data_6873 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6873 _Entry.Title ; 1H, 15N and 13C chemical shift assignments of pleckstrin's C-terminal PH domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-10-25 _Entry.Accession_date 2005-10-25 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details 'C-terminal PH domain of human pleckstrin-1' _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 Christian Edlich . . . 6873 2 Bernd Simon . . . 6873 3 Gunter Stier . . . 6873 4 Michael Sattler . . . 6873 5 Claudia Muhle-Goll . . . 6873 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . EMBL . 6873 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6873 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 401 6873 '15N chemical shifts' 120 6873 '1H chemical shifts' 790 6873 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2007-02-08 2005-10-25 update BMRB 'complete entry citation' 6873 1 . . 2006-05-02 2005-10-25 original author 'original release' 6873 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6873 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16642402 _Citation.Full_citation . _Citation.Title ; New NMR Assignment 1H, 13C, and 15N Assignment of the Second PH Domain of Human Pleckstrin (234-350) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _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 21 _Citation.Page_last 21 _Citation.Year 2006 _Citation.Details 'assignment note' loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Christian Edlich . . . 6873 1 2 Bernd Simon . . . 6873 1 3 Michael Sattler . . . 6873 1 4 Claudia Muhle-Goll . . . 6873 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'PH domain' 6873 1 pleckstrin 6873 1 stop_ save_ save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 6873 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 1569857 _Citation.Full_citation 'Structure (Camb). 2005 Feb;13(2):277-86.' _Citation.Title ; Structure and phosphatidylinositol-(3,4)-bisphosphate binding of the C-terminal PH domain of human pleckstrin. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 13 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 277 _Citation.Page_last 286 _Citation.Year 2005 _Citation.Details 'structure and pip binding' loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Christian Edlich . . . 6873 2 2 Gunter Stier . . . 6873 2 3 Bernd Simon . . . 6873 2 4 Michael Sattler . . . 6873 2 5 Claudia Muhle-Goll . . . 6873 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'PH domain' 6873 2 'phophatidylinositol phosphate' 6873 2 pleckstrin 6873 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6873 _Assembly.ID 1 _Assembly.Name 'C-PH domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 13455.3 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6873 1 stop_ 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 'pleckstrin C-PH' 1 $C-PH . . yes native no no . . . 6873 1 stop_ loop_ _Assembly_systematic_name.Name _Assembly_systematic_name.Naming_system _Assembly_systematic_name.Entry_ID _Assembly_systematic_name.Assembly_ID Pleckstrin . 6873 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'lipid headgroup binding (pip's)' 6873 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_C-PH _Entity.Sf_category entity _Entity.Sf_framecode C-PH _Entity.Entry_ID 6873 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name C-PH _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MHHHHHHKPMMEPKRIREGY LVKKGSVFNTWKPMWVVLLE DGIEFYKKKSDNSPKGMIPL KGSTLTSPCQDFGKRMFVFK ITTTKQQDHFFQAAFLEERD AWVRDINKAIKCIEGGQKFA RKSTRRSIRLPETIDLGALY LSMKDTEKGIKELNLEKDKK IFNHCFTGNCVIDWLVSNQS VRNRQEGLMIASSLLNEGYL QPAGDMSKSAVDGTAENPFL DNPDAFYYFPDSGFFCEENS SDDDVILKEEFRGVIIKQGC LLKQGHRRKNWKVRKFILRE DPAYLHYYDPAGAEDPLGAI HLRGCVVTSVESNSNGRKSE EENLFEIITADEVHYFLQAA TPKERTEWIKAIQMASRTGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; assignment starting from residue 234 to 350. ; _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 360 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13455.3 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; N-terminal His6 tag MHHHHHHKPM ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 DBJ BAG36495 . "unnamed protein product [Homo sapiens]" . . . . . 97.22 350 99.43 99.71 0.00e+00 . . . . 6873 1 2 no DBJ BAI47103 . "pleckstrin [synthetic construct]" . . . . . 97.22 350 99.43 99.71 0.00e+00 . . . . 6873 1 3 no EMBL CAA30564 . "unnamed protein product [Homo sapiens]" . . . . . 97.22 350 100.00 100.00 0.00e+00 . . . . 6873 1 4 no EMBL CAG46853 . "PLEK [Homo sapiens]" . . . . . 97.22 350 99.71 99.71 0.00e+00 . . . . 6873 1 5 no EMBL CAG46876 . "PLEK [Homo sapiens]" . . . . . 97.22 350 99.43 99.43 0.00e+00 . . . . 6873 1 6 no GB AAH18549 . "Pleckstrin [Homo sapiens]" . . . . . 97.22 350 99.71 99.71 0.00e+00 . . . . 6873 1 7 no GB AAP36299 . "Homo sapiens pleckstrin [synthetic construct]" . . . . . 97.22 351 99.71 99.71 0.00e+00 . . . . 6873 1 8 no GB AAX37008 . "pleckstrin [synthetic construct]" . . . . . 97.22 351 99.71 99.71 0.00e+00 . . . . 6873 1 9 no GB AAX43402 . "pleckstrin [synthetic construct]" . . . . . 97.22 351 99.71 99.71 0.00e+00 . . . . 6873 1 10 no GB AAX93121 . "unknown [Homo sapiens]" . . . . . 97.22 350 99.43 99.71 0.00e+00 . . . . 6873 1 11 no PRF 1408254A . "protein kinase C substrate protein P47" . . . . . 97.22 350 99.71 99.71 0.00e+00 . . . . 6873 1 12 no REF NP_002655 . "pleckstrin [Homo sapiens]" . . . . . 97.22 350 99.43 99.71 0.00e+00 . . . . 6873 1 13 no REF XP_001094492 . "PREDICTED: pleckstrin [Macaca mulatta]" . . . . . 97.22 350 98.86 99.71 0.00e+00 . . . . 6873 1 14 no REF XP_002811995 . "PREDICTED: pleckstrin [Pongo abelii]" . . . . . 97.22 350 98.86 99.14 0.00e+00 . . . . 6873 1 15 no REF XP_003262529 . "PREDICTED: pleckstrin [Nomascus leucogenys]" . . . . . 97.22 350 98.57 99.71 0.00e+00 . . . . 6873 1 16 no REF XP_003830964 . "PREDICTED: pleckstrin [Pan paniscus]" . . . . . 97.22 350 99.14 99.71 0.00e+00 . . . . 6873 1 17 no SP P08567 . "RecName: Full=Pleckstrin; AltName: Full=Platelet 47 kDa protein; Short=p47 [Homo sapiens]" . . . . . 97.22 350 99.43 99.71 0.00e+00 . . . . 6873 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 11 MET . 6873 1 2 12 HIS . 6873 1 3 13 HIS . 6873 1 4 14 HIS . 6873 1 5 15 HIS . 6873 1 6 16 HIS . 6873 1 7 17 HIS . 6873 1 8 18 LYS . 6873 1 9 19 PRO . 6873 1 10 20 MET . 6873 1 11 21 MET . 6873 1 12 22 GLU . 6873 1 13 23 PRO . 6873 1 14 24 LYS . 6873 1 15 25 ARG . 6873 1 16 26 ILE . 6873 1 17 27 ARG . 6873 1 18 28 GLU . 6873 1 19 29 GLY . 6873 1 20 30 TYR . 6873 1 21 31 LEU . 6873 1 22 32 VAL . 6873 1 23 33 LYS . 6873 1 24 34 LYS . 6873 1 25 35 GLY . 6873 1 26 36 SER . 6873 1 27 37 VAL . 6873 1 28 38 PHE . 6873 1 29 39 ASN . 6873 1 30 40 THR . 6873 1 31 41 TRP . 6873 1 32 42 LYS . 6873 1 33 43 PRO . 6873 1 34 44 MET . 6873 1 35 45 TRP . 6873 1 36 46 VAL . 6873 1 37 47 VAL . 6873 1 38 48 LEU . 6873 1 39 49 LEU . 6873 1 40 50 GLU . 6873 1 41 51 ASP . 6873 1 42 52 GLY . 6873 1 43 53 ILE . 6873 1 44 54 GLU . 6873 1 45 55 PHE . 6873 1 46 56 TYR . 6873 1 47 57 LYS . 6873 1 48 58 LYS . 6873 1 49 59 LYS . 6873 1 50 60 SER . 6873 1 51 61 ASP . 6873 1 52 62 ASN . 6873 1 53 63 SER . 6873 1 54 64 PRO . 6873 1 55 65 LYS . 6873 1 56 66 GLY . 6873 1 57 67 MET . 6873 1 58 68 ILE . 6873 1 59 69 PRO . 6873 1 60 70 LEU . 6873 1 61 71 LYS . 6873 1 62 72 GLY . 6873 1 63 73 SER . 6873 1 64 74 THR . 6873 1 65 75 LEU . 6873 1 66 76 THR . 6873 1 67 77 SER . 6873 1 68 78 PRO . 6873 1 69 79 CYS . 6873 1 70 80 GLN . 6873 1 71 81 ASP . 6873 1 72 82 PHE . 6873 1 73 83 GLY . 6873 1 74 84 LYS . 6873 1 75 85 ARG . 6873 1 76 86 MET . 6873 1 77 87 PHE . 6873 1 78 88 VAL . 6873 1 79 89 PHE . 6873 1 80 90 LYS . 6873 1 81 91 ILE . 6873 1 82 92 THR . 6873 1 83 93 THR . 6873 1 84 94 THR . 6873 1 85 95 LYS . 6873 1 86 96 GLN . 6873 1 87 97 GLN . 6873 1 88 98 ASP . 6873 1 89 99 HIS . 6873 1 90 100 PHE . 6873 1 91 101 PHE . 6873 1 92 102 GLN . 6873 1 93 103 ALA . 6873 1 94 104 ALA . 6873 1 95 105 PHE . 6873 1 96 106 LEU . 6873 1 97 107 GLU . 6873 1 98 108 GLU . 6873 1 99 109 ARG . 6873 1 100 110 ASP . 6873 1 101 111 ALA . 6873 1 102 112 TRP . 6873 1 103 113 VAL . 6873 1 104 114 ARG . 6873 1 105 115 ASP . 6873 1 106 116 ILE . 6873 1 107 117 ASN . 6873 1 108 118 LYS . 6873 1 109 119 ALA . 6873 1 110 120 ILE . 6873 1 111 121 LYS . 6873 1 112 122 CYS . 6873 1 113 123 ILE . 6873 1 114 124 GLU . 6873 1 115 125 GLY . 6873 1 116 126 GLY . 6873 1 117 127 GLN . 6873 1 118 128 LYS . 6873 1 119 129 PHE . 6873 1 120 130 ALA . 6873 1 121 131 ARG . 6873 1 122 132 LYS . 6873 1 123 133 SER . 6873 1 124 134 THR . 6873 1 125 135 ARG . 6873 1 126 136 ARG . 6873 1 127 137 SER . 6873 1 128 138 ILE . 6873 1 129 139 ARG . 6873 1 130 140 LEU . 6873 1 131 141 PRO . 6873 1 132 142 GLU . 6873 1 133 143 THR . 6873 1 134 144 ILE . 6873 1 135 145 ASP . 6873 1 136 146 LEU . 6873 1 137 147 GLY . 6873 1 138 148 ALA . 6873 1 139 149 LEU . 6873 1 140 150 TYR . 6873 1 141 151 LEU . 6873 1 142 152 SER . 6873 1 143 153 MET . 6873 1 144 154 LYS . 6873 1 145 155 ASP . 6873 1 146 156 THR . 6873 1 147 157 GLU . 6873 1 148 158 LYS . 6873 1 149 159 GLY . 6873 1 150 160 ILE . 6873 1 151 161 LYS . 6873 1 152 162 GLU . 6873 1 153 163 LEU . 6873 1 154 164 ASN . 6873 1 155 165 LEU . 6873 1 156 166 GLU . 6873 1 157 167 LYS . 6873 1 158 168 ASP . 6873 1 159 169 LYS . 6873 1 160 170 LYS . 6873 1 161 171 ILE . 6873 1 162 172 PHE . 6873 1 163 173 ASN . 6873 1 164 174 HIS . 6873 1 165 175 CYS . 6873 1 166 176 PHE . 6873 1 167 177 THR . 6873 1 168 178 GLY . 6873 1 169 179 ASN . 6873 1 170 180 CYS . 6873 1 171 181 VAL . 6873 1 172 182 ILE . 6873 1 173 183 ASP . 6873 1 174 184 TRP . 6873 1 175 185 LEU . 6873 1 176 186 VAL . 6873 1 177 187 SER . 6873 1 178 188 ASN . 6873 1 179 189 GLN . 6873 1 180 190 SER . 6873 1 181 191 VAL . 6873 1 182 192 ARG . 6873 1 183 193 ASN . 6873 1 184 194 ARG . 6873 1 185 195 GLN . 6873 1 186 196 GLU . 6873 1 187 197 GLY . 6873 1 188 198 LEU . 6873 1 189 199 MET . 6873 1 190 200 ILE . 6873 1 191 201 ALA . 6873 1 192 202 SER . 6873 1 193 203 SER . 6873 1 194 204 LEU . 6873 1 195 205 LEU . 6873 1 196 206 ASN . 6873 1 197 207 GLU . 6873 1 198 208 GLY . 6873 1 199 209 TYR . 6873 1 200 210 LEU . 6873 1 201 211 GLN . 6873 1 202 212 PRO . 6873 1 203 213 ALA . 6873 1 204 214 GLY . 6873 1 205 215 ASP . 6873 1 206 216 MET . 6873 1 207 217 SER . 6873 1 208 218 LYS . 6873 1 209 219 SER . 6873 1 210 220 ALA . 6873 1 211 221 VAL . 6873 1 212 222 ASP . 6873 1 213 223 GLY . 6873 1 214 224 THR . 6873 1 215 225 ALA . 6873 1 216 226 GLU . 6873 1 217 227 ASN . 6873 1 218 228 PRO . 6873 1 219 229 PHE . 6873 1 220 230 LEU . 6873 1 221 231 ASP . 6873 1 222 232 ASN . 6873 1 223 233 PRO . 6873 1 224 234 ASP . 6873 1 225 235 ALA . 6873 1 226 236 PHE . 6873 1 227 237 TYR . 6873 1 228 238 TYR . 6873 1 229 239 PHE . 6873 1 230 240 PRO . 6873 1 231 241 ASP . 6873 1 232 242 SER . 6873 1 233 243 GLY . 6873 1 234 244 PHE . 6873 1 235 245 PHE . 6873 1 236 246 CYS . 6873 1 237 247 GLU . 6873 1 238 248 GLU . 6873 1 239 249 ASN . 6873 1 240 250 SER . 6873 1 241 251 SER . 6873 1 242 252 ASP . 6873 1 243 253 ASP . 6873 1 244 254 ASP . 6873 1 245 255 VAL . 6873 1 246 256 ILE . 6873 1 247 257 LEU . 6873 1 248 258 LYS . 6873 1 249 259 GLU . 6873 1 250 260 GLU . 6873 1 251 261 PHE . 6873 1 252 262 ARG . 6873 1 253 263 GLY . 6873 1 254 264 VAL . 6873 1 255 265 ILE . 6873 1 256 266 ILE . 6873 1 257 267 LYS . 6873 1 258 268 GLN . 6873 1 259 269 GLY . 6873 1 260 270 CYS . 6873 1 261 271 LEU . 6873 1 262 272 LEU . 6873 1 263 273 LYS . 6873 1 264 274 GLN . 6873 1 265 275 GLY . 6873 1 266 276 HIS . 6873 1 267 277 ARG . 6873 1 268 278 ARG . 6873 1 269 279 LYS . 6873 1 270 280 ASN . 6873 1 271 281 TRP . 6873 1 272 282 LYS . 6873 1 273 283 VAL . 6873 1 274 284 ARG . 6873 1 275 285 LYS . 6873 1 276 286 PHE . 6873 1 277 287 ILE . 6873 1 278 288 LEU . 6873 1 279 289 ARG . 6873 1 280 290 GLU . 6873 1 281 291 ASP . 6873 1 282 292 PRO . 6873 1 283 293 ALA . 6873 1 284 294 TYR . 6873 1 285 295 LEU . 6873 1 286 296 HIS . 6873 1 287 297 TYR . 6873 1 288 298 TYR . 6873 1 289 299 ASP . 6873 1 290 300 PRO . 6873 1 291 301 ALA . 6873 1 292 302 GLY . 6873 1 293 303 ALA . 6873 1 294 304 GLU . 6873 1 295 305 ASP . 6873 1 296 306 PRO . 6873 1 297 307 LEU . 6873 1 298 308 GLY . 6873 1 299 309 ALA . 6873 1 300 310 ILE . 6873 1 301 311 HIS . 6873 1 302 312 LEU . 6873 1 303 313 ARG . 6873 1 304 314 GLY . 6873 1 305 315 CYS . 6873 1 306 316 VAL . 6873 1 307 317 VAL . 6873 1 308 318 THR . 6873 1 309 319 SER . 6873 1 310 320 VAL . 6873 1 311 321 GLU . 6873 1 312 322 SER . 6873 1 313 323 ASN . 6873 1 314 324 SER . 6873 1 315 325 ASN . 6873 1 316 326 GLY . 6873 1 317 327 ARG . 6873 1 318 328 LYS . 6873 1 319 329 SER . 6873 1 320 330 GLU . 6873 1 321 331 GLU . 6873 1 322 332 GLU . 6873 1 323 333 ASN . 6873 1 324 334 LEU . 6873 1 325 335 PHE . 6873 1 326 336 GLU . 6873 1 327 337 ILE . 6873 1 328 338 ILE . 6873 1 329 339 THR . 6873 1 330 340 ALA . 6873 1 331 341 ASP . 6873 1 332 342 GLU . 6873 1 333 343 VAL . 6873 1 334 344 HIS . 6873 1 335 345 TYR . 6873 1 336 346 PHE . 6873 1 337 347 LEU . 6873 1 338 348 GLN . 6873 1 339 349 ALA . 6873 1 340 350 ALA . 6873 1 341 351 THR . 6873 1 342 352 PRO . 6873 1 343 353 LYS . 6873 1 344 354 GLU . 6873 1 345 355 ARG . 6873 1 346 356 THR . 6873 1 347 357 GLU . 6873 1 348 358 TRP . 6873 1 349 359 ILE . 6873 1 350 360 LYS . 6873 1 351 361 ALA . 6873 1 352 362 ILE . 6873 1 353 363 GLN . 6873 1 354 364 MET . 6873 1 355 365 ALA . 6873 1 356 366 SER . 6873 1 357 367 ARG . 6873 1 358 368 THR . 6873 1 359 369 GLY . 6873 1 360 370 LYS . 6873 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6873 1 . HIS 2 2 6873 1 . HIS 3 3 6873 1 . HIS 4 4 6873 1 . HIS 5 5 6873 1 . HIS 6 6 6873 1 . HIS 7 7 6873 1 . LYS 8 8 6873 1 . PRO 9 9 6873 1 . MET 10 10 6873 1 . MET 11 11 6873 1 . GLU 12 12 6873 1 . PRO 13 13 6873 1 . LYS 14 14 6873 1 . ARG 15 15 6873 1 . ILE 16 16 6873 1 . ARG 17 17 6873 1 . GLU 18 18 6873 1 . GLY 19 19 6873 1 . TYR 20 20 6873 1 . LEU 21 21 6873 1 . VAL 22 22 6873 1 . LYS 23 23 6873 1 . LYS 24 24 6873 1 . GLY 25 25 6873 1 . SER 26 26 6873 1 . VAL 27 27 6873 1 . PHE 28 28 6873 1 . ASN 29 29 6873 1 . THR 30 30 6873 1 . TRP 31 31 6873 1 . LYS 32 32 6873 1 . PRO 33 33 6873 1 . MET 34 34 6873 1 . TRP 35 35 6873 1 . VAL 36 36 6873 1 . VAL 37 37 6873 1 . LEU 38 38 6873 1 . LEU 39 39 6873 1 . GLU 40 40 6873 1 . ASP 41 41 6873 1 . GLY 42 42 6873 1 . ILE 43 43 6873 1 . GLU 44 44 6873 1 . PHE 45 45 6873 1 . TYR 46 46 6873 1 . LYS 47 47 6873 1 . LYS 48 48 6873 1 . LYS 49 49 6873 1 . SER 50 50 6873 1 . ASP 51 51 6873 1 . ASN 52 52 6873 1 . SER 53 53 6873 1 . PRO 54 54 6873 1 . LYS 55 55 6873 1 . GLY 56 56 6873 1 . MET 57 57 6873 1 . ILE 58 58 6873 1 . PRO 59 59 6873 1 . LEU 60 60 6873 1 . LYS 61 61 6873 1 . GLY 62 62 6873 1 . SER 63 63 6873 1 . THR 64 64 6873 1 . LEU 65 65 6873 1 . THR 66 66 6873 1 . SER 67 67 6873 1 . PRO 68 68 6873 1 . CYS 69 69 6873 1 . GLN 70 70 6873 1 . ASP 71 71 6873 1 . PHE 72 72 6873 1 . GLY 73 73 6873 1 . LYS 74 74 6873 1 . ARG 75 75 6873 1 . MET 76 76 6873 1 . PHE 77 77 6873 1 . VAL 78 78 6873 1 . PHE 79 79 6873 1 . LYS 80 80 6873 1 . ILE 81 81 6873 1 . THR 82 82 6873 1 . THR 83 83 6873 1 . THR 84 84 6873 1 . LYS 85 85 6873 1 . GLN 86 86 6873 1 . GLN 87 87 6873 1 . ASP 88 88 6873 1 . HIS 89 89 6873 1 . PHE 90 90 6873 1 . PHE 91 91 6873 1 . GLN 92 92 6873 1 . ALA 93 93 6873 1 . ALA 94 94 6873 1 . PHE 95 95 6873 1 . LEU 96 96 6873 1 . GLU 97 97 6873 1 . GLU 98 98 6873 1 . ARG 99 99 6873 1 . ASP 100 100 6873 1 . ALA 101 101 6873 1 . TRP 102 102 6873 1 . VAL 103 103 6873 1 . ARG 104 104 6873 1 . ASP 105 105 6873 1 . ILE 106 106 6873 1 . ASN 107 107 6873 1 . LYS 108 108 6873 1 . ALA 109 109 6873 1 . ILE 110 110 6873 1 . LYS 111 111 6873 1 . CYS 112 112 6873 1 . ILE 113 113 6873 1 . GLU 114 114 6873 1 . GLY 115 115 6873 1 . GLY 116 116 6873 1 . GLN 117 117 6873 1 . LYS 118 118 6873 1 . PHE 119 119 6873 1 . ALA 120 120 6873 1 . ARG 121 121 6873 1 . LYS 122 122 6873 1 . SER 123 123 6873 1 . THR 124 124 6873 1 . ARG 125 125 6873 1 . ARG 126 126 6873 1 . SER 127 127 6873 1 . ILE 128 128 6873 1 . ARG 129 129 6873 1 . LEU 130 130 6873 1 . PRO 131 131 6873 1 . GLU 132 132 6873 1 . THR 133 133 6873 1 . ILE 134 134 6873 1 . ASP 135 135 6873 1 . LEU 136 136 6873 1 . GLY 137 137 6873 1 . ALA 138 138 6873 1 . LEU 139 139 6873 1 . TYR 140 140 6873 1 . LEU 141 141 6873 1 . SER 142 142 6873 1 . MET 143 143 6873 1 . LYS 144 144 6873 1 . ASP 145 145 6873 1 . THR 146 146 6873 1 . GLU 147 147 6873 1 . LYS 148 148 6873 1 . GLY 149 149 6873 1 . ILE 150 150 6873 1 . LYS 151 151 6873 1 . GLU 152 152 6873 1 . LEU 153 153 6873 1 . ASN 154 154 6873 1 . LEU 155 155 6873 1 . GLU 156 156 6873 1 . LYS 157 157 6873 1 . ASP 158 158 6873 1 . LYS 159 159 6873 1 . LYS 160 160 6873 1 . ILE 161 161 6873 1 . PHE 162 162 6873 1 . ASN 163 163 6873 1 . HIS 164 164 6873 1 . CYS 165 165 6873 1 . PHE 166 166 6873 1 . THR 167 167 6873 1 . GLY 168 168 6873 1 . ASN 169 169 6873 1 . CYS 170 170 6873 1 . VAL 171 171 6873 1 . ILE 172 172 6873 1 . ASP 173 173 6873 1 . TRP 174 174 6873 1 . LEU 175 175 6873 1 . VAL 176 176 6873 1 . SER 177 177 6873 1 . ASN 178 178 6873 1 . GLN 179 179 6873 1 . SER 180 180 6873 1 . VAL 181 181 6873 1 . ARG 182 182 6873 1 . ASN 183 183 6873 1 . ARG 184 184 6873 1 . GLN 185 185 6873 1 . GLU 186 186 6873 1 . GLY 187 187 6873 1 . LEU 188 188 6873 1 . MET 189 189 6873 1 . ILE 190 190 6873 1 . ALA 191 191 6873 1 . SER 192 192 6873 1 . SER 193 193 6873 1 . LEU 194 194 6873 1 . LEU 195 195 6873 1 . ASN 196 196 6873 1 . GLU 197 197 6873 1 . GLY 198 198 6873 1 . TYR 199 199 6873 1 . LEU 200 200 6873 1 . GLN 201 201 6873 1 . PRO 202 202 6873 1 . ALA 203 203 6873 1 . GLY 204 204 6873 1 . ASP 205 205 6873 1 . MET 206 206 6873 1 . SER 207 207 6873 1 . LYS 208 208 6873 1 . SER 209 209 6873 1 . ALA 210 210 6873 1 . VAL 211 211 6873 1 . ASP 212 212 6873 1 . GLY 213 213 6873 1 . THR 214 214 6873 1 . ALA 215 215 6873 1 . GLU 216 216 6873 1 . ASN 217 217 6873 1 . PRO 218 218 6873 1 . PHE 219 219 6873 1 . LEU 220 220 6873 1 . ASP 221 221 6873 1 . ASN 222 222 6873 1 . PRO 223 223 6873 1 . ASP 224 224 6873 1 . ALA 225 225 6873 1 . PHE 226 226 6873 1 . TYR 227 227 6873 1 . TYR 228 228 6873 1 . PHE 229 229 6873 1 . PRO 230 230 6873 1 . ASP 231 231 6873 1 . SER 232 232 6873 1 . GLY 233 233 6873 1 . PHE 234 234 6873 1 . PHE 235 235 6873 1 . CYS 236 236 6873 1 . GLU 237 237 6873 1 . GLU 238 238 6873 1 . ASN 239 239 6873 1 . SER 240 240 6873 1 . SER 241 241 6873 1 . ASP 242 242 6873 1 . ASP 243 243 6873 1 . ASP 244 244 6873 1 . VAL 245 245 6873 1 . ILE 246 246 6873 1 . LEU 247 247 6873 1 . LYS 248 248 6873 1 . GLU 249 249 6873 1 . GLU 250 250 6873 1 . PHE 251 251 6873 1 . ARG 252 252 6873 1 . GLY 253 253 6873 1 . VAL 254 254 6873 1 . ILE 255 255 6873 1 . ILE 256 256 6873 1 . LYS 257 257 6873 1 . GLN 258 258 6873 1 . GLY 259 259 6873 1 . CYS 260 260 6873 1 . LEU 261 261 6873 1 . LEU 262 262 6873 1 . LYS 263 263 6873 1 . GLN 264 264 6873 1 . GLY 265 265 6873 1 . HIS 266 266 6873 1 . ARG 267 267 6873 1 . ARG 268 268 6873 1 . LYS 269 269 6873 1 . ASN 270 270 6873 1 . TRP 271 271 6873 1 . LYS 272 272 6873 1 . VAL 273 273 6873 1 . ARG 274 274 6873 1 . LYS 275 275 6873 1 . PHE 276 276 6873 1 . ILE 277 277 6873 1 . LEU 278 278 6873 1 . ARG 279 279 6873 1 . GLU 280 280 6873 1 . ASP 281 281 6873 1 . PRO 282 282 6873 1 . ALA 283 283 6873 1 . TYR 284 284 6873 1 . LEU 285 285 6873 1 . HIS 286 286 6873 1 . TYR 287 287 6873 1 . TYR 288 288 6873 1 . ASP 289 289 6873 1 . PRO 290 290 6873 1 . ALA 291 291 6873 1 . GLY 292 292 6873 1 . ALA 293 293 6873 1 . GLU 294 294 6873 1 . ASP 295 295 6873 1 . PRO 296 296 6873 1 . LEU 297 297 6873 1 . GLY 298 298 6873 1 . ALA 299 299 6873 1 . ILE 300 300 6873 1 . HIS 301 301 6873 1 . LEU 302 302 6873 1 . ARG 303 303 6873 1 . GLY 304 304 6873 1 . CYS 305 305 6873 1 . VAL 306 306 6873 1 . VAL 307 307 6873 1 . THR 308 308 6873 1 . SER 309 309 6873 1 . VAL 310 310 6873 1 . GLU 311 311 6873 1 . SER 312 312 6873 1 . ASN 313 313 6873 1 . SER 314 314 6873 1 . ASN 315 315 6873 1 . GLY 316 316 6873 1 . ARG 317 317 6873 1 . LYS 318 318 6873 1 . SER 319 319 6873 1 . GLU 320 320 6873 1 . GLU 321 321 6873 1 . GLU 322 322 6873 1 . ASN 323 323 6873 1 . LEU 324 324 6873 1 . PHE 325 325 6873 1 . GLU 326 326 6873 1 . ILE 327 327 6873 1 . ILE 328 328 6873 1 . THR 329 329 6873 1 . ALA 330 330 6873 1 . ASP 331 331 6873 1 . GLU 332 332 6873 1 . VAL 333 333 6873 1 . HIS 334 334 6873 1 . TYR 335 335 6873 1 . PHE 336 336 6873 1 . LEU 337 337 6873 1 . GLN 338 338 6873 1 . ALA 339 339 6873 1 . ALA 340 340 6873 1 . THR 341 341 6873 1 . PRO 342 342 6873 1 . LYS 343 343 6873 1 . GLU 344 344 6873 1 . ARG 345 345 6873 1 . THR 346 346 6873 1 . GLU 347 347 6873 1 . TRP 348 348 6873 1 . ILE 349 349 6873 1 . LYS 350 350 6873 1 . ALA 351 351 6873 1 . ILE 352 352 6873 1 . GLN 353 353 6873 1 . MET 354 354 6873 1 . ALA 355 355 6873 1 . SER 356 356 6873 1 . ARG 357 357 6873 1 . THR 358 358 6873 1 . GLY 359 359 6873 1 . LYS 360 360 6873 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6873 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $C-PH . 9606 organism no 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 6873 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 6873 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $C-PH . 'recombinant technology' . 'E. coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 6873 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6873 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pleckstrin '[U-2H; U-13C; U-15N]' . . 1 $C-PH . . 0.4 . . mM . . . . 6873 1 2 'sodium phosphate buffer' . . . . . . . 20 . . mM . . . . 6873 1 3 NaCl . . . . . . . 100 . . mM . . . . 6873 1 4 DTT . . . . . . . 2 . . mM . . . . 6873 1 5 'sodium azide' . . . . . . . 0.02 . . % . . . . 6873 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6873 _Sample_condition_list.ID 1 _Sample_condition_list.Details '20mM sodium phosphate buffer pH 6.8, 100mM NaCl, 2mM DTT, 0.02% sodium azide.' 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 5 mM 6873 1 pH 6.8 0.1 pH 6873 1 temperature 295 0.1 K 6873 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrview _Software.Sf_category software _Software.Sf_framecode nmrview _Software.Entry_ID 6873 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 6873 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 6873 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6873 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '1H15N HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 2 '1H13C HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 3 'Triple-resonance experiments' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 4 'HCCH tocsy' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 5 13C-HMQC-NOESY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 6 15N-HSQC-NOESY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6873 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6873 _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 0.0 external indirect 0.251449530 . . . . . . . . . 6873 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6873 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.101329118 . . . . . . . . . 6873 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6873 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 'almost complete 1H,13C,15N chemical shifts' _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 '1H15N HSQC' 1 $sample_1 isotropic 6873 1 2 '1H13C HSQC' 1 $sample_1 isotropic 6873 1 3 'Triple-resonance experiments' 1 $sample_1 isotropic 6873 1 4 'HCCH tocsy' 1 $sample_1 isotropic 6873 1 5 13C-HMQC-NOESY 1 $sample_1 isotropic 6873 1 6 15N-HSQC-NOESY 1 $sample_1 isotropic 6873 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 $nmrview . . 6873 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 1 244 244 ASP H H 1 8.220 0.02 . 1 . . . . 234 ASP HN . 6873 1 2 . 1 1 244 244 ASP HA H 1 4.470 0.02 . 1 . . . . 234 ASP HA . 6873 1 3 . 1 1 244 244 ASP HB2 H 1 2.560 0.02 . 2 . . . . 234 ASP HB1 . 6873 1 4 . 1 1 244 244 ASP HB3 H 1 2.560 0.02 . 2 . . . . 234 ASP HB2 . 6873 1 5 . 1 1 244 244 ASP CA C 13 55.100 0.2 . 1 . . . . 234 ASP CA . 6873 1 6 . 1 1 244 244 ASP CB C 13 41.300 0.2 . 1 . . . . 234 ASP CB . 6873 1 7 . 1 1 244 244 ASP N N 15 120.970 0.1 . 1 . . . . 234 ASP N . 6873 1 8 . 1 1 245 245 VAL H H 1 7.820 0.02 . 1 . . . . 235 VAL HN . 6873 1 9 . 1 1 245 245 VAL HA H 1 3.948 0.02 . 1 . . . . 235 VAL HA . 6873 1 10 . 1 1 245 245 VAL HB H 1 1.945 0.02 . 1 . . . . 235 VAL HB . 6873 1 11 . 1 1 245 245 VAL HG11 H 1 0.789 0.02 . 1 . . . . 235 VAL HG1 . 6873 1 12 . 1 1 245 245 VAL HG12 H 1 0.789 0.02 . 1 . . . . 235 VAL HG1 . 6873 1 13 . 1 1 245 245 VAL HG13 H 1 0.789 0.02 . 1 . . . . 235 VAL HG1 . 6873 1 14 . 1 1 245 245 VAL CA C 13 62.848 0.2 . 1 . . . . 235 VAL CA . 6873 1 15 . 1 1 245 245 VAL CB C 13 33.128 0.2 . 1 . . . . 235 VAL CB . 6873 1 16 . 1 1 245 245 VAL CG1 C 13 21.254 0.2 . 2 . . . . 235 VAL CG1 . 6873 1 17 . 1 1 245 245 VAL N N 15 119.672 0.1 . 1 . . . . 235 VAL N . 6873 1 18 . 1 1 246 246 ILE H H 1 8.053 0.02 . 1 . . . . 236 ILE HN . 6873 1 19 . 1 1 246 246 ILE HA H 1 3.989 0.02 . 1 . . . . 236 ILE HA . 6873 1 20 . 1 1 246 246 ILE HB H 1 1.732 0.02 . 1 . . . . 236 ILE HB . 6873 1 21 . 1 1 246 246 ILE HG12 H 1 1.358 0.02 . 9 . . . . 236 ILE HG11 . 6873 1 22 . 1 1 246 246 ILE HG13 H 1 1.068 0.02 . 9 . . . . 236 ILE HG12 . 6873 1 23 . 1 1 246 246 ILE HG21 H 1 0.751 0.02 . 1 . . . . 236 ILE HG2 . 6873 1 24 . 1 1 246 246 ILE HG22 H 1 0.751 0.02 . 1 . . . . 236 ILE HG2 . 6873 1 25 . 1 1 246 246 ILE HG23 H 1 0.751 0.02 . 1 . . . . 236 ILE HG2 . 6873 1 26 . 1 1 246 246 ILE HD11 H 1 0.718 0.02 . 1 . . . . 236 ILE HD1 . 6873 1 27 . 1 1 246 246 ILE HD12 H 1 0.718 0.02 . 1 . . . . 236 ILE HD1 . 6873 1 28 . 1 1 246 246 ILE HD13 H 1 0.718 0.02 . 1 . . . . 236 ILE HD1 . 6873 1 29 . 1 1 246 246 ILE CA C 13 61.313 0.2 . 1 . . . . 236 ILE CA . 6873 1 30 . 1 1 246 246 ILE CB C 13 38.624 0.2 . 1 . . . . 236 ILE CB . 6873 1 31 . 1 1 246 246 ILE CG1 C 13 27.737 0.2 . 1 . . . . 236 ILE CG1 . 6873 1 32 . 1 1 246 246 ILE CG2 C 13 17.789 0.2 . 1 . . . . 236 ILE CG2 . 6873 1 33 . 1 1 246 246 ILE CD1 C 13 12.964 0.2 . 1 . . . . 236 ILE CD1 . 6873 1 34 . 1 1 246 246 ILE N N 15 124.400 0.1 . 1 . . . . 236 ILE N . 6873 1 35 . 1 1 247 247 LEU H H 1 8.200 0.02 . 1 . . . . 237 LEU HN . 6873 1 36 . 1 1 247 247 LEU HA H 1 4.266 0.02 . 1 . . . . 237 LEU HA . 6873 1 37 . 1 1 247 247 LEU HB2 H 1 1.465 0.02 . 2 . . . . 237 LEU HB1 . 6873 1 38 . 1 1 247 247 LEU HB3 H 1 1.436 0.02 . 2 . . . . 237 LEU HB2 . 6873 1 39 . 1 1 247 247 LEU HG H 1 1.498 0.02 . 1 . . . . 237 LEU HG . 6873 1 40 . 1 1 247 247 LEU HD11 H 1 0.705 0.02 . 1 . . . . 237 LEU HD1 . 6873 1 41 . 1 1 247 247 LEU HD12 H 1 0.705 0.02 . 1 . . . . 237 LEU HD1 . 6873 1 42 . 1 1 247 247 LEU HD13 H 1 0.705 0.02 . 1 . . . . 237 LEU HD1 . 6873 1 43 . 1 1 247 247 LEU HD21 H 1 0.780 0.02 . 1 . . . . 237 LEU HD2 . 6873 1 44 . 1 1 247 247 LEU HD22 H 1 0.780 0.02 . 1 . . . . 237 LEU HD2 . 6873 1 45 . 1 1 247 247 LEU HD23 H 1 0.780 0.02 . 1 . . . . 237 LEU HD2 . 6873 1 46 . 1 1 247 247 LEU CA C 13 55.129 0.2 . 1 . . . . 237 LEU CA . 6873 1 47 . 1 1 247 247 LEU CB C 13 43.188 0.2 . 1 . . . . 237 LEU CB . 6873 1 48 . 1 1 247 247 LEU CG C 13 27.333 0.2 . 1 . . . . 237 LEU CG . 6873 1 49 . 1 1 247 247 LEU CD1 C 13 24.050 0.2 . 2 . . . . 237 LEU CD1 . 6873 1 50 . 1 1 247 247 LEU CD2 C 13 25.310 0.2 . 2 . . . . 237 LEU CD2 . 6873 1 51 . 1 1 247 247 LEU N N 15 126.600 0.1 . 1 . . . . 237 LEU N . 6873 1 52 . 1 1 248 248 LYS H H 1 8.290 0.02 . 1 . . . . 238 LYS HN . 6873 1 53 . 1 1 248 248 LYS HA H 1 4.130 0.02 . 1 . . . . 238 LYS HA . 6873 1 54 . 1 1 248 248 LYS HB2 H 1 1.892 0.02 . 2 . . . . 238 LYS HB1 . 6873 1 55 . 1 1 248 248 LYS HB3 H 1 1.683 0.02 . 2 . . . . 238 LYS HB2 . 6873 1 56 . 1 1 248 248 LYS HG2 H 1 1.374 0.02 . 2 . . . . 238 LYS HG1 . 6873 1 57 . 1 1 248 248 LYS HG3 H 1 1.502 0.02 . 2 . . . . 238 LYS HG2 . 6873 1 58 . 1 1 248 248 LYS HD2 H 1 1.595 0.02 . 2 . . . . 238 LYS HD1 . 6873 1 59 . 1 1 248 248 LYS HE2 H 1 2.896 0.02 . 2 . . . . 238 LYS HE1 . 6873 1 60 . 1 1 248 248 LYS CA C 13 57.369 0.2 . 1 . . . . 238 LYS CA . 6873 1 61 . 1 1 248 248 LYS CB C 13 33.500 0.2 . 1 . . . . 238 LYS CB . 6873 1 62 . 1 1 248 248 LYS CG C 13 25.700 0.2 . 1 . . . . 238 LYS CG . 6873 1 63 . 1 1 248 248 LYS CD C 13 29.550 0.2 . 1 . . . . 238 LYS CD . 6873 1 64 . 1 1 248 248 LYS N N 15 122.800 0.1 . 1 . . . . 238 LYS N . 6873 1 65 . 1 1 249 249 GLU H H 1 8.500 0.02 . 1 . . . . 239 GLU HN . 6873 1 66 . 1 1 249 249 GLU HA H 1 3.683 0.02 . 1 . . . . 239 GLU HA . 6873 1 67 . 1 1 249 249 GLU HB2 H 1 1.900 0.02 . 2 . . . . 239 GLU HB1 . 6873 1 68 . 1 1 249 249 GLU HB3 H 1 1.830 0.02 . 2 . . . . 239 GLU HB2 . 6873 1 69 . 1 1 249 249 GLU HG2 H 1 2.161 0.02 . 2 . . . . 239 GLU HG1 . 6873 1 70 . 1 1 249 249 GLU CA C 13 59.850 0.2 . 1 . . . . 239 GLU CA . 6873 1 71 . 1 1 249 249 GLU CB C 13 30.025 0.2 . 1 . . . . 239 GLU CB . 6873 1 72 . 1 1 249 249 GLU CG C 13 36.400 0.2 . 1 . . . . 239 GLU CG . 6873 1 73 . 1 1 249 249 GLU N N 15 122.700 0.1 . 1 . . . . 239 GLU N . 6873 1 74 . 1 1 250 250 GLU H H 1 7.981 0.02 . 1 . . . . 240 GLU HN . 6873 1 75 . 1 1 250 250 GLU HA H 1 3.250 0.02 . 1 . . . . 240 GLU HA . 6873 1 76 . 1 1 250 250 GLU HB2 H 1 0.885 0.02 . 2 . . . . 240 GLU HB1 . 6873 1 77 . 1 1 250 250 GLU HB3 H 1 0.638 0.02 . 2 . . . . 240 GLU HB2 . 6873 1 78 . 1 1 250 250 GLU HG2 H 1 1.097 0.02 . 2 . . . . 240 GLU HG1 . 6873 1 79 . 1 1 250 250 GLU HG3 H 1 0.420 0.02 . 2 . . . . 240 GLU HG2 . 6873 1 80 . 1 1 250 250 GLU CA C 13 57.960 0.2 . 1 . . . . 240 GLU CA . 6873 1 81 . 1 1 250 250 GLU CB C 13 28.800 0.2 . 1 . . . . 240 GLU CB . 6873 1 82 . 1 1 250 250 GLU CG C 13 35.400 0.2 . 1 . . . . 240 GLU CG . 6873 1 83 . 1 1 250 250 GLU N N 15 113.500 0.1 . 1 . . . . 240 GLU N . 6873 1 84 . 1 1 251 251 PHE H H 1 7.412 0.02 . 1 . . . . 241 PHE HN . 6873 1 85 . 1 1 251 251 PHE HA H 1 4.569 0.02 . 1 . . . . 241 PHE HA . 6873 1 86 . 1 1 251 251 PHE HB2 H 1 3.324 0.02 . 2 . . . . 241 PHE HB1 . 6873 1 87 . 1 1 251 251 PHE HB3 H 1 2.497 0.02 . 2 . . . . 241 PHE HB2 . 6873 1 88 . 1 1 251 251 PHE HD1 H 1 6.816 0.02 . 3 . . . . 241 PHE HD1 . 6873 1 89 . 1 1 251 251 PHE HE1 H 1 6.476 0.02 . 3 . . . . 241 PHE HE1 . 6873 1 90 . 1 1 251 251 PHE HZ H 1 6.715 0.02 . 1 . . . . 241 PHE HZ . 6873 1 91 . 1 1 251 251 PHE CA C 13 56.540 0.2 . 1 . . . . 241 PHE CA . 6873 1 92 . 1 1 251 251 PHE CB C 13 39.959 0.2 . 1 . . . . 241 PHE CB . 6873 1 93 . 1 1 251 251 PHE CD1 C 13 131.182 0.2 . 3 . . . . 241 PHE CD1 . 6873 1 94 . 1 1 251 251 PHE CE1 C 13 130.782 0.2 . 3 . . . . 241 PHE CE1 . 6873 1 95 . 1 1 251 251 PHE CZ C 13 129.319 0.2 . 1 . . . . 241 PHE CZ . 6873 1 96 . 1 1 251 251 PHE N N 15 115.818 0.1 . 1 . . . . 241 PHE N . 6873 1 97 . 1 1 252 252 ARG H H 1 7.680 0.02 . 1 . . . . 242 ARG HN . 6873 1 98 . 1 1 252 252 ARG HA H 1 4.090 0.02 . 1 . . . . 242 ARG HA . 6873 1 99 . 1 1 252 252 ARG HB2 H 1 1.878 0.02 . 2 . . . . 242 ARG HB1 . 6873 1 100 . 1 1 252 252 ARG HB3 H 1 1.770 0.02 . 2 . . . . 242 ARG HB2 . 6873 1 101 . 1 1 252 252 ARG HG2 H 1 1.606 0.02 . 2 . . . . 242 ARG HG1 . 6873 1 102 . 1 1 252 252 ARG HG3 H 1 1.736 0.02 . 2 . . . . 242 ARG HG2 . 6873 1 103 . 1 1 252 252 ARG HD2 H 1 3.100 0.02 . 2 . . . . 242 ARG HD1 . 6873 1 104 . 1 1 252 252 ARG HD3 H 1 3.140 0.02 . 2 . . . . 242 ARG HD2 . 6873 1 105 . 1 1 252 252 ARG CA C 13 58.400 0.2 . 1 . . . . 242 ARG CA . 6873 1 106 . 1 1 252 252 ARG CB C 13 31.450 0.2 . 1 . . . . 242 ARG CB . 6873 1 107 . 1 1 252 252 ARG CG C 13 28.368 0.2 . 1 . . . . 242 ARG CG . 6873 1 108 . 1 1 252 252 ARG CD C 13 44.000 0.2 . 1 . . . . 242 ARG CD . 6873 1 109 . 1 1 252 252 ARG N N 15 118.896 0.1 . 1 . . . . 242 ARG N . 6873 1 110 . 1 1 253 253 GLY H H 1 8.732 0.02 . 1 . . . . 243 GLY HN . 6873 1 111 . 1 1 253 253 GLY HA2 H 1 4.118 0.02 . 2 . . . . 243 GLY HA1 . 6873 1 112 . 1 1 253 253 GLY HA3 H 1 3.749 0.02 . 2 . . . . 243 GLY HA2 . 6873 1 113 . 1 1 253 253 GLY CA C 13 45.650 0.2 . 1 . . . . 243 GLY CA . 6873 1 114 . 1 1 253 253 GLY N N 15 109.137 0.1 . 1 . . . . 243 GLY N . 6873 1 115 . 1 1 254 254 VAL H H 1 8.280 0.02 . 1 . . . . 244 VAL HN . 6873 1 116 . 1 1 254 254 VAL HA H 1 3.985 0.02 . 1 . . . . 244 VAL HA . 6873 1 117 . 1 1 254 254 VAL HB H 1 1.945 0.02 . 1 . . . . 244 VAL HB . 6873 1 118 . 1 1 254 254 VAL HG11 H 1 0.993 0.02 . 1 . . . . 244 VAL HG1 . 6873 1 119 . 1 1 254 254 VAL HG12 H 1 0.993 0.02 . 1 . . . . 244 VAL HG1 . 6873 1 120 . 1 1 254 254 VAL HG13 H 1 0.993 0.02 . 1 . . . . 244 VAL HG1 . 6873 1 121 . 1 1 254 254 VAL HG21 H 1 0.864 0.02 . 1 . . . . 244 VAL HG2 . 6873 1 122 . 1 1 254 254 VAL HG22 H 1 0.864 0.02 . 1 . . . . 244 VAL HG2 . 6873 1 123 . 1 1 254 254 VAL HG23 H 1 0.864 0.02 . 1 . . . . 244 VAL HG2 . 6873 1 124 . 1 1 254 254 VAL CA C 13 62.393 0.2 . 1 . . . . 244 VAL CA . 6873 1 125 . 1 1 254 254 VAL CB C 13 33.600 0.2 . 1 . . . . 244 VAL CB . 6873 1 126 . 1 1 254 254 VAL CG1 C 13 21.856 0.2 . 2 . . . . 244 VAL CG1 . 6873 1 127 . 1 1 254 254 VAL CG2 C 13 21.508 0.2 . 2 . . . . 244 VAL CG2 . 6873 1 128 . 1 1 254 254 VAL N N 15 120.740 0.1 . 1 . . . . 244 VAL N . 6873 1 129 . 1 1 255 255 ILE H H 1 8.486 0.02 . 1 . . . . 245 ILE HN . 6873 1 130 . 1 1 255 255 ILE HA H 1 4.116 0.02 . 1 . . . . 245 ILE HA . 6873 1 131 . 1 1 255 255 ILE HB H 1 1.645 0.02 . 1 . . . . 245 ILE HB . 6873 1 132 . 1 1 255 255 ILE HG12 H 1 1.803 0.02 . 9 . . . . 245 ILE HG11 . 6873 1 133 . 1 1 255 255 ILE HG13 H 1 0.694 0.02 . 9 . . . . 245 ILE HG12 . 6873 1 134 . 1 1 255 255 ILE HG21 H 1 0.770 0.02 . 1 . . . . 245 ILE HG2 . 6873 1 135 . 1 1 255 255 ILE HG22 H 1 0.770 0.02 . 1 . . . . 245 ILE HG2 . 6873 1 136 . 1 1 255 255 ILE HG23 H 1 0.770 0.02 . 1 . . . . 245 ILE HG2 . 6873 1 137 . 1 1 255 255 ILE HD11 H 1 0.832 0.02 . 1 . . . . 245 ILE HD1 . 6873 1 138 . 1 1 255 255 ILE HD12 H 1 0.832 0.02 . 1 . . . . 245 ILE HD1 . 6873 1 139 . 1 1 255 255 ILE HD13 H 1 0.832 0.02 . 1 . . . . 245 ILE HD1 . 6873 1 140 . 1 1 255 255 ILE CA C 13 63.169 0.2 . 1 . . . . 245 ILE CA . 6873 1 141 . 1 1 255 255 ILE CB C 13 39.025 0.2 . 1 . . . . 245 ILE CB . 6873 1 142 . 1 1 255 255 ILE CG1 C 13 28.842 0.2 . 1 . . . . 245 ILE CG1 . 6873 1 143 . 1 1 255 255 ILE CG2 C 13 17.478 0.2 . 1 . . . . 245 ILE CG2 . 6873 1 144 . 1 1 255 255 ILE CD1 C 13 14.372 0.2 . 1 . . . . 245 ILE CD1 . 6873 1 145 . 1 1 255 255 ILE N N 15 125.080 0.1 . 1 . . . . 245 ILE N . 6873 1 146 . 1 1 256 256 ILE H H 1 9.054 0.02 . 1 . . . . 246 ILE HN . 6873 1 147 . 1 1 256 256 ILE HA H 1 4.380 0.02 . 1 . . . . 246 ILE HA . 6873 1 148 . 1 1 256 256 ILE HB H 1 1.721 0.02 . 1 . . . . 246 ILE HB . 6873 1 149 . 1 1 256 256 ILE HG12 H 1 1.081 0.02 . 9 . . . . 246 ILE HG11 . 6873 1 150 . 1 1 256 256 ILE HG21 H 1 0.805 0.02 . 1 . . . . 246 ILE HG2 . 6873 1 151 . 1 1 256 256 ILE HG22 H 1 0.805 0.02 . 1 . . . . 246 ILE HG2 . 6873 1 152 . 1 1 256 256 ILE HG23 H 1 0.805 0.02 . 1 . . . . 246 ILE HG2 . 6873 1 153 . 1 1 256 256 ILE HD11 H 1 0.695 0.02 . 1 . . . . 246 ILE HD1 . 6873 1 154 . 1 1 256 256 ILE HD12 H 1 0.695 0.02 . 1 . . . . 246 ILE HD1 . 6873 1 155 . 1 1 256 256 ILE HD13 H 1 0.695 0.02 . 1 . . . . 246 ILE HD1 . 6873 1 156 . 1 1 256 256 ILE CA C 13 60.791 0.2 . 1 . . . . 246 ILE CA . 6873 1 157 . 1 1 256 256 ILE CB C 13 40.020 0.2 . 1 . . . . 246 ILE CB . 6873 1 158 . 1 1 256 256 ILE CG1 C 13 27.085 0.2 . 1 . . . . 246 ILE CG1 . 6873 1 159 . 1 1 256 256 ILE CG2 C 13 18.534 0.2 . 1 . . . . 246 ILE CG2 . 6873 1 160 . 1 1 256 256 ILE CD1 C 13 12.970 0.2 . 1 . . . . 246 ILE CD1 . 6873 1 161 . 1 1 256 256 ILE N N 15 124.394 0.1 . 1 . . . . 246 ILE N . 6873 1 162 . 1 1 257 257 LYS H H 1 7.541 0.02 . 1 . . . . 247 LYS HN . 6873 1 163 . 1 1 257 257 LYS HA H 1 4.249 0.02 . 1 . . . . 247 LYS HA . 6873 1 164 . 1 1 257 257 LYS HB2 H 1 1.269 0.02 . 2 . . . . 247 LYS HB1 . 6873 1 165 . 1 1 257 257 LYS HB3 H 1 1.016 0.02 . 2 . . . . 247 LYS HB2 . 6873 1 166 . 1 1 257 257 LYS HG2 H 1 0.119 0.02 . 2 . . . . 247 LYS HG1 . 6873 1 167 . 1 1 257 257 LYS HG3 H 1 0.956 0.02 . 2 . . . . 247 LYS HG2 . 6873 1 168 . 1 1 257 257 LYS HD2 H 1 -0.434 0.02 . 2 . . . . 247 LYS HD1 . 6873 1 169 . 1 1 257 257 LYS HD3 H 1 0.672 0.02 . 2 . . . . 247 LYS HD2 . 6873 1 170 . 1 1 257 257 LYS HE2 H 1 1.485 0.02 . 2 . . . . 247 LYS HE1 . 6873 1 171 . 1 1 257 257 LYS HE3 H 1 1.058 0.02 . 2 . . . . 247 LYS HE2 . 6873 1 172 . 1 1 257 257 LYS CA C 13 57.523 0.2 . 1 . . . . 247 LYS CA . 6873 1 173 . 1 1 257 257 LYS CB C 13 36.650 0.2 . 1 . . . . 247 LYS CB . 6873 1 174 . 1 1 257 257 LYS CG C 13 25.760 0.2 . 1 . . . . 247 LYS CG . 6873 1 175 . 1 1 257 257 LYS CD C 13 29.300 0.2 . 1 . . . . 247 LYS CD . 6873 1 176 . 1 1 257 257 LYS CE C 13 40.200 0.2 . 1 . . . . 247 LYS CE . 6873 1 177 . 1 1 257 257 LYS N N 15 121.824 0.1 . 1 . . . . 247 LYS N . 6873 1 178 . 1 1 258 258 GLN H H 1 8.491 0.02 . 1 . . . . 248 GLN HN . 6873 1 179 . 1 1 258 258 GLN HA H 1 5.863 0.02 . 1 . . . . 248 GLN HA . 6873 1 180 . 1 1 258 258 GLN HB2 H 1 2.118 0.02 . 2 . . . . 248 GLN HB1 . 6873 1 181 . 1 1 258 258 GLN HG2 H 1 2.241 0.02 . 2 . . . . 248 GLN HG1 . 6873 1 182 . 1 1 258 258 GLN HE21 H 1 7.435 0.02 . 2 . . . . 248 GLN HE21 . 6873 1 183 . 1 1 258 258 GLN HE22 H 1 6.712 0.02 . 2 . . . . 248 GLN HE22 . 6873 1 184 . 1 1 258 258 GLN CA C 13 54.417 0.2 . 1 . . . . 248 GLN CA . 6873 1 185 . 1 1 258 258 GLN CB C 13 33.813 0.2 . 1 . . . . 248 GLN CB . 6873 1 186 . 1 1 258 258 GLN CG C 13 33.794 0.2 . 1 . . . . 248 GLN CG . 6873 1 187 . 1 1 258 258 GLN N N 15 121.567 0.1 . 1 . . . . 248 GLN N . 6873 1 188 . 1 1 258 258 GLN NE2 N 15 111.253 0.1 . 1 . . . . 248 GLN NE2 . 6873 1 189 . 1 1 259 259 GLY H H 1 9.105 0.02 . 1 . . . . 249 GLY HN . 6873 1 190 . 1 1 259 259 GLY HA2 H 1 4.360 0.02 . 2 . . . . 249 GLY HA1 . 6873 1 191 . 1 1 259 259 GLY HA3 H 1 4.851 0.02 . 2 . . . . 249 GLY HA2 . 6873 1 192 . 1 1 259 259 GLY CA C 13 45.887 0.2 . 1 . . . . 249 GLY CA . 6873 1 193 . 1 1 259 259 GLY N N 15 108.527 0.1 . 1 . . . . 249 GLY N . 6873 1 194 . 1 1 260 260 CYS H H 1 9.200 0.02 . 1 . . . . 250 CYS HN . 6873 1 195 . 1 1 260 260 CYS HA H 1 5.823 0.02 . 1 . . . . 250 CYS HA . 6873 1 196 . 1 1 260 260 CYS HB2 H 1 2.658 0.02 . 2 . . . . 250 CYS HB1 . 6873 1 197 . 1 1 260 260 CYS HB3 H 1 3.002 0.02 . 2 . . . . 250 CYS HB2 . 6873 1 198 . 1 1 260 260 CYS CA C 13 59.504 0.2 . 1 . . . . 250 CYS CA . 6873 1 199 . 1 1 260 260 CYS CB C 13 29.438 0.2 . 1 . . . . 250 CYS CB . 6873 1 200 . 1 1 260 260 CYS N N 15 118.516 0.1 . 1 . . . . 250 CYS N . 6873 1 201 . 1 1 261 261 LEU H H 1 9.073 0.02 . 1 . . . . 251 LEU HN . 6873 1 202 . 1 1 261 261 LEU HA H 1 4.551 0.02 . 1 . . . . 251 LEU HA . 6873 1 203 . 1 1 261 261 LEU HB2 H 1 0.813 0.02 . 2 . . . . 251 LEU HB1 . 6873 1 204 . 1 1 261 261 LEU HB3 H 1 1.192 0.02 . 2 . . . . 251 LEU HB2 . 6873 1 205 . 1 1 261 261 LEU HG H 1 0.789 0.02 . 1 . . . . 251 LEU HG . 6873 1 206 . 1 1 261 261 LEU HD11 H 1 -1.120 0.02 . 1 . . . . 251 LEU HD1 . 6873 1 207 . 1 1 261 261 LEU HD12 H 1 -1.120 0.02 . 1 . . . . 251 LEU HD1 . 6873 1 208 . 1 1 261 261 LEU HD13 H 1 -1.120 0.02 . 1 . . . . 251 LEU HD1 . 6873 1 209 . 1 1 261 261 LEU HD21 H 1 0.552 0.02 . 1 . . . . 251 LEU HD2 . 6873 1 210 . 1 1 261 261 LEU HD22 H 1 0.552 0.02 . 1 . . . . 251 LEU HD2 . 6873 1 211 . 1 1 261 261 LEU HD23 H 1 0.552 0.02 . 1 . . . . 251 LEU HD2 . 6873 1 212 . 1 1 261 261 LEU CA C 13 54.173 0.2 . 1 . . . . 251 LEU CA . 6873 1 213 . 1 1 261 261 LEU CB C 13 47.544 0.2 . 1 . . . . 251 LEU CB . 6873 1 214 . 1 1 261 261 LEU CG C 13 26.752 0.2 . 1 . . . . 251 LEU CG . 6873 1 215 . 1 1 261 261 LEU CD1 C 13 24.261 0.2 . 2 . . . . 251 LEU CD1 . 6873 1 216 . 1 1 261 261 LEU CD2 C 13 24.174 0.2 . 2 . . . . 251 LEU CD2 . 6873 1 217 . 1 1 261 261 LEU N N 15 122.884 0.1 . 1 . . . . 251 LEU N . 6873 1 218 . 1 1 262 262 LEU H H 1 7.870 0.02 . 1 . . . . 252 LEU HN . 6873 1 219 . 1 1 262 262 LEU HA H 1 4.965 0.02 . 1 . . . . 252 LEU HA . 6873 1 220 . 1 1 262 262 LEU HB2 H 1 1.495 0.02 . 2 . . . . 252 LEU HB1 . 6873 1 221 . 1 1 262 262 LEU HB3 H 1 1.700 0.02 . 2 . . . . 252 LEU HB2 . 6873 1 222 . 1 1 262 262 LEU HG H 1 1.549 0.02 . 1 . . . . 252 LEU HG . 6873 1 223 . 1 1 262 262 LEU HD11 H 1 0.654 0.02 . 1 . . . . 252 LEU HD1 . 6873 1 224 . 1 1 262 262 LEU HD12 H 1 0.654 0.02 . 1 . . . . 252 LEU HD1 . 6873 1 225 . 1 1 262 262 LEU HD13 H 1 0.654 0.02 . 1 . . . . 252 LEU HD1 . 6873 1 226 . 1 1 262 262 LEU HD21 H 1 0.565 0.02 . 1 . . . . 252 LEU HD2 . 6873 1 227 . 1 1 262 262 LEU HD22 H 1 0.565 0.02 . 1 . . . . 252 LEU HD2 . 6873 1 228 . 1 1 262 262 LEU HD23 H 1 0.565 0.02 . 1 . . . . 252 LEU HD2 . 6873 1 229 . 1 1 262 262 LEU CA C 13 55.120 0.2 . 1 . . . . 252 LEU CA . 6873 1 230 . 1 1 262 262 LEU CB C 13 44.466 0.2 . 1 . . . . 252 LEU CB . 6873 1 231 . 1 1 262 262 LEU CG C 13 28.092 0.2 . 1 . . . . 252 LEU CG . 6873 1 232 . 1 1 262 262 LEU CD1 C 13 25.289 0.2 . 2 . . . . 252 LEU CD1 . 6873 1 233 . 1 1 262 262 LEU CD2 C 13 25.512 0.2 . 2 . . . . 252 LEU CD2 . 6873 1 234 . 1 1 262 262 LEU N N 15 119.801 0.1 . 1 . . . . 252 LEU N . 6873 1 235 . 1 1 263 263 LYS H H 1 9.266 0.02 . 1 . . . . 253 LYS HN . 6873 1 236 . 1 1 263 263 LYS HA H 1 5.110 0.02 . 1 . . . . 253 LYS HA . 6873 1 237 . 1 1 263 263 LYS HB2 H 1 1.480 0.02 . 2 . . . . 253 LYS HB1 . 6873 1 238 . 1 1 263 263 LYS HB3 H 1 1.623 0.02 . 2 . . . . 253 LYS HB2 . 6873 1 239 . 1 1 263 263 LYS HG2 H 1 1.147 0.02 . 2 . . . . 253 LYS HG1 . 6873 1 240 . 1 1 263 263 LYS HG3 H 1 1.404 0.02 . 2 . . . . 253 LYS HG2 . 6873 1 241 . 1 1 263 263 LYS HD2 H 1 1.137 0.02 . 2 . . . . 253 LYS HD1 . 6873 1 242 . 1 1 263 263 LYS HD3 H 1 0.880 0.02 . 2 . . . . 253 LYS HD2 . 6873 1 243 . 1 1 263 263 LYS HE2 H 1 2.548 0.02 . 2 . . . . 253 LYS HE1 . 6873 1 244 . 1 1 263 263 LYS HE3 H 1 2.484 0.02 . 2 . . . . 253 LYS HE2 . 6873 1 245 . 1 1 263 263 LYS CA C 13 54.931 0.2 . 1 . . . . 253 LYS CA . 6873 1 246 . 1 1 263 263 LYS CB C 13 37.400 0.2 . 1 . . . . 253 LYS CB . 6873 1 247 . 1 1 263 263 LYS CG C 13 25.050 0.2 . 1 . . . . 253 LYS CG . 6873 1 248 . 1 1 263 263 LYS CD C 13 29.550 0.2 . 1 . . . . 253 LYS CD . 6873 1 249 . 1 1 263 263 LYS CE C 13 41.440 0.2 . 1 . . . . 253 LYS CE . 6873 1 250 . 1 1 263 263 LYS N N 15 122.884 0.1 . 1 . . . . 253 LYS N . 6873 1 251 . 1 1 264 264 GLN H H 1 8.161 0.02 . 1 . . . . 254 GLN HN . 6873 1 252 . 1 1 264 264 GLN HA H 1 3.722 0.02 . 1 . . . . 254 GLN HA . 6873 1 253 . 1 1 264 264 GLN HB2 H 1 1.462 0.02 . 2 . . . . 254 GLN HB1 . 6873 1 254 . 1 1 264 264 GLN HB3 H 1 -0.020 0.02 . 2 . . . . 254 GLN HB2 . 6873 1 255 . 1 1 264 264 GLN HG2 H 1 1.700 0.02 . 2 . . . . 254 GLN HG1 . 6873 1 256 . 1 1 264 264 GLN HG3 H 1 0.550 0.02 . 2 . . . . 254 GLN HG2 . 6873 1 257 . 1 1 264 264 GLN HE21 H 1 6.347 0.02 . 2 . . . . 254 GLN HE21 . 6873 1 258 . 1 1 264 264 GLN HE22 H 1 6.441 0.02 . 2 . . . . 254 GLN HE22 . 6873 1 259 . 1 1 264 264 GLN CA C 13 56.067 0.2 . 1 . . . . 254 GLN CA . 6873 1 260 . 1 1 264 264 GLN CB C 13 29.550 0.2 . 1 . . . . 254 GLN CB . 6873 1 261 . 1 1 264 264 GLN CG C 13 34.500 0.2 . 1 . . . . 254 GLN CG . 6873 1 262 . 1 1 264 264 GLN N N 15 132.648 0.1 . 1 . . . . 254 GLN N . 6873 1 263 . 1 1 264 264 GLN NE2 N 15 110.738 0.1 . 1 . . . . 254 GLN NE2 . 6873 1 264 . 1 1 265 265 GLY H H 1 8.500 0.02 . 1 . . . . 255 GLY HN . 6873 1 265 . 1 1 265 265 GLY HA2 H 1 4.001 0.02 . 2 . . . . 255 GLY HA1 . 6873 1 266 . 1 1 265 265 GLY HA3 H 1 4.152 0.02 . 2 . . . . 255 GLY HA2 . 6873 1 267 . 1 1 265 265 GLY CA C 13 46.124 0.2 . 1 . . . . 255 GLY CA . 6873 1 268 . 1 1 265 265 GLY N N 15 115.946 0.1 . 1 . . . . 255 GLY N . 6873 1 269 . 1 1 267 267 ARG H H 1 8.295 0.02 . 1 . . . . 257 ARG HN . 6873 1 270 . 1 1 267 267 ARG HA H 1 4.032 0.02 . 1 . . . . 257 ARG HA . 6873 1 271 . 1 1 267 267 ARG HB2 H 1 1.662 0.02 . 2 . . . . 257 ARG HB1 . 6873 1 272 . 1 1 267 267 ARG HB3 H 1 1.726 0.02 . 2 . . . . 257 ARG HB2 . 6873 1 273 . 1 1 267 267 ARG HG2 H 1 1.292 0.02 . 2 . . . . 257 ARG HG1 . 6873 1 274 . 1 1 267 267 ARG HD2 H 1 3.043 0.02 . 2 . . . . 257 ARG HD1 . 6873 1 275 . 1 1 267 267 ARG CA C 13 57.487 0.2 . 1 . . . . 257 ARG CA . 6873 1 276 . 1 1 267 267 ARG CG C 13 27.700 0.2 . 1 . . . . 257 ARG CG . 6873 1 277 . 1 1 267 267 ARG CD C 13 43.500 0.2 . 1 . . . . 257 ARG CD . 6873 1 278 . 1 1 267 267 ARG N N 15 125.240 0.1 . 1 . . . . 257 ARG N . 6873 1 279 . 1 1 268 268 ARG HA H 1 3.821 0.02 . 1 . . . . 258 ARG HA . 6873 1 280 . 1 1 268 268 ARG HB2 H 1 1.669 0.02 . 2 . . . . 258 ARG HB1 . 6873 1 281 . 1 1 268 268 ARG HG2 H 1 1.409 0.02 . 2 . . . . 258 ARG HG1 . 6873 1 282 . 1 1 268 268 ARG HG3 H 1 1.320 0.02 . 2 . . . . 258 ARG HG2 . 6873 1 283 . 1 1 268 268 ARG HD2 H 1 2.984 0.02 . 2 . . . . 258 ARG HD1 . 6873 1 284 . 1 1 268 268 ARG CA C 13 56.300 0.2 . 1 . . . . 258 ARG CA . 6873 1 285 . 1 1 268 268 ARG CB C 13 30.260 0.2 . 1 . . . . 258 ARG CB . 6873 1 286 . 1 1 268 268 ARG CG C 13 27.658 0.2 . 1 . . . . 258 ARG CG . 6873 1 287 . 1 1 268 268 ARG CD C 13 43.519 0.2 . 1 . . . . 258 ARG CD . 6873 1 288 . 1 1 269 269 LYS H H 1 7.925 0.02 . 1 . . . . 259 LYS HN . 6873 1 289 . 1 1 269 269 LYS HA H 1 4.050 0.02 . 1 . . . . 259 LYS HA . 6873 1 290 . 1 1 269 269 LYS HB2 H 1 1.690 0.02 . 2 . . . . 259 LYS HB1 . 6873 1 291 . 1 1 269 269 LYS HB3 H 1 1.630 0.02 . 2 . . . . 259 LYS HB2 . 6873 1 292 . 1 1 269 269 LYS HG2 H 1 1.195 0.02 . 2 . . . . 259 LYS HG1 . 6873 1 293 . 1 1 269 269 LYS HG3 H 1 1.095 0.02 . 2 . . . . 259 LYS HG2 . 6873 1 294 . 1 1 269 269 LYS HD2 H 1 1.440 0.02 . 1 . . . . 259 LYS HD1 . 6873 1 295 . 1 1 269 269 LYS HD3 H 1 1.440 0.02 . 1 . . . . 259 LYS HD2 . 6873 1 296 . 1 1 269 269 LYS HE2 H 1 2.800 0.02 . 2 . . . . 259 LYS HE1 . 6873 1 297 . 1 1 269 269 LYS CA C 13 56.327 0.2 . 1 . . . . 259 LYS CA . 6873 1 298 . 1 1 269 269 LYS CB C 13 31.400 0.2 . 1 . . . . 259 LYS CB . 6873 1 299 . 1 1 269 269 LYS CG C 13 24.817 0.2 . 1 . . . . 259 LYS CG . 6873 1 300 . 1 1 269 269 LYS CD C 13 29.100 0.2 . 1 . . . . 259 LYS CD . 6873 1 301 . 1 1 269 269 LYS CE C 13 42.100 0.2 . 1 . . . . 259 LYS CE . 6873 1 302 . 1 1 269 269 LYS N N 15 117.740 0.1 . 1 . . . . 259 LYS N . 6873 1 303 . 1 1 270 270 ASN H H 1 7.848 0.02 . 1 . . . . 260 ASN HN . 6873 1 304 . 1 1 270 270 ASN HA H 1 4.703 0.02 . 1 . . . . 260 ASN HA . 6873 1 305 . 1 1 270 270 ASN HB2 H 1 2.741 0.02 . 2 . . . . 260 ASN HB1 . 6873 1 306 . 1 1 270 270 ASN HB3 H 1 3.235 0.02 . 2 . . . . 260 ASN HB2 . 6873 1 307 . 1 1 270 270 ASN HD21 H 1 7.595 0.02 . 2 . . . . 260 ASN HD21 . 6873 1 308 . 1 1 270 270 ASN HD22 H 1 6.940 0.02 . 2 . . . . 260 ASN HD22 . 6873 1 309 . 1 1 270 270 ASN CA C 13 52.515 0.2 . 1 . . . . 260 ASN CA . 6873 1 310 . 1 1 270 270 ASN CB C 13 40.200 0.2 . 1 . . . . 260 ASN CB . 6873 1 311 . 1 1 270 270 ASN N N 15 117.231 0.1 . 1 . . . . 260 ASN N . 6873 1 312 . 1 1 270 270 ASN ND2 N 15 113.400 0.1 . 1 . . . . 260 ASN ND2 . 6873 1 313 . 1 1 271 271 TRP H H 1 8.640 0.02 . 1 . . . . 261 TRP HN . 6873 1 314 . 1 1 271 271 TRP HA H 1 4.781 0.02 . 1 . . . . 261 TRP HA . 6873 1 315 . 1 1 271 271 TRP HB2 H 1 2.870 0.02 . 2 . . . . 261 TRP HB1 . 6873 1 316 . 1 1 271 271 TRP HB3 H 1 2.931 0.02 . 2 . . . . 261 TRP HB2 . 6873 1 317 . 1 1 271 271 TRP HD1 H 1 7.225 0.02 . 1 . . . . 261 TRP HD1 . 6873 1 318 . 1 1 271 271 TRP HE1 H 1 10.266 0.02 . 1 . . . . 261 TRP HE1 . 6873 1 319 . 1 1 271 271 TRP HE3 H 1 6.963 0.02 . 1 . . . . 261 TRP HE3 . 6873 1 320 . 1 1 271 271 TRP HZ2 H 1 7.192 0.02 . 1 . . . . 261 TRP HZ2 . 6873 1 321 . 1 1 271 271 TRP HZ3 H 1 6.700 0.02 . 1 . . . . 261 TRP HZ3 . 6873 1 322 . 1 1 271 271 TRP HH2 H 1 6.677 0.02 . 1 . . . . 261 TRP HH2 . 6873 1 323 . 1 1 271 271 TRP CA C 13 57.014 0.2 . 1 . . . . 261 TRP CA . 6873 1 324 . 1 1 271 271 TRP CB C 13 31.528 0.2 . 1 . . . . 261 TRP CB . 6873 1 325 . 1 1 271 271 TRP CD1 C 13 128.488 0.2 . 1 . . . . 261 TRP CD1 . 6873 1 326 . 1 1 271 271 TRP CE3 C 13 120.100 0.2 . 1 . . . . 261 TRP CE3 . 6873 1 327 . 1 1 271 271 TRP CZ2 C 13 115.073 0.2 . 1 . . . . 261 TRP CZ2 . 6873 1 328 . 1 1 271 271 TRP CZ3 C 13 122.600 0.2 . 1 . . . . 261 TRP CZ3 . 6873 1 329 . 1 1 271 271 TRP CH2 C 13 124.156 0.2 . 1 . . . . 261 TRP CH2 . 6873 1 330 . 1 1 271 271 TRP N N 15 121.182 0.1 . 1 . . . . 261 TRP N . 6873 1 331 . 1 1 271 271 TRP NE1 N 15 130.993 0.1 . 1 . . . . 261 TRP NE1 . 6873 1 332 . 1 1 272 272 LYS H H 1 8.392 0.02 . 1 . . . . 262 LYS HN . 6873 1 333 . 1 1 272 272 LYS HA H 1 4.772 0.02 . 1 . . . . 262 LYS HA . 6873 1 334 . 1 1 272 272 LYS HB2 H 1 1.630 0.02 . 2 . . . . 262 LYS HB1 . 6873 1 335 . 1 1 272 272 LYS HG2 H 1 1.323 0.02 . 2 . . . . 262 LYS HG1 . 6873 1 336 . 1 1 272 272 LYS HD2 H 1 1.775 0.02 . 2 . . . . 262 LYS HD1 . 6873 1 337 . 1 1 272 272 LYS HE2 H 1 2.872 0.02 . 2 . . . . 262 LYS HE1 . 6873 1 338 . 1 1 272 272 LYS CA C 13 55.120 0.2 . 1 . . . . 262 LYS CA . 6873 1 339 . 1 1 272 272 LYS CB C 13 37.127 0.2 . 1 . . . . 262 LYS CB . 6873 1 340 . 1 1 272 272 LYS CG C 13 25.146 0.2 . 1 . . . . 262 LYS CG . 6873 1 341 . 1 1 272 272 LYS N N 15 120.925 0.1 . 1 . . . . 262 LYS N . 6873 1 342 . 1 1 273 273 VAL H H 1 8.894 0.02 . 1 . . . . 263 VAL HN . 6873 1 343 . 1 1 273 273 VAL HA H 1 4.189 0.02 . 1 . . . . 263 VAL HA . 6873 1 344 . 1 1 273 273 VAL HB H 1 1.992 0.02 . 1 . . . . 263 VAL HB . 6873 1 345 . 1 1 273 273 VAL HG11 H 1 0.903 0.02 . 1 . . . . 263 VAL HG1 . 6873 1 346 . 1 1 273 273 VAL HG12 H 1 0.903 0.02 . 1 . . . . 263 VAL HG1 . 6873 1 347 . 1 1 273 273 VAL HG13 H 1 0.903 0.02 . 1 . . . . 263 VAL HG1 . 6873 1 348 . 1 1 273 273 VAL HG21 H 1 0.991 0.02 . 1 . . . . 263 VAL HG2 . 6873 1 349 . 1 1 273 273 VAL HG22 H 1 0.991 0.02 . 1 . . . . 263 VAL HG2 . 6873 1 350 . 1 1 273 273 VAL HG23 H 1 0.991 0.02 . 1 . . . . 263 VAL HG2 . 6873 1 351 . 1 1 273 273 VAL CA C 13 64.127 0.2 . 1 . . . . 263 VAL CA . 6873 1 352 . 1 1 273 273 VAL CB C 13 32.051 0.2 . 1 . . . . 263 VAL CB . 6873 1 353 . 1 1 273 273 VAL CG1 C 13 21.692 0.2 . 2 . . . . 263 VAL CG1 . 6873 1 354 . 1 1 273 273 VAL CG2 C 13 22.450 0.2 . 2 . . . . 263 VAL CG2 . 6873 1 355 . 1 1 273 273 VAL N N 15 123.783 0.1 . 1 . . . . 263 VAL N . 6873 1 356 . 1 1 274 274 ARG H H 1 9.250 0.02 . 1 . . . . 264 ARG HN . 6873 1 357 . 1 1 274 274 ARG HA H 1 4.862 0.02 . 1 . . . . 264 ARG HA . 6873 1 358 . 1 1 274 274 ARG HB2 H 1 1.564 0.02 . 2 . . . . 264 ARG HB1 . 6873 1 359 . 1 1 274 274 ARG HD2 H 1 2.842 0.02 . 2 . . . . 264 ARG HD1 . 6873 1 360 . 1 1 274 274 ARG CA C 13 54.800 0.2 . 1 . . . . 264 ARG CA . 6873 1 361 . 1 1 274 274 ARG CB C 13 34.742 0.2 . 1 . . . . 264 ARG CB . 6873 1 362 . 1 1 274 274 ARG CD C 13 43.520 0.2 . 1 . . . . 264 ARG CD . 6873 1 363 . 1 1 274 274 ARG N N 15 129.243 0.1 . 1 . . . . 264 ARG N . 6873 1 364 . 1 1 275 275 LYS H H 1 8.676 0.02 . 1 . . . . 265 LYS HN . 6873 1 365 . 1 1 275 275 LYS HA H 1 4.874 0.02 . 1 . . . . 265 LYS HA . 6873 1 366 . 1 1 275 275 LYS HB2 H 1 1.620 0.02 . 2 . . . . 265 LYS HB1 . 6873 1 367 . 1 1 275 275 LYS HG2 H 1 1.350 0.02 . 2 . . . . 265 LYS HG1 . 6873 1 368 . 1 1 275 275 LYS HG3 H 1 1.151 0.02 . 2 . . . . 265 LYS HG2 . 6873 1 369 . 1 1 275 275 LYS HD2 H 1 1.577 0.02 . 2 . . . . 265 LYS HD1 . 6873 1 370 . 1 1 275 275 LYS HD3 H 1 1.429 0.02 . 2 . . . . 265 LYS HD2 . 6873 1 371 . 1 1 275 275 LYS HE2 H 1 2.648 0.02 . 2 . . . . 265 LYS HE1 . 6873 1 372 . 1 1 275 275 LYS HE3 H 1 2.600 0.02 . 2 . . . . 265 LYS HE2 . 6873 1 373 . 1 1 275 275 LYS CA C 13 56.300 0.2 . 1 . . . . 265 LYS CA . 6873 1 374 . 1 1 275 275 LYS CB C 13 34.233 0.2 . 1 . . . . 265 LYS CB . 6873 1 375 . 1 1 275 275 LYS CG C 13 25.500 0.2 . 1 . . . . 265 LYS CG . 6873 1 376 . 1 1 275 275 LYS CD C 13 29.550 0.2 . 1 . . . . 265 LYS CD . 6873 1 377 . 1 1 275 275 LYS CE C 13 42.336 0.2 . 1 . . . . 265 LYS CE . 6873 1 378 . 1 1 275 275 LYS N N 15 121.600 0.1 . 1 . . . . 265 LYS N . 6873 1 379 . 1 1 276 276 PHE H H 1 9.678 0.02 . 1 . . . . 266 PHE HN . 6873 1 380 . 1 1 276 276 PHE HA H 1 5.498 0.02 . 1 . . . . 266 PHE HA . 6873 1 381 . 1 1 276 276 PHE HB2 H 1 2.691 0.02 . 2 . . . . 266 PHE HB1 . 6873 1 382 . 1 1 276 276 PHE HB3 H 1 2.989 0.02 . 2 . . . . 266 PHE HB2 . 6873 1 383 . 1 1 276 276 PHE HD1 H 1 7.020 0.02 . 3 . . . . 266 PHE HD1 . 6873 1 384 . 1 1 276 276 PHE HE1 H 1 6.732 0.02 . 3 . . . . 266 PHE HE1 . 6873 1 385 . 1 1 276 276 PHE HZ H 1 6.360 0.02 . 1 . . . . 266 PHE HZ . 6873 1 386 . 1 1 276 276 PHE CA C 13 57.946 0.2 . 1 . . . . 266 PHE CA . 6873 1 387 . 1 1 276 276 PHE CB C 13 42.943 0.2 . 1 . . . . 266 PHE CB . 6873 1 388 . 1 1 276 276 PHE CD1 C 13 132.068 0.2 . 3 . . . . 266 PHE CD1 . 6873 1 389 . 1 1 276 276 PHE CE1 C 13 130.989 0.2 . 3 . . . . 266 PHE CE1 . 6873 1 390 . 1 1 276 276 PHE CZ C 13 128.502 0.2 . 1 . . . . 266 PHE CZ . 6873 1 391 . 1 1 276 276 PHE N N 15 127.252 0.1 . 1 . . . . 266 PHE N . 6873 1 392 . 1 1 277 277 ILE H H 1 9.193 0.02 . 1 . . . . 267 ILE HN . 6873 1 393 . 1 1 277 277 ILE HA H 1 4.802 0.02 . 1 . . . . 267 ILE HA . 6873 1 394 . 1 1 277 277 ILE HB H 1 2.160 0.02 . 1 . . . . 267 ILE HB . 6873 1 395 . 1 1 277 277 ILE HG12 H 1 1.611 0.02 . 9 . . . . 267 ILE HG11 . 6873 1 396 . 1 1 277 277 ILE HG13 H 1 1.190 0.02 . 9 . . . . 267 ILE HG12 . 6873 1 397 . 1 1 277 277 ILE HG21 H 1 0.996 0.02 . 1 . . . . 267 ILE HG2 . 6873 1 398 . 1 1 277 277 ILE HG22 H 1 0.996 0.02 . 1 . . . . 267 ILE HG2 . 6873 1 399 . 1 1 277 277 ILE HG23 H 1 0.996 0.02 . 1 . . . . 267 ILE HG2 . 6873 1 400 . 1 1 277 277 ILE HD11 H 1 0.672 0.02 . 1 . . . . 267 ILE HD1 . 6873 1 401 . 1 1 277 277 ILE HD12 H 1 0.672 0.02 . 1 . . . . 267 ILE HD1 . 6873 1 402 . 1 1 277 277 ILE HD13 H 1 0.672 0.02 . 1 . . . . 267 ILE HD1 . 6873 1 403 . 1 1 277 277 ILE CA C 13 62.458 0.2 . 1 . . . . 267 ILE CA . 6873 1 404 . 1 1 277 277 ILE CB C 13 41.389 0.2 . 1 . . . . 267 ILE CB . 6873 1 405 . 1 1 277 277 ILE CG1 C 13 27.778 0.2 . 1 . . . . 267 ILE CG1 . 6873 1 406 . 1 1 277 277 ILE CG2 C 13 19.470 0.2 . 1 . . . . 267 ILE CG2 . 6873 1 407 . 1 1 277 277 ILE CD1 C 13 13.312 0.2 . 1 . . . . 267 ILE CD1 . 6873 1 408 . 1 1 277 277 ILE N N 15 119.319 0.1 . 1 . . . . 267 ILE N . 6873 1 409 . 1 1 278 278 LEU H H 1 9.475 0.02 . 1 . . . . 268 LEU HN . 6873 1 410 . 1 1 278 278 LEU HA H 1 5.414 0.02 . 1 . . . . 268 LEU HA . 6873 1 411 . 1 1 278 278 LEU HB2 H 1 2.169 0.02 . 2 . . . . 268 LEU HB1 . 6873 1 412 . 1 1 278 278 LEU HB3 H 1 1.544 0.02 . 2 . . . . 268 LEU HB2 . 6873 1 413 . 1 1 278 278 LEU HG H 1 1.333 0.02 . 1 . . . . 268 LEU HG . 6873 1 414 . 1 1 278 278 LEU HD11 H 1 0.930 0.02 . 1 . . . . 268 LEU HD1 . 6873 1 415 . 1 1 278 278 LEU HD12 H 1 0.930 0.02 . 1 . . . . 268 LEU HD1 . 6873 1 416 . 1 1 278 278 LEU HD13 H 1 0.930 0.02 . 1 . . . . 268 LEU HD1 . 6873 1 417 . 1 1 278 278 LEU HD21 H 1 0.710 0.02 . 1 . . . . 268 LEU HD2 . 6873 1 418 . 1 1 278 278 LEU HD22 H 1 0.710 0.02 . 1 . . . . 268 LEU HD2 . 6873 1 419 . 1 1 278 278 LEU HD23 H 1 0.710 0.02 . 1 . . . . 268 LEU HD2 . 6873 1 420 . 1 1 278 278 LEU CA C 13 54.480 0.2 . 1 . . . . 268 LEU CA . 6873 1 421 . 1 1 278 278 LEU CB C 13 45.887 0.2 . 1 . . . . 268 LEU CB . 6873 1 422 . 1 1 278 278 LEU CG C 13 28.100 0.2 . 1 . . . . 268 LEU CG . 6873 1 423 . 1 1 278 278 LEU CD1 C 13 25.915 0.2 . 2 . . . . 268 LEU CD1 . 6873 1 424 . 1 1 278 278 LEU CD2 C 13 27.900 0.2 . 2 . . . . 268 LEU CD2 . 6873 1 425 . 1 1 278 278 LEU N N 15 132.423 0.1 . 1 . . . . 268 LEU N . 6873 1 426 . 1 1 279 279 ARG H H 1 9.326 0.02 . 1 . . . . 269 ARG HN . 6873 1 427 . 1 1 279 279 ARG HA H 1 5.434 0.02 . 1 . . . . 269 ARG HA . 6873 1 428 . 1 1 279 279 ARG HB2 H 1 1.716 0.02 . 2 . . . . 269 ARG HB1 . 6873 1 429 . 1 1 279 279 ARG HB3 H 1 1.672 0.02 . 2 . . . . 269 ARG HB2 . 6873 1 430 . 1 1 279 279 ARG HG2 H 1 1.330 0.02 . 2 . . . . 269 ARG HG1 . 6873 1 431 . 1 1 279 279 ARG HG3 H 1 1.720 0.02 . 2 . . . . 269 ARG HG2 . 6873 1 432 . 1 1 279 279 ARG HD2 H 1 3.314 0.02 . 2 . . . . 269 ARG HD1 . 6873 1 433 . 1 1 279 279 ARG HD3 H 1 3.150 0.02 . 2 . . . . 269 ARG HD2 . 6873 1 434 . 1 1 279 279 ARG HE H 1 7.190 0.02 . 1 . . . . 269 ARG HE . 6873 1 435 . 1 1 279 279 ARG HH21 H 1 6.570 0.02 . 9 . . . . 269 ARG HH21 . 6873 1 436 . 1 1 279 279 ARG CA C 13 54.600 0.2 . 1 . . . . 269 ARG CA . 6873 1 437 . 1 1 279 279 ARG CB C 13 35.900 0.2 . 1 . . . . 269 ARG CB . 6873 1 438 . 1 1 279 279 ARG CG C 13 30.500 0.2 . 1 . . . . 269 ARG CG . 6873 1 439 . 1 1 279 279 ARG CD C 13 44.700 0.2 . 1 . . . . 269 ARG CD . 6873 1 440 . 1 1 279 279 ARG N N 15 128.537 0.1 . 1 . . . . 269 ARG N . 6873 1 441 . 1 1 280 280 GLU H H 1 8.188 0.02 . 1 . . . . 270 GLU HN . 6873 1 442 . 1 1 280 280 GLU HA H 1 4.265 0.02 . 1 . . . . 270 GLU HA . 6873 1 443 . 1 1 280 280 GLU HB2 H 1 1.938 0.02 . 2 . . . . 270 GLU HB1 . 6873 1 444 . 1 1 280 280 GLU HB3 H 1 1.826 0.02 . 2 . . . . 270 GLU HB2 . 6873 1 445 . 1 1 280 280 GLU HG2 H 1 2.130 0.02 . 2 . . . . 270 GLU HG1 . 6873 1 446 . 1 1 280 280 GLU HG3 H 1 2.061 0.02 . 2 . . . . 270 GLU HG2 . 6873 1 447 . 1 1 280 280 GLU CA C 13 55.303 0.2 . 1 . . . . 270 GLU CA . 6873 1 448 . 1 1 280 280 GLU CB C 13 33.400 0.2 . 1 . . . . 270 GLU CB . 6873 1 449 . 1 1 280 280 GLU CG C 13 36.200 0.2 . 1 . . . . 270 GLU CG . 6873 1 450 . 1 1 280 280 GLU N N 15 115.626 0.1 . 1 . . . . 270 GLU N . 6873 1 451 . 1 1 281 281 ASP H H 1 7.718 0.02 . 1 . . . . 271 ASP HN . 6873 1 452 . 1 1 281 281 ASP HA H 1 4.363 0.02 . 1 . . . . 271 ASP HA . 6873 1 453 . 1 1 281 281 ASP HB2 H 1 3.019 0.02 . 2 . . . . 271 ASP HB1 . 6873 1 454 . 1 1 281 281 ASP HB3 H 1 2.371 0.02 . 2 . . . . 271 ASP HB2 . 6873 1 455 . 1 1 281 281 ASP CA C 13 53.988 0.2 . 1 . . . . 271 ASP CA . 6873 1 456 . 1 1 281 281 ASP CB C 13 41.547 0.2 . 1 . . . . 271 ASP CB . 6873 1 457 . 1 1 281 281 ASP N N 15 114.116 0.1 . 1 . . . . 271 ASP N . 6873 1 458 . 1 1 282 282 PRO HA H 1 4.671 0.02 . 1 . . . . 272 PRO HA . 6873 1 459 . 1 1 282 282 PRO HB2 H 1 2.420 0.02 . 2 . . . . 272 PRO HB1 . 6873 1 460 . 1 1 282 282 PRO HB3 H 1 2.040 0.02 . 2 . . . . 272 PRO HB2 . 6873 1 461 . 1 1 282 282 PRO HG2 H 1 1.920 0.02 . 2 . . . . 272 PRO HG1 . 6873 1 462 . 1 1 282 282 PRO HG3 H 1 2.020 0.02 . 2 . . . . 272 PRO HG2 . 6873 1 463 . 1 1 282 282 PRO HD2 H 1 3.558 0.02 . 2 . . . . 272 PRO HD1 . 6873 1 464 . 1 1 282 282 PRO HD3 H 1 3.447 0.02 . 2 . . . . 272 PRO HD2 . 6873 1 465 . 1 1 282 282 PRO CA C 13 63.500 0.2 . 1 . . . . 272 PRO CA . 6873 1 466 . 1 1 282 282 PRO CB C 13 35.200 0.2 . 1 . . . . 272 PRO CB . 6873 1 467 . 1 1 282 282 PRO CG C 13 25.500 0.2 . 1 . . . . 272 PRO CG . 6873 1 468 . 1 1 282 282 PRO CD C 13 51.100 0.2 . 1 . . . . 272 PRO CD . 6873 1 469 . 1 1 283 283 ALA H H 1 8.426 0.02 . 1 . . . . 273 ALA HN . 6873 1 470 . 1 1 283 283 ALA HA H 1 4.963 0.02 . 1 . . . . 273 ALA HA . 6873 1 471 . 1 1 283 283 ALA HB1 H 1 1.179 0.02 . 1 . . . . 273 ALA HB . 6873 1 472 . 1 1 283 283 ALA HB2 H 1 1.179 0.02 . 1 . . . . 273 ALA HB . 6873 1 473 . 1 1 283 283 ALA HB3 H 1 1.179 0.02 . 1 . . . . 273 ALA HB . 6873 1 474 . 1 1 283 283 ALA CA C 13 51.929 0.2 . 1 . . . . 273 ALA CA . 6873 1 475 . 1 1 283 283 ALA CB C 13 19.938 0.2 . 1 . . . . 273 ALA CB . 6873 1 476 . 1 1 283 283 ALA N N 15 123.045 0.1 . 1 . . . . 273 ALA N . 6873 1 477 . 1 1 284 284 TYR H H 1 7.989 0.02 . 1 . . . . 274 TYR HN . 6873 1 478 . 1 1 284 284 TYR HA H 1 5.054 0.02 . 1 . . . . 274 TYR HA . 6873 1 479 . 1 1 284 284 TYR HB2 H 1 2.551 0.02 . 2 . . . . 274 TYR HB1 . 6873 1 480 . 1 1 284 284 TYR HB3 H 1 2.697 0.02 . 2 . . . . 274 TYR HB2 . 6873 1 481 . 1 1 284 284 TYR HD1 H 1 6.494 0.02 . 3 . . . . 274 TYR HD1 . 6873 1 482 . 1 1 284 284 TYR HE1 H 1 6.390 0.02 . 3 . . . . 274 TYR HE1 . 6873 1 483 . 1 1 284 284 TYR CA C 13 57.745 0.2 . 1 . . . . 274 TYR CA . 6873 1 484 . 1 1 284 284 TYR CB C 13 46.121 0.2 . 1 . . . . 274 TYR CB . 6873 1 485 . 1 1 284 284 TYR CD1 C 13 132.465 0.2 . 3 . . . . 274 TYR CD1 . 6873 1 486 . 1 1 284 284 TYR CE1 C 13 117.519 0.2 . 3 . . . . 274 TYR CE1 . 6873 1 487 . 1 1 284 284 TYR N N 15 126.674 0.1 . 1 . . . . 274 TYR N . 6873 1 488 . 1 1 285 285 LEU H H 1 8.709 0.02 . 1 . . . . 275 LEU HN . 6873 1 489 . 1 1 285 285 LEU HA H 1 5.501 0.02 . 1 . . . . 275 LEU HA . 6873 1 490 . 1 1 285 285 LEU HB2 H 1 1.912 0.02 . 2 . . . . 275 LEU HB1 . 6873 1 491 . 1 1 285 285 LEU HB3 H 1 1.391 0.02 . 2 . . . . 275 LEU HB2 . 6873 1 492 . 1 1 285 285 LEU HG H 1 1.660 0.02 . 1 . . . . 275 LEU HG . 6873 1 493 . 1 1 285 285 LEU HD11 H 1 1.118 0.02 . 1 . . . . 275 LEU HD1 . 6873 1 494 . 1 1 285 285 LEU HD12 H 1 1.118 0.02 . 1 . . . . 275 LEU HD1 . 6873 1 495 . 1 1 285 285 LEU HD13 H 1 1.118 0.02 . 1 . . . . 275 LEU HD1 . 6873 1 496 . 1 1 285 285 LEU HD21 H 1 0.753 0.02 . 1 . . . . 275 LEU HD2 . 6873 1 497 . 1 1 285 285 LEU HD22 H 1 0.753 0.02 . 1 . . . . 275 LEU HD2 . 6873 1 498 . 1 1 285 285 LEU HD23 H 1 0.753 0.02 . 1 . . . . 275 LEU HD2 . 6873 1 499 . 1 1 285 285 LEU CA C 13 53.469 0.2 . 1 . . . . 275 LEU CA . 6873 1 500 . 1 1 285 285 LEU CB C 13 46.758 0.2 . 1 . . . . 275 LEU CB . 6873 1 501 . 1 1 285 285 LEU CG C 13 27.604 0.2 . 1 . . . . 275 LEU CG . 6873 1 502 . 1 1 285 285 LEU CD1 C 13 25.995 0.2 . 2 . . . . 275 LEU CD1 . 6873 1 503 . 1 1 285 285 LEU CD2 C 13 26.352 0.2 . 2 . . . . 275 LEU CD2 . 6873 1 504 . 1 1 285 285 LEU N N 15 120.893 0.1 . 1 . . . . 275 LEU N . 6873 1 505 . 1 1 286 286 HIS H H 1 8.911 0.02 . 1 . . . . 276 HIS HN . 6873 1 506 . 1 1 286 286 HIS HA H 1 5.120 0.02 . 1 . . . . 276 HIS HA . 6873 1 507 . 1 1 286 286 HIS HB2 H 1 2.792 0.02 . 2 . . . . 276 HIS HB1 . 6873 1 508 . 1 1 286 286 HIS HB3 H 1 3.042 0.02 . 2 . . . . 276 HIS HB2 . 6873 1 509 . 1 1 286 286 HIS HD2 H 1 6.647 0.02 . 1 . . . . 276 HIS HD2 . 6873 1 510 . 1 1 286 286 HIS HE1 H 1 7.700 0.02 . 1 . . . . 276 HIS HE1 . 6873 1 511 . 1 1 286 286 HIS CA C 13 58.200 0.2 . 1 . . . . 276 HIS CA . 6873 1 512 . 1 1 286 286 HIS CB C 13 35.481 0.2 . 1 . . . . 276 HIS CB . 6873 1 513 . 1 1 286 286 HIS CD2 C 13 117.060 0.2 . 1 . . . . 276 HIS CD2 . 6873 1 514 . 1 1 286 286 HIS CE1 C 13 138.203 0.2 . 1 . . . . 276 HIS CE1 . 6873 1 515 . 1 1 286 286 HIS N N 15 124.362 0.1 . 1 . . . . 276 HIS N . 6873 1 516 . 1 1 287 287 TYR H H 1 7.321 0.02 . 1 . . . . 277 TYR HN . 6873 1 517 . 1 1 287 287 TYR HA H 1 5.852 0.02 . 1 . . . . 277 TYR HA . 6873 1 518 . 1 1 287 287 TYR HB2 H 1 1.599 0.02 . 1 . . . . 277 TYR HB1 . 6873 1 519 . 1 1 287 287 TYR HB3 H 1 1.599 0.02 . 1 . . . . 277 TYR HB2 . 6873 1 520 . 1 1 287 287 TYR HD1 H 1 6.359 0.02 . 3 . . . . 277 TYR HD1 . 6873 1 521 . 1 1 287 287 TYR HE1 H 1 6.527 0.02 . 3 . . . . 277 TYR HE1 . 6873 1 522 . 1 1 287 287 TYR CA C 13 54.094 0.2 . 1 . . . . 277 TYR CA . 6873 1 523 . 1 1 287 287 TYR CB C 13 40.440 0.2 . 1 . . . . 277 TYR CB . 6873 1 524 . 1 1 287 287 TYR CD1 C 13 133.484 0.2 . 3 . . . . 277 TYR CD1 . 6873 1 525 . 1 1 287 287 TYR CE1 C 13 117.683 0.2 . 3 . . . . 277 TYR CE1 . 6873 1 526 . 1 1 287 287 TYR N N 15 114.340 0.1 . 1 . . . . 277 TYR N . 6873 1 527 . 1 1 288 288 TYR H H 1 9.152 0.02 . 1 . . . . 278 TYR HN . 6873 1 528 . 1 1 288 288 TYR HA H 1 4.486 0.02 . 1 . . . . 278 TYR HA . 6873 1 529 . 1 1 288 288 TYR HB2 H 1 3.065 0.02 . 2 . . . . 278 TYR HB1 . 6873 1 530 . 1 1 288 288 TYR HB3 H 1 2.453 0.02 . 2 . . . . 278 TYR HB2 . 6873 1 531 . 1 1 288 288 TYR HD1 H 1 6.916 0.02 . 3 . . . . 278 TYR HD1 . 6873 1 532 . 1 1 288 288 TYR HE1 H 1 6.533 0.02 . 3 . . . . 278 TYR HE1 . 6873 1 533 . 1 1 288 288 TYR CA C 13 57.352 0.2 . 1 . . . . 278 TYR CA . 6873 1 534 . 1 1 288 288 TYR CB C 13 43.259 0.2 . 1 . . . . 278 TYR CB . 6873 1 535 . 1 1 288 288 TYR CD1 C 13 133.397 0.2 . 3 . . . . 278 TYR CD1 . 6873 1 536 . 1 1 288 288 TYR CE1 C 13 118.632 0.2 . 3 . . . . 278 TYR CE1 . 6873 1 537 . 1 1 288 288 TYR N N 15 117.681 0.1 . 1 . . . . 278 TYR N . 6873 1 538 . 1 1 289 289 ASP H H 1 9.325 0.02 . 1 . . . . 279 ASP HN . 6873 1 539 . 1 1 289 289 ASP HA H 1 4.869 0.02 . 1 . . . . 279 ASP HA . 6873 1 540 . 1 1 289 289 ASP HB2 H 1 2.622 0.02 . 2 . . . . 279 ASP HB1 . 6873 1 541 . 1 1 289 289 ASP HB3 H 1 2.889 0.02 . 2 . . . . 279 ASP HB2 . 6873 1 542 . 1 1 289 289 ASP CA C 13 52.515 0.2 . 1 . . . . 279 ASP CA . 6873 1 543 . 1 1 289 289 ASP CB C 13 42.809 0.2 . 1 . . . . 279 ASP CB . 6873 1 544 . 1 1 289 289 ASP N N 15 124.008 0.1 . 1 . . . . 279 ASP N . 6873 1 545 . 1 1 290 290 PRO HA H 1 4.216 0.02 . 1 . . . . 280 PRO HA . 6873 1 546 . 1 1 290 290 PRO HB2 H 1 2.196 0.02 . 2 . . . . 280 PRO HB1 . 6873 1 547 . 1 1 290 290 PRO HB3 H 1 2.015 0.02 . 2 . . . . 280 PRO HB2 . 6873 1 548 . 1 1 290 290 PRO HG2 H 1 1.840 0.02 . 2 . . . . 280 PRO HG1 . 6873 1 549 . 1 1 290 290 PRO HG3 H 1 2.025 0.02 . 2 . . . . 280 PRO HG2 . 6873 1 550 . 1 1 290 290 PRO HD2 H 1 4.050 0.02 . 2 . . . . 280 PRO HD1 . 6873 1 551 . 1 1 290 290 PRO HD3 H 1 4.190 0.02 . 2 . . . . 280 PRO HD2 . 6873 1 552 . 1 1 290 290 PRO CA C 13 65.068 0.2 . 1 . . . . 280 PRO CA . 6873 1 553 . 1 1 290 290 PRO CB C 13 32.407 0.2 . 1 . . . . 280 PRO CB . 6873 1 554 . 1 1 290 290 PRO CG C 13 28.150 0.2 . 1 . . . . 280 PRO CG . 6873 1 555 . 1 1 290 290 PRO CD C 13 51.850 0.2 . 1 . . . . 280 PRO CD . 6873 1 556 . 1 1 291 291 ALA H H 1 8.325 0.02 . 1 . . . . 281 ALA HN . 6873 1 557 . 1 1 291 291 ALA HA H 1 4.420 0.02 . 1 . . . . 281 ALA HA . 6873 1 558 . 1 1 291 291 ALA HB1 H 1 1.350 0.02 . 1 . . . . 281 ALA HB . 6873 1 559 . 1 1 291 291 ALA HB2 H 1 1.350 0.02 . 1 . . . . 281 ALA HB . 6873 1 560 . 1 1 291 291 ALA HB3 H 1 1.350 0.02 . 1 . . . . 281 ALA HB . 6873 1 561 . 1 1 291 291 ALA CA C 13 52.330 0.2 . 1 . . . . 281 ALA CA . 6873 1 562 . 1 1 291 291 ALA CB C 13 19.411 0.2 . 1 . . . . 281 ALA CB . 6873 1 563 . 1 1 291 291 ALA N N 15 120.154 0.1 . 1 . . . . 281 ALA N . 6873 1 564 . 1 1 292 292 GLY H H 1 7.641 0.02 . 1 . . . . 282 GLY HN . 6873 1 565 . 1 1 292 292 GLY HA2 H 1 4.123 0.02 . 2 . . . . 282 GLY HA1 . 6873 1 566 . 1 1 292 292 GLY HA3 H 1 3.763 0.02 . 2 . . . . 282 GLY HA2 . 6873 1 567 . 1 1 292 292 GLY CA C 13 45.720 0.2 . 1 . . . . 282 GLY CA . 6873 1 568 . 1 1 292 292 GLY N N 15 107.810 0.1 . 1 . . . . 282 GLY N . 6873 1 569 . 1 1 293 293 ALA H H 1 8.290 0.02 . 1 . . . . 283 ALA HN . 6873 1 570 . 1 1 293 293 ALA HA H 1 4.293 0.02 . 1 . . . . 283 ALA HA . 6873 1 571 . 1 1 293 293 ALA HB1 H 1 1.439 0.02 . 1 . . . . 283 ALA HB . 6873 1 572 . 1 1 293 293 ALA HB2 H 1 1.439 0.02 . 1 . . . . 283 ALA HB . 6873 1 573 . 1 1 293 293 ALA HB3 H 1 1.439 0.02 . 1 . . . . 283 ALA HB . 6873 1 574 . 1 1 293 293 ALA CA C 13 52.763 0.2 . 1 . . . . 283 ALA CA . 6873 1 575 . 1 1 293 293 ALA CB C 13 19.955 0.2 . 1 . . . . 283 ALA CB . 6873 1 576 . 1 1 293 293 ALA N N 15 125.293 0.1 . 1 . . . . 283 ALA N . 6873 1 577 . 1 1 294 294 GLU H H 1 8.533 0.02 . 1 . . . . 284 GLU HN . 6873 1 578 . 1 1 294 294 GLU HA H 1 4.078 0.02 . 1 . . . . 284 GLU HA . 6873 1 579 . 1 1 294 294 GLU HB2 H 1 1.958 0.02 . 2 . . . . 284 GLU HB1 . 6873 1 580 . 1 1 294 294 GLU HB3 H 1 1.850 0.02 . 2 . . . . 284 GLU HB2 . 6873 1 581 . 1 1 294 294 GLU HG2 H 1 2.130 0.02 . 2 . . . . 284 GLU HG1 . 6873 1 582 . 1 1 294 294 GLU CA C 13 57.960 0.2 . 1 . . . . 284 GLU CA . 6873 1 583 . 1 1 294 294 GLU CB C 13 30.300 0.2 . 1 . . . . 284 GLU CB . 6873 1 584 . 1 1 294 294 GLU CG C 13 36.900 0.2 . 1 . . . . 284 GLU CG . 6873 1 585 . 1 1 294 294 GLU N N 15 119.351 0.1 . 1 . . . . 284 GLU N . 6873 1 586 . 1 1 295 295 ASP H H 1 7.646 0.02 . 1 . . . . 285 ASP HN . 6873 1 587 . 1 1 295 295 ASP HA H 1 4.944 0.02 . 1 . . . . 285 ASP HA . 6873 1 588 . 1 1 295 295 ASP HB2 H 1 2.554 0.02 . 2 . . . . 285 ASP HB1 . 6873 1 589 . 1 1 295 295 ASP HB3 H 1 2.348 0.02 . 2 . . . . 285 ASP HB2 . 6873 1 590 . 1 1 295 295 ASP CA C 13 52.515 0.2 . 1 . . . . 285 ASP CA . 6873 1 591 . 1 1 295 295 ASP CB C 13 41.232 0.2 . 1 . . . . 285 ASP CB . 6873 1 592 . 1 1 295 295 ASP N N 15 118.516 0.1 . 1 . . . . 285 ASP N . 6873 1 593 . 1 1 296 296 PRO HA H 1 3.420 0.02 . 1 . . . . 286 PRO HA . 6873 1 594 . 1 1 296 296 PRO HB2 H 1 1.585 0.02 . 2 . . . . 286 PRO HB1 . 6873 1 595 . 1 1 296 296 PRO HB3 H 1 1.366 0.02 . 2 . . . . 286 PRO HB2 . 6873 1 596 . 1 1 296 296 PRO HG2 H 1 2.000 0.02 . 2 . . . . 286 PRO HG1 . 6873 1 597 . 1 1 296 296 PRO HG3 H 1 1.813 0.02 . 2 . . . . 286 PRO HG2 . 6873 1 598 . 1 1 296 296 PRO HD2 H 1 3.805 0.02 . 2 . . . . 286 PRO HD1 . 6873 1 599 . 1 1 296 296 PRO HD3 H 1 3.670 0.02 . 2 . . . . 286 PRO HD2 . 6873 1 600 . 1 1 296 296 PRO CA C 13 63.400 0.2 . 1 . . . . 286 PRO CA . 6873 1 601 . 1 1 296 296 PRO CB C 13 31.450 0.2 . 1 . . . . 286 PRO CB . 6873 1 602 . 1 1 296 296 PRO CG C 13 27.400 0.2 . 1 . . . . 286 PRO CG . 6873 1 603 . 1 1 296 296 PRO CD C 13 50.460 0.2 . 1 . . . . 286 PRO CD . 6873 1 604 . 1 1 297 297 LEU H H 1 8.712 0.02 . 1 . . . . 287 LEU HN . 6873 1 605 . 1 1 297 297 LEU HA H 1 4.050 0.02 . 1 . . . . 287 LEU HA . 6873 1 606 . 1 1 297 297 LEU HB2 H 1 1.410 0.02 . 2 . . . . 287 LEU HB1 . 6873 1 607 . 1 1 297 297 LEU HB3 H 1 1.235 0.02 . 2 . . . . 287 LEU HB2 . 6873 1 608 . 1 1 297 297 LEU HG H 1 1.681 0.02 . 1 . . . . 287 LEU HG . 6873 1 609 . 1 1 297 297 LEU HD11 H 1 0.860 0.02 . 1 . . . . 287 LEU HD1 . 6873 1 610 . 1 1 297 297 LEU HD12 H 1 0.860 0.02 . 1 . . . . 287 LEU HD1 . 6873 1 611 . 1 1 297 297 LEU HD13 H 1 0.860 0.02 . 1 . . . . 287 LEU HD1 . 6873 1 612 . 1 1 297 297 LEU HD21 H 1 0.867 0.02 . 1 . . . . 287 LEU HD2 . 6873 1 613 . 1 1 297 297 LEU HD22 H 1 0.867 0.02 . 1 . . . . 287 LEU HD2 . 6873 1 614 . 1 1 297 297 LEU HD23 H 1 0.867 0.02 . 1 . . . . 287 LEU HD2 . 6873 1 615 . 1 1 297 297 LEU CA C 13 55.370 0.2 . 1 . . . . 287 LEU CA . 6873 1 616 . 1 1 297 297 LEU CB C 13 43.082 0.2 . 1 . . . . 287 LEU CB . 6873 1 617 . 1 1 297 297 LEU CG C 13 27.137 0.2 . 1 . . . . 287 LEU CG . 6873 1 618 . 1 1 297 297 LEU CD1 C 13 26.711 0.2 . 2 . . . . 287 LEU CD1 . 6873 1 619 . 1 1 297 297 LEU CD2 C 13 22.696 0.2 . 2 . . . . 287 LEU CD2 . 6873 1 620 . 1 1 297 297 LEU N N 15 122.145 0.1 . 1 . . . . 287 LEU N . 6873 1 621 . 1 1 298 298 GLY H H 1 6.405 0.02 . 1 . . . . 288 GLY HN . 6873 1 622 . 1 1 298 298 GLY HA2 H 1 3.732 0.02 . 2 . . . . 288 GLY HA1 . 6873 1 623 . 1 1 298 298 GLY HA3 H 1 3.268 0.02 . 2 . . . . 288 GLY HA2 . 6873 1 624 . 1 1 298 298 GLY CA C 13 45.401 0.2 . 1 . . . . 288 GLY CA . 6873 1 625 . 1 1 298 298 GLY N N 15 103.870 0.1 . 1 . . . . 288 GLY N . 6873 1 626 . 1 1 299 299 ALA H H 1 7.946 0.02 . 1 . . . . 289 ALA HN . 6873 1 627 . 1 1 299 299 ALA HA H 1 4.559 0.02 . 1 . . . . 289 ALA HA . 6873 1 628 . 1 1 299 299 ALA HB1 H 1 1.003 0.02 . 1 . . . . 289 ALA HB . 6873 1 629 . 1 1 299 299 ALA HB2 H 1 1.003 0.02 . 1 . . . . 289 ALA HB . 6873 1 630 . 1 1 299 299 ALA HB3 H 1 1.003 0.02 . 1 . . . . 289 ALA HB . 6873 1 631 . 1 1 299 299 ALA CA C 13 51.332 0.2 . 1 . . . . 289 ALA CA . 6873 1 632 . 1 1 299 299 ALA CB C 13 24.122 0.2 . 1 . . . . 289 ALA CB . 6873 1 633 . 1 1 299 299 ALA N N 15 120.443 0.1 . 1 . . . . 289 ALA N . 6873 1 634 . 1 1 300 300 ILE H H 1 8.730 0.02 . 1 . . . . 290 ILE HN . 6873 1 635 . 1 1 300 300 ILE HA H 1 4.043 0.02 . 1 . . . . 290 ILE HA . 6873 1 636 . 1 1 300 300 ILE HB H 1 1.697 0.02 . 1 . . . . 290 ILE HB . 6873 1 637 . 1 1 300 300 ILE HG12 H 1 1.266 0.02 . 9 . . . . 290 ILE HG11 . 6873 1 638 . 1 1 300 300 ILE HG13 H 1 0.247 0.02 . 9 . . . . 290 ILE HG12 . 6873 1 639 . 1 1 300 300 ILE HG21 H 1 0.398 0.02 . 1 . . . . 290 ILE HG2 . 6873 1 640 . 1 1 300 300 ILE HG22 H 1 0.398 0.02 . 1 . . . . 290 ILE HG2 . 6873 1 641 . 1 1 300 300 ILE HG23 H 1 0.398 0.02 . 1 . . . . 290 ILE HG2 . 6873 1 642 . 1 1 300 300 ILE HD11 H 1 -0.013 0.02 . 1 . . . . 290 ILE HD1 . 6873 1 643 . 1 1 300 300 ILE HD12 H 1 -0.013 0.02 . 1 . . . . 290 ILE HD1 . 6873 1 644 . 1 1 300 300 ILE HD13 H 1 -0.013 0.02 . 1 . . . . 290 ILE HD1 . 6873 1 645 . 1 1 300 300 ILE CA C 13 61.038 0.2 . 1 . . . . 290 ILE CA . 6873 1 646 . 1 1 300 300 ILE CB C 13 40.679 0.2 . 1 . . . . 290 ILE CB . 6873 1 647 . 1 1 300 300 ILE CG1 C 13 26.474 0.2 . 1 . . . . 290 ILE CG1 . 6873 1 648 . 1 1 300 300 ILE CG2 C 13 18.372 0.2 . 1 . . . . 290 ILE CG2 . 6873 1 649 . 1 1 300 300 ILE CD1 C 13 13.147 0.2 . 1 . . . . 290 ILE CD1 . 6873 1 650 . 1 1 300 300 ILE N N 15 122.113 0.1 . 1 . . . . 290 ILE N . 6873 1 651 . 1 1 301 301 HIS H H 1 9.013 0.02 . 1 . . . . 291 HIS HN . 6873 1 652 . 1 1 301 301 HIS HA H 1 3.863 0.02 . 1 . . . . 291 HIS HA . 6873 1 653 . 1 1 301 301 HIS HB2 H 1 3.082 0.02 . 2 . . . . 291 HIS HB1 . 6873 1 654 . 1 1 301 301 HIS HB3 H 1 2.744 0.02 . 2 . . . . 291 HIS HB2 . 6873 1 655 . 1 1 301 301 HIS HD2 H 1 6.645 0.02 . 1 . . . . 291 HIS HD2 . 6873 1 656 . 1 1 301 301 HIS HE1 H 1 7.710 0.02 . 1 . . . . 291 HIS HE1 . 6873 1 657 . 1 1 301 301 HIS CA C 13 55.141 0.2 . 1 . . . . 291 HIS CA . 6873 1 658 . 1 1 301 301 HIS CB C 13 30.913 0.2 . 1 . . . . 291 HIS CB . 6873 1 659 . 1 1 301 301 HIS CD2 C 13 119.855 0.2 . 1 . . . . 291 HIS CD2 . 6873 1 660 . 1 1 301 301 HIS CE1 C 13 138.203 0.2 . 1 . . . . 291 HIS CE1 . 6873 1 661 . 1 1 301 301 HIS N N 15 129.051 0.1 . 1 . . . . 291 HIS N . 6873 1 662 . 1 1 302 302 LEU H H 1 7.760 0.02 . 1 . . . . 292 LEU HN . 6873 1 663 . 1 1 302 302 LEU HA H 1 3.990 0.02 . 1 . . . . 292 LEU HA . 6873 1 664 . 1 1 302 302 LEU HB2 H 1 1.449 0.02 . 2 . . . . 292 LEU HB1 . 6873 1 665 . 1 1 302 302 LEU HB3 H 1 1.286 0.02 . 2 . . . . 292 LEU HB2 . 6873 1 666 . 1 1 302 302 LEU HG H 1 1.505 0.02 . 1 . . . . 292 LEU HG . 6873 1 667 . 1 1 302 302 LEU HD11 H 1 0.729 0.02 . 1 . . . . 292 LEU HD1 . 6873 1 668 . 1 1 302 302 LEU HD12 H 1 0.729 0.02 . 1 . . . . 292 LEU HD1 . 6873 1 669 . 1 1 302 302 LEU HD13 H 1 0.729 0.02 . 1 . . . . 292 LEU HD1 . 6873 1 670 . 1 1 302 302 LEU HD21 H 1 0.610 0.02 . 1 . . . . 292 LEU HD2 . 6873 1 671 . 1 1 302 302 LEU HD22 H 1 0.610 0.02 . 1 . . . . 292 LEU HD2 . 6873 1 672 . 1 1 302 302 LEU HD23 H 1 0.610 0.02 . 1 . . . . 292 LEU HD2 . 6873 1 673 . 1 1 302 302 LEU CA C 13 55.400 0.2 . 1 . . . . 292 LEU CA . 6873 1 674 . 1 1 302 302 LEU CB C 13 42.900 0.2 . 1 . . . . 292 LEU CB . 6873 1 675 . 1 1 302 302 LEU CG C 13 26.470 0.2 . 1 . . . . 292 LEU CG . 6873 1 676 . 1 1 302 302 LEU CD1 C 13 28.100 0.2 . 2 . . . . 292 LEU CD1 . 6873 1 677 . 1 1 302 302 LEU CD2 C 13 22.410 0.2 . 2 . . . . 292 LEU CD2 . 6873 1 678 . 1 1 302 302 LEU N N 15 124.843 0.1 . 1 . . . . 292 LEU N . 6873 1 679 . 1 1 303 303 ARG H H 1 6.410 0.02 . 1 . . . . 293 ARG HN . 6873 1 680 . 1 1 303 303 ARG HA H 1 4.000 0.02 . 1 . . . . 293 ARG HA . 6873 1 681 . 1 1 303 303 ARG HB2 H 1 1.191 0.02 . 2 . . . . 293 ARG HB1 . 6873 1 682 . 1 1 303 303 ARG HB3 H 1 1.510 0.02 . 2 . . . . 293 ARG HB2 . 6873 1 683 . 1 1 303 303 ARG HG2 H 1 1.577 0.02 . 2 . . . . 293 ARG HG1 . 6873 1 684 . 1 1 303 303 ARG HG3 H 1 1.380 0.02 . 2 . . . . 293 ARG HG2 . 6873 1 685 . 1 1 303 303 ARG HD2 H 1 3.140 0.02 . 2 . . . . 293 ARG HD1 . 6873 1 686 . 1 1 303 303 ARG HD3 H 1 3.168 0.02 . 2 . . . . 293 ARG HD2 . 6873 1 687 . 1 1 303 303 ARG CA C 13 58.400 0.2 . 1 . . . . 293 ARG CA . 6873 1 688 . 1 1 303 303 ARG CB C 13 29.523 0.2 . 1 . . . . 293 ARG CB . 6873 1 689 . 1 1 303 303 ARG CG C 13 27.000 0.2 . 1 . . . . 293 ARG CG . 6873 1 690 . 1 1 303 303 ARG CD C 13 43.700 0.2 . 1 . . . . 293 ARG CD . 6873 1 691 . 1 1 303 303 ARG N N 15 120.571 0.1 . 1 . . . . 293 ARG N . 6873 1 692 . 1 1 304 304 GLY H H 1 9.203 0.02 . 1 . . . . 294 GLY HN . 6873 1 693 . 1 1 304 304 GLY HA2 H 1 3.973 0.02 . 2 . . . . 294 GLY HA1 . 6873 1 694 . 1 1 304 304 GLY HA3 H 1 3.753 0.02 . 2 . . . . 294 GLY HA2 . 6873 1 695 . 1 1 304 304 GLY CA C 13 46.597 0.2 . 1 . . . . 294 GLY CA . 6873 1 696 . 1 1 304 304 GLY N N 15 118.000 0.1 . 1 . . . . 294 GLY N . 6873 1 697 . 1 1 305 305 CYS H H 1 7.734 0.02 . 1 . . . . 295 CYS HN . 6873 1 698 . 1 1 305 305 CYS HA H 1 4.745 0.02 . 1 . . . . 295 CYS HA . 6873 1 699 . 1 1 305 305 CYS HB2 H 1 2.778 0.02 . 2 . . . . 295 CYS HB1 . 6873 1 700 . 1 1 305 305 CYS HG H 1 2.140 0.02 . 1 . . . . 295 CYS HG . 6873 1 701 . 1 1 305 305 CYS CA C 13 57.960 0.2 . 1 . . . . 295 CYS CA . 6873 1 702 . 1 1 305 305 CYS CB C 13 28.999 0.2 . 1 . . . . 295 CYS CB . 6873 1 703 . 1 1 305 305 CYS N N 15 116.107 0.1 . 1 . . . . 295 CYS N . 6873 1 704 . 1 1 306 306 VAL H H 1 8.610 0.02 . 1 . . . . 296 VAL HN . 6873 1 705 . 1 1 306 306 VAL HA H 1 4.290 0.02 . 1 . . . . 296 VAL HA . 6873 1 706 . 1 1 306 306 VAL HB H 1 1.777 0.02 . 1 . . . . 296 VAL HB . 6873 1 707 . 1 1 306 306 VAL HG11 H 1 0.829 0.02 . 1 . . . . 296 VAL HG1 . 6873 1 708 . 1 1 306 306 VAL HG12 H 1 0.829 0.02 . 1 . . . . 296 VAL HG1 . 6873 1 709 . 1 1 306 306 VAL HG13 H 1 0.829 0.02 . 1 . . . . 296 VAL HG1 . 6873 1 710 . 1 1 306 306 VAL HG21 H 1 0.817 0.02 . 1 . . . . 296 VAL HG2 . 6873 1 711 . 1 1 306 306 VAL HG22 H 1 0.817 0.02 . 1 . . . . 296 VAL HG2 . 6873 1 712 . 1 1 306 306 VAL HG23 H 1 0.817 0.02 . 1 . . . . 296 VAL HG2 . 6873 1 713 . 1 1 306 306 VAL CA C 13 61.781 0.2 . 1 . . . . 296 VAL CA . 6873 1 714 . 1 1 306 306 VAL CB C 13 35.364 0.2 . 1 . . . . 296 VAL CB . 6873 1 715 . 1 1 306 306 VAL CG1 C 13 21.543 0.2 . 2 . . . . 296 VAL CG1 . 6873 1 716 . 1 1 306 306 VAL CG2 C 13 21.503 0.2 . 2 . . . . 296 VAL CG2 . 6873 1 717 . 1 1 306 306 VAL N N 15 120.314 0.1 . 1 . . . . 296 VAL N . 6873 1 718 . 1 1 307 307 VAL H H 1 8.607 0.02 . 1 . . . . 297 VAL HN . 6873 1 719 . 1 1 307 307 VAL HA H 1 5.476 0.02 . 1 . . . . 297 VAL HA . 6873 1 720 . 1 1 307 307 VAL HB H 1 1.875 0.02 . 1 . . . . 297 VAL HB . 6873 1 721 . 1 1 307 307 VAL HG11 H 1 0.954 0.02 . 1 . . . . 297 VAL HG1 . 6873 1 722 . 1 1 307 307 VAL HG12 H 1 0.954 0.02 . 1 . . . . 297 VAL HG1 . 6873 1 723 . 1 1 307 307 VAL HG13 H 1 0.954 0.02 . 1 . . . . 297 VAL HG1 . 6873 1 724 . 1 1 307 307 VAL HG21 H 1 0.987 0.02 . 1 . . . . 297 VAL HG2 . 6873 1 725 . 1 1 307 307 VAL HG22 H 1 0.987 0.02 . 1 . . . . 297 VAL HG2 . 6873 1 726 . 1 1 307 307 VAL HG23 H 1 0.987 0.02 . 1 . . . . 297 VAL HG2 . 6873 1 727 . 1 1 307 307 VAL CA C 13 59.376 0.2 . 1 . . . . 297 VAL CA . 6873 1 728 . 1 1 307 307 VAL CB C 13 34.622 0.2 . 1 . . . . 297 VAL CB . 6873 1 729 . 1 1 307 307 VAL CG1 C 13 23.164 0.2 . 2 . . . . 297 VAL CG1 . 6873 1 730 . 1 1 307 307 VAL CG2 C 13 21.673 0.2 . 2 . . . . 297 VAL CG2 . 6873 1 731 . 1 1 307 307 VAL N N 15 124.747 0.1 . 1 . . . . 297 VAL N . 6873 1 732 . 1 1 308 308 THR H H 1 8.824 0.02 . 1 . . . . 298 THR HN . 6873 1 733 . 1 1 308 308 THR HA H 1 4.686 0.02 . 1 . . . . 298 THR HA . 6873 1 734 . 1 1 308 308 THR HB H 1 3.939 0.02 . 1 . . . . 298 THR HB . 6873 1 735 . 1 1 308 308 THR HG21 H 1 1.108 0.02 . 1 . . . . 298 THR HG2 . 6873 1 736 . 1 1 308 308 THR HG22 H 1 1.108 0.02 . 1 . . . . 298 THR HG2 . 6873 1 737 . 1 1 308 308 THR HG23 H 1 1.108 0.02 . 1 . . . . 298 THR HG2 . 6873 1 738 . 1 1 308 308 THR CA C 13 60.328 0.2 . 1 . . . . 298 THR CA . 6873 1 739 . 1 1 308 308 THR CB C 13 71.490 0.2 . 1 . . . . 298 THR CB . 6873 1 740 . 1 1 308 308 THR CG2 C 13 21.164 0.2 . 1 . . . . 298 THR CG2 . 6873 1 741 . 1 1 308 308 THR N N 15 120.122 0.1 . 1 . . . . 298 THR N . 6873 1 742 . 1 1 309 309 SER H H 1 8.627 0.02 . 1 . . . . 299 SER HN . 6873 1 743 . 1 1 309 309 SER HA H 1 4.390 0.02 . 1 . . . . 299 SER HA . 6873 1 744 . 1 1 309 309 SER HB2 H 1 3.700 0.02 . 2 . . . . 299 SER HB1 . 6873 1 745 . 1 1 309 309 SER HB3 H 1 3.683 0.02 . 2 . . . . 299 SER HB2 . 6873 1 746 . 1 1 309 309 SER CA C 13 59.575 0.2 . 1 . . . . 299 SER CA . 6873 1 747 . 1 1 309 309 SER CB C 13 63.880 0.2 . 1 . . . . 299 SER CB . 6873 1 748 . 1 1 309 309 SER N N 15 120.186 0.1 . 1 . . . . 299 SER N . 6873 1 749 . 1 1 310 310 VAL H H 1 7.757 0.02 . 1 . . . . 300 VAL HN . 6873 1 750 . 1 1 310 310 VAL HA H 1 4.227 0.02 . 1 . . . . 300 VAL HA . 6873 1 751 . 1 1 310 310 VAL HB H 1 1.819 0.02 . 1 . . . . 300 VAL HB . 6873 1 752 . 1 1 310 310 VAL HG11 H 1 0.936 0.02 . 1 . . . . 300 VAL HG1 . 6873 1 753 . 1 1 310 310 VAL HG12 H 1 0.936 0.02 . 1 . . . . 300 VAL HG1 . 6873 1 754 . 1 1 310 310 VAL HG13 H 1 0.936 0.02 . 1 . . . . 300 VAL HG1 . 6873 1 755 . 1 1 310 310 VAL HG21 H 1 0.936 0.02 . 1 . . . . 300 VAL HG2 . 6873 1 756 . 1 1 310 310 VAL HG22 H 1 0.936 0.02 . 1 . . . . 300 VAL HG2 . 6873 1 757 . 1 1 310 310 VAL HG23 H 1 0.936 0.02 . 1 . . . . 300 VAL HG2 . 6873 1 758 . 1 1 310 310 VAL CA C 13 62.293 0.2 . 1 . . . . 300 VAL CA . 6873 1 759 . 1 1 310 310 VAL CB C 13 34.079 0.2 . 1 . . . . 300 VAL CB . 6873 1 760 . 1 1 310 310 VAL CG1 C 13 21.580 0.2 . 1 . . . . 300 VAL CG1 . 6873 1 761 . 1 1 310 310 VAL CG2 C 13 21.580 0.2 . 1 . . . . 300 VAL CG2 . 6873 1 762 . 1 1 310 310 VAL N N 15 125.300 0.1 . 1 . . . . 300 VAL N . 6873 1 763 . 1 1 311 311 GLU H H 1 8.618 0.02 . 1 . . . . 301 GLU HN . 6873 1 764 . 1 1 311 311 GLU HA H 1 4.467 0.02 . 1 . . . . 301 GLU HA . 6873 1 765 . 1 1 311 311 GLU HB2 H 1 1.826 0.02 . 2 . . . . 301 GLU HB1 . 6873 1 766 . 1 1 311 311 GLU HB3 H 1 2.041 0.02 . 2 . . . . 301 GLU HB2 . 6873 1 767 . 1 1 311 311 GLU HG2 H 1 2.189 0.02 . 2 . . . . 301 GLU HG1 . 6873 1 768 . 1 1 311 311 GLU HG3 H 1 2.256 0.02 . 2 . . . . 301 GLU HG2 . 6873 1 769 . 1 1 311 311 GLU CA C 13 56.057 0.2 . 1 . . . . 301 GLU CA . 6873 1 770 . 1 1 311 311 GLU CB C 13 31.110 0.2 . 1 . . . . 301 GLU CB . 6873 1 771 . 1 1 311 311 GLU CG C 13 36.417 0.2 . 1 . . . . 301 GLU CG . 6873 1 772 . 1 1 311 311 GLU N N 15 126.610 0.1 . 1 . . . . 301 GLU N . 6873 1 773 . 1 1 312 312 SER H H 1 8.564 0.02 . 1 . . . . 302 SER HN . 6873 1 774 . 1 1 312 312 SER HA H 1 4.382 0.02 . 1 . . . . 302 SER HA . 6873 1 775 . 1 1 312 312 SER HB2 H 1 3.796 0.02 . 2 . . . . 302 SER HB1 . 6873 1 776 . 1 1 312 312 SER CA C 13 58.652 0.2 . 1 . . . . 302 SER CA . 6873 1 777 . 1 1 312 312 SER CB C 13 64.327 0.2 . 1 . . . . 302 SER CB . 6873 1 778 . 1 1 312 312 SER N N 15 118.002 0.1 . 1 . . . . 302 SER N . 6873 1 779 . 1 1 313 313 ASN H H 1 8.601 0.02 . 1 . . . . 303 ASN HN . 6873 1 780 . 1 1 313 313 ASN HA H 1 4.737 0.02 . 1 . . . . 303 ASN HA . 6873 1 781 . 1 1 313 313 ASN HB2 H 1 2.754 0.02 . 2 . . . . 303 ASN HB1 . 6873 1 782 . 1 1 313 313 ASN HD21 H 1 7.553 0.02 . 2 . . . . 303 ASN HD21 . 6873 1 783 . 1 1 313 313 ASN HD22 H 1 6.847 0.02 . 2 . . . . 303 ASN HD22 . 6873 1 784 . 1 1 313 313 ASN CA C 13 53.462 0.2 . 1 . . . . 303 ASN CA . 6873 1 785 . 1 1 313 313 ASN CB C 13 39.280 0.2 . 1 . . . . 303 ASN CB . 6873 1 786 . 1 1 313 313 ASN N N 15 121.149 0.1 . 1 . . . . 303 ASN N . 6873 1 787 . 1 1 313 313 ASN ND2 N 15 112.879 0.1 . 1 . . . . 303 ASN ND2 . 6873 1 788 . 1 1 314 314 SER H H 1 8.330 0.02 . 1 . . . . 304 SER HN . 6873 1 789 . 1 1 314 314 SER HA H 1 4.407 0.02 . 1 . . . . 304 SER HA . 6873 1 790 . 1 1 314 314 SER HB2 H 1 3.778 0.02 . 2 . . . . 304 SER HB1 . 6873 1 791 . 1 1 314 314 SER CA C 13 58.671 0.2 . 1 . . . . 304 SER CA . 6873 1 792 . 1 1 314 314 SER CB C 13 64.267 0.2 . 1 . . . . 304 SER CB . 6873 1 793 . 1 1 314 314 SER N N 15 116.460 0.1 . 1 . . . . 304 SER N . 6873 1 794 . 1 1 315 315 ASN H H 1 8.604 0.02 . 1 . . . . 305 ASN HN . 6873 1 795 . 1 1 315 315 ASN HA H 1 4.564 0.02 . 1 . . . . 305 ASN HA . 6873 1 796 . 1 1 315 315 ASN HB2 H 1 2.806 0.02 . 2 . . . . 305 ASN HB1 . 6873 1 797 . 1 1 315 315 ASN HB3 H 1 2.702 0.02 . 2 . . . . 305 ASN HB2 . 6873 1 798 . 1 1 315 315 ASN HD21 H 1 6.849 0.02 . 2 . . . . 305 ASN HD21 . 6873 1 799 . 1 1 315 315 ASN HD22 H 1 7.511 0.02 . 2 . . . . 305 ASN HD22 . 6873 1 800 . 1 1 315 315 ASN CA C 13 54.173 0.2 . 1 . . . . 305 ASN CA . 6873 1 801 . 1 1 315 315 ASN CB C 13 38.900 0.2 . 1 . . . . 305 ASN CB . 6873 1 802 . 1 1 315 315 ASN N N 15 120.200 0.1 . 1 . . . . 305 ASN N . 6873 1 803 . 1 1 315 315 ASN ND2 N 15 112.591 0.1 . 1 . . . . 305 ASN ND2 . 6873 1 804 . 1 1 316 316 GLY H H 1 8.331 0.02 . 1 . . . . 306 GLY HN . 6873 1 805 . 1 1 316 316 GLY HA2 H 1 4.001 0.02 . 2 . . . . 306 GLY HA1 . 6873 1 806 . 1 1 316 316 GLY HA3 H 1 4.152 0.02 . 2 . . . . 306 GLY HA2 . 6873 1 807 . 1 1 316 316 GLY CA C 13 46.124 0.2 . 1 . . . . 306 GLY CA . 6873 1 808 . 1 1 316 316 GLY N N 15 108.276 0.1 . 1 . . . . 306 GLY N . 6873 1 809 . 1 1 317 317 ARG H H 1 7.850 0.02 . 1 . . . . 307 ARG HN . 6873 1 810 . 1 1 317 317 ARG HA H 1 4.286 0.02 . 1 . . . . 307 ARG HA . 6873 1 811 . 1 1 317 317 ARG HB2 H 1 1.763 0.02 . 2 . . . . 307 ARG HB1 . 6873 1 812 . 1 1 317 317 ARG HB3 H 1 1.685 0.02 . 2 . . . . 307 ARG HB2 . 6873 1 813 . 1 1 317 317 ARG HG2 H 1 1.523 0.02 . 2 . . . . 307 ARG HG1 . 6873 1 814 . 1 1 317 317 ARG HD2 H 1 3.095 0.02 . 2 . . . . 307 ARG HD1 . 6873 1 815 . 1 1 317 317 ARG CA C 13 56.540 0.2 . 1 . . . . 307 ARG CA . 6873 1 816 . 1 1 317 317 ARG CB C 13 30.970 0.2 . 1 . . . . 307 ARG CB . 6873 1 817 . 1 1 317 317 ARG CG C 13 27.483 0.2 . 1 . . . . 307 ARG CG . 6873 1 818 . 1 1 317 317 ARG CD C 13 43.359 0.2 . 1 . . . . 307 ARG CD . 6873 1 819 . 1 1 317 317 ARG N N 15 120.507 0.1 . 1 . . . . 307 ARG N . 6873 1 820 . 1 1 318 318 LYS H H 1 8.370 0.02 . 1 . . . . 308 LYS HN . 6873 1 821 . 1 1 318 318 LYS HA H 1 4.273 0.02 . 1 . . . . 308 LYS HA . 6873 1 822 . 1 1 318 318 LYS HB2 H 1 1.750 0.02 . 2 . . . . 308 LYS HB1 . 6873 1 823 . 1 1 318 318 LYS HB3 H 1 1.666 0.02 . 2 . . . . 308 LYS HB2 . 6873 1 824 . 1 1 318 318 LYS HG2 H 1 1.340 0.02 . 2 . . . . 308 LYS HG1 . 6873 1 825 . 1 1 318 318 LYS HD2 H 1 1.581 0.02 . 2 . . . . 308 LYS HD1 . 6873 1 826 . 1 1 318 318 LYS HE2 H 1 2.918 0.02 . 2 . . . . 308 LYS HE1 . 6873 1 827 . 1 1 318 318 LYS CA C 13 56.558 0.2 . 1 . . . . 308 LYS CA . 6873 1 828 . 1 1 318 318 LYS CB C 13 32.890 0.2 . 1 . . . . 308 LYS CB . 6873 1 829 . 1 1 318 318 LYS CG C 13 24.920 0.2 . 1 . . . . 308 LYS CG . 6873 1 830 . 1 1 318 318 LYS CD C 13 29.300 0.2 . 1 . . . . 308 LYS CD . 6873 1 831 . 1 1 318 318 LYS CE C 13 42.512 0.2 . 1 . . . . 308 LYS CE . 6873 1 832 . 1 1 318 318 LYS N N 15 122.980 0.1 . 1 . . . . 308 LYS N . 6873 1 833 . 1 1 319 319 SER H H 1 8.380 0.02 . 1 . . . . 309 SER HN . 6873 1 834 . 1 1 319 319 SER HA H 1 4.312 0.02 . 1 . . . . 309 SER HA . 6873 1 835 . 1 1 319 319 SER HB2 H 1 3.770 0.02 . 2 . . . . 309 SER HB1 . 6873 1 836 . 1 1 319 319 SER CA C 13 59.178 0.2 . 1 . . . . 309 SER CA . 6873 1 837 . 1 1 319 319 SER CB C 13 63.196 0.2 . 1 . . . . 309 SER CB . 6873 1 838 . 1 1 319 319 SER N N 15 118.034 0.1 . 1 . . . . 309 SER N . 6873 1 839 . 1 1 320 320 GLU H H 1 8.557 0.02 . 1 . . . . 310 GLU HN . 6873 1 840 . 1 1 320 320 GLU HA H 1 4.163 0.02 . 1 . . . . 310 GLU HA . 6873 1 841 . 1 1 320 320 GLU HB2 H 1 2.011 0.02 . 2 . . . . 310 GLU HB1 . 6873 1 842 . 1 1 320 320 GLU HB3 H 1 1.833 0.02 . 2 . . . . 310 GLU HB2 . 6873 1 843 . 1 1 320 320 GLU HG2 H 1 2.150 0.02 . 2 . . . . 310 GLU HG1 . 6873 1 844 . 1 1 320 320 GLU HG3 H 1 2.262 0.02 . 2 . . . . 310 GLU HG2 . 6873 1 845 . 1 1 320 320 GLU CA C 13 57.469 0.2 . 1 . . . . 310 GLU CA . 6873 1 846 . 1 1 320 320 GLU CB C 13 30.224 0.2 . 1 . . . . 310 GLU CB . 6873 1 847 . 1 1 320 320 GLU CG C 13 36.226 0.2 . 1 . . . . 310 GLU CG . 6873 1 848 . 1 1 320 320 GLU N N 15 121.728 0.1 . 1 . . . . 310 GLU N . 6873 1 849 . 1 1 321 321 GLU H H 1 8.013 0.02 . 1 . . . . 311 GLU HN . 6873 1 850 . 1 1 321 321 GLU HA H 1 4.090 0.02 . 1 . . . . 311 GLU HA . 6873 1 851 . 1 1 321 321 GLU HB2 H 1 1.775 0.02 . 2 . . . . 311 GLU HB1 . 6873 1 852 . 1 1 321 321 GLU HB3 H 1 1.723 0.02 . 2 . . . . 311 GLU HB2 . 6873 1 853 . 1 1 321 321 GLU HG2 H 1 2.026 0.02 . 2 . . . . 311 GLU HG1 . 6873 1 854 . 1 1 321 321 GLU CA C 13 56.500 0.2 . 1 . . . . 311 GLU CA . 6873 1 855 . 1 1 321 321 GLU CB C 13 30.703 0.2 . 1 . . . . 311 GLU CB . 6873 1 856 . 1 1 321 321 GLU CG C 13 36.693 0.2 . 1 . . . . 311 GLU CG . 6873 1 857 . 1 1 321 321 GLU N N 15 119.415 0.1 . 1 . . . . 311 GLU N . 6873 1 858 . 1 1 322 322 GLU H H 1 7.826 0.02 . 1 . . . . 312 GLU HN . 6873 1 859 . 1 1 322 322 GLU HA H 1 4.275 0.02 . 1 . . . . 312 GLU HA . 6873 1 860 . 1 1 322 322 GLU HB2 H 1 1.695 0.02 . 2 . . . . 312 GLU HB1 . 6873 1 861 . 1 1 322 322 GLU HB3 H 1 1.822 0.02 . 2 . . . . 312 GLU HB2 . 6873 1 862 . 1 1 322 322 GLU HG2 H 1 2.043 0.02 . 2 . . . . 312 GLU HG1 . 6873 1 863 . 1 1 322 322 GLU HG3 H 1 2.099 0.02 . 2 . . . . 312 GLU HG2 . 6873 1 864 . 1 1 322 322 GLU CA C 13 55.860 0.2 . 1 . . . . 312 GLU CA . 6873 1 865 . 1 1 322 322 GLU CB C 13 32.426 0.2 . 1 . . . . 312 GLU CB . 6873 1 866 . 1 1 322 322 GLU CG C 13 36.613 0.2 . 1 . . . . 312 GLU CG . 6873 1 867 . 1 1 322 322 GLU N N 15 120.507 0.1 . 1 . . . . 312 GLU N . 6873 1 868 . 1 1 323 323 ASN H H 1 8.499 0.02 . 1 . . . . 313 ASN HN . 6873 1 869 . 1 1 323 323 ASN HA H 1 4.169 0.02 . 1 . . . . 313 ASN HA . 6873 1 870 . 1 1 323 323 ASN HB2 H 1 3.139 0.02 . 2 . . . . 313 ASN HB1 . 6873 1 871 . 1 1 323 323 ASN HB3 H 1 2.082 0.02 . 2 . . . . 313 ASN HB2 . 6873 1 872 . 1 1 323 323 ASN HD21 H 1 6.789 0.02 . 2 . . . . 313 ASN HD21 . 6873 1 873 . 1 1 323 323 ASN HD22 H 1 6.590 0.02 . 2 . . . . 313 ASN HD22 . 6873 1 874 . 1 1 323 323 ASN CA C 13 54.400 0.2 . 1 . . . . 313 ASN CA . 6873 1 875 . 1 1 323 323 ASN CB C 13 38.550 0.2 . 1 . . . . 313 ASN CB . 6873 1 876 . 1 1 323 323 ASN N N 15 114.822 0.1 . 1 . . . . 313 ASN N . 6873 1 877 . 1 1 323 323 ASN ND2 N 15 113.650 0.1 . 1 . . . . 313 ASN ND2 . 6873 1 878 . 1 1 324 324 LEU H H 1 8.430 0.02 . 1 . . . . 314 LEU HN . 6873 1 879 . 1 1 324 324 LEU HA H 1 5.130 0.02 . 1 . . . . 314 LEU HA . 6873 1 880 . 1 1 324 324 LEU HB2 H 1 1.740 0.02 . 2 . . . . 314 LEU HB1 . 6873 1 881 . 1 1 324 324 LEU HB3 H 1 1.494 0.02 . 2 . . . . 314 LEU HB2 . 6873 1 882 . 1 1 324 324 LEU HG H 1 1.463 0.02 . 1 . . . . 314 LEU HG . 6873 1 883 . 1 1 324 324 LEU HD11 H 1 0.806 0.02 . 1 . . . . 314 LEU HD1 . 6873 1 884 . 1 1 324 324 LEU HD12 H 1 0.806 0.02 . 1 . . . . 314 LEU HD1 . 6873 1 885 . 1 1 324 324 LEU HD13 H 1 0.806 0.02 . 1 . . . . 314 LEU HD1 . 6873 1 886 . 1 1 324 324 LEU HD21 H 1 0.672 0.02 . 1 . . . . 314 LEU HD2 . 6873 1 887 . 1 1 324 324 LEU HD22 H 1 0.672 0.02 . 1 . . . . 314 LEU HD2 . 6873 1 888 . 1 1 324 324 LEU HD23 H 1 0.672 0.02 . 1 . . . . 314 LEU HD2 . 6873 1 889 . 1 1 324 324 LEU CA C 13 55.556 0.2 . 1 . . . . 314 LEU CA . 6873 1 890 . 1 1 324 324 LEU CB C 13 44.935 0.2 . 1 . . . . 314 LEU CB . 6873 1 891 . 1 1 324 324 LEU CG C 13 28.097 0.2 . 1 . . . . 314 LEU CG . 6873 1 892 . 1 1 324 324 LEU CD1 C 13 25.771 0.2 . 2 . . . . 314 LEU CD1 . 6873 1 893 . 1 1 324 324 LEU CD2 C 13 25.511 0.2 . 2 . . . . 314 LEU CD2 . 6873 1 894 . 1 1 324 324 LEU N N 15 121.406 0.1 . 1 . . . . 314 LEU N . 6873 1 895 . 1 1 325 325 PHE H H 1 9.470 0.02 . 1 . . . . 315 PHE HN . 6873 1 896 . 1 1 325 325 PHE HA H 1 5.094 0.02 . 1 . . . . 315 PHE HA . 6873 1 897 . 1 1 325 325 PHE HB2 H 1 2.983 0.02 . 2 . . . . 315 PHE HB1 . 6873 1 898 . 1 1 325 325 PHE HB3 H 1 2.880 0.02 . 2 . . . . 315 PHE HB2 . 6873 1 899 . 1 1 325 325 PHE HD1 H 1 6.836 0.02 . 3 . . . . 315 PHE HD1 . 6873 1 900 . 1 1 325 325 PHE HE1 H 1 6.648 0.02 . 3 . . . . 315 PHE HE1 . 6873 1 901 . 1 1 325 325 PHE HZ H 1 6.402 0.02 . 1 . . . . 315 PHE HZ . 6873 1 902 . 1 1 325 325 PHE CA C 13 57.238 0.2 . 1 . . . . 315 PHE CA . 6873 1 903 . 1 1 325 325 PHE CB C 13 42.099 0.2 . 1 . . . . 315 PHE CB . 6873 1 904 . 1 1 325 325 PHE CD1 C 13 132.939 0.2 . 3 . . . . 315 PHE CD1 . 6873 1 905 . 1 1 325 325 PHE CE1 C 13 129.975 0.2 . 3 . . . . 315 PHE CE1 . 6873 1 906 . 1 1 325 325 PHE CZ C 13 129.595 0.2 . 1 . . . . 315 PHE CZ . 6873 1 907 . 1 1 325 325 PHE N N 15 119.447 0.1 . 1 . . . . 315 PHE N . 6873 1 908 . 1 1 326 326 GLU H H 1 8.957 0.02 . 1 . . . . 316 GLU HN . 6873 1 909 . 1 1 326 326 GLU HA H 1 5.229 0.02 . 1 . . . . 316 GLU HA . 6873 1 910 . 1 1 326 326 GLU HB2 H 1 1.776 0.02 . 2 . . . . 316 GLU HB1 . 6873 1 911 . 1 1 326 326 GLU HB3 H 1 1.483 0.02 . 2 . . . . 316 GLU HB2 . 6873 1 912 . 1 1 326 326 GLU HG2 H 1 1.629 0.02 . 2 . . . . 316 GLU HG1 . 6873 1 913 . 1 1 326 326 GLU HG3 H 1 1.370 0.02 . 2 . . . . 316 GLU HG2 . 6873 1 914 . 1 1 326 326 GLU CA C 13 53.713 0.2 . 1 . . . . 316 GLU CA . 6873 1 915 . 1 1 326 326 GLU CB C 13 35.000 0.2 . 1 . . . . 316 GLU CB . 6873 1 916 . 1 1 326 326 GLU CG C 13 35.954 0.2 . 1 . . . . 316 GLU CG . 6873 1 917 . 1 1 326 326 GLU N N 15 121.888 0.1 . 1 . . . . 316 GLU N . 6873 1 918 . 1 1 327 327 ILE H H 1 8.605 0.02 . 1 . . . . 317 ILE HN . 6873 1 919 . 1 1 327 327 ILE HA H 1 4.717 0.02 . 1 . . . . 317 ILE HA . 6873 1 920 . 1 1 327 327 ILE HB H 1 1.492 0.02 . 1 . . . . 317 ILE HB . 6873 1 921 . 1 1 327 327 ILE HG12 H 1 0.810 0.02 . 9 . . . . 317 ILE HG11 . 6873 1 922 . 1 1 327 327 ILE HG13 H 1 1.510 0.02 . 9 . . . . 317 ILE HG12 . 6873 1 923 . 1 1 327 327 ILE HG21 H 1 0.638 0.02 . 1 . . . . 317 ILE HG2 . 6873 1 924 . 1 1 327 327 ILE HG22 H 1 0.638 0.02 . 1 . . . . 317 ILE HG2 . 6873 1 925 . 1 1 327 327 ILE HG23 H 1 0.638 0.02 . 1 . . . . 317 ILE HG2 . 6873 1 926 . 1 1 327 327 ILE HD11 H 1 0.530 0.02 . 1 . . . . 317 ILE HD1 . 6873 1 927 . 1 1 327 327 ILE HD12 H 1 0.530 0.02 . 1 . . . . 317 ILE HD1 . 6873 1 928 . 1 1 327 327 ILE HD13 H 1 0.530 0.02 . 1 . . . . 317 ILE HD1 . 6873 1 929 . 1 1 327 327 ILE CA C 13 60.269 0.2 . 1 . . . . 317 ILE CA . 6873 1 930 . 1 1 327 327 ILE CB C 13 42.289 0.2 . 1 . . . . 317 ILE CB . 6873 1 931 . 1 1 327 327 ILE CG1 C 13 27.658 0.2 . 1 . . . . 317 ILE CG1 . 6873 1 932 . 1 1 327 327 ILE CG2 C 13 17.125 0.2 . 1 . . . . 317 ILE CG2 . 6873 1 933 . 1 1 327 327 ILE CD1 C 13 15.545 0.2 . 1 . . . . 317 ILE CD1 . 6873 1 934 . 1 1 327 327 ILE N N 15 123.559 0.1 . 1 . . . . 317 ILE N . 6873 1 935 . 1 1 328 328 ILE H H 1 9.136 0.02 . 1 . . . . 318 ILE HN . 6873 1 936 . 1 1 328 328 ILE HA H 1 4.657 0.02 . 1 . . . . 318 ILE HA . 6873 1 937 . 1 1 328 328 ILE HB H 1 1.445 0.02 . 1 . . . . 318 ILE HB . 6873 1 938 . 1 1 328 328 ILE HG12 H 1 1.023 0.02 . 9 . . . . 318 ILE HG11 . 6873 1 939 . 1 1 328 328 ILE HG13 H 1 -0.027 0.02 . 9 . . . . 318 ILE HG12 . 6873 1 940 . 1 1 328 328 ILE HG21 H 1 0.289 0.02 . 1 . . . . 318 ILE HG2 . 6873 1 941 . 1 1 328 328 ILE HG22 H 1 0.289 0.02 . 1 . . . . 318 ILE HG2 . 6873 1 942 . 1 1 328 328 ILE HG23 H 1 0.289 0.02 . 1 . . . . 318 ILE HG2 . 6873 1 943 . 1 1 328 328 ILE HD11 H 1 0.550 0.02 . 1 . . . . 318 ILE HD1 . 6873 1 944 . 1 1 328 328 ILE HD12 H 1 0.550 0.02 . 1 . . . . 318 ILE HD1 . 6873 1 945 . 1 1 328 328 ILE HD13 H 1 0.550 0.02 . 1 . . . . 318 ILE HD1 . 6873 1 946 . 1 1 328 328 ILE CA C 13 60.801 0.2 . 1 . . . . 318 ILE CA . 6873 1 947 . 1 1 328 328 ILE CB C 13 39.260 0.2 . 1 . . . . 318 ILE CB . 6873 1 948 . 1 1 328 328 ILE CG1 C 13 28.373 0.2 . 1 . . . . 318 ILE CG1 . 6873 1 949 . 1 1 328 328 ILE CG2 C 13 18.284 0.2 . 1 . . . . 318 ILE CG2 . 6873 1 950 . 1 1 328 328 ILE CD1 C 13 15.198 0.2 . 1 . . . . 318 ILE CD1 . 6873 1 951 . 1 1 328 328 ILE N N 15 126.802 0.1 . 1 . . . . 318 ILE N . 6873 1 952 . 1 1 329 329 THR H H 1 9.020 0.02 . 1 . . . . 319 THR HN . 6873 1 953 . 1 1 329 329 THR HA H 1 4.248 0.02 . 1 . . . . 319 THR HA . 6873 1 954 . 1 1 329 329 THR HB H 1 4.728 0.02 . 1 . . . . 319 THR HB . 6873 1 955 . 1 1 329 329 THR HG1 H 1 6.203 0.02 . 1 . . . . 319 THR HG1 . 6873 1 956 . 1 1 329 329 THR HG21 H 1 1.347 0.02 . 1 . . . . 319 THR HG2 . 6873 1 957 . 1 1 329 329 THR HG22 H 1 1.347 0.02 . 1 . . . . 319 THR HG2 . 6873 1 958 . 1 1 329 329 THR HG23 H 1 1.347 0.02 . 1 . . . . 319 THR HG2 . 6873 1 959 . 1 1 329 329 THR CA C 13 62.143 0.2 . 1 . . . . 319 THR CA . 6873 1 960 . 1 1 329 329 THR CB C 13 71.218 0.2 . 1 . . . . 319 THR CB . 6873 1 961 . 1 1 329 329 THR CG2 C 13 23.865 0.2 . 1 . . . . 319 THR CG2 . 6873 1 962 . 1 1 329 329 THR N N 15 117.135 0.1 . 1 . . . . 319 THR N . 6873 1 963 . 1 1 330 330 ALA H H 1 9.119 0.02 . 1 . . . . 320 ALA HN . 6873 1 964 . 1 1 330 330 ALA HA H 1 4.025 0.02 . 1 . . . . 320 ALA HA . 6873 1 965 . 1 1 330 330 ALA HB1 H 1 1.388 0.02 . 1 . . . . 320 ALA HB . 6873 1 966 . 1 1 330 330 ALA HB2 H 1 1.388 0.02 . 1 . . . . 320 ALA HB . 6873 1 967 . 1 1 330 330 ALA HB3 H 1 1.388 0.02 . 1 . . . . 320 ALA HB . 6873 1 968 . 1 1 330 330 ALA CA C 13 55.287 0.2 . 1 . . . . 320 ALA CA . 6873 1 969 . 1 1 330 330 ALA CB C 13 18.450 0.2 . 1 . . . . 320 ALA CB . 6873 1 970 . 1 1 330 330 ALA N N 15 123.591 0.1 . 1 . . . . 320 ALA N . 6873 1 971 . 1 1 331 331 ASP H H 1 7.893 0.02 . 1 . . . . 321 ASP HN . 6873 1 972 . 1 1 331 331 ASP HA H 1 4.652 0.02 . 1 . . . . 321 ASP HA . 6873 1 973 . 1 1 331 331 ASP HB2 H 1 2.660 0.02 . 2 . . . . 321 ASP HB1 . 6873 1 974 . 1 1 331 331 ASP CA C 13 53.462 0.2 . 1 . . . . 321 ASP CA . 6873 1 975 . 1 1 331 331 ASP CB C 13 39.851 0.2 . 1 . . . . 321 ASP CB . 6873 1 976 . 1 1 331 331 ASP N N 15 113.184 0.1 . 1 . . . . 321 ASP N . 6873 1 977 . 1 1 332 332 GLU H H 1 8.080 0.02 . 1 . . . . 322 GLU HN . 6873 1 978 . 1 1 332 332 GLU HA H 1 3.355 0.02 . 1 . . . . 322 GLU HA . 6873 1 979 . 1 1 332 332 GLU HB2 H 1 2.276 0.02 . 2 . . . . 322 GLU HB1 . 6873 1 980 . 1 1 332 332 GLU HB3 H 1 2.098 0.02 . 2 . . . . 322 GLU HB2 . 6873 1 981 . 1 1 332 332 GLU HG2 H 1 2.085 0.02 . 2 . . . . 322 GLU HG1 . 6873 1 982 . 1 1 332 332 GLU HG3 H 1 1.995 0.02 . 2 . . . . 322 GLU HG2 . 6873 1 983 . 1 1 332 332 GLU CA C 13 57.987 0.2 . 1 . . . . 322 GLU CA . 6873 1 984 . 1 1 332 332 GLU CB C 13 26.684 0.2 . 1 . . . . 322 GLU CB . 6873 1 985 . 1 1 332 332 GLU CG C 13 37.574 0.2 . 1 . . . . 322 GLU CG . 6873 1 986 . 1 1 332 332 GLU N N 15 113.955 0.1 . 1 . . . . 322 GLU N . 6873 1 987 . 1 1 333 333 VAL H H 1 7.525 0.02 . 1 . . . . 323 VAL HN . 6873 1 988 . 1 1 333 333 VAL HA H 1 3.990 0.02 . 1 . . . . 323 VAL HA . 6873 1 989 . 1 1 333 333 VAL HB H 1 1.983 0.02 . 1 . . . . 323 VAL HB . 6873 1 990 . 1 1 333 333 VAL HG11 H 1 0.541 0.02 . 1 . . . . 323 VAL HG1 . 6873 1 991 . 1 1 333 333 VAL HG12 H 1 0.541 0.02 . 1 . . . . 323 VAL HG1 . 6873 1 992 . 1 1 333 333 VAL HG13 H 1 0.541 0.02 . 1 . . . . 323 VAL HG1 . 6873 1 993 . 1 1 333 333 VAL HG21 H 1 0.730 0.02 . 1 . . . . 323 VAL HG2 . 6873 1 994 . 1 1 333 333 VAL HG22 H 1 0.730 0.02 . 1 . . . . 323 VAL HG2 . 6873 1 995 . 1 1 333 333 VAL HG23 H 1 0.730 0.02 . 1 . . . . 323 VAL HG2 . 6873 1 996 . 1 1 333 333 VAL CA C 13 63.129 0.2 . 1 . . . . 323 VAL CA . 6873 1 997 . 1 1 333 333 VAL CB C 13 31.852 0.2 . 1 . . . . 323 VAL CB . 6873 1 998 . 1 1 333 333 VAL CG1 C 13 21.797 0.2 . 2 . . . . 323 VAL CG1 . 6873 1 999 . 1 1 333 333 VAL CG2 C 13 22.208 0.2 . 2 . . . . 323 VAL CG2 . 6873 1 1000 . 1 1 333 333 VAL N N 15 120.957 0.1 . 1 . . . . 323 VAL N . 6873 1 1001 . 1 1 334 334 HIS H H 1 8.561 0.02 . 1 . . . . 324 HIS HN . 6873 1 1002 . 1 1 334 334 HIS HA H 1 5.187 0.02 . 1 . . . . 324 HIS HA . 6873 1 1003 . 1 1 334 334 HIS HB2 H 1 2.930 0.02 . 2 . . . . 324 HIS HB1 . 6873 1 1004 . 1 1 334 334 HIS HB3 H 1 2.583 0.02 . 2 . . . . 324 HIS HB2 . 6873 1 1005 . 1 1 334 334 HIS HD2 H 1 7.190 0.02 . 1 . . . . 324 HIS HD2 . 6873 1 1006 . 1 1 334 334 HIS HE1 H 1 8.382 0.02 . 1 . . . . 324 HIS HE1 . 6873 1 1007 . 1 1 334 334 HIS CA C 13 54.744 0.2 . 1 . . . . 324 HIS CA . 6873 1 1008 . 1 1 334 334 HIS CB C 13 30.972 0.2 . 1 . . . . 324 HIS CB . 6873 1 1009 . 1 1 334 334 HIS CD2 C 13 119.912 0.2 . 1 . . . . 324 HIS CD2 . 6873 1 1010 . 1 1 334 334 HIS CE1 C 13 135.467 0.2 . 1 . . . . 324 HIS CE1 . 6873 1 1011 . 1 1 334 334 HIS N N 15 124.072 0.1 . 1 . . . . 324 HIS N . 6873 1 1012 . 1 1 335 335 TYR H H 1 9.216 0.02 . 1 . . . . 325 TYR HN . 6873 1 1013 . 1 1 335 335 TYR HA H 1 4.475 0.02 . 1 . . . . 325 TYR HA . 6873 1 1014 . 1 1 335 335 TYR HB2 H 1 2.377 0.02 . 2 . . . . 325 TYR HB1 . 6873 1 1015 . 1 1 335 335 TYR HB3 H 1 2.485 0.02 . 2 . . . . 325 TYR HB2 . 6873 1 1016 . 1 1 335 335 TYR HD1 H 1 6.756 0.02 . 3 . . . . 325 TYR HD1 . 6873 1 1017 . 1 1 335 335 TYR HE1 H 1 6.692 0.02 . 3 . . . . 325 TYR HE1 . 6873 1 1018 . 1 1 335 335 TYR CA C 13 57.365 0.2 . 1 . . . . 325 TYR CA . 6873 1 1019 . 1 1 335 335 TYR CB C 13 41.620 0.2 . 1 . . . . 325 TYR CB . 6873 1 1020 . 1 1 335 335 TYR CD1 C 13 132.658 0.2 . 3 . . . . 325 TYR CD1 . 6873 1 1021 . 1 1 335 335 TYR CE1 C 13 118.762 0.2 . 3 . . . . 325 TYR CE1 . 6873 1 1022 . 1 1 335 335 TYR N N 15 121.567 0.1 . 1 . . . . 325 TYR N . 6873 1 1023 . 1 1 336 336 PHE H H 1 8.873 0.02 . 1 . . . . 326 PHE HN . 6873 1 1024 . 1 1 336 336 PHE HA H 1 4.910 0.02 . 1 . . . . 326 PHE HA . 6873 1 1025 . 1 1 336 336 PHE HB2 H 1 2.816 0.02 . 2 . . . . 326 PHE HB1 . 6873 1 1026 . 1 1 336 336 PHE HB3 H 1 2.611 0.02 . 2 . . . . 326 PHE HB2 . 6873 1 1027 . 1 1 336 336 PHE HD1 H 1 7.011 0.02 . 3 . . . . 326 PHE HD1 . 6873 1 1028 . 1 1 336 336 PHE HE1 H 1 7.122 0.02 . 3 . . . . 326 PHE HE1 . 6873 1 1029 . 1 1 336 336 PHE HZ H 1 7.082 0.02 . 1 . . . . 326 PHE HZ . 6873 1 1030 . 1 1 336 336 PHE CA C 13 57.986 0.2 . 1 . . . . 326 PHE CA . 6873 1 1031 . 1 1 336 336 PHE CB C 13 41.810 0.2 . 1 . . . . 326 PHE CB . 6873 1 1032 . 1 1 336 336 PHE CD1 C 13 131.439 0.2 . 3 . . . . 326 PHE CD1 . 6873 1 1033 . 1 1 336 336 PHE CE1 C 13 131.200 0.2 . 3 . . . . 326 PHE CE1 . 6873 1 1034 . 1 1 336 336 PHE CZ C 13 130.600 0.2 . 1 . . . . 326 PHE CZ . 6873 1 1035 . 1 1 336 336 PHE N N 15 121.856 0.1 . 1 . . . . 326 PHE N . 6873 1 1036 . 1 1 337 337 LEU H H 1 8.468 0.02 . 1 . . . . 327 LEU HN . 6873 1 1037 . 1 1 337 337 LEU HA H 1 5.287 0.02 . 1 . . . . 327 LEU HA . 6873 1 1038 . 1 1 337 337 LEU HB2 H 1 0.327 0.02 . 2 . . . . 327 LEU HB1 . 6873 1 1039 . 1 1 337 337 LEU HB3 H 1 -0.293 0.02 . 2 . . . . 327 LEU HB2 . 6873 1 1040 . 1 1 337 337 LEU HG H 1 0.853 0.02 . 1 . . . . 327 LEU HG . 6873 1 1041 . 1 1 337 337 LEU HD11 H 1 -0.078 0.02 . 1 . . . . 327 LEU HD1 . 6873 1 1042 . 1 1 337 337 LEU HD12 H 1 -0.078 0.02 . 1 . . . . 327 LEU HD1 . 6873 1 1043 . 1 1 337 337 LEU HD13 H 1 -0.078 0.02 . 1 . . . . 327 LEU HD1 . 6873 1 1044 . 1 1 337 337 LEU HD21 H 1 0.246 0.02 . 1 . . . . 327 LEU HD2 . 6873 1 1045 . 1 1 337 337 LEU HD22 H 1 0.246 0.02 . 1 . . . . 327 LEU HD2 . 6873 1 1046 . 1 1 337 337 LEU HD23 H 1 0.246 0.02 . 1 . . . . 327 LEU HD2 . 6873 1 1047 . 1 1 337 337 LEU CA C 13 53.179 0.2 . 1 . . . . 327 LEU CA . 6873 1 1048 . 1 1 337 337 LEU CB C 13 44.822 0.2 . 1 . . . . 327 LEU CB . 6873 1 1049 . 1 1 337 337 LEU CG C 13 27.716 0.2 . 1 . . . . 327 LEU CG . 6873 1 1050 . 1 1 337 337 LEU CD1 C 13 25.436 0.2 . 2 . . . . 327 LEU CD1 . 6873 1 1051 . 1 1 337 337 LEU CD2 C 13 25.351 0.2 . 2 . . . . 327 LEU CD2 . 6873 1 1052 . 1 1 337 337 LEU N N 15 123.334 0.1 . 1 . . . . 327 LEU N . 6873 1 1053 . 1 1 338 338 GLN H H 1 8.695 0.02 . 1 . . . . 328 GLN HN . 6873 1 1054 . 1 1 338 338 GLN HA H 1 4.844 0.02 . 1 . . . . 328 GLN HA . 6873 1 1055 . 1 1 338 338 GLN HB2 H 1 1.637 0.02 . 2 . . . . 328 GLN HB1 . 6873 1 1056 . 1 1 338 338 GLN HB3 H 1 1.165 0.02 . 2 . . . . 328 GLN HB2 . 6873 1 1057 . 1 1 338 338 GLN HG2 H 1 2.066 0.02 . 2 . . . . 328 GLN HG1 . 6873 1 1058 . 1 1 338 338 GLN HG3 H 1 1.838 0.02 . 2 . . . . 328 GLN HG2 . 6873 1 1059 . 1 1 338 338 GLN HE21 H 1 6.105 0.02 . 2 . . . . 328 GLN HE21 . 6873 1 1060 . 1 1 338 338 GLN HE22 H 1 4.961 0.02 . 2 . . . . 328 GLN HE22 . 6873 1 1061 . 1 1 338 338 GLN CA C 13 55.356 0.2 . 1 . . . . 328 GLN CA . 6873 1 1062 . 1 1 338 338 GLN CB C 13 32.424 0.2 . 1 . . . . 328 GLN CB . 6873 1 1063 . 1 1 338 338 GLN CG C 13 34.200 0.2 . 1 . . . . 328 GLN CG . 6873 1 1064 . 1 1 338 338 GLN N N 15 117.745 0.1 . 1 . . . . 328 GLN N . 6873 1 1065 . 1 1 338 338 GLN NE2 N 15 107.700 0.1 . 1 . . . . 328 GLN NE2 . 6873 1 1066 . 1 1 339 339 ALA H H 1 8.197 0.02 . 1 . . . . 329 ALA HN . 6873 1 1067 . 1 1 339 339 ALA HA H 1 4.800 0.02 . 1 . . . . 329 ALA HA . 6873 1 1068 . 1 1 339 339 ALA HB1 H 1 1.583 0.02 . 1 . . . . 329 ALA HB . 6873 1 1069 . 1 1 339 339 ALA HB2 H 1 1.583 0.02 . 1 . . . . 329 ALA HB . 6873 1 1070 . 1 1 339 339 ALA HB3 H 1 1.583 0.02 . 1 . . . . 329 ALA HB . 6873 1 1071 . 1 1 339 339 ALA CA C 13 50.385 0.2 . 1 . . . . 329 ALA CA . 6873 1 1072 . 1 1 339 339 ALA CB C 13 21.954 0.2 . 1 . . . . 329 ALA CB . 6873 1 1073 . 1 1 339 339 ALA N N 15 128.055 0.1 . 1 . . . . 329 ALA N . 6873 1 1074 . 1 1 340 340 ALA H H 1 9.180 0.02 . 1 . . . . 330 ALA HN . 6873 1 1075 . 1 1 340 340 ALA HA H 1 4.179 0.02 . 1 . . . . 330 ALA HA . 6873 1 1076 . 1 1 340 340 ALA HB1 H 1 1.497 0.02 . 1 . . . . 330 ALA HB . 6873 1 1077 . 1 1 340 340 ALA HB2 H 1 1.497 0.02 . 1 . . . . 330 ALA HB . 6873 1 1078 . 1 1 340 340 ALA HB3 H 1 1.497 0.02 . 1 . . . . 330 ALA HB . 6873 1 1079 . 1 1 340 340 ALA CA C 13 54.635 0.2 . 1 . . . . 330 ALA CA . 6873 1 1080 . 1 1 340 340 ALA CB C 13 20.529 0.2 . 1 . . . . 330 ALA CB . 6873 1 1081 . 1 1 340 340 ALA N N 15 120.411 0.1 . 1 . . . . 330 ALA N . 6873 1 1082 . 1 1 341 341 THR H H 1 7.088 0.02 . 1 . . . . 331 THR HN . 6873 1 1083 . 1 1 341 341 THR HA H 1 4.797 0.02 . 1 . . . . 331 THR HA . 6873 1 1084 . 1 1 341 341 THR HB H 1 4.571 0.02 . 1 . . . . 331 THR HB . 6873 1 1085 . 1 1 341 341 THR HG21 H 1 1.173 0.02 . 1 . . . . 331 THR HG2 . 6873 1 1086 . 1 1 341 341 THR HG22 H 1 1.173 0.02 . 1 . . . . 331 THR HG2 . 6873 1 1087 . 1 1 341 341 THR HG23 H 1 1.173 0.02 . 1 . . . . 331 THR HG2 . 6873 1 1088 . 1 1 341 341 THR CA C 13 58.197 0.2 . 1 . . . . 331 THR CA . 6873 1 1089 . 1 1 341 341 THR CB C 13 71.900 0.2 . 1 . . . . 331 THR CB . 6873 1 1090 . 1 1 341 341 THR CG2 C 13 22.444 0.2 . 1 . . . . 331 THR CG2 . 6873 1 1091 . 1 1 341 341 THR N N 15 103.131 0.1 . 1 . . . . 331 THR N . 6873 1 1092 . 1 1 342 342 PRO HA H 1 4.150 0.02 . 1 . . . . 332 PRO HA . 6873 1 1093 . 1 1 342 342 PRO HB2 H 1 2.390 0.02 . 2 . . . . 332 PRO HB1 . 6873 1 1094 . 1 1 342 342 PRO HB3 H 1 1.955 0.02 . 2 . . . . 332 PRO HB2 . 6873 1 1095 . 1 1 342 342 PRO HG2 H 1 2.119 0.02 . 2 . . . . 332 PRO HG1 . 6873 1 1096 . 1 1 342 342 PRO HD2 H 1 3.951 0.02 . 2 . . . . 332 PRO HD1 . 6873 1 1097 . 1 1 342 342 PRO HD3 H 1 3.820 0.02 . 2 . . . . 332 PRO HD2 . 6873 1 1098 . 1 1 342 342 PRO CA C 13 65.500 0.2 . 1 . . . . 332 PRO CA . 6873 1 1099 . 1 1 342 342 PRO CB C 13 31.900 0.2 . 1 . . . . 332 PRO CB . 6873 1 1100 . 1 1 342 342 PRO CG C 13 27.800 0.2 . 1 . . . . 332 PRO CG . 6873 1 1101 . 1 1 342 342 PRO CD C 13 51.100 0.2 . 1 . . . . 332 PRO CD . 6873 1 1102 . 1 1 343 343 LYS H H 1 7.690 0.02 . 1 . . . . 333 LYS HN . 6873 1 1103 . 1 1 343 343 LYS HA H 1 3.970 0.02 . 1 . . . . 333 LYS HA . 6873 1 1104 . 1 1 343 343 LYS HB2 H 1 1.810 0.02 . 2 . . . . 333 LYS HB1 . 6873 1 1105 . 1 1 343 343 LYS HB3 H 1 1.630 0.02 . 2 . . . . 333 LYS HB2 . 6873 1 1106 . 1 1 343 343 LYS HG2 H 1 1.332 0.02 . 2 . . . . 333 LYS HG1 . 6873 1 1107 . 1 1 343 343 LYS HD2 H 1 1.544 0.02 . 2 . . . . 333 LYS HD1 . 6873 1 1108 . 1 1 343 343 LYS HE2 H 1 2.891 0.02 . 2 . . . . 333 LYS HE1 . 6873 1 1109 . 1 1 343 343 LYS CA C 13 59.600 0.2 . 1 . . . . 333 LYS CA . 6873 1 1110 . 1 1 343 343 LYS CB C 13 33.100 0.2 . 1 . . . . 333 LYS CB . 6873 1 1111 . 1 1 343 343 LYS CG C 13 25.050 0.2 . 1 . . . . 333 LYS CG . 6873 1 1112 . 1 1 343 343 LYS CD C 13 29.550 0.2 . 1 . . . . 333 LYS CD . 6873 1 1113 . 1 1 343 343 LYS CE C 13 42.300 0.2 . 1 . . . . 333 LYS CE . 6873 1 1114 . 1 1 343 343 LYS N N 15 119.200 0.1 . 1 . . . . 333 LYS N . 6873 1 1115 . 1 1 344 344 GLU H H 1 7.941 0.02 . 1 . . . . 334 GLU HN . 6873 1 1116 . 1 1 344 344 GLU HA H 1 4.095 0.02 . 1 . . . . 334 GLU HA . 6873 1 1117 . 1 1 344 344 GLU HB2 H 1 2.249 0.02 . 2 . . . . 334 GLU HB1 . 6873 1 1118 . 1 1 344 344 GLU HB3 H 1 2.144 0.02 . 2 . . . . 334 GLU HB2 . 6873 1 1119 . 1 1 344 344 GLU HG2 H 1 2.483 0.02 . 2 . . . . 334 GLU HG1 . 6873 1 1120 . 1 1 344 344 GLU HG3 H 1 2.359 0.02 . 2 . . . . 334 GLU HG2 . 6873 1 1121 . 1 1 344 344 GLU CA C 13 59.625 0.2 . 1 . . . . 334 GLU CA . 6873 1 1122 . 1 1 344 344 GLU CB C 13 31.441 0.2 . 1 . . . . 334 GLU CB . 6873 1 1123 . 1 1 344 344 GLU CG C 13 39.000 0.2 . 1 . . . . 334 GLU CG . 6873 1 1124 . 1 1 344 344 GLU N N 15 119.287 0.1 . 1 . . . . 334 GLU N . 6873 1 1125 . 1 1 345 345 ARG H H 1 7.740 0.02 . 1 . . . . 335 ARG HN . 6873 1 1126 . 1 1 345 345 ARG HA H 1 3.540 0.02 . 1 . . . . 335 ARG HA . 6873 1 1127 . 1 1 345 345 ARG HB2 H 1 2.232 0.02 . 2 . . . . 335 ARG HB1 . 6873 1 1128 . 1 1 345 345 ARG HB3 H 1 1.487 0.02 . 2 . . . . 335 ARG HB2 . 6873 1 1129 . 1 1 345 345 ARG HG2 H 1 1.300 0.02 . 2 . . . . 335 ARG HG1 . 6873 1 1130 . 1 1 345 345 ARG HG3 H 1 1.148 0.02 . 2 . . . . 335 ARG HG2 . 6873 1 1131 . 1 1 345 345 ARG HD2 H 1 3.250 0.02 . 2 . . . . 335 ARG HD1 . 6873 1 1132 . 1 1 345 345 ARG HD3 H 1 2.682 0.02 . 2 . . . . 335 ARG HD2 . 6873 1 1133 . 1 1 345 345 ARG CA C 13 60.958 0.2 . 1 . . . . 335 ARG CA . 6873 1 1134 . 1 1 345 345 ARG CB C 13 29.907 0.2 . 1 . . . . 335 ARG CB . 6873 1 1135 . 1 1 345 345 ARG CG C 13 26.474 0.2 . 1 . . . . 335 ARG CG . 6873 1 1136 . 1 1 345 345 ARG CD C 13 44.940 0.2 . 1 . . . . 335 ARG CD . 6873 1 1137 . 1 1 345 345 ARG N N 15 118.869 0.1 . 1 . . . . 335 ARG N . 6873 1 1138 . 1 1 346 346 THR H H 1 8.142 0.02 . 1 . . . . 336 THR HN . 6873 1 1139 . 1 1 346 346 THR HA H 1 3.575 0.02 . 1 . . . . 336 THR HA . 6873 1 1140 . 1 1 346 346 THR HB H 1 4.209 0.02 . 1 . . . . 336 THR HB . 6873 1 1141 . 1 1 346 346 THR HG21 H 1 1.137 0.02 . 1 . . . . 336 THR HG2 . 6873 1 1142 . 1 1 346 346 THR HG22 H 1 1.137 0.02 . 1 . . . . 336 THR HG2 . 6873 1 1143 . 1 1 346 346 THR HG23 H 1 1.137 0.02 . 1 . . . . 336 THR HG2 . 6873 1 1144 . 1 1 346 346 THR CA C 13 67.392 0.2 . 1 . . . . 336 THR CA . 6873 1 1145 . 1 1 346 346 THR CB C 13 69.026 0.2 . 1 . . . . 336 THR CB . 6873 1 1146 . 1 1 346 346 THR CG2 C 13 22.467 0.2 . 1 . . . . 336 THR CG2 . 6873 1 1147 . 1 1 346 346 THR N N 15 115.979 0.1 . 1 . . . . 336 THR N . 6873 1 1148 . 1 1 347 347 GLU H H 1 8.210 0.02 . 1 . . . . 337 GLU HN . 6873 1 1149 . 1 1 347 347 GLU HA H 1 3.734 0.02 . 1 . . . . 337 GLU HA . 6873 1 1150 . 1 1 347 347 GLU HB2 H 1 2.081 0.02 . 2 . . . . 337 GLU HB1 . 6873 1 1151 . 1 1 347 347 GLU HB3 H 1 1.505 0.02 . 2 . . . . 337 GLU HB2 . 6873 1 1152 . 1 1 347 347 GLU HG2 H 1 2.419 0.02 . 2 . . . . 337 GLU HG1 . 6873 1 1153 . 1 1 347 347 GLU HG3 H 1 2.076 0.02 . 2 . . . . 337 GLU HG2 . 6873 1 1154 . 1 1 347 347 GLU CA C 13 59.811 0.2 . 1 . . . . 337 GLU CA . 6873 1 1155 . 1 1 347 347 GLU CB C 13 29.905 0.2 . 1 . . . . 337 GLU CB . 6873 1 1156 . 1 1 347 347 GLU CG C 13 37.076 0.2 . 1 . . . . 337 GLU CG . 6873 1 1157 . 1 1 347 347 GLU N N 15 119.608 0.1 . 1 . . . . 337 GLU N . 6873 1 1158 . 1 1 348 348 TRP H H 1 8.252 0.02 . 1 . . . . 338 TRP HN . 6873 1 1159 . 1 1 348 348 TRP HA H 1 3.840 0.02 . 1 . . . . 338 TRP HA . 6873 1 1160 . 1 1 348 348 TRP HB2 H 1 2.730 0.02 . 2 . . . . 338 TRP HB1 . 6873 1 1161 . 1 1 348 348 TRP HB3 H 1 2.840 0.02 . 2 . . . . 338 TRP HB2 . 6873 1 1162 . 1 1 348 348 TRP HD1 H 1 7.240 0.02 . 1 . . . . 338 TRP HD1 . 6873 1 1163 . 1 1 348 348 TRP HE1 H 1 10.885 0.02 . 1 . . . . 338 TRP HE1 . 6873 1 1164 . 1 1 348 348 TRP HE3 H 1 7.330 0.02 . 1 . . . . 338 TRP HE3 . 6873 1 1165 . 1 1 348 348 TRP HZ2 H 1 6.988 0.02 . 1 . . . . 338 TRP HZ2 . 6873 1 1166 . 1 1 348 348 TRP HZ3 H 1 6.809 0.02 . 1 . . . . 338 TRP HZ3 . 6873 1 1167 . 1 1 348 348 TRP HH2 H 1 6.870 0.02 . 1 . . . . 338 TRP HH2 . 6873 1 1168 . 1 1 348 348 TRP CA C 13 62.700 0.2 . 1 . . . . 338 TRP CA . 6873 1 1169 . 1 1 348 348 TRP CB C 13 30.025 0.2 . 1 . . . . 338 TRP CB . 6873 1 1170 . 1 1 348 348 TRP CD1 C 13 127.036 0.2 . 1 . . . . 338 TRP CD1 . 6873 1 1171 . 1 1 348 348 TRP CE3 C 13 118.974 0.2 . 1 . . . . 338 TRP CE3 . 6873 1 1172 . 1 1 348 348 TRP CZ2 C 13 114.219 0.2 . 1 . . . . 338 TRP CZ2 . 6873 1 1173 . 1 1 348 348 TRP CZ3 C 13 121.140 0.2 . 1 . . . . 338 TRP CZ3 . 6873 1 1174 . 1 1 348 348 TRP CH2 C 13 123.873 0.2 . 1 . . . . 338 TRP CH2 . 6873 1 1175 . 1 1 348 348 TRP N N 15 120.859 0.1 . 1 . . . . 338 TRP N . 6873 1 1176 . 1 1 348 348 TRP NE1 N 15 130.094 0.1 . 1 . . . . 338 TRP NE1 . 6873 1 1177 . 1 1 349 349 ILE H H 1 8.205 0.02 . 1 . . . . 339 ILE HN . 6873 1 1178 . 1 1 349 349 ILE HA H 1 3.188 0.02 . 1 . . . . 339 ILE HA . 6873 1 1179 . 1 1 349 349 ILE HB H 1 1.577 0.02 . 1 . . . . 339 ILE HB . 6873 1 1180 . 1 1 349 349 ILE HG12 H 1 1.127 0.02 . 9 . . . . 339 ILE HG11 . 6873 1 1181 . 1 1 349 349 ILE HG13 H 1 0.323 0.02 . 9 . . . . 339 ILE HG12 . 6873 1 1182 . 1 1 349 349 ILE HG21 H 1 0.629 0.02 . 1 . . . . 339 ILE HG2 . 6873 1 1183 . 1 1 349 349 ILE HG22 H 1 0.629 0.02 . 1 . . . . 339 ILE HG2 . 6873 1 1184 . 1 1 349 349 ILE HG23 H 1 0.629 0.02 . 1 . . . . 339 ILE HG2 . 6873 1 1185 . 1 1 349 349 ILE HD11 H 1 0.536 0.02 . 1 . . . . 339 ILE HD1 . 6873 1 1186 . 1 1 349 349 ILE HD12 H 1 0.536 0.02 . 1 . . . . 339 ILE HD1 . 6873 1 1187 . 1 1 349 349 ILE HD13 H 1 0.536 0.02 . 1 . . . . 339 ILE HD1 . 6873 1 1188 . 1 1 349 349 ILE CA C 13 67.426 0.2 . 1 . . . . 339 ILE CA . 6873 1 1189 . 1 1 349 349 ILE CB C 13 38.232 0.2 . 1 . . . . 339 ILE CB . 6873 1 1190 . 1 1 349 349 ILE CG1 C 13 29.307 0.2 . 1 . . . . 339 ILE CG1 . 6873 1 1191 . 1 1 349 349 ILE CG2 C 13 16.387 0.2 . 1 . . . . 339 ILE CG2 . 6873 1 1192 . 1 1 349 349 ILE CD1 C 13 14.914 0.2 . 1 . . . . 339 ILE CD1 . 6873 1 1193 . 1 1 349 349 ILE N N 15 118.869 0.1 . 1 . . . . 339 ILE N . 6873 1 1194 . 1 1 350 350 LYS H H 1 7.986 0.02 . 1 . . . . 340 LYS HN . 6873 1 1195 . 1 1 350 350 LYS HA H 1 3.925 0.02 . 1 . . . . 340 LYS HA . 6873 1 1196 . 1 1 350 350 LYS HB2 H 1 1.685 0.02 . 2 . . . . 340 LYS HB1 . 6873 1 1197 . 1 1 350 350 LYS HG2 H 1 1.465 0.02 . 2 . . . . 340 LYS HG1 . 6873 1 1198 . 1 1 350 350 LYS HG3 H 1 1.335 0.02 . 2 . . . . 340 LYS HG2 . 6873 1 1199 . 1 1 350 350 LYS HD2 H 1 1.544 0.02 . 2 . . . . 340 LYS HD1 . 6873 1 1200 . 1 1 350 350 LYS HE2 H 1 2.829 0.02 . 2 . . . . 340 LYS HE1 . 6873 1 1201 . 1 1 350 350 LYS CA C 13 59.724 0.2 . 1 . . . . 340 LYS CA . 6873 1 1202 . 1 1 350 350 LYS CB C 13 32.651 0.2 . 1 . . . . 340 LYS CB . 6873 1 1203 . 1 1 350 350 LYS CG C 13 25.527 0.2 . 1 . . . . 340 LYS CG . 6873 1 1204 . 1 1 350 350 LYS CD C 13 29.300 0.2 . 1 . . . . 340 LYS CD . 6873 1 1205 . 1 1 350 350 LYS CE C 13 42.330 0.2 . 1 . . . . 340 LYS CE . 6873 1 1206 . 1 1 350 350 LYS N N 15 117.167 0.1 . 1 . . . . 340 LYS N . 6873 1 1207 . 1 1 351 351 ALA H H 1 7.617 0.02 . 1 . . . . 341 ALA HN . 6873 1 1208 . 1 1 351 351 ALA HA H 1 3.988 0.02 . 1 . . . . 341 ALA HA . 6873 1 1209 . 1 1 351 351 ALA HB1 H 1 1.090 0.02 . 1 . . . . 341 ALA HB . 6873 1 1210 . 1 1 351 351 ALA HB2 H 1 1.090 0.02 . 1 . . . . 341 ALA HB . 6873 1 1211 . 1 1 351 351 ALA HB3 H 1 1.090 0.02 . 1 . . . . 341 ALA HB . 6873 1 1212 . 1 1 351 351 ALA CA C 13 55.514 0.2 . 1 . . . . 341 ALA CA . 6873 1 1213 . 1 1 351 351 ALA CB C 13 18.656 0.2 . 1 . . . . 341 ALA CB . 6873 1 1214 . 1 1 351 351 ALA N N 15 120.668 0.1 . 1 . . . . 341 ALA N . 6873 1 1215 . 1 1 352 352 ILE H H 1 8.546 0.02 . 1 . . . . 342 ILE HN . 6873 1 1216 . 1 1 352 352 ILE HA H 1 3.464 0.02 . 1 . . . . 342 ILE HA . 6873 1 1217 . 1 1 352 352 ILE HB H 1 1.857 0.02 . 1 . . . . 342 ILE HB . 6873 1 1218 . 1 1 352 352 ILE HG12 H 1 0.925 0.02 . 9 . . . . 342 ILE HG11 . 6873 1 1219 . 1 1 352 352 ILE HG13 H 1 2.245 0.02 . 9 . . . . 342 ILE HG12 . 6873 1 1220 . 1 1 352 352 ILE HG21 H 1 0.761 0.02 . 1 . . . . 342 ILE HG2 . 6873 1 1221 . 1 1 352 352 ILE HG22 H 1 0.761 0.02 . 1 . . . . 342 ILE HG2 . 6873 1 1222 . 1 1 352 352 ILE HG23 H 1 0.761 0.02 . 1 . . . . 342 ILE HG2 . 6873 1 1223 . 1 1 352 352 ILE HD11 H 1 0.923 0.02 . 1 . . . . 342 ILE HD1 . 6873 1 1224 . 1 1 352 352 ILE HD12 H 1 0.923 0.02 . 1 . . . . 342 ILE HD1 . 6873 1 1225 . 1 1 352 352 ILE HD13 H 1 0.923 0.02 . 1 . . . . 342 ILE HD1 . 6873 1 1226 . 1 1 352 352 ILE CA C 13 66.278 0.2 . 1 . . . . 342 ILE CA . 6873 1 1227 . 1 1 352 352 ILE CB C 13 38.756 0.2 . 1 . . . . 342 ILE CB . 6873 1 1228 . 1 1 352 352 ILE CG1 C 13 31.216 0.2 . 1 . . . . 342 ILE CG1 . 6873 1 1229 . 1 1 352 352 ILE CG2 C 13 19.119 0.2 . 1 . . . . 342 ILE CG2 . 6873 1 1230 . 1 1 352 352 ILE CD1 C 13 15.128 0.2 . 1 . . . . 342 ILE CD1 . 6873 1 1231 . 1 1 352 352 ILE N N 15 118.965 0.1 . 1 . . . . 342 ILE N . 6873 1 1232 . 1 1 353 353 GLN H H 1 8.685 0.02 . 1 . . . . 343 GLN HN . 6873 1 1233 . 1 1 353 353 GLN HA H 1 3.786 0.02 . 1 . . . . 343 GLN HA . 6873 1 1234 . 1 1 353 353 GLN HB2 H 1 2.222 0.02 . 2 . . . . 343 GLN HB1 . 6873 1 1235 . 1 1 353 353 GLN HB3 H 1 1.836 0.02 . 2 . . . . 343 GLN HB2 . 6873 1 1236 . 1 1 353 353 GLN HG2 H 1 2.529 0.02 . 2 . . . . 343 GLN HG1 . 6873 1 1237 . 1 1 353 353 GLN HG3 H 1 2.226 0.02 . 2 . . . . 343 GLN HG2 . 6873 1 1238 . 1 1 353 353 GLN HE21 H 1 7.265 0.02 . 2 . . . . 343 GLN HE21 . 6873 1 1239 . 1 1 353 353 GLN HE22 H 1 6.651 0.02 . 2 . . . . 343 GLN HE22 . 6873 1 1240 . 1 1 353 353 GLN CA C 13 59.883 0.2 . 1 . . . . 343 GLN CA . 6873 1 1241 . 1 1 353 353 GLN CB C 13 28.424 0.2 . 1 . . . . 343 GLN CB . 6873 1 1242 . 1 1 353 353 GLN CG C 13 35.019 0.2 . 1 . . . . 343 GLN CG . 6873 1 1243 . 1 1 353 353 GLN N N 15 119.769 0.1 . 1 . . . . 343 GLN N . 6873 1 1244 . 1 1 353 353 GLN NE2 N 15 111.253 0.1 . 1 . . . . 343 GLN NE2 . 6873 1 1245 . 1 1 354 354 MET H H 1 8.201 0.02 . 1 . . . . 344 MET HN . 6873 1 1246 . 1 1 354 354 MET HA H 1 4.080 0.02 . 1 . . . . 344 MET HA . 6873 1 1247 . 1 1 354 354 MET HB2 H 1 2.618 0.02 . 2 . . . . 344 MET HB1 . 6873 1 1248 . 1 1 354 354 MET HB3 H 1 2.486 0.02 . 2 . . . . 344 MET HB2 . 6873 1 1249 . 1 1 354 354 MET HG2 H 1 2.137 0.02 . 2 . . . . 344 MET HG1 . 6873 1 1250 . 1 1 354 354 MET HE1 H 1 2.131 0.02 . 1 . . . . 344 MET HE . 6873 1 1251 . 1 1 354 354 MET HE2 H 1 2.131 0.02 . 1 . . . . 344 MET HE . 6873 1 1252 . 1 1 354 354 MET HE3 H 1 2.131 0.02 . 1 . . . . 344 MET HE . 6873 1 1253 . 1 1 354 354 MET CA C 13 59.074 0.2 . 1 . . . . 344 MET CA . 6873 1 1254 . 1 1 354 354 MET CB C 13 32.347 0.2 . 1 . . . . 344 MET CB . 6873 1 1255 . 1 1 354 354 MET CG C 13 32.400 0.2 . 1 . . . . 344 MET CG . 6873 1 1256 . 1 1 354 354 MET CE C 13 17.240 0.2 . 1 . . . . 344 MET CE . 6873 1 1257 . 1 1 354 354 MET N N 15 118.869 0.1 . 1 . . . . 344 MET N . 6873 1 1258 . 1 1 355 355 ALA H H 1 8.205 0.02 . 1 . . . . 345 ALA HN . 6873 1 1259 . 1 1 355 355 ALA HA H 1 4.171 0.02 . 1 . . . . 345 ALA HA . 6873 1 1260 . 1 1 355 355 ALA HB1 H 1 1.427 0.02 . 1 . . . . 345 ALA HB . 6873 1 1261 . 1 1 355 355 ALA HB2 H 1 1.427 0.02 . 1 . . . . 345 ALA HB . 6873 1 1262 . 1 1 355 355 ALA HB3 H 1 1.427 0.02 . 1 . . . . 345 ALA HB . 6873 1 1263 . 1 1 355 355 ALA CA C 13 55.133 0.2 . 1 . . . . 345 ALA CA . 6873 1 1264 . 1 1 355 355 ALA CB C 13 18.902 0.2 . 1 . . . . 345 ALA CB . 6873 1 1265 . 1 1 355 355 ALA N N 15 121.952 0.1 . 1 . . . . 345 ALA N . 6873 1 1266 . 1 1 356 356 SER H H 1 8.087 0.02 . 1 . . . . 346 SER HN . 6873 1 1267 . 1 1 356 356 SER HA H 1 3.957 0.02 . 1 . . . . 346 SER HA . 6873 1 1268 . 1 1 356 356 SER HB2 H 1 3.810 0.02 . 2 . . . . 346 SER HB1 . 6873 1 1269 . 1 1 356 356 SER HB3 H 1 4.085 0.02 . 2 . . . . 346 SER HB2 . 6873 1 1270 . 1 1 356 356 SER CA C 13 60.560 0.2 . 1 . . . . 346 SER CA . 6873 1 1271 . 1 1 356 356 SER CB C 13 64.529 0.2 . 1 . . . . 346 SER CB . 6873 1 1272 . 1 1 356 356 SER N N 15 110.326 0.1 . 1 . . . . 346 SER N . 6873 1 1273 . 1 1 357 357 ARG H H 1 7.284 0.02 . 1 . . . . 347 ARG HN . 6873 1 1274 . 1 1 357 357 ARG HA H 1 4.320 0.02 . 1 . . . . 347 ARG HA . 6873 1 1275 . 1 1 357 357 ARG HB2 H 1 1.957 0.02 . 2 . . . . 347 ARG HB1 . 6873 1 1276 . 1 1 357 357 ARG HB3 H 1 1.880 0.02 . 2 . . . . 347 ARG HB2 . 6873 1 1277 . 1 1 357 357 ARG HG2 H 1 1.700 0.02 . 2 . . . . 347 ARG HG1 . 6873 1 1278 . 1 1 357 357 ARG HD2 H 1 3.160 0.02 . 2 . . . . 347 ARG HD1 . 6873 1 1279 . 1 1 357 357 ARG HD3 H 1 3.121 0.02 . 2 . . . . 347 ARG HD2 . 6873 1 1280 . 1 1 357 357 ARG CA C 13 57.000 0.2 . 1 . . . . 347 ARG CA . 6873 1 1281 . 1 1 357 357 ARG CB C 13 30.829 0.2 . 1 . . . . 347 ARG CB . 6873 1 1282 . 1 1 357 357 ARG CG C 13 27.472 0.2 . 1 . . . . 347 ARG CG . 6873 1 1283 . 1 1 357 357 ARG CD C 13 44.200 0.2 . 1 . . . . 347 ARG CD . 6873 1 1284 . 1 1 357 357 ARG N N 15 120.090 0.1 . 1 . . . . 347 ARG N . 6873 1 1285 . 1 1 358 358 THR H H 1 7.950 0.02 . 1 . . . . 348 THR HN . 6873 1 1286 . 1 1 358 358 THR HA H 1 4.290 0.02 . 1 . . . . 348 THR HA . 6873 1 1287 . 1 1 358 358 THR HB H 1 4.215 0.02 . 1 . . . . 348 THR HB . 6873 1 1288 . 1 1 358 358 THR HG21 H 1 1.229 0.02 . 1 . . . . 348 THR HG2 . 6873 1 1289 . 1 1 358 358 THR HG22 H 1 1.229 0.02 . 1 . . . . 348 THR HG2 . 6873 1 1290 . 1 1 358 358 THR HG23 H 1 1.229 0.02 . 1 . . . . 348 THR HG2 . 6873 1 1291 . 1 1 358 358 THR CA C 13 62.987 0.2 . 1 . . . . 348 THR CA . 6873 1 1292 . 1 1 358 358 THR CB C 13 70.465 0.2 . 1 . . . . 348 THR CB . 6873 1 1293 . 1 1 358 358 THR CG2 C 13 22.182 0.2 . 1 . . . . 348 THR CG2 . 6873 1 1294 . 1 1 358 358 THR N N 15 113.441 0.1 . 1 . . . . 348 THR N . 6873 1 1295 . 1 1 359 359 GLY H H 1 8.408 0.02 . 1 . . . . 349 GLY HN . 6873 1 1296 . 1 1 359 359 GLY HA2 H 1 3.995 0.02 . 2 . . . . 349 GLY HA1 . 6873 1 1297 . 1 1 359 359 GLY HA3 H 1 3.904 0.02 . 2 . . . . 349 GLY HA2 . 6873 1 1298 . 1 1 359 359 GLY CA C 13 45.757 0.2 . 1 . . . . 349 GLY CA . 6873 1 1299 . 1 1 360 360 LYS H H 1 7.887 0.02 . 1 . . . . 350 LYS HN . 6873 1 1300 . 1 1 360 360 LYS HA H 1 4.119 0.02 . 1 . . . . 350 LYS HA . 6873 1 1301 . 1 1 360 360 LYS HB2 H 1 1.789 0.02 . 2 . . . . 350 LYS HB1 . 6873 1 1302 . 1 1 360 360 LYS HB3 H 1 1.649 0.02 . 2 . . . . 350 LYS HB2 . 6873 1 1303 . 1 1 360 360 LYS HG2 H 1 1.339 0.02 . 2 . . . . 350 LYS HG1 . 6873 1 1304 . 1 1 360 360 LYS HD2 H 1 1.612 0.02 . 2 . . . . 350 LYS HD1 . 6873 1 1305 . 1 1 360 360 LYS HE2 H 1 2.897 0.02 . 2 . . . . 350 LYS HE1 . 6873 1 1306 . 1 1 360 360 LYS CA C 13 57.900 0.2 . 1 . . . . 350 LYS CA . 6873 1 1307 . 1 1 360 360 LYS CB C 13 34.048 0.2 . 1 . . . . 350 LYS CB . 6873 1 1308 . 1 1 360 360 LYS CG C 13 25.396 0.2 . 1 . . . . 350 LYS CG . 6873 1 1309 . 1 1 360 360 LYS CD C 13 29.552 0.2 . 1 . . . . 350 LYS CD . 6873 1 1310 . 1 1 360 360 LYS CE C 13 42.540 0.2 . 1 . . . . 350 LYS CE . 6873 1 1311 . 1 1 360 360 LYS N N 15 125.839 0.1 . 1 . . . . 350 LYS N . 6873 1 stop_ save_