data_11012 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11012 _Entry.Title ; 1H, 13C and 15N resonance assignments for the 25.8 kDa DNA binding domain of the human p63 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-11-01 _Entry.Accession_date 2007-11-01 _Entry.Last_release_date 2015-06-16 _Entry.Original_release_date 2015-06-16 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.77 _Entry.Original_NMR_STAR_version 3.0.8.100 _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 Andreas Enthart . . . 11012 2 Horst Kessler . . . 11012 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Beta sandwich' . 11012 'DNA binding' . 11012 Protein . 11012 'p53 family' . 11012 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11012 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 877 11012 '15N chemical shifts' 215 11012 '1H chemical shifts' 1418 11012 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2015-06-16 . original BMRB . 11012 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11012 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure and binding studies of the p63 DNA binding domain ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 Andreas Enthart . . . 11012 1 2 Julien Furrer . . . 11012 1 3 Alexander Dehner . . . 11012 1 4 Horst Kessler . . . 11012 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'DNA binding' 11012 1 'p53 family' 11012 1 p63 11012 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11012 _Assembly.ID 1 _Assembly.Name p63BDB _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 p63BDB 1 $p63BDB A . yes native no no . . . 11012 1 2 'ZINC ION' 2 $ZN B . no native no no . . . 11012 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 coordination single . 1 p63BDB 1 CYS 93 93 SG . 2 'ZINC ION' 2 ZN 1 1 ZN . . 205 CYS SG . . . . ZN 11012 1 2 coordination single . 1 p63BDB 1 HIS 96 96 ND1 . 2 'ZINC ION' 2 ZN 1 1 ZN . . 208 HIS ND1 . . . . ZN 11012 1 3 coordination single . 1 p63BDB 1 CYS 157 157 SG . 2 'ZINC ION' 2 ZN 1 1 ZN . . 269 CYS SG . . . . ZN 11012 1 4 coordination single . 1 p63BDB 1 CYS 161 161 SG . 2 'ZINC ION' 2 ZN 1 1 ZN . . 273 CYS SG . . . . ZN 11012 1 stop_ loop_ _Entity_deleted_atom.ID _Entity_deleted_atom.Entity_atom_list_ID _Entity_deleted_atom.Entity_assembly_ID _Entity_deleted_atom.Entity_ID _Entity_deleted_atom.Comp_ID _Entity_deleted_atom.Comp_index_ID _Entity_deleted_atom.Seq_ID _Entity_deleted_atom.Atom_ID _Entity_deleted_atom.Auth_entity_assembly_ID _Entity_deleted_atom.Auth_seq_ID _Entity_deleted_atom.Auth_comp_ID _Entity_deleted_atom.Auth_atom_ID _Entity_deleted_atom.Entry_ID _Entity_deleted_atom.Assembly_ID 1 . 1 1 CYS 93 93 HG . 205 CYS HG 11012 1 2 . 1 1 HIS 96 96 HD1 . 208 HIS HD1 11012 1 3 . 1 1 CYS 157 157 HG . 269 CYS HG 11012 1 4 . 1 1 CYS 161 161 HG . 273 CYS HG 11012 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes BMRB 5700 . . 'solution NMR' . update . 11012 1 yes DBJ AF124528 . . . . . . 11012 1 yes EMBL AB010153 . . . . . . 11012 1 yes GenBank AAC62639.1 . . . . . . 11012 1 yes GenBank AAC62642.1 . . . . . . 11012 1 yes GenBank AAH90649.1 . . . . . . 11012 1 yes GenBank AAP87984.1 . . . . . . 11012 1 yes GenBank AAP87987.1 . . . . . . 11012 1 yes PDB 2RMN . . . . . . 11012 1 yes REF NP_989682.1 . . . . . . 11012 1 yes REF XP_001160425.1 . . . . . . 11012 1 yes REF XP_001499993.1 . . . . . . 11012 1 yes REF XP_001500003.1 . . . . . . 11012 1 yes REF XP_861289.1 . . . . . . 11012 1 yes SWISS-PROT Q9H3D4 . . . . . . 11012 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'p53 and p73 regulation' 11012 1 'regulation of epithelial morphogenesis' 11012 1 'sequence specific dna binding transcriptional activator or repressor' 11012 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_p63BDB _Entity.Sf_category entity _Entity.Sf_framecode p63BDB _Entity.Entry_ID 11012 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name p63BDB _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSTFDALSPSPAIPSNTDY PGPHSFDVSFQQSSTAKSAT WTYSTELKKLYCQIAKTCPI QIKVMTPPPQGAVIRAMPVY KKAEHVTEVVKRCPNHELSR EFNEGQIAPPSHLIRVEGNS HAQYVEDPITGRQSVLVPYE PPQVGTEFTTVLYNFMCNSS CVGGMNRRPILIIVTLETRD GQVLGRRCFEARICACPGRD RKADEDSIRKQQVSDSTKNG DAFRQNTHGIQMT ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 233 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'DNA binding domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 25883.586 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2RMN . "The Solution Structure Of The P63 Dna-Binding Domain" . . . . . 100.00 233 100.00 100.00 1.03e-172 . . . . 11012 1 2 no PDB 3QYM . "Structure Of P63 Dna Binding Domain In Complex With A 10 Base Pair AT Rich Response Element Half Site" . . . . . 85.41 203 99.50 99.50 1.11e-144 . . . . 11012 1 3 no PDB 3QYN . "Structure Of P63 Dna Binding Domain In Complex With A 22 Base Pair AT Rich Response Element Containing 2 Base Pair Spacer Betwe" . . . . . 85.41 203 99.50 99.50 1.11e-144 . . . . 11012 1 4 no PDB 3US0 . 'Structure Of P63 Dna Binding Domain In Complex With A 22 Base Pair AT Rich Response Element Containing A Two Base Pair "at" Spa' . . . . . 85.41 203 99.50 99.50 1.11e-144 . . . . 11012 1 5 no PDB 3US1 . 'Structure Of P63 Dna Binding Domain In Complex With A 22 Base Pair Response Element Containing A Two Base Pair "gc" Spacer Betw' . . . . . 85.41 203 99.50 99.50 1.11e-144 . . . . 11012 1 6 no PDB 3US2 . "Structure Of P63 Dna Binding Domain In Complex With A 19 Base Pair AT Rich Response Element Containing Two Half Sites With A Si" . . . . . 85.41 203 99.50 99.50 1.11e-144 . . . . 11012 1 7 no DBJ BAA32432 . "p73H [Mus musculus]" . . . . . 101.29 586 97.46 97.46 2.71e-164 . . . . 11012 1 8 no DBJ BAA32433 . "p73H [Homo sapiens]" . . . . . 101.29 586 97.03 97.03 5.15e-163 . . . . 11012 1 9 no DBJ BAA32592 . "p51A [Homo sapiens]" . . . . . 101.29 448 97.88 97.88 1.94e-166 . . . . 11012 1 10 no DBJ BAA32593 . "p51B [Homo sapiens]" . . . . . 101.29 641 97.88 97.88 4.00e-164 . . . . 11012 1 11 no DBJ BAB20631 . "DN p63 alpha [Gallus gallus]" . . . . . 99.57 582 99.14 99.14 6.88e-166 . . . . 11012 1 12 no EMBL CAA76562 . "KET protein [Homo sapiens]" . . . . . 101.29 680 97.88 97.88 3.11e-163 . . . . 11012 1 13 no EMBL CAB88216 . "TA2 KET alpha [Rattus norvegicus]" . . . . . 101.29 680 97.46 97.46 1.50e-162 . . . . 11012 1 14 no EMBL CAC37098 . "TA1 KET alpha protein [Rattus norvegicus]" . . . . . 101.29 663 97.46 97.46 8.94e-163 . . . . 11012 1 15 no EMBL CAC37099 . "DN KET alpha protein [Rattus norvegicus]" . . . . . 101.29 586 97.46 97.46 2.80e-164 . . . . 11012 1 16 no EMBL CAC37100 . "TA1 KET gamma protein [Rattus norvegicus]" . . . . . 101.29 470 97.46 97.46 1.69e-165 . . . . 11012 1 17 no GB AAC24830 . "p53 homolog [Homo sapiens]" . . . . . 101.29 356 97.46 97.46 1.57e-167 . . . . 11012 1 18 no GB AAC43038 . "CUSP [Homo sapiens]" . . . . . 101.29 586 97.88 97.88 3.32e-165 . . . . 11012 1 19 no GB AAC62633 . "TA p63 gamma [Homo sapiens]" . . . . . 101.29 448 97.88 97.88 1.94e-166 . . . . 11012 1 20 no GB AAC62634 . "DN p63 gamma [Homo sapiens]" . . . . . 101.29 393 97.88 97.88 6.37e-168 . . . . 11012 1 21 no GB AAC62635 . "TA p63 alpha [Homo sapiens]" . . . . . 101.29 641 97.88 97.88 3.51e-164 . . . . 11012 1 22 no REF NP_001079107 . "tumor protein p63 [Xenopus laevis]" . . . . . 99.57 365 96.98 99.57 1.81e-167 . . . . 11012 1 23 no REF NP_001108450 . "tumor protein 63 isoform 2 [Homo sapiens]" . . . . . 101.29 555 97.88 97.88 6.77e-165 . . . . 11012 1 24 no REF NP_001108451 . "tumor protein 63 isoform 3 [Homo sapiens]" . . . . . 101.29 487 97.88 97.88 9.40e-166 . . . . 11012 1 25 no REF NP_001108452 . "tumor protein 63 isoform 4 [Homo sapiens]" . . . . . 101.29 586 97.88 97.88 3.32e-165 . . . . 11012 1 26 no REF NP_001108453 . "tumor protein 63 isoform 5 [Homo sapiens]" . . . . . 101.29 461 97.88 97.88 3.09e-167 . . . . 11012 1 27 no SP O88898 . "RecName: Full=Tumor protein 63; Short=p63; AltName: Full=Transformation-related protein 63; Short=TP63; AltName: Full=Tumor pro" . . . . . 101.29 680 97.46 97.46 1.36e-162 . . . . 11012 1 28 no SP Q9H3D4 . "RecName: Full=Tumor protein 63; Short=p63; AltName: Full=Chronic ulcerative stomatitis protein; Short=CUSP; AltName: Full=Kerat" . . . . . 101.29 680 97.88 97.88 3.50e-163 . . . . 11012 1 29 no SP Q9JJP6 . "RecName: Full=Tumor protein 63; Short=p63; AltName: Full=Keratinocyte transcription factor KET; AltName: Full=Transformation-re" . . . . . 101.29 680 97.46 97.46 1.50e-162 . . . . 11012 1 30 no TPG DAA33389 . "TPA: tumor protein p63-like [Bos taurus]" . . . . . 101.29 680 97.88 97.88 2.94e-163 . . . . 11012 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 1 113 GLY . 11012 1 2 114 SER . 11012 1 3 115 SER . 11012 1 4 116 THR . 11012 1 5 117 PHE . 11012 1 6 118 ASP . 11012 1 7 119 ALA . 11012 1 8 120 LEU . 11012 1 9 121 SER . 11012 1 10 122 PRO . 11012 1 11 123 SER . 11012 1 12 124 PRO . 11012 1 13 125 ALA . 11012 1 14 126 ILE . 11012 1 15 127 PRO . 11012 1 16 128 SER . 11012 1 17 129 ASN . 11012 1 18 130 THR . 11012 1 19 131 ASP . 11012 1 20 132 TYR . 11012 1 21 133 PRO . 11012 1 22 134 GLY . 11012 1 23 135 PRO . 11012 1 24 136 HIS . 11012 1 25 137 SER . 11012 1 26 138 PHE . 11012 1 27 139 ASP . 11012 1 28 140 VAL . 11012 1 29 141 SER . 11012 1 30 142 PHE . 11012 1 31 143 GLN . 11012 1 32 144 GLN . 11012 1 33 145 SER . 11012 1 34 146 SER . 11012 1 35 147 THR . 11012 1 36 148 ALA . 11012 1 37 149 LYS . 11012 1 38 150 SER . 11012 1 39 151 ALA . 11012 1 40 152 THR . 11012 1 41 153 TRP . 11012 1 42 154 THR . 11012 1 43 155 TYR . 11012 1 44 156 SER . 11012 1 45 157 THR . 11012 1 46 158 GLU . 11012 1 47 159 LEU . 11012 1 48 160 LYS . 11012 1 49 161 LYS . 11012 1 50 162 LEU . 11012 1 51 163 TYR . 11012 1 52 164 CYS . 11012 1 53 165 GLN . 11012 1 54 166 ILE . 11012 1 55 167 ALA . 11012 1 56 168 LYS . 11012 1 57 169 THR . 11012 1 58 170 CYS . 11012 1 59 171 PRO . 11012 1 60 172 ILE . 11012 1 61 173 GLN . 11012 1 62 174 ILE . 11012 1 63 175 LYS . 11012 1 64 176 VAL . 11012 1 65 177 MET . 11012 1 66 178 THR . 11012 1 67 179 PRO . 11012 1 68 180 PRO . 11012 1 69 181 PRO . 11012 1 70 182 GLN . 11012 1 71 183 GLY . 11012 1 72 184 ALA . 11012 1 73 185 VAL . 11012 1 74 186 ILE . 11012 1 75 187 ARG . 11012 1 76 188 ALA . 11012 1 77 189 MET . 11012 1 78 190 PRO . 11012 1 79 191 VAL . 11012 1 80 192 TYR . 11012 1 81 193 LYS . 11012 1 82 194 LYS . 11012 1 83 195 ALA . 11012 1 84 196 GLU . 11012 1 85 197 HIS . 11012 1 86 198 VAL . 11012 1 87 199 THR . 11012 1 88 200 GLU . 11012 1 89 201 VAL . 11012 1 90 202 VAL . 11012 1 91 203 LYS . 11012 1 92 204 ARG . 11012 1 93 205 CYS . 11012 1 94 206 PRO . 11012 1 95 207 ASN . 11012 1 96 208 HIS . 11012 1 97 209 GLU . 11012 1 98 210 LEU . 11012 1 99 211 SER . 11012 1 100 212 ARG . 11012 1 101 213 GLU . 11012 1 102 214 PHE . 11012 1 103 215 ASN . 11012 1 104 216 GLU . 11012 1 105 217 GLY . 11012 1 106 218 GLN . 11012 1 107 219 ILE . 11012 1 108 220 ALA . 11012 1 109 221 PRO . 11012 1 110 222 PRO . 11012 1 111 223 SER . 11012 1 112 224 HIS . 11012 1 113 225 LEU . 11012 1 114 226 ILE . 11012 1 115 227 ARG . 11012 1 116 228 VAL . 11012 1 117 229 GLU . 11012 1 118 230 GLY . 11012 1 119 231 ASN . 11012 1 120 232 SER . 11012 1 121 233 HIS . 11012 1 122 234 ALA . 11012 1 123 235 GLN . 11012 1 124 236 TYR . 11012 1 125 237 VAL . 11012 1 126 238 GLU . 11012 1 127 239 ASP . 11012 1 128 240 PRO . 11012 1 129 241 ILE . 11012 1 130 242 THR . 11012 1 131 243 GLY . 11012 1 132 244 ARG . 11012 1 133 245 GLN . 11012 1 134 246 SER . 11012 1 135 247 VAL . 11012 1 136 248 LEU . 11012 1 137 249 VAL . 11012 1 138 250 PRO . 11012 1 139 251 TYR . 11012 1 140 252 GLU . 11012 1 141 253 PRO . 11012 1 142 254 PRO . 11012 1 143 255 GLN . 11012 1 144 256 VAL . 11012 1 145 257 GLY . 11012 1 146 258 THR . 11012 1 147 259 GLU . 11012 1 148 260 PHE . 11012 1 149 261 THR . 11012 1 150 262 THR . 11012 1 151 263 VAL . 11012 1 152 264 LEU . 11012 1 153 265 TYR . 11012 1 154 266 ASN . 11012 1 155 267 PHE . 11012 1 156 268 MET . 11012 1 157 269 CYS . 11012 1 158 270 ASN . 11012 1 159 271 SER . 11012 1 160 272 SER . 11012 1 161 273 CYS . 11012 1 162 274 VAL . 11012 1 163 275 GLY . 11012 1 164 276 GLY . 11012 1 165 277 MET . 11012 1 166 278 ASN . 11012 1 167 279 ARG . 11012 1 168 280 ARG . 11012 1 169 281 PRO . 11012 1 170 282 ILE . 11012 1 171 283 LEU . 11012 1 172 284 ILE . 11012 1 173 285 ILE . 11012 1 174 286 VAL . 11012 1 175 287 THR . 11012 1 176 288 LEU . 11012 1 177 289 GLU . 11012 1 178 290 THR . 11012 1 179 291 ARG . 11012 1 180 292 ASP . 11012 1 181 293 GLY . 11012 1 182 294 GLN . 11012 1 183 295 VAL . 11012 1 184 296 LEU . 11012 1 185 297 GLY . 11012 1 186 298 ARG . 11012 1 187 299 ARG . 11012 1 188 300 CYS . 11012 1 189 301 PHE . 11012 1 190 302 GLU . 11012 1 191 303 ALA . 11012 1 192 304 ARG . 11012 1 193 305 ILE . 11012 1 194 306 CYS . 11012 1 195 307 ALA . 11012 1 196 308 CYS . 11012 1 197 309 PRO . 11012 1 198 310 GLY . 11012 1 199 311 ARG . 11012 1 200 312 ASP . 11012 1 201 313 ARG . 11012 1 202 314 LYS . 11012 1 203 315 ALA . 11012 1 204 316 ASP . 11012 1 205 317 GLU . 11012 1 206 318 ASP . 11012 1 207 319 SER . 11012 1 208 320 ILE . 11012 1 209 321 ARG . 11012 1 210 322 LYS . 11012 1 211 323 GLN . 11012 1 212 324 GLN . 11012 1 213 325 VAL . 11012 1 214 326 SER . 11012 1 215 327 ASP . 11012 1 216 328 SER . 11012 1 217 329 THR . 11012 1 218 330 LYS . 11012 1 219 331 ASN . 11012 1 220 332 GLY . 11012 1 221 333 ASP . 11012 1 222 334 ALA . 11012 1 223 335 PHE . 11012 1 224 336 ARG . 11012 1 225 337 GLN . 11012 1 226 338 ASN . 11012 1 227 339 THR . 11012 1 228 340 HIS . 11012 1 229 341 GLY . 11012 1 230 342 ILE . 11012 1 231 343 GLN . 11012 1 232 344 MET . 11012 1 233 345 THR . 11012 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 11012 1 . SER 2 2 11012 1 . SER 3 3 11012 1 . THR 4 4 11012 1 . PHE 5 5 11012 1 . ASP 6 6 11012 1 . ALA 7 7 11012 1 . LEU 8 8 11012 1 . SER 9 9 11012 1 . PRO 10 10 11012 1 . SER 11 11 11012 1 . PRO 12 12 11012 1 . ALA 13 13 11012 1 . ILE 14 14 11012 1 . PRO 15 15 11012 1 . SER 16 16 11012 1 . ASN 17 17 11012 1 . THR 18 18 11012 1 . ASP 19 19 11012 1 . TYR 20 20 11012 1 . PRO 21 21 11012 1 . GLY 22 22 11012 1 . PRO 23 23 11012 1 . HIS 24 24 11012 1 . SER 25 25 11012 1 . PHE 26 26 11012 1 . ASP 27 27 11012 1 . VAL 28 28 11012 1 . SER 29 29 11012 1 . PHE 30 30 11012 1 . GLN 31 31 11012 1 . GLN 32 32 11012 1 . SER 33 33 11012 1 . SER 34 34 11012 1 . THR 35 35 11012 1 . ALA 36 36 11012 1 . LYS 37 37 11012 1 . SER 38 38 11012 1 . ALA 39 39 11012 1 . THR 40 40 11012 1 . TRP 41 41 11012 1 . THR 42 42 11012 1 . TYR 43 43 11012 1 . SER 44 44 11012 1 . THR 45 45 11012 1 . GLU 46 46 11012 1 . LEU 47 47 11012 1 . LYS 48 48 11012 1 . LYS 49 49 11012 1 . LEU 50 50 11012 1 . TYR 51 51 11012 1 . CYS 52 52 11012 1 . GLN 53 53 11012 1 . ILE 54 54 11012 1 . ALA 55 55 11012 1 . LYS 56 56 11012 1 . THR 57 57 11012 1 . CYS 58 58 11012 1 . PRO 59 59 11012 1 . ILE 60 60 11012 1 . GLN 61 61 11012 1 . ILE 62 62 11012 1 . LYS 63 63 11012 1 . VAL 64 64 11012 1 . MET 65 65 11012 1 . THR 66 66 11012 1 . PRO 67 67 11012 1 . PRO 68 68 11012 1 . PRO 69 69 11012 1 . GLN 70 70 11012 1 . GLY 71 71 11012 1 . ALA 72 72 11012 1 . VAL 73 73 11012 1 . ILE 74 74 11012 1 . ARG 75 75 11012 1 . ALA 76 76 11012 1 . MET 77 77 11012 1 . PRO 78 78 11012 1 . VAL 79 79 11012 1 . TYR 80 80 11012 1 . LYS 81 81 11012 1 . LYS 82 82 11012 1 . ALA 83 83 11012 1 . GLU 84 84 11012 1 . HIS 85 85 11012 1 . VAL 86 86 11012 1 . THR 87 87 11012 1 . GLU 88 88 11012 1 . VAL 89 89 11012 1 . VAL 90 90 11012 1 . LYS 91 91 11012 1 . ARG 92 92 11012 1 . CYS 93 93 11012 1 . PRO 94 94 11012 1 . ASN 95 95 11012 1 . HIS 96 96 11012 1 . GLU 97 97 11012 1 . LEU 98 98 11012 1 . SER 99 99 11012 1 . ARG 100 100 11012 1 . GLU 101 101 11012 1 . PHE 102 102 11012 1 . ASN 103 103 11012 1 . GLU 104 104 11012 1 . GLY 105 105 11012 1 . GLN 106 106 11012 1 . ILE 107 107 11012 1 . ALA 108 108 11012 1 . PRO 109 109 11012 1 . PRO 110 110 11012 1 . SER 111 111 11012 1 . HIS 112 112 11012 1 . LEU 113 113 11012 1 . ILE 114 114 11012 1 . ARG 115 115 11012 1 . VAL 116 116 11012 1 . GLU 117 117 11012 1 . GLY 118 118 11012 1 . ASN 119 119 11012 1 . SER 120 120 11012 1 . HIS 121 121 11012 1 . ALA 122 122 11012 1 . GLN 123 123 11012 1 . TYR 124 124 11012 1 . VAL 125 125 11012 1 . GLU 126 126 11012 1 . ASP 127 127 11012 1 . PRO 128 128 11012 1 . ILE 129 129 11012 1 . THR 130 130 11012 1 . GLY 131 131 11012 1 . ARG 132 132 11012 1 . GLN 133 133 11012 1 . SER 134 134 11012 1 . VAL 135 135 11012 1 . LEU 136 136 11012 1 . VAL 137 137 11012 1 . PRO 138 138 11012 1 . TYR 139 139 11012 1 . GLU 140 140 11012 1 . PRO 141 141 11012 1 . PRO 142 142 11012 1 . GLN 143 143 11012 1 . VAL 144 144 11012 1 . GLY 145 145 11012 1 . THR 146 146 11012 1 . GLU 147 147 11012 1 . PHE 148 148 11012 1 . THR 149 149 11012 1 . THR 150 150 11012 1 . VAL 151 151 11012 1 . LEU 152 152 11012 1 . TYR 153 153 11012 1 . ASN 154 154 11012 1 . PHE 155 155 11012 1 . MET 156 156 11012 1 . CYS 157 157 11012 1 . ASN 158 158 11012 1 . SER 159 159 11012 1 . SER 160 160 11012 1 . CYS 161 161 11012 1 . VAL 162 162 11012 1 . GLY 163 163 11012 1 . GLY 164 164 11012 1 . MET 165 165 11012 1 . ASN 166 166 11012 1 . ARG 167 167 11012 1 . ARG 168 168 11012 1 . PRO 169 169 11012 1 . ILE 170 170 11012 1 . LEU 171 171 11012 1 . ILE 172 172 11012 1 . ILE 173 173 11012 1 . VAL 174 174 11012 1 . THR 175 175 11012 1 . LEU 176 176 11012 1 . GLU 177 177 11012 1 . THR 178 178 11012 1 . ARG 179 179 11012 1 . ASP 180 180 11012 1 . GLY 181 181 11012 1 . GLN 182 182 11012 1 . VAL 183 183 11012 1 . LEU 184 184 11012 1 . GLY 185 185 11012 1 . ARG 186 186 11012 1 . ARG 187 187 11012 1 . CYS 188 188 11012 1 . PHE 189 189 11012 1 . GLU 190 190 11012 1 . ALA 191 191 11012 1 . ARG 192 192 11012 1 . ILE 193 193 11012 1 . CYS 194 194 11012 1 . ALA 195 195 11012 1 . CYS 196 196 11012 1 . PRO 197 197 11012 1 . GLY 198 198 11012 1 . ARG 199 199 11012 1 . ASP 200 200 11012 1 . ARG 201 201 11012 1 . LYS 202 202 11012 1 . ALA 203 203 11012 1 . ASP 204 204 11012 1 . GLU 205 205 11012 1 . ASP 206 206 11012 1 . SER 207 207 11012 1 . ILE 208 208 11012 1 . ARG 209 209 11012 1 . LYS 210 210 11012 1 . GLN 211 211 11012 1 . GLN 212 212 11012 1 . VAL 213 213 11012 1 . SER 214 214 11012 1 . ASP 215 215 11012 1 . SER 216 216 11012 1 . THR 217 217 11012 1 . LYS 218 218 11012 1 . ASN 219 219 11012 1 . GLY 220 220 11012 1 . ASP 221 221 11012 1 . ALA 222 222 11012 1 . PHE 223 223 11012 1 . ARG 224 224 11012 1 . GLN 225 225 11012 1 . ASN 226 226 11012 1 . THR 227 227 11012 1 . HIS 228 228 11012 1 . GLY 229 229 11012 1 . ILE 230 230 11012 1 . GLN 231 231 11012 1 . MET 232 232 11012 1 . THR 233 233 11012 1 stop_ save_ save_ZN _Entity.Sf_category entity _Entity.Sf_framecode ZN _Entity.Entry_ID 11012 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ZN . 11012 2 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 11012 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $p63BDB . 9606 organism . 'Homo sapiens' . . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . p63 . 11012 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 11012 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $p63BDB . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . p20020 . . 'p20020 is as modified pQ40 vector (Klein et al., J. Biol. Chem., 276, 49020-7.)' 11012 1 2 2 $ZN . 'obtained from a vendor' . . . . . . . . . . . . . . . . 11012 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 11012 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic . _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Wed Dec 20 05:48:03 2006 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/Zn/q+2 INCHI InChi 1 11012 ZN [Zn++] SMILES_CANONICAL CACTVS 2.87 11012 ZN [Zn+2] SMILES OpenEye/OEToolkits 1.4.2 11012 ZN [Zn+2] SMILES_CANONICAL OpenEye/OEToolkits 1.4.2 11012 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID 'zinc(+2) cation' 'SYSTEMATIC NAME' OpenEye/Lexichem 1.4 11012 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN . ZN . . ZN . N . 2 . . . . no no . . . . . . . . . . . . . . . 11012 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11012 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 p63BDB [U-15N] . . 1 $p63BDB . . 0.7 . . mM 0.1 . . . 11012 1 2 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 11012 1 3 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 11012 1 4 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 11012 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 11012 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 p63BDB '[U-13C; U-15N]' . . 1 $p63BDB . . 0.7 . . mM 0.1 . . . 11012 2 2 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 11012 2 3 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 11012 2 4 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 11012 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 11012 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 11012 1 pH 6.8 . pH 11012 1 pressure 1 . atm 11012 1 temperature 303 . K 11012 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 11012 _Software.ID 1 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 11012 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 11012 1 'data analysis' 11012 1 'peak picking' 11012 1 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 11012 _Software.ID 2 _Software.Name 'X-PLOR NIH' _Software.Version 2.16.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 11012 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11012 2 'structure solution' 11012 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 11012 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 11012 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 11012 3 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 11012 _Software.ID 4 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 11012 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11012 4 processing 11012 4 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 11012 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'with cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11012 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 11012 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _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 11012 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 900 'with cryoprobe' . . 11012 1 2 spectrometer_2 Bruker Avance . 900 . . . 11012 1 3 spectrometer_3 Bruker DMX . 600 . . . 11012 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 11012 _Experiment_list.ID 1 _Experiment_list.Details 'CNH-NOESY means 13C-HSQC-NOE-15N-HSQC' 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 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11012 1 2 '3D HNHB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11012 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11012 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11012 1 5 '3D CNH NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11012 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11012 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 11012 _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 DSS 'methyl protons' . . . . ppm 2.61 . indirect 0.251449530 . . . . . . . . . 11012 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . . . . . 11012 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11012 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 11012 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNHA' . . isotropic 11012 1 2 '3D HNHB' . . isotropic 11012 1 5 '3D CNH NOESY' . . isotropic 11012 1 6 '3D 1H-15N NOESY' . . isotropic 11012 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 11012 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 THR HA H 1 4.370 0.03 . 1 . . . . 116 THR HA . 11012 1 2 . 1 1 4 4 THR HB H 1 4.250 0.03 . 1 . . . . 116 THR HB . 11012 1 3 . 1 1 4 4 THR HG21 H 1 1.170 0.03 . 1 . . . . 116 THR HG2 . 11012 1 4 . 1 1 4 4 THR HG22 H 1 1.170 0.03 . 1 . . . . 116 THR HG2 . 11012 1 5 . 1 1 4 4 THR HG23 H 1 1.170 0.03 . 1 . . . . 116 THR HG2 . 11012 1 6 . 1 1 4 4 THR C C 13 174.500 0.1 . 1 . . . . 116 THR C . 11012 1 7 . 1 1 4 4 THR CA C 13 61.770 0.1 . 1 . . . . 116 THR CA . 11012 1 8 . 1 1 4 4 THR CB C 13 69.190 0.1 . 1 . . . . 116 THR CB . 11012 1 9 . 1 1 4 4 THR CG2 C 13 21.150 0.1 . 1 . . . . 116 THR CG2 . 11012 1 10 . 1 1 5 5 PHE H H 1 8.200 0.03 . 1 . . . . 117 PHE H . 11012 1 11 . 1 1 5 5 PHE HA H 1 4.606 0.03 . 1 . . . . 117 PHE HA . 11012 1 12 . 1 1 5 5 PHE HB2 H 1 3.220 0.03 . 2 . . . . 117 PHE HB2 . 11012 1 13 . 1 1 5 5 PHE HB3 H 1 3.100 0.03 . 2 . . . . 117 PHE HB3 . 11012 1 14 . 1 1 5 5 PHE C C 13 175.430 0.1 . 1 . . . . 117 PHE C . 11012 1 15 . 1 1 5 5 PHE CA C 13 57.640 0.1 . 1 . . . . 117 PHE CA . 11012 1 16 . 1 1 5 5 PHE CB C 13 38.790 0.1 . 1 . . . . 117 PHE CB . 11012 1 17 . 1 1 5 5 PHE N N 15 121.910 0.1 . 1 . . . . 117 PHE N . 11012 1 18 . 1 1 6 6 ASP H H 1 8.210 0.03 . 1 . . . . 118 ASP H . 11012 1 19 . 1 1 6 6 ASP HA H 1 4.570 0.03 . 1 . . . . 118 ASP HA . 11012 1 20 . 1 1 6 6 ASP HB2 H 1 2.600 0.03 . 2 . . . . 118 ASP HB2 . 11012 1 21 . 1 1 6 6 ASP HB3 H 1 2.680 0.03 . 2 . . . . 118 ASP HB3 . 11012 1 22 . 1 1 6 6 ASP C C 13 175.880 0.1 . 1 . . . . 118 ASP C . 11012 1 23 . 1 1 6 6 ASP CA C 13 53.860 0.1 . 1 . . . . 118 ASP CA . 11012 1 24 . 1 1 6 6 ASP CB C 13 40.900 0.1 . 1 . . . . 118 ASP CB . 11012 1 25 . 1 1 6 6 ASP N N 15 122.250 0.1 . 1 . . . . 118 ASP N . 11012 1 26 . 1 1 7 7 ALA H H 1 8.120 0.03 . 1 . . . . 119 ALA H . 11012 1 27 . 1 1 7 7 ALA HA H 1 4.270 0.03 . 1 . . . . 119 ALA HA . 11012 1 28 . 1 1 7 7 ALA HB1 H 1 1.420 0.03 . 1 . . . . 119 ALA HB . 11012 1 29 . 1 1 7 7 ALA HB2 H 1 1.420 0.03 . 1 . . . . 119 ALA HB . 11012 1 30 . 1 1 7 7 ALA HB3 H 1 1.420 0.03 . 1 . . . . 119 ALA HB . 11012 1 31 . 1 1 7 7 ALA C C 13 177.710 0.1 . 1 . . . . 119 ALA C . 11012 1 32 . 1 1 7 7 ALA CA C 13 52.350 0.1 . 1 . . . . 119 ALA CA . 11012 1 33 . 1 1 7 7 ALA CB C 13 18.720 0.1 . 1 . . . . 119 ALA CB . 11012 1 34 . 1 1 7 7 ALA N N 15 124.090 0.1 . 1 . . . . 119 ALA N . 11012 1 35 . 1 1 8 8 LEU H H 1 8.160 0.03 . 1 . . . . 120 LEU H . 11012 1 36 . 1 1 8 8 LEU HA H 1 4.380 0.03 . 1 . . . . 120 LEU HA . 11012 1 37 . 1 1 8 8 LEU HB2 H 1 1.710 0.03 . 2 . . . . 120 LEU HB2 . 11012 1 38 . 1 1 8 8 LEU HB3 H 1 1.620 0.03 . 2 . . . . 120 LEU HB3 . 11012 1 39 . 1 1 8 8 LEU HG H 1 1.650 0.03 . 1 . . . . 120 LEU HG . 11012 1 40 . 1 1 8 8 LEU HD11 H 1 0.890 0.03 . 2 . . . . 120 LEU HD1 . 11012 1 41 . 1 1 8 8 LEU HD12 H 1 0.890 0.03 . 2 . . . . 120 LEU HD1 . 11012 1 42 . 1 1 8 8 LEU HD13 H 1 0.890 0.03 . 2 . . . . 120 LEU HD1 . 11012 1 43 . 1 1 8 8 LEU HD21 H 1 0.950 0.03 . 2 . . . . 120 LEU HD2 . 11012 1 44 . 1 1 8 8 LEU HD22 H 1 0.950 0.03 . 2 . . . . 120 LEU HD2 . 11012 1 45 . 1 1 8 8 LEU HD23 H 1 0.950 0.03 . 2 . . . . 120 LEU HD2 . 11012 1 46 . 1 1 8 8 LEU CA C 13 54.620 0.1 . 1 . . . . 120 LEU CA . 11012 1 47 . 1 1 8 8 LEU CB C 13 41.860 0.1 . 1 . . . . 120 LEU CB . 11012 1 48 . 1 1 8 8 LEU CG C 13 26.590 0.1 . 1 . . . . 120 LEU CG . 11012 1 49 . 1 1 8 8 LEU CD1 C 13 22.920 0.1 . 2 . . . . 120 LEU CD1 . 11012 1 50 . 1 1 8 8 LEU CD2 C 13 24.600 0.1 . 2 . . . . 120 LEU CD2 . 11012 1 51 . 1 1 8 8 LEU N N 15 12 0.1 . 1 . . . . 120 LEU N . 11012 1 52 . 1 1 9 9 SER H H 1 8.110 0.03 . 1 . . . . 121 SER H . 11012 1 53 . 1 1 9 9 SER HA H 1 4.760 0.03 . 1 . . . . 121 SER HA . 11012 1 54 . 1 1 9 9 SER HB2 H 1 3.890 0.03 . 2 . . . . 121 SER HB2 . 11012 1 55 . 1 1 9 9 SER HB3 H 1 3.840 0.03 . 2 . . . . 121 SER HB3 . 11012 1 56 . 1 1 9 9 SER C C 13 172.560 0.1 . 1 . . . . 121 SER C . 11012 1 57 . 1 1 9 9 SER CA C 13 55.910 0.1 . 1 . . . . 121 SER CA . 11012 1 58 . 1 1 9 9 SER CB C 13 63.030 0.1 . 1 . . . . 121 SER CB . 11012 1 59 . 1 1 9 9 SER N N 15 117.460 0.1 . 1 . . . . 121 SER N . 11012 1 60 . 1 1 10 10 PRO HA H 1 4.490 0.03 . 1 . . . . 122 PRO HA . 11012 1 61 . 1 1 10 10 PRO HB2 H 1 2.297 0.03 . 2 . . . . 122 PRO HB2 . 11012 1 62 . 1 1 10 10 PRO HB3 H 1 1.930 0.03 . 2 . . . . 122 PRO HB3 . 11012 1 63 . 1 1 10 10 PRO HG2 H 1 2.053 0.03 . 2 . . . . 122 PRO HG2 . 11012 1 64 . 1 1 10 10 PRO HG3 H 1 2.016 0.03 . 2 . . . . 122 PRO HG3 . 11012 1 65 . 1 1 10 10 PRO HD2 H 1 3.815 0.03 . 2 . . . . 122 PRO HD2 . 11012 1 66 . 1 1 10 10 PRO HD3 H 1 3.738 0.03 . 2 . . . . 122 PRO HD3 . 11012 1 67 . 1 1 10 10 PRO C C 13 176.860 0.1 . 1 . . . . 122 PRO C . 11012 1 68 . 1 1 10 10 PRO CA C 13 62.790 0.1 . 1 . . . . 122 PRO CA . 11012 1 69 . 1 1 10 10 PRO CB C 13 31.695 0.1 . 1 . . . . 122 PRO CB . 11012 1 70 . 1 1 10 10 PRO CG C 13 26.880 0.1 . 1 . . . . 122 PRO CG . 11012 1 71 . 1 1 10 10 PRO CD C 13 50.328 0.1 . 1 . . . . 122 PRO CD . 11012 1 72 . 1 1 11 11 SER H H 1 8.370 0.03 . 1 . . . . 123 SER H . 11012 1 73 . 1 1 11 11 SER HA H 1 4.760 0.03 . 1 . . . . 123 SER HA . 11012 1 74 . 1 1 11 11 SER HB2 H 1 3.888 0.03 . 2 . . . . 123 SER HB2 . 11012 1 75 . 1 1 11 11 SER HB3 H 1 3.833 0.03 . 2 . . . . 123 SER HB3 . 11012 1 76 . 1 1 11 11 SER C C 13 172.836 0.1 . 1 . . . . 123 SER C . 11012 1 77 . 1 1 11 11 SER CA C 13 55.821 0.1 . 1 . . . . 123 SER CA . 11012 1 78 . 1 1 11 11 SER CB C 13 63.155 0.1 . 1 . . . . 123 SER CB . 11012 1 79 . 1 1 11 11 SER N N 15 117.215 0.1 . 1 . . . . 123 SER N . 11012 1 80 . 1 1 12 12 PRO HA H 1 4.440 0.03 . 1 . . . . 124 PRO HA . 11012 1 81 . 1 1 12 12 PRO HB2 H 1 2.292 0.03 . 2 . . . . 124 PRO HB2 . 11012 1 82 . 1 1 12 12 PRO HB3 H 1 1.920 0.03 . 2 . . . . 124 PRO HB3 . 11012 1 83 . 1 1 12 12 PRO HG2 H 1 2.014 0.03 . 1 . . . . 124 PRO HG2 . 11012 1 84 . 1 1 12 12 PRO HG3 H 1 2.014 0.03 . 1 . . . . 124 PRO HG3 . 11012 1 85 . 1 1 12 12 PRO C C 13 176.502 0.1 . 1 . . . . 124 PRO C . 11012 1 86 . 1 1 12 12 PRO CA C 13 62.785 0.1 . 1 . . . . 124 PRO CA . 11012 1 87 . 1 1 12 12 PRO CB C 13 31.697 0.1 . 1 . . . . 124 PRO CB . 11012 1 88 . 1 1 12 12 PRO CG C 13 26.982 0.1 . 1 . . . . 124 PRO CG . 11012 1 89 . 1 1 12 12 PRO CD C 13 50.220 0.1 . 1 . . . . 124 PRO CD . 11012 1 90 . 1 1 13 13 ALA H H 1 8.319 0.03 . 1 . . . . 125 ALA H . 11012 1 91 . 1 1 13 13 ALA HA H 1 4.271 0.03 . 1 . . . . 125 ALA HA . 11012 1 92 . 1 1 13 13 ALA HB1 H 1 1.372 0.03 . 1 . . . . 125 ALA HB . 11012 1 93 . 1 1 13 13 ALA HB2 H 1 1.372 0.03 . 1 . . . . 125 ALA HB . 11012 1 94 . 1 1 13 13 ALA HB3 H 1 1.372 0.03 . 1 . . . . 125 ALA HB . 11012 1 95 . 1 1 13 13 ALA C C 13 177.546 0.1 . 1 . . . . 125 ALA C . 11012 1 96 . 1 1 13 13 ALA CA C 13 52.217 0.1 . 1 . . . . 125 ALA CA . 11012 1 97 . 1 1 13 13 ALA CB C 13 18.548 0.1 . 1 . . . . 125 ALA CB . 11012 1 98 . 1 1 13 13 ALA N N 15 123.603 0.1 . 1 . . . . 125 ALA N . 11012 1 99 . 1 1 14 14 ILE H H 1 8.035 0.03 . 1 . . . . 126 ILE H . 11012 1 100 . 1 1 14 14 ILE HA H 1 4.400 0.03 . 1 . . . . 126 ILE HA . 11012 1 101 . 1 1 14 14 ILE HB H 1 1.848 0.03 . 1 . . . . 126 ILE HB . 11012 1 102 . 1 1 14 14 ILE HG12 H 1 1.142 0.03 . 1 . . . . 126 ILE HG12 . 11012 1 103 . 1 1 14 14 ILE HG13 H 1 1.496 0.03 . 1 . . . . 126 ILE HG13 . 11012 1 104 . 1 1 14 14 ILE HG21 H 1 1.496 0.03 . 1 . . . . 126 ILE HG2 . 11012 1 105 . 1 1 14 14 ILE HG22 H 1 1.496 0.03 . 1 . . . . 126 ILE HG2 . 11012 1 106 . 1 1 14 14 ILE HG23 H 1 1.496 0.03 . 1 . . . . 126 ILE HG2 . 11012 1 107 . 1 1 14 14 ILE HD11 H 1 0.833 0.03 . 1 . . . . 126 ILE HD1 . 11012 1 108 . 1 1 14 14 ILE HD12 H 1 0.833 0.03 . 1 . . . . 126 ILE HD1 . 11012 1 109 . 1 1 14 14 ILE HD13 H 1 0.833 0.03 . 1 . . . . 126 ILE HD1 . 11012 1 110 . 1 1 14 14 ILE C C 13 174.321 0.1 . 1 . . . . 126 ILE C . 11012 1 111 . 1 1 14 14 ILE CA C 13 57.642 0.1 . 1 . . . . 126 ILE CA . 11012 1 112 . 1 1 14 14 ILE CB C 13 38.421 0.1 . 1 . . . . 126 ILE CB . 11012 1 113 . 1 1 14 14 ILE CG1 C 13 26.624 0.1 . 1 . . . . 126 ILE CG1 . 11012 1 114 . 1 1 14 14 ILE CG2 C 13 17.000 0.1 . 1 . . . . 126 ILE CG2 . 11012 1 115 . 1 1 14 14 ILE CD1 C 13 12.300 0.1 . 1 . . . . 126 ILE CD1 . 11012 1 116 . 1 1 14 14 ILE N N 15 121.274 0.1 . 1 . . . . 126 ILE N . 11012 1 117 . 1 1 15 15 PRO HA H 1 4.357 0.03 . 1 . . . . 127 PRO HA . 11012 1 118 . 1 1 15 15 PRO HB2 H 1 1.745 0.03 . 1 . . . . 127 PRO HB2 . 11012 1 119 . 1 1 15 15 PRO HB3 H 1 2.247 0.03 . 1 . . . . 127 PRO HB3 . 11012 1 120 . 1 1 15 15 PRO HG2 H 1 1.921 0.03 . 1 . . . . 127 PRO HG2 . 11012 1 121 . 1 1 15 15 PRO HG3 H 1 1.921 0.03 . 1 . . . . 127 PRO HG3 . 11012 1 122 . 1 1 15 15 PRO HD2 H 1 3.902 0.03 . 1 . . . . 127 PRO HD2 . 11012 1 123 . 1 1 15 15 PRO HD3 H 1 3.483 0.03 . 1 . . . . 127 PRO HD3 . 11012 1 124 . 1 1 15 15 PRO C C 13 176.164 0.1 . 1 . . . . 127 PRO C . 11012 1 125 . 1 1 15 15 PRO CA C 13 62.382 0.1 . 1 . . . . 127 PRO CA . 11012 1 126 . 1 1 15 15 PRO CB C 13 31.644 0.1 . 1 . . . . 127 PRO CB . 11012 1 127 . 1 1 15 15 PRO CG C 13 27.239 0.1 . 1 . . . . 127 PRO CG . 11012 1 128 . 1 1 15 15 PRO CD C 13 50.392 0.1 . 1 . . . . 127 PRO CD . 11012 1 129 . 1 1 16 16 SER H H 1 8.270 0.03 . 1 . . . . 128 SER H . 11012 1 130 . 1 1 16 16 SER HA H 1 4.325 0.03 . 1 . . . . 128 SER HA . 11012 1 131 . 1 1 16 16 SER HB2 H 1 3.628 0.03 . 1 . . . . 128 SER HB2 . 11012 1 132 . 1 1 16 16 SER HB3 H 1 3.885 0.03 . 1 . . . . 128 SER HB3 . 11012 1 133 . 1 1 16 16 SER C C 13 174.569 0.1 . 1 . . . . 128 SER C . 11012 1 134 . 1 1 16 16 SER CA C 13 58.219 0.1 . 1 . . . . 128 SER CA . 11012 1 135 . 1 1 16 16 SER CB C 13 63.384 0.1 . 1 . . . . 128 SER CB . 11012 1 136 . 1 1 16 16 SER N N 15 116.891 0.1 . 1 . . . . 128 SER N . 11012 1 137 . 1 1 17 17 ASN H H 1 8.212 0.03 . 1 . . . . 129 ASN H . 11012 1 138 . 1 1 17 17 ASN HA H 1 4.861 0.03 . 1 . . . . 129 ASN HA . 11012 1 139 . 1 1 17 17 ASN HB2 H 1 2.533 0.03 . 1 . . . . 129 ASN HB2 . 11012 1 140 . 1 1 17 17 ASN HB3 H 1 3.114 0.03 . 1 . . . . 129 ASN HB3 . 11012 1 141 . 1 1 17 17 ASN HD21 H 1 7.067 0.03 . 1 . . . . 129 ASN HD21 . 11012 1 142 . 1 1 17 17 ASN HD22 H 1 6.763 0.03 . 1 . . . . 129 ASN HD22 . 11012 1 143 . 1 1 17 17 ASN C C 13 174.946 0.1 . 1 . . . . 129 ASN C . 11012 1 144 . 1 1 17 17 ASN CA C 13 51.724 0.1 . 1 . . . . 129 ASN CA . 11012 1 145 . 1 1 17 17 ASN CB C 13 37.904 0.1 . 1 . . . . 129 ASN CB . 11012 1 146 . 1 1 17 17 ASN N N 15 120.192 0.1 . 1 . . . . 129 ASN N . 11012 1 147 . 1 1 17 17 ASN ND2 N 15 110.550 0.1 . 1 . . . . 129 ASN ND2 . 11012 1 148 . 1 1 18 18 THR H H 1 7.644 0.03 . 1 . . . . 130 THR H . 11012 1 149 . 1 1 18 18 THR HA H 1 4.367 0.03 . 1 . . . . 130 THR HA . 11012 1 150 . 1 1 18 18 THR HB H 1 4.164 0.03 . 1 . . . . 130 THR HB . 11012 1 151 . 1 1 18 18 THR HG21 H 1 1.342 0.03 . 1 . . . . 130 THR HG2 . 11012 1 152 . 1 1 18 18 THR HG22 H 1 1.342 0.03 . 1 . . . . 130 THR HG2 . 11012 1 153 . 1 1 18 18 THR HG23 H 1 1.342 0.03 . 1 . . . . 130 THR HG2 . 11012 1 154 . 1 1 18 18 THR C C 13 174.809 0.1 . 1 . . . . 130 THR C . 11012 1 155 . 1 1 18 18 THR CA C 13 61.012 0.1 . 1 . . . . 130 THR CA . 11012 1 156 . 1 1 18 18 THR CB C 13 70.192 0.1 . 1 . . . . 130 THR CB . 11012 1 157 . 1 1 18 18 THR CG2 C 13 21.721 0.1 . 1 . . . . 130 THR CG2 . 11012 1 158 . 1 1 18 18 THR N N 15 112.067 0.1 . 1 . . . . 130 THR N . 11012 1 159 . 1 1 19 19 ASP H H 1 8.870 0.03 . 1 . . . . 131 ASP H . 11012 1 160 . 1 1 19 19 ASP HA H 1 4.725 0.03 . 1 . . . . 131 ASP HA . 11012 1 161 . 1 1 19 19 ASP HB2 H 1 2.944 0.03 . 1 . . . . 131 ASP HB2 . 11012 1 162 . 1 1 19 19 ASP HB3 H 1 2.686 0.03 . 1 . . . . 131 ASP HB3 . 11012 1 163 . 1 1 19 19 ASP C C 13 177.035 0.1 . 1 . . . . 131 ASP C . 11012 1 164 . 1 1 19 19 ASP CA C 13 55.219 0.1 . 1 . . . . 131 ASP CA . 11012 1 165 . 1 1 19 19 ASP CB C 13 41.478 0.1 . 1 . . . . 131 ASP CB . 11012 1 166 . 1 1 19 19 ASP N N 15 125.978 0.1 . 1 . . . . 131 ASP N . 11012 1 167 . 1 1 20 20 TYR H H 1 9.740 0.03 . 1 . . . . 132 TYR H . 11012 1 168 . 1 1 20 20 TYR HA H 1 5.345 0.03 . 1 . . . . 132 TYR HA . 11012 1 169 . 1 1 20 20 TYR HB2 H 1 2.941 0.03 . 1 . . . . 132 TYR HB2 . 11012 1 170 . 1 1 20 20 TYR HB3 H 1 3.162 0.03 . 1 . . . . 132 TYR HB3 . 11012 1 171 . 1 1 20 20 TYR HD1 H 1 7.012 0.03 . 1 . . . . 132 TYR HD1 . 11012 1 172 . 1 1 20 20 TYR HD2 H 1 7.012 0.03 . 1 . . . . 132 TYR HD2 . 11012 1 173 . 1 1 20 20 TYR HE1 H 1 6.830 0.03 . 1 . . . . 132 TYR HE1 . 11012 1 174 . 1 1 20 20 TYR HE2 H 1 6.830 0.03 . 1 . . . . 132 TYR HE2 . 11012 1 175 . 1 1 20 20 TYR C C 13 172.104 0.1 . 1 . . . . 132 TYR C . 11012 1 176 . 1 1 20 20 TYR CA C 13 53.394 0.1 . 1 . . . . 132 TYR CA . 11012 1 177 . 1 1 20 20 TYR CB C 13 40.408 0.1 . 1 . . . . 132 TYR CB . 11012 1 178 . 1 1 20 20 TYR N N 15 121.900 0.1 . 1 . . . . 132 TYR N . 11012 1 179 . 1 1 21 21 PRO HA H 1 4.572 0.03 . 1 . . . . 133 PRO HA . 11012 1 180 . 1 1 21 21 PRO HB2 H 1 2.139 0.03 . 1 . . . . 133 PRO HB2 . 11012 1 181 . 1 1 21 21 PRO HB3 H 1 2.487 0.03 . 1 . . . . 133 PRO HB3 . 11012 1 182 . 1 1 21 21 PRO HG2 H 1 2.090 0.03 . 1 . . . . 133 PRO HG2 . 11012 1 183 . 1 1 21 21 PRO HG3 H 1 2.346 0.03 . 1 . . . . 133 PRO HG3 . 11012 1 184 . 1 1 21 21 PRO HD2 H 1 4.030 0.03 . 1 . . . . 133 PRO HD2 . 11012 1 185 . 1 1 21 21 PRO HD3 H 1 3.753 0.03 . 1 . . . . 133 PRO HD3 . 11012 1 186 . 1 1 21 21 PRO C C 13 179.329 0.1 . 1 . . . . 133 PRO C . 11012 1 187 . 1 1 21 21 PRO CA C 13 64.466 0.1 . 1 . . . . 133 PRO CA . 11012 1 188 . 1 1 21 21 PRO CB C 13 31.779 0.1 . 1 . . . . 133 PRO CB . 11012 1 189 . 1 1 21 21 PRO CG C 13 27.613 0.1 . 1 . . . . 133 PRO CG . 11012 1 190 . 1 1 21 21 PRO CD C 13 49.857 0.1 . 1 . . . . 133 PRO CD . 11012 1 191 . 1 1 22 22 GLY H H 1 7.376 0.03 . 1 . . . . 134 GLY H . 11012 1 192 . 1 1 22 22 GLY HA2 H 1 3.171 0.03 . 1 . . . . 134 GLY HA2 . 11012 1 193 . 1 1 22 22 GLY HA3 H 1 4.390 0.03 . 1 . . . . 134 GLY HA3 . 11012 1 194 . 1 1 22 22 GLY CA C 13 44.932 0.1 . 1 . . . . 134 GLY CA . 11012 1 195 . 1 1 22 22 GLY N N 15 101.648 0.1 . 1 . . . . 134 GLY N . 11012 1 196 . 1 1 23 23 PRO HA H 1 4.190 0.03 . 1 . . . . 135 PRO HA . 11012 1 197 . 1 1 23 23 PRO HB2 H 1 1.238 0.03 . 1 . . . . 135 PRO HB2 . 11012 1 198 . 1 1 23 23 PRO HB3 H 1 2.163 0.03 . 1 . . . . 135 PRO HB3 . 11012 1 199 . 1 1 23 23 PRO HG2 H 1 1.720 0.03 . 1 . . . . 135 PRO HG2 . 11012 1 200 . 1 1 23 23 PRO HG3 H 1 2.042 0.03 . 1 . . . . 135 PRO HG3 . 11012 1 201 . 1 1 23 23 PRO HD2 H 1 4.202 0.03 . 1 . . . . 135 PRO HD2 . 11012 1 202 . 1 1 23 23 PRO HD3 H 1 3.492 0.03 . 1 . . . . 135 PRO HD3 . 11012 1 203 . 1 1 23 23 PRO C C 13 177.835 0.1 . 1 . . . . 135 PRO C . 11012 1 204 . 1 1 23 23 PRO CA C 13 63.596 0.1 . 1 . . . . 135 PRO CA . 11012 1 205 . 1 1 23 23 PRO CB C 13 31.331 0.1 . 1 . . . . 135 PRO CB . 11012 1 206 . 1 1 23 23 PRO CG C 13 26.606 0.1 . 1 . . . . 135 PRO CG . 11012 1 207 . 1 1 23 23 PRO CD C 13 49.078 0.1 . 1 . . . . 135 PRO CD . 11012 1 208 . 1 1 24 24 HIS H H 1 8.970 0.03 . 1 . . . . 136 HIS H . 11012 1 209 . 1 1 24 24 HIS HA H 1 4.706 0.03 . 1 . . . . 136 HIS HA . 11012 1 210 . 1 1 24 24 HIS HB2 H 1 3.621 0.03 . 1 . . . . 136 HIS HB2 . 11012 1 211 . 1 1 24 24 HIS HB3 H 1 3.024 0.03 . 1 . . . . 136 HIS HB3 . 11012 1 212 . 1 1 24 24 HIS C C 13 174.748 0.1 . 1 . . . . 136 HIS C . 11012 1 213 . 1 1 24 24 HIS CA C 13 54.560 0.1 . 1 . . . . 136 HIS CA . 11012 1 214 . 1 1 24 24 HIS CB C 13 26.507 0.1 . 1 . . . . 136 HIS CB . 11012 1 215 . 1 1 24 24 HIS N N 15 116.766 0.1 . 1 . . . . 136 HIS N . 11012 1 216 . 1 1 25 25 SER H H 1 7.945 0.03 . 1 . . . . 137 SER H . 11012 1 217 . 1 1 25 25 SER HA H 1 3.482 0.03 . 1 . . . . 137 SER HA . 11012 1 218 . 1 1 25 25 SER HB2 H 1 4.058 0.03 . 1 . . . . 137 SER HB2 . 11012 1 219 . 1 1 25 25 SER HB3 H 1 3.928 0.03 . 1 . . . . 137 SER HB3 . 11012 1 220 . 1 1 25 25 SER C C 13 172.108 0.1 . 1 . . . . 137 SER C . 11012 1 221 . 1 1 25 25 SER CA C 13 58.619 0.1 . 1 . . . . 137 SER CA . 11012 1 222 . 1 1 25 25 SER CB C 13 60.772 0.1 . 1 . . . . 137 SER CB . 11012 1 223 . 1 1 25 25 SER N N 15 115.669 0.1 . 1 . . . . 137 SER N . 11012 1 224 . 1 1 26 26 PHE H H 1 8.539 0.03 . 1 . . . . 138 PHE H . 11012 1 225 . 1 1 26 26 PHE HA H 1 5.028 0.03 . 1 . . . . 138 PHE HA . 11012 1 226 . 1 1 26 26 PHE HB2 H 1 3.157 0.03 . 2 . . . . 138 PHE HB2 . 11012 1 227 . 1 1 26 26 PHE HB3 H 1 3.101 0.03 . 2 . . . . 138 PHE HB3 . 11012 1 228 . 1 1 26 26 PHE HD1 H 1 7.000 0.03 . 1 . . . . 138 PHE HD1 . 11012 1 229 . 1 1 26 26 PHE HD2 H 1 7.000 0.03 . 1 . . . . 138 PHE HD2 . 11012 1 230 . 1 1 26 26 PHE C C 13 174.370 0.1 . 1 . . . . 138 PHE C . 11012 1 231 . 1 1 26 26 PHE CA C 13 56.894 0.1 . 1 . . . . 138 PHE CA . 11012 1 232 . 1 1 26 26 PHE CB C 13 40.387 0.1 . 1 . . . . 138 PHE CB . 11012 1 233 . 1 1 26 26 PHE N N 15 121.712 0.1 . 1 . . . . 138 PHE N . 11012 1 234 . 1 1 27 27 ASP H H 1 9.073 0.03 . 1 . . . . 139 ASP H . 11012 1 235 . 1 1 27 27 ASP HA H 1 4.672 0.03 . 1 . . . . 139 ASP HA . 11012 1 236 . 1 1 27 27 ASP HB2 H 1 2.466 0.03 . 1 . . . . 139 ASP HB2 . 11012 1 237 . 1 1 27 27 ASP HB3 H 1 2.493 0.03 . 1 . . . . 139 ASP HB3 . 11012 1 238 . 1 1 27 27 ASP C C 13 173.555 0.1 . 1 . . . . 139 ASP C . 11012 1 239 . 1 1 27 27 ASP CA C 13 52.817 0.1 . 1 . . . . 139 ASP CA . 11012 1 240 . 1 1 27 27 ASP CB C 13 44.628 0.1 . 1 . . . . 139 ASP CB . 11012 1 241 . 1 1 27 27 ASP N N 15 129.768 0.1 . 1 . . . . 139 ASP N . 11012 1 242 . 1 1 28 28 VAL H H 1 7.973 0.03 . 1 . . . . 140 VAL H . 11012 1 243 . 1 1 28 28 VAL HA H 1 4.905 0.03 . 1 . . . . 140 VAL HA . 11012 1 244 . 1 1 28 28 VAL HB H 1 1.520 0.03 . 1 . . . . 140 VAL HB . 11012 1 245 . 1 1 28 28 VAL HG11 H 1 0.521 0.03 . 2 . . . . 140 VAL HG1 . 11012 1 246 . 1 1 28 28 VAL HG12 H 1 0.521 0.03 . 2 . . . . 140 VAL HG1 . 11012 1 247 . 1 1 28 28 VAL HG13 H 1 0.521 0.03 . 2 . . . . 140 VAL HG1 . 11012 1 248 . 1 1 28 28 VAL HG21 H 1 0.499 0.03 . 2 . . . . 140 VAL HG2 . 11012 1 249 . 1 1 28 28 VAL HG22 H 1 0.499 0.03 . 2 . . . . 140 VAL HG2 . 11012 1 250 . 1 1 28 28 VAL HG23 H 1 0.499 0.03 . 2 . . . . 140 VAL HG2 . 11012 1 251 . 1 1 28 28 VAL C C 13 174.564 0.1 . 1 . . . . 140 VAL C . 11012 1 252 . 1 1 28 28 VAL CA C 13 58.974 0.1 . 1 . . . . 140 VAL CA . 11012 1 253 . 1 1 28 28 VAL CB C 13 34.072 0.1 . 1 . . . . 140 VAL CB . 11012 1 254 . 1 1 28 28 VAL CG1 C 13 20.315 0.1 . 2 . . . . 140 VAL CG1 . 11012 1 255 . 1 1 28 28 VAL CG2 C 13 20.988 0.1 . 2 . . . . 140 VAL CG2 . 11012 1 256 . 1 1 28 28 VAL N N 15 118.731 0.1 . 1 . . . . 140 VAL N . 11012 1 257 . 1 1 29 29 SER H H 1 8.963 0.03 . 1 . . . . 141 SER H . 11012 1 258 . 1 1 29 29 SER HA H 1 4.335 0.03 . 1 . . . . 141 SER HA . 11012 1 259 . 1 1 29 29 SER HB2 H 1 3.679 0.03 . 1 . . . . 141 SER HB2 . 11012 1 260 . 1 1 29 29 SER HB3 H 1 3.558 0.03 . 1 . . . . 141 SER HB3 . 11012 1 261 . 1 1 29 29 SER C C 13 170.278 0.1 . 1 . . . . 141 SER C . 11012 1 262 . 1 1 29 29 SER CA C 13 56.379 0.1 . 1 . . . . 141 SER CA . 11012 1 263 . 1 1 29 29 SER CB C 13 65.393 0.1 . 1 . . . . 141 SER CB . 11012 1 264 . 1 1 29 29 SER N N 15 119.818 0.1 . 1 . . . . 141 SER N . 11012 1 265 . 1 1 30 30 PHE H H 1 7.964 0.03 . 1 . . . . 142 PHE H . 11012 1 266 . 1 1 30 30 PHE HA H 1 4.588 0.03 . 1 . . . . 142 PHE HA . 11012 1 267 . 1 1 30 30 PHE HB2 H 1 3.017 0.03 . 1 . . . . 142 PHE HB2 . 11012 1 268 . 1 1 30 30 PHE HB3 H 1 2.328 0.03 . 1 . . . . 142 PHE HB3 . 11012 1 269 . 1 1 30 30 PHE HD1 H 1 6.111 0.03 . 1 . . . . 142 PHE HD1 . 11012 1 270 . 1 1 30 30 PHE HD2 H 1 6.111 0.03 . 1 . . . . 142 PHE HD2 . 11012 1 271 . 1 1 30 30 PHE HE1 H 1 7.079 0.03 . 1 . . . . 142 PHE HE1 . 11012 1 272 . 1 1 30 30 PHE HE2 H 1 7.079 0.03 . 1 . . . . 142 PHE HE2 . 11012 1 273 . 1 1 30 30 PHE C C 13 176.640 0.1 . 1 . . . . 142 PHE C . 11012 1 274 . 1 1 30 30 PHE CA C 13 56.074 0.1 . 1 . . . . 142 PHE CA . 11012 1 275 . 1 1 30 30 PHE CB C 13 40.976 0.1 . 1 . . . . 142 PHE CB . 11012 1 276 . 1 1 30 30 PHE N N 15 117.197 0.1 . 1 . . . . 142 PHE N . 11012 1 277 . 1 1 31 31 GLN H H 1 8.895 0.03 . 1 . . . . 143 GLN H . 11012 1 278 . 1 1 31 31 GLN HA H 1 4.308 0.03 . 1 . . . . 143 GLN HA . 11012 1 279 . 1 1 31 31 GLN HB2 H 1 2.027 0.03 . 1 . . . . 143 GLN HB2 . 11012 1 280 . 1 1 31 31 GLN HB3 H 1 2.147 0.03 . 1 . . . . 143 GLN HB3 . 11012 1 281 . 1 1 31 31 GLN HG2 H 1 2.256 0.03 . 1 . . . . 143 GLN HG2 . 11012 1 282 . 1 1 31 31 GLN HG3 H 1 2.256 0.03 . 1 . . . . 143 GLN HG3 . 11012 1 283 . 1 1 31 31 GLN C C 13 175.346 0.1 . 1 . . . . 143 GLN C . 11012 1 284 . 1 1 31 31 GLN CA C 13 55.629 0.1 . 1 . . . . 143 GLN CA . 11012 1 285 . 1 1 31 31 GLN CB C 13 29.103 0.1 . 1 . . . . 143 GLN CB . 11012 1 286 . 1 1 31 31 GLN CG C 13 33.346 0.1 . 1 . . . . 143 GLN CG . 11012 1 287 . 1 1 31 31 GLN N N 15 122.374 0.1 . 1 . . . . 143 GLN N . 11012 1 288 . 1 1 32 32 GLN H H 1 8.637 0.03 . 1 . . . . 144 GLN H . 11012 1 289 . 1 1 32 32 GLN HA H 1 4.482 0.03 . 1 . . . . 144 GLN HA . 11012 1 290 . 1 1 32 32 GLN HB2 H 1 2.218 0.03 . 2 . . . . 144 GLN HB2 . 11012 1 291 . 1 1 32 32 GLN HB3 H 1 2.124 0.03 . 2 . . . . 144 GLN HB3 . 11012 1 292 . 1 1 32 32 GLN HG2 H 1 2.456 0.03 . 1 . . . . 144 GLN HG2 . 11012 1 293 . 1 1 32 32 GLN HG3 H 1 2.456 0.03 . 1 . . . . 144 GLN HG3 . 11012 1 294 . 1 1 32 32 GLN C C 13 175.864 0.1 . 1 . . . . 144 GLN C . 11012 1 295 . 1 1 32 32 GLN CA C 13 55.966 0.1 . 1 . . . . 144 GLN CA . 11012 1 296 . 1 1 32 32 GLN CB C 13 29.134 0.1 . 1 . . . . 144 GLN CB . 11012 1 297 . 1 1 32 32 GLN CG C 13 33.360 0.1 . 1 . . . . 144 GLN CG . 11012 1 298 . 1 1 32 32 GLN N N 15 121.482 0.1 . 1 . . . . 144 GLN N . 11012 1 299 . 1 1 33 33 SER H H 1 8.410 0.03 . 1 . . . . 145 SER H . 11012 1 300 . 1 1 33 33 SER C C 13 174.923 0.1 . 1 . . . . 145 SER C . 11012 1 301 . 1 1 33 33 SER CA C 13 57.811 0.1 . 1 . . . . 145 SER CA . 11012 1 302 . 1 1 33 33 SER N N 15 117.685 0.1 . 1 . . . . 145 SER N . 11012 1 303 . 1 1 34 34 SER H H 1 8.767 0.03 . 1 . . . . 146 SER H . 11012 1 304 . 1 1 34 34 SER HA H 1 4.603 0.03 . 1 . . . . 146 SER HA . 11012 1 305 . 1 1 34 34 SER C C 13 177.118 0.1 . 1 . . . . 146 SER C . 11012 1 306 . 1 1 34 34 SER CA C 13 60.670 0.1 . 1 . . . . 146 SER CA . 11012 1 307 . 1 1 34 34 SER N N 15 116.390 0.1 . 1 . . . . 146 SER N . 11012 1 308 . 1 1 35 35 THR H H 1 7.649 0.03 . 1 . . . . 147 THR H . 11012 1 309 . 1 1 35 35 THR HA H 1 4.337 0.03 . 1 . . . . 147 THR HA . 11012 1 310 . 1 1 35 35 THR HB H 1 4.466 0.03 . 1 . . . . 147 THR HB . 11012 1 311 . 1 1 35 35 THR HG21 H 1 1.175 0.03 . 1 . . . . 147 THR HG2 . 11012 1 312 . 1 1 35 35 THR HG22 H 1 1.175 0.03 . 1 . . . . 147 THR HG2 . 11012 1 313 . 1 1 35 35 THR HG23 H 1 1.175 0.03 . 1 . . . . 147 THR HG2 . 11012 1 314 . 1 1 35 35 THR C C 13 174.329 0.1 . 1 . . . . 147 THR C . 11012 1 315 . 1 1 35 35 THR CA C 13 61.103 0.1 . 1 . . . . 147 THR CA . 11012 1 316 . 1 1 35 35 THR CB C 13 68.421 0.1 . 1 . . . . 147 THR CB . 11012 1 317 . 1 1 35 35 THR CG2 C 13 21.330 0.1 . 1 . . . . 147 THR CG2 . 11012 1 318 . 1 1 35 35 THR N N 15 112.407 0.1 . 1 . . . . 147 THR N . 11012 1 319 . 1 1 36 36 ALA H H 1 8.007 0.03 . 1 . . . . 148 ALA H . 11012 1 320 . 1 1 36 36 ALA HA H 1 4.330 0.03 . 1 . . . . 148 ALA HA . 11012 1 321 . 1 1 36 36 ALA HB1 H 1 1.345 0.03 . 1 . . . . 148 ALA HB . 11012 1 322 . 1 1 36 36 ALA HB2 H 1 1.345 0.03 . 1 . . . . 148 ALA HB . 11012 1 323 . 1 1 36 36 ALA HB3 H 1 1.345 0.03 . 1 . . . . 148 ALA HB . 11012 1 324 . 1 1 36 36 ALA C C 13 178.425 0.1 . 1 . . . . 148 ALA C . 11012 1 325 . 1 1 36 36 ALA CA C 13 52.323 0.1 . 1 . . . . 148 ALA CA . 11012 1 326 . 1 1 36 36 ALA CB C 13 18.714 0.1 . 1 . . . . 148 ALA CB . 11012 1 327 . 1 1 36 36 ALA N N 15 125.086 0.1 . 1 . . . . 148 ALA N . 11012 1 328 . 1 1 37 37 LYS H H 1 8.485 0.03 . 1 . . . . 149 LYS H . 11012 1 329 . 1 1 37 37 LYS HA H 1 5.067 0.03 . 1 . . . . 149 LYS HA . 11012 1 330 . 1 1 37 37 LYS C C 13 177.062 0.1 . 1 . . . . 149 LYS C . 11012 1 331 . 1 1 37 37 LYS CA C 13 57.580 0.1 . 1 . . . . 149 LYS CA . 11012 1 332 . 1 1 37 37 LYS N N 15 121.093 0.1 . 1 . . . . 149 LYS N . 11012 1 333 . 1 1 38 38 SER H H 1 7.966 0.03 . 1 . . . . 150 SER H . 11012 1 334 . 1 1 38 38 SER HA H 1 4.434 0.03 . 1 . . . . 150 SER HA . 11012 1 335 . 1 1 38 38 SER HB2 H 1 3.847 0.03 . 2 . . . . 150 SER HB2 . 11012 1 336 . 1 1 38 38 SER HB3 H 1 3.999 0.03 . 2 . . . . 150 SER HB3 . 11012 1 337 . 1 1 38 38 SER C C 13 174.370 0.1 . 1 . . . . 150 SER C . 11012 1 338 . 1 1 38 38 SER CA C 13 57.249 0.1 . 1 . . . . 150 SER CA . 11012 1 339 . 1 1 38 38 SER CB C 13 63.029 0.1 . 1 . . . . 150 SER CB . 11012 1 340 . 1 1 38 38 SER N N 15 112.769 0.1 . 1 . . . . 150 SER N . 11012 1 341 . 1 1 39 39 ALA H H 1 7.854 0.03 . 1 . . . . 151 ALA H . 11012 1 342 . 1 1 39 39 ALA HA H 1 4.353 0.03 . 1 . . . . 151 ALA HA . 11012 1 343 . 1 1 39 39 ALA HB1 H 1 1.419 0.03 . 1 . . . . 151 ALA HB . 11012 1 344 . 1 1 39 39 ALA HB2 H 1 1.419 0.03 . 1 . . . . 151 ALA HB . 11012 1 345 . 1 1 39 39 ALA HB3 H 1 1.419 0.03 . 1 . . . . 151 ALA HB . 11012 1 346 . 1 1 39 39 ALA C C 13 178.488 0.1 . 1 . . . . 151 ALA C . 11012 1 347 . 1 1 39 39 ALA CA C 13 52.527 0.1 . 1 . . . . 151 ALA CA . 11012 1 348 . 1 1 39 39 ALA CB C 13 18.466 0.1 . 1 . . . . 151 ALA CB . 11012 1 349 . 1 1 39 39 ALA N N 15 125.574 0.1 . 1 . . . . 151 ALA N . 11012 1 350 . 1 1 40 40 THR H H 1 8.495 0.03 . 1 . . . . 152 THR H . 11012 1 351 . 1 1 40 40 THR HA H 1 4.279 0.03 . 1 . . . . 152 THR HA . 11012 1 352 . 1 1 40 40 THR HB H 1 4.515 0.03 . 1 . . . . 152 THR HB . 11012 1 353 . 1 1 40 40 THR HG21 H 1 1.459 0.03 . 1 . . . . 152 THR HG2 . 11012 1 354 . 1 1 40 40 THR HG22 H 1 1.459 0.03 . 1 . . . . 152 THR HG2 . 11012 1 355 . 1 1 40 40 THR HG23 H 1 1.459 0.03 . 1 . . . . 152 THR HG2 . 11012 1 356 . 1 1 40 40 THR C C 13 173.433 0.1 . 1 . . . . 152 THR C . 11012 1 357 . 1 1 40 40 THR CA C 13 62.682 0.1 . 1 . . . . 152 THR CA . 11012 1 358 . 1 1 40 40 THR CB C 13 69.096 0.1 . 1 . . . . 152 THR CB . 11012 1 359 . 1 1 40 40 THR CG2 C 13 22.371 0.1 . 1 . . . . 152 THR CG2 . 11012 1 360 . 1 1 40 40 THR N N 15 111.808 0.1 . 1 . . . . 152 THR N . 11012 1 361 . 1 1 41 41 TRP H H 1 7.210 0.03 . 1 . . . . 153 TRP H . 11012 1 362 . 1 1 41 41 TRP HA H 1 5.530 0.03 . 1 . . . . 153 TRP HA . 11012 1 363 . 1 1 41 41 TRP HB2 H 1 3.578 0.03 . 1 . . . . 153 TRP HB2 . 11012 1 364 . 1 1 41 41 TRP HB3 H 1 3.776 0.03 . 1 . . . . 153 TRP HB3 . 11012 1 365 . 1 1 41 41 TRP HD1 H 1 7.515 0.03 . 1 . . . . 153 TRP HD1 . 11012 1 366 . 1 1 41 41 TRP HE1 H 1 10.359 0.03 . 1 . . . . 153 TRP HE1 . 11012 1 367 . 1 1 41 41 TRP HZ2 H 1 7.511 0.03 . 1 . . . . 153 TRP HZ2 . 11012 1 368 . 1 1 41 41 TRP C C 13 173.815 0.1 . 1 . . . . 153 TRP C . 11012 1 369 . 1 1 41 41 TRP CA C 13 55.034 0.1 . 1 . . . . 153 TRP CA . 11012 1 370 . 1 1 41 41 TRP CB C 13 31.081 0.1 . 1 . . . . 153 TRP CB . 11012 1 371 . 1 1 41 41 TRP N N 15 114.677 0.1 . 1 . . . . 153 TRP N . 11012 1 372 . 1 1 41 41 TRP NE1 N 15 129.490 0.1 . 1 . . . . 153 TRP NE1 . 11012 1 373 . 1 1 42 42 THR H H 1 9.716 0.03 . 1 . . . . 154 THR H . 11012 1 374 . 1 1 42 42 THR HA H 1 4.176 0.03 . 1 . . . . 154 THR HA . 11012 1 375 . 1 1 42 42 THR HB H 1 4.120 0.03 . 1 . . . . 154 THR HB . 11012 1 376 . 1 1 42 42 THR HG21 H 1 0.852 0.03 . 1 . . . . 154 THR HG2 . 11012 1 377 . 1 1 42 42 THR HG22 H 1 0.852 0.03 . 1 . . . . 154 THR HG2 . 11012 1 378 . 1 1 42 42 THR HG23 H 1 0.852 0.03 . 1 . . . . 154 THR HG2 . 11012 1 379 . 1 1 42 42 THR C C 13 170.301 0.1 . 1 . . . . 154 THR C . 11012 1 380 . 1 1 42 42 THR CA C 13 61.308 0.1 . 1 . . . . 154 THR CA . 11012 1 381 . 1 1 42 42 THR CB C 13 68.163 0.1 . 1 . . . . 154 THR CB . 11012 1 382 . 1 1 42 42 THR CG2 C 13 19.879 0.1 . 1 . . . . 154 THR CG2 . 11012 1 383 . 1 1 42 42 THR N N 15 114.683 0.1 . 1 . . . . 154 THR N . 11012 1 384 . 1 1 43 43 TYR H H 1 8.618 0.03 . 1 . . . . 155 TYR H . 11012 1 385 . 1 1 43 43 TYR HA H 1 5.435 0.03 . 1 . . . . 155 TYR HA . 11012 1 386 . 1 1 43 43 TYR HB2 H 1 2.361 0.03 . 1 . . . . 155 TYR HB2 . 11012 1 387 . 1 1 43 43 TYR HB3 H 1 2.927 0.03 . 1 . . . . 155 TYR HB3 . 11012 1 388 . 1 1 43 43 TYR HE1 H 1 6.360 0.03 . 1 . . . . 155 TYR HE1 . 11012 1 389 . 1 1 43 43 TYR HE2 H 1 6.360 0.03 . 1 . . . . 155 TYR HE2 . 11012 1 390 . 1 1 43 43 TYR C C 13 174.063 0.1 . 1 . . . . 155 TYR C . 11012 1 391 . 1 1 43 43 TYR CA C 13 56.224 0.1 . 1 . . . . 155 TYR CA . 11012 1 392 . 1 1 43 43 TYR CB C 13 41.820 0.1 . 1 . . . . 155 TYR CB . 11012 1 393 . 1 1 43 43 TYR N N 15 128.224 0.1 . 1 . . . . 155 TYR N . 11012 1 394 . 1 1 44 44 SER H H 1 8.582 0.03 . 1 . . . . 156 SER H . 11012 1 395 . 1 1 44 44 SER HA H 1 4.557 0.03 . 1 . . . . 156 SER HA . 11012 1 396 . 1 1 44 44 SER HB2 H 1 3.829 0.03 . 1 . . . . 156 SER HB2 . 11012 1 397 . 1 1 44 44 SER HB3 H 1 4.035 0.03 . 1 . . . . 156 SER HB3 . 11012 1 398 . 1 1 44 44 SER C C 13 175.367 0.1 . 1 . . . . 156 SER C . 11012 1 399 . 1 1 44 44 SER CA C 13 55.314 0.1 . 1 . . . . 156 SER CA . 11012 1 400 . 1 1 44 44 SER CB C 13 63.833 0.1 . 1 . . . . 156 SER CB . 11012 1 401 . 1 1 44 44 SER N N 15 120.323 0.1 . 1 . . . . 156 SER N . 11012 1 402 . 1 1 45 45 THR H H 1 8.380 0.03 . 1 . . . . 157 THR H . 11012 1 403 . 1 1 45 45 THR HA H 1 4.081 0.03 . 1 . . . . 157 THR HA . 11012 1 404 . 1 1 45 45 THR HB H 1 4.345 0.03 . 1 . . . . 157 THR HB . 11012 1 405 . 1 1 45 45 THR HG21 H 1 1.548 0.03 . 1 . . . . 157 THR HG2 . 11012 1 406 . 1 1 45 45 THR HG22 H 1 1.548 0.03 . 1 . . . . 157 THR HG2 . 11012 1 407 . 1 1 45 45 THR HG23 H 1 1.548 0.03 . 1 . . . . 157 THR HG2 . 11012 1 408 . 1 1 45 45 THR C C 13 177.469 0.1 . 1 . . . . 157 THR C . 11012 1 409 . 1 1 45 45 THR CA C 13 64.399 0.1 . 1 . . . . 157 THR CA . 11012 1 410 . 1 1 45 45 THR CB C 13 68.016 0.1 . 1 . . . . 157 THR CB . 11012 1 411 . 1 1 45 45 THR CG2 C 13 21.821 0.1 . 1 . . . . 157 THR CG2 . 11012 1 412 . 1 1 45 45 THR N N 15 123.865 0.1 . 1 . . . . 157 THR N . 11012 1 413 . 1 1 46 46 GLU H H 1 8.591 0.03 . 1 . . . . 158 GLU H . 11012 1 414 . 1 1 46 46 GLU HA H 1 4.081 0.03 . 1 . . . . 158 GLU HA . 11012 1 415 . 1 1 46 46 GLU HB2 H 1 1.965 0.03 . 2 . . . . 158 GLU HB2 . 11012 1 416 . 1 1 46 46 GLU HB3 H 1 1.891 0.03 . 2 . . . . 158 GLU HB3 . 11012 1 417 . 1 1 46 46 GLU HG2 H 1 2.289 0.03 . 2 . . . . 158 GLU HG2 . 11012 1 418 . 1 1 46 46 GLU HG3 H 1 2.297 0.03 . 2 . . . . 158 GLU HG3 . 11012 1 419 . 1 1 46 46 GLU C C 13 178.142 0.1 . 1 . . . . 158 GLU C . 11012 1 420 . 1 1 46 46 GLU CA C 13 58.944 0.1 . 1 . . . . 158 GLU CA . 11012 1 421 . 1 1 46 46 GLU CB C 13 29.687 0.1 . 1 . . . . 158 GLU CB . 11012 1 422 . 1 1 46 46 GLU CG C 13 36.020 0.1 . 1 . . . . 158 GLU CG . 11012 1 423 . 1 1 46 46 GLU N N 15 122.376 0.1 . 1 . . . . 158 GLU N . 11012 1 424 . 1 1 47 47 LEU H H 1 7.562 0.03 . 1 . . . . 159 LEU H . 11012 1 425 . 1 1 47 47 LEU HA H 1 4.335 0.03 . 1 . . . . 159 LEU HA . 11012 1 426 . 1 1 47 47 LEU HB2 H 1 1.570 0.03 . 1 . . . . 159 LEU HB2 . 11012 1 427 . 1 1 47 47 LEU HB3 H 1 1.570 0.03 . 1 . . . . 159 LEU HB3 . 11012 1 428 . 1 1 47 47 LEU HG H 1 1.592 0.03 . 1 . . . . 159 LEU HG . 11012 1 429 . 1 1 47 47 LEU HD11 H 1 0.963 0.03 . 1 . . . . 159 LEU HD1 . 11012 1 430 . 1 1 47 47 LEU HD12 H 1 0.963 0.03 . 1 . . . . 159 LEU HD1 . 11012 1 431 . 1 1 47 47 LEU HD13 H 1 0.963 0.03 . 1 . . . . 159 LEU HD1 . 11012 1 432 . 1 1 47 47 LEU HD21 H 1 0.866 0.03 . 1 . . . . 159 LEU HD2 . 11012 1 433 . 1 1 47 47 LEU HD22 H 1 0.866 0.03 . 1 . . . . 159 LEU HD2 . 11012 1 434 . 1 1 47 47 LEU HD23 H 1 0.866 0.03 . 1 . . . . 159 LEU HD2 . 11012 1 435 . 1 1 47 47 LEU C C 13 176.003 0.1 . 1 . . . . 159 LEU C . 11012 1 436 . 1 1 47 47 LEU CA C 13 53.860 0.1 . 1 . . . . 159 LEU CA . 11012 1 437 . 1 1 47 47 LEU CB C 13 42.030 0.1 . 1 . . . . 159 LEU CB . 11012 1 438 . 1 1 47 47 LEU CG C 13 27.254 0.1 . 1 . . . . 159 LEU CG . 11012 1 439 . 1 1 47 47 LEU CD1 C 13 26.199 0.1 . 1 . . . . 159 LEU CD1 . 11012 1 440 . 1 1 47 47 LEU CD2 C 13 22.502 0.1 . 1 . . . . 159 LEU CD2 . 11012 1 441 . 1 1 47 47 LEU N N 15 115.079 0.1 . 1 . . . . 159 LEU N . 11012 1 442 . 1 1 48 48 LYS H H 1 7.692 0.03 . 1 . . . . 160 LYS H . 11012 1 443 . 1 1 48 48 LYS HA H 1 3.983 0.03 . 1 . . . . 160 LYS HA . 11012 1 444 . 1 1 48 48 LYS HB2 H 1 2.151 0.03 . 2 . . . . 160 LYS HB2 . 11012 1 445 . 1 1 48 48 LYS HB3 H 1 2.112 0.03 . 2 . . . . 160 LYS HB3 . 11012 1 446 . 1 1 48 48 LYS HG2 H 1 1.667 0.03 . 2 . . . . 160 LYS HG2 . 11012 1 447 . 1 1 48 48 LYS HG3 H 1 1.623 0.03 . 2 . . . . 160 LYS HG3 . 11012 1 448 . 1 1 48 48 LYS HD2 H 1 1.987 0.03 . 2 . . . . 160 LYS HD2 . 11012 1 449 . 1 1 48 48 LYS HD3 H 1 1.940 0.03 . 2 . . . . 160 LYS HD3 . 11012 1 450 . 1 1 48 48 LYS HE2 H 1 3.269 0.03 . 1 . . . . 160 LYS HE2 . 11012 1 451 . 1 1 48 48 LYS HE3 H 1 3.269 0.03 . 1 . . . . 160 LYS HE3 . 11012 1 452 . 1 1 48 48 LYS C C 13 174.695 0.1 . 1 . . . . 160 LYS C . 11012 1 453 . 1 1 48 48 LYS CA C 13 56.802 0.1 . 1 . . . . 160 LYS CA . 11012 1 454 . 1 1 48 48 LYS CB C 13 29.620 0.1 . 1 . . . . 160 LYS CB . 11012 1 455 . 1 1 48 48 LYS CG C 13 24.978 0.1 . 1 . . . . 160 LYS CG . 11012 1 456 . 1 1 48 48 LYS CD C 13 29.694 0.1 . 1 . . . . 160 LYS CD . 11012 1 457 . 1 1 48 48 LYS CE C 13 42.091 0.1 . 1 . . . . 160 LYS CE . 11012 1 458 . 1 1 48 48 LYS N N 15 120.902 0.1 . 1 . . . . 160 LYS N . 11012 1 459 . 1 1 49 49 LYS H H 1 7.036 0.03 . 1 . . . . 161 LYS H . 11012 1 460 . 1 1 49 49 LYS HA H 1 5.054 0.03 . 1 . . . . 161 LYS HA . 11012 1 461 . 1 1 49 49 LYS HB2 H 1 1.159 0.03 . 1 . . . . 161 LYS HB2 . 11012 1 462 . 1 1 49 49 LYS HB3 H 1 1.536 0.03 . 1 . . . . 161 LYS HB3 . 11012 1 463 . 1 1 49 49 LYS HG2 H 1 1.230 0.03 . 1 . . . . 161 LYS HG2 . 11012 1 464 . 1 1 49 49 LYS HG3 H 1 1.230 0.03 . 1 . . . . 161 LYS HG3 . 11012 1 465 . 1 1 49 49 LYS C C 13 171.977 0.1 . 1 . . . . 161 LYS C . 11012 1 466 . 1 1 49 49 LYS CA C 13 54.484 0.1 . 1 . . . . 161 LYS CA . 11012 1 467 . 1 1 49 49 LYS CB C 13 38.445 0.1 . 1 . . . . 161 LYS CB . 11012 1 468 . 1 1 49 49 LYS CG C 13 24.453 0.1 . 1 . . . . 161 LYS CG . 11012 1 469 . 1 1 49 49 LYS N N 15 119.291 0.1 . 1 . . . . 161 LYS N . 11012 1 470 . 1 1 50 50 LEU H H 1 9.286 0.03 . 1 . . . . 162 LEU H . 11012 1 471 . 1 1 50 50 LEU HA H 1 4.742 0.03 . 1 . . . . 162 LEU HA . 11012 1 472 . 1 1 50 50 LEU HB2 H 1 1.929 0.03 . 1 . . . . 162 LEU HB2 . 11012 1 473 . 1 1 50 50 LEU HB3 H 1 1.180 0.03 . 1 . . . . 162 LEU HB3 . 11012 1 474 . 1 1 50 50 LEU HG H 1 1.439 0.03 . 1 . . . . 162 LEU HG . 11012 1 475 . 1 1 50 50 LEU HD11 H 1 0.915 0.03 . 1 . . . . 162 LEU HD1 . 11012 1 476 . 1 1 50 50 LEU HD12 H 1 0.915 0.03 . 1 . . . . 162 LEU HD1 . 11012 1 477 . 1 1 50 50 LEU HD13 H 1 0.915 0.03 . 1 . . . . 162 LEU HD1 . 11012 1 478 . 1 1 50 50 LEU HD21 H 1 0.937 0.03 . 1 . . . . 162 LEU HD2 . 11012 1 479 . 1 1 50 50 LEU HD22 H 1 0.937 0.03 . 1 . . . . 162 LEU HD2 . 11012 1 480 . 1 1 50 50 LEU HD23 H 1 0.937 0.03 . 1 . . . . 162 LEU HD2 . 11012 1 481 . 1 1 50 50 LEU C C 13 173.356 0.1 . 1 . . . . 162 LEU C . 11012 1 482 . 1 1 50 50 LEU CA C 13 53.539 0.1 . 1 . . . . 162 LEU CA . 11012 1 483 . 1 1 50 50 LEU CB C 13 44.689 0.1 . 1 . . . . 162 LEU CB . 11012 1 484 . 1 1 50 50 LEU CG C 13 27.752 0.1 . 1 . . . . 162 LEU CG . 11012 1 485 . 1 1 50 50 LEU CD1 C 13 22.562 0.1 . 1 . . . . 162 LEU CD1 . 11012 1 486 . 1 1 50 50 LEU CD2 C 13 26.104 0.1 . 1 . . . . 162 LEU CD2 . 11012 1 487 . 1 1 50 50 LEU N N 15 129.223 0.1 . 1 . . . . 162 LEU N . 11012 1 488 . 1 1 51 51 TYR H H 1 9.290 0.03 . 1 . . . . 163 TYR H . 11012 1 489 . 1 1 51 51 TYR HA H 1 5.683 0.03 . 1 . . . . 163 TYR HA . 11012 1 490 . 1 1 51 51 TYR HB2 H 1 3.042 0.03 . 1 . . . . 163 TYR HB2 . 11012 1 491 . 1 1 51 51 TYR HB3 H 1 2.591 0.03 . 1 . . . . 163 TYR HB3 . 11012 1 492 . 1 1 51 51 TYR HD1 H 1 7.080 0.03 . 1 . . . . 163 TYR HD1 . 11012 1 493 . 1 1 51 51 TYR HD2 H 1 7.080 0.03 . 1 . . . . 163 TYR HD2 . 11012 1 494 . 1 1 51 51 TYR HE1 H 1 6.130 0.03 . 1 . . . . 163 TYR HE1 . 11012 1 495 . 1 1 51 51 TYR HE2 H 1 6.130 0.03 . 1 . . . . 163 TYR HE2 . 11012 1 496 . 1 1 51 51 TYR C C 13 175.751 0.1 . 1 . . . . 163 TYR C . 11012 1 497 . 1 1 51 51 TYR CA C 13 54.902 0.1 . 1 . . . . 163 TYR CA . 11012 1 498 . 1 1 51 51 TYR CB C 13 39.857 0.1 . 1 . . . . 163 TYR CB . 11012 1 499 . 1 1 51 51 TYR N N 15 125.054 0.1 . 1 . . . . 163 TYR N . 11012 1 500 . 1 1 52 52 CYS H H 1 9.232 0.03 . 1 . . . . 164 CYS H . 11012 1 501 . 1 1 52 52 CYS HA H 1 5.604 0.03 . 1 . . . . 164 CYS HA . 11012 1 502 . 1 1 52 52 CYS HB2 H 1 3.106 0.03 . 2 . . . . 164 CYS HB2 . 11012 1 503 . 1 1 52 52 CYS HB3 H 1 3.059 0.03 . 2 . . . . 164 CYS HB3 . 11012 1 504 . 1 1 52 52 CYS C C 13 172.079 0.1 . 1 . . . . 164 CYS C . 11012 1 505 . 1 1 52 52 CYS CA C 13 56.432 0.1 . 1 . . . . 164 CYS CA . 11012 1 506 . 1 1 52 52 CYS CB C 13 31.570 0.1 . 1 . . . . 164 CYS CB . 11012 1 507 . 1 1 52 52 CYS N N 15 119.971 0.1 . 1 . . . . 164 CYS N . 11012 1 508 . 1 1 53 53 GLN H H 1 8.313 0.03 . 1 . . . . 165 GLN H . 11012 1 509 . 1 1 53 53 GLN HA H 1 5.204 0.03 . 1 . . . . 165 GLN HA . 11012 1 510 . 1 1 53 53 GLN HB2 H 1 2.211 0.03 . 1 . . . . 165 GLN HB2 . 11012 1 511 . 1 1 53 53 GLN HB3 H 1 2.211 0.03 . 1 . . . . 165 GLN HB3 . 11012 1 512 . 1 1 53 53 GLN HG2 H 1 2.744 0.03 . 2 . . . . 165 GLN HG2 . 11012 1 513 . 1 1 53 53 GLN HG3 H 1 2.644 0.03 . 2 . . . . 165 GLN HG3 . 11012 1 514 . 1 1 53 53 GLN HE21 H 1 7.394 0.03 . 1 . . . . 165 GLN HE21 . 11012 1 515 . 1 1 53 53 GLN HE22 H 1 6.889 0.03 . 1 . . . . 165 GLN HE22 . 11012 1 516 . 1 1 53 53 GLN C C 13 176.957 0.1 . 1 . . . . 165 GLN C . 11012 1 517 . 1 1 53 53 GLN CA C 13 54.817 0.1 . 1 . . . . 165 GLN CA . 11012 1 518 . 1 1 53 53 GLN CB C 13 31.329 0.1 . 1 . . . . 165 GLN CB . 11012 1 519 . 1 1 53 53 GLN CG C 13 34.612 0.1 . 1 . . . . 165 GLN CG . 11012 1 520 . 1 1 53 53 GLN N N 15 121.451 0.1 . 1 . . . . 165 GLN N . 11012 1 521 . 1 1 53 53 GLN NE2 N 15 109.754 0.1 . 1 . . . . 165 GLN NE2 . 11012 1 522 . 1 1 54 54 ILE H H 1 8.756 0.03 . 1 . . . . 166 ILE H . 11012 1 523 . 1 1 54 54 ILE HA H 1 3.940 0.03 . 1 . . . . 166 ILE HA . 11012 1 524 . 1 1 54 54 ILE HB H 1 1.765 0.03 . 1 . . . . 166 ILE HB . 11012 1 525 . 1 1 54 54 ILE HG12 H 1 0.694 0.03 . 1 . . . . 166 ILE HG12 . 11012 1 526 . 1 1 54 54 ILE HG13 H 1 1.271 0.03 . 1 . . . . 166 ILE HG13 . 11012 1 527 . 1 1 54 54 ILE HG21 H 1 0.943 0.03 . 1 . . . . 166 ILE HG2 . 11012 1 528 . 1 1 54 54 ILE HG22 H 1 0.943 0.03 . 1 . . . . 166 ILE HG2 . 11012 1 529 . 1 1 54 54 ILE HG23 H 1 0.943 0.03 . 1 . . . . 166 ILE HG2 . 11012 1 530 . 1 1 54 54 ILE HD11 H 1 0.361 0.03 . 1 . . . . 166 ILE HD1 . 11012 1 531 . 1 1 54 54 ILE HD12 H 1 0.361 0.03 . 1 . . . . 166 ILE HD1 . 11012 1 532 . 1 1 54 54 ILE HD13 H 1 0.361 0.03 . 1 . . . . 166 ILE HD1 . 11012 1 533 . 1 1 54 54 ILE C C 13 174.562 0.1 . 1 . . . . 166 ILE C . 11012 1 534 . 1 1 54 54 ILE CA C 13 61.208 0.1 . 1 . . . . 166 ILE CA . 11012 1 535 . 1 1 54 54 ILE CB C 13 37.388 0.1 . 1 . . . . 166 ILE CB . 11012 1 536 . 1 1 54 54 ILE CG1 C 13 28.771 0.1 . 1 . . . . 166 ILE CG1 . 11012 1 537 . 1 1 54 54 ILE CG2 C 13 15.458 0.1 . 1 . . . . 166 ILE CG2 . 11012 1 538 . 1 1 54 54 ILE CD1 C 13 13.169 0.1 . 1 . . . . 166 ILE CD1 . 11012 1 539 . 1 1 54 54 ILE N N 15 123.824 0.1 . 1 . . . . 166 ILE N . 11012 1 540 . 1 1 55 55 ALA H H 1 8.740 0.03 . 1 . . . . 167 ALA H . 11012 1 541 . 1 1 55 55 ALA HA H 1 3.538 0.03 . 1 . . . . 167 ALA HA . 11012 1 542 . 1 1 55 55 ALA HB1 H 1 0.965 0.03 . 1 . . . . 167 ALA HB . 11012 1 543 . 1 1 55 55 ALA HB2 H 1 0.965 0.03 . 1 . . . . 167 ALA HB . 11012 1 544 . 1 1 55 55 ALA HB3 H 1 0.965 0.03 . 1 . . . . 167 ALA HB . 11012 1 545 . 1 1 55 55 ALA C C 13 175.957 0.1 . 1 . . . . 167 ALA C . 11012 1 546 . 1 1 55 55 ALA CA C 13 54.250 0.1 . 1 . . . . 167 ALA CA . 11012 1 547 . 1 1 55 55 ALA CB C 13 18.473 0.1 . 1 . . . . 167 ALA CB . 11012 1 548 . 1 1 55 55 ALA N N 15 123.310 0.1 . 1 . . . . 167 ALA N . 11012 1 549 . 1 1 56 56 LYS H H 1 7.527 0.03 . 1 . . . . 168 LYS H . 11012 1 550 . 1 1 56 56 LYS HA H 1 4.748 0.03 . 1 . . . . 168 LYS HA . 11012 1 551 . 1 1 56 56 LYS HB2 H 1 2.047 0.03 . 1 . . . . 168 LYS HB2 . 11012 1 552 . 1 1 56 56 LYS HB3 H 1 2.047 0.03 . 1 . . . . 168 LYS HB3 . 11012 1 553 . 1 1 56 56 LYS HD2 H 1 1.943 0.03 . 2 . . . . 168 LYS HD2 . 11012 1 554 . 1 1 56 56 LYS HD3 H 1 1.823 0.03 . 2 . . . . 168 LYS HD3 . 11012 1 555 . 1 1 56 56 LYS HE2 H 1 3.209 0.03 . 2 . . . . 168 LYS HE2 . 11012 1 556 . 1 1 56 56 LYS HE3 H 1 3.179 0.03 . 2 . . . . 168 LYS HE3 . 11012 1 557 . 1 1 56 56 LYS C C 13 177.268 0.1 . 1 . . . . 168 LYS C . 11012 1 558 . 1 1 56 56 LYS CA C 13 53.839 0.1 . 1 . . . . 168 LYS CA . 11012 1 559 . 1 1 56 56 LYS CB C 13 33.766 0.1 . 1 . . . . 168 LYS CB . 11012 1 560 . 1 1 56 56 LYS CG C 13 24.637 0.1 . 1 . . . . 168 LYS CG . 11012 1 561 . 1 1 56 56 LYS CD C 13 27.967 0.1 . 1 . . . . 168 LYS CD . 11012 1 562 . 1 1 56 56 LYS CE C 13 42.330 0.1 . 1 . . . . 168 LYS CE . 11012 1 563 . 1 1 56 56 LYS N N 15 117.878 0.1 . 1 . . . . 168 LYS N . 11012 1 564 . 1 1 57 57 THR H H 1 8.124 0.03 . 1 . . . . 169 THR H . 11012 1 565 . 1 1 57 57 THR HA H 1 3.512 0.03 . 1 . . . . 169 THR HA . 11012 1 566 . 1 1 57 57 THR HB H 1 3.828 0.03 . 1 . . . . 169 THR HB . 11012 1 567 . 1 1 57 57 THR HG21 H 1 1.115 0.03 . 1 . . . . 169 THR HG2 . 11012 1 568 . 1 1 57 57 THR HG22 H 1 1.115 0.03 . 1 . . . . 169 THR HG2 . 11012 1 569 . 1 1 57 57 THR HG23 H 1 1.115 0.03 . 1 . . . . 169 THR HG2 . 11012 1 570 . 1 1 57 57 THR C C 13 174.061 0.1 . 1 . . . . 169 THR C . 11012 1 571 . 1 1 57 57 THR CA C 13 65.247 0.1 . 1 . . . . 169 THR CA . 11012 1 572 . 1 1 57 57 THR CB C 13 68.989 0.1 . 1 . . . . 169 THR CB . 11012 1 573 . 1 1 57 57 THR CG2 C 13 23.497 0.1 . 1 . . . . 169 THR CG2 . 11012 1 574 . 1 1 57 57 THR N N 15 117.573 0.1 . 1 . . . . 169 THR N . 11012 1 575 . 1 1 58 58 CYS H H 1 9.168 0.03 . 1 . . . . 170 CYS H . 11012 1 576 . 1 1 58 58 CYS HA H 1 4.568 0.03 . 1 . . . . 170 CYS HA . 11012 1 577 . 1 1 58 58 CYS HB2 H 1 2.759 0.03 . 1 . . . . 170 CYS HB2 . 11012 1 578 . 1 1 58 58 CYS HB3 H 1 2.981 0.03 . 1 . . . . 170 CYS HB3 . 11012 1 579 . 1 1 58 58 CYS C C 13 171.845 0.1 . 1 . . . . 170 CYS C . 11012 1 580 . 1 1 58 58 CYS CA C 13 55.350 0.1 . 1 . . . . 170 CYS CA . 11012 1 581 . 1 1 58 58 CYS CB C 13 27.797 0.1 . 1 . . . . 170 CYS CB . 11012 1 582 . 1 1 58 58 CYS N N 15 127.908 0.1 . 1 . . . . 170 CYS N . 11012 1 583 . 1 1 59 59 PRO HA H 1 4.769 0.03 . 1 . . . . 171 PRO HA . 11012 1 584 . 1 1 59 59 PRO HB2 H 1 2.160 0.03 . 2 . . . . 171 PRO HB2 . 11012 1 585 . 1 1 59 59 PRO HB3 H 1 1.660 0.03 . 2 . . . . 171 PRO HB3 . 11012 1 586 . 1 1 59 59 PRO HG2 H 1 1.990 0.03 . 2 . . . . 171 PRO HG2 . 11012 1 587 . 1 1 59 59 PRO HG3 H 1 1.760 0.03 . 2 . . . . 171 PRO HG3 . 11012 1 588 . 1 1 59 59 PRO HD2 H 1 2.780 0.03 . 1 . . . . 171 PRO HD2 . 11012 1 589 . 1 1 59 59 PRO HD3 H 1 3.380 0.03 . 1 . . . . 171 PRO HD3 . 11012 1 590 . 1 1 59 59 PRO C C 13 175.380 0.1 . 1 . . . . 171 PRO C . 11012 1 591 . 1 1 59 59 PRO CA C 13 61.090 0.1 . 1 . . . . 171 PRO CA . 11012 1 592 . 1 1 59 59 PRO CB C 13 31.210 0.1 . 1 . . . . 171 PRO CB . 11012 1 593 . 1 1 59 59 PRO CG C 13 26.530 0.1 . 1 . . . . 171 PRO CG . 11012 1 594 . 1 1 59 59 PRO CD C 13 49.600 0.1 . 1 . . . . 171 PRO CD . 11012 1 595 . 1 1 60 60 ILE H H 1 8.927 0.03 . 1 . . . . 172 ILE H . 11012 1 596 . 1 1 60 60 ILE HA H 1 3.724 0.03 . 1 . . . . 172 ILE HA . 11012 1 597 . 1 1 60 60 ILE HB H 1 1.595 0.03 . 1 . . . . 172 ILE HB . 11012 1 598 . 1 1 60 60 ILE HG12 H 1 0.911 0.03 . 1 . . . . 172 ILE HG12 . 11012 1 599 . 1 1 60 60 ILE HG13 H 1 1.330 0.03 . 1 . . . . 172 ILE HG13 . 11012 1 600 . 1 1 60 60 ILE HG21 H 1 0.507 0.03 . 1 . . . . 172 ILE HG2 . 11012 1 601 . 1 1 60 60 ILE HG22 H 1 0.507 0.03 . 1 . . . . 172 ILE HG2 . 11012 1 602 . 1 1 60 60 ILE HG23 H 1 0.507 0.03 . 1 . . . . 172 ILE HG2 . 11012 1 603 . 1 1 60 60 ILE HD11 H 1 0.781 0.03 . 1 . . . . 172 ILE HD1 . 11012 1 604 . 1 1 60 60 ILE HD12 H 1 0.781 0.03 . 1 . . . . 172 ILE HD1 . 11012 1 605 . 1 1 60 60 ILE HD13 H 1 0.781 0.03 . 1 . . . . 172 ILE HD1 . 11012 1 606 . 1 1 60 60 ILE C C 13 174.048 0.1 . 1 . . . . 172 ILE C . 11012 1 607 . 1 1 60 60 ILE CA C 13 60.384 0.1 . 1 . . . . 172 ILE CA . 11012 1 608 . 1 1 60 60 ILE CB C 13 39.226 0.1 . 1 . . . . 172 ILE CB . 11012 1 609 . 1 1 60 60 ILE CG1 C 13 27.562 0.1 . 1 . . . . 172 ILE CG1 . 11012 1 610 . 1 1 60 60 ILE CG2 C 13 16.789 0.1 . 1 . . . . 172 ILE CG2 . 11012 1 611 . 1 1 60 60 ILE CD1 C 13 13.625 0.1 . 1 . . . . 172 ILE CD1 . 11012 1 612 . 1 1 60 60 ILE N N 15 124.512 0.1 . 1 . . . . 172 ILE N . 11012 1 613 . 1 1 61 61 GLN H H 1 7.835 0.03 . 1 . . . . 173 GLN H . 11012 1 614 . 1 1 61 61 GLN HA H 1 4.785 0.03 . 1 . . . . 173 GLN HA . 11012 1 615 . 1 1 61 61 GLN HB2 H 1 1.600 0.03 . 2 . . . . 173 GLN HB2 . 11012 1 616 . 1 1 61 61 GLN HB3 H 1 1.306 0.03 . 2 . . . . 173 GLN HB3 . 11012 1 617 . 1 1 61 61 GLN HG2 H 1 1.928 0.03 . 2 . . . . 173 GLN HG2 . 11012 1 618 . 1 1 61 61 GLN HG3 H 1 1.667 0.03 . 2 . . . . 173 GLN HG3 . 11012 1 619 . 1 1 61 61 GLN HE21 H 1 6.664 0.03 . 1 . . . . 173 GLN HE21 . 11012 1 620 . 1 1 61 61 GLN HE22 H 1 6.155 0.03 . 1 . . . . 173 GLN HE22 . 11012 1 621 . 1 1 61 61 GLN C C 13 174.929 0.1 . 1 . . . . 173 GLN C . 11012 1 622 . 1 1 61 61 GLN CA C 13 53.932 0.1 . 1 . . . . 173 GLN CA . 11012 1 623 . 1 1 61 61 GLN CB C 13 28.520 0.1 . 1 . . . . 173 GLN CB . 11012 1 624 . 1 1 61 61 GLN CG C 13 33.420 0.1 . 1 . . . . 173 GLN CG . 11012 1 625 . 1 1 61 61 GLN N N 15 121.746 0.1 . 1 . . . . 173 GLN N . 11012 1 626 . 1 1 61 61 GLN NE2 N 15 109.160 0.1 . 1 . . . . 173 GLN NE2 . 11012 1 627 . 1 1 62 62 ILE H H 1 9.509 0.03 . 1 . . . . 174 ILE H . 11012 1 628 . 1 1 62 62 ILE HA H 1 4.754 0.03 . 1 . . . . 174 ILE HA . 11012 1 629 . 1 1 62 62 ILE HB H 1 2.053 0.03 . 1 . . . . 174 ILE HB . 11012 1 630 . 1 1 62 62 ILE HG12 H 1 1.448 0.03 . 1 . . . . 174 ILE HG12 . 11012 1 631 . 1 1 62 62 ILE HG13 H 1 1.490 0.03 . 1 . . . . 174 ILE HG13 . 11012 1 632 . 1 1 62 62 ILE HG21 H 1 1.186 0.03 . 1 . . . . 174 ILE HG2 . 11012 1 633 . 1 1 62 62 ILE HG22 H 1 1.186 0.03 . 1 . . . . 174 ILE HG2 . 11012 1 634 . 1 1 62 62 ILE HG23 H 1 1.186 0.03 . 1 . . . . 174 ILE HG2 . 11012 1 635 . 1 1 62 62 ILE HD11 H 1 0.912 0.03 . 1 . . . . 174 ILE HD1 . 11012 1 636 . 1 1 62 62 ILE HD12 H 1 0.912 0.03 . 1 . . . . 174 ILE HD1 . 11012 1 637 . 1 1 62 62 ILE HD13 H 1 0.912 0.03 . 1 . . . . 174 ILE HD1 . 11012 1 638 . 1 1 62 62 ILE C C 13 174.584 0.1 . 1 . . . . 174 ILE C . 11012 1 639 . 1 1 62 62 ILE CA C 13 58.883 0.1 . 1 . . . . 174 ILE CA . 11012 1 640 . 1 1 62 62 ILE CB C 13 39.791 0.1 . 1 . . . . 174 ILE CB . 11012 1 641 . 1 1 62 62 ILE CG1 C 13 28.797 0.1 . 1 . . . . 174 ILE CG1 . 11012 1 642 . 1 1 62 62 ILE CG2 C 13 18.368 0.1 . 1 . . . . 174 ILE CG2 . 11012 1 643 . 1 1 62 62 ILE CD1 C 13 13.246 0.1 . 1 . . . . 174 ILE CD1 . 11012 1 644 . 1 1 62 62 ILE N N 15 123.912 0.1 . 1 . . . . 174 ILE N . 11012 1 645 . 1 1 63 63 LYS H H 1 8.754 0.03 . 1 . . . . 175 LYS H . 11012 1 646 . 1 1 63 63 LYS HA H 1 5.119 0.03 . 1 . . . . 175 LYS HA . 11012 1 647 . 1 1 63 63 LYS HB2 H 1 1.774 0.03 . 1 . . . . 175 LYS HB2 . 11012 1 648 . 1 1 63 63 LYS HB3 H 1 1.743 0.03 . 1 . . . . 175 LYS HB3 . 11012 1 649 . 1 1 63 63 LYS HG2 H 1 1.369 0.03 . 1 . . . . 175 LYS HG2 . 11012 1 650 . 1 1 63 63 LYS HG3 H 1 1.412 0.03 . 1 . . . . 175 LYS HG3 . 11012 1 651 . 1 1 63 63 LYS HD2 H 1 1.538 0.03 . 2 . . . . 175 LYS HD2 . 11012 1 652 . 1 1 63 63 LYS HD3 H 1 1.552 0.03 . 2 . . . . 175 LYS HD3 . 11012 1 653 . 1 1 63 63 LYS HE2 H 1 2.820 0.03 . 1 . . . . 175 LYS HE2 . 11012 1 654 . 1 1 63 63 LYS HE3 H 1 2.820 0.03 . 1 . . . . 175 LYS HE3 . 11012 1 655 . 1 1 63 63 LYS C C 13 174.341 0.1 . 1 . . . . 175 LYS C . 11012 1 656 . 1 1 63 63 LYS CA C 13 54.237 0.1 . 1 . . . . 175 LYS CA . 11012 1 657 . 1 1 63 63 LYS CB C 13 36.692 0.1 . 1 . . . . 175 LYS CB . 11012 1 658 . 1 1 63 63 LYS CG C 13 24.772 0.1 . 1 . . . . 175 LYS CG . 11012 1 659 . 1 1 63 63 LYS CD C 13 29.048 0.1 . 1 . . . . 175 LYS CD . 11012 1 660 . 1 1 63 63 LYS CE C 13 41.842 0.1 . 1 . . . . 175 LYS CE . 11012 1 661 . 1 1 63 63 LYS N N 15 127.964 0.1 . 1 . . . . 175 LYS N . 11012 1 662 . 1 1 64 64 VAL H H 1 7.961 0.03 . 1 . . . . 176 VAL H . 11012 1 663 . 1 1 64 64 VAL HA H 1 4.922 0.03 . 1 . . . . 176 VAL HA . 11012 1 664 . 1 1 64 64 VAL HB H 1 2.551 0.03 . 1 . . . . 176 VAL HB . 11012 1 665 . 1 1 64 64 VAL HG11 H 1 0.944 0.03 . 1 . . . . 176 VAL HG1 . 11012 1 666 . 1 1 64 64 VAL HG12 H 1 0.944 0.03 . 1 . . . . 176 VAL HG1 . 11012 1 667 . 1 1 64 64 VAL HG13 H 1 0.944 0.03 . 1 . . . . 176 VAL HG1 . 11012 1 668 . 1 1 64 64 VAL HG21 H 1 0.738 0.03 . 1 . . . . 176 VAL HG2 . 11012 1 669 . 1 1 64 64 VAL HG22 H 1 0.738 0.03 . 1 . . . . 176 VAL HG2 . 11012 1 670 . 1 1 64 64 VAL HG23 H 1 0.738 0.03 . 1 . . . . 176 VAL HG2 . 11012 1 671 . 1 1 64 64 VAL C C 13 176.322 0.1 . 1 . . . . 176 VAL C . 11012 1 672 . 1 1 64 64 VAL CA C 13 58.725 0.1 . 1 . . . . 176 VAL CA . 11012 1 673 . 1 1 64 64 VAL CB C 13 34.911 0.1 . 1 . . . . 176 VAL CB . 11012 1 674 . 1 1 64 64 VAL CG1 C 13 23.056 0.1 . 1 . . . . 176 VAL CG1 . 11012 1 675 . 1 1 64 64 VAL CG2 C 13 18.361 0.1 . 1 . . . . 176 VAL CG2 . 11012 1 676 . 1 1 64 64 VAL N N 15 113.535 0.1 . 1 . . . . 176 VAL N . 11012 1 677 . 1 1 65 65 MET H H 1 8.829 0.03 . 1 . . . . 177 MET H . 11012 1 678 . 1 1 65 65 MET HA H 1 4.691 0.03 . 1 . . . . 177 MET HA . 11012 1 679 . 1 1 65 65 MET HB2 H 1 2.060 0.03 . 1 . . . . 177 MET HB2 . 11012 1 680 . 1 1 65 65 MET HB3 H 1 2.200 0.03 . 1 . . . . 177 MET HB3 . 11012 1 681 . 1 1 65 65 MET HG2 H 1 2.627 0.03 . 2 . . . . 177 MET HG2 . 11012 1 682 . 1 1 65 65 MET HG3 H 1 2.780 0.03 . 2 . . . . 177 MET HG3 . 11012 1 683 . 1 1 65 65 MET HE1 H 1 2.152 0.03 . 1 . . . . 177 MET HE . 11012 1 684 . 1 1 65 65 MET HE2 H 1 2.152 0.03 . 1 . . . . 177 MET HE . 11012 1 685 . 1 1 65 65 MET HE3 H 1 2.152 0.03 . 1 . . . . 177 MET HE . 11012 1 686 . 1 1 65 65 MET C C 13 176.962 0.1 . 1 . . . . 177 MET C . 11012 1 687 . 1 1 65 65 MET CA C 13 55.266 0.1 . 1 . . . . 177 MET CA . 11012 1 688 . 1 1 65 65 MET CB C 13 33.196 0.1 . 1 . . . . 177 MET CB . 11012 1 689 . 1 1 65 65 MET CG C 13 32.216 0.1 . 1 . . . . 177 MET CG . 11012 1 690 . 1 1 65 65 MET CE C 13 16.302 0.1 . 1 . . . . 177 MET CE . 11012 1 691 . 1 1 65 65 MET N N 15 118.675 0.1 . 1 . . . . 177 MET N . 11012 1 692 . 1 1 66 66 THR H H 1 7.518 0.03 . 1 . . . . 178 THR H . 11012 1 693 . 1 1 66 66 THR HA H 1 4.817 0.03 . 1 . . . . 178 THR HA . 11012 1 694 . 1 1 66 66 THR HB H 1 4.403 0.03 . 1 . . . . 178 THR HB . 11012 1 695 . 1 1 66 66 THR HG21 H 1 1.266 0.03 . 1 . . . . 178 THR HG2 . 11012 1 696 . 1 1 66 66 THR HG22 H 1 1.266 0.03 . 1 . . . . 178 THR HG2 . 11012 1 697 . 1 1 66 66 THR HG23 H 1 1.266 0.03 . 1 . . . . 178 THR HG2 . 11012 1 698 . 1 1 66 66 THR C C 13 171.638 0.1 . 1 . . . . 178 THR C . 11012 1 699 . 1 1 66 66 THR CA C 13 57.442 0.1 . 1 . . . . 178 THR CA . 11012 1 700 . 1 1 66 66 THR CB C 13 69.617 0.1 . 1 . . . . 178 THR CB . 11012 1 701 . 1 1 66 66 THR CG2 C 13 22.041 0.1 . 1 . . . . 178 THR CG2 . 11012 1 702 . 1 1 66 66 THR N N 15 110.656 0.1 . 1 . . . . 178 THR N . 11012 1 703 . 1 1 67 67 PRO HA H 1 4.527 0.03 . 1 . . . . 179 PRO HA . 11012 1 704 . 1 1 67 67 PRO HB2 H 1 1.820 0.03 . 1 . . . . 179 PRO HB2 . 11012 1 705 . 1 1 67 67 PRO HB3 H 1 2.324 0.03 . 1 . . . . 179 PRO HB3 . 11012 1 706 . 1 1 67 67 PRO HG2 H 1 2.144 0.03 . 1 . . . . 179 PRO HG2 . 11012 1 707 . 1 1 67 67 PRO HG3 H 1 1.985 0.03 . 1 . . . . 179 PRO HG3 . 11012 1 708 . 1 1 67 67 PRO HD2 H 1 3.684 0.03 . 1 . . . . 179 PRO HD2 . 11012 1 709 . 1 1 67 67 PRO HD3 H 1 3.829 0.03 . 1 . . . . 179 PRO HD3 . 11012 1 710 . 1 1 67 67 PRO CA C 13 60.784 0.1 . 1 . . . . 179 PRO CA . 11012 1 711 . 1 1 67 67 PRO CB C 13 31.396 0.1 . 1 . . . . 179 PRO CB . 11012 1 712 . 1 1 67 67 PRO CG C 13 27.372 0.1 . 1 . . . . 179 PRO CG . 11012 1 713 . 1 1 67 67 PRO CD C 13 50.182 0.1 . 1 . . . . 179 PRO CD . 11012 1 714 . 1 1 68 68 PRO HA H 1 3.375 0.03 . 1 . . . . 180 PRO HA . 11012 1 715 . 1 1 68 68 PRO HB2 H 1 1.272 0.03 . 2 . . . . 180 PRO HB2 . 11012 1 716 . 1 1 68 68 PRO HB3 H 1 1.178 0.03 . 2 . . . . 180 PRO HB3 . 11012 1 717 . 1 1 68 68 PRO HG2 H 1 0.617 0.03 . 2 . . . . 180 PRO HG2 . 11012 1 718 . 1 1 68 68 PRO HG3 H 1 0.569 0.03 . 2 . . . . 180 PRO HG3 . 11012 1 719 . 1 1 68 68 PRO HD2 H 1 3.120 0.03 . 1 . . . . 180 PRO HD2 . 11012 1 720 . 1 1 68 68 PRO HD3 H 1 3.581 0.03 . 1 . . . . 180 PRO HD3 . 11012 1 721 . 1 1 68 68 PRO CA C 13 59.617 0.1 . 1 . . . . 180 PRO CA . 11012 1 722 . 1 1 68 68 PRO CB C 13 29.905 0.1 . 1 . . . . 180 PRO CB . 11012 1 723 . 1 1 68 68 PRO CG C 13 26.135 0.1 . 1 . . . . 180 PRO CG . 11012 1 724 . 1 1 68 68 PRO CD C 13 50.181 0.1 . 1 . . . . 180 PRO CD . 11012 1 725 . 1 1 69 69 PRO HA H 1 4.406 0.03 . 1 . . . . 181 PRO HA . 11012 1 726 . 1 1 69 69 PRO HB2 H 1 1.920 0.03 . 2 . . . . 181 PRO HB2 . 11012 1 727 . 1 1 69 69 PRO HB3 H 1 2.390 0.03 . 2 . . . . 181 PRO HB3 . 11012 1 728 . 1 1 69 69 PRO HG2 H 1 1.858 0.03 . 2 . . . . 181 PRO HG2 . 11012 1 729 . 1 1 69 69 PRO HG3 H 1 2.095 0.03 . 2 . . . . 181 PRO HG3 . 11012 1 730 . 1 1 69 69 PRO HD2 H 1 2.939 0.03 . 1 . . . . 181 PRO HD2 . 11012 1 731 . 1 1 69 69 PRO HD3 H 1 3.654 0.03 . 1 . . . . 181 PRO HD3 . 11012 1 732 . 1 1 69 69 PRO C C 13 176.225 0.1 . 1 . . . . 181 PRO C . 11012 1 733 . 1 1 69 69 PRO CA C 13 61.702 0.1 . 1 . . . . 181 PRO CA . 11012 1 734 . 1 1 69 69 PRO CB C 13 31.845 0.1 . 1 . . . . 181 PRO CB . 11012 1 735 . 1 1 69 69 PRO CG C 13 27.168 0.1 . 1 . . . . 181 PRO CG . 11012 1 736 . 1 1 69 69 PRO CD C 13 49.820 0.1 . 1 . . . . 181 PRO CD . 11012 1 737 . 1 1 70 70 GLN H H 1 8.505 0.03 . 1 . . . . 182 GLN H . 11012 1 738 . 1 1 70 70 GLN HA H 1 4.150 0.03 . 1 . . . . 182 GLN HA . 11012 1 739 . 1 1 70 70 GLN HB2 H 1 2.069 0.03 . 1 . . . . 182 GLN HB2 . 11012 1 740 . 1 1 70 70 GLN HB3 H 1 2.069 0.03 . 1 . . . . 182 GLN HB3 . 11012 1 741 . 1 1 70 70 GLN HG2 H 1 2.451 0.03 . 2 . . . . 182 GLN HG2 . 11012 1 742 . 1 1 70 70 GLN HG3 H 1 2.515 0.03 . 2 . . . . 182 GLN HG3 . 11012 1 743 . 1 1 70 70 GLN C C 13 178.096 0.1 . 1 . . . . 182 GLN C . 11012 1 744 . 1 1 70 70 GLN CA C 13 57.010 0.1 . 1 . . . . 182 GLN CA . 11012 1 745 . 1 1 70 70 GLN CB C 13 28.016 0.1 . 1 . . . . 182 GLN CB . 11012 1 746 . 1 1 70 70 GLN CG C 13 33.508 0.1 . 1 . . . . 182 GLN CG . 11012 1 747 . 1 1 70 70 GLN N N 15 120.417 0.1 . 1 . . . . 182 GLN N . 11012 1 748 . 1 1 71 71 GLY H H 1 9.209 0.03 . 1 . . . . 183 GLY H . 11012 1 749 . 1 1 71 71 GLY HA2 H 1 4.150 0.03 . 1 . . . . 183 GLY HA2 . 11012 1 750 . 1 1 71 71 GLY HA3 H 1 3.773 0.03 . 1 . . . . 183 GLY HA3 . 11012 1 751 . 1 1 71 71 GLY C C 13 173.104 0.1 . 1 . . . . 183 GLY C . 11012 1 752 . 1 1 71 71 GLY CA C 13 44.717 0.1 . 1 . . . . 183 GLY CA . 11012 1 753 . 1 1 71 71 GLY N N 15 114.252 0.1 . 1 . . . . 183 GLY N . 11012 1 754 . 1 1 72 72 ALA H H 1 7.415 0.03 . 1 . . . . 184 ALA H . 11012 1 755 . 1 1 72 72 ALA HA H 1 4.656 0.03 . 1 . . . . 184 ALA HA . 11012 1 756 . 1 1 72 72 ALA HB1 H 1 1.222 0.03 . 1 . . . . 184 ALA HB . 11012 1 757 . 1 1 72 72 ALA HB2 H 1 1.222 0.03 . 1 . . . . 184 ALA HB . 11012 1 758 . 1 1 72 72 ALA HB3 H 1 1.222 0.03 . 1 . . . . 184 ALA HB . 11012 1 759 . 1 1 72 72 ALA C C 13 177.491 0.1 . 1 . . . . 184 ALA C . 11012 1 760 . 1 1 72 72 ALA CA C 13 52.005 0.1 . 1 . . . . 184 ALA CA . 11012 1 761 . 1 1 72 72 ALA CB C 13 18.338 0.1 . 1 . . . . 184 ALA CB . 11012 1 762 . 1 1 72 72 ALA N N 15 119.556 0.1 . 1 . . . . 184 ALA N . 11012 1 763 . 1 1 73 73 VAL H H 1 9.133 0.03 . 1 . . . . 185 VAL H . 11012 1 764 . 1 1 73 73 VAL HA H 1 5.058 0.03 . 1 . . . . 185 VAL HA . 11012 1 765 . 1 1 73 73 VAL HB H 1 1.884 0.03 . 1 . . . . 185 VAL HB . 11012 1 766 . 1 1 73 73 VAL HG11 H 1 0.852 0.03 . 1 . . . . 185 VAL HG1 . 11012 1 767 . 1 1 73 73 VAL HG12 H 1 0.852 0.03 . 1 . . . . 185 VAL HG1 . 11012 1 768 . 1 1 73 73 VAL HG13 H 1 0.852 0.03 . 1 . . . . 185 VAL HG1 . 11012 1 769 . 1 1 73 73 VAL HG21 H 1 0.683 0.03 . 1 . . . . 185 VAL HG2 . 11012 1 770 . 1 1 73 73 VAL HG22 H 1 0.683 0.03 . 1 . . . . 185 VAL HG2 . 11012 1 771 . 1 1 73 73 VAL HG23 H 1 0.683 0.03 . 1 . . . . 185 VAL HG2 . 11012 1 772 . 1 1 73 73 VAL C C 13 173.702 0.1 . 1 . . . . 185 VAL C . 11012 1 773 . 1 1 73 73 VAL CA C 13 58.772 0.1 . 1 . . . . 185 VAL CA . 11012 1 774 . 1 1 73 73 VAL CB C 13 36.053 0.1 . 1 . . . . 185 VAL CB . 11012 1 775 . 1 1 73 73 VAL CG1 C 13 20.794 0.1 . 1 . . . . 185 VAL CG1 . 11012 1 776 . 1 1 73 73 VAL CG2 C 13 18.907 0.1 . 1 . . . . 185 VAL CG2 . 11012 1 777 . 1 1 73 73 VAL N N 15 113.864 0.1 . 1 . . . . 185 VAL N . 11012 1 778 . 1 1 74 74 ILE H H 1 9.172 0.03 . 1 . . . . 186 ILE H . 11012 1 779 . 1 1 74 74 ILE HA H 1 5.338 0.03 . 1 . . . . 186 ILE HA . 11012 1 780 . 1 1 74 74 ILE HB H 1 1.860 0.03 . 1 . . . . 186 ILE HB . 11012 1 781 . 1 1 74 74 ILE HG12 H 1 1.579 0.03 . 1 . . . . 186 ILE HG12 . 11012 1 782 . 1 1 74 74 ILE HG13 H 1 1.194 0.03 . 1 . . . . 186 ILE HG13 . 11012 1 783 . 1 1 74 74 ILE HG21 H 1 0.912 0.03 . 1 . . . . 186 ILE HG2 . 11012 1 784 . 1 1 74 74 ILE HG22 H 1 0.912 0.03 . 1 . . . . 186 ILE HG2 . 11012 1 785 . 1 1 74 74 ILE HG23 H 1 0.912 0.03 . 1 . . . . 186 ILE HG2 . 11012 1 786 . 1 1 74 74 ILE HD11 H 1 1.035 0.03 . 1 . . . . 186 ILE HD1 . 11012 1 787 . 1 1 74 74 ILE HD12 H 1 1.035 0.03 . 1 . . . . 186 ILE HD1 . 11012 1 788 . 1 1 74 74 ILE HD13 H 1 1.035 0.03 . 1 . . . . 186 ILE HD1 . 11012 1 789 . 1 1 74 74 ILE C C 13 176.363 0.1 . 1 . . . . 186 ILE C . 11012 1 790 . 1 1 74 74 ILE CA C 13 58.017 0.1 . 1 . . . . 186 ILE CA . 11012 1 791 . 1 1 74 74 ILE CB C 13 38.987 0.1 . 1 . . . . 186 ILE CB . 11012 1 792 . 1 1 74 74 ILE CG1 C 13 26.741 0.1 . 1 . . . . 186 ILE CG1 . 11012 1 793 . 1 1 74 74 ILE CG2 C 13 16.740 0.1 . 1 . . . . 186 ILE CG2 . 11012 1 794 . 1 1 74 74 ILE CD1 C 13 13.587 0.1 . 1 . . . . 186 ILE CD1 . 11012 1 795 . 1 1 74 74 ILE N N 15 120.426 0.1 . 1 . . . . 186 ILE N . 11012 1 796 . 1 1 75 75 ARG H H 1 9.703 0.03 . 1 . . . . 187 ARG H . 11012 1 797 . 1 1 75 75 ARG HA H 1 5.278 0.03 . 1 . . . . 187 ARG HA . 11012 1 798 . 1 1 75 75 ARG HB2 H 1 2.152 0.03 . 1 . . . . 187 ARG HB2 . 11012 1 799 . 1 1 75 75 ARG HB3 H 1 1.300 0.03 . 1 . . . . 187 ARG HB3 . 11012 1 800 . 1 1 75 75 ARG C C 13 173.738 0.1 . 1 . . . . 187 ARG C . 11012 1 801 . 1 1 75 75 ARG CA C 13 53.760 0.1 . 1 . . . . 187 ARG CA . 11012 1 802 . 1 1 75 75 ARG CB C 13 32.762 0.1 . 1 . . . . 187 ARG CB . 11012 1 803 . 1 1 75 75 ARG N N 15 132.489 0.1 . 1 . . . . 187 ARG N . 11012 1 804 . 1 1 76 76 ALA H H 1 8.484 0.03 . 1 . . . . 188 ALA H . 11012 1 805 . 1 1 76 76 ALA HA H 1 5.402 0.03 . 1 . . . . 188 ALA HA . 11012 1 806 . 1 1 76 76 ALA HB1 H 1 1.094 0.03 . 1 . . . . 188 ALA HB . 11012 1 807 . 1 1 76 76 ALA HB2 H 1 1.094 0.03 . 1 . . . . 188 ALA HB . 11012 1 808 . 1 1 76 76 ALA HB3 H 1 1.094 0.03 . 1 . . . . 188 ALA HB . 11012 1 809 . 1 1 76 76 ALA C C 13 175.478 0.1 . 1 . . . . 188 ALA C . 11012 1 810 . 1 1 76 76 ALA CA C 13 50.395 0.1 . 1 . . . . 188 ALA CA . 11012 1 811 . 1 1 76 76 ALA CB C 13 20.751 0.1 . 1 . . . . 188 ALA CB . 11012 1 812 . 1 1 76 76 ALA N N 15 127.000 0.1 . 1 . . . . 188 ALA N . 11012 1 813 . 1 1 77 77 MET H H 1 8.491 0.03 . 1 . . . . 189 MET H . 11012 1 814 . 1 1 77 77 MET HA H 1 5.076 0.03 . 1 . . . . 189 MET HA . 11012 1 815 . 1 1 77 77 MET HB2 H 1 2.022 0.03 . 2 . . . . 189 MET HB2 . 11012 1 816 . 1 1 77 77 MET HB3 H 1 1.932 0.03 . 2 . . . . 189 MET HB3 . 11012 1 817 . 1 1 77 77 MET HG2 H 1 2.439 0.03 . 1 . . . . 189 MET HG2 . 11012 1 818 . 1 1 77 77 MET HG3 H 1 2.439 0.03 . 1 . . . . 189 MET HG3 . 11012 1 819 . 1 1 77 77 MET CA C 13 51.413 0.1 . 1 . . . . 189 MET CA . 11012 1 820 . 1 1 77 77 MET CB C 13 40.103 0.1 . 1 . . . . 189 MET CB . 11012 1 821 . 1 1 77 77 MET CG C 13 37.806 0.1 . 1 . . . . 189 MET CG . 11012 1 822 . 1 1 77 77 MET N N 15 121.074 0.1 . 1 . . . . 189 MET N . 11012 1 823 . 1 1 78 78 PRO HA H 1 5.734 0.03 . 1 . . . . 190 PRO HA . 11012 1 824 . 1 1 78 78 PRO HB2 H 1 1.540 0.03 . 1 . . . . 190 PRO HB2 . 11012 1 825 . 1 1 78 78 PRO HB3 H 1 1.784 0.03 . 1 . . . . 190 PRO HB3 . 11012 1 826 . 1 1 78 78 PRO HD2 H 1 4.192 0.03 . 1 . . . . 190 PRO HD2 . 11012 1 827 . 1 1 78 78 PRO HD3 H 1 3.934 0.03 . 1 . . . . 190 PRO HD3 . 11012 1 828 . 1 1 78 78 PRO CA C 13 60.532 0.1 . 1 . . . . 190 PRO CA . 11012 1 829 . 1 1 78 78 PRO CB C 13 31.690 0.1 . 1 . . . . 190 PRO CB . 11012 1 830 . 1 1 78 78 PRO CG C 13 25.900 0.1 . 1 . . . . 190 PRO CG . 11012 1 831 . 1 1 78 78 PRO CD C 13 49.627 0.1 . 1 . . . . 190 PRO CD . 11012 1 832 . 1 1 79 79 VAL H H 1 9.184 0.03 . 1 . . . . 191 VAL H . 11012 1 833 . 1 1 79 79 VAL HA H 1 4.452 0.03 . 1 . . . . 191 VAL HA . 11012 1 834 . 1 1 79 79 VAL HB H 1 2.052 0.03 . 1 . . . . 191 VAL HB . 11012 1 835 . 1 1 79 79 VAL HG11 H 1 0.935 0.03 . 1 . . . . 191 VAL HG1 . 11012 1 836 . 1 1 79 79 VAL HG12 H 1 0.935 0.03 . 1 . . . . 191 VAL HG1 . 11012 1 837 . 1 1 79 79 VAL HG13 H 1 0.935 0.03 . 1 . . . . 191 VAL HG1 . 11012 1 838 . 1 1 79 79 VAL HG21 H 1 0.825 0.03 . 1 . . . . 191 VAL HG2 . 11012 1 839 . 1 1 79 79 VAL HG22 H 1 0.825 0.03 . 1 . . . . 191 VAL HG2 . 11012 1 840 . 1 1 79 79 VAL HG23 H 1 0.825 0.03 . 1 . . . . 191 VAL HG2 . 11012 1 841 . 1 1 79 79 VAL C C 13 174.621 0.1 . 1 . . . . 191 VAL C . 11012 1 842 . 1 1 79 79 VAL CA C 13 59.828 0.1 . 1 . . . . 191 VAL CA . 11012 1 843 . 1 1 79 79 VAL CB C 13 36.314 0.1 . 1 . . . . 191 VAL CB . 11012 1 844 . 1 1 79 79 VAL CG1 C 13 21.630 0.1 . 1 . . . . 191 VAL CG1 . 11012 1 845 . 1 1 79 79 VAL CG2 C 13 20.288 0.1 . 1 . . . . 191 VAL CG2 . 11012 1 846 . 1 1 79 79 VAL N N 15 116.900 0.1 . 1 . . . . 191 VAL N . 11012 1 847 . 1 1 80 80 TYR H H 1 9.269 0.03 . 1 . . . . 192 TYR H . 11012 1 848 . 1 1 80 80 TYR HA H 1 4.678 0.03 . 1 . . . . 192 TYR HA . 11012 1 849 . 1 1 80 80 TYR HB2 H 1 3.673 0.03 . 1 . . . . 192 TYR HB2 . 11012 1 850 . 1 1 80 80 TYR HB3 H 1 2.545 0.03 . 1 . . . . 192 TYR HB3 . 11012 1 851 . 1 1 80 80 TYR HD1 H 1 7.431 0.03 . 1 . . . . 192 TYR HD1 . 11012 1 852 . 1 1 80 80 TYR HD2 H 1 7.431 0.03 . 1 . . . . 192 TYR HD2 . 11012 1 853 . 1 1 80 80 TYR C C 13 175.295 0.1 . 1 . . . . 192 TYR C . 11012 1 854 . 1 1 80 80 TYR CA C 13 61.203 0.1 . 1 . . . . 192 TYR CA . 11012 1 855 . 1 1 80 80 TYR CB C 13 37.797 0.1 . 1 . . . . 192 TYR CB . 11012 1 856 . 1 1 80 80 TYR N N 15 123.453 0.1 . 1 . . . . 192 TYR N . 11012 1 857 . 1 1 81 81 LYS H H 1 8.088 0.03 . 1 . . . . 193 LYS H . 11012 1 858 . 1 1 81 81 LYS HA H 1 3.900 0.03 . 1 . . . . 193 LYS HA . 11012 1 859 . 1 1 81 81 LYS HB2 H 1 1.643 0.03 . 1 . . . . 193 LYS HB2 . 11012 1 860 . 1 1 81 81 LYS HB3 H 1 1.405 0.03 . 1 . . . . 193 LYS HB3 . 11012 1 861 . 1 1 81 81 LYS C C 13 177.487 0.1 . 1 . . . . 193 LYS C . 11012 1 862 . 1 1 81 81 LYS CA C 13 58.073 0.1 . 1 . . . . 193 LYS CA . 11012 1 863 . 1 1 81 81 LYS CB C 13 35.462 0.1 . 1 . . . . 193 LYS CB . 11012 1 864 . 1 1 81 81 LYS N N 15 120.128 0.1 . 1 . . . . 193 LYS N . 11012 1 865 . 1 1 82 82 LYS H H 1 9.349 0.03 . 1 . . . . 194 LYS H . 11012 1 866 . 1 1 82 82 LYS HA H 1 4.288 0.03 . 1 . . . . 194 LYS HA . 11012 1 867 . 1 1 82 82 LYS HB2 H 1 1.906 0.03 . 2 . . . . 194 LYS HB2 . 11012 1 868 . 1 1 82 82 LYS HB3 H 1 1.762 0.03 . 2 . . . . 194 LYS HB3 . 11012 1 869 . 1 1 82 82 LYS HG2 H 1 1.493 0.03 . 1 . . . . 194 LYS HG2 . 11012 1 870 . 1 1 82 82 LYS HG3 H 1 1.493 0.03 . 1 . . . . 194 LYS HG3 . 11012 1 871 . 1 1 82 82 LYS C C 13 178.229 0.1 . 1 . . . . 194 LYS C . 11012 1 872 . 1 1 82 82 LYS CA C 13 56.347 0.1 . 1 . . . . 194 LYS CA . 11012 1 873 . 1 1 82 82 LYS CB C 13 31.426 0.1 . 1 . . . . 194 LYS CB . 11012 1 874 . 1 1 82 82 LYS N N 15 118.594 0.1 . 1 . . . . 194 LYS N . 11012 1 875 . 1 1 83 83 ALA H H 1 8.720 0.03 . 1 . . . . 195 ALA H . 11012 1 876 . 1 1 83 83 ALA HA H 1 4.027 0.03 . 1 . . . . 195 ALA HA . 11012 1 877 . 1 1 83 83 ALA HB1 H 1 1.469 0.03 . 1 . . . . 195 ALA HB . 11012 1 878 . 1 1 83 83 ALA HB2 H 1 1.469 0.03 . 1 . . . . 195 ALA HB . 11012 1 879 . 1 1 83 83 ALA HB3 H 1 1.469 0.03 . 1 . . . . 195 ALA HB . 11012 1 880 . 1 1 83 83 ALA C C 13 179.811 0.1 . 1 . . . . 195 ALA C . 11012 1 881 . 1 1 83 83 ALA CA C 13 54.958 0.1 . 1 . . . . 195 ALA CA . 11012 1 882 . 1 1 83 83 ALA CB C 13 18.093 0.1 . 1 . . . . 195 ALA CB . 11012 1 883 . 1 1 83 83 ALA N N 15 126.346 0.1 . 1 . . . . 195 ALA N . 11012 1 884 . 1 1 84 84 GLU H H 1 9.392 0.03 . 1 . . . . 196 GLU H . 11012 1 885 . 1 1 84 84 GLU HA H 1 4.093 0.03 . 1 . . . . 196 GLU HA . 11012 1 886 . 1 1 84 84 GLU HB2 H 1 1.743 0.03 . 1 . . . . 196 GLU HB2 . 11012 1 887 . 1 1 84 84 GLU HB3 H 1 1.743 0.03 . 1 . . . . 196 GLU HB3 . 11012 1 888 . 1 1 84 84 GLU HG2 H 1 1.879 0.03 . 2 . . . . 196 GLU HG2 . 11012 1 889 . 1 1 84 84 GLU HG3 H 1 1.619 0.03 . 2 . . . . 196 GLU HG3 . 11012 1 890 . 1 1 84 84 GLU C C 13 176.548 0.1 . 1 . . . . 196 GLU C . 11012 1 891 . 1 1 84 84 GLU CA C 13 58.036 0.1 . 1 . . . . 196 GLU CA . 11012 1 892 . 1 1 84 84 GLU CB C 13 28.108 0.1 . 1 . . . . 196 GLU CB . 11012 1 893 . 1 1 84 84 GLU CG C 13 35.094 0.1 . 1 . . . . 196 GLU CG . 11012 1 894 . 1 1 84 84 GLU N N 15 114.968 0.1 . 1 . . . . 196 GLU N . 11012 1 895 . 1 1 85 85 HIS H H 1 7.695 0.03 . 1 . . . . 197 HIS H . 11012 1 896 . 1 1 85 85 HIS HA H 1 5.090 0.03 . 1 . . . . 197 HIS HA . 11012 1 897 . 1 1 85 85 HIS HB2 H 1 2.990 0.03 . 2 . . . . 197 HIS HB2 . 11012 1 898 . 1 1 85 85 HIS HB3 H 1 2.931 0.03 . 2 . . . . 197 HIS HB3 . 11012 1 899 . 1 1 85 85 HIS C C 13 177.223 0.1 . 1 . . . . 197 HIS C . 11012 1 900 . 1 1 85 85 HIS CA C 13 54.411 0.1 . 1 . . . . 197 HIS CA . 11012 1 901 . 1 1 85 85 HIS CB C 13 32.967 0.1 . 1 . . . . 197 HIS CB . 11012 1 902 . 1 1 85 85 HIS N N 15 117.047 0.1 . 1 . . . . 197 HIS N . 11012 1 903 . 1 1 86 86 VAL H H 1 7.411 0.03 . 1 . . . . 198 VAL H . 11012 1 904 . 1 1 86 86 VAL HA H 1 4.127 0.03 . 1 . . . . 198 VAL HA . 11012 1 905 . 1 1 86 86 VAL HB H 1 2.275 0.03 . 1 . . . . 198 VAL HB . 11012 1 906 . 1 1 86 86 VAL HG11 H 1 1.126 0.03 . 1 . . . . 198 VAL HG1 . 11012 1 907 . 1 1 86 86 VAL HG12 H 1 1.126 0.03 . 1 . . . . 198 VAL HG1 . 11012 1 908 . 1 1 86 86 VAL HG13 H 1 1.126 0.03 . 1 . . . . 198 VAL HG1 . 11012 1 909 . 1 1 86 86 VAL HG21 H 1 1.196 0.03 . 1 . . . . 198 VAL HG2 . 11012 1 910 . 1 1 86 86 VAL HG22 H 1 1.196 0.03 . 1 . . . . 198 VAL HG2 . 11012 1 911 . 1 1 86 86 VAL HG23 H 1 1.196 0.03 . 1 . . . . 198 VAL HG2 . 11012 1 912 . 1 1 86 86 VAL C C 13 177.257 0.1 . 1 . . . . 198 VAL C . 11012 1 913 . 1 1 86 86 VAL CA C 13 65.670 0.1 . 1 . . . . 198 VAL CA . 11012 1 914 . 1 1 86 86 VAL CB C 13 32.006 0.1 . 1 . . . . 198 VAL CB . 11012 1 915 . 1 1 86 86 VAL CG1 C 13 19.886 0.1 . 1 . . . . 198 VAL CG1 . 11012 1 916 . 1 1 86 86 VAL CG2 C 13 22.061 0.1 . 1 . . . . 198 VAL CG2 . 11012 1 917 . 1 1 86 86 VAL N N 15 118.114 0.1 . 1 . . . . 198 VAL N . 11012 1 918 . 1 1 87 87 THR H H 1 8.331 0.03 . 1 . . . . 199 THR H . 11012 1 919 . 1 1 87 87 THR HA H 1 4.068 0.03 . 1 . . . . 199 THR HA . 11012 1 920 . 1 1 87 87 THR HB H 1 4.485 0.03 . 1 . . . . 199 THR HB . 11012 1 921 . 1 1 87 87 THR HG21 H 1 1.311 0.03 . 1 . . . . 199 THR HG2 . 11012 1 922 . 1 1 87 87 THR HG22 H 1 1.311 0.03 . 1 . . . . 199 THR HG2 . 11012 1 923 . 1 1 87 87 THR HG23 H 1 1.311 0.03 . 1 . . . . 199 THR HG2 . 11012 1 924 . 1 1 87 87 THR C C 13 174.218 0.1 . 1 . . . . 199 THR C . 11012 1 925 . 1 1 87 87 THR CA C 13 63.360 0.1 . 1 . . . . 199 THR CA . 11012 1 926 . 1 1 87 87 THR CB C 13 68.416 0.1 . 1 . . . . 199 THR CB . 11012 1 927 . 1 1 87 87 THR CG2 C 13 21.753 0.1 . 1 . . . . 199 THR CG2 . 11012 1 928 . 1 1 87 87 THR N N 15 112.715 0.1 . 1 . . . . 199 THR N . 11012 1 929 . 1 1 88 88 GLU H H 1 8.162 0.03 . 1 . . . . 200 GLU H . 11012 1 930 . 1 1 88 88 GLU HA H 1 4.467 0.03 . 1 . . . . 200 GLU HA . 11012 1 931 . 1 1 88 88 GLU HB2 H 1 2.212 0.03 . 1 . . . . 200 GLU HB2 . 11012 1 932 . 1 1 88 88 GLU HB3 H 1 2.354 0.03 . 1 . . . . 200 GLU HB3 . 11012 1 933 . 1 1 88 88 GLU HG2 H 1 2.380 0.03 . 1 . . . . 200 GLU HG2 . 11012 1 934 . 1 1 88 88 GLU HG3 H 1 2.479 0.03 . 1 . . . . 200 GLU HG3 . 11012 1 935 . 1 1 88 88 GLU C C 13 175.781 0.1 . 1 . . . . 200 GLU C . 11012 1 936 . 1 1 88 88 GLU CA C 13 55.762 0.1 . 1 . . . . 200 GLU CA . 11012 1 937 . 1 1 88 88 GLU CB C 13 29.968 0.1 . 1 . . . . 200 GLU CB . 11012 1 938 . 1 1 88 88 GLU CG C 13 36.141 0.1 . 1 . . . . 200 GLU CG . 11012 1 939 . 1 1 88 88 GLU N N 15 123.912 0.1 . 1 . . . . 200 GLU N . 11012 1 940 . 1 1 89 89 VAL H H 1 8.814 0.03 . 1 . . . . 201 VAL H . 11012 1 941 . 1 1 89 89 VAL HA H 1 3.772 0.03 . 1 . . . . 201 VAL HA . 11012 1 942 . 1 1 89 89 VAL HB H 1 2.032 0.03 . 1 . . . . 201 VAL HB . 11012 1 943 . 1 1 89 89 VAL HG11 H 1 0.942 0.03 . 1 . . . . 201 VAL HG1 . 11012 1 944 . 1 1 89 89 VAL HG12 H 1 0.942 0.03 . 1 . . . . 201 VAL HG1 . 11012 1 945 . 1 1 89 89 VAL HG13 H 1 0.942 0.03 . 1 . . . . 201 VAL HG1 . 11012 1 946 . 1 1 89 89 VAL HG21 H 1 1.040 0.03 . 1 . . . . 201 VAL HG2 . 11012 1 947 . 1 1 89 89 VAL HG22 H 1 1.040 0.03 . 1 . . . . 201 VAL HG2 . 11012 1 948 . 1 1 89 89 VAL HG23 H 1 1.040 0.03 . 1 . . . . 201 VAL HG2 . 11012 1 949 . 1 1 89 89 VAL C C 13 177.062 0.1 . 1 . . . . 201 VAL C . 11012 1 950 . 1 1 89 89 VAL CA C 13 63.807 0.1 . 1 . . . . 201 VAL CA . 11012 1 951 . 1 1 89 89 VAL CB C 13 32.016 0.1 . 1 . . . . 201 VAL CB . 11012 1 952 . 1 1 89 89 VAL CG1 C 13 21.670 0.1 . 1 . . . . 201 VAL CG1 . 11012 1 953 . 1 1 89 89 VAL CG2 C 13 21.924 0.1 . 1 . . . . 201 VAL CG2 . 11012 1 954 . 1 1 89 89 VAL N N 15 126.429 0.1 . 1 . . . . 201 VAL N . 11012 1 955 . 1 1 90 90 VAL H H 1 8.687 0.03 . 1 . . . . 202 VAL H . 11012 1 956 . 1 1 90 90 VAL HA H 1 3.707 0.03 . 1 . . . . 202 VAL HA . 11012 1 957 . 1 1 90 90 VAL HB H 1 1.778 0.03 . 1 . . . . 202 VAL HB . 11012 1 958 . 1 1 90 90 VAL HG11 H 1 0.651 0.03 . 1 . . . . 202 VAL HG1 . 11012 1 959 . 1 1 90 90 VAL HG12 H 1 0.651 0.03 . 1 . . . . 202 VAL HG1 . 11012 1 960 . 1 1 90 90 VAL HG13 H 1 0.651 0.03 . 1 . . . . 202 VAL HG1 . 11012 1 961 . 1 1 90 90 VAL HG21 H 1 -0.062 0.03 . 1 . . . . 202 VAL HG2 . 11012 1 962 . 1 1 90 90 VAL HG22 H 1 -0.062 0.03 . 1 . . . . 202 VAL HG2 . 11012 1 963 . 1 1 90 90 VAL HG23 H 1 -0.062 0.03 . 1 . . . . 202 VAL HG2 . 11012 1 964 . 1 1 90 90 VAL C C 13 174.921 0.1 . 1 . . . . 202 VAL C . 11012 1 965 . 1 1 90 90 VAL CA C 13 62.909 0.1 . 1 . . . . 202 VAL CA . 11012 1 966 . 1 1 90 90 VAL CB C 13 30.302 0.1 . 1 . . . . 202 VAL CB . 11012 1 967 . 1 1 90 90 VAL CG1 C 13 22.460 0.1 . 1 . . . . 202 VAL CG1 . 11012 1 968 . 1 1 90 90 VAL CG2 C 13 19.991 0.1 . 1 . . . . 202 VAL CG2 . 11012 1 969 . 1 1 90 90 VAL N N 15 128.866 0.1 . 1 . . . . 202 VAL N . 11012 1 970 . 1 1 91 91 LYS H H 1 7.959 0.03 . 1 . . . . 203 LYS H . 11012 1 971 . 1 1 91 91 LYS HA H 1 4.867 0.03 . 1 . . . . 203 LYS HA . 11012 1 972 . 1 1 91 91 LYS HB2 H 1 2.036 0.03 . 2 . . . . 203 LYS HB2 . 11012 1 973 . 1 1 91 91 LYS HB3 H 1 1.935 0.03 . 2 . . . . 203 LYS HB3 . 11012 1 974 . 1 1 91 91 LYS HG2 H 1 1.370 0.03 . 1 . . . . 203 LYS HG2 . 11012 1 975 . 1 1 91 91 LYS HG3 H 1 1.370 0.03 . 1 . . . . 203 LYS HG3 . 11012 1 976 . 1 1 91 91 LYS HD2 H 1 1.682 0.03 . 1 . . . . 203 LYS HD2 . 11012 1 977 . 1 1 91 91 LYS HD3 H 1 1.682 0.03 . 1 . . . . 203 LYS HD3 . 11012 1 978 . 1 1 91 91 LYS C C 13 174.844 0.1 . 1 . . . . 203 LYS C . 11012 1 979 . 1 1 91 91 LYS CA C 13 54.856 0.1 . 1 . . . . 203 LYS CA . 11012 1 980 . 1 1 91 91 LYS CB C 13 35.025 0.1 . 1 . . . . 203 LYS CB . 11012 1 981 . 1 1 91 91 LYS CG C 13 23.015 0.1 . 1 . . . . 203 LYS CG . 11012 1 982 . 1 1 91 91 LYS CD C 13 29.266 0.1 . 1 . . . . 203 LYS CD . 11012 1 983 . 1 1 91 91 LYS CE C 13 41.642 0.1 . 1 . . . . 203 LYS CE . 11012 1 984 . 1 1 91 91 LYS N N 15 127.101 0.1 . 1 . . . . 203 LYS N . 11012 1 985 . 1 1 92 92 ARG H H 1 8.406 0.03 . 1 . . . . 204 ARG H . 11012 1 986 . 1 1 92 92 ARG HA H 1 4.557 0.03 . 1 . . . . 204 ARG HA . 11012 1 987 . 1 1 92 92 ARG HB2 H 1 2.138 0.03 . 1 . . . . 204 ARG HB2 . 11012 1 988 . 1 1 92 92 ARG HB3 H 1 2.138 0.03 . 1 . . . . 204 ARG HB3 . 11012 1 989 . 1 1 92 92 ARG C C 13 176.193 0.1 . 1 . . . . 204 ARG C . 11012 1 990 . 1 1 92 92 ARG CA C 13 56.559 0.1 . 1 . . . . 204 ARG CA . 11012 1 991 . 1 1 92 92 ARG CB C 13 32.416 0.1 . 1 . . . . 204 ARG CB . 11012 1 992 . 1 1 92 92 ARG N N 15 116.204 0.1 . 1 . . . . 204 ARG N . 11012 1 993 . 1 1 93 93 CYS H H 1 8.913 0.03 . 1 . . . . 205 CYS H . 11012 1 994 . 1 1 93 93 CYS HA H 1 3.723 0.03 . 1 . . . . 205 CYS HA . 11012 1 995 . 1 1 93 93 CYS C C 13 172.539 0.1 . 1 . . . . 205 CYS C . 11012 1 996 . 1 1 93 93 CYS CA C 13 55.804 0.1 . 1 . . . . 205 CYS CA . 11012 1 997 . 1 1 93 93 CYS CB C 13 33.600 0.1 . 1 . . . . 205 CYS CB . 11012 1 998 . 1 1 93 93 CYS N N 15 124.459 0.1 . 1 . . . . 205 CYS N . 11012 1 999 . 1 1 94 94 PRO HA H 1 4.421 0.03 . 1 . . . . 206 PRO HA . 11012 1 1000 . 1 1 94 94 PRO HB2 H 1 2.433 0.03 . 1 . . . . 206 PRO HB2 . 11012 1 1001 . 1 1 94 94 PRO HB3 H 1 1.943 0.03 . 1 . . . . 206 PRO HB3 . 11012 1 1002 . 1 1 94 94 PRO HG2 H 1 1.897 0.03 . 1 . . . . 206 PRO HG2 . 11012 1 1003 . 1 1 94 94 PRO HG3 H 1 1.897 0.03 . 1 . . . . 206 PRO HG3 . 11012 1 1004 . 1 1 94 94 PRO HD2 H 1 3.911 0.03 . 1 . . . . 206 PRO HD2 . 11012 1 1005 . 1 1 94 94 PRO HD3 H 1 3.911 0.03 . 1 . . . . 206 PRO HD3 . 11012 1 1006 . 1 1 94 94 PRO C C 13 178.572 0.1 . 1 . . . . 206 PRO C . 11012 1 1007 . 1 1 94 94 PRO CA C 13 65.300 0.1 . 1 . . . . 206 PRO CA . 11012 1 1008 . 1 1 94 94 PRO CB C 13 31.532 0.1 . 1 . . . . 206 PRO CB . 11012 1 1009 . 1 1 94 94 PRO CG C 13 27.452 0.1 . 1 . . . . 206 PRO CG . 11012 1 1010 . 1 1 94 94 PRO CD C 13 49.841 0.1 . 1 . . . . 206 PRO CD . 11012 1 1011 . 1 1 95 95 ASN H H 1 8.078 0.03 . 1 . . . . 207 ASN H . 11012 1 1012 . 1 1 95 95 ASN HA H 1 4.354 0.03 . 1 . . . . 207 ASN HA . 11012 1 1013 . 1 1 95 95 ASN HB2 H 1 2.654 0.03 . 1 . . . . 207 ASN HB2 . 11012 1 1014 . 1 1 95 95 ASN HB3 H 1 2.842 0.03 . 1 . . . . 207 ASN HB3 . 11012 1 1015 . 1 1 95 95 ASN HD21 H 1 7.432 0.03 . 1 . . . . 207 ASN HD21 . 11012 1 1016 . 1 1 95 95 ASN HD22 H 1 6.894 0.03 . 1 . . . . 207 ASN HD22 . 11012 1 1017 . 1 1 95 95 ASN C C 13 178.243 0.1 . 1 . . . . 207 ASN C . 11012 1 1018 . 1 1 95 95 ASN CA C 13 56.075 0.1 . 1 . . . . 207 ASN CA . 11012 1 1019 . 1 1 95 95 ASN CB C 13 38.109 0.1 . 1 . . . . 207 ASN CB . 11012 1 1020 . 1 1 95 95 ASN N N 15 114.342 0.1 . 1 . . . . 207 ASN N . 11012 1 1021 . 1 1 95 95 ASN ND2 N 15 112.100 0.1 . 1 . . . . 207 ASN ND2 . 11012 1 1022 . 1 1 96 96 HIS H H 1 8.974 0.03 . 1 . . . . 208 HIS H . 11012 1 1023 . 1 1 96 96 HIS HA H 1 4.491 0.03 . 1 . . . . 208 HIS HA . 11012 1 1024 . 1 1 96 96 HIS HB2 H 1 3.391 0.03 . 2 . . . . 208 HIS HB2 . 11012 1 1025 . 1 1 96 96 HIS HB3 H 1 3.683 0.03 . 2 . . . . 208 HIS HB3 . 11012 1 1026 . 1 1 96 96 HIS C C 13 178.106 0.1 . 1 . . . . 208 HIS C . 11012 1 1027 . 1 1 96 96 HIS CA C 13 62.076 0.1 . 1 . . . . 208 HIS CA . 11012 1 1028 . 1 1 96 96 HIS CB C 13 30.034 0.1 . 1 . . . . 208 HIS CB . 11012 1 1029 . 1 1 96 96 HIS N N 15 119.650 0.1 . 1 . . . . 208 HIS N . 11012 1 1030 . 1 1 97 97 GLU H H 1 9.084 0.03 . 1 . . . . 209 GLU H . 11012 1 1031 . 1 1 97 97 GLU HA H 1 4.099 0.03 . 1 . . . . 209 GLU HA . 11012 1 1032 . 1 1 97 97 GLU HB2 H 1 1.918 0.03 . 1 . . . . 209 GLU HB2 . 11012 1 1033 . 1 1 97 97 GLU HB3 H 1 2.100 0.03 . 1 . . . . 209 GLU HB3 . 11012 1 1034 . 1 1 97 97 GLU C C 13 176.819 0.1 . 1 . . . . 209 GLU C . 11012 1 1035 . 1 1 97 97 GLU CA C 13 59.304 0.1 . 1 . . . . 209 GLU CA . 11012 1 1036 . 1 1 97 97 GLU CB C 13 29.696 0.1 . 1 . . . . 209 GLU CB . 11012 1 1037 . 1 1 97 97 GLU CG C 13 35.500 0.1 . 1 . . . . 209 GLU CG . 11012 1 1038 . 1 1 97 97 GLU N N 15 123.470 0.1 . 1 . . . . 209 GLU N . 11012 1 1039 . 1 1 98 98 LEU H H 1 7.788 0.03 . 1 . . . . 210 LEU H . 11012 1 1040 . 1 1 98 98 LEU HA H 1 4.312 0.03 . 1 . . . . 210 LEU HA . 11012 1 1041 . 1 1 98 98 LEU HB2 H 1 1.646 0.03 . 1 . . . . 210 LEU HB2 . 11012 1 1042 . 1 1 98 98 LEU HB3 H 1 1.793 0.03 . 1 . . . . 210 LEU HB3 . 11012 1 1043 . 1 1 98 98 LEU HG H 1 1.803 0.03 . 1 . . . . 210 LEU HG . 11012 1 1044 . 1 1 98 98 LEU HD11 H 1 0.871 0.03 . 1 . . . . 210 LEU HD1 . 11012 1 1045 . 1 1 98 98 LEU HD12 H 1 0.871 0.03 . 1 . . . . 210 LEU HD1 . 11012 1 1046 . 1 1 98 98 LEU HD13 H 1 0.871 0.03 . 1 . . . . 210 LEU HD1 . 11012 1 1047 . 1 1 98 98 LEU HD21 H 1 0.903 0.03 . 1 . . . . 210 LEU HD2 . 11012 1 1048 . 1 1 98 98 LEU HD22 H 1 0.903 0.03 . 1 . . . . 210 LEU HD2 . 11012 1 1049 . 1 1 98 98 LEU HD23 H 1 0.903 0.03 . 1 . . . . 210 LEU HD2 . 11012 1 1050 . 1 1 98 98 LEU C C 13 178.091 0.1 . 1 . . . . 210 LEU C . 11012 1 1051 . 1 1 98 98 LEU CA C 13 54.657 0.1 . 1 . . . . 210 LEU CA . 11012 1 1052 . 1 1 98 98 LEU CB C 13 41.623 0.1 . 1 . . . . 210 LEU CB . 11012 1 1053 . 1 1 98 98 LEU CG C 13 26.873 0.1 . 1 . . . . 210 LEU CG . 11012 1 1054 . 1 1 98 98 LEU CD1 C 13 22.293 0.1 . 1 . . . . 210 LEU CD1 . 11012 1 1055 . 1 1 98 98 LEU CD2 C 13 24.473 0.1 . 1 . . . . 210 LEU CD2 . 11012 1 1056 . 1 1 98 98 LEU N N 15 113.927 0.1 . 1 . . . . 210 LEU N . 11012 1 1057 . 1 1 99 99 SER H H 1 7.024 0.03 . 1 . . . . 211 SER H . 11012 1 1058 . 1 1 99 99 SER HA H 1 4.432 0.03 . 1 . . . . 211 SER HA . 11012 1 1059 . 1 1 99 99 SER HB2 H 1 4.212 0.03 . 2 . . . . 211 SER HB2 . 11012 1 1060 . 1 1 99 99 SER HB3 H 1 3.963 0.03 . 2 . . . . 211 SER HB3 . 11012 1 1061 . 1 1 99 99 SER C C 13 174.953 0.1 . 1 . . . . 211 SER C . 11012 1 1062 . 1 1 99 99 SER CA C 13 57.649 0.1 . 1 . . . . 211 SER CA . 11012 1 1063 . 1 1 99 99 SER CB C 13 63.378 0.1 . 1 . . . . 211 SER CB . 11012 1 1064 . 1 1 99 99 SER N N 15 113.386 0.1 . 1 . . . . 211 SER N . 11012 1 1065 . 1 1 100 100 ARG C C 13 175.568 0.1 . 1 . . . . 212 ARG C . 11012 1 1066 . 1 1 100 100 ARG CA C 13 62.560 0.1 . 1 . . . . 212 ARG CA . 11012 1 1067 . 1 1 101 101 GLU H H 1 8.526 0.03 . 1 . . . . 213 GLU H . 11012 1 1068 . 1 1 101 101 GLU HB2 H 1 1.820 0.03 . 2 . . . . 213 GLU HB2 . 11012 1 1069 . 1 1 101 101 GLU HB3 H 1 1.545 0.03 . 2 . . . . 213 GLU HB3 . 11012 1 1070 . 1 1 101 101 GLU C C 13 175.740 0.1 . 1 . . . . 213 GLU C . 11012 1 1071 . 1 1 101 101 GLU CA C 13 52.271 0.1 . 1 . . . . 213 GLU CA . 11012 1 1072 . 1 1 101 101 GLU CB C 13 31.028 0.1 . 1 . . . . 213 GLU CB . 11012 1 1073 . 1 1 101 101 GLU N N 15 123.840 0.1 . 1 . . . . 213 GLU N . 11012 1 1074 . 1 1 102 102 PHE H H 1 7.889 0.03 . 1 . . . . 214 PHE H . 11012 1 1075 . 1 1 102 102 PHE HA H 1 4.320 0.03 . 1 . . . . 214 PHE HA . 11012 1 1076 . 1 1 102 102 PHE C C 13 175.510 0.1 . 1 . . . . 214 PHE C . 11012 1 1077 . 1 1 102 102 PHE CA C 13 58.512 0.1 . 1 . . . . 214 PHE CA . 11012 1 1078 . 1 1 102 102 PHE N N 15 109.720 0.1 . 1 . . . . 214 PHE N . 11012 1 1079 . 1 1 103 103 ASN H H 1 7.856 0.03 . 1 . . . . 215 ASN H . 11012 1 1080 . 1 1 103 103 ASN HA H 1 5.095 0.03 . 1 . . . . 215 ASN HA . 11012 1 1081 . 1 1 103 103 ASN HB2 H 1 3.021 0.03 . 1 . . . . 215 ASN HB2 . 11012 1 1082 . 1 1 103 103 ASN HB3 H 1 2.800 0.03 . 1 . . . . 215 ASN HB3 . 11012 1 1083 . 1 1 103 103 ASN C C 13 175.980 0.1 . 1 . . . . 215 ASN C . 11012 1 1084 . 1 1 103 103 ASN CA C 13 52.919 0.1 . 1 . . . . 215 ASN CA . 11012 1 1085 . 1 1 103 103 ASN CB C 13 39.898 0.1 . 1 . . . . 215 ASN CB . 11012 1 1086 . 1 1 103 103 ASN N N 15 118.068 0.1 . 1 . . . . 215 ASN N . 11012 1 1087 . 1 1 104 104 GLU H H 1 8.303 0.03 . 1 . . . . 216 GLU H . 11012 1 1088 . 1 1 104 104 GLU HA H 1 4.372 0.03 . 1 . . . . 216 GLU HA . 11012 1 1089 . 1 1 104 104 GLU HB2 H 1 2.122 0.03 . 2 . . . . 216 GLU HB2 . 11012 1 1090 . 1 1 104 104 GLU HB3 H 1 2.066 0.03 . 2 . . . . 216 GLU HB3 . 11012 1 1091 . 1 1 104 104 GLU HG2 H 1 2.366 0.03 . 1 . . . . 216 GLU HG2 . 11012 1 1092 . 1 1 104 104 GLU HG3 H 1 2.366 0.03 . 1 . . . . 216 GLU HG3 . 11012 1 1093 . 1 1 104 104 GLU C C 13 177.768 0.1 . 1 . . . . 216 GLU C . 11012 1 1094 . 1 1 104 104 GLU CA C 13 57.267 0.1 . 1 . . . . 216 GLU CA . 11012 1 1095 . 1 1 104 104 GLU CB C 13 29.740 0.1 . 1 . . . . 216 GLU CB . 11012 1 1096 . 1 1 104 104 GLU CG C 13 35.766 0.1 . 1 . . . . 216 GLU CG . 11012 1 1097 . 1 1 104 104 GLU N N 15 122.388 0.1 . 1 . . . . 216 GLU N . 11012 1 1098 . 1 1 105 105 GLY H H 1 9.049 0.03 . 1 . . . . 217 GLY H . 11012 1 1099 . 1 1 105 105 GLY HA2 H 1 4.065 0.03 . 2 . . . . 217 GLY HA2 . 11012 1 1100 . 1 1 105 105 GLY HA3 H 1 3.890 0.03 . 2 . . . . 217 GLY HA3 . 11012 1 1101 . 1 1 105 105 GLY C C 13 174.015 0.1 . 1 . . . . 217 GLY C . 11012 1 1102 . 1 1 105 105 GLY CA C 13 45.719 0.1 . 1 . . . . 217 GLY CA . 11012 1 1103 . 1 1 105 105 GLY N N 15 113.290 0.1 . 1 . . . . 217 GLY N . 11012 1 1104 . 1 1 106 106 GLN H H 1 7.823 0.03 . 1 . . . . 218 GLN H . 11012 1 1105 . 1 1 106 106 GLN HA H 1 4.569 0.03 . 1 . . . . 218 GLN HA . 11012 1 1106 . 1 1 106 106 GLN HB2 H 1 2.118 0.03 . 2 . . . . 218 GLN HB2 . 11012 1 1107 . 1 1 106 106 GLN HB3 H 1 2.115 0.03 . 2 . . . . 218 GLN HB3 . 11012 1 1108 . 1 1 106 106 GLN HG2 H 1 2.477 0.03 . 1 . . . . 218 GLN HG2 . 11012 1 1109 . 1 1 106 106 GLN HG3 H 1 2.477 0.03 . 1 . . . . 218 GLN HG3 . 11012 1 1110 . 1 1 106 106 GLN C C 13 176.078 0.1 . 1 . . . . 218 GLN C . 11012 1 1111 . 1 1 106 106 GLN CA C 13 53.911 0.1 . 1 . . . . 218 GLN CA . 11012 1 1112 . 1 1 106 106 GLN CB C 13 28.702 0.1 . 1 . . . . 218 GLN CB . 11012 1 1113 . 1 1 106 106 GLN CG C 13 32.166 0.1 . 1 . . . . 218 GLN CG . 11012 1 1114 . 1 1 106 106 GLN N N 15 117.082 0.1 . 1 . . . . 218 GLN N . 11012 1 1115 . 1 1 107 107 ILE H H 1 8.122 0.03 . 1 . . . . 219 ILE H . 11012 1 1116 . 1 1 107 107 ILE HA H 1 4.177 0.03 . 1 . . . . 219 ILE HA . 11012 1 1117 . 1 1 107 107 ILE HB H 1 1.978 0.03 . 1 . . . . 219 ILE HB . 11012 1 1118 . 1 1 107 107 ILE HG12 H 1 1.361 0.03 . 1 . . . . 219 ILE HG12 . 11012 1 1119 . 1 1 107 107 ILE HG13 H 1 1.514 0.03 . 1 . . . . 219 ILE HG13 . 11012 1 1120 . 1 1 107 107 ILE HG21 H 1 1.019 0.03 . 1 . . . . 219 ILE HG2 . 11012 1 1121 . 1 1 107 107 ILE HG22 H 1 1.019 0.03 . 1 . . . . 219 ILE HG2 . 11012 1 1122 . 1 1 107 107 ILE HG23 H 1 1.019 0.03 . 1 . . . . 219 ILE HG2 . 11012 1 1123 . 1 1 107 107 ILE HD11 H 1 0.989 0.03 . 1 . . . . 219 ILE HD1 . 11012 1 1124 . 1 1 107 107 ILE HD12 H 1 0.989 0.03 . 1 . . . . 219 ILE HD1 . 11012 1 1125 . 1 1 107 107 ILE HD13 H 1 0.989 0.03 . 1 . . . . 219 ILE HD1 . 11012 1 1126 . 1 1 107 107 ILE C C 13 176.587 0.1 . 1 . . . . 219 ILE C . 11012 1 1127 . 1 1 107 107 ILE CA C 13 61.306 0.1 . 1 . . . . 219 ILE CA . 11012 1 1128 . 1 1 107 107 ILE CB C 13 38.686 0.1 . 1 . . . . 219 ILE CB . 11012 1 1129 . 1 1 107 107 ILE CG1 C 13 27.320 0.1 . 1 . . . . 219 ILE CG1 . 11012 1 1130 . 1 1 107 107 ILE CG2 C 13 17.629 0.1 . 1 . . . . 219 ILE CG2 . 11012 1 1131 . 1 1 107 107 ILE CD1 C 13 12.917 0.1 . 1 . . . . 219 ILE CD1 . 11012 1 1132 . 1 1 107 107 ILE N N 15 118.970 0.1 . 1 . . . . 219 ILE N . 11012 1 1133 . 1 1 108 108 ALA H H 1 7.941 0.03 . 1 . . . . 220 ALA H . 11012 1 1134 . 1 1 108 108 ALA HA H 1 3.262 0.03 . 1 . . . . 220 ALA HA . 11012 1 1135 . 1 1 108 108 ALA HB1 H 1 0.752 0.03 . 1 . . . . 220 ALA HB . 11012 1 1136 . 1 1 108 108 ALA HB2 H 1 0.752 0.03 . 1 . . . . 220 ALA HB . 11012 1 1137 . 1 1 108 108 ALA HB3 H 1 0.752 0.03 . 1 . . . . 220 ALA HB . 11012 1 1138 . 1 1 108 108 ALA C C 13 174.490 0.1 . 1 . . . . 220 ALA C . 11012 1 1139 . 1 1 108 108 ALA CA C 13 49.872 0.1 . 1 . . . . 220 ALA CA . 11012 1 1140 . 1 1 108 108 ALA CB C 13 17.406 0.1 . 1 . . . . 220 ALA CB . 11012 1 1141 . 1 1 108 108 ALA N N 15 125.660 0.1 . 1 . . . . 220 ALA N . 11012 1 1142 . 1 1 109 109 PRO HD2 H 1 3.255 0.03 . 2 . . . . 221 PRO HD2 . 11012 1 1143 . 1 1 109 109 PRO HD3 H 1 2.138 0.03 . 2 . . . . 221 PRO HD3 . 11012 1 1144 . 1 1 109 109 PRO CG C 13 27.589 0.1 . 1 . . . . 221 PRO CG . 11012 1 1145 . 1 1 109 109 PRO CD C 13 50.446 0.1 . 1 . . . . 221 PRO CD . 11012 1 1146 . 1 1 110 110 PRO HA H 1 4.504 0.03 . 1 . . . . 222 PRO HA . 11012 1 1147 . 1 1 110 110 PRO HB2 H 1 2.295 0.03 . 2 . . . . 222 PRO HB2 . 11012 1 1148 . 1 1 110 110 PRO HB3 H 1 1.947 0.03 . 2 . . . . 222 PRO HB3 . 11012 1 1149 . 1 1 110 110 PRO HG2 H 1 1.955 0.03 . 1 . . . . 222 PRO HG2 . 11012 1 1150 . 1 1 110 110 PRO HG3 H 1 1.955 0.03 . 1 . . . . 222 PRO HG3 . 11012 1 1151 . 1 1 110 110 PRO HD2 H 1 3.857 0.03 . 1 . . . . 222 PRO HD2 . 11012 1 1152 . 1 1 110 110 PRO HD3 H 1 3.857 0.03 . 1 . . . . 222 PRO HD3 . 11012 1 1153 . 1 1 110 110 PRO C C 13 176.865 0.1 . 1 . . . . 222 PRO C . 11012 1 1154 . 1 1 110 110 PRO CA C 13 62.802 0.1 . 1 . . . . 222 PRO CA . 11012 1 1155 . 1 1 110 110 PRO CB C 13 31.798 0.1 . 1 . . . . 222 PRO CB . 11012 1 1156 . 1 1 110 110 PRO CG C 13 26.853 0.1 . 1 . . . . 222 PRO CG . 11012 1 1157 . 1 1 110 110 PRO CD C 13 50.203 0.1 . 1 . . . . 222 PRO CD . 11012 1 1158 . 1 1 113 113 LEU H H 1 8.688 0.03 . 1 . . . . 225 LEU H . 11012 1 1159 . 1 1 113 113 LEU HG H 1 1.746 0.03 . 1 . . . . 225 LEU HG . 11012 1 1160 . 1 1 113 113 LEU HD11 H 1 1.008 0.03 . 1 . . . . 225 LEU HD1 . 11012 1 1161 . 1 1 113 113 LEU HD12 H 1 1.008 0.03 . 1 . . . . 225 LEU HD1 . 11012 1 1162 . 1 1 113 113 LEU HD13 H 1 1.008 0.03 . 1 . . . . 225 LEU HD1 . 11012 1 1163 . 1 1 113 113 LEU HD21 H 1 0.821 0.03 . 2 . . . . 225 LEU HD2 . 11012 1 1164 . 1 1 113 113 LEU HD22 H 1 0.821 0.03 . 2 . . . . 225 LEU HD2 . 11012 1 1165 . 1 1 113 113 LEU HD23 H 1 0.821 0.03 . 2 . . . . 225 LEU HD2 . 11012 1 1166 . 1 1 113 113 LEU CG C 13 27.095 0.1 . 1 . . . . 225 LEU CG . 11012 1 1167 . 1 1 113 113 LEU CD1 C 13 26.250 0.1 . 1 . . . . 225 LEU CD1 . 11012 1 1168 . 1 1 113 113 LEU CD2 C 13 25.600 0.1 . 2 . . . . 225 LEU CD2 . 11012 1 1169 . 1 1 114 114 ILE HA H 1 4.413 0.03 . 1 . . . . 226 ILE HA . 11012 1 1170 . 1 1 114 114 ILE HB H 1 1.726 0.03 . 1 . . . . 226 ILE HB . 11012 1 1171 . 1 1 114 114 ILE HG21 H 1 0.462 0.03 . 1 . . . . 226 ILE HG2 . 11012 1 1172 . 1 1 114 114 ILE HG22 H 1 0.462 0.03 . 1 . . . . 226 ILE HG2 . 11012 1 1173 . 1 1 114 114 ILE HG23 H 1 0.462 0.03 . 1 . . . . 226 ILE HG2 . 11012 1 1174 . 1 1 114 114 ILE HD11 H 1 0.618 0.03 . 1 . . . . 226 ILE HD1 . 11012 1 1175 . 1 1 114 114 ILE HD12 H 1 0.618 0.03 . 1 . . . . 226 ILE HD1 . 11012 1 1176 . 1 1 114 114 ILE HD13 H 1 0.618 0.03 . 1 . . . . 226 ILE HD1 . 11012 1 1177 . 1 1 114 114 ILE CA C 13 60.748 0.1 . 1 . . . . 226 ILE CA . 11012 1 1178 . 1 1 114 114 ILE CB C 13 38.389 0.1 . 1 . . . . 226 ILE CB . 11012 1 1179 . 1 1 114 114 ILE CG1 C 13 26.181 0.1 . 1 . . . . 226 ILE CG1 . 11012 1 1180 . 1 1 114 114 ILE CG2 C 13 18.078 0.1 . 1 . . . . 226 ILE CG2 . 11012 1 1181 . 1 1 114 114 ILE CD1 C 13 14.722 0.1 . 1 . . . . 226 ILE CD1 . 11012 1 1182 . 1 1 115 115 ARG C C 13 176.406 0.1 . 1 . . . . 227 ARG C . 11012 1 1183 . 1 1 116 116 VAL H H 1 7.730 0.03 . 1 . . . . 228 VAL H . 11012 1 1184 . 1 1 116 116 VAL HA H 1 4.720 0.03 . 1 . . . . 228 VAL HA . 11012 1 1185 . 1 1 116 116 VAL HB H 1 1.486 0.03 . 1 . . . . 228 VAL HB . 11012 1 1186 . 1 1 116 116 VAL HG11 H 1 0.777 0.03 . 2 . . . . 228 VAL HG1 . 11012 1 1187 . 1 1 116 116 VAL HG12 H 1 0.777 0.03 . 2 . . . . 228 VAL HG1 . 11012 1 1188 . 1 1 116 116 VAL HG13 H 1 0.777 0.03 . 2 . . . . 228 VAL HG1 . 11012 1 1189 . 1 1 116 116 VAL HG21 H 1 0.791 0.03 . 2 . . . . 228 VAL HG2 . 11012 1 1190 . 1 1 116 116 VAL HG22 H 1 0.791 0.03 . 2 . . . . 228 VAL HG2 . 11012 1 1191 . 1 1 116 116 VAL HG23 H 1 0.791 0.03 . 2 . . . . 228 VAL HG2 . 11012 1 1192 . 1 1 116 116 VAL C C 13 175.376 0.1 . 1 . . . . 228 VAL C . 11012 1 1193 . 1 1 116 116 VAL CA C 13 60.250 0.1 . 1 . . . . 228 VAL CA . 11012 1 1194 . 1 1 116 116 VAL CB C 13 33.526 0.1 . 1 . . . . 228 VAL CB . 11012 1 1195 . 1 1 116 116 VAL CG1 C 13 23.369 0.1 . 2 . . . . 228 VAL CG1 . 11012 1 1196 . 1 1 116 116 VAL CG2 C 13 21.944 0.1 . 2 . . . . 228 VAL CG2 . 11012 1 1197 . 1 1 116 116 VAL N N 15 119.377 0.1 . 1 . . . . 228 VAL N . 11012 1 1198 . 1 1 117 117 GLU H H 1 8.583 0.03 . 1 . . . . 229 GLU H . 11012 1 1199 . 1 1 117 117 GLU HA H 1 4.503 0.03 . 1 . . . . 229 GLU HA . 11012 1 1200 . 1 1 117 117 GLU HB2 H 1 1.674 0.03 . 1 . . . . 229 GLU HB2 . 11012 1 1201 . 1 1 117 117 GLU HB3 H 1 1.839 0.03 . 1 . . . . 229 GLU HB3 . 11012 1 1202 . 1 1 117 117 GLU HG2 H 1 1.839 0.03 . 1 . . . . 229 GLU HG2 . 11012 1 1203 . 1 1 117 117 GLU HG3 H 1 2.200 0.03 . 1 . . . . 229 GLU HG3 . 11012 1 1204 . 1 1 117 117 GLU C C 13 176.082 0.1 . 1 . . . . 229 GLU C . 11012 1 1205 . 1 1 117 117 GLU CA C 13 53.956 0.1 . 1 . . . . 229 GLU CA . 11012 1 1206 . 1 1 117 117 GLU CB C 13 31.018 0.1 . 1 . . . . 229 GLU CB . 11012 1 1207 . 1 1 117 117 GLU CG C 13 35.191 0.1 . 1 . . . . 229 GLU CG . 11012 1 1208 . 1 1 117 117 GLU N N 15 130.458 0.1 . 1 . . . . 229 GLU N . 11012 1 1209 . 1 1 118 118 GLY H H 1 8.686 0.03 . 1 . . . . 230 GLY H . 11012 1 1210 . 1 1 118 118 GLY HA2 H 1 3.793 0.03 . 1 . . . . 230 GLY HA2 . 11012 1 1211 . 1 1 118 118 GLY HA3 H 1 3.927 0.03 . 1 . . . . 230 GLY HA3 . 11012 1 1212 . 1 1 118 118 GLY C C 13 174.251 0.1 . 1 . . . . 230 GLY C . 11012 1 1213 . 1 1 118 118 GLY CA C 13 46.165 0.1 . 1 . . . . 230 GLY CA . 11012 1 1214 . 1 1 118 118 GLY N N 15 111.216 0.1 . 1 . . . . 230 GLY N . 11012 1 1215 . 1 1 119 119 ASN H H 1 7.947 0.03 . 1 . . . . 231 ASN H . 11012 1 1216 . 1 1 119 119 ASN HA H 1 4.930 0.03 . 1 . . . . 231 ASN HA . 11012 1 1217 . 1 1 119 119 ASN HB2 H 1 2.453 0.03 . 1 . . . . 231 ASN HB2 . 11012 1 1218 . 1 1 119 119 ASN HB3 H 1 2.756 0.03 . 1 . . . . 231 ASN HB3 . 11012 1 1219 . 1 1 119 119 ASN HD21 H 1 8.325 0.03 . 1 . . . . 231 ASN HD21 . 11012 1 1220 . 1 1 119 119 ASN HD22 H 1 7.418 0.03 . 1 . . . . 231 ASN HD22 . 11012 1 1221 . 1 1 119 119 ASN C C 13 175.877 0.1 . 1 . . . . 231 ASN C . 11012 1 1222 . 1 1 119 119 ASN CA C 13 52.365 0.1 . 1 . . . . 231 ASN CA . 11012 1 1223 . 1 1 119 119 ASN CB C 13 39.906 0.1 . 1 . . . . 231 ASN CB . 11012 1 1224 . 1 1 119 119 ASN N N 15 116.036 0.1 . 1 . . . . 231 ASN N . 11012 1 1225 . 1 1 119 119 ASN ND2 N 15 113.754 0.1 . 1 . . . . 231 ASN ND2 . 11012 1 1226 . 1 1 120 120 SER H H 1 8.931 0.03 . 1 . . . . 232 SER H . 11012 1 1227 . 1 1 120 120 SER HA H 1 4.328 0.03 . 1 . . . . 232 SER HA . 11012 1 1228 . 1 1 120 120 SER HB2 H 1 3.840 0.03 . 1 . . . . 232 SER HB2 . 11012 1 1229 . 1 1 120 120 SER HB3 H 1 3.840 0.03 . 1 . . . . 232 SER HB3 . 11012 1 1230 . 1 1 120 120 SER C C 13 174.556 0.1 . 1 . . . . 232 SER C . 11012 1 1231 . 1 1 120 120 SER CA C 13 59.770 0.1 . 1 . . . . 232 SER CA . 11012 1 1232 . 1 1 120 120 SER CB C 13 62.435 0.1 . 1 . . . . 232 SER CB . 11012 1 1233 . 1 1 120 120 SER N N 15 116.870 0.1 . 1 . . . . 232 SER N . 11012 1 1234 . 1 1 121 121 HIS H H 1 8.864 0.03 . 1 . . . . 233 HIS H . 11012 1 1235 . 1 1 121 121 HIS HA H 1 4.789 0.03 . 1 . . . . 233 HIS HA . 11012 1 1236 . 1 1 121 121 HIS HB2 H 1 3.374 0.03 . 2 . . . . 233 HIS HB2 . 11012 1 1237 . 1 1 121 121 HIS HB3 H 1 3.036 0.03 . 2 . . . . 233 HIS HB3 . 11012 1 1238 . 1 1 121 121 HIS C C 13 174.395 0.1 . 1 . . . . 233 HIS C . 11012 1 1239 . 1 1 121 121 HIS CA C 13 54.853 0.1 . 1 . . . . 233 HIS CA . 11012 1 1240 . 1 1 121 121 HIS CB C 13 28.803 0.1 . 1 . . . . 233 HIS CB . 11012 1 1241 . 1 1 121 121 HIS N N 15 119.365 0.1 . 1 . . . . 233 HIS N . 11012 1 1242 . 1 1 122 122 ALA H H 1 7.106 0.03 . 1 . . . . 234 ALA H . 11012 1 1243 . 1 1 122 122 ALA HA H 1 4.714 0.03 . 1 . . . . 234 ALA HA . 11012 1 1244 . 1 1 122 122 ALA HB1 H 1 1.171 0.03 . 1 . . . . 234 ALA HB . 11012 1 1245 . 1 1 122 122 ALA HB2 H 1 1.171 0.03 . 1 . . . . 234 ALA HB . 11012 1 1246 . 1 1 122 122 ALA HB3 H 1 1.171 0.03 . 1 . . . . 234 ALA HB . 11012 1 1247 . 1 1 122 122 ALA C C 13 176.865 0.1 . 1 . . . . 234 ALA C . 11012 1 1248 . 1 1 122 122 ALA CA C 13 52.229 0.1 . 1 . . . . 234 ALA CA . 11012 1 1249 . 1 1 122 122 ALA CB C 13 18.340 0.1 . 1 . . . . 234 ALA CB . 11012 1 1250 . 1 1 122 122 ALA N N 15 121.532 0.1 . 1 . . . . 234 ALA N . 11012 1 1251 . 1 1 123 123 GLN H H 1 9.075 0.03 . 1 . . . . 235 GLN H . 11012 1 1252 . 1 1 123 123 GLN HA H 1 4.730 0.03 . 1 . . . . 235 GLN HA . 11012 1 1253 . 1 1 123 123 GLN HB2 H 1 2.011 0.03 . 1 . . . . 235 GLN HB2 . 11012 1 1254 . 1 1 123 123 GLN HB3 H 1 1.838 0.03 . 1 . . . . 235 GLN HB3 . 11012 1 1255 . 1 1 123 123 GLN HG2 H 1 2.396 0.03 . 2 . . . . 235 GLN HG2 . 11012 1 1256 . 1 1 123 123 GLN HG3 H 1 2.256 0.03 . 2 . . . . 235 GLN HG3 . 11012 1 1257 . 1 1 123 123 GLN HE21 H 1 7.467 0.03 . 1 . . . . 235 GLN HE21 . 11012 1 1258 . 1 1 123 123 GLN HE22 H 1 6.799 0.03 . 1 . . . . 235 GLN HE22 . 11012 1 1259 . 1 1 123 123 GLN C C 13 173.479 0.1 . 1 . . . . 235 GLN C . 11012 1 1260 . 1 1 123 123 GLN CA C 13 53.998 0.1 . 1 . . . . 235 GLN CA . 11012 1 1261 . 1 1 123 123 GLN CB C 13 31.449 0.1 . 1 . . . . 235 GLN CB . 11012 1 1262 . 1 1 123 123 GLN CG C 13 33.205 0.1 . 1 . . . . 235 GLN CG . 11012 1 1263 . 1 1 123 123 GLN N N 15 121.943 0.1 . 1 . . . . 235 GLN N . 11012 1 1264 . 1 1 123 123 GLN NE2 N 15 110.794 0.1 . 1 . . . . 235 GLN NE2 . 11012 1 1265 . 1 1 124 124 TYR H H 1 8.944 0.03 . 1 . . . . 236 TYR H . 11012 1 1266 . 1 1 124 124 TYR HA H 1 4.816 0.03 . 1 . . . . 236 TYR HA . 11012 1 1267 . 1 1 124 124 TYR HB2 H 1 2.718 0.03 . 2 . . . . 236 TYR HB2 . 11012 1 1268 . 1 1 124 124 TYR HB3 H 1 2.285 0.03 . 2 . . . . 236 TYR HB3 . 11012 1 1269 . 1 1 124 124 TYR HE1 H 1 6.475 0.03 . 1 . . . . 236 TYR HE1 . 11012 1 1270 . 1 1 124 124 TYR HE2 H 1 6.475 0.03 . 1 . . . . 236 TYR HE2 . 11012 1 1271 . 1 1 124 124 TYR C C 13 176.039 0.1 . 1 . . . . 236 TYR C . 11012 1 1272 . 1 1 124 124 TYR CA C 13 58.437 0.1 . 1 . . . . 236 TYR CA . 11012 1 1273 . 1 1 124 124 TYR CB C 13 38.022 0.1 . 1 . . . . 236 TYR CB . 11012 1 1274 . 1 1 124 124 TYR N N 15 125.580 0.1 . 1 . . . . 236 TYR N . 11012 1 1275 . 1 1 125 125 VAL H H 1 9.253 0.03 . 1 . . . . 237 VAL H . 11012 1 1276 . 1 1 125 125 VAL HA H 1 4.762 0.03 . 1 . . . . 237 VAL HA . 11012 1 1277 . 1 1 125 125 VAL HB H 1 2.126 0.03 . 1 . . . . 237 VAL HB . 11012 1 1278 . 1 1 125 125 VAL HG11 H 1 0.895 0.03 . 1 . . . . 237 VAL HG1 . 11012 1 1279 . 1 1 125 125 VAL HG12 H 1 0.895 0.03 . 1 . . . . 237 VAL HG1 . 11012 1 1280 . 1 1 125 125 VAL HG13 H 1 0.895 0.03 . 1 . . . . 237 VAL HG1 . 11012 1 1281 . 1 1 125 125 VAL HG21 H 1 0.826 0.03 . 1 . . . . 237 VAL HG2 . 11012 1 1282 . 1 1 125 125 VAL HG22 H 1 0.826 0.03 . 1 . . . . 237 VAL HG2 . 11012 1 1283 . 1 1 125 125 VAL HG23 H 1 0.826 0.03 . 1 . . . . 237 VAL HG2 . 11012 1 1284 . 1 1 125 125 VAL C C 13 174.155 0.1 . 1 . . . . 237 VAL C . 11012 1 1285 . 1 1 125 125 VAL CA C 13 60.347 0.1 . 1 . . . . 237 VAL CA . 11012 1 1286 . 1 1 125 125 VAL CB C 13 35.094 0.1 . 1 . . . . 237 VAL CB . 11012 1 1287 . 1 1 125 125 VAL CG1 C 13 21.159 0.1 . 1 . . . . 237 VAL CG1 . 11012 1 1288 . 1 1 125 125 VAL CG2 C 13 19.643 0.1 . 1 . . . . 237 VAL CG2 . 11012 1 1289 . 1 1 125 125 VAL N N 15 122.156 0.1 . 1 . . . . 237 VAL N . 11012 1 1290 . 1 1 126 126 GLU H H 1 8.296 0.03 . 1 . . . . 238 GLU H . 11012 1 1291 . 1 1 126 126 GLU HA H 1 5.065 0.03 . 1 . . . . 238 GLU HA . 11012 1 1292 . 1 1 126 126 GLU HB2 H 1 2.113 0.03 . 2 . . . . 238 GLU HB2 . 11012 1 1293 . 1 1 126 126 GLU HB3 H 1 1.949 0.03 . 2 . . . . 238 GLU HB3 . 11012 1 1294 . 1 1 126 126 GLU HG2 H 1 2.036 0.03 . 2 . . . . 238 GLU HG2 . 11012 1 1295 . 1 1 126 126 GLU HG3 H 1 1.987 0.03 . 2 . . . . 238 GLU HG3 . 11012 1 1296 . 1 1 126 126 GLU C C 13 175.576 0.1 . 1 . . . . 238 GLU C . 11012 1 1297 . 1 1 126 126 GLU CA C 13 53.873 0.1 . 1 . . . . 238 GLU CA . 11012 1 1298 . 1 1 126 126 GLU CB C 13 32.384 0.1 . 1 . . . . 238 GLU CB . 11012 1 1299 . 1 1 126 126 GLU CG C 13 36.306 0.1 . 1 . . . . 238 GLU CG . 11012 1 1300 . 1 1 126 126 GLU N N 15 121.848 0.1 . 1 . . . . 238 GLU N . 11012 1 1301 . 1 1 127 127 ASP H H 1 8.578 0.03 . 1 . . . . 239 ASP H . 11012 1 1302 . 1 1 127 127 ASP HA H 1 4.841 0.03 . 1 . . . . 239 ASP HA . 11012 1 1303 . 1 1 127 127 ASP HB2 H 1 2.622 0.03 . 1 . . . . 239 ASP HB2 . 11012 1 1304 . 1 1 127 127 ASP HB3 H 1 3.048 0.03 . 1 . . . . 239 ASP HB3 . 11012 1 1305 . 1 1 127 127 ASP C C 13 176.216 0.1 . 1 . . . . 239 ASP C . 11012 1 1306 . 1 1 127 127 ASP CA C 13 51.869 0.1 . 1 . . . . 239 ASP CA . 11012 1 1307 . 1 1 127 127 ASP CB C 13 42.897 0.1 . 1 . . . . 239 ASP CB . 11012 1 1308 . 1 1 127 127 ASP N N 15 128.921 0.1 . 1 . . . . 239 ASP N . 11012 1 1309 . 1 1 128 128 PRO HA H 1 4.519 0.03 . 1 . . . . 240 PRO HA . 11012 1 1310 . 1 1 128 128 PRO HB2 H 1 2.445 0.03 . 2 . . . . 240 PRO HB2 . 11012 1 1311 . 1 1 128 128 PRO HB3 H 1 2.074 0.03 . 2 . . . . 240 PRO HB3 . 11012 1 1312 . 1 1 128 128 PRO HG2 H 1 2.203 0.03 . 2 . . . . 240 PRO HG2 . 11012 1 1313 . 1 1 128 128 PRO HG3 H 1 2.085 0.03 . 2 . . . . 240 PRO HG3 . 11012 1 1314 . 1 1 128 128 PRO HD2 H 1 4.127 0.03 . 2 . . . . 240 PRO HD2 . 11012 1 1315 . 1 1 128 128 PRO HD3 H 1 3.952 0.03 . 2 . . . . 240 PRO HD3 . 11012 1 1316 . 1 1 128 128 PRO C C 13 177.074 0.1 . 1 . . . . 240 PRO C . 11012 1 1317 . 1 1 128 128 PRO CA C 13 64.035 0.1 . 1 . . . . 240 PRO CA . 11012 1 1318 . 1 1 128 128 PRO CB C 13 31.980 0.1 . 1 . . . . 240 PRO CB . 11012 1 1319 . 1 1 128 128 PRO CG C 13 26.960 0.1 . 1 . . . . 240 PRO CG . 11012 1 1320 . 1 1 128 128 PRO CD C 13 50.777 0.1 . 1 . . . . 240 PRO CD . 11012 1 1321 . 1 1 129 129 ILE H H 1 8.476 0.03 . 1 . . . . 241 ILE H . 11012 1 1322 . 1 1 129 129 ILE HA H 1 4.143 0.03 . 1 . . . . 241 ILE HA . 11012 1 1323 . 1 1 129 129 ILE HB H 1 2.218 0.03 . 1 . . . . 241 ILE HB . 11012 1 1324 . 1 1 129 129 ILE HG12 H 1 1.594 0.03 . 2 . . . . 241 ILE HG12 . 11012 1 1325 . 1 1 129 129 ILE HG13 H 1 1.329 0.03 . 2 . . . . 241 ILE HG13 . 11012 1 1326 . 1 1 129 129 ILE HG21 H 1 0.940 0.03 . 1 . . . . 241 ILE HG2 . 11012 1 1327 . 1 1 129 129 ILE HG22 H 1 0.940 0.03 . 1 . . . . 241 ILE HG2 . 11012 1 1328 . 1 1 129 129 ILE HG23 H 1 0.940 0.03 . 1 . . . . 241 ILE HG2 . 11012 1 1329 . 1 1 129 129 ILE HD11 H 1 0.900 0.03 . 1 . . . . 241 ILE HD1 . 11012 1 1330 . 1 1 129 129 ILE HD12 H 1 0.900 0.03 . 1 . . . . 241 ILE HD1 . 11012 1 1331 . 1 1 129 129 ILE HD13 H 1 0.900 0.03 . 1 . . . . 241 ILE HD1 . 11012 1 1332 . 1 1 129 129 ILE C C 13 178.242 0.1 . 1 . . . . 241 ILE C . 11012 1 1333 . 1 1 129 129 ILE CA C 13 62.239 0.1 . 1 . . . . 241 ILE CA . 11012 1 1334 . 1 1 129 129 ILE CB C 13 37.011 0.1 . 1 . . . . 241 ILE CB . 11012 1 1335 . 1 1 129 129 ILE CG1 C 13 27.544 0.1 . 1 . . . . 241 ILE CG1 . 11012 1 1336 . 1 1 129 129 ILE CG2 C 13 16.876 0.1 . 1 . . . . 241 ILE CG2 . 11012 1 1337 . 1 1 129 129 ILE CD1 C 13 10.845 0.1 . 1 . . . . 241 ILE CD1 . 11012 1 1338 . 1 1 129 129 ILE N N 15 118.352 0.1 . 1 . . . . 241 ILE N . 11012 1 1339 . 1 1 130 130 THR H H 1 8.347 0.03 . 1 . . . . 242 THR H . 11012 1 1340 . 1 1 130 130 THR HA H 1 4.356 0.03 . 1 . . . . 242 THR HA . 11012 1 1341 . 1 1 130 130 THR HB H 1 4.459 0.03 . 1 . . . . 242 THR HB . 11012 1 1342 . 1 1 130 130 THR HG21 H 1 1.315 0.03 . 1 . . . . 242 THR HG2 . 11012 1 1343 . 1 1 130 130 THR HG22 H 1 1.315 0.03 . 1 . . . . 242 THR HG2 . 11012 1 1344 . 1 1 130 130 THR HG23 H 1 1.315 0.03 . 1 . . . . 242 THR HG2 . 11012 1 1345 . 1 1 130 130 THR C C 13 176.756 0.1 . 1 . . . . 242 THR C . 11012 1 1346 . 1 1 130 130 THR CA C 13 61.861 0.1 . 1 . . . . 242 THR CA . 11012 1 1347 . 1 1 130 130 THR CB C 13 70.685 0.1 . 1 . . . . 242 THR CB . 11012 1 1348 . 1 1 130 130 THR CG2 C 13 20.905 0.1 . 1 . . . . 242 THR CG2 . 11012 1 1349 . 1 1 130 130 THR N N 15 108.270 0.1 . 1 . . . . 242 THR N . 11012 1 1350 . 1 1 131 131 GLY H H 1 8.214 0.03 . 1 . . . . 243 GLY H . 11012 1 1351 . 1 1 131 131 GLY HA2 H 1 4.254 0.03 . 1 . . . . 243 GLY HA2 . 11012 1 1352 . 1 1 131 131 GLY HA3 H 1 3.922 0.03 . 1 . . . . 243 GLY HA3 . 11012 1 1353 . 1 1 131 131 GLY C C 13 174.290 0.1 . 1 . . . . 243 GLY C . 11012 1 1354 . 1 1 131 131 GLY CA C 13 45.123 0.1 . 1 . . . . 243 GLY CA . 11012 1 1355 . 1 1 131 131 GLY N N 15 109.822 0.1 . 1 . . . . 243 GLY N . 11012 1 1356 . 1 1 132 132 ARG H H 1 7.895 0.03 . 1 . . . . 244 ARG H . 11012 1 1357 . 1 1 132 132 ARG HA H 1 4.003 0.03 . 1 . . . . 244 ARG HA . 11012 1 1358 . 1 1 132 132 ARG HB2 H 1 1.849 0.03 . 2 . . . . 244 ARG HB2 . 11012 1 1359 . 1 1 132 132 ARG HB3 H 1 1.750 0.03 . 2 . . . . 244 ARG HB3 . 11012 1 1360 . 1 1 132 132 ARG HG2 H 1 1.728 0.03 . 2 . . . . 244 ARG HG2 . 11012 1 1361 . 1 1 132 132 ARG HG3 H 1 1.673 0.03 . 2 . . . . 244 ARG HG3 . 11012 1 1362 . 1 1 132 132 ARG HD2 H 1 3.288 0.03 . 1 . . . . 244 ARG HD2 . 11012 1 1363 . 1 1 132 132 ARG HD3 H 1 3.288 0.03 . 1 . . . . 244 ARG HD3 . 11012 1 1364 . 1 1 132 132 ARG C C 13 176.654 0.1 . 1 . . . . 244 ARG C . 11012 1 1365 . 1 1 132 132 ARG CA C 13 57.882 0.1 . 1 . . . . 244 ARG CA . 11012 1 1366 . 1 1 132 132 ARG CB C 13 29.873 0.1 . 1 . . . . 244 ARG CB . 11012 1 1367 . 1 1 132 132 ARG CG C 13 27.691 0.1 . 1 . . . . 244 ARG CG . 11012 1 1368 . 1 1 132 132 ARG CD C 13 43.245 0.1 . 1 . . . . 244 ARG CD . 11012 1 1369 . 1 1 132 132 ARG N N 15 117.059 0.1 . 1 . . . . 244 ARG N . 11012 1 1370 . 1 1 133 133 GLN H H 1 8.001 0.03 . 1 . . . . 245 GLN H . 11012 1 1371 . 1 1 133 133 GLN HA H 1 5.385 0.03 . 1 . . . . 245 GLN HA . 11012 1 1372 . 1 1 133 133 GLN HB2 H 1 1.992 0.03 . 1 . . . . 245 GLN HB2 . 11012 1 1373 . 1 1 133 133 GLN HB3 H 1 1.992 0.03 . 1 . . . . 245 GLN HB3 . 11012 1 1374 . 1 1 133 133 GLN HG2 H 1 2.450 0.03 . 1 . . . . 245 GLN HG2 . 11012 1 1375 . 1 1 133 133 GLN HG3 H 1 2.450 0.03 . 1 . . . . 245 GLN HG3 . 11012 1 1376 . 1 1 133 133 GLN C C 13 175.400 0.1 . 1 . . . . 245 GLN C . 11012 1 1377 . 1 1 133 133 GLN CA C 13 53.891 0.1 . 1 . . . . 245 GLN CA . 11012 1 1378 . 1 1 133 133 GLN CB C 13 29.199 0.1 . 1 . . . . 245 GLN CB . 11012 1 1379 . 1 1 133 133 GLN N N 15 124.969 0.1 . 1 . . . . 245 GLN N . 11012 1 1380 . 1 1 134 134 SER H H 1 9.053 0.03 . 1 . . . . 246 SER H . 11012 1 1381 . 1 1 134 134 SER HA H 1 5.053 0.03 . 1 . . . . 246 SER HA . 11012 1 1382 . 1 1 134 134 SER HB2 H 1 3.947 0.03 . 1 . . . . 246 SER HB2 . 11012 1 1383 . 1 1 134 134 SER HB3 H 1 3.947 0.03 . 1 . . . . 246 SER HB3 . 11012 1 1384 . 1 1 134 134 SER C C 13 171.245 0.1 . 1 . . . . 246 SER C . 11012 1 1385 . 1 1 134 134 SER CA C 13 57.883 0.1 . 1 . . . . 246 SER CA . 11012 1 1386 . 1 1 134 134 SER CB C 13 66.026 0.1 . 1 . . . . 246 SER CB . 11012 1 1387 . 1 1 134 134 SER N N 15 114.054 0.1 . 1 . . . . 246 SER N . 11012 1 1388 . 1 1 135 135 VAL H H 1 8.038 0.03 . 1 . . . . 247 VAL H . 11012 1 1389 . 1 1 135 135 VAL HA H 1 5.447 0.03 . 1 . . . . 247 VAL HA . 11012 1 1390 . 1 1 135 135 VAL HB H 1 2.365 0.03 . 1 . . . . 247 VAL HB . 11012 1 1391 . 1 1 135 135 VAL HG11 H 1 0.976 0.03 . 1 . . . . 247 VAL HG1 . 11012 1 1392 . 1 1 135 135 VAL HG12 H 1 0.976 0.03 . 1 . . . . 247 VAL HG1 . 11012 1 1393 . 1 1 135 135 VAL HG13 H 1 0.976 0.03 . 1 . . . . 247 VAL HG1 . 11012 1 1394 . 1 1 135 135 VAL HG21 H 1 0.253 0.03 . 1 . . . . 247 VAL HG2 . 11012 1 1395 . 1 1 135 135 VAL HG22 H 1 0.253 0.03 . 1 . . . . 247 VAL HG2 . 11012 1 1396 . 1 1 135 135 VAL HG23 H 1 0.253 0.03 . 1 . . . . 247 VAL HG2 . 11012 1 1397 . 1 1 135 135 VAL C C 13 174.041 0.1 . 1 . . . . 247 VAL C . 11012 1 1398 . 1 1 135 135 VAL CA C 13 57.532 0.1 . 1 . . . . 247 VAL CA . 11012 1 1399 . 1 1 135 135 VAL CB C 13 33.248 0.1 . 1 . . . . 247 VAL CB . 11012 1 1400 . 1 1 135 135 VAL CG1 C 13 18.776 0.1 . 1 . . . . 247 VAL CG1 . 11012 1 1401 . 1 1 135 135 VAL CG2 C 13 21.686 0.1 . 1 . . . . 247 VAL CG2 . 11012 1 1402 . 1 1 135 135 VAL N N 15 113.024 0.1 . 1 . . . . 247 VAL N . 11012 1 1403 . 1 1 136 136 LEU H H 1 9.218 0.03 . 1 . . . . 248 LEU H . 11012 1 1404 . 1 1 136 136 LEU HA H 1 5.631 0.03 . 1 . . . . 248 LEU HA . 11012 1 1405 . 1 1 136 136 LEU HB2 H 1 1.606 0.03 . 1 . . . . 248 LEU HB2 . 11012 1 1406 . 1 1 136 136 LEU HB3 H 1 1.270 0.03 . 1 . . . . 248 LEU HB3 . 11012 1 1407 . 1 1 136 136 LEU HG H 1 1.557 0.03 . 1 . . . . 248 LEU HG . 11012 1 1408 . 1 1 136 136 LEU HD11 H 1 0.795 0.03 . 1 . . . . 248 LEU HD1 . 11012 1 1409 . 1 1 136 136 LEU HD12 H 1 0.795 0.03 . 1 . . . . 248 LEU HD1 . 11012 1 1410 . 1 1 136 136 LEU HD13 H 1 0.795 0.03 . 1 . . . . 248 LEU HD1 . 11012 1 1411 . 1 1 136 136 LEU HD21 H 1 0.704 0.03 . 1 . . . . 248 LEU HD2 . 11012 1 1412 . 1 1 136 136 LEU HD22 H 1 0.704 0.03 . 1 . . . . 248 LEU HD2 . 11012 1 1413 . 1 1 136 136 LEU HD23 H 1 0.704 0.03 . 1 . . . . 248 LEU HD2 . 11012 1 1414 . 1 1 136 136 LEU C C 13 176.358 0.1 . 1 . . . . 248 LEU C . 11012 1 1415 . 1 1 136 136 LEU CA C 13 52.983 0.1 . 1 . . . . 248 LEU CA . 11012 1 1416 . 1 1 136 136 LEU CB C 13 46.224 0.1 . 1 . . . . 248 LEU CB . 11012 1 1417 . 1 1 136 136 LEU CG C 13 26.591 0.1 . 1 . . . . 248 LEU CG . 11012 1 1418 . 1 1 136 136 LEU CD1 C 13 25.274 0.1 . 1 . . . . 248 LEU CD1 . 11012 1 1419 . 1 1 136 136 LEU CD2 C 13 25.385 0.1 . 1 . . . . 248 LEU CD2 . 11012 1 1420 . 1 1 136 136 LEU N N 15 128.909 0.1 . 1 . . . . 248 LEU N . 11012 1 1421 . 1 1 137 137 VAL H H 1 8.554 0.03 . 1 . . . . 249 VAL H . 11012 1 1422 . 1 1 137 137 VAL HA H 1 4.761 0.03 . 1 . . . . 249 VAL HA . 11012 1 1423 . 1 1 137 137 VAL HB H 1 2.037 0.03 . 1 . . . . 249 VAL HB . 11012 1 1424 . 1 1 137 137 VAL HG11 H 1 0.886 0.03 . 1 . . . . 249 VAL HG1 . 11012 1 1425 . 1 1 137 137 VAL HG12 H 1 0.886 0.03 . 1 . . . . 249 VAL HG1 . 11012 1 1426 . 1 1 137 137 VAL HG13 H 1 0.886 0.03 . 1 . . . . 249 VAL HG1 . 11012 1 1427 . 1 1 137 137 VAL HG21 H 1 0.811 0.03 . 1 . . . . 249 VAL HG2 . 11012 1 1428 . 1 1 137 137 VAL HG22 H 1 0.811 0.03 . 1 . . . . 249 VAL HG2 . 11012 1 1429 . 1 1 137 137 VAL HG23 H 1 0.811 0.03 . 1 . . . . 249 VAL HG2 . 11012 1 1430 . 1 1 137 137 VAL C C 13 172.816 0.1 . 1 . . . . 249 VAL C . 11012 1 1431 . 1 1 137 137 VAL CA C 13 57.429 0.1 . 1 . . . . 249 VAL CA . 11012 1 1432 . 1 1 137 137 VAL CB C 13 33.733 0.1 . 1 . . . . 249 VAL CB . 11012 1 1433 . 1 1 137 137 VAL CG1 C 13 22.926 0.1 . 1 . . . . 249 VAL CG1 . 11012 1 1434 . 1 1 137 137 VAL CG2 C 13 18.312 0.1 . 1 . . . . 249 VAL CG2 . 11012 1 1435 . 1 1 137 137 VAL N N 15 112.753 0.1 . 1 . . . . 249 VAL N . 11012 1 1436 . 1 1 138 138 PRO HA H 1 4.553 0.03 . 1 . . . . 250 PRO HA . 11012 1 1437 . 1 1 138 138 PRO HB2 H 1 2.419 0.03 . 2 . . . . 250 PRO HB2 . 11012 1 1438 . 1 1 138 138 PRO HB3 H 1 1.786 0.03 . 2 . . . . 250 PRO HB3 . 11012 1 1439 . 1 1 138 138 PRO HG2 H 1 1.858 0.03 . 1 . . . . 250 PRO HG2 . 11012 1 1440 . 1 1 138 138 PRO HG3 H 1 1.858 0.03 . 1 . . . . 250 PRO HG3 . 11012 1 1441 . 1 1 138 138 PRO HD2 H 1 3.737 0.03 . 2 . . . . 250 PRO HD2 . 11012 1 1442 . 1 1 138 138 PRO HD3 H 1 3.516 0.03 . 2 . . . . 250 PRO HD3 . 11012 1 1443 . 1 1 138 138 PRO C C 13 177.748 0.1 . 1 . . . . 250 PRO C . 11012 1 1444 . 1 1 138 138 PRO CA C 13 62.560 0.1 . 1 . . . . 250 PRO CA . 11012 1 1445 . 1 1 138 138 PRO CB C 13 31.266 0.1 . 1 . . . . 250 PRO CB . 11012 1 1446 . 1 1 138 138 PRO CG C 13 27.459 0.1 . 1 . . . . 250 PRO CG . 11012 1 1447 . 1 1 138 138 PRO CD C 13 50.033 0.1 . 1 . . . . 250 PRO CD . 11012 1 1448 . 1 1 139 139 TYR H H 1 8.851 0.03 . 1 . . . . 251 TYR H . 11012 1 1449 . 1 1 139 139 TYR HA H 1 3.960 0.03 . 1 . . . . 251 TYR HA . 11012 1 1450 . 1 1 139 139 TYR HB2 H 1 2.403 0.03 . 1 . . . . 251 TYR HB2 . 11012 1 1451 . 1 1 139 139 TYR HB3 H 1 2.559 0.03 . 1 . . . . 251 TYR HB3 . 11012 1 1452 . 1 1 139 139 TYR HD1 H 1 6.840 0.03 . 1 . . . . 251 TYR HD1 . 11012 1 1453 . 1 1 139 139 TYR HD2 H 1 6.840 0.03 . 1 . . . . 251 TYR HD2 . 11012 1 1454 . 1 1 139 139 TYR C C 13 174.240 0.1 . 1 . . . . 251 TYR C . 11012 1 1455 . 1 1 139 139 TYR CA C 13 59.905 0.1 . 1 . . . . 251 TYR CA . 11012 1 1456 . 1 1 139 139 TYR CB C 13 37.767 0.1 . 1 . . . . 251 TYR CB . 11012 1 1457 . 1 1 139 139 TYR N N 15 124.698 0.1 . 1 . . . . 251 TYR N . 11012 1 1458 . 1 1 140 140 GLU H H 1 6.862 0.03 . 1 . . . . 252 GLU H . 11012 1 1459 . 1 1 140 140 GLU HA H 1 4.491 0.03 . 1 . . . . 252 GLU HA . 11012 1 1460 . 1 1 140 140 GLU HB2 H 1 1.638 0.03 . 1 . . . . 252 GLU HB2 . 11012 1 1461 . 1 1 140 140 GLU HB3 H 1 1.801 0.03 . 1 . . . . 252 GLU HB3 . 11012 1 1462 . 1 1 140 140 GLU HG2 H 1 2.091 0.03 . 2 . . . . 252 GLU HG2 . 11012 1 1463 . 1 1 140 140 GLU HG3 H 1 2.056 0.03 . 2 . . . . 252 GLU HG3 . 11012 1 1464 . 1 1 140 140 GLU C C 13 170.865 0.1 . 1 . . . . 252 GLU C . 11012 1 1465 . 1 1 140 140 GLU CA C 13 51.874 0.1 . 1 . . . . 252 GLU CA . 11012 1 1466 . 1 1 140 140 GLU CB C 13 31.305 0.1 . 1 . . . . 252 GLU CB . 11012 1 1467 . 1 1 140 140 GLU CG C 13 35.504 0.1 . 1 . . . . 252 GLU CG . 11012 1 1468 . 1 1 140 140 GLU N N 15 129.821 0.1 . 1 . . . . 252 GLU N . 11012 1 1469 . 1 1 141 141 PRO HA H 1 4.583 0.03 . 1 . . . . 253 PRO HA . 11012 1 1470 . 1 1 141 141 PRO HB2 H 1 1.930 0.03 . 1 . . . . 253 PRO HB2 . 11012 1 1471 . 1 1 141 141 PRO HB3 H 1 2.437 0.03 . 1 . . . . 253 PRO HB3 . 11012 1 1472 . 1 1 141 141 PRO HG2 H 1 1.974 0.03 . 1 . . . . 253 PRO HG2 . 11012 1 1473 . 1 1 141 141 PRO HG3 H 1 2.082 0.03 . 1 . . . . 253 PRO HG3 . 11012 1 1474 . 1 1 141 141 PRO HD2 H 1 3.606 0.03 . 1 . . . . 253 PRO HD2 . 11012 1 1475 . 1 1 141 141 PRO HD3 H 1 3.606 0.03 . 1 . . . . 253 PRO HD3 . 11012 1 1476 . 1 1 141 141 PRO CA C 13 60.180 0.1 . 1 . . . . 253 PRO CA . 11012 1 1477 . 1 1 141 141 PRO CB C 13 30.270 0.1 . 1 . . . . 253 PRO CB . 11012 1 1478 . 1 1 141 141 PRO CG C 13 26.542 0.1 . 1 . . . . 253 PRO CG . 11012 1 1479 . 1 1 141 141 PRO CD C 13 50.013 0.1 . 1 . . . . 253 PRO CD . 11012 1 1480 . 1 1 142 142 PRO HA H 1 4.146 0.03 . 1 . . . . 254 PRO HA . 11012 1 1481 . 1 1 142 142 PRO HB2 H 1 2.082 0.03 . 1 . . . . 254 PRO HB2 . 11012 1 1482 . 1 1 142 142 PRO HB3 H 1 2.082 0.03 . 1 . . . . 254 PRO HB3 . 11012 1 1483 . 1 1 142 142 PRO HG2 H 1 1.862 0.03 . 2 . . . . 254 PRO HG2 . 11012 1 1484 . 1 1 142 142 PRO HG3 H 1 1.695 0.03 . 2 . . . . 254 PRO HG3 . 11012 1 1485 . 1 1 142 142 PRO HD2 H 1 3.468 0.03 . 1 . . . . 254 PRO HD2 . 11012 1 1486 . 1 1 142 142 PRO HD3 H 1 3.780 0.03 . 1 . . . . 254 PRO HD3 . 11012 1 1487 . 1 1 142 142 PRO C C 13 177.465 0.1 . 1 . . . . 254 PRO C . 11012 1 1488 . 1 1 142 142 PRO CA C 13 62.455 0.1 . 1 . . . . 254 PRO CA . 11012 1 1489 . 1 1 142 142 PRO CB C 13 32.152 0.1 . 1 . . . . 254 PRO CB . 11012 1 1490 . 1 1 142 142 PRO CG C 13 27.407 0.1 . 1 . . . . 254 PRO CG . 11012 1 1491 . 1 1 142 142 PRO CD C 13 50.069 0.1 . 1 . . . . 254 PRO CD . 11012 1 1492 . 1 1 143 143 GLN H H 1 8.295 0.03 . 1 . . . . 255 GLN H . 11012 1 1493 . 1 1 143 143 GLN HA H 1 4.195 0.03 . 1 . . . . 255 GLN HA . 11012 1 1494 . 1 1 143 143 GLN HB2 H 1 2.159 0.03 . 2 . . . . 255 GLN HB2 . 11012 1 1495 . 1 1 143 143 GLN HB3 H 1 1.986 0.03 . 2 . . . . 255 GLN HB3 . 11012 1 1496 . 1 1 143 143 GLN HG2 H 1 2.541 0.03 . 1 . . . . 255 GLN HG2 . 11012 1 1497 . 1 1 143 143 GLN HG3 H 1 2.541 0.03 . 1 . . . . 255 GLN HG3 . 11012 1 1498 . 1 1 143 143 GLN HE21 H 1 7.858 0.03 . 1 . . . . 255 GLN HE21 . 11012 1 1499 . 1 1 143 143 GLN HE22 H 1 7.647 0.03 . 1 . . . . 255 GLN HE22 . 11012 1 1500 . 1 1 143 143 GLN C C 13 176.469 0.1 . 1 . . . . 255 GLN C . 11012 1 1501 . 1 1 143 143 GLN CA C 13 55.427 0.1 . 1 . . . . 255 GLN CA . 11012 1 1502 . 1 1 143 143 GLN CB C 13 28.814 0.1 . 1 . . . . 255 GLN CB . 11012 1 1503 . 1 1 143 143 GLN CG C 13 33.592 0.1 . 1 . . . . 255 GLN CG . 11012 1 1504 . 1 1 143 143 GLN N N 15 121.481 0.1 . 1 . . . . 255 GLN N . 11012 1 1505 . 1 1 144 144 VAL H H 1 8.361 0.03 . 1 . . . . 256 VAL H . 11012 1 1506 . 1 1 144 144 VAL HA H 1 3.862 0.03 . 1 . . . . 256 VAL HA . 11012 1 1507 . 1 1 144 144 VAL HB H 1 2.047 0.03 . 1 . . . . 256 VAL HB . 11012 1 1508 . 1 1 144 144 VAL HG11 H 1 1.005 0.03 . 1 . . . . 256 VAL HG1 . 11012 1 1509 . 1 1 144 144 VAL HG12 H 1 1.005 0.03 . 1 . . . . 256 VAL HG1 . 11012 1 1510 . 1 1 144 144 VAL HG13 H 1 1.005 0.03 . 1 . . . . 256 VAL HG1 . 11012 1 1511 . 1 1 144 144 VAL HG21 H 1 1.105 0.03 . 1 . . . . 256 VAL HG2 . 11012 1 1512 . 1 1 144 144 VAL HG22 H 1 1.105 0.03 . 1 . . . . 256 VAL HG2 . 11012 1 1513 . 1 1 144 144 VAL HG23 H 1 1.105 0.03 . 1 . . . . 256 VAL HG2 . 11012 1 1514 . 1 1 144 144 VAL C C 13 177.211 0.1 . 1 . . . . 256 VAL C . 11012 1 1515 . 1 1 144 144 VAL CA C 13 64.116 0.1 . 1 . . . . 256 VAL CA . 11012 1 1516 . 1 1 144 144 VAL CB C 13 31.285 0.1 . 1 . . . . 256 VAL CB . 11012 1 1517 . 1 1 144 144 VAL CG1 C 13 20.210 0.1 . 1 . . . . 256 VAL CG1 . 11012 1 1518 . 1 1 144 144 VAL CG2 C 13 21.249 0.1 . 1 . . . . 256 VAL CG2 . 11012 1 1519 . 1 1 144 144 VAL N N 15 122.297 0.1 . 1 . . . . 256 VAL N . 11012 1 1520 . 1 1 145 145 GLY H H 1 8.853 0.03 . 1 . . . . 257 GLY H . 11012 1 1521 . 1 1 145 145 GLY HA2 H 1 3.740 0.03 . 1 . . . . 257 GLY HA2 . 11012 1 1522 . 1 1 145 145 GLY HA3 H 1 4.330 0.03 . 1 . . . . 257 GLY HA3 . 11012 1 1523 . 1 1 145 145 GLY C C 13 174.172 0.1 . 1 . . . . 257 GLY C . 11012 1 1524 . 1 1 145 145 GLY CA C 13 44.583 0.1 . 1 . . . . 257 GLY CA . 11012 1 1525 . 1 1 145 145 GLY N N 15 114.273 0.1 . 1 . . . . 257 GLY N . 11012 1 1526 . 1 1 146 146 THR H H 1 8.156 0.03 . 1 . . . . 258 THR H . 11012 1 1527 . 1 1 146 146 THR HA H 1 4.823 0.03 . 1 . . . . 258 THR HA . 11012 1 1528 . 1 1 146 146 THR HB H 1 4.271 0.03 . 1 . . . . 258 THR HB . 11012 1 1529 . 1 1 146 146 THR HG21 H 1 1.198 0.03 . 1 . . . . 258 THR HG2 . 11012 1 1530 . 1 1 146 146 THR HG22 H 1 1.198 0.03 . 1 . . . . 258 THR HG2 . 11012 1 1531 . 1 1 146 146 THR HG23 H 1 1.198 0.03 . 1 . . . . 258 THR HG2 . 11012 1 1532 . 1 1 146 146 THR C C 13 173.388 0.1 . 1 . . . . 258 THR C . 11012 1 1533 . 1 1 146 146 THR CA C 13 60.022 0.1 . 1 . . . . 258 THR CA . 11012 1 1534 . 1 1 146 146 THR CB C 13 70.899 0.1 . 1 . . . . 258 THR CB . 11012 1 1535 . 1 1 146 146 THR CG2 C 13 21.060 0.1 . 1 . . . . 258 THR CG2 . 11012 1 1536 . 1 1 146 146 THR N N 15 113.055 0.1 . 1 . . . . 258 THR N . 11012 1 1537 . 1 1 147 147 GLU H H 1 8.381 0.03 . 1 . . . . 259 GLU H . 11012 1 1538 . 1 1 147 147 GLU HA H 1 4.318 0.03 . 1 . . . . 259 GLU HA . 11012 1 1539 . 1 1 147 147 GLU HB2 H 1 1.664 0.03 . 1 . . . . 259 GLU HB2 . 11012 1 1540 . 1 1 147 147 GLU HB3 H 1 1.541 0.03 . 1 . . . . 259 GLU HB3 . 11012 1 1541 . 1 1 147 147 GLU HG2 H 1 1.899 0.03 . 2 . . . . 259 GLU HG2 . 11012 1 1542 . 1 1 147 147 GLU HG3 H 1 1.747 0.03 . 2 . . . . 259 GLU HG3 . 11012 1 1543 . 1 1 147 147 GLU C C 13 175.574 0.1 . 1 . . . . 259 GLU C . 11012 1 1544 . 1 1 147 147 GLU CA C 13 56.309 0.1 . 1 . . . . 259 GLU CA . 11012 1 1545 . 1 1 147 147 GLU CB C 13 30.990 0.1 . 1 . . . . 259 GLU CB . 11012 1 1546 . 1 1 147 147 GLU CG C 13 35.726 0.1 . 1 . . . . 259 GLU CG . 11012 1 1547 . 1 1 147 147 GLU N N 15 118.649 0.1 . 1 . . . . 259 GLU N . 11012 1 1548 . 1 1 148 148 PHE H H 1 7.471 0.03 . 1 . . . . 260 PHE H . 11012 1 1549 . 1 1 148 148 PHE HA H 1 5.323 0.03 . 1 . . . . 260 PHE HA . 11012 1 1550 . 1 1 148 148 PHE HB2 H 1 2.925 0.03 . 1 . . . . 260 PHE HB2 . 11012 1 1551 . 1 1 148 148 PHE HB3 H 1 2.715 0.03 . 1 . . . . 260 PHE HB3 . 11012 1 1552 . 1 1 148 148 PHE C C 13 175.589 0.1 . 1 . . . . 260 PHE C . 11012 1 1553 . 1 1 148 148 PHE CA C 13 55.645 0.1 . 1 . . . . 260 PHE CA . 11012 1 1554 . 1 1 148 148 PHE CB C 13 42.199 0.1 . 1 . . . . 260 PHE CB . 11012 1 1555 . 1 1 148 148 PHE N N 15 114.848 0.1 . 1 . . . . 260 PHE N . 11012 1 1556 . 1 1 149 149 THR H H 1 9.443 0.03 . 1 . . . . 261 THR H . 11012 1 1557 . 1 1 149 149 THR HA H 1 4.351 0.03 . 1 . . . . 261 THR HA . 11012 1 1558 . 1 1 149 149 THR HB H 1 3.950 0.03 . 1 . . . . 261 THR HB . 11012 1 1559 . 1 1 149 149 THR HG21 H 1 1.154 0.03 . 1 . . . . 261 THR HG2 . 11012 1 1560 . 1 1 149 149 THR HG22 H 1 1.154 0.03 . 1 . . . . 261 THR HG2 . 11012 1 1561 . 1 1 149 149 THR HG23 H 1 1.154 0.03 . 1 . . . . 261 THR HG2 . 11012 1 1562 . 1 1 149 149 THR C C 13 173.609 0.1 . 1 . . . . 261 THR C . 11012 1 1563 . 1 1 149 149 THR CA C 13 62.835 0.1 . 1 . . . . 261 THR CA . 11012 1 1564 . 1 1 149 149 THR CB C 13 70.023 0.1 . 1 . . . . 261 THR CB . 11012 1 1565 . 1 1 149 149 THR CG2 C 13 20.803 0.1 . 1 . . . . 261 THR CG2 . 11012 1 1566 . 1 1 149 149 THR N N 15 121.441 0.1 . 1 . . . . 261 THR N . 11012 1 1567 . 1 1 150 150 THR H H 1 8.912 0.03 . 1 . . . . 262 THR H . 11012 1 1568 . 1 1 150 150 THR HA H 1 5.143 0.03 . 1 . . . . 262 THR HA . 11012 1 1569 . 1 1 150 150 THR HB H 1 3.849 0.03 . 1 . . . . 262 THR HB . 11012 1 1570 . 1 1 150 150 THR HG21 H 1 0.993 0.03 . 1 . . . . 262 THR HG2 . 11012 1 1571 . 1 1 150 150 THR HG22 H 1 0.993 0.03 . 1 . . . . 262 THR HG2 . 11012 1 1572 . 1 1 150 150 THR HG23 H 1 0.993 0.03 . 1 . . . . 262 THR HG2 . 11012 1 1573 . 1 1 150 150 THR C C 13 174.340 0.1 . 1 . . . . 262 THR C . 11012 1 1574 . 1 1 150 150 THR CA C 13 62.178 0.1 . 1 . . . . 262 THR CA . 11012 1 1575 . 1 1 150 150 THR CB C 13 69.673 0.1 . 1 . . . . 262 THR CB . 11012 1 1576 . 1 1 150 150 THR CG2 C 13 21.890 0.1 . 1 . . . . 262 THR CG2 . 11012 1 1577 . 1 1 150 150 THR N N 15 124.812 0.1 . 1 . . . . 262 THR N . 11012 1 1578 . 1 1 151 151 VAL H H 1 8.901 0.03 . 1 . . . . 263 VAL H . 11012 1 1579 . 1 1 151 151 VAL HA H 1 3.806 0.03 . 1 . . . . 263 VAL HA . 11012 1 1580 . 1 1 151 151 VAL HB H 1 1.566 0.03 . 1 . . . . 263 VAL HB . 11012 1 1581 . 1 1 151 151 VAL HG11 H 1 0.314 0.03 . 1 . . . . 263 VAL HG1 . 11012 1 1582 . 1 1 151 151 VAL HG12 H 1 0.314 0.03 . 1 . . . . 263 VAL HG1 . 11012 1 1583 . 1 1 151 151 VAL HG13 H 1 0.314 0.03 . 1 . . . . 263 VAL HG1 . 11012 1 1584 . 1 1 151 151 VAL HG21 H 1 0.698 0.03 . 1 . . . . 263 VAL HG2 . 11012 1 1585 . 1 1 151 151 VAL HG22 H 1 0.698 0.03 . 1 . . . . 263 VAL HG2 . 11012 1 1586 . 1 1 151 151 VAL HG23 H 1 0.698 0.03 . 1 . . . . 263 VAL HG2 . 11012 1 1587 . 1 1 151 151 VAL C C 13 172.659 0.1 . 1 . . . . 263 VAL C . 11012 1 1588 . 1 1 151 151 VAL CA C 13 61.398 0.1 . 1 . . . . 263 VAL CA . 11012 1 1589 . 1 1 151 151 VAL CB C 13 33.742 0.1 . 1 . . . . 263 VAL CB . 11012 1 1590 . 1 1 151 151 VAL CG1 C 13 20.307 0.1 . 1 . . . . 263 VAL CG1 . 11012 1 1591 . 1 1 151 151 VAL CG2 C 13 20.454 0.1 . 1 . . . . 263 VAL CG2 . 11012 1 1592 . 1 1 151 151 VAL N N 15 130.337 0.1 . 1 . . . . 263 VAL N . 11012 1 1593 . 1 1 152 152 LEU H H 1 8.263 0.03 . 1 . . . . 264 LEU H . 11012 1 1594 . 1 1 152 152 LEU HA H 1 4.506 0.03 . 1 . . . . 264 LEU HA . 11012 1 1595 . 1 1 152 152 LEU HB2 H 1 2.226 0.03 . 1 . . . . 264 LEU HB2 . 11012 1 1596 . 1 1 152 152 LEU HB3 H 1 0.803 0.03 . 1 . . . . 264 LEU HB3 . 11012 1 1597 . 1 1 152 152 LEU HG H 1 1.577 0.03 . 1 . . . . 264 LEU HG . 11012 1 1598 . 1 1 152 152 LEU HD11 H 1 0.757 0.03 . 1 . . . . 264 LEU HD1 . 11012 1 1599 . 1 1 152 152 LEU HD12 H 1 0.757 0.03 . 1 . . . . 264 LEU HD1 . 11012 1 1600 . 1 1 152 152 LEU HD13 H 1 0.757 0.03 . 1 . . . . 264 LEU HD1 . 11012 1 1601 . 1 1 152 152 LEU HD21 H 1 0.566 0.03 . 1 . . . . 264 LEU HD2 . 11012 1 1602 . 1 1 152 152 LEU HD22 H 1 0.566 0.03 . 1 . . . . 264 LEU HD2 . 11012 1 1603 . 1 1 152 152 LEU HD23 H 1 0.566 0.03 . 1 . . . . 264 LEU HD2 . 11012 1 1604 . 1 1 152 152 LEU C C 13 174.960 0.1 . 1 . . . . 264 LEU C . 11012 1 1605 . 1 1 152 152 LEU CA C 13 52.671 0.1 . 1 . . . . 264 LEU CA . 11012 1 1606 . 1 1 152 152 LEU CB C 13 41.576 0.1 . 1 . . . . 264 LEU CB . 11012 1 1607 . 1 1 152 152 LEU CG C 13 25.571 0.1 . 1 . . . . 264 LEU CG . 11012 1 1608 . 1 1 152 152 LEU CD1 C 13 24.480 0.1 . 1 . . . . 264 LEU CD1 . 11012 1 1609 . 1 1 152 152 LEU CD2 C 13 22.202 0.1 . 1 . . . . 264 LEU CD2 . 11012 1 1610 . 1 1 152 152 LEU N N 15 125.043 0.1 . 1 . . . . 264 LEU N . 11012 1 1611 . 1 1 153 153 TYR H H 1 8.250 0.03 . 1 . . . . 265 TYR H . 11012 1 1612 . 1 1 153 153 TYR HA H 1 5.413 0.03 . 1 . . . . 265 TYR HA . 11012 1 1613 . 1 1 153 153 TYR HB2 H 1 2.364 0.03 . 1 . . . . 265 TYR HB2 . 11012 1 1614 . 1 1 153 153 TYR HB3 H 1 2.909 0.03 . 1 . . . . 265 TYR HB3 . 11012 1 1615 . 1 1 153 153 TYR HD1 H 1 6.811 0.03 . 1 . . . . 265 TYR HD1 . 11012 1 1616 . 1 1 153 153 TYR HD2 H 1 6.811 0.03 . 1 . . . . 265 TYR HD2 . 11012 1 1617 . 1 1 153 153 TYR HE1 H 1 6.240 0.03 . 1 . . . . 265 TYR HE1 . 11012 1 1618 . 1 1 153 153 TYR HE2 H 1 6.240 0.03 . 1 . . . . 265 TYR HE2 . 11012 1 1619 . 1 1 153 153 TYR C C 13 176.317 0.1 . 1 . . . . 265 TYR C . 11012 1 1620 . 1 1 153 153 TYR CA C 13 56.313 0.1 . 1 . . . . 265 TYR CA . 11012 1 1621 . 1 1 153 153 TYR CB C 13 41.942 0.1 . 1 . . . . 265 TYR CB . 11012 1 1622 . 1 1 153 153 TYR N N 15 120.991 0.1 . 1 . . . . 265 TYR N . 11012 1 1623 . 1 1 154 154 ASN H H 1 8.908 0.03 . 1 . . . . 266 ASN H . 11012 1 1624 . 1 1 154 154 ASN HA H 1 4.729 0.03 . 1 . . . . 266 ASN HA . 11012 1 1625 . 1 1 154 154 ASN HB2 H 1 2.261 0.03 . 1 . . . . 266 ASN HB2 . 11012 1 1626 . 1 1 154 154 ASN HB3 H 1 2.436 0.03 . 1 . . . . 266 ASN HB3 . 11012 1 1627 . 1 1 154 154 ASN HD21 H 1 7.788 0.03 . 1 . . . . 266 ASN HD21 . 11012 1 1628 . 1 1 154 154 ASN HD22 H 1 6.729 0.03 . 1 . . . . 266 ASN HD22 . 11012 1 1629 . 1 1 154 154 ASN C C 13 172.137 0.1 . 1 . . . . 266 ASN C . 11012 1 1630 . 1 1 154 154 ASN CA C 13 51.091 0.1 . 1 . . . . 266 ASN CA . 11012 1 1631 . 1 1 154 154 ASN CB C 13 44.086 0.1 . 1 . . . . 266 ASN CB . 11012 1 1632 . 1 1 154 154 ASN N N 15 117.246 0.1 . 1 . . . . 266 ASN N . 11012 1 1633 . 1 1 154 154 ASN ND2 N 15 109.413 0.1 . 1 . . . . 266 ASN ND2 . 11012 1 1634 . 1 1 155 155 PHE H H 1 9.948 0.03 . 1 . . . . 267 PHE H . 11012 1 1635 . 1 1 155 155 PHE HA H 1 5.047 0.03 . 1 . . . . 267 PHE HA . 11012 1 1636 . 1 1 155 155 PHE HB2 H 1 3.122 0.03 . 2 . . . . 267 PHE HB2 . 11012 1 1637 . 1 1 155 155 PHE HB3 H 1 3.016 0.03 . 2 . . . . 267 PHE HB3 . 11012 1 1638 . 1 1 155 155 PHE HD1 H 1 7.280 0.03 . 1 . . . . 267 PHE HD1 . 11012 1 1639 . 1 1 155 155 PHE HD2 H 1 7.280 0.03 . 1 . . . . 267 PHE HD2 . 11012 1 1640 . 1 1 155 155 PHE HZ H 1 6.910 0.03 . 1 . . . . 267 PHE HZ . 11012 1 1641 . 1 1 155 155 PHE C C 13 178.715 0.1 . 1 . . . . 267 PHE C . 11012 1 1642 . 1 1 155 155 PHE CA C 13 56.881 0.1 . 1 . . . . 267 PHE CA . 11012 1 1643 . 1 1 155 155 PHE CB C 13 40.702 0.1 . 1 . . . . 267 PHE CB . 11012 1 1644 . 1 1 155 155 PHE N N 15 121.763 0.1 . 1 . . . . 267 PHE N . 11012 1 1645 . 1 1 156 156 MET H H 1 8.722 0.03 . 1 . . . . 268 MET H . 11012 1 1646 . 1 1 156 156 MET HA H 1 4.495 0.03 . 1 . . . . 268 MET HA . 11012 1 1647 . 1 1 156 156 MET HB2 H 1 2.240 0.03 . 1 . . . . 268 MET HB2 . 11012 1 1648 . 1 1 156 156 MET HB3 H 1 2.240 0.03 . 1 . . . . 268 MET HB3 . 11012 1 1649 . 1 1 156 156 MET HG2 H 1 2.457 0.03 . 1 . . . . 268 MET HG2 . 11012 1 1650 . 1 1 156 156 MET HG3 H 1 2.457 0.03 . 1 . . . . 268 MET HG3 . 11012 1 1651 . 1 1 156 156 MET C C 13 174.886 0.1 . 1 . . . . 268 MET C . 11012 1 1652 . 1 1 156 156 MET CA C 13 54.404 0.1 . 1 . . . . 268 MET CA . 11012 1 1653 . 1 1 156 156 MET CB C 13 28.948 0.1 . 1 . . . . 268 MET CB . 11012 1 1654 . 1 1 156 156 MET N N 15 116.672 0.1 . 1 . . . . 268 MET N . 11012 1 1655 . 1 1 157 157 CYS H H 1 7.368 0.03 . 1 . . . . 269 CYS H . 11012 1 1656 . 1 1 157 157 CYS HA H 1 4.064 0.03 . 1 . . . . 269 CYS HA . 11012 1 1657 . 1 1 157 157 CYS HB2 H 1 3.201 0.03 . 2 . . . . 269 CYS HB2 . 11012 1 1658 . 1 1 157 157 CYS HB3 H 1 2.730 0.03 . 2 . . . . 269 CYS HB3 . 11012 1 1659 . 1 1 157 157 CYS C C 13 173.456 0.1 . 1 . . . . 269 CYS C . 11012 1 1660 . 1 1 157 157 CYS CA C 13 60.585 0.1 . 1 . . . . 269 CYS CA . 11012 1 1661 . 1 1 157 157 CYS CB C 13 33.759 0.1 . 1 . . . . 269 CYS CB . 11012 1 1662 . 1 1 157 157 CYS N N 15 120.379 0.1 . 1 . . . . 269 CYS N . 11012 1 1663 . 1 1 158 158 ASN H H 1 8.309 0.03 . 1 . . . . 270 ASN H . 11012 1 1664 . 1 1 158 158 ASN HA H 1 4.795 0.03 . 1 . . . . 270 ASN HA . 11012 1 1665 . 1 1 158 158 ASN HB2 H 1 3.025 0.03 . 1 . . . . 270 ASN HB2 . 11012 1 1666 . 1 1 158 158 ASN HB3 H 1 3.379 0.03 . 1 . . . . 270 ASN HB3 . 11012 1 1667 . 1 1 158 158 ASN HD21 H 1 7.522 0.03 . 1 . . . . 270 ASN HD21 . 11012 1 1668 . 1 1 158 158 ASN HD22 H 1 6.845 0.03 . 1 . . . . 270 ASN HD22 . 11012 1 1669 . 1 1 158 158 ASN C C 13 177.425 0.1 . 1 . . . . 270 ASN C . 11012 1 1670 . 1 1 158 158 ASN CA C 13 53.623 0.1 . 1 . . . . 270 ASN CA . 11012 1 1671 . 1 1 158 158 ASN CB C 13 40.300 0.1 . 1 . . . . 270 ASN CB . 11012 1 1672 . 1 1 158 158 ASN N N 15 118.552 0.1 . 1 . . . . 270 ASN N . 11012 1 1673 . 1 1 158 158 ASN ND2 N 15 111.932 0.1 . 1 . . . . 270 ASN ND2 . 11012 1 1674 . 1 1 159 159 SER H H 1 9.673 0.03 . 1 . . . . 271 SER H . 11012 1 1675 . 1 1 159 159 SER HA H 1 3.968 0.03 . 1 . . . . 271 SER HA . 11012 1 1676 . 1 1 159 159 SER HB2 H 1 3.979 0.03 . 1 . . . . 271 SER HB2 . 11012 1 1677 . 1 1 159 159 SER HB3 H 1 3.979 0.03 . 1 . . . . 271 SER HB3 . 11012 1 1678 . 1 1 159 159 SER C C 13 174.425 0.1 . 1 . . . . 271 SER C . 11012 1 1679 . 1 1 159 159 SER CA C 13 63.583 0.1 . 1 . . . . 271 SER CA . 11012 1 1680 . 1 1 159 159 SER N N 15 119.792 0.1 . 1 . . . . 271 SER N . 11012 1 1681 . 1 1 160 160 SER H H 1 8.179 0.03 . 1 . . . . 272 SER H . 11012 1 1682 . 1 1 160 160 SER HA H 1 4.218 0.03 . 1 . . . . 272 SER HA . 11012 1 1683 . 1 1 160 160 SER HB2 H 1 4.227 0.03 . 2 . . . . 272 SER HB2 . 11012 1 1684 . 1 1 160 160 SER HB3 H 1 3.966 0.03 . 2 . . . . 272 SER HB3 . 11012 1 1685 . 1 1 160 160 SER C C 13 175.614 0.1 . 1 . . . . 272 SER C . 11012 1 1686 . 1 1 160 160 SER CA C 13 57.992 0.1 . 1 . . . . 272 SER CA . 11012 1 1687 . 1 1 160 160 SER CB C 13 63.129 0.1 . 1 . . . . 272 SER CB . 11012 1 1688 . 1 1 160 160 SER N N 15 109.294 0.1 . 1 . . . . 272 SER N . 11012 1 1689 . 1 1 161 161 CYS H H 1 7.922 0.03 . 1 . . . . 273 CYS H . 11012 1 1690 . 1 1 161 161 CYS HA H 1 4.333 0.03 . 1 . . . . 273 CYS HA . 11012 1 1691 . 1 1 161 161 CYS HB2 H 1 3.328 0.03 . 1 . . . . 273 CYS HB2 . 11012 1 1692 . 1 1 161 161 CYS HB3 H 1 3.328 0.03 . 1 . . . . 273 CYS HB3 . 11012 1 1693 . 1 1 161 161 CYS C C 13 178.603 0.1 . 1 . . . . 273 CYS C . 11012 1 1694 . 1 1 161 161 CYS CA C 13 64.351 0.1 . 1 . . . . 273 CYS CA . 11012 1 1695 . 1 1 161 161 CYS CB C 13 29.161 0.1 . 1 . . . . 273 CYS CB . 11012 1 1696 . 1 1 161 161 CYS N N 15 122.757 0.1 . 1 . . . . 273 CYS N . 11012 1 1697 . 1 1 162 162 VAL H H 1 8.749 0.03 . 1 . . . . 274 VAL H . 11012 1 1698 . 1 1 162 162 VAL HA H 1 3.922 0.03 . 1 . . . . 274 VAL HA . 11012 1 1699 . 1 1 162 162 VAL HB H 1 2.126 0.03 . 1 . . . . 274 VAL HB . 11012 1 1700 . 1 1 162 162 VAL HG11 H 1 1.064 0.03 . 2 . . . . 274 VAL HG1 . 11012 1 1701 . 1 1 162 162 VAL HG12 H 1 1.064 0.03 . 2 . . . . 274 VAL HG1 . 11012 1 1702 . 1 1 162 162 VAL HG13 H 1 1.064 0.03 . 2 . . . . 274 VAL HG1 . 11012 1 1703 . 1 1 162 162 VAL HG21 H 1 1.147 0.03 . 2 . . . . 274 VAL HG2 . 11012 1 1704 . 1 1 162 162 VAL HG22 H 1 1.147 0.03 . 2 . . . . 274 VAL HG2 . 11012 1 1705 . 1 1 162 162 VAL HG23 H 1 1.147 0.03 . 2 . . . . 274 VAL HG2 . 11012 1 1706 . 1 1 162 162 VAL C C 13 177.390 0.1 . 1 . . . . 274 VAL C . 11012 1 1707 . 1 1 162 162 VAL CA C 13 64.033 0.1 . 1 . . . . 274 VAL CA . 11012 1 1708 . 1 1 162 162 VAL CB C 13 31.392 0.1 . 1 . . . . 274 VAL CB . 11012 1 1709 . 1 1 162 162 VAL CG1 C 13 20.564 0.1 . 2 . . . . 274 VAL CG1 . 11012 1 1710 . 1 1 162 162 VAL CG2 C 13 20.970 0.1 . 2 . . . . 274 VAL CG2 . 11012 1 1711 . 1 1 162 162 VAL N N 15 129.665 0.1 . 1 . . . . 274 VAL N . 11012 1 1712 . 1 1 163 163 GLY H H 1 8.783 0.03 . 1 . . . . 275 GLY H . 11012 1 1713 . 1 1 163 163 GLY HA2 H 1 4.124 0.03 . 1 . . . . 275 GLY HA2 . 11012 1 1714 . 1 1 163 163 GLY HA3 H 1 4.124 0.03 . 1 . . . . 275 GLY HA3 . 11012 1 1715 . 1 1 163 163 GLY C C 13 173.646 0.1 . 1 . . . . 275 GLY C . 11012 1 1716 . 1 1 163 163 GLY CA C 13 44.741 0.1 . 1 . . . . 275 GLY CA . 11012 1 1717 . 1 1 163 163 GLY N N 15 110.538 0.1 . 1 . . . . 275 GLY N . 11012 1 1718 . 1 1 164 164 GLY H H 1 7.364 0.03 . 1 . . . . 276 GLY H . 11012 1 1719 . 1 1 164 164 GLY HA2 H 1 3.770 0.03 . 1 . . . . 276 GLY HA2 . 11012 1 1720 . 1 1 164 164 GLY HA3 H 1 4.620 0.03 . 1 . . . . 276 GLY HA3 . 11012 1 1721 . 1 1 164 164 GLY C C 13 174.715 0.1 . 1 . . . . 276 GLY C . 11012 1 1722 . 1 1 164 164 GLY CA C 13 43.934 0.1 . 1 . . . . 276 GLY CA . 11012 1 1723 . 1 1 164 164 GLY N N 15 108.221 0.1 . 1 . . . . 276 GLY N . 11012 1 1724 . 1 1 165 165 MET H H 1 9.252 0.03 . 1 . . . . 277 MET H . 11012 1 1725 . 1 1 165 165 MET HA H 1 5.091 0.03 . 1 . . . . 277 MET HA . 11012 1 1726 . 1 1 165 165 MET HG2 H 1 2.477 0.03 . 1 . . . . 277 MET HG2 . 11012 1 1727 . 1 1 165 165 MET HG3 H 1 2.477 0.03 . 1 . . . . 277 MET HG3 . 11012 1 1728 . 1 1 165 165 MET C C 13 179.457 0.1 . 1 . . . . 277 MET C . 11012 1 1729 . 1 1 165 165 MET CA C 13 59.243 0.1 . 1 . . . . 277 MET CA . 11012 1 1730 . 1 1 165 165 MET CB C 13 34.112 0.1 . 1 . . . . 277 MET CB . 11012 1 1731 . 1 1 166 166 ASN H H 1 8.645 0.03 . 1 . . . . 278 ASN H . 11012 1 1732 . 1 1 166 166 ASN HA H 1 4.099 0.03 . 1 . . . . 278 ASN HA . 11012 1 1733 . 1 1 166 166 ASN HB2 H 1 3.076 0.03 . 2 . . . . 278 ASN HB2 . 11012 1 1734 . 1 1 166 166 ASN HB3 H 1 2.353 0.03 . 2 . . . . 278 ASN HB3 . 11012 1 1735 . 1 1 166 166 ASN HD21 H 1 7.510 0.03 . 1 . . . . 278 ASN HD21 . 11012 1 1736 . 1 1 166 166 ASN HD22 H 1 6.645 0.03 . 1 . . . . 278 ASN HD22 . 11012 1 1737 . 1 1 166 166 ASN C C 13 173.822 0.1 . 1 . . . . 278 ASN C . 11012 1 1738 . 1 1 166 166 ASN CA C 13 54.307 0.1 . 1 . . . . 278 ASN CA . 11012 1 1739 . 1 1 166 166 ASN CB C 13 36.675 0.1 . 1 . . . . 278 ASN CB . 11012 1 1740 . 1 1 166 166 ASN N N 15 117.351 0.1 . 1 . . . . 278 ASN N . 11012 1 1741 . 1 1 166 166 ASN ND2 N 15 109.351 0.1 . 1 . . . . 278 ASN ND2 . 11012 1 1742 . 1 1 167 167 ARG H H 1 9.266 0.03 . 1 . . . . 279 ARG H . 11012 1 1743 . 1 1 167 167 ARG HA H 1 3.585 0.03 . 1 . . . . 279 ARG HA . 11012 1 1744 . 1 1 167 167 ARG HB2 H 1 2.247 0.03 . 1 . . . . 279 ARG HB2 . 11012 1 1745 . 1 1 167 167 ARG HB3 H 1 2.078 0.03 . 1 . . . . 279 ARG HB3 . 11012 1 1746 . 1 1 167 167 ARG HG2 H 1 1.587 0.03 . 1 . . . . 279 ARG HG2 . 11012 1 1747 . 1 1 167 167 ARG HG3 H 1 1.587 0.03 . 1 . . . . 279 ARG HG3 . 11012 1 1748 . 1 1 167 167 ARG C C 13 176.232 0.1 . 1 . . . . 279 ARG C . 11012 1 1749 . 1 1 167 167 ARG CA C 13 57.736 0.1 . 1 . . . . 279 ARG CA . 11012 1 1750 . 1 1 167 167 ARG CB C 13 27.061 0.1 . 1 . . . . 279 ARG CB . 11012 1 1751 . 1 1 167 167 ARG CG C 13 28.817 0.1 . 1 . . . . 279 ARG CG . 11012 1 1752 . 1 1 167 167 ARG CD C 13 43.220 0.1 . 1 . . . . 279 ARG CD . 11012 1 1753 . 1 1 167 167 ARG N N 15 107.247 0.1 . 1 . . . . 279 ARG N . 11012 1 1754 . 1 1 168 168 ARG H H 1 7.979 0.03 . 1 . . . . 280 ARG H . 11012 1 1755 . 1 1 168 168 ARG HA H 1 4.648 0.03 . 1 . . . . 280 ARG HA . 11012 1 1756 . 1 1 168 168 ARG HB2 H 1 1.477 0.03 . 1 . . . . 280 ARG HB2 . 11012 1 1757 . 1 1 168 168 ARG HB3 H 1 1.477 0.03 . 1 . . . . 280 ARG HB3 . 11012 1 1758 . 1 1 168 168 ARG HG2 H 1 1.730 0.03 . 1 . . . . 280 ARG HG2 . 11012 1 1759 . 1 1 168 168 ARG HG3 H 1 1.730 0.03 . 1 . . . . 280 ARG HG3 . 11012 1 1760 . 1 1 168 168 ARG HE H 1 6.499 0.03 . 1 . . . . 280 ARG HE . 11012 1 1761 . 1 1 168 168 ARG C C 13 174.581 0.1 . 1 . . . . 280 ARG C . 11012 1 1762 . 1 1 168 168 ARG CA C 13 53.969 0.1 . 1 . . . . 280 ARG CA . 11012 1 1763 . 1 1 168 168 ARG CB C 13 30.590 0.1 . 1 . . . . 280 ARG CB . 11012 1 1764 . 1 1 168 168 ARG CG C 13 25.794 0.1 . 1 . . . . 280 ARG CG . 11012 1 1765 . 1 1 168 168 ARG N N 15 123.699 0.1 . 1 . . . . 280 ARG N . 11012 1 1766 . 1 1 168 168 ARG NE N 15 82.122 0.1 . 1 . . . . 280 ARG NE . 11012 1 1767 . 1 1 169 169 PRO HA H 1 4.839 0.03 . 1 . . . . 281 PRO HA . 11012 1 1768 . 1 1 169 169 PRO HB2 H 1 1.854 0.03 . 1 . . . . 281 PRO HB2 . 11012 1 1769 . 1 1 169 169 PRO HB3 H 1 2.470 0.03 . 1 . . . . 281 PRO HB3 . 11012 1 1770 . 1 1 169 169 PRO HG2 H 1 2.265 0.03 . 1 . . . . 281 PRO HG2 . 11012 1 1771 . 1 1 169 169 PRO HG3 H 1 2.265 0.03 . 1 . . . . 281 PRO HG3 . 11012 1 1772 . 1 1 169 169 PRO HD2 H 1 4.050 0.03 . 2 . . . . 281 PRO HD2 . 11012 1 1773 . 1 1 169 169 PRO HD3 H 1 3.246 0.03 . 2 . . . . 281 PRO HD3 . 11012 1 1774 . 1 1 169 169 PRO C C 13 177.532 0.1 . 1 . . . . 281 PRO C . 11012 1 1775 . 1 1 169 169 PRO CA C 13 62.247 0.1 . 1 . . . . 281 PRO CA . 11012 1 1776 . 1 1 169 169 PRO CB C 13 32.936 0.1 . 1 . . . . 281 PRO CB . 11012 1 1777 . 1 1 169 169 PRO CG C 13 27.262 0.1 . 1 . . . . 281 PRO CG . 11012 1 1778 . 1 1 169 169 PRO CD C 13 50.270 0.1 . 1 . . . . 281 PRO CD . 11012 1 1779 . 1 1 170 170 ILE H H 1 7.786 0.03 . 1 . . . . 282 ILE H . 11012 1 1780 . 1 1 170 170 ILE HA H 1 5.197 0.03 . 1 . . . . 282 ILE HA . 11012 1 1781 . 1 1 170 170 ILE HB H 1 1.654 0.03 . 1 . . . . 282 ILE HB . 11012 1 1782 . 1 1 170 170 ILE HG12 H 1 1.282 0.03 . 2 . . . . 282 ILE HG12 . 11012 1 1783 . 1 1 170 170 ILE HG13 H 1 1.238 0.03 . 2 . . . . 282 ILE HG13 . 11012 1 1784 . 1 1 170 170 ILE HG21 H 1 0.736 0.03 . 1 . . . . 282 ILE HG2 . 11012 1 1785 . 1 1 170 170 ILE HG22 H 1 0.736 0.03 . 1 . . . . 282 ILE HG2 . 11012 1 1786 . 1 1 170 170 ILE HG23 H 1 0.736 0.03 . 1 . . . . 282 ILE HG2 . 11012 1 1787 . 1 1 170 170 ILE HD11 H 1 0.629 0.03 . 1 . . . . 282 ILE HD1 . 11012 1 1788 . 1 1 170 170 ILE HD12 H 1 0.629 0.03 . 1 . . . . 282 ILE HD1 . 11012 1 1789 . 1 1 170 170 ILE HD13 H 1 0.629 0.03 . 1 . . . . 282 ILE HD1 . 11012 1 1790 . 1 1 170 170 ILE C C 13 174.296 0.1 . 1 . . . . 282 ILE C . 11012 1 1791 . 1 1 170 170 ILE CA C 13 58.942 0.1 . 1 . . . . 282 ILE CA . 11012 1 1792 . 1 1 170 170 ILE CB C 13 42.856 0.1 . 1 . . . . 282 ILE CB . 11012 1 1793 . 1 1 170 170 ILE CG1 C 13 23.888 0.1 . 1 . . . . 282 ILE CG1 . 11012 1 1794 . 1 1 170 170 ILE CG2 C 13 18.966 0.1 . 1 . . . . 282 ILE CG2 . 11012 1 1795 . 1 1 170 170 ILE CD1 C 13 14.840 0.1 . 1 . . . . 282 ILE CD1 . 11012 1 1796 . 1 1 170 170 ILE N N 15 112.887 0.1 . 1 . . . . 282 ILE N . 11012 1 1797 . 1 1 171 171 LEU H H 1 9.473 0.03 . 1 . . . . 283 LEU H . 11012 1 1798 . 1 1 171 171 LEU HA H 1 4.877 0.03 . 1 . . . . 283 LEU HA . 11012 1 1799 . 1 1 171 171 LEU HB2 H 1 1.459 0.03 . 1 . . . . 283 LEU HB2 . 11012 1 1800 . 1 1 171 171 LEU HB3 H 1 1.132 0.03 . 1 . . . . 283 LEU HB3 . 11012 1 1801 . 1 1 171 171 LEU HG H 1 1.341 0.03 . 1 . . . . 283 LEU HG . 11012 1 1802 . 1 1 171 171 LEU HD11 H 1 0.884 0.03 . 1 . . . . 283 LEU HD1 . 11012 1 1803 . 1 1 171 171 LEU HD12 H 1 0.884 0.03 . 1 . . . . 283 LEU HD1 . 11012 1 1804 . 1 1 171 171 LEU HD13 H 1 0.884 0.03 . 1 . . . . 283 LEU HD1 . 11012 1 1805 . 1 1 171 171 LEU HD21 H 1 0.786 0.03 . 1 . . . . 283 LEU HD2 . 11012 1 1806 . 1 1 171 171 LEU HD22 H 1 0.786 0.03 . 1 . . . . 283 LEU HD2 . 11012 1 1807 . 1 1 171 171 LEU HD23 H 1 0.786 0.03 . 1 . . . . 283 LEU HD2 . 11012 1 1808 . 1 1 171 171 LEU C C 13 175.213 0.1 . 1 . . . . 283 LEU C . 11012 1 1809 . 1 1 171 171 LEU CA C 13 52.133 0.1 . 1 . . . . 283 LEU CA . 11012 1 1810 . 1 1 171 171 LEU CB C 13 44.631 0.1 . 1 . . . . 283 LEU CB . 11012 1 1811 . 1 1 171 171 LEU CG C 13 26.555 0.1 . 1 . . . . 283 LEU CG . 11012 1 1812 . 1 1 171 171 LEU CD1 C 13 25.383 0.1 . 1 . . . . 283 LEU CD1 . 11012 1 1813 . 1 1 171 171 LEU CD2 C 13 22.314 0.1 . 1 . . . . 283 LEU CD2 . 11012 1 1814 . 1 1 171 171 LEU N N 15 118.517 0.1 . 1 . . . . 283 LEU N . 11012 1 1815 . 1 1 172 172 ILE H H 1 8.979 0.03 . 1 . . . . 284 ILE H . 11012 1 1816 . 1 1 172 172 ILE HA H 1 4.156 0.03 . 1 . . . . 284 ILE HA . 11012 1 1817 . 1 1 172 172 ILE HB H 1 0.876 0.03 . 1 . . . . 284 ILE HB . 11012 1 1818 . 1 1 172 172 ILE HG12 H 1 1.180 0.03 . 2 . . . . 284 ILE HG12 . 11012 1 1819 . 1 1 172 172 ILE HG13 H 1 0.868 0.03 . 2 . . . . 284 ILE HG13 . 11012 1 1820 . 1 1 172 172 ILE HG21 H 1 0.386 0.03 . 1 . . . . 284 ILE HG2 . 11012 1 1821 . 1 1 172 172 ILE HG22 H 1 0.386 0.03 . 1 . . . . 284 ILE HG2 . 11012 1 1822 . 1 1 172 172 ILE HG23 H 1 0.386 0.03 . 1 . . . . 284 ILE HG2 . 11012 1 1823 . 1 1 172 172 ILE HD11 H 1 0.506 0.03 . 1 . . . . 284 ILE HD1 . 11012 1 1824 . 1 1 172 172 ILE HD12 H 1 0.506 0.03 . 1 . . . . 284 ILE HD1 . 11012 1 1825 . 1 1 172 172 ILE HD13 H 1 0.506 0.03 . 1 . . . . 284 ILE HD1 . 11012 1 1826 . 1 1 172 172 ILE C C 13 174.048 0.1 . 1 . . . . 284 ILE C . 11012 1 1827 . 1 1 172 172 ILE CA C 13 57.735 0.1 . 1 . . . . 284 ILE CA . 11012 1 1828 . 1 1 172 172 ILE CB C 13 34.029 0.1 . 1 . . . . 284 ILE CB . 11012 1 1829 . 1 1 172 172 ILE CG1 C 13 26.958 0.1 . 1 . . . . 284 ILE CG1 . 11012 1 1830 . 1 1 172 172 ILE CG2 C 13 16.444 0.1 . 1 . . . . 284 ILE CG2 . 11012 1 1831 . 1 1 172 172 ILE CD1 C 13 9.513 0.1 . 1 . . . . 284 ILE CD1 . 11012 1 1832 . 1 1 172 172 ILE N N 15 119.930 0.1 . 1 . . . . 284 ILE N . 11012 1 1833 . 1 1 173 173 ILE H H 1 8.819 0.03 . 1 . . . . 285 ILE H . 11012 1 1834 . 1 1 173 173 ILE HA H 1 4.388 0.03 . 1 . . . . 285 ILE HA . 11012 1 1835 . 1 1 173 173 ILE HB H 1 2.001 0.03 . 1 . . . . 285 ILE HB . 11012 1 1836 . 1 1 173 173 ILE HG12 H 1 1.521 0.03 . 1 . . . . 285 ILE HG12 . 11012 1 1837 . 1 1 173 173 ILE HG13 H 1 1.065 0.03 . 1 . . . . 285 ILE HG13 . 11012 1 1838 . 1 1 173 173 ILE HG21 H 1 0.963 0.03 . 1 . . . . 285 ILE HG2 . 11012 1 1839 . 1 1 173 173 ILE HG22 H 1 0.963 0.03 . 1 . . . . 285 ILE HG2 . 11012 1 1840 . 1 1 173 173 ILE HG23 H 1 0.963 0.03 . 1 . . . . 285 ILE HG2 . 11012 1 1841 . 1 1 173 173 ILE HD11 H 1 0.768 0.03 . 1 . . . . 285 ILE HD1 . 11012 1 1842 . 1 1 173 173 ILE HD12 H 1 0.768 0.03 . 1 . . . . 285 ILE HD1 . 11012 1 1843 . 1 1 173 173 ILE HD13 H 1 0.768 0.03 . 1 . . . . 285 ILE HD1 . 11012 1 1844 . 1 1 173 173 ILE C C 13 176.689 0.1 . 1 . . . . 285 ILE C . 11012 1 1845 . 1 1 173 173 ILE CA C 13 60.009 0.1 . 1 . . . . 285 ILE CA . 11012 1 1846 . 1 1 173 173 ILE CB C 13 37.779 0.1 . 1 . . . . 285 ILE CB . 11012 1 1847 . 1 1 173 173 ILE CG1 C 13 26.326 0.1 . 1 . . . . 285 ILE CG1 . 11012 1 1848 . 1 1 173 173 ILE CG2 C 13 18.053 0.1 . 1 . . . . 285 ILE CG2 . 11012 1 1849 . 1 1 173 173 ILE CD1 C 13 13.143 0.1 . 1 . . . . 285 ILE CD1 . 11012 1 1850 . 1 1 173 173 ILE N N 15 125.306 0.1 . 1 . . . . 285 ILE N . 11012 1 1851 . 1 1 174 174 VAL H H 1 9.485 0.03 . 1 . . . . 286 VAL H . 11012 1 1852 . 1 1 174 174 VAL HA H 1 5.590 0.03 . 1 . . . . 286 VAL HA . 11012 1 1853 . 1 1 174 174 VAL HB H 1 2.245 0.03 . 1 . . . . 286 VAL HB . 11012 1 1854 . 1 1 174 174 VAL HG11 H 1 1.097 0.03 . 1 . . . . 286 VAL HG1 . 11012 1 1855 . 1 1 174 174 VAL HG12 H 1 1.097 0.03 . 1 . . . . 286 VAL HG1 . 11012 1 1856 . 1 1 174 174 VAL HG13 H 1 1.097 0.03 . 1 . . . . 286 VAL HG1 . 11012 1 1857 . 1 1 174 174 VAL HG21 H 1 0.970 0.03 . 1 . . . . 286 VAL HG2 . 11012 1 1858 . 1 1 174 174 VAL HG22 H 1 0.970 0.03 . 1 . . . . 286 VAL HG2 . 11012 1 1859 . 1 1 174 174 VAL HG23 H 1 0.970 0.03 . 1 . . . . 286 VAL HG2 . 11012 1 1860 . 1 1 174 174 VAL C C 13 176.352 0.1 . 1 . . . . 286 VAL C . 11012 1 1861 . 1 1 174 174 VAL CA C 13 60.082 0.1 . 1 . . . . 286 VAL CA . 11012 1 1862 . 1 1 174 174 VAL CB C 13 32.546 0.1 . 1 . . . . 286 VAL CB . 11012 1 1863 . 1 1 174 174 VAL CG1 C 13 21.543 0.1 . 1 . . . . 286 VAL CG1 . 11012 1 1864 . 1 1 174 174 VAL CG2 C 13 21.070 0.1 . 1 . . . . 286 VAL CG2 . 11012 1 1865 . 1 1 174 174 VAL N N 15 132.201 0.1 . 1 . . . . 286 VAL N . 11012 1 1866 . 1 1 175 175 THR H H 1 9.713 0.03 . 1 . . . . 287 THR H . 11012 1 1867 . 1 1 175 175 THR HA H 1 5.414 0.03 . 1 . . . . 287 THR HA . 11012 1 1868 . 1 1 175 175 THR HB H 1 4.295 0.03 . 1 . . . . 287 THR HB . 11012 1 1869 . 1 1 175 175 THR HG21 H 1 1.374 0.03 . 1 . . . . 287 THR HG2 . 11012 1 1870 . 1 1 175 175 THR HG22 H 1 1.374 0.03 . 1 . . . . 287 THR HG2 . 11012 1 1871 . 1 1 175 175 THR HG23 H 1 1.374 0.03 . 1 . . . . 287 THR HG2 . 11012 1 1872 . 1 1 175 175 THR C C 13 172.551 0.1 . 1 . . . . 287 THR C . 11012 1 1873 . 1 1 175 175 THR CA C 13 57.537 0.1 . 1 . . . . 287 THR CA . 11012 1 1874 . 1 1 175 175 THR CB C 13 69.962 0.1 . 1 . . . . 287 THR CB . 11012 1 1875 . 1 1 175 175 THR CG2 C 13 24.167 0.1 . 1 . . . . 287 THR CG2 . 11012 1 1876 . 1 1 175 175 THR N N 15 115.918 0.1 . 1 . . . . 287 THR N . 11012 1 1877 . 1 1 176 176 LEU H H 1 7.726 0.03 . 1 . . . . 288 LEU H . 11012 1 1878 . 1 1 176 176 LEU HA H 1 4.937 0.03 . 1 . . . . 288 LEU HA . 11012 1 1879 . 1 1 176 176 LEU HB2 H 1 -0.129 0.03 . 1 . . . . 288 LEU HB2 . 11012 1 1880 . 1 1 176 176 LEU HB3 H 1 0.706 0.03 . 1 . . . . 288 LEU HB3 . 11012 1 1881 . 1 1 176 176 LEU HG H 1 1.113 0.03 . 1 . . . . 288 LEU HG . 11012 1 1882 . 1 1 176 176 LEU HD11 H 1 0.524 0.03 . 1 . . . . 288 LEU HD1 . 11012 1 1883 . 1 1 176 176 LEU HD12 H 1 0.524 0.03 . 1 . . . . 288 LEU HD1 . 11012 1 1884 . 1 1 176 176 LEU HD13 H 1 0.524 0.03 . 1 . . . . 288 LEU HD1 . 11012 1 1885 . 1 1 176 176 LEU HD21 H 1 0.459 0.03 . 1 . . . . 288 LEU HD2 . 11012 1 1886 . 1 1 176 176 LEU HD22 H 1 0.459 0.03 . 1 . . . . 288 LEU HD2 . 11012 1 1887 . 1 1 176 176 LEU HD23 H 1 0.459 0.03 . 1 . . . . 288 LEU HD2 . 11012 1 1888 . 1 1 176 176 LEU C C 13 175.935 0.1 . 1 . . . . 288 LEU C . 11012 1 1889 . 1 1 176 176 LEU CA C 13 52.043 0.1 . 1 . . . . 288 LEU CA . 11012 1 1890 . 1 1 176 176 LEU CB C 13 42.019 0.1 . 1 . . . . 288 LEU CB . 11012 1 1891 . 1 1 176 176 LEU CG C 13 26.786 0.1 . 1 . . . . 288 LEU CG . 11012 1 1892 . 1 1 176 176 LEU CD1 C 13 25.823 0.1 . 1 . . . . 288 LEU CD1 . 11012 1 1893 . 1 1 176 176 LEU CD2 C 13 21.830 0.1 . 1 . . . . 288 LEU CD2 . 11012 1 1894 . 1 1 176 176 LEU N N 15 124.027 0.1 . 1 . . . . 288 LEU N . 11012 1 1895 . 1 1 177 177 GLU H H 1 9.525 0.03 . 1 . . . . 289 GLU H . 11012 1 1896 . 1 1 177 177 GLU HA H 1 5.670 0.03 . 1 . . . . 289 GLU HA . 11012 1 1897 . 1 1 177 177 GLU HB2 H 1 2.080 0.03 . 1 . . . . 289 GLU HB2 . 11012 1 1898 . 1 1 177 177 GLU HB3 H 1 1.697 0.03 . 1 . . . . 289 GLU HB3 . 11012 1 1899 . 1 1 177 177 GLU HG2 H 1 1.655 0.03 . 2 . . . . 289 GLU HG2 . 11012 1 1900 . 1 1 177 177 GLU HG3 H 1 1.605 0.03 . 2 . . . . 289 GLU HG3 . 11012 1 1901 . 1 1 177 177 GLU C C 13 176.989 0.1 . 1 . . . . 289 GLU C . 11012 1 1902 . 1 1 177 177 GLU CA C 13 53.053 0.1 . 1 . . . . 289 GLU CA . 11012 1 1903 . 1 1 177 177 GLU CB C 13 33.911 0.1 . 1 . . . . 289 GLU CB . 11012 1 1904 . 1 1 177 177 GLU CG C 13 35.050 0.1 . 1 . . . . 289 GLU CG . 11012 1 1905 . 1 1 177 177 GLU N N 15 125.936 0.1 . 1 . . . . 289 GLU N . 11012 1 1906 . 1 1 178 178 THR H H 1 8.793 0.03 . 1 . . . . 290 THR H . 11012 1 1907 . 1 1 178 178 THR HA H 1 4.478 0.03 . 1 . . . . 290 THR HA . 11012 1 1908 . 1 1 178 178 THR HB H 1 4.716 0.03 . 1 . . . . 290 THR HB . 11012 1 1909 . 1 1 178 178 THR HG21 H 1 1.395 0.03 . 1 . . . . 290 THR HG2 . 11012 1 1910 . 1 1 178 178 THR HG22 H 1 1.395 0.03 . 1 . . . . 290 THR HG2 . 11012 1 1911 . 1 1 178 178 THR HG23 H 1 1.395 0.03 . 1 . . . . 290 THR HG2 . 11012 1 1912 . 1 1 178 178 THR C C 13 176.958 0.1 . 1 . . . . 290 THR C . 11012 1 1913 . 1 1 178 178 THR CA C 13 60.896 0.1 . 1 . . . . 290 THR CA . 11012 1 1914 . 1 1 178 178 THR CB C 13 71.270 0.1 . 1 . . . . 290 THR CB . 11012 1 1915 . 1 1 178 178 THR CG2 C 13 23.008 0.1 . 1 . . . . 290 THR CG2 . 11012 1 1916 . 1 1 178 178 THR N N 15 108.578 0.1 . 1 . . . . 290 THR N . 11012 1 1917 . 1 1 179 179 ARG H H 1 9.312 0.03 . 1 . . . . 291 ARG H . 11012 1 1918 . 1 1 179 179 ARG HA H 1 4.019 0.03 . 1 . . . . 291 ARG HA . 11012 1 1919 . 1 1 179 179 ARG HB2 H 1 1.891 0.03 . 1 . . . . 291 ARG HB2 . 11012 1 1920 . 1 1 179 179 ARG HB3 H 1 2.027 0.03 . 1 . . . . 291 ARG HB3 . 11012 1 1921 . 1 1 179 179 ARG HG2 H 1 1.724 0.03 . 1 . . . . 291 ARG HG2 . 11012 1 1922 . 1 1 179 179 ARG HG3 H 1 1.665 0.03 . 1 . . . . 291 ARG HG3 . 11012 1 1923 . 1 1 179 179 ARG HD2 H 1 3.265 0.03 . 1 . . . . 291 ARG HD2 . 11012 1 1924 . 1 1 179 179 ARG HD3 H 1 3.265 0.03 . 1 . . . . 291 ARG HD3 . 11012 1 1925 . 1 1 179 179 ARG C C 13 176.411 0.1 . 1 . . . . 291 ARG C . 11012 1 1926 . 1 1 179 179 ARG CA C 13 58.265 0.1 . 1 . . . . 291 ARG CA . 11012 1 1927 . 1 1 179 179 ARG CB C 13 29.496 0.1 . 1 . . . . 291 ARG CB . 11012 1 1928 . 1 1 179 179 ARG CG C 13 25.837 0.1 . 1 . . . . 291 ARG CG . 11012 1 1929 . 1 1 179 179 ARG CD C 13 43.279 0.1 . 1 . . . . 291 ARG CD . 11012 1 1930 . 1 1 179 179 ARG N N 15 121.322 0.1 . 1 . . . . 291 ARG N . 11012 1 1931 . 1 1 180 180 ASP H H 1 7.835 0.03 . 1 . . . . 292 ASP H . 11012 1 1932 . 1 1 180 180 ASP HA H 1 4.757 0.03 . 1 . . . . 292 ASP HA . 11012 1 1933 . 1 1 180 180 ASP HB2 H 1 2.871 0.03 . 2 . . . . 292 ASP HB2 . 11012 1 1934 . 1 1 180 180 ASP HB3 H 1 2.697 0.03 . 2 . . . . 292 ASP HB3 . 11012 1 1935 . 1 1 180 180 ASP C C 13 176.445 0.1 . 1 . . . . 292 ASP C . 11012 1 1936 . 1 1 180 180 ASP CA C 13 52.763 0.1 . 1 . . . . 292 ASP CA . 11012 1 1937 . 1 1 180 180 ASP CB C 13 40.062 0.1 . 1 . . . . 292 ASP CB . 11012 1 1938 . 1 1 180 180 ASP N N 15 113.030 0.1 . 1 . . . . 292 ASP N . 11012 1 1939 . 1 1 181 181 GLY H H 1 7.726 0.03 . 1 . . . . 293 GLY H . 11012 1 1940 . 1 1 181 181 GLY HA2 H 1 4.171 0.03 . 2 . . . . 293 GLY HA2 . 11012 1 1941 . 1 1 181 181 GLY HA3 H 1 3.900 0.03 . 2 . . . . 293 GLY HA3 . 11012 1 1942 . 1 1 181 181 GLY C C 13 174.711 0.1 . 1 . . . . 293 GLY C . 11012 1 1943 . 1 1 181 181 GLY CA C 13 45.459 0.1 . 1 . . . . 293 GLY CA . 11012 1 1944 . 1 1 181 181 GLY N N 15 107.507 0.1 . 1 . . . . 293 GLY N . 11012 1 1945 . 1 1 182 182 GLN H H 1 7.863 0.03 . 1 . . . . 294 GLN H . 11012 1 1946 . 1 1 182 182 GLN HA H 1 4.361 0.03 . 1 . . . . 294 GLN HA . 11012 1 1947 . 1 1 182 182 GLN HB2 H 1 2.100 0.03 . 1 . . . . 294 GLN HB2 . 11012 1 1948 . 1 1 182 182 GLN HB3 H 1 2.144 0.03 . 1 . . . . 294 GLN HB3 . 11012 1 1949 . 1 1 182 182 GLN HG2 H 1 2.171 0.03 . 1 . . . . 294 GLN HG2 . 11012 1 1950 . 1 1 182 182 GLN HG3 H 1 2.324 0.03 . 1 . . . . 294 GLN HG3 . 11012 1 1951 . 1 1 182 182 GLN HE21 H 1 8.876 0.03 . 1 . . . . 294 GLN HE21 . 11012 1 1952 . 1 1 182 182 GLN HE22 H 1 6.877 0.03 . 1 . . . . 294 GLN HE22 . 11012 1 1953 . 1 1 182 182 GLN C C 13 176.508 0.1 . 1 . . . . 294 GLN C . 11012 1 1954 . 1 1 182 182 GLN CA C 13 55.176 0.1 . 1 . . . . 294 GLN CA . 11012 1 1955 . 1 1 182 182 GLN CB C 13 28.003 0.1 . 1 . . . . 294 GLN CB . 11012 1 1956 . 1 1 182 182 GLN CG C 13 33.237 0.1 . 1 . . . . 294 GLN CG . 11012 1 1957 . 1 1 182 182 GLN N N 15 119.944 0.1 . 1 . . . . 294 GLN N . 11012 1 1958 . 1 1 183 183 VAL H H 1 8.922 0.03 . 1 . . . . 295 VAL H . 11012 1 1959 . 1 1 183 183 VAL HA H 1 3.965 0.03 . 1 . . . . 295 VAL HA . 11012 1 1960 . 1 1 183 183 VAL HB H 1 2.122 0.03 . 1 . . . . 295 VAL HB . 11012 1 1961 . 1 1 183 183 VAL HG11 H 1 1.071 0.03 . 1 . . . . 295 VAL HG1 . 11012 1 1962 . 1 1 183 183 VAL HG12 H 1 1.071 0.03 . 1 . . . . 295 VAL HG1 . 11012 1 1963 . 1 1 183 183 VAL HG13 H 1 1.071 0.03 . 1 . . . . 295 VAL HG1 . 11012 1 1964 . 1 1 183 183 VAL HG21 H 1 1.071 0.03 . 1 . . . . 295 VAL HG2 . 11012 1 1965 . 1 1 183 183 VAL HG22 H 1 1.071 0.03 . 1 . . . . 295 VAL HG2 . 11012 1 1966 . 1 1 183 183 VAL HG23 H 1 1.071 0.03 . 1 . . . . 295 VAL HG2 . 11012 1 1967 . 1 1 183 183 VAL C C 13 176.033 0.1 . 1 . . . . 295 VAL C . 11012 1 1968 . 1 1 183 183 VAL CA C 13 64.614 0.1 . 1 . . . . 295 VAL CA . 11012 1 1969 . 1 1 183 183 VAL CB C 13 31.311 0.1 . 1 . . . . 295 VAL CB . 11012 1 1970 . 1 1 183 183 VAL CG1 C 13 20.900 0.1 . 2 . . . . 295 VAL CG1 . 11012 1 1971 . 1 1 183 183 VAL CG2 C 13 21.600 0.1 . 2 . . . . 295 VAL CG2 . 11012 1 1972 . 1 1 183 183 VAL N N 15 125.926 0.1 . 1 . . . . 295 VAL N . 11012 1 1973 . 1 1 184 184 LEU H H 1 9.703 0.03 . 1 . . . . 296 LEU H . 11012 1 1974 . 1 1 184 184 LEU HA H 1 4.780 0.03 . 1 . . . . 296 LEU HA . 11012 1 1975 . 1 1 184 184 LEU HB2 H 1 1.501 0.03 . 2 . . . . 296 LEU HB2 . 11012 1 1976 . 1 1 184 184 LEU HB3 H 1 1.434 0.03 . 2 . . . . 296 LEU HB3 . 11012 1 1977 . 1 1 184 184 LEU HG H 1 1.805 0.03 . 1 . . . . 296 LEU HG . 11012 1 1978 . 1 1 184 184 LEU HD11 H 1 0.773 0.03 . 2 . . . . 296 LEU HD1 . 11012 1 1979 . 1 1 184 184 LEU HD12 H 1 0.773 0.03 . 2 . . . . 296 LEU HD1 . 11012 1 1980 . 1 1 184 184 LEU HD13 H 1 0.773 0.03 . 2 . . . . 296 LEU HD1 . 11012 1 1981 . 1 1 184 184 LEU HD21 H 1 0.942 0.03 . 2 . . . . 296 LEU HD2 . 11012 1 1982 . 1 1 184 184 LEU HD22 H 1 0.942 0.03 . 2 . . . . 296 LEU HD2 . 11012 1 1983 . 1 1 184 184 LEU HD23 H 1 0.942 0.03 . 2 . . . . 296 LEU HD2 . 11012 1 1984 . 1 1 184 184 LEU C C 13 176.951 0.1 . 1 . . . . 296 LEU C . 11012 1 1985 . 1 1 184 184 LEU CA C 13 54.208 0.1 . 1 . . . . 296 LEU CA . 11012 1 1986 . 1 1 184 184 LEU CB C 13 44.230 0.1 . 1 . . . . 296 LEU CB . 11012 1 1987 . 1 1 184 184 LEU CG C 13 26.251 0.1 . 1 . . . . 296 LEU CG . 11012 1 1988 . 1 1 184 184 LEU CD1 C 13 25.073 0.1 . 2 . . . . 296 LEU CD1 . 11012 1 1989 . 1 1 184 184 LEU CD2 C 13 21.627 0.1 . 2 . . . . 296 LEU CD2 . 11012 1 1990 . 1 1 184 184 LEU N N 15 128.315 0.1 . 1 . . . . 296 LEU N . 11012 1 1991 . 1 1 185 185 GLY H H 1 7.923 0.03 . 1 . . . . 297 GLY H . 11012 1 1992 . 1 1 185 185 GLY HA2 H 1 4.644 0.03 . 2 . . . . 297 GLY HA2 . 11012 1 1993 . 1 1 185 185 GLY HA3 H 1 3.366 0.03 . 2 . . . . 297 GLY HA3 . 11012 1 1994 . 1 1 185 185 GLY C C 13 171.350 0.1 . 1 . . . . 297 GLY C . 11012 1 1995 . 1 1 185 185 GLY CA C 13 45.088 0.1 . 1 . . . . 297 GLY CA . 11012 1 1996 . 1 1 185 185 GLY N N 15 106.549 0.1 . 1 . . . . 297 GLY N . 11012 1 1997 . 1 1 186 186 ARG H H 1 9.908 0.03 . 1 . . . . 298 ARG H . 11012 1 1998 . 1 1 186 186 ARG HA H 1 5.642 0.03 . 1 . . . . 298 ARG HA . 11012 1 1999 . 1 1 186 186 ARG HB2 H 1 2.171 0.03 . 2 . . . . 298 ARG HB2 . 11012 1 2000 . 1 1 186 186 ARG HB3 H 1 1.779 0.03 . 2 . . . . 298 ARG HB3 . 11012 1 2001 . 1 1 186 186 ARG HG2 H 1 1.730 0.03 . 2 . . . . 298 ARG HG2 . 11012 1 2002 . 1 1 186 186 ARG HG3 H 1 1.398 0.03 . 2 . . . . 298 ARG HG3 . 11012 1 2003 . 1 1 186 186 ARG C C 13 174.694 0.1 . 1 . . . . 298 ARG C . 11012 1 2004 . 1 1 186 186 ARG CA C 13 55.783 0.1 . 1 . . . . 298 ARG CA . 11012 1 2005 . 1 1 186 186 ARG CB C 13 34.792 0.1 . 1 . . . . 298 ARG CB . 11012 1 2006 . 1 1 186 186 ARG N N 15 125.611 0.1 . 1 . . . . 298 ARG N . 11012 1 2007 . 1 1 187 187 ARG H H 1 9.839 0.03 . 1 . . . . 299 ARG H . 11012 1 2008 . 1 1 187 187 ARG HA H 1 5.125 0.03 . 1 . . . . 299 ARG HA . 11012 1 2009 . 1 1 187 187 ARG HB2 H 1 2.113 0.03 . 2 . . . . 299 ARG HB2 . 11012 1 2010 . 1 1 187 187 ARG HB3 H 1 1.755 0.03 . 2 . . . . 299 ARG HB3 . 11012 1 2011 . 1 1 187 187 ARG HG2 H 1 1.583 0.03 . 1 . . . . 299 ARG HG2 . 11012 1 2012 . 1 1 187 187 ARG HG3 H 1 1.583 0.03 . 1 . . . . 299 ARG HG3 . 11012 1 2013 . 1 1 187 187 ARG HD2 H 1 3.379 0.03 . 2 . . . . 299 ARG HD2 . 11012 1 2014 . 1 1 187 187 ARG HD3 H 1 3.101 0.03 . 2 . . . . 299 ARG HD3 . 11012 1 2015 . 1 1 187 187 ARG C C 13 174.514 0.1 . 1 . . . . 299 ARG C . 11012 1 2016 . 1 1 187 187 ARG CA C 13 53.175 0.1 . 1 . . . . 299 ARG CA . 11012 1 2017 . 1 1 187 187 ARG CB C 13 34.906 0.1 . 1 . . . . 299 ARG CB . 11012 1 2018 . 1 1 187 187 ARG CG C 13 26.800 0.1 . 1 . . . . 299 ARG CG . 11012 1 2019 . 1 1 187 187 ARG CD C 13 43.152 0.1 . 1 . . . . 299 ARG CD . 11012 1 2020 . 1 1 187 187 ARG N N 15 127.292 0.1 . 1 . . . . 299 ARG N . 11012 1 2021 . 1 1 188 188 CYS H H 1 8.594 0.03 . 1 . . . . 300 CYS H . 11012 1 2022 . 1 1 188 188 CYS HA H 1 5.800 0.03 . 1 . . . . 300 CYS HA . 11012 1 2023 . 1 1 188 188 CYS HB2 H 1 2.920 0.03 . 1 . . . . 300 CYS HB2 . 11012 1 2024 . 1 1 188 188 CYS HB3 H 1 2.717 0.03 . 1 . . . . 300 CYS HB3 . 11012 1 2025 . 1 1 188 188 CYS C C 13 174.328 0.1 . 1 . . . . 300 CYS C . 11012 1 2026 . 1 1 188 188 CYS CA C 13 55.431 0.1 . 1 . . . . 300 CYS CA . 11012 1 2027 . 1 1 188 188 CYS CB C 13 30.712 0.1 . 1 . . . . 300 CYS CB . 11012 1 2028 . 1 1 188 188 CYS N N 15 117.963 0.1 . 1 . . . . 300 CYS N . 11012 1 2029 . 1 1 189 189 PHE H H 1 8.135 0.03 . 1 . . . . 301 PHE H . 11012 1 2030 . 1 1 189 189 PHE HA H 1 5.125 0.03 . 1 . . . . 301 PHE HA . 11012 1 2031 . 1 1 189 189 PHE HB2 H 1 3.218 0.03 . 1 . . . . 301 PHE HB2 . 11012 1 2032 . 1 1 189 189 PHE HB3 H 1 3.421 0.03 . 1 . . . . 301 PHE HB3 . 11012 1 2033 . 1 1 189 189 PHE HD1 H 1 7.092 0.03 . 1 . . . . 301 PHE HD1 . 11012 1 2034 . 1 1 189 189 PHE HD2 H 1 7.092 0.03 . 1 . . . . 301 PHE HD2 . 11012 1 2035 . 1 1 189 189 PHE HE1 H 1 7.081 0.03 . 1 . . . . 301 PHE HE1 . 11012 1 2036 . 1 1 189 189 PHE HE2 H 1 7.081 0.03 . 1 . . . . 301 PHE HE2 . 11012 1 2037 . 1 1 189 189 PHE HZ H 1 6.933 0.03 . 1 . . . . 301 PHE HZ . 11012 1 2038 . 1 1 189 189 PHE C C 13 172.762 0.1 . 1 . . . . 301 PHE C . 11012 1 2039 . 1 1 189 189 PHE CA C 13 55.534 0.1 . 1 . . . . 301 PHE CA . 11012 1 2040 . 1 1 189 189 PHE CB C 13 40.178 0.1 . 1 . . . . 301 PHE CB . 11012 1 2041 . 1 1 189 189 PHE N N 15 119.022 0.1 . 1 . . . . 301 PHE N . 11012 1 2042 . 1 1 190 190 GLU H H 1 8.785 0.03 . 1 . . . . 302 GLU H . 11012 1 2043 . 1 1 190 190 GLU HA H 1 5.012 0.03 . 1 . . . . 302 GLU HA . 11012 1 2044 . 1 1 190 190 GLU HB2 H 1 1.796 0.03 . 1 . . . . 302 GLU HB2 . 11012 1 2045 . 1 1 190 190 GLU HB3 H 1 2.177 0.03 . 1 . . . . 302 GLU HB3 . 11012 1 2046 . 1 1 190 190 GLU HG2 H 1 2.951 0.03 . 2 . . . . 302 GLU HG2 . 11012 1 2047 . 1 1 190 190 GLU HG3 H 1 2.923 0.03 . 2 . . . . 302 GLU HG3 . 11012 1 2048 . 1 1 190 190 GLU C C 13 174.660 0.1 . 1 . . . . 302 GLU C . 11012 1 2049 . 1 1 190 190 GLU CA C 13 55.615 0.1 . 1 . . . . 302 GLU CA . 11012 1 2050 . 1 1 190 190 GLU CB C 13 30.056 0.1 . 1 . . . . 302 GLU CB . 11012 1 2051 . 1 1 190 190 GLU CG C 13 36.333 0.1 . 1 . . . . 302 GLU CG . 11012 1 2052 . 1 1 190 190 GLU N N 15 122.909 0.1 . 1 . . . . 302 GLU N . 11012 1 2053 . 1 1 191 191 ALA H H 1 7.931 0.03 . 1 . . . . 303 ALA H . 11012 1 2054 . 1 1 191 191 ALA HA H 1 5.579 0.03 . 1 . . . . 303 ALA HA . 11012 1 2055 . 1 1 191 191 ALA HB1 H 1 0.850 0.03 . 1 . . . . 303 ALA HB . 11012 1 2056 . 1 1 191 191 ALA HB2 H 1 0.850 0.03 . 1 . . . . 303 ALA HB . 11012 1 2057 . 1 1 191 191 ALA HB3 H 1 0.850 0.03 . 1 . . . . 303 ALA HB . 11012 1 2058 . 1 1 191 191 ALA C C 13 175.099 0.1 . 1 . . . . 303 ALA C . 11012 1 2059 . 1 1 191 191 ALA CA C 13 49.918 0.1 . 1 . . . . 303 ALA CA . 11012 1 2060 . 1 1 191 191 ALA CB C 13 21.384 0.1 . 1 . . . . 303 ALA CB . 11012 1 2061 . 1 1 191 191 ALA N N 15 125.037 0.1 . 1 . . . . 303 ALA N . 11012 1 2062 . 1 1 192 192 ARG H H 1 9.016 0.03 . 1 . . . . 304 ARG H . 11012 1 2063 . 1 1 192 192 ARG HA H 1 4.380 0.03 . 1 . . . . 304 ARG HA . 11012 1 2064 . 1 1 192 192 ARG HB2 H 1 1.423 0.03 . 2 . . . . 304 ARG HB2 . 11012 1 2065 . 1 1 192 192 ARG HB3 H 1 1.505 0.03 . 2 . . . . 304 ARG HB3 . 11012 1 2066 . 1 1 192 192 ARG HG2 H 1 1.765 0.03 . 1 . . . . 304 ARG HG2 . 11012 1 2067 . 1 1 192 192 ARG HG3 H 1 1.765 0.03 . 1 . . . . 304 ARG HG3 . 11012 1 2068 . 1 1 192 192 ARG C C 13 173.345 0.1 . 1 . . . . 304 ARG C . 11012 1 2069 . 1 1 192 192 ARG CA C 13 54.480 0.1 . 1 . . . . 304 ARG CA . 11012 1 2070 . 1 1 192 192 ARG CB C 13 32.566 0.1 . 1 . . . . 304 ARG CB . 11012 1 2071 . 1 1 192 192 ARG CG C 13 26.952 0.1 . 1 . . . . 304 ARG CG . 11012 1 2072 . 1 1 192 192 ARG N N 15 123.511 0.1 . 1 . . . . 304 ARG N . 11012 1 2073 . 1 1 193 193 ILE H H 1 8.554 0.03 . 1 . . . . 305 ILE H . 11012 1 2074 . 1 1 193 193 ILE HA H 1 5.570 0.03 . 1 . . . . 305 ILE HA . 11012 1 2075 . 1 1 193 193 ILE HB H 1 2.191 0.03 . 1 . . . . 305 ILE HB . 11012 1 2076 . 1 1 193 193 ILE HG12 H 1 1.264 0.03 . 2 . . . . 305 ILE HG12 . 11012 1 2077 . 1 1 193 193 ILE HG13 H 1 1.155 0.03 . 2 . . . . 305 ILE HG13 . 11012 1 2078 . 1 1 193 193 ILE HG21 H 1 1.008 0.03 . 1 . . . . 305 ILE HG2 . 11012 1 2079 . 1 1 193 193 ILE HG22 H 1 1.008 0.03 . 1 . . . . 305 ILE HG2 . 11012 1 2080 . 1 1 193 193 ILE HG23 H 1 1.008 0.03 . 1 . . . . 305 ILE HG2 . 11012 1 2081 . 1 1 193 193 ILE HD11 H 1 0.579 0.03 . 1 . . . . 305 ILE HD1 . 11012 1 2082 . 1 1 193 193 ILE HD12 H 1 0.579 0.03 . 1 . . . . 305 ILE HD1 . 11012 1 2083 . 1 1 193 193 ILE HD13 H 1 0.579 0.03 . 1 . . . . 305 ILE HD1 . 11012 1 2084 . 1 1 193 193 ILE C C 13 177.497 0.1 . 1 . . . . 305 ILE C . 11012 1 2085 . 1 1 193 193 ILE CA C 13 59.428 0.1 . 1 . . . . 305 ILE CA . 11012 1 2086 . 1 1 193 193 ILE CB C 13 37.221 0.1 . 1 . . . . 305 ILE CB . 11012 1 2087 . 1 1 193 193 ILE CG1 C 13 29.071 0.1 . 1 . . . . 305 ILE CG1 . 11012 1 2088 . 1 1 193 193 ILE CG2 C 13 19.542 0.1 . 1 . . . . 305 ILE CG2 . 11012 1 2089 . 1 1 193 193 ILE CD1 C 13 14.172 0.1 . 1 . . . . 305 ILE CD1 . 11012 1 2090 . 1 1 193 193 ILE N N 15 129.774 0.1 . 1 . . . . 305 ILE N . 11012 1 2091 . 1 1 194 194 CYS H H 1 9.621 0.03 . 1 . . . . 306 CYS H . 11012 1 2092 . 1 1 194 194 CYS HA H 1 5.188 0.03 . 1 . . . . 306 CYS HA . 11012 1 2093 . 1 1 194 194 CYS HB2 H 1 3.357 0.03 . 1 . . . . 306 CYS HB2 . 11012 1 2094 . 1 1 194 194 CYS HB3 H 1 3.006 0.03 . 1 . . . . 306 CYS HB3 . 11012 1 2095 . 1 1 194 194 CYS C C 13 173.023 0.1 . 1 . . . . 306 CYS C . 11012 1 2096 . 1 1 194 194 CYS CA C 13 54.802 0.1 . 1 . . . . 306 CYS CA . 11012 1 2097 . 1 1 194 194 CYS CB C 13 31.535 0.1 . 1 . . . . 306 CYS CB . 11012 1 2098 . 1 1 194 194 CYS N N 15 123.630 0.1 . 1 . . . . 306 CYS N . 11012 1 2099 . 1 1 195 195 ALA H H 1 8.596 0.03 . 1 . . . . 307 ALA H . 11012 1 2100 . 1 1 195 195 ALA HA H 1 4.370 0.03 . 1 . . . . 307 ALA HA . 11012 1 2101 . 1 1 195 195 ALA HB1 H 1 1.593 0.03 . 1 . . . . 307 ALA HB . 11012 1 2102 . 1 1 195 195 ALA HB2 H 1 1.593 0.03 . 1 . . . . 307 ALA HB . 11012 1 2103 . 1 1 195 195 ALA HB3 H 1 1.593 0.03 . 1 . . . . 307 ALA HB . 11012 1 2104 . 1 1 195 195 ALA C C 13 179.268 0.1 . 1 . . . . 307 ALA C . 11012 1 2105 . 1 1 195 195 ALA CA C 13 54.745 0.1 . 1 . . . . 307 ALA CA . 11012 1 2106 . 1 1 195 195 ALA CB C 13 19.249 0.1 . 1 . . . . 307 ALA CB . 11012 1 2107 . 1 1 195 195 ALA N N 15 122.497 0.1 . 1 . . . . 307 ALA N . 11012 1 2108 . 1 1 196 196 CYS H H 1 8.852 0.03 . 1 . . . . 308 CYS H . 11012 1 2109 . 1 1 196 196 CYS HA H 1 4.954 0.03 . 1 . . . . 308 CYS HA . 11012 1 2110 . 1 1 196 196 CYS HB2 H 1 2.956 0.03 . 1 . . . . 308 CYS HB2 . 11012 1 2111 . 1 1 196 196 CYS HB3 H 1 2.912 0.03 . 1 . . . . 308 CYS HB3 . 11012 1 2112 . 1 1 196 196 CYS C C 13 171.696 0.1 . 1 . . . . 308 CYS C . 11012 1 2113 . 1 1 196 196 CYS CA C 13 54.862 0.1 . 1 . . . . 308 CYS CA . 11012 1 2114 . 1 1 196 196 CYS CB C 13 27.343 0.1 . 1 . . . . 308 CYS CB . 11012 1 2115 . 1 1 196 196 CYS N N 15 116.092 0.1 . 1 . . . . 308 CYS N . 11012 1 2116 . 1 1 197 197 PRO HA H 1 3.914 0.03 . 1 . . . . 309 PRO HA . 11012 1 2117 . 1 1 197 197 PRO HB2 H 1 1.676 0.03 . 1 . . . . 309 PRO HB2 . 11012 1 2118 . 1 1 197 197 PRO HB3 H 1 2.176 0.03 . 1 . . . . 309 PRO HB3 . 11012 1 2119 . 1 1 197 197 PRO HG2 H 1 2.139 0.03 . 2 . . . . 309 PRO HG2 . 11012 1 2120 . 1 1 197 197 PRO HG3 H 1 1.736 0.03 . 2 . . . . 309 PRO HG3 . 11012 1 2121 . 1 1 197 197 PRO HD2 H 1 3.627 0.03 . 1 . . . . 309 PRO HD2 . 11012 1 2122 . 1 1 197 197 PRO HD3 H 1 3.861 0.03 . 1 . . . . 309 PRO HD3 . 11012 1 2123 . 1 1 197 197 PRO C C 13 176.697 0.1 . 1 . . . . 309 PRO C . 11012 1 2124 . 1 1 197 197 PRO CA C 13 66.418 0.1 . 1 . . . . 309 PRO CA . 11012 1 2125 . 1 1 197 197 PRO CB C 13 32.562 0.1 . 1 . . . . 309 PRO CB . 11012 1 2126 . 1 1 197 197 PRO CG C 13 26.814 0.1 . 1 . . . . 309 PRO CG . 11012 1 2127 . 1 1 197 197 PRO CD C 13 49.595 0.1 . 1 . . . . 309 PRO CD . 11012 1 2128 . 1 1 198 198 GLY H H 1 8.902 0.03 . 1 . . . . 310 GLY H . 11012 1 2129 . 1 1 198 198 GLY HA2 H 1 3.747 0.03 . 2 . . . . 310 GLY HA2 . 11012 1 2130 . 1 1 198 198 GLY HA3 H 1 3.445 0.03 . 2 . . . . 310 GLY HA3 . 11012 1 2131 . 1 1 198 198 GLY C C 13 176.353 0.1 . 1 . . . . 310 GLY C . 11012 1 2132 . 1 1 198 198 GLY CA C 13 46.698 0.1 . 1 . . . . 310 GLY CA . 11012 1 2133 . 1 1 198 198 GLY N N 15 102.990 0.1 . 1 . . . . 310 GLY N . 11012 1 2134 . 1 1 199 199 ARG H H 1 7.426 0.03 . 1 . . . . 311 ARG H . 11012 1 2135 . 1 1 199 199 ARG HA H 1 4.051 0.03 . 1 . . . . 311 ARG HA . 11012 1 2136 . 1 1 199 199 ARG HB2 H 1 2.019 0.03 . 2 . . . . 311 ARG HB2 . 11012 1 2137 . 1 1 199 199 ARG HB3 H 1 1.925 0.03 . 2 . . . . 311 ARG HB3 . 11012 1 2138 . 1 1 199 199 ARG HG2 H 1 1.616 0.03 . 1 . . . . 311 ARG HG2 . 11012 1 2139 . 1 1 199 199 ARG HG3 H 1 1.616 0.03 . 1 . . . . 311 ARG HG3 . 11012 1 2140 . 1 1 199 199 ARG HD2 H 1 3.281 0.03 . 1 . . . . 311 ARG HD2 . 11012 1 2141 . 1 1 199 199 ARG HD3 H 1 3.281 0.03 . 1 . . . . 311 ARG HD3 . 11012 1 2142 . 1 1 199 199 ARG C C 13 178.976 0.1 . 1 . . . . 311 ARG C . 11012 1 2143 . 1 1 199 199 ARG CA C 13 58.467 0.1 . 1 . . . . 311 ARG CA . 11012 1 2144 . 1 1 199 199 ARG CB C 13 29.861 0.1 . 1 . . . . 311 ARG CB . 11012 1 2145 . 1 1 199 199 ARG CD C 13 42.973 0.1 . 1 . . . . 311 ARG CD . 11012 1 2146 . 1 1 199 199 ARG N N 15 122.215 0.1 . 1 . . . . 311 ARG N . 11012 1 2147 . 1 1 200 200 ASP H H 1 8.020 0.03 . 1 . . . . 312 ASP H . 11012 1 2148 . 1 1 200 200 ASP HA H 1 4.336 0.03 . 1 . . . . 312 ASP HA . 11012 1 2149 . 1 1 200 200 ASP HB2 H 1 2.706 0.03 . 1 . . . . 312 ASP HB2 . 11012 1 2150 . 1 1 200 200 ASP HB3 H 1 2.706 0.03 . 1 . . . . 312 ASP HB3 . 11012 1 2151 . 1 1 200 200 ASP C C 13 177.749 0.1 . 1 . . . . 312 ASP C . 11012 1 2152 . 1 1 200 200 ASP CA C 13 57.075 0.1 . 1 . . . . 312 ASP CA . 11012 1 2153 . 1 1 200 200 ASP CB C 13 39.428 0.1 . 1 . . . . 312 ASP CB . 11012 1 2154 . 1 1 200 200 ASP N N 15 122.691 0.1 . 1 . . . . 312 ASP N . 11012 1 2155 . 1 1 201 201 ARG H H 1 7.823 0.03 . 1 . . . . 313 ARG H . 11012 1 2156 . 1 1 201 201 ARG HA H 1 3.409 0.03 . 1 . . . . 313 ARG HA . 11012 1 2157 . 1 1 201 201 ARG HB2 H 1 0.456 0.03 . 1 . . . . 313 ARG HB2 . 11012 1 2158 . 1 1 201 201 ARG HB3 H 1 1.266 0.03 . 1 . . . . 313 ARG HB3 . 11012 1 2159 . 1 1 201 201 ARG C C 13 177.402 0.1 . 1 . . . . 313 ARG C . 11012 1 2160 . 1 1 201 201 ARG CA C 13 58.891 0.1 . 1 . . . . 313 ARG CA . 11012 1 2161 . 1 1 201 201 ARG CB C 13 28.403 0.1 . 1 . . . . 313 ARG CB . 11012 1 2162 . 1 1 201 201 ARG CG C 13 26.539 0.1 . 1 . . . . 313 ARG CG . 11012 1 2163 . 1 1 201 201 ARG N N 15 120.937 0.1 . 1 . . . . 313 ARG N . 11012 1 2164 . 1 1 202 202 LYS H H 1 7.336 0.03 . 1 . . . . 314 LYS H . 11012 1 2165 . 1 1 202 202 LYS HA H 1 4.003 0.03 . 1 . . . . 314 LYS HA . 11012 1 2166 . 1 1 202 202 LYS HB2 H 1 1.805 0.03 . 1 . . . . 314 LYS HB2 . 11012 1 2167 . 1 1 202 202 LYS HB3 H 1 1.902 0.03 . 1 . . . . 314 LYS HB3 . 11012 1 2168 . 1 1 202 202 LYS HG2 H 1 1.426 0.03 . 1 . . . . 314 LYS HG2 . 11012 1 2169 . 1 1 202 202 LYS HG3 H 1 1.493 0.03 . 1 . . . . 314 LYS HG3 . 11012 1 2170 . 1 1 202 202 LYS HD2 H 1 1.686 0.03 . 1 . . . . 314 LYS HD2 . 11012 1 2171 . 1 1 202 202 LYS HD3 H 1 1.686 0.03 . 1 . . . . 314 LYS HD3 . 11012 1 2172 . 1 1 202 202 LYS C C 13 178.291 0.1 . 1 . . . . 314 LYS C . 11012 1 2173 . 1 1 202 202 LYS CA C 13 58.672 0.1 . 1 . . . . 314 LYS CA . 11012 1 2174 . 1 1 202 202 LYS CB C 13 31.799 0.1 . 1 . . . . 314 LYS CB . 11012 1 2175 . 1 1 202 202 LYS CG C 13 24.455 0.1 . 1 . . . . 314 LYS CG . 11012 1 2176 . 1 1 202 202 LYS CD C 13 28.689 0.1 . 1 . . . . 314 LYS CD . 11012 1 2177 . 1 1 202 202 LYS N N 15 118.552 0.1 . 1 . . . . 314 LYS N . 11012 1 2178 . 1 1 203 203 ALA H H 1 7.945 0.03 . 1 . . . . 315 ALA H . 11012 1 2179 . 1 1 203 203 ALA HA H 1 4.199 0.03 . 1 . . . . 315 ALA HA . 11012 1 2180 . 1 1 203 203 ALA HB1 H 1 1.537 0.03 . 1 . . . . 315 ALA HB . 11012 1 2181 . 1 1 203 203 ALA HB2 H 1 1.537 0.03 . 1 . . . . 315 ALA HB . 11012 1 2182 . 1 1 203 203 ALA HB3 H 1 1.537 0.03 . 1 . . . . 315 ALA HB . 11012 1 2183 . 1 1 203 203 ALA C C 13 181.230 0.1 . 1 . . . . 315 ALA C . 11012 1 2184 . 1 1 203 203 ALA CA C 13 54.660 0.1 . 1 . . . . 315 ALA CA . 11012 1 2185 . 1 1 203 203 ALA CB C 13 17.650 0.1 . 1 . . . . 315 ALA CB . 11012 1 2186 . 1 1 203 203 ALA N N 15 120.006 0.1 . 1 . . . . 315 ALA N . 11012 1 2187 . 1 1 204 204 ASP H H 1 8.068 0.03 . 1 . . . . 316 ASP H . 11012 1 2188 . 1 1 204 204 ASP HA H 1 4.445 0.03 . 1 . . . . 316 ASP HA . 11012 1 2189 . 1 1 204 204 ASP HB2 H 1 2.652 0.03 . 1 . . . . 316 ASP HB2 . 11012 1 2190 . 1 1 204 204 ASP HB3 H 1 3.042 0.03 . 1 . . . . 316 ASP HB3 . 11012 1 2191 . 1 1 204 204 ASP C C 13 179.665 0.1 . 1 . . . . 316 ASP C . 11012 1 2192 . 1 1 204 204 ASP CA C 13 56.601 0.1 . 1 . . . . 316 ASP CA . 11012 1 2193 . 1 1 204 204 ASP CB C 13 39.593 0.1 . 1 . . . . 316 ASP CB . 11012 1 2194 . 1 1 204 204 ASP N N 15 119.706 0.1 . 1 . . . . 316 ASP N . 11012 1 2195 . 1 1 205 205 GLU H H 1 8.674 0.03 . 1 . . . . 317 GLU H . 11012 1 2196 . 1 1 205 205 GLU HA H 1 3.935 0.03 . 1 . . . . 317 GLU HA . 11012 1 2197 . 1 1 205 205 GLU HB2 H 1 2.155 0.03 . 1 . . . . 317 GLU HB2 . 11012 1 2198 . 1 1 205 205 GLU HB3 H 1 2.000 0.03 . 1 . . . . 317 GLU HB3 . 11012 1 2199 . 1 1 205 205 GLU HG2 H 1 2.658 0.03 . 1 . . . . 317 GLU HG2 . 11012 1 2200 . 1 1 205 205 GLU HG3 H 1 2.658 0.03 . 1 . . . . 317 GLU HG3 . 11012 1 2201 . 1 1 205 205 GLU C C 13 179.424 0.1 . 1 . . . . 317 GLU C . 11012 1 2202 . 1 1 205 205 GLU CA C 13 59.192 0.1 . 1 . . . . 317 GLU CA . 11012 1 2203 . 1 1 205 205 GLU CB C 13 28.542 0.1 . 1 . . . . 317 GLU CB . 11012 1 2204 . 1 1 205 205 GLU CG C 13 37.644 0.1 . 1 . . . . 317 GLU CG . 11012 1 2205 . 1 1 205 205 GLU N N 15 120.528 0.1 . 1 . . . . 317 GLU N . 11012 1 2206 . 1 1 206 206 ASP H H 1 8.758 0.03 . 1 . . . . 318 ASP H . 11012 1 2207 . 1 1 206 206 ASP HA H 1 4.497 0.03 . 1 . . . . 318 ASP HA . 11012 1 2208 . 1 1 206 206 ASP HB2 H 1 2.901 0.03 . 2 . . . . 318 ASP HB2 . 11012 1 2209 . 1 1 206 206 ASP HB3 H 1 2.666 0.03 . 2 . . . . 318 ASP HB3 . 11012 1 2210 . 1 1 206 206 ASP C C 13 178.753 0.1 . 1 . . . . 318 ASP C . 11012 1 2211 . 1 1 206 206 ASP CA C 13 56.674 0.1 . 1 . . . . 318 ASP CA . 11012 1 2212 . 1 1 206 206 ASP CB C 13 40.019 0.1 . 1 . . . . 318 ASP CB . 11012 1 2213 . 1 1 206 206 ASP N N 15 120.119 0.1 . 1 . . . . 318 ASP N . 11012 1 2214 . 1 1 207 207 SER H H 1 7.842 0.03 . 1 . . . . 319 SER H . 11012 1 2215 . 1 1 207 207 SER HA H 1 4.320 0.03 . 1 . . . . 319 SER HA . 11012 1 2216 . 1 1 207 207 SER HB2 H 1 4.086 0.03 . 2 . . . . 319 SER HB2 . 11012 1 2217 . 1 1 207 207 SER HB3 H 1 4.122 0.03 . 2 . . . . 319 SER HB3 . 11012 1 2218 . 1 1 207 207 SER C C 13 176.381 0.1 . 1 . . . . 319 SER C . 11012 1 2219 . 1 1 207 207 SER CA C 13 60.747 0.1 . 1 . . . . 319 SER CA . 11012 1 2220 . 1 1 207 207 SER CB C 13 62.901 0.1 . 1 . . . . 319 SER CB . 11012 1 2221 . 1 1 207 207 SER N N 15 114.103 0.1 . 1 . . . . 319 SER N . 11012 1 2222 . 1 1 208 208 ILE H H 1 7.594 0.03 . 1 . . . . 320 ILE H . 11012 1 2223 . 1 1 208 208 ILE HA H 1 4.111 0.03 . 1 . . . . 320 ILE HA . 11012 1 2224 . 1 1 208 208 ILE HB H 1 2.025 0.03 . 1 . . . . 320 ILE HB . 11012 1 2225 . 1 1 208 208 ILE HG12 H 1 1.627 0.03 . 2 . . . . 320 ILE HG12 . 11012 1 2226 . 1 1 208 208 ILE HG13 H 1 1.375 0.03 . 2 . . . . 320 ILE HG13 . 11012 1 2227 . 1 1 208 208 ILE HG21 H 1 0.976 0.03 . 1 . . . . 320 ILE HG2 . 11012 1 2228 . 1 1 208 208 ILE HG22 H 1 0.976 0.03 . 1 . . . . 320 ILE HG2 . 11012 1 2229 . 1 1 208 208 ILE HG23 H 1 0.976 0.03 . 1 . . . . 320 ILE HG2 . 11012 1 2230 . 1 1 208 208 ILE HD11 H 1 0.890 0.03 . 1 . . . . 320 ILE HD1 . 11012 1 2231 . 1 1 208 208 ILE HD12 H 1 0.890 0.03 . 1 . . . . 320 ILE HD1 . 11012 1 2232 . 1 1 208 208 ILE HD13 H 1 0.890 0.03 . 1 . . . . 320 ILE HD1 . 11012 1 2233 . 1 1 208 208 ILE C C 13 177.710 0.1 . 1 . . . . 320 ILE C . 11012 1 2234 . 1 1 208 208 ILE CA C 13 62.569 0.1 . 1 . . . . 320 ILE CA . 11012 1 2235 . 1 1 208 208 ILE CB C 13 37.605 0.1 . 1 . . . . 320 ILE CB . 11012 1 2236 . 1 1 208 208 ILE CG1 C 13 27.745 0.1 . 1 . . . . 320 ILE CG1 . 11012 1 2237 . 1 1 208 208 ILE CG2 C 13 17.276 0.1 . 1 . . . . 320 ILE CG2 . 11012 1 2238 . 1 1 208 208 ILE CD1 C 13 12.757 0.1 . 1 . . . . 320 ILE CD1 . 11012 1 2239 . 1 1 208 208 ILE N N 15 120.006 0.1 . 1 . . . . 320 ILE N . 11012 1 2240 . 1 1 209 209 ARG H H 1 7.842 0.03 . 1 . . . . 321 ARG H . 11012 1 2241 . 1 1 209 209 ARG HA H 1 4.259 0.03 . 1 . . . . 321 ARG HA . 11012 1 2242 . 1 1 209 209 ARG HB2 H 1 1.777 0.03 . 2 . . . . 321 ARG HB2 . 11012 1 2243 . 1 1 209 209 ARG HB3 H 1 1.955 0.03 . 2 . . . . 321 ARG HB3 . 11012 1 2244 . 1 1 209 209 ARG HG2 H 1 1.814 0.03 . 2 . . . . 321 ARG HG2 . 11012 1 2245 . 1 1 209 209 ARG HG3 H 1 1.724 0.03 . 2 . . . . 321 ARG HG3 . 11012 1 2246 . 1 1 209 209 ARG HD2 H 1 3.259 0.03 . 1 . . . . 321 ARG HD2 . 11012 1 2247 . 1 1 209 209 ARG HD3 H 1 3.259 0.03 . 1 . . . . 321 ARG HD3 . 11012 1 2248 . 1 1 209 209 ARG C C 13 177.733 0.1 . 1 . . . . 321 ARG C . 11012 1 2249 . 1 1 209 209 ARG CA C 13 57.324 0.1 . 1 . . . . 321 ARG CA . 11012 1 2250 . 1 1 209 209 ARG CB C 13 29.918 0.1 . 1 . . . . 321 ARG CB . 11012 1 2251 . 1 1 209 209 ARG CG C 13 27.093 0.1 . 1 . . . . 321 ARG CG . 11012 1 2252 . 1 1 209 209 ARG CD C 13 42.897 0.1 . 1 . . . . 321 ARG CD . 11012 1 2253 . 1 1 209 209 ARG N N 15 121.648 0.1 . 1 . . . . 321 ARG N . 11012 1 2254 . 1 1 210 210 LYS H H 1 8.009 0.03 . 1 . . . . 322 LYS H . 11012 1 2255 . 1 1 210 210 LYS HA H 1 4.266 0.03 . 1 . . . . 322 LYS HA . 11012 1 2256 . 1 1 210 210 LYS HB2 H 1 1.938 0.03 . 2 . . . . 322 LYS HB2 . 11012 1 2257 . 1 1 210 210 LYS HB3 H 1 1.886 0.03 . 2 . . . . 322 LYS HB3 . 11012 1 2258 . 1 1 210 210 LYS HG2 H 1 1.571 0.03 . 2 . . . . 322 LYS HG2 . 11012 1 2259 . 1 1 210 210 LYS HG3 H 1 1.492 0.03 . 2 . . . . 322 LYS HG3 . 11012 1 2260 . 1 1 210 210 LYS HD2 H 1 1.720 0.03 . 1 . . . . 322 LYS HD2 . 11012 1 2261 . 1 1 210 210 LYS HD3 H 1 1.720 0.03 . 1 . . . . 322 LYS HD3 . 11012 1 2262 . 1 1 210 210 LYS HE2 H 1 3.025 0.03 . 1 . . . . 322 LYS HE2 . 11012 1 2263 . 1 1 210 210 LYS HE3 H 1 3.025 0.03 . 1 . . . . 322 LYS HE3 . 11012 1 2264 . 1 1 210 210 LYS C C 13 177.445 0.1 . 1 . . . . 322 LYS C . 11012 1 2265 . 1 1 210 210 LYS CA C 13 57.041 0.1 . 1 . . . . 322 LYS CA . 11012 1 2266 . 1 1 210 210 LYS CB C 13 32.380 0.1 . 1 . . . . 322 LYS CB . 11012 1 2267 . 1 1 210 210 LYS CG C 13 24.723 0.1 . 1 . . . . 322 LYS CG . 11012 1 2268 . 1 1 210 210 LYS CD C 13 28.770 0.1 . 1 . . . . 322 LYS CD . 11012 1 2269 . 1 1 210 210 LYS CE C 13 41.774 0.1 . 1 . . . . 322 LYS CE . 11012 1 2270 . 1 1 210 210 LYS N N 15 119.768 0.1 . 1 . . . . 322 LYS N . 11012 1 2271 . 1 1 211 211 GLN H H 1 8.054 0.03 . 1 . . . . 323 GLN H . 11012 1 2272 . 1 1 211 211 GLN HA H 1 4.293 0.03 . 1 . . . . 323 GLN HA . 11012 1 2273 . 1 1 211 211 GLN HB2 H 1 2.202 0.03 . 1 . . . . 323 GLN HB2 . 11012 1 2274 . 1 1 211 211 GLN HB3 H 1 2.202 0.03 . 1 . . . . 323 GLN HB3 . 11012 1 2275 . 1 1 211 211 GLN HG2 H 1 2.462 0.03 . 1 . . . . 323 GLN HG2 . 11012 1 2276 . 1 1 211 211 GLN HG3 H 1 2.462 0.03 . 1 . . . . 323 GLN HG3 . 11012 1 2277 . 1 1 211 211 GLN C C 13 176.474 0.1 . 1 . . . . 323 GLN C . 11012 1 2278 . 1 1 211 211 GLN CA C 13 56.097 0.1 . 1 . . . . 323 GLN CA . 11012 1 2279 . 1 1 211 211 GLN CB C 13 28.819 0.1 . 1 . . . . 323 GLN CB . 11012 1 2280 . 1 1 211 211 GLN CG C 13 33.533 0.1 . 1 . . . . 323 GLN CG . 11012 1 2281 . 1 1 211 211 GLN N N 15 119.671 0.1 . 1 . . . . 323 GLN N . 11012 1 2282 . 1 1 212 212 GLN H H 1 8.253 0.03 . 1 . . . . 324 GLN H . 11012 1 2283 . 1 1 212 212 GLN HA H 1 4.378 0.03 . 1 . . . . 324 GLN HA . 11012 1 2284 . 1 1 212 212 GLN HB2 H 1 2.204 0.03 . 2 . . . . 324 GLN HB2 . 11012 1 2285 . 1 1 212 212 GLN HB3 H 1 2.139 0.03 . 2 . . . . 324 GLN HB3 . 11012 1 2286 . 1 1 212 212 GLN HG2 H 1 2.483 0.03 . 2 . . . . 324 GLN HG2 . 11012 1 2287 . 1 1 212 212 GLN HG3 H 1 2.433 0.03 . 2 . . . . 324 GLN HG3 . 11012 1 2288 . 1 1 212 212 GLN C C 13 176.590 0.1 . 1 . . . . 324 GLN C . 11012 1 2289 . 1 1 212 212 GLN CA C 13 55.918 0.1 . 1 . . . . 324 GLN CA . 11012 1 2290 . 1 1 212 212 GLN CB C 13 28.879 0.1 . 1 . . . . 324 GLN CB . 11012 1 2291 . 1 1 212 212 GLN CG C 13 33.422 0.1 . 1 . . . . 324 GLN CG . 11012 1 2292 . 1 1 212 212 GLN N N 15 120.570 0.1 . 1 . . . . 324 GLN N . 11012 1 2293 . 1 1 213 213 VAL H H 1 8.159 0.03 . 1 . . . . 325 VAL H . 11012 1 2294 . 1 1 213 213 VAL HA H 1 4.205 0.03 . 1 . . . . 325 VAL HA . 11012 1 2295 . 1 1 213 213 VAL HB H 1 2.176 0.03 . 1 . . . . 325 VAL HB . 11012 1 2296 . 1 1 213 213 VAL HG11 H 1 1.006 0.03 . 2 . . . . 325 VAL HG1 . 11012 1 2297 . 1 1 213 213 VAL HG12 H 1 1.006 0.03 . 2 . . . . 325 VAL HG1 . 11012 1 2298 . 1 1 213 213 VAL HG13 H 1 1.006 0.03 . 2 . . . . 325 VAL HG1 . 11012 1 2299 . 1 1 213 213 VAL HG21 H 1 1.015 0.03 . 2 . . . . 325 VAL HG2 . 11012 1 2300 . 1 1 213 213 VAL HG22 H 1 1.015 0.03 . 2 . . . . 325 VAL HG2 . 11012 1 2301 . 1 1 213 213 VAL HG23 H 1 1.015 0.03 . 2 . . . . 325 VAL HG2 . 11012 1 2302 . 1 1 213 213 VAL C C 13 176.580 0.1 . 1 . . . . 325 VAL C . 11012 1 2303 . 1 1 213 213 VAL CA C 13 62.316 0.1 . 1 . . . . 325 VAL CA . 11012 1 2304 . 1 1 213 213 VAL CB C 13 32.327 0.1 . 1 . . . . 325 VAL CB . 11012 1 2305 . 1 1 213 213 VAL CG1 C 13 20.682 0.1 . 2 . . . . 325 VAL CG1 . 11012 1 2306 . 1 1 213 213 VAL CG2 C 13 20.268 0.1 . 2 . . . . 325 VAL CG2 . 11012 1 2307 . 1 1 213 213 VAL N N 15 120.526 0.1 . 1 . . . . 325 VAL N . 11012 1 2308 . 1 1 214 214 SER H H 1 8.365 0.03 . 1 . . . . 326 SER H . 11012 1 2309 . 1 1 214 214 SER HA H 1 4.497 0.03 . 1 . . . . 326 SER HA . 11012 1 2310 . 1 1 214 214 SER HB2 H 1 3.943 0.03 . 1 . . . . 326 SER HB2 . 11012 1 2311 . 1 1 214 214 SER HB3 H 1 3.943 0.03 . 1 . . . . 326 SER HB3 . 11012 1 2312 . 1 1 214 214 SER C C 13 174.597 0.1 . 1 . . . . 326 SER C . 11012 1 2313 . 1 1 214 214 SER CA C 13 58.215 0.1 . 1 . . . . 326 SER CA . 11012 1 2314 . 1 1 214 214 SER CB C 13 63.451 0.1 . 1 . . . . 326 SER CB . 11012 1 2315 . 1 1 214 214 SER N N 15 118.943 0.1 . 1 . . . . 326 SER N . 11012 1 2316 . 1 1 215 215 ASP H H 1 8.434 0.03 . 1 . . . . 327 ASP H . 11012 1 2317 . 1 1 215 215 ASP HA H 1 4.641 0.03 . 1 . . . . 327 ASP HA . 11012 1 2318 . 1 1 215 215 ASP HB2 H 1 2.737 0.03 . 2 . . . . 327 ASP HB2 . 11012 1 2319 . 1 1 215 215 ASP HB3 H 1 2.681 0.03 . 2 . . . . 327 ASP HB3 . 11012 1 2320 . 1 1 215 215 ASP C C 13 176.864 0.1 . 1 . . . . 327 ASP C . 11012 1 2321 . 1 1 215 215 ASP CA C 13 54.328 0.1 . 1 . . . . 327 ASP CA . 11012 1 2322 . 1 1 215 215 ASP CB C 13 40.800 0.1 . 1 . . . . 327 ASP CB . 11012 1 2323 . 1 1 215 215 ASP N N 15 122.592 0.1 . 1 . . . . 327 ASP N . 11012 1 2324 . 1 1 216 216 SER H H 1 8.402 0.03 . 1 . . . . 328 SER H . 11012 1 2325 . 1 1 216 216 SER HA H 1 4.500 0.03 . 1 . . . . 328 SER HA . 11012 1 2326 . 1 1 216 216 SER HB2 H 1 4.013 0.03 . 2 . . . . 328 SER HB2 . 11012 1 2327 . 1 1 216 216 SER HB3 H 1 3.937 0.03 . 2 . . . . 328 SER HB3 . 11012 1 2328 . 1 1 216 216 SER C C 13 175.445 0.1 . 1 . . . . 328 SER C . 11012 1 2329 . 1 1 216 216 SER CA C 13 58.837 0.1 . 1 . . . . 328 SER CA . 11012 1 2330 . 1 1 216 216 SER CB C 13 63.189 0.1 . 1 . . . . 328 SER CB . 11012 1 2331 . 1 1 216 216 SER N N 15 116.613 0.1 . 1 . . . . 328 SER N . 11012 1 2332 . 1 1 217 217 THR H H 1 8.252 0.03 . 1 . . . . 329 THR H . 11012 1 2333 . 1 1 217 217 THR HA H 1 4.371 0.03 . 1 . . . . 329 THR HA . 11012 1 2334 . 1 1 217 217 THR HB H 1 4.327 0.03 . 1 . . . . 329 THR HB . 11012 1 2335 . 1 1 217 217 THR HG21 H 1 1.278 0.03 . 1 . . . . 329 THR HG2 . 11012 1 2336 . 1 1 217 217 THR HG22 H 1 1.278 0.03 . 1 . . . . 329 THR HG2 . 11012 1 2337 . 1 1 217 217 THR HG23 H 1 1.278 0.03 . 1 . . . . 329 THR HG2 . 11012 1 2338 . 1 1 217 217 THR C C 13 175.164 0.1 . 1 . . . . 329 THR C . 11012 1 2339 . 1 1 217 217 THR CA C 13 62.414 0.1 . 1 . . . . 329 THR CA . 11012 1 2340 . 1 1 217 217 THR CB C 13 69.158 0.1 . 1 . . . . 329 THR CB . 11012 1 2341 . 1 1 217 217 THR CG2 C 13 21.302 0.1 . 1 . . . . 329 THR CG2 . 11012 1 2342 . 1 1 217 217 THR N N 15 115.424 0.1 . 1 . . . . 329 THR N . 11012 1 2343 . 1 1 218 218 LYS H H 1 8.153 0.03 . 1 . . . . 330 LYS H . 11012 1 2344 . 1 1 218 218 LYS HA H 1 4.369 0.03 . 1 . . . . 330 LYS HA . 11012 1 2345 . 1 1 218 218 LYS HB2 H 1 1.878 0.03 . 2 . . . . 330 LYS HB2 . 11012 1 2346 . 1 1 218 218 LYS HB3 H 1 1.808 0.03 . 2 . . . . 330 LYS HB3 . 11012 1 2347 . 1 1 218 218 LYS HG2 H 1 1.501 0.03 . 2 . . . . 330 LYS HG2 . 11012 1 2348 . 1 1 218 218 LYS HG3 H 1 1.422 0.03 . 2 . . . . 330 LYS HG3 . 11012 1 2349 . 1 1 218 218 LYS HD2 H 1 1.750 0.03 . 2 . . . . 330 LYS HD2 . 11012 1 2350 . 1 1 218 218 LYS HD3 H 1 1.674 0.03 . 2 . . . . 330 LYS HD3 . 11012 1 2351 . 1 1 218 218 LYS HE2 H 1 3.020 0.03 . 2 . . . . 330 LYS HE2 . 11012 1 2352 . 1 1 218 218 LYS HE3 H 1 3.049 0.03 . 2 . . . . 330 LYS HE3 . 11012 1 2353 . 1 1 218 218 LYS C C 13 176.533 0.1 . 1 . . . . 330 LYS C . 11012 1 2354 . 1 1 218 218 LYS CA C 13 56.203 0.1 . 1 . . . . 330 LYS CA . 11012 1 2355 . 1 1 218 218 LYS CB C 13 32.327 0.1 . 1 . . . . 330 LYS CB . 11012 1 2356 . 1 1 218 218 LYS CG C 13 24.369 0.1 . 1 . . . . 330 LYS CG . 11012 1 2357 . 1 1 218 218 LYS CD C 13 28.598 0.1 . 1 . . . . 330 LYS CD . 11012 1 2358 . 1 1 218 218 LYS CE C 13 41.776 0.1 . 1 . . . . 330 LYS CE . 11012 1 2359 . 1 1 218 218 LYS N N 15 122.713 0.1 . 1 . . . . 330 LYS N . 11012 1 2360 . 1 1 219 219 ASN H H 1 8.342 0.03 . 1 . . . . 331 ASN H . 11012 1 2361 . 1 1 219 219 ASN HA H 1 4.784 0.03 . 1 . . . . 331 ASN HA . 11012 1 2362 . 1 1 219 219 ASN HB2 H 1 2.874 0.03 . 2 . . . . 331 ASN HB2 . 11012 1 2363 . 1 1 219 219 ASN HB3 H 1 2.825 0.03 . 2 . . . . 331 ASN HB3 . 11012 1 2364 . 1 1 219 219 ASN HD21 H 1 7.642 0.03 . 1 . . . . 331 ASN HD21 . 11012 1 2365 . 1 1 219 219 ASN HD22 H 1 6.971 0.03 . 1 . . . . 331 ASN HD22 . 11012 1 2366 . 1 1 219 219 ASN C C 13 175.911 0.1 . 1 . . . . 331 ASN C . 11012 1 2367 . 1 1 219 219 ASN CA C 13 52.991 0.1 . 1 . . . . 331 ASN CA . 11012 1 2368 . 1 1 219 219 ASN CB C 13 38.487 0.1 . 1 . . . . 331 ASN CB . 11012 1 2369 . 1 1 219 219 ASN N N 15 117.701 0.1 . 1 . . . . 331 ASN N . 11012 1 2370 . 1 1 219 219 ASN ND2 N 15 112.584 0.1 . 1 . . . . 331 ASN ND2 . 11012 1 2371 . 1 1 220 220 GLY H H 1 8.371 0.03 . 1 . . . . 332 GLY H . 11012 1 2372 . 1 1 220 220 GLY HA2 H 1 4.022 0.03 . 1 . . . . 332 GLY HA2 . 11012 1 2373 . 1 1 220 220 GLY HA3 H 1 4.022 0.03 . 1 . . . . 332 GLY HA3 . 11012 1 2374 . 1 1 220 220 GLY C C 13 174.339 0.1 . 1 . . . . 332 GLY C . 11012 1 2375 . 1 1 220 220 GLY CA C 13 45.271 0.1 . 1 . . . . 332 GLY CA . 11012 1 2376 . 1 1 220 220 GLY N N 15 109.305 0.1 . 1 . . . . 332 GLY N . 11012 1 2377 . 1 1 221 221 ASP H H 1 8.276 0.03 . 1 . . . . 333 ASP H . 11012 1 2378 . 1 1 221 221 ASP HA H 1 4.615 0.03 . 1 . . . . 333 ASP HA . 11012 1 2379 . 1 1 221 221 ASP HB2 H 1 2.712 0.03 . 1 . . . . 333 ASP HB2 . 11012 1 2380 . 1 1 221 221 ASP HB3 H 1 2.712 0.03 . 1 . . . . 333 ASP HB3 . 11012 1 2381 . 1 1 221 221 ASP C C 13 176.660 0.1 . 1 . . . . 333 ASP C . 11012 1 2382 . 1 1 221 221 ASP CA C 13 54.407 0.1 . 1 . . . . 333 ASP CA . 11012 1 2383 . 1 1 221 221 ASP CB C 13 40.903 0.1 . 1 . . . . 333 ASP CB . 11012 1 2384 . 1 1 221 221 ASP N N 15 120.650 0.1 . 1 . . . . 333 ASP N . 11012 1 2385 . 1 1 222 222 ALA H H 1 8.220 0.03 . 1 . . . . 334 ALA H . 11012 1 2386 . 1 1 222 222 ALA HA H 1 4.229 0.03 . 1 . . . . 334 ALA HA . 11012 1 2387 . 1 1 222 222 ALA HB1 H 1 1.311 0.03 . 1 . . . . 334 ALA HB . 11012 1 2388 . 1 1 222 222 ALA HB2 H 1 1.311 0.03 . 1 . . . . 334 ALA HB . 11012 1 2389 . 1 1 222 222 ALA HB3 H 1 1.311 0.03 . 1 . . . . 334 ALA HB . 11012 1 2390 . 1 1 222 222 ALA C C 13 177.991 0.1 . 1 . . . . 334 ALA C . 11012 1 2391 . 1 1 222 222 ALA CA C 13 52.817 0.1 . 1 . . . . 334 ALA CA . 11012 1 2392 . 1 1 222 222 ALA CB C 13 18.471 0.1 . 1 . . . . 334 ALA CB . 11012 1 2393 . 1 1 222 222 ALA N N 15 123.448 0.1 . 1 . . . . 334 ALA N . 11012 1 2394 . 1 1 223 223 PHE H H 1 8.116 0.03 . 1 . . . . 335 PHE H . 11012 1 2395 . 1 1 223 223 PHE HA H 1 4.638 0.03 . 1 . . . . 335 PHE HA . 11012 1 2396 . 1 1 223 223 PHE HB2 H 1 3.195 0.03 . 1 . . . . 335 PHE HB2 . 11012 1 2397 . 1 1 223 223 PHE HB3 H 1 3.062 0.03 . 1 . . . . 335 PHE HB3 . 11012 1 2398 . 1 1 223 223 PHE HD1 H 1 7.180 0.03 . 1 . . . . 335 PHE HD1 . 11012 1 2399 . 1 1 223 223 PHE HD2 H 1 7.180 0.03 . 1 . . . . 335 PHE HD2 . 11012 1 2400 . 1 1 223 223 PHE C C 13 176.001 0.1 . 1 . . . . 335 PHE C . 11012 1 2401 . 1 1 223 223 PHE CA C 13 57.547 0.1 . 1 . . . . 335 PHE CA . 11012 1 2402 . 1 1 223 223 PHE CB C 13 39.073 0.1 . 1 . . . . 335 PHE CB . 11012 1 2403 . 1 1 223 223 PHE N N 15 118.026 0.1 . 1 . . . . 335 PHE N . 11012 1 2404 . 1 1 224 224 ARG H H 1 7.974 0.03 . 1 . . . . 336 ARG H . 11012 1 2405 . 1 1 224 224 ARG HA H 1 4.312 0.03 . 1 . . . . 336 ARG HA . 11012 1 2406 . 1 1 224 224 ARG HB2 H 1 1.781 0.03 . 2 . . . . 336 ARG HB2 . 11012 1 2407 . 1 1 224 224 ARG HB3 H 1 1.860 0.03 . 2 . . . . 336 ARG HB3 . 11012 1 2408 . 1 1 224 224 ARG HG2 H 1 1.624 0.03 . 2 . . . . 336 ARG HG2 . 11012 1 2409 . 1 1 224 224 ARG HG3 H 1 1.594 0.03 . 2 . . . . 336 ARG HG3 . 11012 1 2410 . 1 1 224 224 ARG HD2 H 1 3.242 0.03 . 1 . . . . 336 ARG HD2 . 11012 1 2411 . 1 1 224 224 ARG HD3 H 1 3.242 0.03 . 1 . . . . 336 ARG HD3 . 11012 1 2412 . 1 1 224 224 ARG C C 13 176.108 0.1 . 1 . . . . 336 ARG C . 11012 1 2413 . 1 1 224 224 ARG CA C 13 55.804 0.1 . 1 . . . . 336 ARG CA . 11012 1 2414 . 1 1 224 224 ARG CB C 13 30.374 0.1 . 1 . . . . 336 ARG CB . 11012 1 2415 . 1 1 224 224 ARG CG C 13 26.827 0.1 . 1 . . . . 336 ARG CG . 11012 1 2416 . 1 1 224 224 ARG CD C 13 42.969 0.1 . 1 . . . . 336 ARG CD . 11012 1 2417 . 1 1 224 224 ARG N N 15 121.824 0.1 . 1 . . . . 336 ARG N . 11012 1 2418 . 1 1 225 225 GLN H H 1 8.319 0.03 . 1 . . . . 337 GLN H . 11012 1 2419 . 1 1 225 225 GLN HA H 1 4.324 0.03 . 1 . . . . 337 GLN HA . 11012 1 2420 . 1 1 225 225 GLN HB2 H 1 2.169 0.03 . 2 . . . . 337 GLN HB2 . 11012 1 2421 . 1 1 225 225 GLN HB3 H 1 2.084 0.03 . 2 . . . . 337 GLN HB3 . 11012 1 2422 . 1 1 225 225 GLN HG2 H 1 2.493 0.03 . 2 . . . . 337 GLN HG2 . 11012 1 2423 . 1 1 225 225 GLN HG3 H 1 2.412 0.03 . 2 . . . . 337 GLN HG3 . 11012 1 2424 . 1 1 225 225 GLN C C 13 175.899 0.1 . 1 . . . . 337 GLN C . 11012 1 2425 . 1 1 225 225 GLN CA C 13 55.697 0.1 . 1 . . . . 337 GLN CA . 11012 1 2426 . 1 1 225 225 GLN CB C 13 28.993 0.1 . 1 . . . . 337 GLN CB . 11012 1 2427 . 1 1 225 225 GLN CG C 13 33.296 0.1 . 1 . . . . 337 GLN CG . 11012 1 2428 . 1 1 225 225 GLN N N 15 120.651 0.1 . 1 . . . . 337 GLN N . 11012 1 2429 . 1 1 226 226 ASN H H 1 8.509 0.03 . 1 . . . . 338 ASN H . 11012 1 2430 . 1 1 226 226 ASN HA H 1 4.810 0.03 . 1 . . . . 338 ASN HA . 11012 1 2431 . 1 1 226 226 ASN HB2 H 1 2.901 0.03 . 2 . . . . 338 ASN HB2 . 11012 1 2432 . 1 1 226 226 ASN HB3 H 1 2.830 0.03 . 2 . . . . 338 ASN HB3 . 11012 1 2433 . 1 1 226 226 ASN C C 13 175.639 0.1 . 1 . . . . 338 ASN C . 11012 1 2434 . 1 1 226 226 ASN CA C 13 52.979 0.1 . 1 . . . . 338 ASN CA . 11012 1 2435 . 1 1 226 226 ASN CB C 13 38.306 0.1 . 1 . . . . 338 ASN CB . 11012 1 2436 . 1 1 226 226 ASN N N 15 119.680 0.1 . 1 . . . . 338 ASN N . 11012 1 2437 . 1 1 227 227 THR H H 1 8.145 0.03 . 1 . . . . 339 THR H . 11012 1 2438 . 1 1 227 227 THR HA H 1 4.321 0.03 . 1 . . . . 339 THR HA . 11012 1 2439 . 1 1 227 227 THR HB H 1 4.186 0.03 . 1 . . . . 339 THR HB . 11012 1 2440 . 1 1 227 227 THR HG21 H 1 1.163 0.03 . 1 . . . . 339 THR HG2 . 11012 1 2441 . 1 1 227 227 THR HG22 H 1 1.163 0.03 . 1 . . . . 339 THR HG2 . 11012 1 2442 . 1 1 227 227 THR HG23 H 1 1.163 0.03 . 1 . . . . 339 THR HG2 . 11012 1 2443 . 1 1 227 227 THR C C 13 174.524 0.1 . 1 . . . . 339 THR C . 11012 1 2444 . 1 1 227 227 THR CA C 13 61.755 0.1 . 1 . . . . 339 THR CA . 11012 1 2445 . 1 1 227 227 THR CB C 13 69.262 0.1 . 1 . . . . 339 THR CB . 11012 1 2446 . 1 1 227 227 THR CG2 C 13 21.223 0.1 . 1 . . . . 339 THR CG2 . 11012 1 2447 . 1 1 227 227 THR N N 15 113.843 0.1 . 1 . . . . 339 THR N . 11012 1 2448 . 1 1 228 228 HIS H H 1 8.147 0.03 . 1 . . . . 340 HIS H . 11012 1 2449 . 1 1 228 228 HIS HA H 1 4.429 0.03 . 1 . . . . 340 HIS HA . 11012 1 2450 . 1 1 228 228 HIS C C 13 175.529 0.1 . 1 . . . . 340 HIS C . 11012 1 2451 . 1 1 228 228 HIS CA C 13 55.932 0.1 . 1 . . . . 340 HIS CA . 11012 1 2452 . 1 1 228 228 HIS CB C 13 32.610 0.1 . 1 . . . . 340 HIS CB . 11012 1 2453 . 1 1 228 228 HIS N N 15 123.494 0.1 . 1 . . . . 340 HIS N . 11012 1 2454 . 1 1 229 229 GLY H H 1 8.338 0.03 . 1 . . . . 341 GLY H . 11012 1 2455 . 1 1 229 229 GLY HA2 H 1 3.986 0.03 . 1 . . . . 341 GLY HA2 . 11012 1 2456 . 1 1 229 229 GLY HA3 H 1 3.986 0.03 . 1 . . . . 341 GLY HA3 . 11012 1 2457 . 1 1 229 229 GLY C C 13 174.015 0.1 . 1 . . . . 341 GLY C . 11012 1 2458 . 1 1 229 229 GLY CA C 13 44.932 0.1 . 1 . . . . 341 GLY CA . 11012 1 2459 . 1 1 229 229 GLY N N 15 109.728 0.1 . 1 . . . . 341 GLY N . 11012 1 2460 . 1 1 230 230 ILE H H 1 8.023 0.03 . 1 . . . . 342 ILE H . 11012 1 2461 . 1 1 230 230 ILE HA H 1 4.224 0.03 . 1 . . . . 342 ILE HA . 11012 1 2462 . 1 1 230 230 ILE HB H 1 1.901 0.03 . 1 . . . . 342 ILE HB . 11012 1 2463 . 1 1 230 230 ILE HG12 H 1 1.489 0.03 . 2 . . . . 342 ILE HG12 . 11012 1 2464 . 1 1 230 230 ILE HG13 H 1 1.211 0.03 . 2 . . . . 342 ILE HG13 . 11012 1 2465 . 1 1 230 230 ILE HG21 H 1 0.954 0.03 . 1 . . . . 342 ILE HG2 . 11012 1 2466 . 1 1 230 230 ILE HG22 H 1 0.954 0.03 . 1 . . . . 342 ILE HG2 . 11012 1 2467 . 1 1 230 230 ILE HG23 H 1 0.954 0.03 . 1 . . . . 342 ILE HG2 . 11012 1 2468 . 1 1 230 230 ILE HD11 H 1 0.908 0.03 . 1 . . . . 342 ILE HD1 . 11012 1 2469 . 1 1 230 230 ILE HD12 H 1 0.908 0.03 . 1 . . . . 342 ILE HD1 . 11012 1 2470 . 1 1 230 230 ILE HD13 H 1 0.908 0.03 . 1 . . . . 342 ILE HD1 . 11012 1 2471 . 1 1 230 230 ILE C C 13 176.222 0.1 . 1 . . . . 342 ILE C . 11012 1 2472 . 1 1 230 230 ILE CA C 13 60.685 0.1 . 1 . . . . 342 ILE CA . 11012 1 2473 . 1 1 230 230 ILE CB C 13 38.438 0.1 . 1 . . . . 342 ILE CB . 11012 1 2474 . 1 1 230 230 ILE CG1 C 13 26.883 0.1 . 1 . . . . 342 ILE CG1 . 11012 1 2475 . 1 1 230 230 ILE CG2 C 13 17.186 0.1 . 1 . . . . 342 ILE CG2 . 11012 1 2476 . 1 1 230 230 ILE CD1 C 13 12.558 0.1 . 1 . . . . 342 ILE CD1 . 11012 1 2477 . 1 1 230 230 ILE N N 15 119.985 0.1 . 1 . . . . 342 ILE N . 11012 1 2478 . 1 1 231 231 GLN H H 1 8.532 0.03 . 1 . . . . 343 GLN H . 11012 1 2479 . 1 1 231 231 GLN HA H 1 4.422 0.03 . 1 . . . . 343 GLN HA . 11012 1 2480 . 1 1 231 231 GLN HB2 H 1 2.144 0.03 . 2 . . . . 343 GLN HB2 . 11012 1 2481 . 1 1 231 231 GLN HB3 H 1 2.040 0.03 . 2 . . . . 343 GLN HB3 . 11012 1 2482 . 1 1 231 231 GLN HG2 H 1 2.410 0.03 . 1 . . . . 343 GLN HG2 . 11012 1 2483 . 1 1 231 231 GLN HG3 H 1 2.410 0.03 . 1 . . . . 343 GLN HG3 . 11012 1 2484 . 1 1 231 231 GLN C C 13 175.738 0.1 . 1 . . . . 343 GLN C . 11012 1 2485 . 1 1 231 231 GLN CA C 13 55.281 0.1 . 1 . . . . 343 GLN CA . 11012 1 2486 . 1 1 231 231 GLN CB C 13 29.095 0.1 . 1 . . . . 343 GLN CB . 11012 1 2487 . 1 1 231 231 GLN CG C 13 33.422 0.1 . 1 . . . . 343 GLN CG . 11012 1 2488 . 1 1 231 231 GLN N N 15 124.671 0.1 . 1 . . . . 343 GLN N . 11012 1 2489 . 1 1 232 232 MET H H 1 8.542 0.03 . 1 . . . . 344 MET H . 11012 1 2490 . 1 1 232 232 MET HA H 1 4.616 0.03 . 1 . . . . 344 MET HA . 11012 1 2491 . 1 1 232 232 MET HB2 H 1 2.198 0.03 . 2 . . . . 344 MET HB2 . 11012 1 2492 . 1 1 232 232 MET HB3 H 1 2.054 0.03 . 2 . . . . 344 MET HB3 . 11012 1 2493 . 1 1 232 232 MET HG2 H 1 2.670 0.03 . 2 . . . . 344 MET HG2 . 11012 1 2494 . 1 1 232 232 MET HG3 H 1 2.588 0.03 . 2 . . . . 344 MET HG3 . 11012 1 2495 . 1 1 232 232 MET C C 13 175.660 0.1 . 1 . . . . 344 MET C . 11012 1 2496 . 1 1 232 232 MET CA C 13 55.181 0.1 . 1 . . . . 344 MET CA . 11012 1 2497 . 1 1 232 232 MET CB C 13 32.707 0.1 . 1 . . . . 344 MET CB . 11012 1 2498 . 1 1 232 232 MET CG C 13 31.674 0.1 . 1 . . . . 344 MET CG . 11012 1 2499 . 1 1 232 232 MET N N 15 123.233 0.1 . 1 . . . . 344 MET N . 11012 1 2500 . 1 1 233 233 THR H H 1 7.825 0.03 . 1 . . . . 345 THR H . 11012 1 2501 . 1 1 233 233 THR HA H 1 4.205 0.03 . 1 . . . . 345 THR HA . 11012 1 2502 . 1 1 233 233 THR HB H 1 4.293 0.03 . 1 . . . . 345 THR HB . 11012 1 2503 . 1 1 233 233 THR HG21 H 1 1.207 0.03 . 1 . . . . 345 THR HG2 . 11012 1 2504 . 1 1 233 233 THR HG22 H 1 1.207 0.03 . 1 . . . . 345 THR HG2 . 11012 1 2505 . 1 1 233 233 THR HG23 H 1 1.207 0.03 . 1 . . . . 345 THR HG2 . 11012 1 2506 . 1 1 233 233 THR C C 13 179.205 0.1 . 1 . . . . 345 THR C . 11012 1 2507 . 1 1 233 233 THR CA C 13 62.782 0.1 . 1 . . . . 345 THR CA . 11012 1 2508 . 1 1 233 233 THR CB C 13 70.377 0.1 . 1 . . . . 345 THR CB . 11012 1 2509 . 1 1 233 233 THR CG2 C 13 21.634 0.1 . 1 . . . . 345 THR CG2 . 11012 1 2510 . 1 1 233 233 THR N N 15 120.308 0.1 . 1 . . . . 345 THR N . 11012 1 stop_ save_