data_28063 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 28063 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical shift Assignments for SWIRM domain of BAF155 and RPT1 of hSNF5 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-01-22 _Entry.Accession_date 2020-01-22 _Entry.Last_release_date 2020-01-22 _Entry.Original_release_date 2020-01-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jeongmin Han . . . . 28063 2 Iktae Kim . . . . 28063 3 Jeong-Yong Suh . . . . 28063 4 Weontae Lee . . . . 28063 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 28063 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 152 28063 '15N chemical shifts' 85 28063 '1H chemical shifts' 85 28063 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2021-07-16 . original BMRB . 28063 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19204 . 28063 BMRB 28062 'RPT1 with SWRIM heterodimer' 28063 BMRB 28064 'RPT1 monomer' 28063 PDB 6KZ7 . 28063 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 28063 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32244797 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; A Coil-to-Helix Transition Serves as a Binding Motif for hSNF5 and BAF155 Interaction ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Int. J. Mol. Sci.' _Citation.Journal_name_full 'International journal of molecular sciences' _Citation.Journal_volume 21 _Citation.Journal_issue 7 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1422-0067 _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 2452 _Citation.Page_last 2452 _Citation.Year 2020 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Jeongmin Han J. . . . 28063 1 2 Iktae Kim I. . . . 28063 1 3 Jae-Hyun Park J. H. . . 28063 1 4 Ji-Hye Yun J. H. . . 28063 1 5 Keehyoung Joo K. . . . 28063 1 6 Taehee Kim T. . . . 28063 1 7 Gye-Young Park G. Y. . . 28063 1 8 Kyoung-Seok Ryu K. S. . . 28063 1 9 Yoon-Joo Ko Y. J. . . 28063 1 10 Kenji Mizutani K. . . . 28063 1 11 Sam-Young Park S. Y. . . 28063 1 12 'Rho Hyun' Seong R. H. . . 28063 1 13 Jooyoung Lee J. . . . 28063 1 14 Jeong-Yong Suh J. Y. . . 28063 1 15 Weontae Lee W. . . . 28063 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 28063 _Assembly.ID 1 _Assembly.Name 'SWIRM with RPT1 heterodimer' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'subunit 1' 1 $SWIRM A . yes native no no . . . 28063 1 2 'subunit 2' 2 $RPT1 B . no native no no . . . 28063 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SWIRM _Entity.Sf_category entity _Entity.Sf_framecode SWIRM _Entity.Entry_ID 28063 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SWIRM _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 ; IIIPSYASWFDYNCIHVIER RALPEFFNGKNKSKTPEIYL AYRNFMIDTYRLNPQEYLTS TACRRNLTGDVCAVMRVHAF LEQWGLVNYQVDPESRPM ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 98 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 449 ILE . 28063 1 2 450 ILE . 28063 1 3 451 ILE . 28063 1 4 452 PRO . 28063 1 5 453 SER . 28063 1 6 454 TYR . 28063 1 7 455 ALA . 28063 1 8 456 SER . 28063 1 9 457 TRP . 28063 1 10 458 PHE . 28063 1 11 459 ASP . 28063 1 12 460 TYR . 28063 1 13 461 ASN . 28063 1 14 462 CYS . 28063 1 15 463 ILE . 28063 1 16 464 HIS . 28063 1 17 465 VAL . 28063 1 18 466 ILE . 28063 1 19 467 GLU . 28063 1 20 468 ARG . 28063 1 21 469 ARG . 28063 1 22 470 ALA . 28063 1 23 471 LEU . 28063 1 24 472 PRO . 28063 1 25 473 GLU . 28063 1 26 474 PHE . 28063 1 27 475 PHE . 28063 1 28 476 ASN . 28063 1 29 477 GLY . 28063 1 30 478 LYS . 28063 1 31 479 ASN . 28063 1 32 480 LYS . 28063 1 33 481 SER . 28063 1 34 482 LYS . 28063 1 35 483 THR . 28063 1 36 484 PRO . 28063 1 37 485 GLU . 28063 1 38 486 ILE . 28063 1 39 487 TYR . 28063 1 40 488 LEU . 28063 1 41 489 ALA . 28063 1 42 490 TYR . 28063 1 43 491 ARG . 28063 1 44 492 ASN . 28063 1 45 493 PHE . 28063 1 46 494 MET . 28063 1 47 495 ILE . 28063 1 48 496 ASP . 28063 1 49 497 THR . 28063 1 50 498 TYR . 28063 1 51 499 ARG . 28063 1 52 500 LEU . 28063 1 53 501 ASN . 28063 1 54 502 PRO . 28063 1 55 503 GLN . 28063 1 56 504 GLU . 28063 1 57 505 TYR . 28063 1 58 506 LEU . 28063 1 59 507 THR . 28063 1 60 508 SER . 28063 1 61 509 THR . 28063 1 62 510 ALA . 28063 1 63 511 CYS . 28063 1 64 512 ARG . 28063 1 65 513 ARG . 28063 1 66 514 ASN . 28063 1 67 515 LEU . 28063 1 68 516 THR . 28063 1 69 517 GLY . 28063 1 70 518 ASP . 28063 1 71 519 VAL . 28063 1 72 520 CYS . 28063 1 73 521 ALA . 28063 1 74 522 VAL . 28063 1 75 523 MET . 28063 1 76 524 ARG . 28063 1 77 525 VAL . 28063 1 78 526 HIS . 28063 1 79 527 ALA . 28063 1 80 528 PHE . 28063 1 81 529 LEU . 28063 1 82 530 GLU . 28063 1 83 531 GLN . 28063 1 84 532 TRP . 28063 1 85 533 GLY . 28063 1 86 534 LEU . 28063 1 87 535 VAL . 28063 1 88 536 ASN . 28063 1 89 537 TYR . 28063 1 90 538 GLN . 28063 1 91 539 VAL . 28063 1 92 540 ASP . 28063 1 93 541 PRO . 28063 1 94 542 GLU . 28063 1 95 543 SER . 28063 1 96 544 ARG . 28063 1 97 545 PRO . 28063 1 98 546 MET . 28063 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 . ILE 1 1 28063 1 . ILE 2 2 28063 1 . ILE 3 3 28063 1 . PRO 4 4 28063 1 . SER 5 5 28063 1 . TYR 6 6 28063 1 . ALA 7 7 28063 1 . SER 8 8 28063 1 . TRP 9 9 28063 1 . PHE 10 10 28063 1 . ASP 11 11 28063 1 . TYR 12 12 28063 1 . ASN 13 13 28063 1 . CYS 14 14 28063 1 . ILE 15 15 28063 1 . HIS 16 16 28063 1 . VAL 17 17 28063 1 . ILE 18 18 28063 1 . GLU 19 19 28063 1 . ARG 20 20 28063 1 . ARG 21 21 28063 1 . ALA 22 22 28063 1 . LEU 23 23 28063 1 . PRO 24 24 28063 1 . GLU 25 25 28063 1 . PHE 26 26 28063 1 . PHE 27 27 28063 1 . ASN 28 28 28063 1 . GLY 29 29 28063 1 . LYS 30 30 28063 1 . ASN 31 31 28063 1 . LYS 32 32 28063 1 . SER 33 33 28063 1 . LYS 34 34 28063 1 . THR 35 35 28063 1 . PRO 36 36 28063 1 . GLU 37 37 28063 1 . ILE 38 38 28063 1 . TYR 39 39 28063 1 . LEU 40 40 28063 1 . ALA 41 41 28063 1 . TYR 42 42 28063 1 . ARG 43 43 28063 1 . ASN 44 44 28063 1 . PHE 45 45 28063 1 . MET 46 46 28063 1 . ILE 47 47 28063 1 . ASP 48 48 28063 1 . THR 49 49 28063 1 . TYR 50 50 28063 1 . ARG 51 51 28063 1 . LEU 52 52 28063 1 . ASN 53 53 28063 1 . PRO 54 54 28063 1 . GLN 55 55 28063 1 . GLU 56 56 28063 1 . TYR 57 57 28063 1 . LEU 58 58 28063 1 . THR 59 59 28063 1 . SER 60 60 28063 1 . THR 61 61 28063 1 . ALA 62 62 28063 1 . CYS 63 63 28063 1 . ARG 64 64 28063 1 . ARG 65 65 28063 1 . ASN 66 66 28063 1 . LEU 67 67 28063 1 . THR 68 68 28063 1 . GLY 69 69 28063 1 . ASP 70 70 28063 1 . VAL 71 71 28063 1 . CYS 72 72 28063 1 . ALA 73 73 28063 1 . VAL 74 74 28063 1 . MET 75 75 28063 1 . ARG 76 76 28063 1 . VAL 77 77 28063 1 . HIS 78 78 28063 1 . ALA 79 79 28063 1 . PHE 80 80 28063 1 . LEU 81 81 28063 1 . GLU 82 82 28063 1 . GLN 83 83 28063 1 . TRP 84 84 28063 1 . GLY 85 85 28063 1 . LEU 86 86 28063 1 . VAL 87 87 28063 1 . ASN 88 88 28063 1 . TYR 89 89 28063 1 . GLN 90 90 28063 1 . VAL 91 91 28063 1 . ASP 92 92 28063 1 . PRO 93 93 28063 1 . GLU 94 94 28063 1 . SER 95 95 28063 1 . ARG 96 96 28063 1 . PRO 97 97 28063 1 . MET 98 98 28063 1 stop_ save_ save_RPT1 _Entity.Sf_category entity _Entity.Sf_framecode RPT1 _Entity.Entry_ID 28063 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name RPT1 _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 ; HDPAVIHENASQPEVLVPIR LDMEIDGQKLRDAFTWNMNE KLMTPEMFSEILCDDLDLNP LTFVPAIASAIRQQIESYPT DSILEDQS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 88 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 171 HIS . 28063 2 2 172 ASP . 28063 2 3 173 PRO . 28063 2 4 174 ALA . 28063 2 5 175 VAL . 28063 2 6 176 ILE . 28063 2 7 177 HIS . 28063 2 8 178 GLU . 28063 2 9 179 ASN . 28063 2 10 180 ALA . 28063 2 11 181 SER . 28063 2 12 182 GLN . 28063 2 13 183 PRO . 28063 2 14 184 GLU . 28063 2 15 185 VAL . 28063 2 16 186 LEU . 28063 2 17 187 VAL . 28063 2 18 188 PRO . 28063 2 19 189 ILE . 28063 2 20 190 ARG . 28063 2 21 191 LEU . 28063 2 22 192 ASP . 28063 2 23 193 MET . 28063 2 24 194 GLU . 28063 2 25 195 ILE . 28063 2 26 196 ASP . 28063 2 27 197 GLY . 28063 2 28 198 GLN . 28063 2 29 199 LYS . 28063 2 30 200 LEU . 28063 2 31 201 ARG . 28063 2 32 202 ASP . 28063 2 33 203 ALA . 28063 2 34 204 PHE . 28063 2 35 205 THR . 28063 2 36 206 TRP . 28063 2 37 207 ASN . 28063 2 38 208 MET . 28063 2 39 209 ASN . 28063 2 40 210 GLU . 28063 2 41 211 LYS . 28063 2 42 212 LEU . 28063 2 43 213 MET . 28063 2 44 214 THR . 28063 2 45 215 PRO . 28063 2 46 216 GLU . 28063 2 47 217 MET . 28063 2 48 218 PHE . 28063 2 49 219 SER . 28063 2 50 220 GLU . 28063 2 51 221 ILE . 28063 2 52 222 LEU . 28063 2 53 223 CYS . 28063 2 54 224 ASP . 28063 2 55 225 ASP . 28063 2 56 226 LEU . 28063 2 57 227 ASP . 28063 2 58 228 LEU . 28063 2 59 229 ASN . 28063 2 60 230 PRO . 28063 2 61 231 LEU . 28063 2 62 232 THR . 28063 2 63 233 PHE . 28063 2 64 234 VAL . 28063 2 65 235 PRO . 28063 2 66 236 ALA . 28063 2 67 237 ILE . 28063 2 68 238 ALA . 28063 2 69 239 SER . 28063 2 70 240 ALA . 28063 2 71 241 ILE . 28063 2 72 242 ARG . 28063 2 73 243 GLN . 28063 2 74 244 GLN . 28063 2 75 245 ILE . 28063 2 76 246 GLU . 28063 2 77 247 SER . 28063 2 78 248 TYR . 28063 2 79 249 PRO . 28063 2 80 250 THR . 28063 2 81 251 ASP . 28063 2 82 252 SER . 28063 2 83 253 ILE . 28063 2 84 254 LEU . 28063 2 85 255 GLU . 28063 2 86 256 ASP . 28063 2 87 257 GLN . 28063 2 88 258 SER . 28063 2 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 . HIS 1 1 28063 2 . ASP 2 2 28063 2 . PRO 3 3 28063 2 . ALA 4 4 28063 2 . VAL 5 5 28063 2 . ILE 6 6 28063 2 . HIS 7 7 28063 2 . GLU 8 8 28063 2 . ASN 9 9 28063 2 . ALA 10 10 28063 2 . SER 11 11 28063 2 . GLN 12 12 28063 2 . PRO 13 13 28063 2 . GLU 14 14 28063 2 . VAL 15 15 28063 2 . LEU 16 16 28063 2 . VAL 17 17 28063 2 . PRO 18 18 28063 2 . ILE 19 19 28063 2 . ARG 20 20 28063 2 . LEU 21 21 28063 2 . ASP 22 22 28063 2 . MET 23 23 28063 2 . GLU 24 24 28063 2 . ILE 25 25 28063 2 . ASP 26 26 28063 2 . GLY 27 27 28063 2 . GLN 28 28 28063 2 . LYS 29 29 28063 2 . LEU 30 30 28063 2 . ARG 31 31 28063 2 . ASP 32 32 28063 2 . ALA 33 33 28063 2 . PHE 34 34 28063 2 . THR 35 35 28063 2 . TRP 36 36 28063 2 . ASN 37 37 28063 2 . MET 38 38 28063 2 . ASN 39 39 28063 2 . GLU 40 40 28063 2 . LYS 41 41 28063 2 . LEU 42 42 28063 2 . MET 43 43 28063 2 . THR 44 44 28063 2 . PRO 45 45 28063 2 . GLU 46 46 28063 2 . MET 47 47 28063 2 . PHE 48 48 28063 2 . SER 49 49 28063 2 . GLU 50 50 28063 2 . ILE 51 51 28063 2 . LEU 52 52 28063 2 . CYS 53 53 28063 2 . ASP 54 54 28063 2 . ASP 55 55 28063 2 . LEU 56 56 28063 2 . ASP 57 57 28063 2 . LEU 58 58 28063 2 . ASN 59 59 28063 2 . PRO 60 60 28063 2 . LEU 61 61 28063 2 . THR 62 62 28063 2 . PHE 63 63 28063 2 . VAL 64 64 28063 2 . PRO 65 65 28063 2 . ALA 66 66 28063 2 . ILE 67 67 28063 2 . ALA 68 68 28063 2 . SER 69 69 28063 2 . ALA 70 70 28063 2 . ILE 71 71 28063 2 . ARG 72 72 28063 2 . GLN 73 73 28063 2 . GLN 74 74 28063 2 . ILE 75 75 28063 2 . GLU 76 76 28063 2 . SER 77 77 28063 2 . TYR 78 78 28063 2 . PRO 79 79 28063 2 . THR 80 80 28063 2 . ASP 81 81 28063 2 . SER 82 82 28063 2 . ILE 83 83 28063 2 . LEU 84 84 28063 2 . GLU 85 85 28063 2 . ASP 86 86 28063 2 . GLN 87 87 28063 2 . SER 88 88 28063 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 28063 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $SWIRM . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 28063 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 28063 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $SWIRM . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pMAL-C2 . . . 28063 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 28063 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 SWIRM '[U-99% 13C; U-99% 15N]' . . 1 $SWIRM . . 0.5 . . mM . . . . 28063 1 2 RPT1 'natural abundance' . . 2 $RPT1 . . 0.5 . . mM . . . . 28063 1 3 HEPES 'natural abundance' . . . . . . 10 . . mM . . . . 28063 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 28063 1 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 28063 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 28063 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 28063 1 pH 7.0 . pH 28063 1 pressure 1 . atm 28063 1 temperature 298 . K 28063 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 28063 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version NMRFAM-SPARKY _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 28063 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 28063 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 28063 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 28063 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 28063 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 500 . . . 28063 1 2 spectrometer_2 Bruker Avance . 800 . . . 28063 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 28063 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . . 28063 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . . 28063 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . . 28063 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 28063 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 28063 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 28063 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 28063 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 28063 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 28063 1 2 '3D CBCA(CO)NH' . . . 28063 1 3 '3D HNCACB' . . . 28063 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 ILE CA C 13 60.080 . . . . . . . . 449 ILE CA . 28063 1 2 . 1 . 1 2 2 ILE H H 1 7.956 . . . . . . . . 450 ILE H . 28063 1 3 . 1 . 1 2 2 ILE CA C 13 60.560 . . . . . . . . 450 ILE CA . 28063 1 4 . 1 . 1 2 2 ILE CB C 13 39.410 . . . . . . . . 450 ILE CB . 28063 1 5 . 1 . 1 2 2 ILE N N 15 126.300 . . . . . . . . 450 ILE N . 28063 1 6 . 1 . 1 3 3 ILE H H 1 7.981 . . . . . . . . 451 ILE H . 28063 1 7 . 1 . 1 3 3 ILE CA C 13 57.350 . . . . . . . . 451 ILE CA . 28063 1 8 . 1 . 1 3 3 ILE N N 15 122.800 . . . . . . . . 451 ILE N . 28063 1 9 . 1 . 1 6 6 TYR CA C 13 56.830 . . . . . . . . 454 TYR CA . 28063 1 10 . 1 . 1 7 7 ALA H H 1 7.553 . . . . . . . . 455 ALA H . 28063 1 11 . 1 . 1 7 7 ALA CA C 13 51.260 . . . . . . . . 455 ALA CA . 28063 1 12 . 1 . 1 7 7 ALA CB C 13 17.530 . . . . . . . . 455 ALA CB . 28063 1 13 . 1 . 1 7 7 ALA N N 15 124.100 . . . . . . . . 455 ALA N . 28063 1 14 . 1 . 1 8 8 SER H H 1 7.481 . . . . . . . . 456 SER H . 28063 1 15 . 1 . 1 8 8 SER CA C 13 61.200 . . . . . . . . 456 SER CA . 28063 1 16 . 1 . 1 8 8 SER CB C 13 63.410 . . . . . . . . 456 SER CB . 28063 1 17 . 1 . 1 8 8 SER N N 15 114.000 . . . . . . . . 456 SER N . 28063 1 18 . 1 . 1 9 9 TRP H H 1 6.534 . . . . . . . . 457 TRP H . 28063 1 19 . 1 . 1 9 9 TRP CA C 13 54.970 . . . . . . . . 457 TRP CA . 28063 1 20 . 1 . 1 9 9 TRP CB C 13 28.360 . . . . . . . . 457 TRP CB . 28063 1 21 . 1 . 1 9 9 TRP N N 15 117.800 . . . . . . . . 457 TRP N . 28063 1 22 . 1 . 1 10 10 PHE H H 1 6.700 . . . . . . . . 458 PHE H . 28063 1 23 . 1 . 1 10 10 PHE CA C 13 61.120 . . . . . . . . 458 PHE CA . 28063 1 24 . 1 . 1 10 10 PHE CB C 13 38.310 . . . . . . . . 458 PHE CB . 28063 1 25 . 1 . 1 10 10 PHE N N 15 123.400 . . . . . . . . 458 PHE N . 28063 1 26 . 1 . 1 11 11 ASP H H 1 7.098 . . . . . . . . 459 ASP H . 28063 1 27 . 1 . 1 11 11 ASP CA C 13 53.100 . . . . . . . . 459 ASP CA . 28063 1 28 . 1 . 1 11 11 ASP CB C 13 44.090 . . . . . . . . 459 ASP CB . 28063 1 29 . 1 . 1 11 11 ASP N N 15 127.200 . . . . . . . . 459 ASP N . 28063 1 30 . 1 . 1 12 12 TYR H H 1 8.340 . . . . . . . . 460 TYR H . 28063 1 31 . 1 . 1 12 12 TYR CA C 13 61.300 . . . . . . . . 460 TYR CA . 28063 1 32 . 1 . 1 12 12 TYR N N 15 127.400 . . . . . . . . 460 TYR N . 28063 1 33 . 1 . 1 13 13 ASN H H 1 8.579 . . . . . . . . 461 ASN H . 28063 1 34 . 1 . 1 13 13 ASN CA C 13 53.610 . . . . . . . . 461 ASN CA . 28063 1 35 . 1 . 1 13 13 ASN CB C 13 40.010 . . . . . . . . 461 ASN CB . 28063 1 36 . 1 . 1 13 13 ASN N N 15 110.700 . . . . . . . . 461 ASN N . 28063 1 37 . 1 . 1 14 14 CYS H H 1 7.810 . . . . . . . . 462 CYS H . 28063 1 38 . 1 . 1 14 14 CYS CA C 13 57.300 . . . . . . . . 462 CYS CA . 28063 1 39 . 1 . 1 14 14 CYS CB C 13 31.840 . . . . . . . . 462 CYS CB . 28063 1 40 . 1 . 1 14 14 CYS N N 15 116.600 . . . . . . . . 462 CYS N . 28063 1 41 . 1 . 1 15 15 ILE H H 1 8.415 . . . . . . . . 463 ILE H . 28063 1 42 . 1 . 1 15 15 ILE CA C 13 61.450 . . . . . . . . 463 ILE CA . 28063 1 43 . 1 . 1 15 15 ILE CB C 13 39.700 . . . . . . . . 463 ILE CB . 28063 1 44 . 1 . 1 15 15 ILE N N 15 121.200 . . . . . . . . 463 ILE N . 28063 1 45 . 1 . 1 16 16 HIS H H 1 10.280 . . . . . . . . 464 HIS H . 28063 1 46 . 1 . 1 16 16 HIS CA C 13 57.670 . . . . . . . . 464 HIS CA . 28063 1 47 . 1 . 1 16 16 HIS CB C 13 33.790 . . . . . . . . 464 HIS CB . 28063 1 48 . 1 . 1 16 16 HIS N N 15 133.200 . . . . . . . . 464 HIS N . 28063 1 49 . 1 . 1 17 17 VAL H H 1 7.727 . . . . . . . . 465 VAL H . 28063 1 50 . 1 . 1 17 17 VAL CA C 13 66.390 . . . . . . . . 465 VAL CA . 28063 1 51 . 1 . 1 17 17 VAL CB C 13 30.910 . . . . . . . . 465 VAL CB . 28063 1 52 . 1 . 1 17 17 VAL N N 15 127.900 . . . . . . . . 465 VAL N . 28063 1 53 . 1 . 1 18 18 ILE H H 1 11.280 . . . . . . . . 466 ILE H . 28063 1 54 . 1 . 1 18 18 ILE CA C 13 66.640 . . . . . . . . 466 ILE CA . 28063 1 55 . 1 . 1 18 18 ILE N N 15 125.900 . . . . . . . . 466 ILE N . 28063 1 56 . 1 . 1 19 19 GLU H H 1 6.869 . . . . . . . . 467 GLU H . 28063 1 57 . 1 . 1 19 19 GLU CA C 13 58.610 . . . . . . . . 467 GLU CA . 28063 1 58 . 1 . 1 19 19 GLU CB C 13 29.130 . . . . . . . . 467 GLU CB . 28063 1 59 . 1 . 1 19 19 GLU N N 15 117.200 . . . . . . . . 467 GLU N . 28063 1 60 . 1 . 1 20 20 ARG H H 1 6.644 . . . . . . . . 468 ARG H . 28063 1 61 . 1 . 1 20 20 ARG CA C 13 58.290 . . . . . . . . 468 ARG CA . 28063 1 62 . 1 . 1 20 20 ARG CB C 13 28.880 . . . . . . . . 468 ARG CB . 28063 1 63 . 1 . 1 20 20 ARG N N 15 114.700 . . . . . . . . 468 ARG N . 28063 1 64 . 1 . 1 21 21 ARG H H 1 7.932 . . . . . . . . 469 ARG H . 28063 1 65 . 1 . 1 21 21 ARG CA C 13 57.740 . . . . . . . . 469 ARG CA . 28063 1 66 . 1 . 1 21 21 ARG N N 15 115.000 . . . . . . . . 469 ARG N . 28063 1 67 . 1 . 1 22 22 ALA H H 1 7.213 . . . . . . . . 470 ALA H . 28063 1 68 . 1 . 1 22 22 ALA CA C 13 54.050 . . . . . . . . 470 ALA CA . 28063 1 69 . 1 . 1 22 22 ALA CB C 13 21.170 . . . . . . . . 470 ALA CB . 28063 1 70 . 1 . 1 22 22 ALA N N 15 119.700 . . . . . . . . 470 ALA N . 28063 1 71 . 1 . 1 23 23 LEU H H 1 7.211 . . . . . . . . 471 LEU H . 28063 1 72 . 1 . 1 23 23 LEU CA C 13 52.400 . . . . . . . . 471 LEU CA . 28063 1 73 . 1 . 1 23 23 LEU CB C 13 41.970 . . . . . . . . 471 LEU CB . 28063 1 74 . 1 . 1 23 23 LEU N N 15 117.900 . . . . . . . . 471 LEU N . 28063 1 75 . 1 . 1 24 24 PRO CA C 13 65.510 . . . . . . . . 472 PRO CA . 28063 1 76 . 1 . 1 25 25 GLU H H 1 8.117 . . . . . . . . 473 GLU H . 28063 1 77 . 1 . 1 25 25 GLU CA C 13 57.980 . . . . . . . . 473 GLU CA . 28063 1 78 . 1 . 1 25 25 GLU N N 15 116.500 . . . . . . . . 473 GLU N . 28063 1 79 . 1 . 1 26 26 PHE H H 1 6.982 . . . . . . . . 474 PHE H . 28063 1 80 . 1 . 1 26 26 PHE CA C 13 59.360 . . . . . . . . 474 PHE CA . 28063 1 81 . 1 . 1 26 26 PHE CB C 13 38.590 . . . . . . . . 474 PHE CB . 28063 1 82 . 1 . 1 26 26 PHE N N 15 113.700 . . . . . . . . 474 PHE N . 28063 1 83 . 1 . 1 27 27 PHE H H 1 7.408 . . . . . . . . 475 PHE H . 28063 1 84 . 1 . 1 27 27 PHE CA C 13 58.170 . . . . . . . . 475 PHE CA . 28063 1 85 . 1 . 1 27 27 PHE CB C 13 41.120 . . . . . . . . 475 PHE CB . 28063 1 86 . 1 . 1 27 27 PHE N N 15 113.200 . . . . . . . . 475 PHE N . 28063 1 87 . 1 . 1 28 28 ASN H H 1 7.475 . . . . . . . . 476 ASN H . 28063 1 88 . 1 . 1 28 28 ASN CA C 13 52.860 . . . . . . . . 476 ASN CA . 28063 1 89 . 1 . 1 28 28 ASN CB C 13 37.920 . . . . . . . . 476 ASN CB . 28063 1 90 . 1 . 1 28 28 ASN N N 15 116.400 . . . . . . . . 476 ASN N . 28063 1 91 . 1 . 1 29 29 GLY H H 1 8.613 . . . . . . . . 477 GLY H . 28063 1 92 . 1 . 1 29 29 GLY CA C 13 46.260 . . . . . . . . 477 GLY CA . 28063 1 93 . 1 . 1 29 29 GLY N N 15 109.800 . . . . . . . . 477 GLY N . 28063 1 94 . 1 . 1 30 30 LYS H H 1 7.619 . . . . . . . . 478 LYS H . 28063 1 95 . 1 . 1 30 30 LYS CA C 13 57.000 . . . . . . . . 478 LYS CA . 28063 1 96 . 1 . 1 30 30 LYS CB C 13 32.940 . . . . . . . . 478 LYS CB . 28063 1 97 . 1 . 1 30 30 LYS N N 15 119.000 . . . . . . . . 478 LYS N . 28063 1 98 . 1 . 1 31 31 ASN H H 1 8.953 . . . . . . . . 479 ASN H . 28063 1 99 . 1 . 1 31 31 ASN CA C 13 52.480 . . . . . . . . 479 ASN CA . 28063 1 100 . 1 . 1 31 31 ASN CB C 13 41.120 . . . . . . . . 479 ASN CB . 28063 1 101 . 1 . 1 31 31 ASN N N 15 117.600 . . . . . . . . 479 ASN N . 28063 1 102 . 1 . 1 32 32 LYS CA C 13 61.840 . . . . . . . . 480 LYS CA . 28063 1 103 . 1 . 1 33 33 SER H H 1 8.415 . . . . . . . . 481 SER H . 28063 1 104 . 1 . 1 33 33 SER CA C 13 58.990 . . . . . . . . 481 SER CA . 28063 1 105 . 1 . 1 33 33 SER N N 15 110.900 . . . . . . . . 481 SER N . 28063 1 106 . 1 . 1 34 34 LYS H H 1 7.344 . . . . . . . . 482 LYS H . 28063 1 107 . 1 . 1 34 34 LYS CA C 13 57.100 . . . . . . . . 482 LYS CA . 28063 1 108 . 1 . 1 34 34 LYS N N 15 122.100 . . . . . . . . 482 LYS N . 28063 1 109 . 1 . 1 35 35 THR H H 1 6.340 . . . . . . . . 483 THR H . 28063 1 110 . 1 . 1 35 35 THR CA C 13 58.450 . . . . . . . . 483 THR CA . 28063 1 111 . 1 . 1 35 35 THR N N 15 111.500 . . . . . . . . 483 THR N . 28063 1 112 . 1 . 1 36 36 PRO CA C 13 65.710 . . . . . . . . 484 PRO CA . 28063 1 113 . 1 . 1 37 37 GLU H H 1 8.229 . . . . . . . . 485 GLU H . 28063 1 114 . 1 . 1 37 37 GLU CA C 13 60.470 . . . . . . . . 485 GLU CA . 28063 1 115 . 1 . 1 37 37 GLU CB C 13 28.450 . . . . . . . . 485 GLU CB . 28063 1 116 . 1 . 1 37 37 GLU N N 15 114.400 . . . . . . . . 485 GLU N . 28063 1 117 . 1 . 1 38 38 ILE H H 1 7.545 . . . . . . . . 486 ILE H . 28063 1 118 . 1 . 1 38 38 ILE CA C 13 63.460 . . . . . . . . 486 ILE CA . 28063 1 119 . 1 . 1 38 38 ILE CB C 13 37.760 . . . . . . . . 486 ILE CB . 28063 1 120 . 1 . 1 38 38 ILE N N 15 123.500 . . . . . . . . 486 ILE N . 28063 1 121 . 1 . 1 39 39 TYR H H 1 8.052 . . . . . . . . 487 TYR H . 28063 1 122 . 1 . 1 39 39 TYR CA C 13 62.030 . . . . . . . . 487 TYR CA . 28063 1 123 . 1 . 1 39 39 TYR CB C 13 36.660 . . . . . . . . 487 TYR CB . 28063 1 124 . 1 . 1 39 39 TYR N N 15 119.500 . . . . . . . . 487 TYR N . 28063 1 125 . 1 . 1 40 40 LEU H H 1 7.885 . . . . . . . . 488 LEU H . 28063 1 126 . 1 . 1 40 40 LEU CA C 13 58.420 . . . . . . . . 488 LEU CA . 28063 1 127 . 1 . 1 40 40 LEU CB C 13 42.230 . . . . . . . . 488 LEU CB . 28063 1 128 . 1 . 1 40 40 LEU N N 15 117.900 . . . . . . . . 488 LEU N . 28063 1 129 . 1 . 1 41 41 ALA H H 1 7.275 . . . . . . . . 489 ALA H . 28063 1 130 . 1 . 1 41 41 ALA CA C 13 54.840 . . . . . . . . 489 ALA CA . 28063 1 131 . 1 . 1 41 41 ALA CB C 13 17.590 . . . . . . . . 489 ALA CB . 28063 1 132 . 1 . 1 41 41 ALA N N 15 119.400 . . . . . . . . 489 ALA N . 28063 1 133 . 1 . 1 42 42 TYR H H 1 8.505 . . . . . . . . 490 TYR H . 28063 1 134 . 1 . 1 42 42 TYR CA C 13 57.660 . . . . . . . . 490 TYR CA . 28063 1 135 . 1 . 1 42 42 TYR CB C 13 37.590 . . . . . . . . 490 TYR CB . 28063 1 136 . 1 . 1 42 42 TYR N N 15 118.400 . . . . . . . . 490 TYR N . 28063 1 137 . 1 . 1 43 43 ARG H H 1 8.951 . . . . . . . . 491 ARG H . 28063 1 138 . 1 . 1 43 43 ARG CA C 13 59.180 . . . . . . . . 491 ARG CA . 28063 1 139 . 1 . 1 43 43 ARG N N 15 118.900 . . . . . . . . 491 ARG N . 28063 1 140 . 1 . 1 44 44 ASN H H 1 8.801 . . . . . . . . 492 ASN H . 28063 1 141 . 1 . 1 44 44 ASN CA C 13 55.390 . . . . . . . . 492 ASN CA . 28063 1 142 . 1 . 1 44 44 ASN CB C 13 35.110 . . . . . . . . 492 ASN CB . 28063 1 143 . 1 . 1 44 44 ASN N N 15 117.000 . . . . . . . . 492 ASN N . 28063 1 144 . 1 . 1 45 45 PHE H H 1 7.793 . . . . . . . . 493 PHE H . 28063 1 145 . 1 . 1 45 45 PHE CA C 13 62.100 . . . . . . . . 493 PHE CA . 28063 1 146 . 1 . 1 45 45 PHE CB C 13 39.020 . . . . . . . . 493 PHE CB . 28063 1 147 . 1 . 1 45 45 PHE N N 15 120.100 . . . . . . . . 493 PHE N . 28063 1 148 . 1 . 1 46 46 MET H H 1 7.964 . . . . . . . . 494 MET H . 28063 1 149 . 1 . 1 46 46 MET CA C 13 61.170 . . . . . . . . 494 MET CA . 28063 1 150 . 1 . 1 46 46 MET CB C 13 31.530 . . . . . . . . 494 MET CB . 28063 1 151 . 1 . 1 46 46 MET N N 15 121.400 . . . . . . . . 494 MET N . 28063 1 152 . 1 . 1 47 47 ILE H H 1 7.998 . . . . . . . . 495 ILE H . 28063 1 153 . 1 . 1 47 47 ILE CA C 13 65.910 . . . . . . . . 495 ILE CA . 28063 1 154 . 1 . 1 47 47 ILE CB C 13 38.440 . . . . . . . . 495 ILE CB . 28063 1 155 . 1 . 1 47 47 ILE N N 15 118.500 . . . . . . . . 495 ILE N . 28063 1 156 . 1 . 1 48 48 ASP H H 1 8.959 . . . . . . . . 496 ASP H . 28063 1 157 . 1 . 1 48 48 ASP CA C 13 57.430 . . . . . . . . 496 ASP CA . 28063 1 158 . 1 . 1 48 48 ASP N N 15 119.300 . . . . . . . . 496 ASP N . 28063 1 159 . 1 . 1 49 49 THR H H 1 7.896 . . . . . . . . 497 THR H . 28063 1 160 . 1 . 1 49 49 THR CA C 13 67.340 . . . . . . . . 497 THR CA . 28063 1 161 . 1 . 1 49 49 THR N N 15 115.900 . . . . . . . . 497 THR N . 28063 1 162 . 1 . 1 50 50 TYR H H 1 8.243 . . . . . . . . 498 TYR H . 28063 1 163 . 1 . 1 50 50 TYR CA C 13 61.330 . . . . . . . . 498 TYR CA . 28063 1 164 . 1 . 1 50 50 TYR N N 15 122.900 . . . . . . . . 498 TYR N . 28063 1 165 . 1 . 1 51 51 ARG H H 1 8.169 . . . . . . . . 499 ARG H . 28063 1 166 . 1 . 1 51 51 ARG CA C 13 59.250 . . . . . . . . 499 ARG CA . 28063 1 167 . 1 . 1 51 51 ARG N N 15 113.800 . . . . . . . . 499 ARG N . 28063 1 168 . 1 . 1 52 52 LEU H H 1 7.095 . . . . . . . . 500 LEU H . 28063 1 169 . 1 . 1 52 52 LEU CA C 13 57.010 . . . . . . . . 500 LEU CA . 28063 1 170 . 1 . 1 52 52 LEU CB C 13 42.510 . . . . . . . . 500 LEU CB . 28063 1 171 . 1 . 1 52 52 LEU N N 15 118.100 . . . . . . . . 500 LEU N . 28063 1 172 . 1 . 1 53 53 ASN H H 1 7.044 . . . . . . . . 501 ASN H . 28063 1 173 . 1 . 1 53 53 ASN CA C 13 51.550 . . . . . . . . 501 ASN CA . 28063 1 174 . 1 . 1 53 53 ASN CB C 13 39.280 . . . . . . . . 501 ASN CB . 28063 1 175 . 1 . 1 53 53 ASN N N 15 112.000 . . . . . . . . 501 ASN N . 28063 1 176 . 1 . 1 54 54 PRO CA C 13 64.140 . . . . . . . . 502 PRO CA . 28063 1 177 . 1 . 1 55 55 GLN H H 1 8.170 . . . . . . . . 503 GLN H . 28063 1 178 . 1 . 1 55 55 GLN CA C 13 57.000 . . . . . . . . 503 GLN CA . 28063 1 179 . 1 . 1 55 55 GLN CB C 13 27.810 . . . . . . . . 503 GLN CB . 28063 1 180 . 1 . 1 55 55 GLN N N 15 116.500 . . . . . . . . 503 GLN N . 28063 1 181 . 1 . 1 56 56 GLU H H 1 7.525 . . . . . . . . 504 GLU H . 28063 1 182 . 1 . 1 56 56 GLU CA C 13 54.500 . . . . . . . . 504 GLU CA . 28063 1 183 . 1 . 1 56 56 GLU N N 15 120.900 . . . . . . . . 504 GLU N . 28063 1 184 . 1 . 1 57 57 TYR H H 1 8.674 . . . . . . . . 505 TYR H . 28063 1 185 . 1 . 1 57 57 TYR CA C 13 59.670 . . . . . . . . 505 TYR CA . 28063 1 186 . 1 . 1 57 57 TYR N N 15 125.200 . . . . . . . . 505 TYR N . 28063 1 187 . 1 . 1 58 58 LEU H H 1 9.629 . . . . . . . . 506 LEU H . 28063 1 188 . 1 . 1 58 58 LEU CA C 13 53.340 . . . . . . . . 506 LEU CA . 28063 1 189 . 1 . 1 58 58 LEU CB C 13 42.050 . . . . . . . . 506 LEU CB . 28063 1 190 . 1 . 1 58 58 LEU N N 15 133.800 . . . . . . . . 506 LEU N . 28063 1 191 . 1 . 1 59 59 THR H H 1 8.681 . . . . . . . . 507 THR H . 28063 1 192 . 1 . 1 59 59 THR CA C 13 60.980 . . . . . . . . 507 THR CA . 28063 1 193 . 1 . 1 59 59 THR CB C 13 70.840 . . . . . . . . 507 THR CB . 28063 1 194 . 1 . 1 59 59 THR N N 15 120.600 . . . . . . . . 507 THR N . 28063 1 195 . 1 . 1 60 60 SER H H 1 9.717 . . . . . . . . 508 SER H . 28063 1 196 . 1 . 1 60 60 SER CA C 13 60.800 . . . . . . . . 508 SER CA . 28063 1 197 . 1 . 1 60 60 SER N N 15 120.600 . . . . . . . . 508 SER N . 28063 1 198 . 1 . 1 61 61 THR H H 1 7.814 . . . . . . . . 509 THR H . 28063 1 199 . 1 . 1 61 61 THR N N 15 120.800 . . . . . . . . 509 THR N . 28063 1 200 . 1 . 1 62 62 ALA H H 1 8.071 . . . . . . . . 510 ALA H . 28063 1 201 . 1 . 1 62 62 ALA CA C 13 55.260 . . . . . . . . 510 ALA CA . 28063 1 202 . 1 . 1 62 62 ALA CB C 13 17.770 . . . . . . . . 510 ALA CB . 28063 1 203 . 1 . 1 62 62 ALA N N 15 123.000 . . . . . . . . 510 ALA N . 28063 1 204 . 1 . 1 63 63 CYS H H 1 7.173 . . . . . . . . 511 CYS H . 28063 1 205 . 1 . 1 63 63 CYS CA C 13 63.800 . . . . . . . . 511 CYS CA . 28063 1 206 . 1 . 1 63 63 CYS CB C 13 27.380 . . . . . . . . 511 CYS CB . 28063 1 207 . 1 . 1 63 63 CYS N N 15 112.500 . . . . . . . . 511 CYS N . 28063 1 208 . 1 . 1 64 64 ARG H H 1 8.611 . . . . . . . . 512 ARG H . 28063 1 209 . 1 . 1 64 64 ARG CA C 13 58.860 . . . . . . . . 512 ARG CA . 28063 1 210 . 1 . 1 64 64 ARG CB C 13 27.590 . . . . . . . . 512 ARG CB . 28063 1 211 . 1 . 1 64 64 ARG N N 15 117.800 . . . . . . . . 512 ARG N . 28063 1 212 . 1 . 1 65 65 ARG H H 1 7.994 . . . . . . . . 513 ARG H . 28063 1 213 . 1 . 1 65 65 ARG CA C 13 58.950 . . . . . . . . 513 ARG CA . 28063 1 214 . 1 . 1 65 65 ARG CB C 13 29.650 . . . . . . . . 513 ARG CB . 28063 1 215 . 1 . 1 65 65 ARG N N 15 117.700 . . . . . . . . 513 ARG N . 28063 1 216 . 1 . 1 66 66 ASN H H 1 7.455 . . . . . . . . 514 ASN H . 28063 1 217 . 1 . 1 66 66 ASN CA C 13 53.500 . . . . . . . . 514 ASN CA . 28063 1 218 . 1 . 1 66 66 ASN CB C 13 41.970 . . . . . . . . 514 ASN CB . 28063 1 219 . 1 . 1 66 66 ASN N N 15 115.900 . . . . . . . . 514 ASN N . 28063 1 220 . 1 . 1 67 67 LEU H H 1 7.275 . . . . . . . . 515 LEU H . 28063 1 221 . 1 . 1 67 67 LEU CA C 13 53.470 . . . . . . . . 515 LEU CA . 28063 1 222 . 1 . 1 67 67 LEU CB C 13 44.880 . . . . . . . . 515 LEU CB . 28063 1 223 . 1 . 1 67 67 LEU N N 15 120.100 . . . . . . . . 515 LEU N . 28063 1 224 . 1 . 1 68 68 THR H H 1 8.315 . . . . . . . . 516 THR H . 28063 1 225 . 1 . 1 68 68 THR CA C 13 61.350 . . . . . . . . 516 THR CA . 28063 1 226 . 1 . 1 68 68 THR CB C 13 70.600 . . . . . . . . 516 THR CB . 28063 1 227 . 1 . 1 68 68 THR N N 15 113.600 . . . . . . . . 516 THR N . 28063 1 228 . 1 . 1 69 69 GLY H H 1 8.467 . . . . . . . . 517 GLY H . 28063 1 229 . 1 . 1 69 69 GLY CA C 13 43.770 . . . . . . . . 517 GLY CA . 28063 1 230 . 1 . 1 69 69 GLY N N 15 111.200 . . . . . . . . 517 GLY N . 28063 1 231 . 1 . 1 70 70 ASP H H 1 8.780 . . . . . . . . 518 ASP H . 28063 1 232 . 1 . 1 70 70 ASP CA C 13 54.390 . . . . . . . . 518 ASP CA . 28063 1 233 . 1 . 1 70 70 ASP CB C 13 41.710 . . . . . . . . 518 ASP CB . 28063 1 234 . 1 . 1 70 70 ASP N N 15 120.000 . . . . . . . . 518 ASP N . 28063 1 235 . 1 . 1 71 71 VAL H H 1 8.338 . . . . . . . . 519 VAL H . 28063 1 236 . 1 . 1 71 71 VAL CA C 13 65.060 . . . . . . . . 519 VAL CA . 28063 1 237 . 1 . 1 71 71 VAL CB C 13 31.440 . . . . . . . . 519 VAL CB . 28063 1 238 . 1 . 1 71 71 VAL N N 15 125.900 . . . . . . . . 519 VAL N . 28063 1 239 . 1 . 1 72 72 CYS H H 1 7.340 . . . . . . . . 520 CYS H . 28063 1 240 . 1 . 1 72 72 CYS CA C 13 62.640 . . . . . . . . 520 CYS CA . 28063 1 241 . 1 . 1 72 72 CYS CB C 13 25.890 . . . . . . . . 520 CYS CB . 28063 1 242 . 1 . 1 72 72 CYS N N 15 119.300 . . . . . . . . 520 CYS N . 28063 1 243 . 1 . 1 73 73 ALA H H 1 7.090 . . . . . . . . 521 ALA H . 28063 1 244 . 1 . 1 73 73 ALA CA C 13 54.990 . . . . . . . . 521 ALA CA . 28063 1 245 . 1 . 1 73 73 ALA CB C 13 18.480 . . . . . . . . 521 ALA CB . 28063 1 246 . 1 . 1 73 73 ALA N N 15 123.200 . . . . . . . . 521 ALA N . 28063 1 247 . 1 . 1 74 74 VAL H H 1 7.662 . . . . . . . . 522 VAL H . 28063 1 248 . 1 . 1 74 74 VAL CA C 13 67.580 . . . . . . . . 522 VAL CA . 28063 1 249 . 1 . 1 74 74 VAL N N 15 116.000 . . . . . . . . 522 VAL N . 28063 1 250 . 1 . 1 75 75 MET H H 1 8.033 . . . . . . . . 523 MET H . 28063 1 251 . 1 . 1 75 75 MET CA C 13 60.190 . . . . . . . . 523 MET CA . 28063 1 252 . 1 . 1 75 75 MET CB C 13 32.860 . . . . . . . . 523 MET CB . 28063 1 253 . 1 . 1 75 75 MET N N 15 117.500 . . . . . . . . 523 MET N . 28063 1 254 . 1 . 1 76 76 ARG H H 1 8.346 . . . . . . . . 524 ARG H . 28063 1 255 . 1 . 1 76 76 ARG CA C 13 61.110 . . . . . . . . 524 ARG CA . 28063 1 256 . 1 . 1 76 76 ARG N N 15 121.200 . . . . . . . . 524 ARG N . 28063 1 257 . 1 . 1 77 77 VAL H H 1 8.006 . . . . . . . . 525 VAL H . 28063 1 258 . 1 . 1 77 77 VAL CA C 13 68.100 . . . . . . . . 525 VAL CA . 28063 1 259 . 1 . 1 77 77 VAL N N 15 121.600 . . . . . . . . 525 VAL N . 28063 1 260 . 1 . 1 78 78 HIS H H 1 7.626 . . . . . . . . 526 HIS H . 28063 1 261 . 1 . 1 78 78 HIS CA C 13 62.690 . . . . . . . . 526 HIS CA . 28063 1 262 . 1 . 1 78 78 HIS CB C 13 31.360 . . . . . . . . 526 HIS CB . 28063 1 263 . 1 . 1 78 78 HIS N N 15 119.300 . . . . . . . . 526 HIS N . 28063 1 264 . 1 . 1 79 79 ALA H H 1 8.325 . . . . . . . . 527 ALA H . 28063 1 265 . 1 . 1 79 79 ALA CA C 13 55.440 . . . . . . . . 527 ALA CA . 28063 1 266 . 1 . 1 79 79 ALA CB C 13 18.300 . . . . . . . . 527 ALA CB . 28063 1 267 . 1 . 1 79 79 ALA N N 15 119.000 . . . . . . . . 527 ALA N . 28063 1 268 . 1 . 1 80 80 PHE H H 1 8.130 . . . . . . . . 528 PHE H . 28063 1 269 . 1 . 1 80 80 PHE CA C 13 61.840 . . . . . . . . 528 PHE CA . 28063 1 270 . 1 . 1 80 80 PHE N N 15 120.800 . . . . . . . . 528 PHE N . 28063 1 271 . 1 . 1 81 81 LEU H H 1 8.347 . . . . . . . . 529 LEU H . 28063 1 272 . 1 . 1 81 81 LEU CA C 13 57.660 . . . . . . . . 529 LEU CA . 28063 1 273 . 1 . 1 81 81 LEU N N 15 118.400 . . . . . . . . 529 LEU N . 28063 1 274 . 1 . 1 82 82 GLU H H 1 8.676 . . . . . . . . 530 GLU H . 28063 1 275 . 1 . 1 82 82 GLU CA C 13 60.120 . . . . . . . . 530 GLU CA . 28063 1 276 . 1 . 1 82 82 GLU N N 15 120.200 . . . . . . . . 530 GLU N . 28063 1 277 . 1 . 1 83 83 GLN H H 1 8.265 . . . . . . . . 531 GLN H . 28063 1 278 . 1 . 1 83 83 GLN CA C 13 58.830 . . . . . . . . 531 GLN CA . 28063 1 279 . 1 . 1 83 83 GLN N N 15 122.100 . . . . . . . . 531 GLN N . 28063 1 280 . 1 . 1 84 84 TRP H H 1 7.290 . . . . . . . . 532 TRP H . 28063 1 281 . 1 . 1 84 84 TRP CA C 13 58.240 . . . . . . . . 532 TRP CA . 28063 1 282 . 1 . 1 84 84 TRP N N 15 117.400 . . . . . . . . 532 TRP N . 28063 1 283 . 1 . 1 85 85 GLY H H 1 7.506 . . . . . . . . 533 GLY H . 28063 1 284 . 1 . 1 85 85 GLY CA C 13 45.990 . . . . . . . . 533 GLY CA . 28063 1 285 . 1 . 1 85 85 GLY N N 15 104.400 . . . . . . . . 533 GLY N . 28063 1 286 . 1 . 1 86 86 LEU H H 1 8.144 . . . . . . . . 534 LEU H . 28063 1 287 . 1 . 1 86 86 LEU CA C 13 55.400 . . . . . . . . 534 LEU CA . 28063 1 288 . 1 . 1 86 86 LEU CB C 13 42.890 . . . . . . . . 534 LEU CB . 28063 1 289 . 1 . 1 86 86 LEU N N 15 118.700 . . . . . . . . 534 LEU N . 28063 1 290 . 1 . 1 87 87 VAL H H 1 6.524 . . . . . . . . 535 VAL H . 28063 1 291 . 1 . 1 87 87 VAL CA C 13 60.240 . . . . . . . . 535 VAL CA . 28063 1 292 . 1 . 1 87 87 VAL CB C 13 34.630 . . . . . . . . 535 VAL CB . 28063 1 293 . 1 . 1 87 87 VAL N N 15 105.600 . . . . . . . . 535 VAL N . 28063 1 294 . 1 . 1 90 90 GLN CA C 13 54.980 . . . . . . . . 538 GLN CA . 28063 1 295 . 1 . 1 91 91 VAL H H 1 6.864 . . . . . . . . 539 VAL H . 28063 1 296 . 1 . 1 91 91 VAL CA C 13 62.710 . . . . . . . . 539 VAL CA . 28063 1 297 . 1 . 1 91 91 VAL CB C 13 32.120 . . . . . . . . 539 VAL CB . 28063 1 298 . 1 . 1 91 91 VAL N N 15 118.900 . . . . . . . . 539 VAL N . 28063 1 299 . 1 . 1 92 92 ASP H H 1 8.516 . . . . . . . . 540 ASP H . 28063 1 300 . 1 . 1 92 92 ASP CA C 13 52.190 . . . . . . . . 540 ASP CA . 28063 1 301 . 1 . 1 92 92 ASP CB C 13 41.240 . . . . . . . . 540 ASP CB . 28063 1 302 . 1 . 1 92 92 ASP N N 15 126.500 . . . . . . . . 540 ASP N . 28063 1 303 . 1 . 1 93 93 PRO CA C 13 64.400 . . . . . . . . 541 PRO CA . 28063 1 304 . 1 . 1 93 93 PRO CB C 13 31.610 . . . . . . . . 541 PRO CB . 28063 1 305 . 1 . 1 94 94 GLU H H 1 8.379 . . . . . . . . 542 GLU H . 28063 1 306 . 1 . 1 94 94 GLU CA C 13 57.230 . . . . . . . . 542 GLU CA . 28063 1 307 . 1 . 1 94 94 GLU CB C 13 29.020 . . . . . . . . 542 GLU CB . 28063 1 308 . 1 . 1 94 94 GLU N N 15 117.500 . . . . . . . . 542 GLU N . 28063 1 309 . 1 . 1 95 95 SER H H 1 7.966 . . . . . . . . 543 SER H . 28063 1 310 . 1 . 1 95 95 SER CA C 13 58.520 . . . . . . . . 543 SER CA . 28063 1 311 . 1 . 1 95 95 SER CB C 13 64.030 . . . . . . . . 543 SER CB . 28063 1 312 . 1 . 1 95 95 SER N N 15 115.400 . . . . . . . . 543 SER N . 28063 1 313 . 1 . 1 96 96 ARG H H 1 7.762 . . . . . . . . 544 ARG H . 28063 1 314 . 1 . 1 96 96 ARG CA C 13 53.750 . . . . . . . . 544 ARG CA . 28063 1 315 . 1 . 1 96 96 ARG CB C 13 29.840 . . . . . . . . 544 ARG CB . 28063 1 316 . 1 . 1 96 96 ARG N N 15 123.100 . . . . . . . . 544 ARG N . 28063 1 317 . 1 . 1 97 97 PRO CA C 13 63.700 . . . . . . . . 545 PRO CA . 28063 1 318 . 1 . 1 97 97 PRO CB C 13 31.460 . . . . . . . . 545 PRO CB . 28063 1 319 . 1 . 1 98 98 MET H H 1 7.933 . . . . . . . . 546 MET H . 28063 1 320 . 1 . 1 98 98 MET CA C 13 57.100 . . . . . . . . 546 MET CA . 28063 1 321 . 1 . 1 98 98 MET CB C 13 33.820 . . . . . . . . 546 MET CB . 28063 1 322 . 1 . 1 98 98 MET N N 15 126.100 . . . . . . . . 546 MET N . 28063 1 stop_ save_