 1 195 . GLY . 15199 1 196 . LYS . 15199 1 197 . ILE . 15199 1 198 . ASP . 15199 1 199 . VAL . 15199 1 200 . GLY . 15199 1 201 . ASP . 15199 1 202 . VAL . 15199 1 203 . ILE . 15199 1 204 . LEU . 15199 1 205 . LYS . 15199 1 206 . VAL . 15199 1 207 . ASN . 15199 1 208 . GLY . 15199 1 209 . ALA . 15199 1 210 . PRO . 15199 1 211 . LEU . 15199 1 212 . LYS . 15199 1 213 . GLY . 15199 1 214 . LEU . 15199 1 215 . SER . 15199 1 216 . GLN . 15199 1 217 . GLN . 15199 1 218 . ASP . 15199 1 219 . VAL . 15199 1 220 . ILE . 15199 1 221 . SER . 15199 1 222 . ALA . 15199 1 223 . LEU . 15199 1 224 . ARG . 15199 1 225 . GLY . 15199 1 226 . THR . 15199 1 227 . ALA . 15199 1 228 . PRO . 15199 1 229 . GLU . 15199 1 230 . VAL . 15199 1 231 . SER . 15199 1 232 . LEU . 15199 1 233 . LEU . 15199 1 234 . LEU . 15199 1 235 . CYS . 15199 1 236 . ARG . 15199 1 237 . PRO . 15199 1 238 . ALA . 15199 1 239 . PRO . 15199 1 240 . GLY . 15199 1 241 . VAL . 15199 1 242 . LEU . 15199 1 243 . PRO . 15199 1 244 . GLU . 15199 1 245 . ILE . 15199 1 246 . ASP . 15199 1 247 . THR . 15199 1 248 . PRO . 15199 1 249 . GLY . 15199 1 250 . ASN . 15199 1 251 . SER . 15199 1 252 . SER . 15199 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 15199 1 . SER 2 2 15199 1 . PRO 3 3 15199 1 . GLY 4 4 15199 1 . SER 5 5 15199 1 . ALA 6 6 15199 1 . SER 7 7 15199 1 . PRO 8 8 15199 1 . PRO 9 9 15199 1 . LYS 10 10 15199 1 . PRO 11 11 15199 1 . GLY 12 12 15199 1 . ASP 13 13 15199 1 . THR 14 14 15199 1 . PHE 15 15 15199 1 . GLU 16 16 15199 1 . VAL 17 17 15199 1 . GLU 18 18 15199 1 . LEU 19 19 15199 1 . ALA 20 20 15199 1 . LYS 21 21 15199 1 . THR 22 22 15199 1 . ASP 23 23 15199 1 . GLY 24 24 15199 1 . SER 25 25 15199 1 . LEU 26 26 15199 1 . GLY 27 27 15199 1 . ILE 28 28 15199 1 . SER 29 29 15199 1 . VAL 30 30 15199 1 . THR 31 31 15199 1 . GLY 32 32 15199 1 . GLY 33 33 15199 1 . VAL 34 34 15199 1 . ASN 35 35 15199 1 . THR 36 36 15199 1 . SER 37 37 15199 1 . VAL 38 38 15199 1 . ARG 39 39 15199 1 . HIS 40 40 15199 1 . GLY 41 41 15199 1 . GLY 42 42 15199 1 . ILE 43 43 15199 1 . TYR 44 44 15199 1 . VAL 45 45 15199 1 . LYS 46 46 15199 1 . ALA 47 47 15199 1 . ILE 48 48 15199 1 . ILE 49 49 15199 1 . PRO 50 50 15199 1 . LYS 51 51 15199 1 . GLY 52 52 15199 1 . ALA 53 53 15199 1 . ALA 54 54 15199 1 . GLU 55 55 15199 1 . SER 56 56 15199 1 . ASP 57 57 15199 1 . GLY 58 58 15199 1 . ARG 59 59 15199 1 . ILE 60 60 15199 1 . HIS 61 61 15199 1 . LYS 62 62 15199 1 . GLY 63 63 15199 1 . ASP 64 64 15199 1 . ARG 65 65 15199 1 . VAL 66 66 15199 1 . LEU 67 67 15199 1 . ALA 68 68 15199 1 . VAL 69 69 15199 1 . ASN 70 70 15199 1 . GLY 71 71 15199 1 . VAL 72 72 15199 1 . SER 73 73 15199 1 . LEU 74 74 15199 1 . GLU 75 75 15199 1 . GLY 76 76 15199 1 . ALA 77 77 15199 1 . THR 78 78 15199 1 . HIS 79 79 15199 1 . LYS 80 80 15199 1 . GLN 81 81 15199 1 . ALA 82 82 15199 1 . VAL 83 83 15199 1 . GLU 84 84 15199 1 . THR 85 85 15199 1 . LEU 86 86 15199 1 . ARG 87 87 15199 1 . ASN 88 88 15199 1 . THR 89 89 15199 1 . GLY 90 90 15199 1 . GLN 91 91 15199 1 . VAL 92 92 15199 1 . VAL 93 93 15199 1 . HIS 94 94 15199 1 . LEU 95 95 15199 1 . LEU 96 96 15199 1 . LEU 97 97 15199 1 . GLU 98 98 15199 1 . LYS 99 99 15199 1 . GLY 100 100 15199 1 . GLN 101 101 15199 1 . VAL 102 102 15199 1 . PRO 103 103 15199 1 . THR 104 104 15199 1 . SER 105 105 15199 1 . ARG 106 106 15199 1 . GLU 107 107 15199 1 . ARG 108 108 15199 1 . ASP 109 109 15199 1 . PRO 110 110 15199 1 . ALA 111 111 15199 1 . GLY 112 112 15199 1 . PRO 113 113 15199 1 . GLN 114 114 15199 1 . SER 115 115 15199 1 . PRO 116 116 15199 1 . PRO 117 117 15199 1 . PRO 118 118 15199 1 . ASP 119 119 15199 1 . GLN 120 120 15199 1 . ASP 121 121 15199 1 . ALA 122 122 15199 1 . GLN 123 123 15199 1 . ARG 124 124 15199 1 . GLN 125 125 15199 1 . ALA 126 126 15199 1 . PRO 127 127 15199 1 . GLU 128 128 15199 1 . LYS 129 129 15199 1 . VAL 130 130 15199 1 . ALA 131 131 15199 1 . LYS 132 132 15199 1 . GLN 133 133 15199 1 . THR 134 134 15199 1 . PRO 135 135 15199 1 . HIS 136 136 15199 1 . VAL 137 137 15199 1 . LYS 138 138 15199 1 . ASP 139 139 15199 1 . TYR 140 140 15199 1 . SER 141 141 15199 1 . PHE 142 142 15199 1 . VAL 143 143 15199 1 . THR 144 144 15199 1 . GLU 145 145 15199 1 . ASP 146 146 15199 1 . ASN 147 147 15199 1 . THR 148 148 15199 1 . PHE 149 149 15199 1 . GLU 150 150 15199 1 . VAL 151 151 15199 1 . LYS 152 152 15199 1 . LEU 153 153 15199 1 . PHE 154 154 15199 1 . LYS 155 155 15199 1 . ASN 156 156 15199 1 . SER 157 157 15199 1 . SER 158 158 15199 1 . GLY 159 159 15199 1 . LEU 160 160 15199 1 . GLY 161 161 15199 1 . PHE 162 162 15199 1 . SER 163 163 15199 1 . PHE 164 164 15199 1 . SER 165 165 15199 1 . ARG 166 166 15199 1 . GLU 167 167 15199 1 . ASP 168 168 15199 1 . ASN 169 169 15199 1 . LEU 170 170 15199 1 . ILE 171 171 15199 1 . PRO 172 172 15199 1 . GLU 173 173 15199 1 . GLN 174 174 15199 1 . ILE 175 175 15199 1 . ASN 176 176 15199 1 . GLY 177 177 15199 1 . SER 178 178 15199 1 . ILE 179 179 15199 1 . VAL 180 180 15199 1 . ARG 181 181 15199 1 . VAL 182 182 15199 1 . LYS 183 183 15199 1 . LYS 184 184 15199 1 . LEU 185 185 15199 1 . PHE 186 186 15199 1 . PRO 187 187 15199 1 . GLY 188 188 15199 1 . GLN 189 189 15199 1 . PRO 190 190 15199 1 . ALA 191 191 15199 1 . ALA 192 192 15199 1 . GLU 193 193 15199 1 . SER 194 194 15199 1 . GLY 195 195 15199 1 . LYS 196 196 15199 1 . ILE 197 197 15199 1 . ASP 198 198 15199 1 . VAL 199 199 15199 1 . GLY 200 200 15199 1 . ASP 201 201 15199 1 . VAL 202 202 15199 1 . ILE 203 203 15199 1 . LEU 204 204 15199 1 . LYS 205 205 15199 1 . VAL 206 206 15199 1 . ASN 207 207 15199 1 . GLY 208 208 15199 1 . ALA 209 209 15199 1 . PRO 210 210 15199 1 . LEU 211 211 15199 1 . LYS 212 212 15199 1 . GLY 213 213 15199 1 . LEU 214 214 15199 1 . SER 215 215 15199 1 . GLN 216 216 15199 1 . GLN 217 217 15199 1 . ASP 218 218 15199 1 . VAL 219 219 15199 1 . ILE 220 220 15199 1 . SER 221 221 15199 1 . ALA 222 222 15199 1 . LEU 223 223 15199 1 . ARG 224 224 15199 1 . GLY 225 225 15199 1 . THR 226 226 15199 1 . ALA 227 227 15199 1 . PRO 228 228 15199 1 . GLU 229 229 15199 1 . VAL 230 230 15199 1 . SER 231 231 15199 1 . LEU 232 232 15199 1 . LEU 233 233 15199 1 . LEU 234 234 15199 1 . CYS 235 235 15199 1 . ARG 236 236 15199 1 . PRO 237 237 15199 1 . ALA 238 238 15199 1 . PRO 239 239 15199 1 . GLY 240 240 15199 1 . VAL 241 241 15199 1 . LEU 242 242 15199 1 . PRO 243 243 15199 1 . GLU 244 244 15199 1 . ILE 245 245 15199 1 . ASP 246 246 15199 1 . THR 247 247 15199 1 . PRO 248 248 15199 1 . GLY 249 249 15199 1 . ASN 250 250 15199 1 . SER 251 251 15199 1 . SER 252 252 15199 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15199 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PDZ2_PDZ3_Tandemdomain . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 15199 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 15199 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PDZ2_PDZ3_Tandemdomain . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pGEX . . . . . . 15199 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15199 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'PDZ2/PDZ3 Tandemdomain' '[U-100% 13C; U-100% 15N]' . . 1 $PDZ2_PDZ3_Tandemdomain . . 1 . . mM . . . . 15199 1 2 D2O 'natural abundance' . . . . . . 10 . . % . . . . 15199 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15199 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 15199 1 5 TSP 'natural abundance' . . . . . . 1 . . mM . . . . 15199 1 6 'potassium phosphate' 'natural abundance' . . . . . . 1.4 . . mM . . . . 15199 1 7 'sodium chloride' 'natural abundance' . . . . . . 137 . . mM . . . . 15199 1 8 'potassium chloride' 'natural abundance' . . . . . . 2.7 . . mM . . . . 15199 1 9 'sodium phosphat' 'natural abundance' . . . . . . 9 . . mM . . . . 15199 1 10 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 15199 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 15199 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.4 . pH 15199 1 pressure 1 . atm 15199 1 temperature 298 . K 15199 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15199 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15199 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15199 1 processing 15199 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15199 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15199 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 15199 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15199 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15199 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15199 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15199 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15199 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methyl carbons' . . . . ppm 0 internal direct 1 . . . . . . . . . 15199 1 H 1 TSP 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . . . . . 15199 1 N 15 TSP 'methyl protons' . . . . ppm 0 na indirect 0.101329118 . . . . . . . . . 15199 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15199 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.04 _Assigned_chem_shift_list.Chem_shift_15N_err 0.05 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15199 1 2 '3D HNCA' . . . 15199 1 3 '3D CBCA(CO)NH' . . . 15199 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 11 11 PRO C C 13 177.539 0.04 . 1 . . . . 11 PRO C . 15199 1 2 . 1 1 11 11 PRO CA C 13 64.556 0.04 . 1 . . . . 11 PRO CA . 15199 1 3 . 1 1 11 11 PRO CB C 13 32.006 0.04 . 1 . . . . 11 PRO CB . 15199 1 4 . 1 1 12 12 GLY H H 1 8.955 0.02 . 1 . . . . 12 GLY HN . 15199 1 5 . 1 1 12 12 GLY C C 13 174.101 0.04 . 1 . . . . 12 GLY C . 15199 1 6 . 1 1 12 12 GLY CA C 13 45.184 0.04 . 1 . . . . 12 GLY CA . 15199 1 7 . 1 1 12 12 GLY N N 15 113.864 0.05 . 1 . . . . 12 GLY N . 15199 1 8 . 1 1 13 13 ASP H H 1 8.571 0.02 . 1 . . . . 13 ASP HN . 15199 1 9 . 1 1 13 13 ASP C C 13 176.638 0.04 . 1 . . . . 13 ASP C . 15199 1 10 . 1 1 13 13 ASP CA C 13 54.613 0.04 . 1 . . . . 13 ASP CA . 15199 1 11 . 1 1 13 13 ASP CB C 13 41.558 0.04 . 1 . . . . 13 ASP CB . 15199 1 12 . 1 1 13 13 ASP N N 15 122.490 0.05 . 1 . . . . 13 ASP N . 15199 1 13 . 1 1 14 14 THR H H 1 8.481 0.02 . 1 . . . . 14 THR HN . 15199 1 14 . 1 1 14 14 THR C C 13 174.888 0.04 . 1 . . . . 14 THR C . 15199 1 15 . 1 1 14 14 THR CA C 13 60.710 0.04 . 1 . . . . 14 THR CA . 15199 1 16 . 1 1 14 14 THR CB C 13 70.541 0.04 . 1 . . . . 14 THR CB . 15199 1 17 . 1 1 14 14 THR N N 15 113.729 0.05 . 1 . . . . 14 THR N . 15199 1 18 . 1 1 15 15 PHE H H 1 9.366 0.02 . 1 . . . . 15 PHE HN . 15199 1 19 . 1 1 15 15 PHE C C 13 171.384 0.04 . 1 . . . . 15 PHE C . 15199 1 20 . 1 1 15 15 PHE CA C 13 56.152 0.04 . 1 . . . . 15 PHE CA . 15199 1 21 . 1 1 15 15 PHE CB C 13 40.455 0.04 . 1 . . . . 15 PHE CB . 15199 1 22 . 1 1 15 15 PHE N N 15 120.719 0.05 . 1 . . . . 15 PHE N . 15199 1 23 . 1 1 16 16 GLU H H 1 8.594 0.02 . 1 . . . . 16 GLU HN . 15199 1 24 . 1 1 16 16 GLU C C 13 176.105 0.04 . 1 . . . . 16 GLU C . 15199 1 25 . 1 1 16 16 GLU CA C 13 54.094 0.04 . 1 . . . . 16 GLU CA . 15199 1 26 . 1 1 16 16 GLU CB C 13 33.400 0.04 . 1 . . . . 16 GLU CB . 15199 1 27 . 1 1 16 16 GLU N N 15 119.622 0.05 . 1 . . . . 16 GLU N . 15199 1 28 . 1 1 17 17 VAL H H 1 8.632 0.02 . 1 . . . . 17 VAL HN . 15199 1 29 . 1 1 17 17 VAL C C 13 173.168 0.04 . 1 . . . . 17 VAL C . 15199 1 30 . 1 1 17 17 VAL CA C 13 61.155 0.04 . 1 . . . . 17 VAL CA . 15199 1 31 . 1 1 17 17 VAL CB C 13 36.681 0.04 . 1 . . . . 17 VAL CB . 15199 1 32 . 1 1 17 17 VAL N N 15 120.333 0.05 . 1 . . . . 17 VAL N . 15199 1 33 . 1 1 18 18 GLU H H 1 7.877 0.02 . 1 . . . . 18 GLU HN . 15199 1 34 . 1 1 18 18 GLU C C 13 174.673 0.04 . 1 . . . . 18 GLU C . 15199 1 35 . 1 1 18 18 GLU CA C 13 54.938 0.04 . 1 . . . . 18 GLU CA . 15199 1 36 . 1 1 18 18 GLU CB C 13 31.011 0.04 . 1 . . . . 18 GLU CB . 15199 1 37 . 1 1 18 18 GLU N N 15 126.632 0.05 . 1 . . . . 18 GLU N . 15199 1 38 . 1 1 19 19 LEU H H 1 8.923 0.02 . 1 . . . . 19 LEU HN . 15199 1 39 . 1 1 19 19 LEU C C 13 173.914 0.04 . 1 . . . . 19 LEU C . 15199 1 40 . 1 1 19 19 LEU CA C 13 53.241 0.04 . 1 . . . . 19 LEU CA . 15199 1 41 . 1 1 19 19 LEU CB C 13 46.049 0.04 . 1 . . . . 19 LEU CB . 15199 1 42 . 1 1 19 19 LEU N N 15 127.001 0.05 . 1 . . . . 19 LEU N . 15199 1 43 . 1 1 20 20 ALA H H 1 8.508 0.02 . 1 . . . . 20 ALA HN . 15199 1 44 . 1 1 20 20 ALA C C 13 177.394 0.04 . 1 . . . . 20 ALA C . 15199 1 45 . 1 1 20 20 ALA CA C 13 49.937 0.04 . 1 . . . . 20 ALA CA . 15199 1 46 . 1 1 20 20 ALA CB C 13 19.665 0.04 . 1 . . . . 20 ALA CB . 15199 1 47 . 1 1 20 20 ALA N N 15 127.077 0.05 . 1 . . . . 20 ALA N . 15199 1 48 . 1 1 21 21 LYS H H 1 8.520 0.02 . 1 . . . . 21 LYS HN . 15199 1 49 . 1 1 21 21 LYS C C 13 177.134 0.04 . 1 . . . . 21 LYS C . 15199 1 50 . 1 1 21 21 LYS CA C 13 57.811 0.04 . 1 . . . . 21 LYS CA . 15199 1 51 . 1 1 21 21 LYS CB C 13 34.615 0.04 . 1 . . . . 21 LYS CB . 15199 1 52 . 1 1 21 21 LYS N N 15 121.078 0.05 . 1 . . . . 21 LYS N . 15199 1 53 . 1 1 22 22 THR H H 1 8.128 0.02 . 1 . . . . 22 THR HN . 15199 1 54 . 1 1 22 22 THR CA C 13 61.265 0.04 . 1 . . . . 22 THR CA . 15199 1 55 . 1 1 22 22 THR N N 15 114.561 0.05 . 1 . . . . 22 THR N . 15199 1 56 . 1 1 23 23 ASP C C 13 176.482 0.04 . 1 . . . . 23 ASP C . 15199 1 57 . 1 1 23 23 ASP CA C 13 55.505 0.04 . 1 . . . . 23 ASP CA . 15199 1 58 . 1 1 23 23 ASP CB C 13 39.917 0.04 . 1 . . . . 23 ASP CB . 15199 1 59 . 1 1 24 24 GLY H H 1 8.772 0.02 . 1 . . . . 24 GLY HN . 15199 1 60 . 1 1 24 24 GLY C C 13 174.207 0.04 . 1 . . . . 24 GLY C . 15199 1 61 . 1 1 24 24 GLY CA C 13 45.920 0.04 . 1 . . . . 24 GLY CA . 15199 1 62 . 1 1 24 24 GLY N N 15 103.208 0.05 . 1 . . . . 24 GLY N . 15199 1 63 . 1 1 25 25 SER H H 1 8.056 0.02 . 1 . . . . 25 SER HN . 15199 1 64 . 1 1 25 25 SER CA C 13 56.310 0.04 . 1 . . . . 25 SER CA . 15199 1 65 . 1 1 25 25 SER N N 15 114.602 0.05 . 1 . . . . 25 SER N . 15199 1 66 . 1 1 26 26 LEU C C 13 177.101 0.04 . 1 . . . . 26 LEU C . 15199 1 67 . 1 1 26 26 LEU CA C 13 55.626 0.04 . 1 . . . . 26 LEU CA . 15199 1 68 . 1 1 26 26 LEU CB C 13 43.242 0.04 . 1 . . . . 26 LEU CB . 15199 1 69 . 1 1 27 27 GLY H H 1 8.931 0.02 . 1 . . . . 27 GLY HN . 15199 1 70 . 1 1 27 27 GLY C C 13 176.117 0.04 . 1 . . . . 27 GLY C . 15199 1 71 . 1 1 27 27 GLY CA C 13 46.649 0.04 . 1 . . . . 27 GLY CA . 15199 1 72 . 1 1 27 27 GLY N N 15 106.407 0.05 . 1 . . . . 27 GLY N . 15199 1 73 . 1 1 28 28 ILE H H 1 7.647 0.02 . 1 . . . . 28 ILE HN . 15199 1 74 . 1 1 28 28 ILE C C 13 174.028 0.04 . 1 . . . . 28 ILE C . 15199 1 75 . 1 1 28 28 ILE CA C 13 59.835 0.04 . 1 . . . . 28 ILE CA . 15199 1 76 . 1 1 28 28 ILE CB C 13 42.716 0.04 . 1 . . . . 28 ILE CB . 15199 1 77 . 1 1 28 28 ILE N N 15 115.529 0.05 . 1 . . . . 28 ILE N . 15199 1 78 . 1 1 29 29 SER H H 1 8.540 0.02 . 1 . . . . 29 SER HN . 15199 1 79 . 1 1 29 29 SER CA C 13 56.158 0.04 . 1 . . . . 29 SER CA . 15199 1 80 . 1 1 29 29 SER N N 15 119.779 0.05 . 1 . . . . 29 SER N . 15199 1 81 . 1 1 30 30 VAL C C 13 174.556 0.04 . 1 . . . . 30 VAL C . 15199 1 82 . 1 1 30 30 VAL CA C 13 59.481 0.04 . 1 . . . . 30 VAL CA . 15199 1 83 . 1 1 30 30 VAL CB C 13 35.098 0.04 . 1 . . . . 30 VAL CB . 15199 1 84 . 1 1 31 31 THR H H 1 9.318 0.02 . 1 . . . . 31 THR HN . 15199 1 85 . 1 1 31 31 THR C C 13 171.584 0.04 . 1 . . . . 31 THR C . 15199 1 86 . 1 1 31 31 THR CA C 13 59.627 0.04 . 1 . . . . 31 THR CA . 15199 1 87 . 1 1 31 31 THR CB C 13 70.194 0.04 . 1 . . . . 31 THR CB . 15199 1 88 . 1 1 31 31 THR N N 15 116.395 0.05 . 1 . . . . 31 THR N . 15199 1 89 . 1 1 32 32 GLY H H 1 8.412 0.02 . 1 . . . . 32 GLY HN . 15199 1 90 . 1 1 32 32 GLY CA C 13 44.664 0.04 . 1 . . . . 32 GLY CA . 15199 1 91 . 1 1 32 32 GLY N N 15 112.627 0.05 . 1 . . . . 32 GLY N . 15199 1 92 . 1 1 33 33 GLY C C 13 176.403 0.04 . 1 . . . . 33 GLY C . 15199 1 93 . 1 1 33 33 GLY CA C 13 43.731 0.04 . 1 . . . . 33 GLY CA . 15199 1 94 . 1 1 34 34 VAL H H 1 8.205 0.02 . 1 . . . . 34 VAL HN . 15199 1 95 . 1 1 34 34 VAL C C 13 175.736 0.04 . 1 . . . . 34 VAL C . 15199 1 96 . 1 1 34 34 VAL CA C 13 64.103 0.04 . 1 . . . . 34 VAL CA . 15199 1 97 . 1 1 34 34 VAL N N 15 117.524 0.05 . 1 . . . . 34 VAL N . 15199 1 98 . 1 1 35 35 ASN H H 1 8.870 0.02 . 1 . . . . 35 ASN HN . 15199 1 99 . 1 1 35 35 ASN C C 13 174.812 0.04 . 1 . . . . 35 ASN C . 15199 1 100 . 1 1 35 35 ASN CA C 13 53.615 0.04 . 1 . . . . 35 ASN CA . 15199 1 101 . 1 1 35 35 ASN CB C 13 37.810 0.04 . 1 . . . . 35 ASN CB . 15199 1 102 . 1 1 35 35 ASN N N 15 118.429 0.05 . 1 . . . . 35 ASN N . 15199 1 103 . 1 1 36 36 THR H H 1 7.914 0.02 . 1 . . . . 36 THR HN . 15199 1 104 . 1 1 36 36 THR CA C 13 61.666 0.04 . 1 . . . . 36 THR CA . 15199 1 105 . 1 1 36 36 THR N N 15 112.312 0.05 . 1 . . . . 36 THR N . 15199 1 106 . 1 1 40 40 HIS CA C 13 57.318 0.04 . 1 . . . . 40 HIS CA . 15199 1 107 . 1 1 41 41 GLY CA C 13 46.662 0.04 . 1 . . . . 41 GLY CA . 15199 1 108 . 1 1 42 42 GLY C C 13 170.382 0.04 . 1 . . . . 42 GLY C . 15199 1 109 . 1 1 42 42 GLY CA C 13 44.606 0.04 . 1 . . . . 42 GLY CA . 15199 1 110 . 1 1 43 43 ILE H H 1 8.450 0.02 . 1 . . . . 43 ILE HN . 15199 1 111 . 1 1 43 43 ILE C C 13 174.644 0.04 . 1 . . . . 43 ILE C . 15199 1 112 . 1 1 43 43 ILE CA C 13 57.033 0.04 . 1 . . . . 43 ILE CA . 15199 1 113 . 1 1 43 43 ILE N N 15 119.975 0.05 . 1 . . . . 43 ILE N . 15199 1 114 . 1 1 44 44 TYR H H 1 9.014 0.02 . 1 . . . . 44 TYR HN . 15199 1 115 . 1 1 44 44 TYR C C 13 176.014 0.04 . 1 . . . . 44 TYR C . 15199 1 116 . 1 1 44 44 TYR CA C 13 55.952 0.04 . 1 . . . . 44 TYR CA . 15199 1 117 . 1 1 44 44 TYR CB C 13 42.421 0.04 . 1 . . . . 44 TYR CB . 15199 1 118 . 1 1 44 44 TYR N N 15 123.864 0.05 . 1 . . . . 44 TYR N . 15199 1 119 . 1 1 45 45 VAL H H 1 9.323 0.02 . 1 . . . . 45 VAL HN . 15199 1 120 . 1 1 45 45 VAL C C 13 175.906 0.04 . 1 . . . . 45 VAL C . 15199 1 121 . 1 1 45 45 VAL CA C 13 64.453 0.04 . 1 . . . . 45 VAL CA . 15199 1 122 . 1 1 45 45 VAL CB C 13 31.478 0.04 . 1 . . . . 45 VAL CB . 15199 1 123 . 1 1 45 45 VAL N N 15 121.100 0.05 . 1 . . . . 45 VAL N . 15199 1 124 . 1 1 46 46 LYS H H 1 9.610 0.02 . 1 . . . . 46 LYS HN . 15199 1 125 . 1 1 46 46 LYS C C 13 174.726 0.04 . 1 . . . . 46 LYS C . 15199 1 126 . 1 1 46 46 LYS CA C 13 56.977 0.04 . 1 . . . . 46 LYS CA . 15199 1 127 . 1 1 46 46 LYS CB C 13 34.310 0.04 . 1 . . . . 46 LYS CB . 15199 1 128 . 1 1 46 46 LYS N N 15 135.172 0.05 . 1 . . . . 46 LYS N . 15199 1 129 . 1 1 47 47 ALA H H 1 7.567 0.02 . 1 . . . . 47 ALA HN . 15199 1 130 . 1 1 47 47 ALA C C 13 174.379 0.04 . 1 . . . . 47 ALA C . 15199 1 131 . 1 1 47 47 ALA CA C 13 51.561 0.04 . 1 . . . . 47 ALA CA . 15199 1 132 . 1 1 47 47 ALA N N 15 117.861 0.05 . 1 . . . . 47 ALA N . 15199 1 133 . 1 1 48 48 ILE H H 1 8.646 0.02 . 1 . . . . 48 ILE HN . 15199 1 134 . 1 1 48 48 ILE C C 13 176.077 0.04 . 1 . . . . 48 ILE C . 15199 1 135 . 1 1 48 48 ILE CA C 13 57.834 0.04 . 1 . . . . 48 ILE CA . 15199 1 136 . 1 1 48 48 ILE CB C 13 36.529 0.04 . 1 . . . . 48 ILE CB . 15199 1 137 . 1 1 48 48 ILE N N 15 121.663 0.05 . 1 . . . . 48 ILE N . 15199 1 138 . 1 1 49 49 ILE H H 1 7.838 0.02 . 1 . . . . 49 ILE HN . 15199 1 139 . 1 1 49 49 ILE CA C 13 58.748 0.04 . 1 . . . . 49 ILE CA . 15199 1 140 . 1 1 49 49 ILE N N 15 130.238 0.05 . 1 . . . . 49 ILE N . 15199 1 141 . 1 1 50 50 PRO C C 13 177.334 0.04 . 1 . . . . 50 PRO C . 15199 1 142 . 1 1 50 50 PRO CA C 13 64.351 0.04 . 1 . . . . 50 PRO CA . 15199 1 143 . 1 1 50 50 PRO CB C 13 32.087 0.04 . 1 . . . . 50 PRO CB . 15199 1 144 . 1 1 51 51 LYS H H 1 9.423 0.02 . 1 . . . . 51 LYS HN . 15199 1 145 . 1 1 51 51 LYS C C 13 176.316 0.04 . 1 . . . . 51 LYS C . 15199 1 146 . 1 1 51 51 LYS CA C 13 58.026 0.04 . 1 . . . . 51 LYS CA . 15199 1 147 . 1 1 51 51 LYS CB C 13 29.420 0.04 . 1 . . . . 51 LYS CB . 15199 1 148 . 1 1 51 51 LYS N N 15 118.357 0.05 . 1 . . . . 51 LYS N . 15199 1 149 . 1 1 52 52 GLY H H 1 7.877 0.02 . 1 . . . . 52 GLY HN . 15199 1 150 . 1 1 52 52 GLY C C 13 174.487 0.04 . 1 . . . . 52 GLY C . 15199 1 151 . 1 1 52 52 GLY CA C 13 44.784 0.04 . 1 . . . . 52 GLY CA . 15199 1 152 . 1 1 52 52 GLY N N 15 106.840 0.05 . 1 . . . . 52 GLY N . 15199 1 153 . 1 1 53 53 ALA H H 1 8.886 0.02 . 1 . . . . 53 ALA HN . 15199 1 154 . 1 1 53 53 ALA C C 13 178.329 0.04 . 1 . . . . 53 ALA C . 15199 1 155 . 1 1 53 53 ALA CA C 13 55.292 0.04 . 1 . . . . 53 ALA CA . 15199 1 156 . 1 1 53 53 ALA N N 15 121.777 0.05 . 1 . . . . 53 ALA N . 15199 1 157 . 1 1 54 54 ALA H H 1 7.830 0.02 . 1 . . . . 54 ALA HN . 15199 1 158 . 1 1 54 54 ALA C C 13 180.957 0.04 . 1 . . . . 54 ALA C . 15199 1 159 . 1 1 54 54 ALA CA C 13 54.891 0.04 . 1 . . . . 54 ALA CA . 15199 1 160 . 1 1 54 54 ALA CB C 13 18.523 0.04 . 1 . . . . 54 ALA CB . 15199 1 161 . 1 1 54 54 ALA N N 15 119.548 0.05 . 1 . . . . 54 ALA N . 15199 1 162 . 1 1 55 55 GLU H H 1 9.357 0.02 . 1 . . . . 55 GLU HN . 15199 1 163 . 1 1 55 55 GLU C C 13 178.002 0.04 . 1 . . . . 55 GLU C . 15199 1 164 . 1 1 55 55 GLU CA C 13 60.029 0.04 . 1 . . . . 55 GLU CA . 15199 1 165 . 1 1 55 55 GLU CB C 13 29.603 0.04 . 1 . . . . 55 GLU CB . 15199 1 166 . 1 1 55 55 GLU N N 15 125.098 0.05 . 1 . . . . 55 GLU N . 15199 1 167 . 1 1 56 56 SER H H 1 8.052 0.02 . 1 . . . . 56 SER HN . 15199 1 168 . 1 1 56 56 SER CA C 13 61.357 0.04 . 1 . . . . 56 SER CA . 15199 1 169 . 1 1 56 56 SER CB C 13 62.649 0.04 . 1 . . . . 56 SER CB . 15199 1 170 . 1 1 56 56 SER N N 15 113.999 0.05 . 1 . . . . 56 SER N . 15199 1 171 . 1 1 57 57 ASP H H 1 7.755 0.02 . 1 . . . . 57 ASP HN . 15199 1 172 . 1 1 57 57 ASP C C 13 177.694 0.04 . 1 . . . . 57 ASP C . 15199 1 173 . 1 1 57 57 ASP CA C 13 57.292 0.04 . 1 . . . . 57 ASP CA . 15199 1 174 . 1 1 57 57 ASP CB C 13 44.211 0.04 . 1 . . . . 57 ASP CB . 15199 1 175 . 1 1 57 57 ASP N N 15 120.897 0.05 . 1 . . . . 57 ASP N . 15199 1 176 . 1 1 58 58 GLY H H 1 7.507 0.02 . 1 . . . . 58 GLY HN . 15199 1 177 . 1 1 58 58 GLY C C 13 174.905 0.04 . 1 . . . . 58 GLY C . 15199 1 178 . 1 1 58 58 GLY CA C 13 46.432 0.04 . 1 . . . . 58 GLY CA . 15199 1 179 . 1 1 58 58 GLY N N 15 103.378 0.05 . 1 . . . . 58 GLY N . 15199 1 180 . 1 1 59 59 ARG H H 1 8.005 0.02 . 1 . . . . 59 ARG HN . 15199 1 181 . 1 1 59 59 ARG C C 13 175.841 0.04 . 1 . . . . 59 ARG C . 15199 1 182 . 1 1 59 59 ARG CA C 13 58.145 0.04 . 1 . . . . 59 ARG CA . 15199 1 183 . 1 1 59 59 ARG N N 15 118.460 0.05 . 1 . . . . 59 ARG N . 15199 1 184 . 1 1 60 60 ILE H H 1 8.433 0.02 . 1 . . . . 60 ILE HN . 15199 1 185 . 1 1 60 60 ILE C C 13 173.631 0.04 . 1 . . . . 60 ILE C . 15199 1 186 . 1 1 60 60 ILE CA C 13 61.581 0.04 . 1 . . . . 60 ILE CA . 15199 1 187 . 1 1 60 60 ILE N N 15 120.749 0.05 . 1 . . . . 60 ILE N . 15199 1 188 . 1 1 61 61 HIS H H 1 9.123 0.02 . 1 . . . . 61 HIS HN . 15199 1 189 . 1 1 61 61 HIS CA C 13 54.978 0.04 . 1 . . . . 61 HIS CA . 15199 1 190 . 1 1 61 61 HIS N N 15 124.194 0.05 . 1 . . . . 61 HIS N . 15199 1 191 . 1 1 62 62 LYS H H 1 8.725 0.02 . 1 . . . . 62 LYS HN . 15199 1 192 . 1 1 62 62 LYS C C 13 177.070 0.04 . 1 . . . . 62 LYS C . 15199 1 193 . 1 1 62 62 LYS CA C 13 58.554 0.04 . 1 . . . . 62 LYS CA . 15199 1 194 . 1 1 62 62 LYS CB C 13 32.458 0.04 . 1 . . . . 62 LYS CB . 15199 1 195 . 1 1 62 62 LYS N N 15 121.440 0.05 . 1 . . . . 62 LYS N . 15199 1 196 . 1 1 63 63 GLY H H 1 9.171 0.02 . 1 . . . . 63 GLY HN . 15199 1 197 . 1 1 63 63 GLY C C 13 174.314 0.04 . 1 . . . . 63 GLY C . 15199 1 198 . 1 1 63 63 GLY CA C 13 44.867 0.04 . 1 . . . . 63 GLY CA . 15199 1 199 . 1 1 63 63 GLY N N 15 115.124 0.05 . 1 . . . . 63 GLY N . 15199 1 200 . 1 1 64 64 ASP H H 1 8.083 0.02 . 1 . . . . 64 ASP HN . 15199 1 201 . 1 1 64 64 ASP C C 13 174.746 0.04 . 1 . . . . 64 ASP C . 15199 1 202 . 1 1 64 64 ASP CA C 13 56.028 0.04 . 1 . . . . 64 ASP CA . 15199 1 203 . 1 1 64 64 ASP CB C 13 41.028 0.04 . 1 . . . . 64 ASP CB . 15199 1 204 . 1 1 64 64 ASP N N 15 122.277 0.05 . 1 . . . . 64 ASP N . 15199 1 205 . 1 1 65 65 ARG H H 1 9.110 0.02 . 1 . . . . 65 ARG HN . 15199 1 206 . 1 1 65 65 ARG C C 13 175.650 0.04 . 1 . . . . 65 ARG C . 15199 1 207 . 1 1 65 65 ARG CA C 13 54.779 0.04 . 1 . . . . 65 ARG CA . 15199 1 208 . 1 1 65 65 ARG CB C 13 33.844 0.04 . 1 . . . . 65 ARG CB . 15199 1 209 . 1 1 65 65 ARG N N 15 123.772 0.05 . 1 . . . . 65 ARG N . 15199 1 210 . 1 1 66 66 VAL H H 1 8.994 0.02 . 1 . . . . 66 VAL HN . 15199 1 211 . 1 1 66 66 VAL C C 13 174.463 0.04 . 1 . . . . 66 VAL C . 15199 1 212 . 1 1 66 66 VAL CA C 13 62.350 0.04 . 1 . . . . 66 VAL CA . 15199 1 213 . 1 1 66 66 VAL CB C 13 30.844 0.04 . 1 . . . . 66 VAL CB . 15199 1 214 . 1 1 66 66 VAL N N 15 126.795 0.05 . 1 . . . . 66 VAL N . 15199 1 215 . 1 1 67 67 LEU H H 1 9.238 0.02 . 1 . . . . 67 LEU HN . 15199 1 216 . 1 1 67 67 LEU C C 13 180.958 0.04 . 1 . . . . 67 LEU C . 15199 1 217 . 1 1 67 67 LEU CA C 13 56.038 0.04 . 1 . . . . 67 LEU CA . 15199 1 218 . 1 1 67 67 LEU CB C 13 42.517 0.04 . 1 . . . . 67 LEU CB . 15199 1 219 . 1 1 67 67 LEU N N 15 127.699 0.05 . 1 . . . . 67 LEU N . 15199 1 220 . 1 1 68 68 ALA H H 1 7.879 0.02 . 1 . . . . 68 ALA HN . 15199 1 221 . 1 1 68 68 ALA C C 13 175.416 0.04 . 1 . . . . 68 ALA C . 15199 1 222 . 1 1 68 68 ALA CA C 13 52.271 0.04 . 1 . . . . 68 ALA CA . 15199 1 223 . 1 1 68 68 ALA CB C 13 22.191 0.04 . 1 . . . . 68 ALA CB . 15199 1 224 . 1 1 68 68 ALA N N 15 119.577 0.05 . 1 . . . . 68 ALA N . 15199 1 225 . 1 1 69 69 VAL H H 1 8.347 0.02 . 1 . . . . 69 VAL HN . 15199 1 226 . 1 1 69 69 VAL C C 13 175.438 0.04 . 1 . . . . 69 VAL C . 15199 1 227 . 1 1 69 69 VAL CA C 13 60.529 0.04 . 1 . . . . 69 VAL CA . 15199 1 228 . 1 1 69 69 VAL N N 15 120.923 0.05 . 1 . . . . 69 VAL N . 15199 1 229 . 1 1 70 70 ASN H H 1 10.572 0.02 . 1 . . . . 70 ASN HN . 15199 1 230 . 1 1 70 70 ASN C C 13 175.258 0.04 . 1 . . . . 70 ASN C . 15199 1 231 . 1 1 70 70 ASN CA C 13 54.202 0.04 . 1 . . . . 70 ASN CA . 15199 1 232 . 1 1 70 70 ASN CB C 13 36.871 0.04 . 1 . . . . 70 ASN CB . 15199 1 233 . 1 1 70 70 ASN N N 15 129.605 0.05 . 1 . . . . 70 ASN N . 15199 1 234 . 1 1 71 71 GLY H H 1 9.176 0.02 . 1 . . . . 71 GLY HN . 15199 1 235 . 1 1 71 71 GLY C C 13 173.915 0.04 . 1 . . . . 71 GLY C . 15199 1 236 . 1 1 71 71 GLY CA C 13 45.194 0.04 . 1 . . . . 71 GLY CA . 15199 1 237 . 1 1 71 71 GLY N N 15 103.982 0.05 . 1 . . . . 71 GLY N . 15199 1 238 . 1 1 72 72 VAL H H 1 8.115 0.02 . 1 . . . . 72 VAL HN . 15199 1 239 . 1 1 72 72 VAL CA C 13 62.265 0.04 . 1 . . . . 72 VAL CA . 15199 1 240 . 1 1 72 72 VAL N N 15 124.188 0.05 . 1 . . . . 72 VAL N . 15199 1 241 . 1 1 73 73 SER H H 1 8.712 0.02 . 1 . . . . 73 SER HN . 15199 1 242 . 1 1 73 73 SER C C 13 176.418 0.04 . 1 . . . . 73 SER C . 15199 1 243 . 1 1 73 73 SER CA C 13 58.458 0.04 . 1 . . . . 73 SER CA . 15199 1 244 . 1 1 73 73 SER CB C 13 63.781 0.04 . 1 . . . . 73 SER CB . 15199 1 245 . 1 1 73 73 SER N N 15 121.471 0.05 . 1 . . . . 73 SER N . 15199 1 246 . 1 1 74 74 LEU H H 1 8.283 0.02 . 1 . . . . 74 LEU HN . 15199 1 247 . 1 1 74 74 LEU C C 13 176.326 0.04 . 1 . . . . 74 LEU C . 15199 1 248 . 1 1 74 74 LEU CA C 13 53.865 0.04 . 1 . . . . 74 LEU CA . 15199 1 249 . 1 1 74 74 LEU N N 15 125.886 0.05 . 1 . . . . 74 LEU N . 15199 1 250 . 1 1 75 75 GLU H H 1 8.361 0.02 . 1 . . . . 75 GLU HN . 15199 1 251 . 1 1 75 75 GLU C C 13 177.851 0.04 . 1 . . . . 75 GLU C . 15199 1 252 . 1 1 75 75 GLU CA C 13 58.616 0.04 . 1 . . . . 75 GLU CA . 15199 1 253 . 1 1 75 75 GLU CB C 13 29.359 0.04 . 1 . . . . 75 GLU CB . 15199 1 254 . 1 1 75 75 GLU N N 15 124.053 0.05 . 1 . . . . 75 GLU N . 15199 1 255 . 1 1 76 76 GLY H H 1 9.058 0.02 . 1 . . . . 76 GLY HN . 15199 1 256 . 1 1 76 76 GLY C C 13 173.629 0.04 . 1 . . . . 76 GLY C . 15199 1 257 . 1 1 76 76 GLY CA C 13 45.412 0.04 . 1 . . . . 76 GLY CA . 15199 1 258 . 1 1 76 76 GLY N N 15 116.179 0.05 . 1 . . . . 76 GLY N . 15199 1 259 . 1 1 77 77 ALA H H 1 7.907 0.02 . 1 . . . . 77 ALA HN . 15199 1 260 . 1 1 77 77 ALA C C 13 179.829 0.04 . 1 . . . . 77 ALA C . 15199 1 261 . 1 1 77 77 ALA CA C 13 52.637 0.04 . 1 . . . . 77 ALA CA . 15199 1 262 . 1 1 77 77 ALA CB C 13 19.855 0.04 . 1 . . . . 77 ALA CB . 15199 1 263 . 1 1 77 77 ALA N N 15 122.814 0.05 . 1 . . . . 77 ALA N . 15199 1 264 . 1 1 78 78 THR H H 1 8.290 0.02 . 1 . . . . 78 THR HN . 15199 1 265 . 1 1 78 78 THR C C 13 174.746 0.04 . 1 . . . . 78 THR C . 15199 1 266 . 1 1 78 78 THR CA C 13 60.875 0.04 . 1 . . . . 78 THR CA . 15199 1 267 . 1 1 78 78 THR N N 15 111.894 0.05 . 1 . . . . 78 THR N . 15199 1 268 . 1 1 79 79 HIS H H 1 9.206 0.02 . 1 . . . . 79 HIS HN . 15199 1 269 . 1 1 79 79 HIS C C 13 176.784 0.04 . 1 . . . . 79 HIS C . 15199 1 270 . 1 1 79 79 HIS CA C 13 62.109 0.04 . 1 . . . . 79 HIS CA . 15199 1 271 . 1 1 79 79 HIS CB C 13 30.559 0.04 . 1 . . . . 79 HIS CB . 15199 1 272 . 1 1 79 79 HIS N N 15 122.365 0.05 . 1 . . . . 79 HIS N . 15199 1 273 . 1 1 80 80 LYS H H 1 8.558 0.02 . 1 . . . . 80 LYS HN . 15199 1 274 . 1 1 80 80 LYS C C 13 179.108 0.04 . 1 . . . . 80 LYS C . 15199 1 275 . 1 1 80 80 LYS CA C 13 59.721 0.04 . 1 . . . . 80 LYS CA . 15199 1 276 . 1 1 80 80 LYS CB C 13 32.848 0.04 . 1 . . . . 80 LYS CB . 15199 1 277 . 1 1 80 80 LYS N N 15 117.390 0.05 . 1 . . . . 80 LYS N . 15199 1 278 . 1 1 81 81 GLN H H 1 7.732 0.02 . 1 . . . . 81 GLN HN . 15199 1 279 . 1 1 81 81 GLN C C 13 179.514 0.04 . 1 . . . . 81 GLN C . 15199 1 280 . 1 1 81 81 GLN CA C 13 58.399 0.04 . 1 . . . . 81 GLN CA . 15199 1 281 . 1 1 81 81 GLN CB C 13 28.843 0.04 . 1 . . . . 81 GLN CB . 15199 1 282 . 1 1 81 81 GLN N N 15 118.254 0.05 . 1 . . . . 81 GLN N . 15199 1 283 . 1 1 82 82 ALA H H 1 8.578 0.02 . 1 . . . . 82 ALA HN . 15199 1 284 . 1 1 82 82 ALA C C 13 178.684 0.04 . 1 . . . . 82 ALA C . 15199 1 285 . 1 1 82 82 ALA CA C 13 55.648 0.04 . 1 . . . . 82 ALA CA . 15199 1 286 . 1 1 82 82 ALA CB C 13 19.462 0.04 . 1 . . . . 82 ALA CB . 15199 1 287 . 1 1 82 82 ALA N N 15 124.624 0.05 . 1 . . . . 82 ALA N . 15199 1 288 . 1 1 83 83 VAL H H 1 8.349 0.02 . 1 . . . . 83 VAL HN . 15199 1 289 . 1 1 83 83 VAL C C 13 179.185 0.04 . 1 . . . . 83 VAL C . 15199 1 290 . 1 1 83 83 VAL CA C 13 67.143 0.04 . 1 . . . . 83 VAL CA . 15199 1 291 . 1 1 83 83 VAL CB C 13 31.622 0.04 . 1 . . . . 83 VAL CB . 15199 1 292 . 1 1 83 83 VAL N N 15 117.998 0.05 . 1 . . . . 83 VAL N . 15199 1 293 . 1 1 84 84 GLU H H 1 8.178 0.02 . 1 . . . . 84 GLU HN . 15199 1 294 . 1 1 84 84 GLU C C 13 178.528 0.04 . 1 . . . . 84 GLU C . 15199 1 295 . 1 1 84 84 GLU CA C 13 59.523 0.04 . 1 . . . . 84 GLU CA . 15199 1 296 . 1 1 84 84 GLU CB C 13 29.131 0.04 . 1 . . . . 84 GLU CB . 15199 1 297 . 1 1 84 84 GLU N N 15 120.960 0.05 . 1 . . . . 84 GLU N . 15199 1 298 . 1 1 85 85 THR H H 1 8.285 0.02 . 1 . . . . 85 THR HN . 15199 1 299 . 1 1 85 85 THR C C 13 173.967 0.04 . 1 . . . . 85 THR C . 15199 1 300 . 1 1 85 85 THR CA C 13 67.169 0.04 . 1 . . . . 85 THR CA . 15199 1 301 . 1 1 85 85 THR N N 15 118.005 0.05 . 1 . . . . 85 THR N . 15199 1 302 . 1 1 86 86 LEU H H 1 7.978 0.02 . 1 . . . . 86 LEU HN . 15199 1 303 . 1 1 86 86 LEU N N 15 120.116 0.05 . 1 . . . . 86 LEU N . 15199 1 304 . 1 1 87 87 ARG C C 13 178.172 0.04 . 1 . . . . 87 ARG C . 15199 1 305 . 1 1 87 87 ARG CA C 13 58.718 0.04 . 1 . . . . 87 ARG CA . 15199 1 306 . 1 1 87 87 ARG CB C 13 30.888 0.04 . 1 . . . . 87 ARG CB . 15199 1 307 . 1 1 88 88 ASN H H 1 7.838 0.02 . 1 . . . . 88 ASN HN . 15199 1 308 . 1 1 88 88 ASN C C 13 174.966 0.04 . 1 . . . . 88 ASN C . 15199 1 309 . 1 1 88 88 ASN CA C 13 52.769 0.04 . 1 . . . . 88 ASN CA . 15199 1 310 . 1 1 88 88 ASN CB C 13 37.148 0.04 . 1 . . . . 88 ASN CB . 15199 1 311 . 1 1 88 88 ASN N N 15 120.351 0.05 . 1 . . . . 88 ASN N . 15199 1 312 . 1 1 89 89 THR H H 1 7.689 0.02 . 1 . . . . 89 THR HN . 15199 1 313 . 1 1 89 89 THR C C 13 175.191 0.04 . 1 . . . . 89 THR C . 15199 1 314 . 1 1 89 89 THR CA C 13 59.890 0.04 . 1 . . . . 89 THR CA . 15199 1 315 . 1 1 89 89 THR CB C 13 63.754 0.04 . 1 . . . . 89 THR CB . 15199 1 316 . 1 1 89 89 THR N N 15 110.344 0.05 . 1 . . . . 89 THR N . 15199 1 317 . 1 1 90 90 GLY H H 1 8.510 0.02 . 1 . . . . 90 GLY HN . 15199 1 318 . 1 1 90 90 GLY C C 13 173.421 0.04 . 1 . . . . 90 GLY C . 15199 1 319 . 1 1 90 90 GLY CA C 13 44.031 0.04 . 1 . . . . 90 GLY CA . 15199 1 320 . 1 1 90 90 GLY N N 15 110.269 0.05 . 1 . . . . 90 GLY N . 15199 1 321 . 1 1 91 91 GLN H H 1 8.251 0.02 . 1 . . . . 91 GLN HN . 15199 1 322 . 1 1 91 91 GLN C C 13 175.115 0.04 . 1 . . . . 91 GLN C . 15199 1 323 . 1 1 91 91 GLN CA C 13 58.481 0.04 . 1 . . . . 91 GLN CA . 15199 1 324 . 1 1 91 91 GLN CB C 13 29.068 0.04 . 1 . . . . 91 GLN CB . 15199 1 325 . 1 1 91 91 GLN N N 15 118.569 0.05 . 1 . . . . 91 GLN N . 15199 1 326 . 1 1 92 92 VAL H H 1 7.777 0.02 . 1 . . . . 92 VAL HN . 15199 1 327 . 1 1 92 92 VAL C C 13 175.832 0.04 . 1 . . . . 92 VAL C . 15199 1 328 . 1 1 92 92 VAL CA C 13 61.364 0.04 . 1 . . . . 92 VAL CA . 15199 1 329 . 1 1 92 92 VAL CB C 13 33.094 0.04 . 1 . . . . 92 VAL CB . 15199 1 330 . 1 1 92 92 VAL N N 15 116.660 0.05 . 1 . . . . 92 VAL N . 15199 1 331 . 1 1 93 93 VAL H H 1 9.083 0.02 . 1 . . . . 93 VAL HN . 15199 1 332 . 1 1 93 93 VAL C C 13 173.198 0.04 . 1 . . . . 93 VAL C . 15199 1 333 . 1 1 93 93 VAL CA C 13 61.198 0.04 . 1 . . . . 93 VAL CA . 15199 1 334 . 1 1 93 93 VAL CB C 13 34.935 0.04 . 1 . . . . 93 VAL CB . 15199 1 335 . 1 1 93 93 VAL N N 15 129.275 0.05 . 1 . . . . 93 VAL N . 15199 1 336 . 1 1 94 94 HIS H H 1 8.812 0.02 . 1 . . . . 94 HIS HN . 15199 1 337 . 1 1 94 94 HIS C C 13 174.416 0.04 . 1 . . . . 94 HIS C . 15199 1 338 . 1 1 94 94 HIS CA C 13 56.300 0.04 . 1 . . . . 94 HIS CA . 15199 1 339 . 1 1 94 94 HIS CB C 13 32.202 0.04 . 1 . . . . 94 HIS CB . 15199 1 340 . 1 1 94 94 HIS N N 15 127.422 0.05 . 1 . . . . 94 HIS N . 15199 1 341 . 1 1 95 95 LEU H H 1 9.029 0.02 . 1 . . . . 95 LEU HN . 15199 1 342 . 1 1 95 95 LEU C C 13 173.497 0.04 . 1 . . . . 95 LEU C . 15199 1 343 . 1 1 95 95 LEU CA C 13 53.651 0.04 . 1 . . . . 95 LEU CA . 15199 1 344 . 1 1 95 95 LEU CB C 13 45.349 0.04 . 1 . . . . 95 LEU CB . 15199 1 345 . 1 1 95 95 LEU N N 15 127.502 0.05 . 1 . . . . 95 LEU N . 15199 1 346 . 1 1 96 96 LEU H H 1 8.041 0.02 . 1 . . . . 96 LEU HN . 15199 1 347 . 1 1 96 96 LEU C C 13 175.111 0.04 . 1 . . . . 96 LEU C . 15199 1 348 . 1 1 96 96 LEU CA C 13 53.881 0.04 . 1 . . . . 96 LEU CA . 15199 1 349 . 1 1 96 96 LEU CB C 13 44.666 0.04 . 1 . . . . 96 LEU CB . 15199 1 350 . 1 1 96 96 LEU N N 15 124.473 0.05 . 1 . . . . 96 LEU N . 15199 1 351 . 1 1 97 97 LEU H H 1 8.942 0.02 . 1 . . . . 97 LEU HN . 15199 1 352 . 1 1 97 97 LEU C C 13 174.051 0.04 . 1 . . . . 97 LEU C . 15199 1 353 . 1 1 97 97 LEU CA C 13 54.066 0.04 . 1 . . . . 97 LEU CA . 15199 1 354 . 1 1 97 97 LEU CB C 13 45.951 0.04 . 1 . . . . 97 LEU CB . 15199 1 355 . 1 1 97 97 LEU N N 15 128.206 0.05 . 1 . . . . 97 LEU N . 15199 1 356 . 1 1 98 98 GLU H H 1 8.985 0.02 . 1 . . . . 98 GLU HN . 15199 1 357 . 1 1 98 98 GLU C C 13 176.357 0.04 . 1 . . . . 98 GLU C . 15199 1 358 . 1 1 98 98 GLU CA C 13 54.109 0.04 . 1 . . . . 98 GLU CA . 15199 1 359 . 1 1 98 98 GLU CB C 13 34.373 0.04 . 1 . . . . 98 GLU CB . 15199 1 360 . 1 1 98 98 GLU N N 15 119.675 0.05 . 1 . . . . 98 GLU N . 15199 1 361 . 1 1 99 99 LYS H H 1 9.217 0.02 . 1 . . . . 99 LYS HN . 15199 1 362 . 1 1 99 99 LYS C C 13 178.024 0.04 . 1 . . . . 99 LYS C . 15199 1 363 . 1 1 99 99 LYS CA C 13 56.196 0.04 . 1 . . . . 99 LYS CA . 15199 1 364 . 1 1 99 99 LYS CB C 13 31.772 0.04 . 1 . . . . 99 LYS CB . 15199 1 365 . 1 1 99 99 LYS N N 15 128.994 0.05 . 1 . . . . 99 LYS N . 15199 1 366 . 1 1 100 100 GLY H H 1 9.724 0.02 . 1 . . . . 100 GLY HN . 15199 1 367 . 1 1 100 100 GLY C C 13 172.912 0.04 . 1 . . . . 100 GLY C . 15199 1 368 . 1 1 100 100 GLY CA C 13 45.364 0.04 . 1 . . . . 100 GLY CA . 15199 1 369 . 1 1 100 100 GLY N N 15 118.080 0.05 . 1 . . . . 100 GLY N . 15199 1 370 . 1 1 101 101 GLN H H 1 8.224 0.02 . 1 . . . . 101 GLN HN . 15199 1 371 . 1 1 101 101 GLN C C 13 175.980 0.04 . 1 . . . . 101 GLN C . 15199 1 372 . 1 1 101 101 GLN CA C 13 55.293 0.04 . 1 . . . . 101 GLN CA . 15199 1 373 . 1 1 101 101 GLN CB C 13 30.305 0.04 . 1 . . . . 101 GLN CB . 15199 1 374 . 1 1 101 101 GLN N N 15 117.949 0.05 . 1 . . . . 101 GLN N . 15199 1 375 . 1 1 102 102 VAL H H 1 8.382 0.02 . 1 . . . . 102 VAL HN . 15199 1 376 . 1 1 102 102 VAL CA C 13 60.313 0.04 . 1 . . . . 102 VAL CA . 15199 1 377 . 1 1 102 102 VAL N N 15 123.908 0.05 . 1 . . . . 102 VAL N . 15199 1 378 . 1 1 103 103 PRO CA C 13 63.046 0.04 . 1 . . . . 103 PRO CA . 15199 1 379 . 1 1 103 103 PRO CB C 13 32.323 0.04 . 1 . . . . 103 PRO CB . 15199 1 380 . 1 1 110 110 PRO C C 13 176.705 0.04 . 1 . . . . 110 PRO C . 15199 1 381 . 1 1 110 110 PRO CA C 13 63.612 0.04 . 1 . . . . 110 PRO CA . 15199 1 382 . 1 1 110 110 PRO CB C 13 32.211 0.04 . 1 . . . . 110 PRO CB . 15199 1 383 . 1 1 111 111 ALA H H 1 8.460 0.02 . 1 . . . . 111 ALA HN . 15199 1 384 . 1 1 111 111 ALA C C 13 177.948 0.04 . 1 . . . . 111 ALA C . 15199 1 385 . 1 1 111 111 ALA CA C 13 52.341 0.04 . 1 . . . . 111 ALA CA . 15199 1 386 . 1 1 111 111 ALA CB C 13 19.602 0.04 . 1 . . . . 111 ALA CB . 15199 1 387 . 1 1 111 111 ALA N N 15 123.923 0.05 . 1 . . . . 111 ALA N . 15199 1 388 . 1 1 112 112 GLY H H 1 8.046 0.02 . 1 . . . . 112 GLY HN . 15199 1 389 . 1 1 112 112 GLY CA C 13 44.606 0.04 . 1 . . . . 112 GLY CA . 15199 1 390 . 1 1 112 112 GLY N N 15 108.385 0.05 . 1 . . . . 112 GLY N . 15199 1 391 . 1 1 118 118 PRO C C 13 176.730 0.04 . 1 . . . . 118 PRO C . 15199 1 392 . 1 1 118 118 PRO CA C 13 63.230 0.04 . 1 . . . . 118 PRO CA . 15199 1 393 . 1 1 119 119 ASP H H 1 8.417 0.02 . 1 . . . . 119 ASP HN . 15199 1 394 . 1 1 119 119 ASP C C 13 176.568 0.04 . 1 . . . . 119 ASP C . 15199 1 395 . 1 1 119 119 ASP CA C 13 54.342 0.04 . 1 . . . . 119 ASP CA . 15199 1 396 . 1 1 119 119 ASP N N 15 120.397 0.05 . 1 . . . . 119 ASP N . 15199 1 397 . 1 1 120 120 GLN H H 1 8.351 0.02 . 1 . . . . 120 GLN HN . 15199 1 398 . 1 1 120 120 GLN C C 13 176.071 0.04 . 1 . . . . 120 GLN C . 15199 1 399 . 1 1 120 120 GLN CA C 13 56.502 0.04 . 1 . . . . 120 GLN CA . 15199 1 400 . 1 1 120 120 GLN CB C 13 29.418 0.04 . 1 . . . . 120 GLN CB . 15199 1 401 . 1 1 120 120 GLN N N 15 120.889 0.05 . 1 . . . . 120 GLN N . 15199 1 402 . 1 1 121 121 ASP H H 1 8.386 0.02 . 1 . . . . 121 ASP HN . 15199 1 403 . 1 1 121 121 ASP C C 13 176.472 0.04 . 1 . . . . 121 ASP C . 15199 1 404 . 1 1 121 121 ASP CA C 13 54.866 0.04 . 1 . . . . 121 ASP CA . 15199 1 405 . 1 1 121 121 ASP CB C 13 41.157 0.04 . 1 . . . . 121 ASP CB . 15199 1 406 . 1 1 121 121 ASP N N 15 121.658 0.05 . 1 . . . . 121 ASP N . 15199 1 407 . 1 1 122 122 ALA H H 1 8.182 0.02 . 1 . . . . 122 ALA HN . 15199 1 408 . 1 1 122 122 ALA C C 13 178.170 0.04 . 1 . . . . 122 ALA C . 15199 1 409 . 1 1 122 122 ALA CA C 13 53.209 0.04 . 1 . . . . 122 ALA CA . 15199 1 410 . 1 1 122 122 ALA CB C 13 19.155 0.04 . 1 . . . . 122 ALA CB . 15199 1 411 . 1 1 122 122 ALA N N 15 124.647 0.05 . 1 . . . . 122 ALA N . 15199 1 412 . 1 1 123 123 GLN H H 1 8.292 0.02 . 1 . . . . 123 GLN HN . 15199 1 413 . 1 1 123 123 GLN CA C 13 56.138 0.04 . 1 . . . . 123 GLN CA . 15199 1 414 . 1 1 123 123 GLN N N 15 118.554 0.05 . 1 . . . . 123 GLN N . 15199 1 415 . 1 1 129 129 LYS C C 13 176.439 0.04 . 1 . . . . 129 LYS C . 15199 1 416 . 1 1 129 129 LYS CA C 13 56.273 0.04 . 1 . . . . 129 LYS CA . 15199 1 417 . 1 1 130 130 VAL H H 1 8.063 0.02 . 1 . . . . 130 VAL HN . 15199 1 418 . 1 1 130 130 VAL C C 13 175.804 0.04 . 1 . . . . 130 VAL C . 15199 1 419 . 1 1 130 130 VAL CA C 13 62.266 0.04 . 1 . . . . 130 VAL CA . 15199 1 420 . 1 1 130 130 VAL N N 15 121.803 0.05 . 1 . . . . 130 VAL N . 15199 1 421 . 1 1 131 131 ALA H H 1 8.411 0.02 . 1 . . . . 131 ALA HN . 15199 1 422 . 1 1 131 131 ALA C C 13 177.467 0.04 . 1 . . . . 131 ALA C . 15199 1 423 . 1 1 131 131 ALA CA C 13 52.381 0.04 . 1 . . . . 131 ALA CA . 15199 1 424 . 1 1 131 131 ALA N N 15 128.524 0.05 . 1 . . . . 131 ALA N . 15199 1 425 . 1 1 132 132 LYS H H 1 8.334 0.02 . 1 . . . . 132 LYS HN . 15199 1 426 . 1 1 132 132 LYS CA C 13 56.489 0.04 . 1 . . . . 132 LYS CA . 15199 1 427 . 1 1 132 132 LYS N N 15 117.515 0.05 . 1 . . . . 132 LYS N . 15199 1 428 . 1 1 141 141 SER CA C 13 61.054 0.04 . 1 . . . . 141 SER CA . 15199 1 429 . 1 1 142 142 PHE H H 1 6.334 0.02 . 1 . . . . 142 PHE HN . 15199 1 430 . 1 1 142 142 PHE C C 13 175.183 0.04 . 1 . . . . 142 PHE C . 15199 1 431 . 1 1 142 142 PHE CA C 13 55.531 0.04 . 1 . . . . 142 PHE CA . 15199 1 432 . 1 1 142 142 PHE CB C 13 38.502 0.04 . 1 . . . . 142 PHE CB . 15199 1 433 . 1 1 142 142 PHE N N 15 112.892 0.05 . 1 . . . . 142 PHE N . 15199 1 434 . 1 1 143 143 VAL H H 1 7.175 0.02 . 1 . . . . 143 VAL HN . 15199 1 435 . 1 1 143 143 VAL C C 13 175.156 0.04 . 1 . . . . 143 VAL C . 15199 1 436 . 1 1 143 143 VAL CA C 13 63.759 0.04 . 1 . . . . 143 VAL CA . 15199 1 437 . 1 1 143 143 VAL N N 15 126.862 0.05 . 1 . . . . 143 VAL N . 15199 1 438 . 1 1 144 144 THR H H 1 9.323 0.02 . 1 . . . . 144 THR HN . 15199 1 439 . 1 1 144 144 THR C C 13 174.715 0.04 . 1 . . . . 144 THR C . 15199 1 440 . 1 1 144 144 THR CA C 13 59.283 0.04 . 1 . . . . 144 THR CA . 15199 1 441 . 1 1 144 144 THR N N 15 121.072 0.05 . 1 . . . . 144 THR N . 15199 1 442 . 1 1 145 145 GLU H H 1 8.919 0.02 . 1 . . . . 145 GLU HN . 15199 1 443 . 1 1 145 145 GLU C C 13 177.531 0.04 . 1 . . . . 145 GLU C . 15199 1 444 . 1 1 145 145 GLU CA C 13 58.780 0.04 . 1 . . . . 145 GLU CA . 15199 1 445 . 1 1 145 145 GLU CB C 13 29.416 0.04 . 1 . . . . 145 GLU CB . 15199 1 446 . 1 1 145 145 GLU N N 15 118.405 0.05 . 1 . . . . 145 GLU N . 15199 1 447 . 1 1 146 146 ASP H H 1 8.056 0.02 . 1 . . . . 146 ASP HN . 15199 1 448 . 1 1 146 146 ASP C C 13 177.024 0.04 . 1 . . . . 146 ASP C . 15199 1 449 . 1 1 146 146 ASP CA C 13 54.697 0.04 . 1 . . . . 146 ASP CA . 15199 1 450 . 1 1 146 146 ASP CB C 13 42.270 0.04 . 1 . . . . 146 ASP CB . 15199 1 451 . 1 1 146 146 ASP N N 15 114.602 0.05 . 1 . . . . 146 ASP N . 15199 1 452 . 1 1 147 147 ASN H H 1 7.651 0.02 . 1 . . . . 147 ASN HN . 15199 1 453 . 1 1 147 147 ASN C C 13 174.888 0.04 . 1 . . . . 147 ASN C . 15199 1 454 . 1 1 147 147 ASN CA C 13 51.701 0.04 . 1 . . . . 147 ASN CA . 15199 1 455 . 1 1 147 147 ASN CB C 13 38.342 0.04 . 1 . . . . 147 ASN CB . 15199 1 456 . 1 1 147 147 ASN N N 15 118.241 0.05 . 1 . . . . 147 ASN N . 15199 1 457 . 1 1 148 148 THR H H 1 7.370 0.02 . 1 . . . . 148 THR HN . 15199 1 458 . 1 1 148 148 THR C C 13 174.709 0.04 . 1 . . . . 148 THR C . 15199 1 459 . 1 1 148 148 THR CA C 13 60.721 0.04 . 1 . . . . 148 THR CA . 15199 1 460 . 1 1 148 148 THR N N 15 111.665 0.05 . 1 . . . . 148 THR N . 15199 1 461 . 1 1 149 149 PHE H H 1 8.831 0.02 . 1 . . . . 149 PHE HN . 15199 1 462 . 1 1 149 149 PHE C C 13 171.626 0.04 . 1 . . . . 149 PHE C . 15199 1 463 . 1 1 149 149 PHE CA C 13 56.124 0.04 . 1 . . . . 149 PHE CA . 15199 1 464 . 1 1 149 149 PHE CB C 13 40.021 0.04 . 1 . . . . 149 PHE CB . 15199 1 465 . 1 1 149 149 PHE N N 15 121.374 0.05 . 1 . . . . 149 PHE N . 15199 1 466 . 1 1 150 150 GLU H H 1 8.763 0.02 . 1 . . . . 150 GLU HN . 15199 1 467 . 1 1 150 150 GLU C C 13 176.339 0.04 . 1 . . . . 150 GLU C . 15199 1 468 . 1 1 150 150 GLU CA C 13 54.308 0.04 . 1 . . . . 150 GLU CA . 15199 1 469 . 1 1 150 150 GLU CB C 13 33.001 0.04 . 1 . . . . 150 GLU CB . 15199 1 470 . 1 1 150 150 GLU N N 15 122.411 0.05 . 1 . . . . 150 GLU N . 15199 1 471 . 1 1 151 151 VAL H H 1 9.069 0.02 . 1 . . . . 151 VAL HN . 15199 1 472 . 1 1 151 151 VAL C C 13 173.436 0.04 . 1 . . . . 151 VAL C . 15199 1 473 . 1 1 151 151 VAL CA C 13 61.480 0.04 . 1 . . . . 151 VAL CA . 15199 1 474 . 1 1 151 151 VAL CB C 13 36.062 0.04 . 1 . . . . 151 VAL CB . 15199 1 475 . 1 1 151 151 VAL N N 15 125.107 0.05 . 1 . . . . 151 VAL N . 15199 1 476 . 1 1 152 152 LYS H H 1 8.629 0.02 . 1 . . . . 152 LYS HN . 15199 1 477 . 1 1 152 152 LYS C C 13 175.440 0.04 . 1 . . . . 152 LYS C . 15199 1 478 . 1 1 152 152 LYS CA C 13 55.056 0.04 . 1 . . . . 152 LYS CA . 15199 1 479 . 1 1 152 152 LYS CB C 13 33.481 0.04 . 1 . . . . 152 LYS CB . 15199 1 480 . 1 1 152 152 LYS N N 15 128.034 0.05 . 1 . . . . 152 LYS N . 15199 1 481 . 1 1 153 153 LEU H H 1 8.895 0.02 . 1 . . . . 153 LEU HN . 15199 1 482 . 1 1 153 153 LEU C C 13 174.737 0.04 . 1 . . . . 153 LEU C . 15199 1 483 . 1 1 153 153 LEU CA C 13 52.738 0.04 . 1 . . . . 153 LEU CA . 15199 1 484 . 1 1 153 153 LEU CB C 13 46.485 0.04 . 1 . . . . 153 LEU CB . 15199 1 485 . 1 1 153 153 LEU N N 15 124.143 0.05 . 1 . . . . 153 LEU N . 15199 1 486 . 1 1 154 154 PHE H H 1 8.654 0.02 . 1 . . . . 154 PHE HN . 15199 1 487 . 1 1 154 154 PHE C C 13 175.837 0.04 . 1 . . . . 154 PHE C . 15199 1 488 . 1 1 154 154 PHE CA C 13 56.863 0.04 . 1 . . . . 154 PHE CA . 15199 1 489 . 1 1 154 154 PHE N N 15 121.827 0.05 . 1 . . . . 154 PHE N . 15199 1 490 . 1 1 155 155 LYS CA C 13 56.492 0.04 . 1 . . . . 155 LYS CA . 15199 1 491 . 1 1 158 158 SER C C 13 174.079 0.04 . 1 . . . . 158 SER C . 15199 1 492 . 1 1 158 158 SER CA C 13 59.206 0.04 . 1 . . . . 158 SER CA . 15199 1 493 . 1 1 158 158 SER CB C 13 63.925 0.04 . 1 . . . . 158 SER CB . 15199 1 494 . 1 1 159 159 GLY H H 1 8.085 0.02 . 1 . . . . 159 GLY HN . 15199 1 495 . 1 1 159 159 GLY CA C 13 45.136 0.04 . 1 . . . . 159 GLY CA . 15199 1 496 . 1 1 159 159 GLY N N 15 111.159 0.05 . 1 . . . . 159 GLY N . 15199 1 497 . 1 1 160 160 LEU C C 13 177.785 0.04 . 1 . . . . 160 LEU C . 15199 1 498 . 1 1 160 160 LEU CA C 13 55.459 0.04 . 1 . . . . 160 LEU CA . 15199 1 499 . 1 1 160 160 LEU CB C 13 43.863 0.04 . 1 . . . . 160 LEU CB . 15199 1 500 . 1 1 161 161 GLY H H 1 8.811 0.02 . 1 . . . . 161 GLY HN . 15199 1 501 . 1 1 161 161 GLY C C 13 175.129 0.04 . 1 . . . . 161 GLY C . 15199 1 502 . 1 1 161 161 GLY CA C 13 46.413 0.04 . 1 . . . . 161 GLY CA . 15199 1 503 . 1 1 161 161 GLY N N 15 105.398 0.05 . 1 . . . . 161 GLY N . 15199 1 504 . 1 1 162 162 PHE H H 1 7.481 0.02 . 1 . . . . 162 PHE HN . 15199 1 505 . 1 1 162 162 PHE C C 13 173.185 0.04 . 1 . . . . 162 PHE C . 15199 1 506 . 1 1 162 162 PHE CA C 13 55.854 0.04 . 1 . . . . 162 PHE CA . 15199 1 507 . 1 1 162 162 PHE CB C 13 41.569 0.04 . 1 . . . . 162 PHE CB . 15199 1 508 . 1 1 162 162 PHE N N 15 117.008 0.05 . 1 . . . . 162 PHE N . 15199 1 509 . 1 1 163 163 SER H H 1 8.805 0.02 . 1 . . . . 163 SER HN . 15199 1 510 . 1 1 163 163 SER C C 13 174.628 0.04 . 1 . . . . 163 SER C . 15199 1 511 . 1 1 163 163 SER CA C 13 55.608 0.04 . 1 . . . . 163 SER CA . 15199 1 512 . 1 1 163 163 SER CB C 13 65.488 0.04 . 1 . . . . 163 SER CB . 15199 1 513 . 1 1 163 163 SER N N 15 116.350 0.05 . 1 . . . . 163 SER N . 15199 1 514 . 1 1 164 164 PHE H H 1 8.631 0.02 . 1 . . . . 164 PHE HN . 15199 1 515 . 1 1 164 164 PHE C C 13 173.169 0.04 . 1 . . . . 164 PHE C . 15199 1 516 . 1 1 164 164 PHE CA C 13 55.393 0.04 . 1 . . . . 164 PHE CA . 15199 1 517 . 1 1 164 164 PHE CB C 13 42.998 0.04 . 1 . . . . 164 PHE CB . 15199 1 518 . 1 1 164 164 PHE N N 15 120.305 0.05 . 1 . . . . 164 PHE N . 15199 1 519 . 1 1 165 165 SER H H 1 9.523 0.02 . 1 . . . . 165 SER HN . 15199 1 520 . 1 1 165 165 SER CA C 13 56.394 0.04 . 1 . . . . 165 SER CA . 15199 1 521 . 1 1 165 165 SER N N 15 116.853 0.05 . 1 . . . . 165 SER N . 15199 1 522 . 1 1 166 166 ARG H H 1 9.098 0.02 . 1 . . . . 166 ARG HN . 15199 1 523 . 1 1 166 166 ARG N N 15 126.921 0.05 . 1 . . . . 166 ARG N . 15199 1 524 . 1 1 167 167 GLU H H 1 8.121 0.02 . 1 . . . . 167 GLU HN . 15199 1 525 . 1 1 167 167 GLU C C 13 175.547 0.04 . 1 . . . . 167 GLU C . 15199 1 526 . 1 1 167 167 GLU CA C 13 55.246 0.04 . 1 . . . . 167 GLU CA . 15199 1 527 . 1 1 167 167 GLU CB C 13 33.481 0.04 . 1 . . . . 167 GLU CB . 15199 1 528 . 1 1 167 167 GLU N N 15 121.716 0.05 . 1 . . . . 167 GLU N . 15199 1 529 . 1 1 168 168 ASP H H 1 8.916 0.02 . 1 . . . . 168 ASP HN . 15199 1 530 . 1 1 168 168 ASP C C 13 175.458 0.04 . 1 . . . . 168 ASP C . 15199 1 531 . 1 1 168 168 ASP CA C 13 53.821 0.04 . 1 . . . . 168 ASP CA . 15199 1 532 . 1 1 168 168 ASP CB C 13 42.698 0.04 . 1 . . . . 168 ASP CB . 15199 1 533 . 1 1 168 168 ASP N N 15 124.126 0.05 . 1 . . . . 168 ASP N . 15199 1 534 . 1 1 169 169 ASN H H 1 8.714 0.02 . 1 . . . . 169 ASN HN . 15199 1 535 . 1 1 169 169 ASN C C 13 175.061 0.04 . 1 . . . . 169 ASN C . 15199 1 536 . 1 1 169 169 ASN CA C 13 53.784 0.04 . 1 . . . . 169 ASN CA . 15199 1 537 . 1 1 169 169 ASN CB C 13 38.365 0.04 . 1 . . . . 169 ASN CB . 15199 1 538 . 1 1 169 169 ASN N N 15 117.143 0.05 . 1 . . . . 169 ASN N . 15199 1 539 . 1 1 170 170 LEU H H 1 8.591 0.02 . 1 . . . . 170 LEU HN . 15199 1 540 . 1 1 170 170 LEU C C 13 177.119 0.04 . 1 . . . . 170 LEU C . 15199 1 541 . 1 1 170 170 LEU CA C 13 56.741 0.04 . 1 . . . . 170 LEU CA . 15199 1 542 . 1 1 170 170 LEU CB C 13 43.451 0.04 . 1 . . . . 170 LEU CB . 15199 1 543 . 1 1 170 170 LEU N N 15 119.672 0.05 . 1 . . . . 170 LEU N . 15199 1 544 . 1 1 171 171 ILE H H 1 7.803 0.02 . 1 . . . . 171 ILE HN . 15199 1 545 . 1 1 171 171 ILE CA C 13 58.426 0.04 . 1 . . . . 171 ILE CA . 15199 1 546 . 1 1 171 171 ILE N N 15 115.247 0.05 . 1 . . . . 171 ILE N . 15199 1 547 . 1 1 172 172 PRO C C 13 177.387 0.04 . 1 . . . . 172 PRO C . 15199 1 548 . 1 1 172 172 PRO CA C 13 64.859 0.04 . 1 . . . . 172 PRO CA . 15199 1 549 . 1 1 172 172 PRO CB C 13 31.967 0.04 . 1 . . . . 172 PRO CB . 15199 1 550 . 1 1 173 173 GLU H H 1 8.636 0.02 . 1 . . . . 173 GLU HN . 15199 1 551 . 1 1 173 173 GLU C C 13 176.204 0.04 . 1 . . . . 173 GLU C . 15199 1 552 . 1 1 173 173 GLU CA C 13 57.609 0.04 . 1 . . . . 173 GLU CA . 15199 1 553 . 1 1 173 173 GLU CB C 13 29.143 0.04 . 1 . . . . 173 GLU CB . 15199 1 554 . 1 1 173 173 GLU N N 15 116.278 0.05 . 1 . . . . 173 GLU N . 15199 1 555 . 1 1 174 174 GLN H H 1 8.085 0.02 . 1 . . . . 174 GLN HN . 15199 1 556 . 1 1 174 174 GLN CA C 13 55.806 0.04 . 1 . . . . 174 GLN CA . 15199 1 557 . 1 1 174 174 GLN N N 15 120.223 0.05 . 1 . . . . 174 GLN N . 15199 1 558 . 1 1 176 176 ASN C C 13 175.127 0.04 . 1 . . . . 176 ASN C . 15199 1 559 . 1 1 176 176 ASN CA C 13 53.414 0.04 . 1 . . . . 176 ASN CA . 15199 1 560 . 1 1 176 176 ASN CB C 13 39.175 0.04 . 1 . . . . 176 ASN CB . 15199 1 561 . 1 1 177 177 GLY H H 1 8.311 0.02 . 1 . . . . 177 GLY HN . 15199 1 562 . 1 1 177 177 GLY CA C 13 45.448 0.04 . 1 . . . . 177 GLY CA . 15199 1 563 . 1 1 177 177 GLY N N 15 108.622 0.05 . 1 . . . . 177 GLY N . 15199 1 564 . 1 1 178 178 SER H H 1 8.296 0.02 . 1 . . . . 178 SER HN . 15199 1 565 . 1 1 178 178 SER C C 13 173.849 0.04 . 1 . . . . 178 SER C . 15199 1 566 . 1 1 178 178 SER CA C 13 59.077 0.04 . 1 . . . . 178 SER CA . 15199 1 567 . 1 1 178 178 SER CB C 13 64.099 0.04 . 1 . . . . 178 SER CB . 15199 1 568 . 1 1 178 178 SER N N 15 116.375 0.05 . 1 . . . . 178 SER N . 15199 1 569 . 1 1 179 179 ILE H H 1 8.656 0.02 . 1 . . . . 179 ILE HN . 15199 1 570 . 1 1 179 179 ILE C C 13 173.968 0.04 . 1 . . . . 179 ILE C . 15199 1 571 . 1 1 179 179 ILE CA C 13 60.872 0.04 . 1 . . . . 179 ILE CA . 15199 1 572 . 1 1 179 179 ILE N N 15 122.197 0.05 . 1 . . . . 179 ILE N . 15199 1 573 . 1 1 180 180 VAL H H 1 9.610 0.02 . 1 . . . . 180 VAL HN . 15199 1 574 . 1 1 180 180 VAL C C 13 175.028 0.04 . 1 . . . . 180 VAL C . 15199 1 575 . 1 1 180 180 VAL CA C 13 61.122 0.04 . 1 . . . . 180 VAL CA . 15199 1 576 . 1 1 180 180 VAL N N 15 130.829 0.05 . 1 . . . . 180 VAL N . 15199 1 577 . 1 1 181 181 ARG H H 1 8.691 0.02 . 1 . . . . 181 ARG HN . 15199 1 578 . 1 1 181 181 ARG C C 13 176.180 0.04 . 1 . . . . 181 ARG C . 15199 1 579 . 1 1 181 181 ARG CA C 13 53.575 0.04 . 1 . . . . 181 ARG CA . 15199 1 580 . 1 1 181 181 ARG N N 15 123.942 0.05 . 1 . . . . 181 ARG N . 15199 1 581 . 1 1 182 182 VAL H H 1 8.688 0.02 . 1 . . . . 182 VAL HN . 15199 1 582 . 1 1 182 182 VAL C C 13 174.776 0.04 . 1 . . . . 182 VAL C . 15199 1 583 . 1 1 182 182 VAL CA C 13 64.396 0.04 . 1 . . . . 182 VAL CA . 15199 1 584 . 1 1 182 182 VAL N N 15 121.452 0.05 . 1 . . . . 182 VAL N . 15199 1 585 . 1 1 183 183 LYS H H 1 9.218 0.02 . 1 . . . . 183 LYS HN . 15199 1 586 . 1 1 183 183 LYS C C 13 174.251 0.04 . 1 . . . . 183 LYS C . 15199 1 587 . 1 1 183 183 LYS CA C 13 57.145 0.04 . 1 . . . . 183 LYS CA . 15199 1 588 . 1 1 183 183 LYS CB C 13 34.410 0.04 . 1 . . . . 183 LYS CB . 15199 1 589 . 1 1 183 183 LYS N N 15 131.712 0.05 . 1 . . . . 183 LYS N . 15199 1 590 . 1 1 184 184 LYS H H 1 7.188 0.02 . 1 . . . . 184 LYS HN . 15199 1 591 . 1 1 184 184 LYS C C 13 177.176 0.04 . 1 . . . . 184 LYS C . 15199 1 592 . 1 1 184 184 LYS CA C 13 56.014 0.04 . 1 . . . . 184 LYS CA . 15199 1 593 . 1 1 184 184 LYS CB C 13 36.192 0.04 . 1 . . . . 184 LYS CB . 15199 1 594 . 1 1 184 184 LYS N N 15 117.431 0.05 . 1 . . . . 184 LYS N . 15199 1 595 . 1 1 185 185 LEU H H 1 8.692 0.02 . 1 . . . . 185 LEU HN . 15199 1 596 . 1 1 185 185 LEU C C 13 176.047 0.04 . 1 . . . . 185 LEU C . 15199 1 597 . 1 1 185 185 LEU CA C 13 53.269 0.04 . 1 . . . . 185 LEU CA . 15199 1 598 . 1 1 185 185 LEU CB C 13 44.373 0.04 . 1 . . . . 185 LEU CB . 15199 1 599 . 1 1 185 185 LEU N N 15 124.794 0.05 . 1 . . . . 185 LEU N . 15199 1 600 . 1 1 186 186 PHE H H 1 7.575 0.02 . 1 . . . . 186 PHE HN . 15199 1 601 . 1 1 186 186 PHE CA C 13 53.673 0.04 . 1 . . . . 186 PHE CA . 15199 1 602 . 1 1 186 186 PHE N N 15 122.852 0.05 . 1 . . . . 186 PHE N . 15199 1 603 . 1 1 187 187 PRO C C 13 178.000 0.04 . 1 . . . . 187 PRO C . 15199 1 604 . 1 1 187 187 PRO CA C 13 64.058 0.04 . 1 . . . . 187 PRO CA . 15199 1 605 . 1 1 188 188 GLY H H 1 9.403 0.02 . 1 . . . . 188 GLY HN . 15199 1 606 . 1 1 188 188 GLY C C 13 173.517 0.04 . 1 . . . . 188 GLY C . 15199 1 607 . 1 1 188 188 GLY CA C 13 45.651 0.04 . 1 . . . . 188 GLY CA . 15199 1 608 . 1 1 188 188 GLY N N 15 111.318 0.05 . 1 . . . . 188 GLY N . 15199 1 609 . 1 1 189 189 GLN H H 1 7.286 0.02 . 1 . . . . 189 GLN HN . 15199 1 610 . 1 1 189 189 GLN CA C 13 54.149 0.04 . 1 . . . . 189 GLN CA . 15199 1 611 . 1 1 189 189 GLN N N 15 119.196 0.05 . 1 . . . . 189 GLN N . 15199 1 612 . 1 1 190 190 PRO C C 13 179.468 0.04 . 1 . . . . 190 PRO C . 15199 1 613 . 1 1 190 190 PRO CA C 13 67.666 0.04 . 1 . . . . 190 PRO CA . 15199 1 614 . 1 1 191 191 ALA H H 1 8.465 0.02 . 1 . . . . 191 ALA HN . 15199 1 615 . 1 1 191 191 ALA C C 13 180.494 0.04 . 1 . . . . 191 ALA C . 15199 1 616 . 1 1 191 191 ALA CA C 13 56.093 0.04 . 1 . . . . 191 ALA CA . 15199 1 617 . 1 1 191 191 ALA CB C 13 19.091 0.04 . 1 . . . . 191 ALA CB . 15199 1 618 . 1 1 191 191 ALA N N 15 119.222 0.05 . 1 . . . . 191 ALA N . 15199 1 619 . 1 1 192 192 ALA H H 1 10.289 0.02 . 1 . . . . 192 ALA HN . 15199 1 620 . 1 1 192 192 ALA C C 13 180.257 0.04 . 1 . . . . 192 ALA C . 15199 1 621 . 1 1 192 192 ALA CA C 13 55.301 0.04 . 1 . . . . 192 ALA CA . 15199 1 622 . 1 1 192 192 ALA CB C 13 19.356 0.04 . 1 . . . . 192 ALA CB . 15199 1 623 . 1 1 192 192 ALA N N 15 127.131 0.05 . 1 . . . . 192 ALA N . 15199 1 624 . 1 1 193 193 GLU H H 1 8.428 0.02 . 1 . . . . 193 GLU HN . 15199 1 625 . 1 1 193 193 GLU C C 13 178.386 0.04 . 1 . . . . 193 GLU C . 15199 1 626 . 1 1 193 193 GLU CA C 13 58.446 0.04 . 1 . . . . 193 GLU CA . 15199 1 627 . 1 1 193 193 GLU CB C 13 29.877 0.04 . 1 . . . . 193 GLU CB . 15199 1 628 . 1 1 193 193 GLU N N 15 117.316 0.05 . 1 . . . . 193 GLU N . 15199 1 629 . 1 1 194 194 SER H H 1 7.891 0.02 . 1 . . . . 194 SER HN . 15199 1 630 . 1 1 194 194 SER C C 13 175.843 0.04 . 1 . . . . 194 SER C . 15199 1 631 . 1 1 194 194 SER CA C 13 61.230 0.04 . 1 . . . . 194 SER CA . 15199 1 632 . 1 1 194 194 SER CB C 13 64.205 0.04 . 1 . . . . 194 SER CB . 15199 1 633 . 1 1 194 194 SER N N 15 113.718 0.05 . 1 . . . . 194 SER N . 15199 1 634 . 1 1 195 195 GLY H H 1 7.381 0.02 . 1 . . . . 195 GLY HN . 15199 1 635 . 1 1 195 195 GLY C C 13 174.797 0.04 . 1 . . . . 195 GLY C . 15199 1 636 . 1 1 195 195 GLY CA C 13 46.536 0.04 . 1 . . . . 195 GLY CA . 15199 1 637 . 1 1 195 195 GLY N N 15 109.544 0.05 . 1 . . . . 195 GLY N . 15199 1 638 . 1 1 196 196 LYS H H 1 7.812 0.02 . 1 . . . . 196 LYS HN . 15199 1 639 . 1 1 196 196 LYS C C 13 174.795 0.04 . 1 . . . . 196 LYS C . 15199 1 640 . 1 1 196 196 LYS CA C 13 56.120 0.04 . 1 . . . . 196 LYS CA . 15199 1 641 . 1 1 196 196 LYS CB C 13 36.269 0.04 . 1 . . . . 196 LYS CB . 15199 1 642 . 1 1 196 196 LYS N N 15 118.202 0.05 . 1 . . . . 196 LYS N . 15199 1 643 . 1 1 197 197 ILE H H 1 7.778 0.02 . 1 . . . . 197 ILE HN . 15199 1 644 . 1 1 197 197 ILE C C 13 173.228 0.04 . 1 . . . . 197 ILE C . 15199 1 645 . 1 1 197 197 ILE CA C 13 60.246 0.04 . 1 . . . . 197 ILE CA . 15199 1 646 . 1 1 197 197 ILE CB C 13 40.916 0.04 . 1 . . . . 197 ILE CB . 15199 1 647 . 1 1 197 197 ILE N N 15 117.761 0.05 . 1 . . . . 197 ILE N . 15199 1 648 . 1 1 198 198 ASP H H 1 9.157 0.02 . 1 . . . . 198 ASP HN . 15199 1 649 . 1 1 198 198 ASP C C 13 176.250 0.04 . 1 . . . . 198 ASP C . 15199 1 650 . 1 1 198 198 ASP CA C 13 51.714 0.04 . 1 . . . . 198 ASP CA . 15199 1 651 . 1 1 198 198 ASP CB C 13 42.865 0.04 . 1 . . . . 198 ASP CB . 15199 1 652 . 1 1 198 198 ASP N N 15 129.396 0.05 . 1 . . . . 198 ASP N . 15199 1 653 . 1 1 199 199 VAL H H 1 8.506 0.02 . 1 . . . . 199 VAL HN . 15199 1 654 . 1 1 199 199 VAL C C 13 177.990 0.04 . 1 . . . . 199 VAL C . 15199 1 655 . 1 1 199 199 VAL CA C 13 65.392 0.04 . 1 . . . . 199 VAL CA . 15199 1 656 . 1 1 199 199 VAL CB C 13 31.493 0.04 . 1 . . . . 199 VAL CB . 15199 1 657 . 1 1 199 199 VAL N N 15 120.542 0.05 . 1 . . . . 199 VAL N . 15199 1 658 . 1 1 200 200 GLY H H 1 9.487 0.02 . 1 . . . . 200 GLY HN . 15199 1 659 . 1 1 200 200 GLY C C 13 173.934 0.04 . 1 . . . . 200 GLY C . 15199 1 660 . 1 1 200 200 GLY CA C 13 44.581 0.04 . 1 . . . . 200 GLY CA . 15199 1 661 . 1 1 200 200 GLY N N 15 117.725 0.05 . 1 . . . . 200 GLY N . 15199 1 662 . 1 1 201 201 ASP H H 1 7.853 0.02 . 1 . . . . 201 ASP HN . 15199 1 663 . 1 1 201 201 ASP C C 13 175.272 0.04 . 1 . . . . 201 ASP C . 15199 1 664 . 1 1 201 201 ASP CA C 13 56.205 0.04 . 1 . . . . 201 ASP CA . 15199 1 665 . 1 1 201 201 ASP CB C 13 40.548 0.04 . 1 . . . . 201 ASP CB . 15199 1 666 . 1 1 201 201 ASP N N 15 122.654 0.05 . 1 . . . . 201 ASP N . 15199 1 667 . 1 1 202 202 VAL H H 1 9.091 0.02 . 1 . . . . 202 VAL HN . 15199 1 668 . 1 1 202 202 VAL C C 13 175.957 0.04 . 1 . . . . 202 VAL C . 15199 1 669 . 1 1 202 202 VAL CA C 13 61.156 0.04 . 1 . . . . 202 VAL CA . 15199 1 670 . 1 1 202 202 VAL N N 15 122.438 0.05 . 1 . . . . 202 VAL N . 15199 1 671 . 1 1 203 203 ILE H H 1 8.857 0.02 . 1 . . . . 203 ILE HN . 15199 1 672 . 1 1 203 203 ILE C C 13 174.403 0.04 . 1 . . . . 203 ILE C . 15199 1 673 . 1 1 203 203 ILE CA C 13 61.342 0.04 . 1 . . . . 203 ILE CA . 15199 1 674 . 1 1 203 203 ILE N N 15 126.528 0.05 . 1 . . . . 203 ILE N . 15199 1 675 . 1 1 204 204 LEU H H 1 9.205 0.02 . 1 . . . . 204 LEU HN . 15199 1 676 . 1 1 204 204 LEU C C 13 179.322 0.04 . 1 . . . . 204 LEU C . 15199 1 677 . 1 1 204 204 LEU CA C 13 56.431 0.04 . 1 . . . . 204 LEU CA . 15199 1 678 . 1 1 204 204 LEU CB C 13 43.555 0.04 . 1 . . . . 204 LEU CB . 15199 1 679 . 1 1 204 204 LEU N N 15 126.528 0.05 . 1 . . . . 204 LEU N . 15199 1 680 . 1 1 205 205 LYS H H 1 7.860 0.02 . 1 . . . . 205 LYS HN . 15199 1 681 . 1 1 205 205 LYS C C 13 174.667 0.04 . 1 . . . . 205 LYS C . 15199 1 682 . 1 1 205 205 LYS CA C 13 54.870 0.04 . 1 . . . . 205 LYS CA . 15199 1 683 . 1 1 205 205 LYS CB C 13 29.376 0.04 . 1 . . . . 205 LYS CB . 15199 1 684 . 1 1 205 205 LYS N N 15 115.163 0.05 . 1 . . . . 205 LYS N . 15199 1 685 . 1 1 206 206 VAL H H 1 8.400 0.02 . 1 . . . . 206 VAL HN . 15199 1 686 . 1 1 206 206 VAL C C 13 176.027 0.04 . 1 . . . . 206 VAL C . 15199 1 687 . 1 1 206 206 VAL CA C 13 60.771 0.04 . 1 . . . . 206 VAL CA . 15199 1 688 . 1 1 206 206 VAL N N 15 119.132 0.05 . 1 . . . . 206 VAL N . 15199 1 689 . 1 1 207 207 ASN H H 1 10.154 0.02 . 1 . . . . 207 ASN HN . 15199 1 690 . 1 1 207 207 ASN C C 13 175.570 0.04 . 1 . . . . 207 ASN C . 15199 1 691 . 1 1 207 207 ASN CA C 13 54.190 0.04 . 1 . . . . 207 ASN CA . 15199 1 692 . 1 1 207 207 ASN CB C 13 37.044 0.04 . 1 . . . . 207 ASN CB . 15199 1 693 . 1 1 207 207 ASN N N 15 130.018 0.05 . 1 . . . . 207 ASN N . 15199 1 694 . 1 1 208 208 GLY H H 1 9.085 0.02 . 1 . . . . 208 GLY HN . 15199 1 695 . 1 1 208 208 GLY C C 13 172.745 0.04 . 1 . . . . 208 GLY C . 15199 1 696 . 1 1 208 208 GLY CA C 13 45.352 0.04 . 1 . . . . 208 GLY CA . 15199 1 697 . 1 1 208 208 GLY N N 15 103.821 0.05 . 1 . . . . 208 GLY N . 15199 1 698 . 1 1 209 209 ALA H H 1 8.088 0.02 . 1 . . . . 209 ALA HN . 15199 1 699 . 1 1 209 209 ALA CA C 13 48.855 0.04 . 1 . . . . 209 ALA CA . 15199 1 700 . 1 1 209 209 ALA N N 15 127.186 0.05 . 1 . . . . 209 ALA N . 15199 1 701 . 1 1 210 210 PRO C C 13 177.664 0.04 . 1 . . . . 210 PRO C . 15199 1 702 . 1 1 210 210 PRO CA C 13 62.089 0.04 . 1 . . . . 210 PRO CA . 15199 1 703 . 1 1 210 210 PRO CB C 13 32.608 0.04 . 1 . . . . 210 PRO CB . 15199 1 704 . 1 1 211 211 LEU H H 1 7.629 0.02 . 1 . . . . 211 LEU HN . 15199 1 705 . 1 1 211 211 LEU C C 13 178.218 0.04 . 1 . . . . 211 LEU C . 15199 1 706 . 1 1 211 211 LEU CA C 13 55.053 0.04 . 1 . . . . 211 LEU CA . 15199 1 707 . 1 1 211 211 LEU CB C 13 40.968 0.04 . 1 . . . . 211 LEU CB . 15199 1 708 . 1 1 211 211 LEU N N 15 119.417 0.05 . 1 . . . . 211 LEU N . 15199 1 709 . 1 1 212 212 LYS H H 1 8.336 0.02 . 1 . . . . 212 LYS HN . 15199 1 710 . 1 1 212 212 LYS C C 13 177.442 0.04 . 1 . . . . 212 LYS C . 15199 1 711 . 1 1 212 212 LYS CA C 13 59.213 0.04 . 1 . . . . 212 LYS CA . 15199 1 712 . 1 1 212 212 LYS N N 15 123.490 0.05 . 1 . . . . 212 LYS N . 15199 1 713 . 1 1 213 213 GLY H H 1 8.444 0.02 . 1 . . . . 213 GLY HN . 15199 1 714 . 1 1 213 213 GLY C C 13 174.658 0.04 . 1 . . . . 213 GLY C . 15199 1 715 . 1 1 213 213 GLY CA C 13 45.548 0.04 . 1 . . . . 213 GLY CA . 15199 1 716 . 1 1 213 213 GLY N N 15 113.857 0.05 . 1 . . . . 213 GLY N . 15199 1 717 . 1 1 214 214 LEU H H 1 7.652 0.02 . 1 . . . . 214 LEU HN . 15199 1 718 . 1 1 214 214 LEU C C 13 178.794 0.04 . 1 . . . . 214 LEU C . 15199 1 719 . 1 1 214 214 LEU CA C 13 54.890 0.04 . 1 . . . . 214 LEU CA . 15199 1 720 . 1 1 214 214 LEU N N 15 121.616 0.05 . 1 . . . . 214 LEU N . 15199 1 721 . 1 1 215 215 SER H H 1 9.494 0.02 . 1 . . . . 215 SER HN . 15199 1 722 . 1 1 215 215 SER C C 13 173.796 0.04 . 1 . . . . 215 SER C . 15199 1 723 . 1 1 215 215 SER CA C 13 57.516 0.04 . 1 . . . . 215 SER CA . 15199 1 724 . 1 1 215 215 SER N N 15 120.137 0.05 . 1 . . . . 215 SER N . 15199 1 725 . 1 1 216 216 GLN H H 1 9.276 0.02 . 1 . . . . 216 GLN HN . 15199 1 726 . 1 1 216 216 GLN C C 13 177.715 0.04 . 1 . . . . 216 GLN C . 15199 1 727 . 1 1 216 216 GLN CA C 13 60.703 0.04 . 1 . . . . 216 GLN CA . 15199 1 728 . 1 1 216 216 GLN CB C 13 28.214 0.04 . 1 . . . . 216 GLN CB . 15199 1 729 . 1 1 216 216 GLN N N 15 121.452 0.05 . 1 . . . . 216 GLN N . 15199 1 730 . 1 1 217 217 GLN H H 1 8.665 0.02 . 1 . . . . 217 GLN HN . 15199 1 731 . 1 1 217 217 GLN C C 13 178.160 0.04 . 1 . . . . 217 GLN C . 15199 1 732 . 1 1 217 217 GLN CA C 13 59.169 0.04 . 1 . . . . 217 GLN CA . 15199 1 733 . 1 1 217 217 GLN CB C 13 27.982 0.04 . 1 . . . . 217 GLN CB . 15199 1 734 . 1 1 217 217 GLN N N 15 116.721 0.05 . 1 . . . . 217 GLN N . 15199 1 735 . 1 1 218 218 ASP H H 1 7.865 0.02 . 1 . . . . 218 ASP HN . 15199 1 736 . 1 1 218 218 ASP C C 13 179.298 0.04 . 1 . . . . 218 ASP C . 15199 1 737 . 1 1 218 218 ASP CA C 13 57.123 0.04 . 1 . . . . 218 ASP CA . 15199 1 738 . 1 1 218 218 ASP CB C 13 40.117 0.04 . 1 . . . . 218 ASP CB . 15199 1 739 . 1 1 218 218 ASP N N 15 121.796 0.05 . 1 . . . . 218 ASP N . 15199 1 740 . 1 1 219 219 VAL H H 1 8.495 0.02 . 1 . . . . 219 VAL HN . 15199 1 741 . 1 1 219 219 VAL C C 13 177.044 0.04 . 1 . . . . 219 VAL C . 15199 1 742 . 1 1 219 219 VAL CA C 13 67.594 0.04 . 1 . . . . 219 VAL CA . 15199 1 743 . 1 1 219 219 VAL CB C 13 29.170 0.04 . 1 . . . . 219 VAL CB . 15199 1 744 . 1 1 219 219 VAL N N 15 124.679 0.05 . 1 . . . . 219 VAL N . 15199 1 745 . 1 1 220 220 ILE H H 1 8.074 0.02 . 1 . . . . 220 ILE HN . 15199 1 746 . 1 1 220 220 ILE C C 13 178.971 0.04 . 1 . . . . 220 ILE C . 15199 1 747 . 1 1 220 220 ILE CA C 13 66.049 0.04 . 1 . . . . 220 ILE CA . 15199 1 748 . 1 1 220 220 ILE CB C 13 38.117 0.04 . 1 . . . . 220 ILE CB . 15199 1 749 . 1 1 220 220 ILE N N 15 119.765 0.05 . 1 . . . . 220 ILE N . 15199 1 750 . 1 1 221 221 SER H H 1 8.147 0.02 . 1 . . . . 221 SER HN . 15199 1 751 . 1 1 221 221 SER C C 13 176.892 0.04 . 1 . . . . 221 SER C . 15199 1 752 . 1 1 221 221 SER CA C 13 61.840 0.04 . 1 . . . . 221 SER CA . 15199 1 753 . 1 1 221 221 SER CB C 13 62.593 0.04 . 1 . . . . 221 SER CB . 15199 1 754 . 1 1 221 221 SER N N 15 113.973 0.05 . 1 . . . . 221 SER N . 15199 1 755 . 1 1 222 222 ALA H H 1 7.979 0.02 . 1 . . . . 222 ALA HN . 15199 1 756 . 1 1 222 222 ALA C C 13 179.723 0.04 . 1 . . . . 222 ALA C . 15199 1 757 . 1 1 222 222 ALA CA C 13 54.690 0.04 . 1 . . . . 222 ALA CA . 15199 1 758 . 1 1 222 222 ALA CB C 13 17.530 0.04 . 1 . . . . 222 ALA CB . 15199 1 759 . 1 1 222 222 ALA N N 15 124.568 0.05 . 1 . . . . 222 ALA N . 15199 1 760 . 1 1 223 223 LEU H H 1 7.841 0.02 . 1 . . . . 223 LEU HN . 15199 1 761 . 1 1 223 223 LEU C C 13 177.267 0.04 . 1 . . . . 223 LEU C . 15199 1 762 . 1 1 223 223 LEU CA C 13 56.427 0.04 . 1 . . . . 223 LEU CA . 15199 1 763 . 1 1 223 223 LEU CB C 13 42.311 0.04 . 1 . . . . 223 LEU CB . 15199 1 764 . 1 1 223 223 LEU N N 15 116.119 0.05 . 1 . . . . 223 LEU N . 15199 1 765 . 1 1 224 224 ARG H H 1 7.812 0.02 . 1 . . . . 224 ARG HN . 15199 1 766 . 1 1 224 224 ARG C C 13 177.293 0.04 . 1 . . . . 224 ARG C . 15199 1 767 . 1 1 224 224 ARG CA C 13 57.096 0.04 . 1 . . . . 224 ARG CA . 15199 1 768 . 1 1 224 224 ARG CB C 13 30.542 0.04 . 1 . . . . 224 ARG CB . 15199 1 769 . 1 1 224 224 ARG N N 15 119.509 0.05 . 1 . . . . 224 ARG N . 15199 1 770 . 1 1 225 225 GLY H H 1 7.743 0.02 . 1 . . . . 225 GLY HN . 15199 1 771 . 1 1 225 225 GLY C C 13 173.796 0.04 . 1 . . . . 225 GLY C . 15199 1 772 . 1 1 225 225 GLY CA C 13 45.200 0.04 . 1 . . . . 225 GLY CA . 15199 1 773 . 1 1 225 225 GLY N N 15 106.527 0.05 . 1 . . . . 225 GLY N . 15199 1 774 . 1 1 226 226 THR H H 1 7.917 0.02 . 1 . . . . 226 THR HN . 15199 1 775 . 1 1 226 226 THR CA C 13 61.208 0.04 . 1 . . . . 226 THR CA . 15199 1 776 . 1 1 226 226 THR N N 15 119.975 0.05 . 1 . . . . 226 THR N . 15199 1 777 . 1 1 228 228 PRO C C 13 175.823 0.04 . 1 . . . . 228 PRO C . 15199 1 778 . 1 1 228 228 PRO CA C 13 65.148 0.04 . 1 . . . . 228 PRO CA . 15199 1 779 . 1 1 228 228 PRO CB C 13 32.657 0.04 . 1 . . . . 228 PRO CB . 15199 1 780 . 1 1 229 229 GLU H H 1 7.248 0.02 . 1 . . . . 229 GLU HN . 15199 1 781 . 1 1 229 229 GLU C C 13 175.249 0.04 . 1 . . . . 229 GLU C . 15199 1 782 . 1 1 229 229 GLU CA C 13 54.718 0.04 . 1 . . . . 229 GLU CA . 15199 1 783 . 1 1 229 229 GLU CB C 13 31.584 0.04 . 1 . . . . 229 GLU CB . 15199 1 784 . 1 1 229 229 GLU N N 15 115.550 0.05 . 1 . . . . 229 GLU N . 15199 1 785 . 1 1 230 230 VAL H H 1 9.048 0.02 . 1 . . . . 230 VAL HN . 15199 1 786 . 1 1 230 230 VAL C C 13 174.262 0.04 . 1 . . . . 230 VAL C . 15199 1 787 . 1 1 230 230 VAL CA C 13 61.057 0.04 . 1 . . . . 230 VAL CA . 15199 1 788 . 1 1 230 230 VAL CB C 13 32.319 0.04 . 1 . . . . 230 VAL CB . 15199 1 789 . 1 1 230 230 VAL N N 15 126.152 0.05 . 1 . . . . 230 VAL N . 15199 1 790 . 1 1 231 231 SER H H 1 8.583 0.02 . 1 . . . . 231 SER HN . 15199 1 791 . 1 1 231 231 SER C C 13 174.147 0.04 . 1 . . . . 231 SER C . 15199 1 792 . 1 1 231 231 SER CA C 13 56.989 0.04 . 1 . . . . 231 SER CA . 15199 1 793 . 1 1 231 231 SER CB C 13 63.637 0.04 . 1 . . . . 231 SER CB . 15199 1 794 . 1 1 231 231 SER N N 15 121.649 0.05 . 1 . . . . 231 SER N . 15199 1 795 . 1 1 232 232 LEU H H 1 9.346 0.02 . 1 . . . . 232 LEU HN . 15199 1 796 . 1 1 232 232 LEU C C 13 174.510 0.04 . 1 . . . . 232 LEU C . 15199 1 797 . 1 1 232 232 LEU CA C 13 53.356 0.04 . 1 . . . . 232 LEU CA . 15199 1 798 . 1 1 232 232 LEU CB C 13 44.327 0.04 . 1 . . . . 232 LEU CB . 15199 1 799 . 1 1 232 232 LEU N N 15 128.367 0.05 . 1 . . . . 232 LEU N . 15199 1 800 . 1 1 233 233 LEU H H 1 8.465 0.02 . 1 . . . . 233 LEU HN . 15199 1 801 . 1 1 233 233 LEU C C 13 174.857 0.04 . 1 . . . . 233 LEU C . 15199 1 802 . 1 1 233 233 LEU CA C 13 54.190 0.04 . 1 . . . . 233 LEU CA . 15199 1 803 . 1 1 233 233 LEU CB C 13 43.923 0.04 . 1 . . . . 233 LEU CB . 15199 1 804 . 1 1 233 233 LEU N N 15 125.521 0.05 . 1 . . . . 233 LEU N . 15199 1 805 . 1 1 234 234 LEU H H 1 9.043 0.02 . 1 . . . . 234 LEU HN . 15199 1 806 . 1 1 234 234 LEU C C 13 174.456 0.04 . 1 . . . . 234 LEU C . 15199 1 807 . 1 1 234 234 LEU CA C 13 53.509 0.04 . 1 . . . . 234 LEU CA . 15199 1 808 . 1 1 234 234 LEU N N 15 128.959 0.05 . 1 . . . . 234 LEU N . 15199 1 809 . 1 1 235 235 CYS H H 1 9.166 0.02 . 1 . . . . 235 CYS HN . 15199 1 810 . 1 1 235 235 CYS C C 13 172.863 0.04 . 1 . . . . 235 CYS C . 15199 1 811 . 1 1 235 235 CYS CA C 13 56.343 0.04 . 1 . . . . 235 CYS CA . 15199 1 812 . 1 1 235 235 CYS CB C 13 30.499 0.04 . 1 . . . . 235 CYS CB . 15199 1 813 . 1 1 235 235 CYS N N 15 117.751 0.05 . 1 . . . . 235 CYS N . 15199 1 814 . 1 1 236 236 ARG H H 1 8.797 0.02 . 1 . . . . 236 ARG HN . 15199 1 815 . 1 1 236 236 ARG CA C 13 52.556 0.04 . 1 . . . . 236 ARG CA . 15199 1 816 . 1 1 236 236 ARG N N 15 132.189 0.05 . 1 . . . . 236 ARG N . 15199 1 817 . 1 1 237 237 PRO C C 13 175.241 0.04 . 1 . . . . 237 PRO C . 15199 1 818 . 1 1 237 237 PRO CA C 13 62.151 0.04 . 1 . . . . 237 PRO CA . 15199 1 819 . 1 1 237 237 PRO CB C 13 31.999 0.04 . 1 . . . . 237 PRO CB . 15199 1 820 . 1 1 238 238 ALA H H 1 8.420 0.02 . 1 . . . . 238 ALA HN . 15199 1 821 . 1 1 238 238 ALA N N 15 124.979 0.05 . 1 . . . . 238 ALA N . 15199 1 822 . 1 1 239 239 PRO C C 13 177.978 0.04 . 1 . . . . 239 PRO C . 15199 1 823 . 1 1 239 239 PRO CA C 13 64.049 0.04 . 1 . . . . 239 PRO CA . 15199 1 824 . 1 1 239 239 PRO CB C 13 31.390 0.04 . 1 . . . . 239 PRO CB . 15199 1 825 . 1 1 240 240 GLY H H 1 8.876 0.02 . 1 . . . . 240 GLY HN . 15199 1 826 . 1 1 240 240 GLY C C 13 174.704 0.04 . 1 . . . . 240 GLY C . 15199 1 827 . 1 1 240 240 GLY CA C 13 45.237 0.04 . 1 . . . . 240 GLY CA . 15199 1 828 . 1 1 240 240 GLY N N 15 112.572 0.05 . 1 . . . . 240 GLY N . 15199 1 829 . 1 1 241 241 VAL H H 1 7.602 0.02 . 1 . . . . 241 VAL HN . 15199 1 830 . 1 1 241 241 VAL C C 13 176.046 0.04 . 1 . . . . 241 VAL C . 15199 1 831 . 1 1 241 241 VAL CA C 13 65.569 0.04 . 1 . . . . 241 VAL CA . 15199 1 832 . 1 1 241 241 VAL CB C 13 29.298 0.04 . 1 . . . . 241 VAL CB . 15199 1 833 . 1 1 241 241 VAL N N 15 122.040 0.05 . 1 . . . . 241 VAL N . 15199 1 834 . 1 1 242 242 LEU H H 1 8.368 0.02 . 1 . . . . 242 LEU HN . 15199 1 835 . 1 1 242 242 LEU CA C 13 50.935 0.04 . 1 . . . . 242 LEU CA . 15199 1 836 . 1 1 242 242 LEU N N 15 118.554 0.05 . 1 . . . . 242 LEU N . 15199 1 837 . 1 1 243 243 PRO C C 13 176.797 0.04 . 1 . . . . 243 PRO C . 15199 1 838 . 1 1 243 243 PRO CA C 13 63.232 0.04 . 1 . . . . 243 PRO CA . 15199 1 839 . 1 1 243 243 PRO CB C 13 32.319 0.04 . 1 . . . . 243 PRO CB . 15199 1 840 . 1 1 244 244 GLU H H 1 8.520 0.02 . 1 . . . . 244 GLU HN . 15199 1 841 . 1 1 244 244 GLU C C 13 174.052 0.04 . 1 . . . . 244 GLU C . 15199 1 842 . 1 1 244 244 GLU CA C 13 56.615 0.04 . 1 . . . . 244 GLU CA . 15199 1 843 . 1 1 244 244 GLU CB C 13 30.072 0.04 . 1 . . . . 244 GLU CB . 15199 1 844 . 1 1 244 244 GLU N N 15 121.704 0.05 . 1 . . . . 244 GLU N . 15199 1 845 . 1 1 245 245 ILE H H 1 8.692 0.02 . 1 . . . . 245 ILE HN . 15199 1 846 . 1 1 245 245 ILE C C 13 175.655 0.04 . 1 . . . . 245 ILE C . 15199 1 847 . 1 1 245 245 ILE CA C 13 61.886 0.04 . 1 . . . . 245 ILE CA . 15199 1 848 . 1 1 245 245 ILE CB C 13 38.741 0.04 . 1 . . . . 245 ILE CB . 15199 1 849 . 1 1 245 245 ILE N N 15 124.756 0.05 . 1 . . . . 245 ILE N . 15199 1 850 . 1 1 246 246 ASP H H 1 8.516 0.02 . 1 . . . . 246 ASP HN . 15199 1 851 . 1 1 246 246 ASP C C 13 175.375 0.04 . 1 . . . . 246 ASP C . 15199 1 852 . 1 1 246 246 ASP CA C 13 54.187 0.04 . 1 . . . . 246 ASP CA . 15199 1 853 . 1 1 246 246 ASP CB C 13 41.153 0.04 . 1 . . . . 246 ASP CB . 15199 1 854 . 1 1 246 246 ASP N N 15 125.571 0.05 . 1 . . . . 246 ASP N . 15199 1 855 . 1 1 247 247 THR H H 1 7.927 0.02 . 1 . . . . 247 THR HN . 15199 1 856 . 1 1 247 247 THR CA C 13 59.913 0.04 . 1 . . . . 247 THR CA . 15199 1 857 . 1 1 247 247 THR N N 15 116.947 0.05 . 1 . . . . 247 THR N . 15199 1 858 . 1 1 248 248 PRO C C 13 177.517 0.04 . 1 . . . . 248 PRO C . 15199 1 859 . 1 1 248 248 PRO CA C 13 63.709 0.04 . 1 . . . . 248 PRO CA . 15199 1 860 . 1 1 248 248 PRO CB C 13 32.393 0.04 . 1 . . . . 248 PRO CB . 15199 1 861 . 1 1 249 249 GLY H H 1 8.500 0.02 . 1 . . . . 249 GLY HN . 15199 1 862 . 1 1 249 249 GLY C C 13 173.839 0.04 . 1 . . . . 249 GLY C . 15199 1 863 . 1 1 249 249 GLY CA C 13 45.126 0.04 . 1 . . . . 249 GLY CA . 15199 1 864 . 1 1 249 249 GLY N N 15 109.782 0.05 . 1 . . . . 249 GLY N . 15199 1 865 . 1 1 250 250 ASN H H 1 8.329 0.02 . 1 . . . . 250 ASN HN . 15199 1 866 . 1 1 250 250 ASN CA C 13 53.214 0.04 . 1 . . . . 250 ASN CA . 15199 1 867 . 1 1 250 250 ASN N N 15 119.357 0.05 . 1 . . . . 250 ASN N . 15199 1 stop_ save_