data_8YNU
# 
_entry.id   8YNU 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   8YNU         pdb_00008ynu 10.2210/pdb8ynu/pdb 
WWPDB D_1300046016 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-04-09 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8YNU 
_pdbx_database_status.recvd_initial_deposition_date   2024-03-12 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBC 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              zhou_yuanze@163.com 
_pdbx_contact_author.name_first         Yuanze 
_pdbx_contact_author.name_last          Zhou 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-8542-6048 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Zhou, Y.Z.' 1 ? 
'Wu, Z.F.'   2 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Structure 
_citation.journal_id_ASTM           STRUE6 
_citation.journal_id_CSD            2005 
_citation.journal_id_ISSN           0969-2126 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            32 
_citation.language                  ? 
_citation.page_first                889 
_citation.page_last                 898.e3 
_citation.title                     
'Structural and functional insights into yeast Tbf1 as an atypical telomeric repeat-binding factor.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1016/j.str.2024.04.002 
_citation.pdbx_database_id_PubMed   38677290 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Wu, Z.'   1 ? 
primary 'Gu, X.'   2 ? 
primary 'Zha, L.'  3 ? 
primary 'Yang, Q.' 4 ? 
primary 'Zhou, Y.' 5 ? 
primary 'Zeng, Z.' 6 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'Telomeric DNA-binding factor trf1' 9061.449 2   ? ? ? ? 
2 non-polymer syn GLYCEROL                            92.094   1   ? ? ? ? 
3 water       nat water                               18.015   137 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       GSWTKEEEEALLDGLDLVKGPRWSQILELYGPGGKKSEVLKYRNQVQLKDKARNMKLFFLKSGQVVPAALQCVTGDLRRD 
_entity_poly.pdbx_seq_one_letter_code_can   GSWTKEEEEALLDGLDLVKGPRWSQILELYGPGGKKSEVLKYRNQVQLKDKARNMKLFFLKSGQVVPAALQCVTGDLRRD 
_entity_poly.pdbx_strand_id                 A,B 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 GLYCEROL GOL 
3 water    HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1  GLY n 
1 2  SER n 
1 3  TRP n 
1 4  THR n 
1 5  LYS n 
1 6  GLU n 
1 7  GLU n 
1 8  GLU n 
1 9  GLU n 
1 10 ALA n 
1 11 LEU n 
1 12 LEU n 
1 13 ASP n 
1 14 GLY n 
1 15 LEU n 
1 16 ASP n 
1 17 LEU n 
1 18 VAL n 
1 19 LYS n 
1 20 GLY n 
1 21 PRO n 
1 22 ARG n 
1 23 TRP n 
1 24 SER n 
1 25 GLN n 
1 26 ILE n 
1 27 LEU n 
1 28 GLU n 
1 29 LEU n 
1 30 TYR n 
1 31 GLY n 
1 32 PRO n 
1 33 GLY n 
1 34 GLY n 
1 35 LYS n 
1 36 LYS n 
1 37 SER n 
1 38 GLU n 
1 39 VAL n 
1 40 LEU n 
1 41 LYS n 
1 42 TYR n 
1 43 ARG n 
1 44 ASN n 
1 45 GLN n 
1 46 VAL n 
1 47 GLN n 
1 48 LEU n 
1 49 LYS n 
1 50 ASP n 
1 51 LYS n 
1 52 ALA n 
1 53 ARG n 
1 54 ASN n 
1 55 MET n 
1 56 LYS n 
1 57 LEU n 
1 58 PHE n 
1 59 PHE n 
1 60 LEU n 
1 61 LYS n 
1 62 SER n 
1 63 GLY n 
1 64 GLN n 
1 65 VAL n 
1 66 VAL n 
1 67 PRO n 
1 68 ALA n 
1 69 ALA n 
1 70 LEU n 
1 71 GLN n 
1 72 CYS n 
1 73 VAL n 
1 74 THR n 
1 75 GLY n 
1 76 ASP n 
1 77 LEU n 
1 78 ARG n 
1 79 ARG n 
1 80 ASP n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   80 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'trf1, SPBC19G7.13' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Schizosaccharomyces pombe 972h-' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     284812 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ?                               'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ?                               'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ?                               'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                               'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ?                               'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ?                               'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ?                               'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ?                               'C2 H5 N O2'     75.067  
GOL non-polymer         . GLYCEROL        'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'       92.094  
HOH non-polymer         . WATER           ?                               'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ?                               'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ?                               'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ?                               'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ?                               'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ?                               'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ?                               'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ?                               'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ?                               'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ?                               'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ?                               'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ?                               'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  GLY 1  406 406 GLY GLY A . n 
A 1 2  SER 2  407 407 SER SER A . n 
A 1 3  TRP 3  408 408 TRP TRP A . n 
A 1 4  THR 4  409 409 THR THR A . n 
A 1 5  LYS 5  410 410 LYS LYS A . n 
A 1 6  GLU 6  411 411 GLU GLU A . n 
A 1 7  GLU 7  412 412 GLU GLU A . n 
A 1 8  GLU 8  413 413 GLU GLU A . n 
A 1 9  GLU 9  414 414 GLU GLU A . n 
A 1 10 ALA 10 415 415 ALA ALA A . n 
A 1 11 LEU 11 416 416 LEU LEU A . n 
A 1 12 LEU 12 417 417 LEU LEU A . n 
A 1 13 ASP 13 418 418 ASP ASP A . n 
A 1 14 GLY 14 419 419 GLY GLY A . n 
A 1 15 LEU 15 420 420 LEU LEU A . n 
A 1 16 ASP 16 421 421 ASP ASP A . n 
A 1 17 LEU 17 422 422 LEU LEU A . n 
A 1 18 VAL 18 423 423 VAL VAL A . n 
A 1 19 LYS 19 424 424 LYS LYS A . n 
A 1 20 GLY 20 425 425 GLY GLY A . n 
A 1 21 PRO 21 426 426 PRO PRO A . n 
A 1 22 ARG 22 427 427 ARG ARG A . n 
A 1 23 TRP 23 428 428 TRP TRP A . n 
A 1 24 SER 24 429 429 SER SER A . n 
A 1 25 GLN 25 430 430 GLN GLN A . n 
A 1 26 ILE 26 431 431 ILE ILE A . n 
A 1 27 LEU 27 432 432 LEU LEU A . n 
A 1 28 GLU 28 433 433 GLU GLU A . n 
A 1 29 LEU 29 434 434 LEU LEU A . n 
A 1 30 TYR 30 435 435 TYR TYR A . n 
A 1 31 GLY 31 436 436 GLY GLY A . n 
A 1 32 PRO 32 437 437 PRO PRO A . n 
A 1 33 GLY 33 438 438 GLY GLY A . n 
A 1 34 GLY 34 439 439 GLY GLY A . n 
A 1 35 LYS 35 440 440 LYS LYS A . n 
A 1 36 LYS 36 441 441 LYS LYS A . n 
A 1 37 SER 37 442 442 SER SER A . n 
A 1 38 GLU 38 443 443 GLU GLU A . n 
A 1 39 VAL 39 444 444 VAL VAL A . n 
A 1 40 LEU 40 445 445 LEU LEU A . n 
A 1 41 LYS 41 446 446 LYS LYS A . n 
A 1 42 TYR 42 447 447 TYR TYR A . n 
A 1 43 ARG 43 448 448 ARG ARG A . n 
A 1 44 ASN 44 449 449 ASN ASN A . n 
A 1 45 GLN 45 450 450 GLN GLN A . n 
A 1 46 VAL 46 451 451 VAL VAL A . n 
A 1 47 GLN 47 452 452 GLN GLN A . n 
A 1 48 LEU 48 453 453 LEU LEU A . n 
A 1 49 LYS 49 454 454 LYS LYS A . n 
A 1 50 ASP 50 455 455 ASP ASP A . n 
A 1 51 LYS 51 456 456 LYS LYS A . n 
A 1 52 ALA 52 457 457 ALA ALA A . n 
A 1 53 ARG 53 458 458 ARG ARG A . n 
A 1 54 ASN 54 459 459 ASN ASN A . n 
A 1 55 MET 55 460 460 MET MET A . n 
A 1 56 LYS 56 461 461 LYS LYS A . n 
A 1 57 LEU 57 462 462 LEU LEU A . n 
A 1 58 PHE 58 463 463 PHE PHE A . n 
A 1 59 PHE 59 464 464 PHE PHE A . n 
A 1 60 LEU 60 465 465 LEU LEU A . n 
A 1 61 LYS 61 466 466 LYS LYS A . n 
A 1 62 SER 62 467 467 SER SER A . n 
A 1 63 GLY 63 468 468 GLY GLY A . n 
A 1 64 GLN 64 469 469 GLN GLN A . n 
A 1 65 VAL 65 470 470 VAL VAL A . n 
A 1 66 VAL 66 471 471 VAL VAL A . n 
A 1 67 PRO 67 472 472 PRO PRO A . n 
A 1 68 ALA 68 473 473 ALA ALA A . n 
A 1 69 ALA 69 474 474 ALA ALA A . n 
A 1 70 LEU 70 475 475 LEU LEU A . n 
A 1 71 GLN 71 476 476 GLN GLN A . n 
A 1 72 CYS 72 477 477 CYS CYS A . n 
A 1 73 VAL 73 478 478 VAL VAL A . n 
A 1 74 THR 74 479 479 THR THR A . n 
A 1 75 GLY 75 480 480 GLY GLY A . n 
A 1 76 ASP 76 481 481 ASP ASP A . n 
A 1 77 LEU 77 482 482 LEU LEU A . n 
A 1 78 ARG 78 483 483 ARG ARG A . n 
A 1 79 ARG 79 484 484 ARG ARG A . n 
A 1 80 ASP 80 485 485 ASP ASP A . n 
B 1 1  GLY 1  406 ?   ?   ?   B . n 
B 1 2  SER 2  407 407 SER SER B . n 
B 1 3  TRP 3  408 408 TRP TRP B . n 
B 1 4  THR 4  409 409 THR THR B . n 
B 1 5  LYS 5  410 410 LYS LYS B . n 
B 1 6  GLU 6  411 411 GLU GLU B . n 
B 1 7  GLU 7  412 412 GLU GLU B . n 
B 1 8  GLU 8  413 413 GLU GLU B . n 
B 1 9  GLU 9  414 414 GLU GLU B . n 
B 1 10 ALA 10 415 415 ALA ALA B . n 
B 1 11 LEU 11 416 416 LEU LEU B . n 
B 1 12 LEU 12 417 417 LEU LEU B . n 
B 1 13 ASP 13 418 418 ASP ASP B . n 
B 1 14 GLY 14 419 419 GLY GLY B . n 
B 1 15 LEU 15 420 420 LEU LEU B . n 
B 1 16 ASP 16 421 421 ASP ASP B . n 
B 1 17 LEU 17 422 422 LEU LEU B . n 
B 1 18 VAL 18 423 423 VAL VAL B . n 
B 1 19 LYS 19 424 424 LYS LYS B . n 
B 1 20 GLY 20 425 425 GLY GLY B . n 
B 1 21 PRO 21 426 426 PRO PRO B . n 
B 1 22 ARG 22 427 427 ARG ARG B . n 
B 1 23 TRP 23 428 428 TRP TRP B . n 
B 1 24 SER 24 429 429 SER SER B . n 
B 1 25 GLN 25 430 430 GLN GLN B . n 
B 1 26 ILE 26 431 431 ILE ILE B . n 
B 1 27 LEU 27 432 432 LEU LEU B . n 
B 1 28 GLU 28 433 433 GLU GLU B . n 
B 1 29 LEU 29 434 434 LEU LEU B . n 
B 1 30 TYR 30 435 435 TYR TYR B . n 
B 1 31 GLY 31 436 436 GLY GLY B . n 
B 1 32 PRO 32 437 437 PRO PRO B . n 
B 1 33 GLY 33 438 438 GLY GLY B . n 
B 1 34 GLY 34 439 439 GLY GLY B . n 
B 1 35 LYS 35 440 440 LYS LYS B . n 
B 1 36 LYS 36 441 441 LYS LYS B . n 
B 1 37 SER 37 442 442 SER SER B . n 
B 1 38 GLU 38 443 443 GLU GLU B . n 
B 1 39 VAL 39 444 444 VAL VAL B . n 
B 1 40 LEU 40 445 445 LEU LEU B . n 
B 1 41 LYS 41 446 446 LYS LYS B . n 
B 1 42 TYR 42 447 447 TYR TYR B . n 
B 1 43 ARG 43 448 448 ARG ARG B . n 
B 1 44 ASN 44 449 449 ASN ASN B . n 
B 1 45 GLN 45 450 450 GLN GLN B . n 
B 1 46 VAL 46 451 451 VAL VAL B . n 
B 1 47 GLN 47 452 452 GLN GLN B . n 
B 1 48 LEU 48 453 453 LEU LEU B . n 
B 1 49 LYS 49 454 454 LYS LYS B . n 
B 1 50 ASP 50 455 455 ASP ASP B . n 
B 1 51 LYS 51 456 456 LYS LYS B . n 
B 1 52 ALA 52 457 457 ALA ALA B . n 
B 1 53 ARG 53 458 458 ARG ARG B . n 
B 1 54 ASN 54 459 459 ASN ASN B . n 
B 1 55 MET 55 460 460 MET MET B . n 
B 1 56 LYS 56 461 461 LYS LYS B . n 
B 1 57 LEU 57 462 462 LEU LEU B . n 
B 1 58 PHE 58 463 463 PHE PHE B . n 
B 1 59 PHE 59 464 464 PHE PHE B . n 
B 1 60 LEU 60 465 465 LEU LEU B . n 
B 1 61 LYS 61 466 466 LYS LYS B . n 
B 1 62 SER 62 467 467 SER SER B . n 
B 1 63 GLY 63 468 468 GLY GLY B . n 
B 1 64 GLN 64 469 469 GLN GLN B . n 
B 1 65 VAL 65 470 470 VAL VAL B . n 
B 1 66 VAL 66 471 471 VAL VAL B . n 
B 1 67 PRO 67 472 472 PRO PRO B . n 
B 1 68 ALA 68 473 473 ALA ALA B . n 
B 1 69 ALA 69 474 474 ALA ALA B . n 
B 1 70 LEU 70 475 475 LEU LEU B . n 
B 1 71 GLN 71 476 476 GLN GLN B . n 
B 1 72 CYS 72 477 477 CYS CYS B . n 
B 1 73 VAL 73 478 478 VAL VAL B . n 
B 1 74 THR 74 479 479 THR THR B . n 
B 1 75 GLY 75 480 480 GLY GLY B . n 
B 1 76 ASP 76 481 481 ASP ASP B . n 
B 1 77 LEU 77 482 482 LEU LEU B . n 
B 1 78 ARG 78 483 483 ARG ARG B . n 
B 1 79 ARG 79 484 484 ARG ARG B . n 
B 1 80 ASP 80 485 ?   ?   ?   B . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 2 GOL 1  501 201 GOL GOL A . 
D 3 HOH 1  601 31  HOH HOH A . 
D 3 HOH 2  602 21  HOH HOH A . 
D 3 HOH 3  603 4   HOH HOH A . 
D 3 HOH 4  604 38  HOH HOH A . 
D 3 HOH 5  605 91  HOH HOH A . 
D 3 HOH 6  606 7   HOH HOH A . 
D 3 HOH 7  607 59  HOH HOH A . 
D 3 HOH 8  608 56  HOH HOH A . 
D 3 HOH 9  609 64  HOH HOH A . 
D 3 HOH 10 610 45  HOH HOH A . 
D 3 HOH 11 611 133 HOH HOH A . 
D 3 HOH 12 612 9   HOH HOH A . 
D 3 HOH 13 613 10  HOH HOH A . 
D 3 HOH 14 614 14  HOH HOH A . 
D 3 HOH 15 615 72  HOH HOH A . 
D 3 HOH 16 616 3   HOH HOH A . 
D 3 HOH 17 617 23  HOH HOH A . 
D 3 HOH 18 618 134 HOH HOH A . 
D 3 HOH 19 619 25  HOH HOH A . 
D 3 HOH 20 620 60  HOH HOH A . 
D 3 HOH 21 621 83  HOH HOH A . 
D 3 HOH 22 622 71  HOH HOH A . 
D 3 HOH 23 623 55  HOH HOH A . 
D 3 HOH 24 624 53  HOH HOH A . 
D 3 HOH 25 625 101 HOH HOH A . 
D 3 HOH 26 626 119 HOH HOH A . 
D 3 HOH 27 627 15  HOH HOH A . 
D 3 HOH 28 628 18  HOH HOH A . 
D 3 HOH 29 629 1   HOH HOH A . 
D 3 HOH 30 630 5   HOH HOH A . 
D 3 HOH 31 631 70  HOH HOH A . 
D 3 HOH 32 632 6   HOH HOH A . 
D 3 HOH 33 633 61  HOH HOH A . 
D 3 HOH 34 634 87  HOH HOH A . 
D 3 HOH 35 635 20  HOH HOH A . 
D 3 HOH 36 636 100 HOH HOH A . 
D 3 HOH 37 637 32  HOH HOH A . 
D 3 HOH 38 638 28  HOH HOH A . 
D 3 HOH 39 639 16  HOH HOH A . 
D 3 HOH 40 640 111 HOH HOH A . 
D 3 HOH 41 641 13  HOH HOH A . 
D 3 HOH 42 642 89  HOH HOH A . 
D 3 HOH 43 643 113 HOH HOH A . 
D 3 HOH 44 644 11  HOH HOH A . 
D 3 HOH 45 645 49  HOH HOH A . 
D 3 HOH 46 646 27  HOH HOH A . 
D 3 HOH 47 647 34  HOH HOH A . 
D 3 HOH 48 648 132 HOH HOH A . 
D 3 HOH 49 649 54  HOH HOH A . 
D 3 HOH 50 650 127 HOH HOH A . 
D 3 HOH 51 651 97  HOH HOH A . 
D 3 HOH 52 652 46  HOH HOH A . 
D 3 HOH 53 653 43  HOH HOH A . 
D 3 HOH 54 654 82  HOH HOH A . 
D 3 HOH 55 655 90  HOH HOH A . 
D 3 HOH 56 656 44  HOH HOH A . 
D 3 HOH 57 657 112 HOH HOH A . 
D 3 HOH 58 658 17  HOH HOH A . 
D 3 HOH 59 659 75  HOH HOH A . 
D 3 HOH 60 660 98  HOH HOH A . 
D 3 HOH 61 661 109 HOH HOH A . 
D 3 HOH 62 662 136 HOH HOH A . 
D 3 HOH 63 663 26  HOH HOH A . 
D 3 HOH 64 664 63  HOH HOH A . 
D 3 HOH 65 665 51  HOH HOH A . 
D 3 HOH 66 666 69  HOH HOH A . 
D 3 HOH 67 667 135 HOH HOH A . 
D 3 HOH 68 668 92  HOH HOH A . 
D 3 HOH 69 669 84  HOH HOH A . 
D 3 HOH 70 670 99  HOH HOH A . 
D 3 HOH 71 671 96  HOH HOH A . 
D 3 HOH 72 672 65  HOH HOH A . 
D 3 HOH 73 673 137 HOH HOH A . 
D 3 HOH 74 674 118 HOH HOH A . 
D 3 HOH 75 675 79  HOH HOH A . 
D 3 HOH 76 676 39  HOH HOH A . 
D 3 HOH 77 677 121 HOH HOH A . 
D 3 HOH 78 678 131 HOH HOH A . 
D 3 HOH 79 679 115 HOH HOH A . 
D 3 HOH 80 680 42  HOH HOH A . 
D 3 HOH 81 681 47  HOH HOH A . 
D 3 HOH 82 682 93  HOH HOH A . 
D 3 HOH 83 683 62  HOH HOH A . 
D 3 HOH 84 684 88  HOH HOH A . 
D 3 HOH 85 685 105 HOH HOH A . 
D 3 HOH 86 686 66  HOH HOH A . 
D 3 HOH 87 687 94  HOH HOH A . 
D 3 HOH 88 688 120 HOH HOH A . 
E 3 HOH 1  501 73  HOH HOH B . 
E 3 HOH 2  502 68  HOH HOH B . 
E 3 HOH 3  503 126 HOH HOH B . 
E 3 HOH 4  504 106 HOH HOH B . 
E 3 HOH 5  505 22  HOH HOH B . 
E 3 HOH 6  506 12  HOH HOH B . 
E 3 HOH 7  507 77  HOH HOH B . 
E 3 HOH 8  508 81  HOH HOH B . 
E 3 HOH 9  509 24  HOH HOH B . 
E 3 HOH 10 510 85  HOH HOH B . 
E 3 HOH 11 511 52  HOH HOH B . 
E 3 HOH 12 512 78  HOH HOH B . 
E 3 HOH 13 513 37  HOH HOH B . 
E 3 HOH 14 514 125 HOH HOH B . 
E 3 HOH 15 515 108 HOH HOH B . 
E 3 HOH 16 516 30  HOH HOH B . 
E 3 HOH 17 517 29  HOH HOH B . 
E 3 HOH 18 518 102 HOH HOH B . 
E 3 HOH 19 519 50  HOH HOH B . 
E 3 HOH 20 520 19  HOH HOH B . 
E 3 HOH 21 521 41  HOH HOH B . 
E 3 HOH 22 522 57  HOH HOH B . 
E 3 HOH 23 523 123 HOH HOH B . 
E 3 HOH 24 524 36  HOH HOH B . 
E 3 HOH 25 525 76  HOH HOH B . 
E 3 HOH 26 526 129 HOH HOH B . 
E 3 HOH 27 527 2   HOH HOH B . 
E 3 HOH 28 528 80  HOH HOH B . 
E 3 HOH 29 529 122 HOH HOH B . 
E 3 HOH 30 530 116 HOH HOH B . 
E 3 HOH 31 531 40  HOH HOH B . 
E 3 HOH 32 532 104 HOH HOH B . 
E 3 HOH 33 533 128 HOH HOH B . 
E 3 HOH 34 534 103 HOH HOH B . 
E 3 HOH 35 535 74  HOH HOH B . 
E 3 HOH 36 536 48  HOH HOH B . 
E 3 HOH 37 537 110 HOH HOH B . 
E 3 HOH 38 538 86  HOH HOH B . 
E 3 HOH 39 539 58  HOH HOH B . 
E 3 HOH 40 540 124 HOH HOH B . 
E 3 HOH 41 541 130 HOH HOH B . 
E 3 HOH 42 542 8   HOH HOH B . 
E 3 HOH 43 543 95  HOH HOH B . 
E 3 HOH 44 544 35  HOH HOH B . 
E 3 HOH 45 545 117 HOH HOH B . 
E 3 HOH 46 546 114 HOH HOH B . 
E 3 HOH 47 547 33  HOH HOH B . 
E 3 HOH 48 548 107 HOH HOH B . 
E 3 HOH 49 549 67  HOH HOH B . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX   ? ? ? 1.13_2998 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? .         2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? .         3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER   ? ? ? .         4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8YNU 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     41.393 
_cell.length_a_esd                 ? 
_cell.length_b                     62.230 
_cell.length_b_esd                 ? 
_cell.length_c                     86.773 
_cell.length_c_esd                 ? 
_cell.volume                       223517.390 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8YNU 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                16 
_symmetry.space_group_name_Hall            'P 2 2' 
_symmetry.space_group_name_H-M             'P 2 2 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8YNU 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             3.09 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          60.23 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '16% PEG 8000, 40mM Potassium phosphate dibasic, 20% Glycerol' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            277.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2017-01-15 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97778 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SSRF BEAMLINE BL18U1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97778 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL18U1 
_diffrn_source.pdbx_synchrotron_site       SSRF 
# 
_reflns.B_iso_Wilson_estimate                          20.63 
_reflns.entry_id                                       8YNU 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.76 
_reflns.d_resolution_low                               50.00 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     292977 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                12.9 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          36.28 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.112 
_reflns.pdbx_Rpim_I_all                                0.031 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   ? 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.107 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                0.107 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.76 
_reflns_shell.d_res_low                                     1.79 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           6.083 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             1114 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               0.396 
_reflns_shell.pdbx_Rpim_I_all                               0.111 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.937 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  0.380 
_reflns_shell.pdbx_Rsym_value                               0.380 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               24.35 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8YNU 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.76 
_refine.ls_d_res_low                             43.39 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     22680 
_refine.ls_number_reflns_R_free                  1133 
_refine.ls_number_reflns_R_work                  21547 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.56 
_refine.ls_percent_reflns_R_free                 5.00 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1955 
_refine.ls_R_factor_R_free                       0.2320 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1936 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.36 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1100 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 20.7545 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.1717 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.76 
_refine_hist.d_res_low                        43.39 
_refine_hist.number_atoms_solvent             137 
_refine_hist.number_atoms_total               1403 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1260 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         6 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.0087  ? 1283 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.8857  ? 1718 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0544  ? 185  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0042  ? 218  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 19.7620 ? 500  ? f_dihedral_angle_d ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.76 1.84  . . 138 2606 98.42 . . . . 0.2312 . . . . . . . . . . . 0.2630 
'X-RAY DIFFRACTION' 1.84 1.94  . . 140 2659 99.89 . . . . 0.1983 . . . . . . . . . . . 0.2373 
'X-RAY DIFFRACTION' 1.94 2.06  . . 139 2650 99.89 . . . . 0.1956 . . . . . . . . . . . 0.2218 
'X-RAY DIFFRACTION' 2.06 2.22  . . 140 2671 99.86 . . . . 0.1995 . . . . . . . . . . . 0.2362 
'X-RAY DIFFRACTION' 2.22 2.45  . . 140 2679 99.86 . . . . 0.1965 . . . . . . . . . . . 0.2535 
'X-RAY DIFFRACTION' 2.45 2.80  . . 142 2700 99.79 . . . . 0.2075 . . . . . . . . . . . 0.2302 
'X-RAY DIFFRACTION' 2.80 3.53  . . 142 2722 99.76 . . . . 0.1991 . . . . . . . . . . . 0.2463 
'X-RAY DIFFRACTION' 3.53 43.39 . . 152 2860 99.08 . . . . 0.1750 . . . . . . . . . . . 0.2107 
# 
_struct.entry_id                     8YNU 
_struct.title                        'Crystal structure of the myb domain of S.pombe Tbf1 in the P222 space group' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        8YNU 
_struct_keywords.text            'Telomere binding protein, DNA BINDING PROTEIN' 
_struct_keywords.pdbx_keywords   'DNA BINDING PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 1 ? 
C N N 2 ? 
D N N 3 ? 
E N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    TRF1_SCHPO 
_struct_ref.pdbx_db_accession          Q6E434 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   SWTKEEEEALLDGLDLVKGPRWSQILELYGPGGKKSEVLKYRNQVQLKDKARNMKLFFLKSGQVVPAALQCVTGDLRRD 
_struct_ref.pdbx_align_begin           407 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 8YNU A 2 ? 80 ? Q6E434 407 ? 485 ? 407 485 
2 1 8YNU B 2 ? 80 ? Q6E434 407 ? 485 ? 407 485 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 8YNU GLY A 1 ? UNP Q6E434 ? ? 'expression tag' 406 1 
2 8YNU GLY B 1 ? UNP Q6E434 ? ? 'expression tag' 406 2 
# 
loop_
_pdbx_struct_assembly.id 
_pdbx_struct_assembly.details 
_pdbx_struct_assembly.method_details 
_pdbx_struct_assembly.oligomeric_details 
_pdbx_struct_assembly.oligomeric_count 
1 author_defined_assembly ? monomeric 1 
2 author_defined_assembly ? monomeric 1 
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 1 A,C,D 
2 1 B,E   
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 THR A 4  ? LYS A 19 ? THR A 409 LYS A 424 1 ? 16 
HELX_P HELX_P2 AA2 ARG A 22 ? GLY A 31 ? ARG A 427 GLY A 436 1 ? 10 
HELX_P HELX_P3 AA3 ASN A 44 ? SER A 62 ? ASN A 449 SER A 467 1 ? 19 
HELX_P HELX_P4 AA4 PRO A 67 ? GLN A 71 ? PRO A 472 GLN A 476 5 ? 5  
HELX_P HELX_P5 AA5 THR B 4  ? VAL B 18 ? THR B 409 VAL B 423 1 ? 15 
HELX_P HELX_P6 AA6 ARG B 22 ? GLY B 31 ? ARG B 427 GLY B 436 1 ? 10 
HELX_P HELX_P7 AA7 ASN B 44 ? SER B 62 ? ASN B 449 SER B 467 1 ? 19 
HELX_P HELX_P8 AA8 PRO B 67 ? CYS B 72 ? PRO B 472 CYS B 477 1 ? 6  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_pdbx_entry_details.entry_id                   8YNU 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 O  B LYS 424 ? ? 1_555 N  B GLY 425 ? ? 2_645 0.09 
2 1 C  B LYS 424 ? ? 1_555 N  B GLY 425 ? ? 2_645 1.29 
3 1 C3 A GOL 501 ? ? 1_555 O3 A GOL 501 ? ? 2_555 1.40 
4 1 O  B LYS 424 ? ? 1_555 CA B GLY 425 ? ? 2_645 1.49 
# 
_pdbx_validate_polymer_linkage.id               1 
_pdbx_validate_polymer_linkage.PDB_model_num    1 
_pdbx_validate_polymer_linkage.auth_atom_id_1   C 
_pdbx_validate_polymer_linkage.auth_asym_id_1   B 
_pdbx_validate_polymer_linkage.auth_comp_id_1   LYS 
_pdbx_validate_polymer_linkage.auth_seq_id_1    424 
_pdbx_validate_polymer_linkage.PDB_ins_code_1   ? 
_pdbx_validate_polymer_linkage.label_alt_id_1   ? 
_pdbx_validate_polymer_linkage.auth_atom_id_2   N 
_pdbx_validate_polymer_linkage.auth_asym_id_2   B 
_pdbx_validate_polymer_linkage.auth_comp_id_2   GLY 
_pdbx_validate_polymer_linkage.auth_seq_id_2    425 
_pdbx_validate_polymer_linkage.PDB_ins_code_2   ? 
_pdbx_validate_polymer_linkage.label_alt_id_2   ? 
_pdbx_validate_polymer_linkage.dist             9.32 
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 A GOL 501 ? C GOL . 
2 1 A HOH 657 ? D HOH . 
3 1 B HOH 536 ? E HOH . 
4 1 B HOH 547 ? E HOH . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z   
2 x,-y,-z 
3 -x,y,-z 
4 -x,-y,z 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1 1 Y 1 B GLY 406 ? B GLY 1  
2 1 Y 1 B ASP 485 ? B ASP 80 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
GOL C1   C N N 137 
GOL O1   O N N 138 
GOL C2   C N N 139 
GOL O2   O N N 140 
GOL C3   C N N 141 
GOL O3   O N N 142 
GOL H11  H N N 143 
GOL H12  H N N 144 
GOL HO1  H N N 145 
GOL H2   H N N 146 
GOL HO2  H N N 147 
GOL H31  H N N 148 
GOL H32  H N N 149 
GOL HO3  H N N 150 
HOH O    O N N 151 
HOH H1   H N N 152 
HOH H2   H N N 153 
ILE N    N N N 154 
ILE CA   C N S 155 
ILE C    C N N 156 
ILE O    O N N 157 
ILE CB   C N S 158 
ILE CG1  C N N 159 
ILE CG2  C N N 160 
ILE CD1  C N N 161 
ILE OXT  O N N 162 
ILE H    H N N 163 
ILE H2   H N N 164 
ILE HA   H N N 165 
ILE HB   H N N 166 
ILE HG12 H N N 167 
ILE HG13 H N N 168 
ILE HG21 H N N 169 
ILE HG22 H N N 170 
ILE HG23 H N N 171 
ILE HD11 H N N 172 
ILE HD12 H N N 173 
ILE HD13 H N N 174 
ILE HXT  H N N 175 
LEU N    N N N 176 
LEU CA   C N S 177 
LEU C    C N N 178 
LEU O    O N N 179 
LEU CB   C N N 180 
LEU CG   C N N 181 
LEU CD1  C N N 182 
LEU CD2  C N N 183 
LEU OXT  O N N 184 
LEU H    H N N 185 
LEU H2   H N N 186 
LEU HA   H N N 187 
LEU HB2  H N N 188 
LEU HB3  H N N 189 
LEU HG   H N N 190 
LEU HD11 H N N 191 
LEU HD12 H N N 192 
LEU HD13 H N N 193 
LEU HD21 H N N 194 
LEU HD22 H N N 195 
LEU HD23 H N N 196 
LEU HXT  H N N 197 
LYS N    N N N 198 
LYS CA   C N S 199 
LYS C    C N N 200 
LYS O    O N N 201 
LYS CB   C N N 202 
LYS CG   C N N 203 
LYS CD   C N N 204 
LYS CE   C N N 205 
LYS NZ   N N N 206 
LYS OXT  O N N 207 
LYS H    H N N 208 
LYS H2   H N N 209 
LYS HA   H N N 210 
LYS HB2  H N N 211 
LYS HB3  H N N 212 
LYS HG2  H N N 213 
LYS HG3  H N N 214 
LYS HD2  H N N 215 
LYS HD3  H N N 216 
LYS HE2  H N N 217 
LYS HE3  H N N 218 
LYS HZ1  H N N 219 
LYS HZ2  H N N 220 
LYS HZ3  H N N 221 
LYS HXT  H N N 222 
MET N    N N N 223 
MET CA   C N S 224 
MET C    C N N 225 
MET O    O N N 226 
MET CB   C N N 227 
MET CG   C N N 228 
MET SD   S N N 229 
MET CE   C N N 230 
MET OXT  O N N 231 
MET H    H N N 232 
MET H2   H N N 233 
MET HA   H N N 234 
MET HB2  H N N 235 
MET HB3  H N N 236 
MET HG2  H N N 237 
MET HG3  H N N 238 
MET HE1  H N N 239 
MET HE2  H N N 240 
MET HE3  H N N 241 
MET HXT  H N N 242 
PHE N    N N N 243 
PHE CA   C N S 244 
PHE C    C N N 245 
PHE O    O N N 246 
PHE CB   C N N 247 
PHE CG   C Y N 248 
PHE CD1  C Y N 249 
PHE CD2  C Y N 250 
PHE CE1  C Y N 251 
PHE CE2  C Y N 252 
PHE CZ   C Y N 253 
PHE OXT  O N N 254 
PHE H    H N N 255 
PHE H2   H N N 256 
PHE HA   H N N 257 
PHE HB2  H N N 258 
PHE HB3  H N N 259 
PHE HD1  H N N 260 
PHE HD2  H N N 261 
PHE HE1  H N N 262 
PHE HE2  H N N 263 
PHE HZ   H N N 264 
PHE HXT  H N N 265 
PRO N    N N N 266 
PRO CA   C N S 267 
PRO C    C N N 268 
PRO O    O N N 269 
PRO CB   C N N 270 
PRO CG   C N N 271 
PRO CD   C N N 272 
PRO OXT  O N N 273 
PRO H    H N N 274 
PRO HA   H N N 275 
PRO HB2  H N N 276 
PRO HB3  H N N 277 
PRO HG2  H N N 278 
PRO HG3  H N N 279 
PRO HD2  H N N 280 
PRO HD3  H N N 281 
PRO HXT  H N N 282 
SER N    N N N 283 
SER CA   C N S 284 
SER C    C N N 285 
SER O    O N N 286 
SER CB   C N N 287 
SER OG   O N N 288 
SER OXT  O N N 289 
SER H    H N N 290 
SER H2   H N N 291 
SER HA   H N N 292 
SER HB2  H N N 293 
SER HB3  H N N 294 
SER HG   H N N 295 
SER HXT  H N N 296 
THR N    N N N 297 
THR CA   C N S 298 
THR C    C N N 299 
THR O    O N N 300 
THR CB   C N R 301 
THR OG1  O N N 302 
THR CG2  C N N 303 
THR OXT  O N N 304 
THR H    H N N 305 
THR H2   H N N 306 
THR HA   H N N 307 
THR HB   H N N 308 
THR HG1  H N N 309 
THR HG21 H N N 310 
THR HG22 H N N 311 
THR HG23 H N N 312 
THR HXT  H N N 313 
TRP N    N N N 314 
TRP CA   C N S 315 
TRP C    C N N 316 
TRP O    O N N 317 
TRP CB   C N N 318 
TRP CG   C Y N 319 
TRP CD1  C Y N 320 
TRP CD2  C Y N 321 
TRP NE1  N Y N 322 
TRP CE2  C Y N 323 
TRP CE3  C Y N 324 
TRP CZ2  C Y N 325 
TRP CZ3  C Y N 326 
TRP CH2  C Y N 327 
TRP OXT  O N N 328 
TRP H    H N N 329 
TRP H2   H N N 330 
TRP HA   H N N 331 
TRP HB2  H N N 332 
TRP HB3  H N N 333 
TRP HD1  H N N 334 
TRP HE1  H N N 335 
TRP HE3  H N N 336 
TRP HZ2  H N N 337 
TRP HZ3  H N N 338 
TRP HH2  H N N 339 
TRP HXT  H N N 340 
TYR N    N N N 341 
TYR CA   C N S 342 
TYR C    C N N 343 
TYR O    O N N 344 
TYR CB   C N N 345 
TYR CG   C Y N 346 
TYR CD1  C Y N 347 
TYR CD2  C Y N 348 
TYR CE1  C Y N 349 
TYR CE2  C Y N 350 
TYR CZ   C Y N 351 
TYR OH   O N N 352 
TYR OXT  O N N 353 
TYR H    H N N 354 
TYR H2   H N N 355 
TYR HA   H N N 356 
TYR HB2  H N N 357 
TYR HB3  H N N 358 
TYR HD1  H N N 359 
TYR HD2  H N N 360 
TYR HE1  H N N 361 
TYR HE2  H N N 362 
TYR HH   H N N 363 
TYR HXT  H N N 364 
VAL N    N N N 365 
VAL CA   C N S 366 
VAL C    C N N 367 
VAL O    O N N 368 
VAL CB   C N N 369 
VAL CG1  C N N 370 
VAL CG2  C N N 371 
VAL OXT  O N N 372 
VAL H    H N N 373 
VAL H2   H N N 374 
VAL HA   H N N 375 
VAL HB   H N N 376 
VAL HG11 H N N 377 
VAL HG12 H N N 378 
VAL HG13 H N N 379 
VAL HG21 H N N 380 
VAL HG22 H N N 381 
VAL HG23 H N N 382 
VAL HXT  H N N 383 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
GOL C1  O1   sing N N 129 
GOL C1  C2   sing N N 130 
GOL C1  H11  sing N N 131 
GOL C1  H12  sing N N 132 
GOL O1  HO1  sing N N 133 
GOL C2  O2   sing N N 134 
GOL C2  C3   sing N N 135 
GOL C2  H2   sing N N 136 
GOL O2  HO2  sing N N 137 
GOL C3  O3   sing N N 138 
GOL C3  H31  sing N N 139 
GOL C3  H32  sing N N 140 
GOL O3  HO3  sing N N 141 
HOH O   H1   sing N N 142 
HOH O   H2   sing N N 143 
ILE N   CA   sing N N 144 
ILE N   H    sing N N 145 
ILE N   H2   sing N N 146 
ILE CA  C    sing N N 147 
ILE CA  CB   sing N N 148 
ILE CA  HA   sing N N 149 
ILE C   O    doub N N 150 
ILE C   OXT  sing N N 151 
ILE CB  CG1  sing N N 152 
ILE CB  CG2  sing N N 153 
ILE CB  HB   sing N N 154 
ILE CG1 CD1  sing N N 155 
ILE CG1 HG12 sing N N 156 
ILE CG1 HG13 sing N N 157 
ILE CG2 HG21 sing N N 158 
ILE CG2 HG22 sing N N 159 
ILE CG2 HG23 sing N N 160 
ILE CD1 HD11 sing N N 161 
ILE CD1 HD12 sing N N 162 
ILE CD1 HD13 sing N N 163 
ILE OXT HXT  sing N N 164 
LEU N   CA   sing N N 165 
LEU N   H    sing N N 166 
LEU N   H2   sing N N 167 
LEU CA  C    sing N N 168 
LEU CA  CB   sing N N 169 
LEU CA  HA   sing N N 170 
LEU C   O    doub N N 171 
LEU C   OXT  sing N N 172 
LEU CB  CG   sing N N 173 
LEU CB  HB2  sing N N 174 
LEU CB  HB3  sing N N 175 
LEU CG  CD1  sing N N 176 
LEU CG  CD2  sing N N 177 
LEU CG  HG   sing N N 178 
LEU CD1 HD11 sing N N 179 
LEU CD1 HD12 sing N N 180 
LEU CD1 HD13 sing N N 181 
LEU CD2 HD21 sing N N 182 
LEU CD2 HD22 sing N N 183 
LEU CD2 HD23 sing N N 184 
LEU OXT HXT  sing N N 185 
LYS N   CA   sing N N 186 
LYS N   H    sing N N 187 
LYS N   H2   sing N N 188 
LYS CA  C    sing N N 189 
LYS CA  CB   sing N N 190 
LYS CA  HA   sing N N 191 
LYS C   O    doub N N 192 
LYS C   OXT  sing N N 193 
LYS CB  CG   sing N N 194 
LYS CB  HB2  sing N N 195 
LYS CB  HB3  sing N N 196 
LYS CG  CD   sing N N 197 
LYS CG  HG2  sing N N 198 
LYS CG  HG3  sing N N 199 
LYS CD  CE   sing N N 200 
LYS CD  HD2  sing N N 201 
LYS CD  HD3  sing N N 202 
LYS CE  NZ   sing N N 203 
LYS CE  HE2  sing N N 204 
LYS CE  HE3  sing N N 205 
LYS NZ  HZ1  sing N N 206 
LYS NZ  HZ2  sing N N 207 
LYS NZ  HZ3  sing N N 208 
LYS OXT HXT  sing N N 209 
MET N   CA   sing N N 210 
MET N   H    sing N N 211 
MET N   H2   sing N N 212 
MET CA  C    sing N N 213 
MET CA  CB   sing N N 214 
MET CA  HA   sing N N 215 
MET C   O    doub N N 216 
MET C   OXT  sing N N 217 
MET CB  CG   sing N N 218 
MET CB  HB2  sing N N 219 
MET CB  HB3  sing N N 220 
MET CG  SD   sing N N 221 
MET CG  HG2  sing N N 222 
MET CG  HG3  sing N N 223 
MET SD  CE   sing N N 224 
MET CE  HE1  sing N N 225 
MET CE  HE2  sing N N 226 
MET CE  HE3  sing N N 227 
MET OXT HXT  sing N N 228 
PHE N   CA   sing N N 229 
PHE N   H    sing N N 230 
PHE N   H2   sing N N 231 
PHE CA  C    sing N N 232 
PHE CA  CB   sing N N 233 
PHE CA  HA   sing N N 234 
PHE C   O    doub N N 235 
PHE C   OXT  sing N N 236 
PHE CB  CG   sing N N 237 
PHE CB  HB2  sing N N 238 
PHE CB  HB3  sing N N 239 
PHE CG  CD1  doub Y N 240 
PHE CG  CD2  sing Y N 241 
PHE CD1 CE1  sing Y N 242 
PHE CD1 HD1  sing N N 243 
PHE CD2 CE2  doub Y N 244 
PHE CD2 HD2  sing N N 245 
PHE CE1 CZ   doub Y N 246 
PHE CE1 HE1  sing N N 247 
PHE CE2 CZ   sing Y N 248 
PHE CE2 HE2  sing N N 249 
PHE CZ  HZ   sing N N 250 
PHE OXT HXT  sing N N 251 
PRO N   CA   sing N N 252 
PRO N   CD   sing N N 253 
PRO N   H    sing N N 254 
PRO CA  C    sing N N 255 
PRO CA  CB   sing N N 256 
PRO CA  HA   sing N N 257 
PRO C   O    doub N N 258 
PRO C   OXT  sing N N 259 
PRO CB  CG   sing N N 260 
PRO CB  HB2  sing N N 261 
PRO CB  HB3  sing N N 262 
PRO CG  CD   sing N N 263 
PRO CG  HG2  sing N N 264 
PRO CG  HG3  sing N N 265 
PRO CD  HD2  sing N N 266 
PRO CD  HD3  sing N N 267 
PRO OXT HXT  sing N N 268 
SER N   CA   sing N N 269 
SER N   H    sing N N 270 
SER N   H2   sing N N 271 
SER CA  C    sing N N 272 
SER CA  CB   sing N N 273 
SER CA  HA   sing N N 274 
SER C   O    doub N N 275 
SER C   OXT  sing N N 276 
SER CB  OG   sing N N 277 
SER CB  HB2  sing N N 278 
SER CB  HB3  sing N N 279 
SER OG  HG   sing N N 280 
SER OXT HXT  sing N N 281 
THR N   CA   sing N N 282 
THR N   H    sing N N 283 
THR N   H2   sing N N 284 
THR CA  C    sing N N 285 
THR CA  CB   sing N N 286 
THR CA  HA   sing N N 287 
THR C   O    doub N N 288 
THR C   OXT  sing N N 289 
THR CB  OG1  sing N N 290 
THR CB  CG2  sing N N 291 
THR CB  HB   sing N N 292 
THR OG1 HG1  sing N N 293 
THR CG2 HG21 sing N N 294 
THR CG2 HG22 sing N N 295 
THR CG2 HG23 sing N N 296 
THR OXT HXT  sing N N 297 
TRP N   CA   sing N N 298 
TRP N   H    sing N N 299 
TRP N   H2   sing N N 300 
TRP CA  C    sing N N 301 
TRP CA  CB   sing N N 302 
TRP CA  HA   sing N N 303 
TRP C   O    doub N N 304 
TRP C   OXT  sing N N 305 
TRP CB  CG   sing N N 306 
TRP CB  HB2  sing N N 307 
TRP CB  HB3  sing N N 308 
TRP CG  CD1  doub Y N 309 
TRP CG  CD2  sing Y N 310 
TRP CD1 NE1  sing Y N 311 
TRP CD1 HD1  sing N N 312 
TRP CD2 CE2  doub Y N 313 
TRP CD2 CE3  sing Y N 314 
TRP NE1 CE2  sing Y N 315 
TRP NE1 HE1  sing N N 316 
TRP CE2 CZ2  sing Y N 317 
TRP CE3 CZ3  doub Y N 318 
TRP CE3 HE3  sing N N 319 
TRP CZ2 CH2  doub Y N 320 
TRP CZ2 HZ2  sing N N 321 
TRP CZ3 CH2  sing Y N 322 
TRP CZ3 HZ3  sing N N 323 
TRP CH2 HH2  sing N N 324 
TRP OXT HXT  sing N N 325 
TYR N   CA   sing N N 326 
TYR N   H    sing N N 327 
TYR N   H2   sing N N 328 
TYR CA  C    sing N N 329 
TYR CA  CB   sing N N 330 
TYR CA  HA   sing N N 331 
TYR C   O    doub N N 332 
TYR C   OXT  sing N N 333 
TYR CB  CG   sing N N 334 
TYR CB  HB2  sing N N 335 
TYR CB  HB3  sing N N 336 
TYR CG  CD1  doub Y N 337 
TYR CG  CD2  sing Y N 338 
TYR CD1 CE1  sing Y N 339 
TYR CD1 HD1  sing N N 340 
TYR CD2 CE2  doub Y N 341 
TYR CD2 HD2  sing N N 342 
TYR CE1 CZ   doub Y N 343 
TYR CE1 HE1  sing N N 344 
TYR CE2 CZ   sing Y N 345 
TYR CE2 HE2  sing N N 346 
TYR CZ  OH   sing N N 347 
TYR OH  HH   sing N N 348 
TYR OXT HXT  sing N N 349 
VAL N   CA   sing N N 350 
VAL N   H    sing N N 351 
VAL N   H2   sing N N 352 
VAL CA  C    sing N N 353 
VAL CA  CB   sing N N 354 
VAL CA  HA   sing N N 355 
VAL C   O    doub N N 356 
VAL C   OXT  sing N N 357 
VAL CB  CG1  sing N N 358 
VAL CB  CG2  sing N N 359 
VAL CB  HB   sing N N 360 
VAL CG1 HG11 sing N N 361 
VAL CG1 HG12 sing N N 362 
VAL CG1 HG13 sing N N 363 
VAL CG2 HG21 sing N N 364 
VAL CG2 HG22 sing N N 365 
VAL CG2 HG23 sing N N 366 
VAL OXT HXT  sing N N 367 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   6K5U 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 2 2 2' 
_space_group.name_Hall        'P 2 2' 
_space_group.IT_number        16 
_space_group.crystal_system   orthorhombic 
_space_group.id               1 
# 
_atom_sites.entry_id                    8YNU 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.024159 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.016069 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.011524 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C ? ? 3.54356 2.42580 25.62398 1.50364  0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N ? ? 4.01032 2.96436 19.97189 1.75589  0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O ? ? 4.49882 3.47563 15.80542 1.70748  0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S ? ? 9.55732 6.39887 1.23737  29.19336 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N   . GLY A 1 1  ? -4.26400 -15.78500 9.70400   1.000 36.04000 ? 406 GLY A N   1 
ATOM   2    C CA  . GLY A 1 1  ? -4.03500 -14.62500 8.84700   1.000 30.32000 ? 406 GLY A CA  1 
ATOM   3    C C   . GLY A 1 1  ? -2.85400 -13.79700 9.31500   1.000 27.19000 ? 406 GLY A C   1 
ATOM   4    O O   . GLY A 1 1  ? -1.73000 -14.00100 8.84600   1.000 24.99000 ? 406 GLY A O   1 
ATOM   5    N N   . SER A 1 2  ? -3.09700 -12.87000 10.24600  1.000 28.94000 ? 407 SER A N   1 
ATOM   6    C CA  . SER A 1 2  ? -2.02600 -12.02500 10.76400  1.000 26.38000 ? 407 SER A CA  1 
ATOM   7    C C   . SER A 1 2  ? -0.98500 -12.86100 11.50900  1.000 25.00000 ? 407 SER A C   1 
ATOM   8    O O   . SER A 1 2  ? -1.29400 -13.90500 12.08300  1.000 25.26000 ? 407 SER A O   1 
ATOM   9    C CB  . SER A 1 2  ? -2.59700 -10.94900 11.68700  1.000 31.20000 ? 407 SER A CB  1 
ATOM   10   O OG  . SER A 1 2  ? -3.41100 -11.52900 12.69700  1.000 38.39000 ? 407 SER A OG  1 
ATOM   11   N N   . TRP A 1 3  ? 0.26300  -12.38700 11.49600  1.000 19.91000 ? 408 TRP A N   1 
ATOM   12   C CA  . TRP A 1 3  ? 1.38800  -13.12400 12.07000  1.000 19.32000 ? 408 TRP A CA  1 
ATOM   13   C C   . TRP A 1 3  ? 1.64600  -12.69300 13.50500  1.000 22.91000 ? 408 TRP A C   1 
ATOM   14   O O   . TRP A 1 3  ? 1.44500  -11.52800 13.86700  1.000 23.22000 ? 408 TRP A O   1 
ATOM   15   C CB  . TRP A 1 3  ? 2.66300  -12.89700 11.25100  1.000 17.08000 ? 408 TRP A CB  1 
ATOM   16   C CG  . TRP A 1 3  ? 2.71800  -13.70800 9.99800   1.000 14.62000 ? 408 TRP A CG  1 
ATOM   17   C CD1 . TRP A 1 3  ? 1.74300  -13.81800 9.05400   1.000 17.38000 ? 408 TRP A CD1 1 
ATOM   18   C CD2 . TRP A 1 3  ? 3.81500  -14.50000 9.54300   1.000 12.69000 ? 408 TRP A CD2 1 
ATOM   19   N NE1 . TRP A 1 3  ? 2.15500  -14.64800 8.04000   1.000 13.55000 ? 408 TRP A NE1 1 
ATOM   20   C CE2 . TRP A 1 3  ? 3.42800  -15.07600 8.31200   1.000 14.61000 ? 408 TRP A CE2 1 
ATOM   21   C CE3 . TRP A 1 3  ? 5.09100  -14.77300 10.05200  1.000 14.34000 ? 408 TRP A CE3 1 
ATOM   22   C CZ2 . TRP A 1 3  ? 4.26000  -15.92000 7.59000   1.000 13.42000 ? 408 TRP A CZ2 1 
ATOM   23   C CZ3 . TRP A 1 3  ? 5.93100  -15.62500 9.32900   1.000 13.53000 ? 408 TRP A CZ3 1 
ATOM   24   C CH2 . TRP A 1 3  ? 5.50700  -16.18800 8.10700   1.000 12.59000 ? 408 TRP A CH2 1 
ATOM   25   N N   . THR A 1 4  ? 2.11400  -13.63600 14.32300  1.000 19.95000 ? 409 THR A N   1 
ATOM   26   C CA  . THR A 1 4  ? 2.60700  -13.26100 15.63900  1.000 19.45000 ? 409 THR A CA  1 
ATOM   27   C C   . THR A 1 4  ? 4.05100  -12.78000 15.56200  1.000 23.11000 ? 409 THR A C   1 
ATOM   28   O O   . THR A 1 4  ? 4.77100  -13.01500 14.58800  1.000 19.53000 ? 409 THR A O   1 
ATOM   29   C CB  . THR A 1 4  ? 2.55000  -14.42700 16.62000  1.000 20.09000 ? 409 THR A CB  1 
ATOM   30   O OG1 . THR A 1 4  ? 3.61500  -15.32700 16.32400  1.000 19.15000 ? 409 THR A OG1 1 
ATOM   31   C CG2 . THR A 1 4  ? 1.20900  -15.14700 16.54600  1.000 18.63000 ? 409 THR A CG2 1 
ATOM   32   N N   . LYS A 1 5  ? 4.46900  -12.10300 16.63300  1.000 25.24000 ? 410 LYS A N   1 
ATOM   33   C CA  . LYS A 1 5  ? 5.85700  -11.67100 16.76400  1.000 24.18000 ? 410 LYS A CA  1 
ATOM   34   C C   . LYS A 1 5  ? 6.79900  -12.86400 16.75400  1.000 22.12000 ? 410 LYS A C   1 
ATOM   35   O O   . LYS A 1 5  ? 7.89400  -12.79700 16.19200  1.000 22.75000 ? 410 LYS A O   1 
ATOM   36   C CB  . LYS A 1 5  ? 6.03900  -10.86000 18.05200  1.000 32.74000 ? 410 LYS A CB  1 
ATOM   37   C CG  . LYS A 1 5  ? 5.30100  -9.49900  18.10500  1.000 37.66000 ? 410 LYS A CG  1 
ATOM   38   C CD  . LYS A 1 5  ? 3.77300  -9.62200  18.13600  1.000 44.37000 ? 410 LYS A CD  1 
ATOM   39   C CE  . LYS A 1 5  ? 3.28400  -10.75100 19.05500  1.000 39.72000 ? 410 LYS A CE  1 
ATOM   40   N NZ  . LYS A 1 5  ? 1.89800  -11.14600 18.69300  1.000 40.75000 ? 410 LYS A NZ  1 
ATOM   41   N N   . GLU A 1 6  ? 6.37500  -13.97400 17.36200  1.000 19.94000 ? 411 GLU A N   1 
ATOM   42   C CA  . GLU A 1 6  ? 7.20000  -15.17200 17.40900  1.000 22.10000 ? 411 GLU A CA  1 
ATOM   43   C C   . GLU A 1 6  ? 7.37300  -15.78300 16.02600  1.000 19.95000 ? 411 GLU A C   1 
ATOM   44   O O   . GLU A 1 6  ? 8.46000  -16.26200 15.68700  1.000 18.81000 ? 411 GLU A O   1 
ATOM   45   C CB  . GLU A 1 6  ? 6.57000  -16.18600 18.36200  1.000 23.38000 ? 411 GLU A CB  1 
ATOM   46   C CG  . GLU A 1 6  ? 7.49400  -17.31700 18.75400  1.000 31.86000 ? 411 GLU A CG  1 
ATOM   47   C CD  . GLU A 1 6  ? 6.79800  -18.35900 19.62800  1.000 37.00000 ? 411 GLU A CD  1 
ATOM   48   O OE1 . GLU A 1 6  ? 5.53900  -18.41700 19.61900  1.000 38.01000 ? 411 GLU A OE1 1 
ATOM   49   O OE2 . GLU A 1 6  ? 7.51500  -19.11700 20.32100  1.000 38.90000 ? 411 GLU A OE2 1 
ATOM   50   N N   . GLU A 1 7  ? 6.30300  -15.79800 15.23200  1.000 17.74000 ? 412 GLU A N   1 
ATOM   51   C CA  . GLU A 1 7  ? 6.40400  -16.27600 13.85700  1.000 15.50000 ? 412 GLU A CA  1 
ATOM   52   C C   . GLU A 1 7  ? 7.35200  -15.40700 13.03500  1.000 15.05000 ? 412 GLU A C   1 
ATOM   53   O O   . GLU A 1 7  ? 8.17400  -15.92300 12.26700  1.000 15.65000 ? 412 GLU A O   1 
ATOM   54   C CB  . GLU A 1 7  ? 5.01800  -16.28400 13.21600  1.000 15.05000 ? 412 GLU A CB  1 
ATOM   55   C CG  . GLU A 1 7  ? 4.05000  -17.32700 13.77200  1.000 15.50000 ? 412 GLU A CG  1 
ATOM   56   C CD  . GLU A 1 7  ? 2.71000  -17.27900 13.05700  1.000 17.28000 ? 412 GLU A CD  1 
ATOM   57   O OE1 . GLU A 1 7  ? 2.06700  -16.20500 13.07600  1.000 19.00000 ? 412 GLU A OE1 1 
ATOM   58   O OE2 . GLU A 1 7  ? 2.31000  -18.29800 12.45100  1.000 17.44000 ? 412 GLU A OE2 1 
ATOM   59   N N   . GLU A 1 8  ? 7.24500  -14.08400 13.17300  1.000 15.58000 ? 413 GLU A N   1 
ATOM   60   C CA  . GLU A 1 8  ? 8.11600  -13.20000 12.40100  1.000 17.48000 ? 413 GLU A CA  1 
ATOM   61   C C   . GLU A 1 8  ? 9.58300  -13.41400 12.77500  1.000 17.54000 ? 413 GLU A C   1 
ATOM   62   O O   . GLU A 1 8  ? 10.45500 -13.46200 11.90100  1.000 18.41000 ? 413 GLU A O   1 
ATOM   63   C CB  . GLU A 1 8  ? 7.69800  -11.74400 12.61000  1.000 18.36000 ? 413 GLU A CB  1 
ATOM   64   C CG  . GLU A 1 8  ? 6.36900  -11.38400 11.95500  1.000 19.85000 ? 413 GLU A CG  1 
ATOM   65   C CD  . GLU A 1 8  ? 6.13100  -9.88600  11.91600  1.000 26.96000 ? 413 GLU A CD  1 
ATOM   66   O OE1 . GLU A 1 8  ? 7.01000  -9.13700  12.39900  1.000 29.39000 ? 413 GLU A OE1 1 
ATOM   67   O OE2 . GLU A 1 8  ? 5.06700  -9.46500  11.41600  1.000 25.83000 ? 413 GLU A OE2 1 
ATOM   68   N N   . GLU A 1 9  ? 9.87000  -13.56600 14.07000  1.000 20.31000 ? 414 GLU A N   1 
ATOM   69   C CA  . GLU A 1 9  ? 11.24000 -13.81900 14.51700  1.000 21.84000 ? 414 GLU A CA  1 
ATOM   70   C C   . GLU A 1 9  ? 11.76700 -15.14000 13.98400  1.000 17.27000 ? 414 GLU A C   1 
ATOM   71   O O   . GLU A 1 9  ? 12.95500 -15.26200 13.67100  1.000 18.69000 ? 414 GLU A O   1 
ATOM   72   C CB  . GLU A 1 9  ? 11.30200 -13.82400 16.04900  1.000 24.64000 ? 414 GLU A CB  1 
ATOM   73   C CG  . GLU A 1 9  ? 10.91200 -12.52300 16.71700  1.000 34.43000 ? 414 GLU A CG  1 
ATOM   74   C CD  . GLU A 1 9  ? 10.79400 -12.66200 18.23500  1.000 43.75000 ? 414 GLU A CD  1 
ATOM   75   O OE1 . GLU A 1 9  ? 10.78600 -11.61900 18.92800  1.000 46.59000 ? 414 GLU A OE1 1 
ATOM   76   O OE2 . GLU A 1 9  ? 10.70900 -13.81300 18.73100  1.000 44.04000 ? 414 GLU A OE2 1 
ATOM   77   N N   . ALA A 1 10 ? 10.89900 -16.15700 13.90100  1.000 17.77000 ? 415 ALA A N   1 
ATOM   78   C CA  . ALA A 1 10 ? 11.32100 -17.45300 13.39900  1.000 15.74000 ? 415 ALA A CA  1 
ATOM   79   C C   . ALA A 1 10 ? 11.63700 -17.39200 11.91400  1.000 16.92000 ? 415 ALA A C   1 
ATOM   80   O O   . ALA A 1 10 ? 12.56700 -18.05000 11.44500  1.000 17.19000 ? 415 ALA A O   1 
ATOM   81   C CB  . ALA A 1 10 ? 10.23600 -18.49200 13.66400  1.000 17.32000 ? 415 ALA A CB  1 
ATOM   82   N N   . LEU A 1 11 ? 10.84600 -16.63400 11.15300  1.000 15.22000 ? 416 LEU A N   1 
ATOM   83   C CA  . LEU A 1 11 ? 11.13600 -16.48700 9.73300   1.000 13.81000 ? 416 LEU A CA  1 
ATOM   84   C C   . LEU A 1 11 ? 12.49700 -15.82800 9.52600   1.000 15.04000 ? 416 LEU A C   1 
ATOM   85   O O   . LEU A 1 11 ? 13.28100 -16.25700 8.67000   1.000 16.47000 ? 416 LEU A O   1 
ATOM   86   C CB  . LEU A 1 11 ? 10.02100 -15.68500 9.06300   1.000 14.17000 ? 416 LEU A CB  1 
ATOM   87   C CG  . LEU A 1 11 ? 10.22600 -15.35000 7.58100   1.000 13.41000 ? 416 LEU A CG  1 
ATOM   88   C CD1 . LEU A 1 11 ? 10.43700 -16.59900 6.71100   1.000 15.02000 ? 416 LEU A CD1 1 
ATOM   89   C CD2 . LEU A 1 11 ? 9.03100  -14.52100 7.07400   1.000 12.83000 ? 416 LEU A CD2 1 
ATOM   90   N N   . LEU A 1 12 ? 12.79100 -14.78700 10.30700  1.000 17.95000 ? 417 LEU A N   1 
ATOM   91   C CA  . LEU A 1 12 ? 14.07500 -14.11000 10.17200  1.000 19.43000 ? 417 LEU A CA  1 
ATOM   92   C C   . LEU A 1 12 ? 15.22700 -15.01700 10.60100  1.000 23.52000 ? 417 LEU A C   1 
ATOM   93   O O   . LEU A 1 12 ? 16.27300 -15.05400 9.94300   1.000 19.27000 ? 417 LEU A O   1 
ATOM   94   C CB  . LEU A 1 12 ? 14.06300 -12.81200 10.98200  1.000 18.42000 ? 417 LEU A CB  1 
ATOM   95   C CG  . LEU A 1 12 ? 13.06500 -11.73800 10.52800  1.000 24.07000 ? 417 LEU A CG  1 
ATOM   96   C CD1 . LEU A 1 12 ? 13.04500 -10.55400 11.48700  1.000 26.86000 ? 417 LEU A CD1 1 
ATOM   97   C CD2 . LEU A 1 12 ? 13.38600 -11.26900 9.11900   1.000 26.68000 ? 417 LEU A CD2 1 
ATOM   98   N N   . ASP A 1 13 ? 15.05100 -15.76800 11.69200  1.000 21.12000 ? 418 ASP A N   1 
ATOM   99   C CA  . ASP A 1 13 ? 16.08000 -16.72400 12.09500  1.000 20.29000 ? 418 ASP A CA  1 
ATOM   100  C C   . ASP A 1 13 ? 16.25800 -17.81800 11.05000  1.000 21.60000 ? 418 ASP A C   1 
ATOM   101  O O   . ASP A 1 13 ? 17.38600 -18.21500 10.74100  1.000 23.29000 ? 418 ASP A O   1 
ATOM   102  C CB  . ASP A 1 13 ? 15.72800 -17.32700 13.45700  1.000 22.16000 ? 418 ASP A CB  1 
ATOM   103  C CG  . ASP A 1 13 ? 16.83400 -18.23000 14.00600  1.000 29.38000 ? 418 ASP A CG  1 
ATOM   104  O OD1 . ASP A 1 13 ? 18.00200 -17.78200 14.05400  1.000 26.66000 ? 418 ASP A OD1 1 
ATOM   105  O OD2 . ASP A 1 13 ? 16.53300 -19.38400 14.40000  1.000 30.86000 ? 418 ASP A OD2 1 
ATOM   106  N N   . GLY A 1 14 ? 15.15400 -18.31200 10.48500  1.000 18.85000 ? 419 GLY A N   1 
ATOM   107  C CA  . GLY A 1 14 ? 15.25500 -19.31500 9.44000   1.000 20.26000 ? 419 GLY A CA  1 
ATOM   108  C C   . GLY A 1 14 ? 16.01600 -18.83500 8.21600   1.000 20.97000 ? 419 GLY A C   1 
ATOM   109  O O   . GLY A 1 14 ? 16.85000 -19.56000 7.67300   1.000 19.80000 ? 419 GLY A O   1 
ATOM   110  N N   . LEU A 1 15 ? 15.72200 -17.61500 7.75400   1.000 20.44000 ? 420 LEU A N   1 
ATOM   111  C CA  . LEU A 1 15 ? 16.44900 -17.04600 6.62400   1.000 19.48000 ? 420 LEU A CA  1 
ATOM   112  C C   . LEU A 1 15 ? 17.94500 -16.99600 6.89000   1.000 22.54000 ? 420 LEU A C   1 
ATOM   113  O O   . LEU A 1 15 ? 18.75200 -17.30900 6.00700   1.000 24.49000 ? 420 LEU A O   1 
ATOM   114  C CB  . LEU A 1 15 ? 15.93600 -15.63900 6.33500   1.000 21.66000 ? 420 LEU A CB  1 
ATOM   115  C CG  . LEU A 1 15 ? 14.62900 -15.64600 5.56700   1.000 18.83000 ? 420 LEU A CG  1 
ATOM   116  C CD1 . LEU A 1 15 ? 14.00700 -14.28800 5.72900   1.000 19.51000 ? 420 LEU A CD1 1 
ATOM   117  C CD2 . LEU A 1 15 ? 14.87100 -16.00300 4.09500   1.000 18.20000 ? 420 LEU A CD2 1 
ATOM   118  N N   . ASP A 1 16 ? 18.32500 -16.56500 8.09000   1.000 24.09000 ? 421 ASP A N   1 
ATOM   119  C CA  . ASP A 1 16 ? 19.73700 -16.51700 8.46100   1.000 28.43000 ? 421 ASP A CA  1 
ATOM   120  C C   . ASP A 1 16 ? 20.38300 -17.90000 8.41600   1.000 30.17000 ? 421 ASP A C   1 
ATOM   121  O O   . ASP A 1 16 ? 21.51600 -18.05000 7.94500   1.000 31.39000 ? 421 ASP A O   1 
ATOM   122  C CB  . ASP A 1 16 ? 19.87200 -15.89300 9.84800   1.000 28.62000 ? 421 ASP A CB  1 
ATOM   123  C CG  . ASP A 1 16 ? 21.28600 -15.96300 10.37900  1.000 42.19000 ? 421 ASP A CG  1 
ATOM   124  O OD1 . ASP A 1 16 ? 21.48600 -16.53700 11.47400  1.000 41.74000 ? 421 ASP A OD1 1 
ATOM   125  O OD2 . ASP A 1 16 ? 22.19900 -15.44700 9.69700   1.000 42.46000 ? 421 ASP A OD2 1 
ATOM   126  N N   . LEU A 1 17 ? 19.66600 -18.93100 8.86700   1.000 26.01000 ? 422 LEU A N   1 
ATOM   127  C CA  . LEU A 1 17 ? 20.25100 -20.26100 8.98200   1.000 24.87000 ? 422 LEU A CA  1 
ATOM   128  C C   . LEU A 1 17 ? 20.34900 -20.98400 7.64100   1.000 30.09000 ? 422 LEU A C   1 
ATOM   129  O O   . LEU A 1 17 ? 21.32000 -21.71200 7.40100   1.000 30.08000 ? 422 LEU A O   1 
ATOM   130  C CB  . LEU A 1 17 ? 19.44200 -21.09100 9.98000   1.000 24.34000 ? 422 LEU A CB  1 
ATOM   131  C CG  . LEU A 1 17 ? 19.55500 -20.61800 11.43100  1.000 23.32000 ? 422 LEU A CG  1 
ATOM   132  C CD1 . LEU A 1 17 ? 18.52900 -21.32200 12.30600  1.000 25.65000 ? 422 LEU A CD1 1 
ATOM   133  C CD2 . LEU A 1 17 ? 20.96700 -20.85100 11.94900  1.000 28.95000 ? 422 LEU A CD2 1 
ATOM   134  N N   . VAL A 1 18 ? 19.35400 -20.82800 6.75800   1.000 22.98000 ? 423 VAL A N   1 
ATOM   135  C CA  . VAL A 1 18 ? 19.37900 -21.54000 5.48400   1.000 27.22000 ? 423 VAL A CA  1 
ATOM   136  C C   . VAL A 1 18 ? 20.13600 -20.77100 4.41000   1.000 27.91000 ? 423 VAL A C   1 
ATOM   137  O O   . VAL A 1 18 ? 20.23900 -21.25700 3.27300   1.000 29.19000 ? 423 VAL A O   1 
ATOM   138  C CB  . VAL A 1 18 ? 17.95600 -21.87000 4.98800   1.000 29.13000 ? 423 VAL A CB  1 
ATOM   139  C CG1 . VAL A 1 18 ? 17.18900 -22.64600 6.05800   1.000 24.15000 ? 423 VAL A CG1 1 
ATOM   140  C CG2 . VAL A 1 18 ? 17.21900 -20.59900 4.60600   1.000 22.25000 ? 423 VAL A CG2 1 
ATOM   141  N N   . LYS A 1 19 ? 20.66900 -19.59200 4.74400   1.000 28.27000 ? 424 LYS A N   1 
ATOM   142  C CA  . LYS A 1 19 ? 21.52500 -18.80000 3.86000   1.000 32.96000 ? 424 LYS A CA  1 
ATOM   143  C C   . LYS A 1 19 ? 20.83700 -18.48400 2.53300   1.000 36.19000 ? 424 LYS A C   1 
ATOM   144  O O   . LYS A 1 19 ? 21.40100 -18.67700 1.45500   1.000 36.37000 ? 424 LYS A O   1 
ATOM   145  C CB  . LYS A 1 19 ? 22.86300 -19.50200 3.61700   1.000 31.70000 ? 424 LYS A CB  1 
ATOM   146  C CG  . LYS A 1 19 ? 23.53200 -20.07300 4.85500   1.000 33.72000 ? 424 LYS A CG  1 
ATOM   147  C CD  . LYS A 1 19 ? 24.86600 -20.72000 4.47500   1.000 38.38000 ? 424 LYS A CD  1 
ATOM   148  C CE  . LYS A 1 19 ? 25.59000 -21.29700 5.68700   1.000 42.62000 ? 424 LYS A CE  1 
ATOM   149  N NZ  . LYS A 1 19 ? 26.89600 -21.92000 5.30400   1.000 45.88000 ? 424 LYS A NZ  1 
ATOM   150  N N   . GLY A 1 20 ? 19.60100 -17.99700 2.61000   1.000 30.93000 ? 425 GLY A N   1 
ATOM   151  C CA  . GLY A 1 20 ? 18.91900 -17.54200 1.42200   1.000 28.92000 ? 425 GLY A CA  1 
ATOM   152  C C   . GLY A 1 20 ? 17.44200 -17.87900 1.40200   1.000 30.60000 ? 425 GLY A C   1 
ATOM   153  O O   . GLY A 1 20 ? 16.90100 -18.47500 2.34000   1.000 26.62000 ? 425 GLY A O   1 
ATOM   154  N N   . PRO A 1 21 ? 16.75900 -17.50000 0.31700   1.000 27.80000 ? 426 PRO A N   1 
ATOM   155  C CA  . PRO A 1 21 ? 15.29400 -17.65700 0.23200   1.000 29.24000 ? 426 PRO A CA  1 
ATOM   156  C C   . PRO A 1 21 ? 14.91900 -19.09300 -0.12200  1.000 28.72000 ? 426 PRO A C   1 
ATOM   157  O O   . PRO A 1 21 ? 14.37000 -19.41000 -1.17400  1.000 28.73000 ? 426 PRO A O   1 
ATOM   158  C CB  . PRO A 1 21 ? 14.92100 -16.64000 -0.85200  1.000 26.14000 ? 426 PRO A CB  1 
ATOM   159  C CG  . PRO A 1 21 ? 16.09200 -16.64400 -1.77000  1.000 31.39000 ? 426 PRO A CG  1 
ATOM   160  C CD  . PRO A 1 21 ? 17.31900 -16.87600 -0.89600  1.000 31.48000 ? 426 PRO A CD  1 
ATOM   161  N N   . ARG A 1 22 ? 15.23900 -20.00000 0.79500   1.000 28.32000 ? 427 ARG A N   1 
ATOM   162  C CA  . ARG A 1 22 ? 15.07600 -21.44100 0.60700   1.000 29.28000 ? 427 ARG A CA  1 
ATOM   163  C C   . ARG A 1 22 ? 13.95500 -21.90400 1.53200   1.000 22.29000 ? 427 ARG A C   1 
ATOM   164  O O   . ARG A 1 22 ? 14.18600 -22.41500 2.62700   1.000 25.45000 ? 427 ARG A O   1 
ATOM   165  C CB  . ARG A 1 22 ? 16.37900 -22.11300 0.87700   1.000 24.73000 ? 427 ARG A CB  1 
ATOM   166  C CG  . ARG A 1 22 ? 17.51700 -21.32500 0.21400   1.000 32.99000 ? 427 ARG A CG  1 
ATOM   167  C CD  . ARG A 1 22 ? 18.87400 -21.98400 0.30700   1.000 30.06000 ? 427 ARG A CD  1 
ATOM   168  N NE  . ARG A 1 22 ? 18.82900 -23.39100 -0.06600  1.000 33.79000 ? 427 ARG A NE  1 
ATOM   169  C CZ  . ARG A 1 22 ? 19.23600 -24.37000 0.73100   1.000 35.80000 ? 427 ARG A CZ  1 
ATOM   170  N NH1 . ARG A 1 22 ? 19.72500 -24.07400 1.92900   1.000 33.03000 ? 427 ARG A NH1 1 
ATOM   171  N NH2 . ARG A 1 22 ? 19.17100 -25.63600 0.33200   1.000 36.80000 ? 427 ARG A NH2 1 
ATOM   172  N N   . TRP A 1 23 ? 12.72000 -21.72300 1.05800   1.000 23.22000 ? 428 TRP A N   1 
ATOM   173  C CA  . TRP A 1 23 ? 11.56300 -21.71900 1.94400   1.000 19.27000 ? 428 TRP A CA  1 
ATOM   174  C C   . TRP A 1 23 ? 11.29300 -23.09800 2.52700   1.000 24.95000 ? 428 TRP A C   1 
ATOM   175  O O   . TRP A 1 23 ? 10.90200 -23.21600 3.69400   1.000 22.11000 ? 428 TRP A O   1 
ATOM   176  C CB  . TRP A 1 23 ? 10.34300 -21.19200 1.18600   1.000 22.64000 ? 428 TRP A CB  1 
ATOM   177  C CG  . TRP A 1 23 ? 10.66400 -19.90200 0.48700   1.000 21.55000 ? 428 TRP A CG  1 
ATOM   178  C CD1 . TRP A 1 23 ? 10.73000 -19.69100 -0.85900  1.000 25.16000 ? 428 TRP A CD1 1 
ATOM   179  C CD2 . TRP A 1 23 ? 11.01200 -18.65400 1.10800   1.000 21.29000 ? 428 TRP A CD2 1 
ATOM   180  N NE1 . TRP A 1 23 ? 11.08300 -18.38000 -1.11700  1.000 23.29000 ? 428 TRP A NE1 1 
ATOM   181  C CE2 . TRP A 1 23 ? 11.26200 -17.72600 0.07300   1.000 20.65000 ? 428 TRP A CE2 1 
ATOM   182  C CE3 . TRP A 1 23 ? 11.12200 -18.22900 2.43900   1.000 17.88000 ? 428 TRP A CE3 1 
ATOM   183  C CZ2 . TRP A 1 23 ? 11.61800 -16.40100 0.32500   1.000 19.84000 ? 428 TRP A CZ2 1 
ATOM   184  C CZ3 . TRP A 1 23 ? 11.47200 -16.91500 2.68700   1.000 16.69000 ? 428 TRP A CZ3 1 
ATOM   185  C CH2 . TRP A 1 23 ? 11.72600 -16.01700 1.63400   1.000 17.68000 ? 428 TRP A CH2 1 
ATOM   186  N N   . SER A 1 24 ? 11.50000 -24.15200 1.73600   1.000 23.28000 ? 429 SER A N   1 
ATOM   187  C CA  . SER A 1 24 ? 11.28100 -25.49800 2.24900   1.000 24.81000 ? 429 SER A CA  1 
ATOM   188  C C   . SER A 1 24 ? 12.22600 -25.81300 3.39700   1.000 25.42000 ? 429 SER A C   1 
ATOM   189  O O   . SER A 1 24 ? 11.84100 -26.50900 4.34400   1.000 25.47000 ? 429 SER A O   1 
ATOM   190  C CB  . SER A 1 24 ? 11.44800 -26.52600 1.13400   1.000 28.48000 ? 429 SER A CB  1 
ATOM   191  O OG  . SER A 1 24 ? 11.40800 -27.83400 1.67500   1.000 40.18000 ? 429 SER A OG  1 
ATOM   192  N N   . GLN A 1 25 ? 13.45800 -25.29300 3.34100   1.000 21.33000 ? 430 GLN A N   1 
ATOM   193  C CA  . GLN A 1 25 ? 14.42200 -25.53900 4.40400   1.000 21.98000 ? 430 GLN A CA  1 
ATOM   194  C C   . GLN A 1 25 ? 14.06700 -24.79100 5.67600   1.000 23.39000 ? 430 GLN A C   1 
ATOM   195  O O   . GLN A 1 25 ? 14.34700 -25.27100 6.78000   1.000 21.07000 ? 430 GLN A O   1 
ATOM   196  C CB  . GLN A 1 25 ? 15.81700 -25.13700 3.94100   1.000 29.60000 ? 430 GLN A CB  1 
ATOM   197  C CG  . GLN A 1 25 ? 16.41500 -26.10300 2.96500   1.000 33.08000 ? 430 GLN A CG  1 
ATOM   198  C CD  . GLN A 1 25 ? 17.90700 -26.24600 3.15500   1.000 41.23000 ? 430 GLN A CD  1 
ATOM   199  O OE1 . GLN A 1 25 ? 18.58700 -26.86700 2.33300   1.000 47.14000 ? 430 GLN A OE1 1 
ATOM   200  N NE2 . GLN A 1 25 ? 18.43000 -25.67700 4.24200   1.000 40.48000 ? 430 GLN A NE2 1 
ATOM   201  N N   . ILE A 1 26 ? 13.44300 -23.62200 5.55100   1.000 20.64000 ? 431 ILE A N   1 
ATOM   202  C CA  . ILE A 1 26 ? 12.95800 -22.94100 6.74200   1.000 18.97000 ? 431 ILE A CA  1 
ATOM   203  C C   . ILE A 1 26 ? 11.88300 -23.77700 7.42100   1.000 15.52000 ? 431 ILE A C   1 
ATOM   204  O O   . ILE A 1 26 ? 11.81600 -23.84100 8.65500   1.000 18.30000 ? 431 ILE A O   1 
ATOM   205  C CB  . ILE A 1 26 ? 12.45500 -21.53200 6.38600   1.000 16.97000 ? 431 ILE A CB  1 
ATOM   206  C CG1 . ILE A 1 26 ? 13.63600 -20.67400 5.92800   1.000 18.61000 ? 431 ILE A CG1 1 
ATOM   207  C CG2 . ILE A 1 26 ? 11.78000 -20.89200 7.59200   1.000 17.93000 ? 431 ILE A CG2 1 
ATOM   208  C CD1 . ILE A 1 26 ? 13.23800 -19.27800 5.43200   1.000 19.05000 ? 431 ILE A CD1 1 
ATOM   209  N N   . LEU A 1 27 ? 11.04400 -24.45000 6.63300   1.000 16.82000 ? 432 LEU A N   1 
ATOM   210  C CA  . LEU A 1 27 ? 10.00900 -25.29000 7.22400   1.000 16.94000 ? 432 LEU A CA  1 
ATOM   211  C C   . LEU A 1 27 ? 10.59500 -26.56500 7.81800   1.000 22.47000 ? 432 LEU A C   1 
ATOM   212  O O   . LEU A 1 27 ? 10.00400 -27.14200 8.74000   1.000 19.02000 ? 432 LEU A O   1 
ATOM   213  C CB  . LEU A 1 27 ? 8.92800  -25.61900 6.19300   1.000 17.46000 ? 432 LEU A CB  1 
ATOM   214  C CG  . LEU A 1 27 ? 8.02300  -24.42700 5.85200   1.000 19.83000 ? 432 LEU A CG  1 
ATOM   215  C CD1 . LEU A 1 27 ? 6.94300  -24.81800 4.84800   1.000 23.50000 ? 432 LEU A CD1 1 
ATOM   216  C CD2 . LEU A 1 27 ? 7.38600  -23.84800 7.10400   1.000 20.59000 ? 432 LEU A CD2 1 
ATOM   217  N N   . GLU A 1 28 ? 11.75600 -27.01400 7.32900   1.000 19.88000 ? 433 GLU A N   1 
ATOM   218  C CA  . GLU A 1 28 ? 12.42300 -28.12500 8.00500   1.000 22.31000 ? 433 GLU A CA  1 
ATOM   219  C C   . GLU A 1 28 ? 12.82200 -27.74800 9.42200   1.000 20.76000 ? 433 GLU A C   1 
ATOM   220  O O   . GLU A 1 28 ? 12.84700 -28.60800 10.30900  1.000 22.53000 ? 433 GLU A O   1 
ATOM   221  C CB  . GLU A 1 28 ? 13.66000 -28.57300 7.23100   1.000 21.56000 ? 433 GLU A CB  1 
ATOM   222  C CG  . GLU A 1 28 ? 13.37500 -29.25200 5.92800   1.000 24.86000 ? 433 GLU A CG  1 
ATOM   223  C CD  . GLU A 1 28 ? 14.64500 -29.52100 5.15300   1.000 34.07000 ? 433 GLU A CD  1 
ATOM   224  O OE1 . GLU A 1 28 ? 15.73600 -29.39500 5.74600   1.000 39.84000 ? 433 GLU A OE1 1 
ATOM   225  O OE2 . GLU A 1 28 ? 14.55100 -29.85400 3.95400   1.000 42.22000 ? 433 GLU A OE2 1 
ATOM   226  N N   . LEU A 1 29 ? 13.13200 -26.47100 9.65300   1.000 18.42000 ? 434 LEU A N   1 
ATOM   227  C CA  . LEU A 1 29 ? 13.54000 -25.96200 10.95200  1.000 19.10000 ? 434 LEU A CA  1 
ATOM   228  C C   . LEU A 1 29 ? 12.36400 -25.60300 11.84400  1.000 20.06000 ? 434 LEU A C   1 
ATOM   229  O O   . LEU A 1 29 ? 12.41200 -25.82700 13.05800  1.000 20.65000 ? 434 LEU A O   1 
ATOM   230  C CB  . LEU A 1 29 ? 14.40900 -24.71700 10.77500  1.000 20.01000 ? 434 LEU A CB  1 
ATOM   231  C CG  . LEU A 1 29 ? 15.80600 -24.87900 10.20100  1.000 23.55000 ? 434 LEU A CG  1 
ATOM   232  C CD1 . LEU A 1 29 ? 16.41100 -23.51600 9.90400   1.000 23.30000 ? 434 LEU A CD1 1 
ATOM   233  C CD2 . LEU A 1 29 ? 16.67800 -25.65300 11.18400  1.000 23.91000 ? 434 LEU A CD2 1 
ATOM   234  N N   . TYR A 1 30 ? 11.31800 -25.01200 11.26600  1.000 18.42000 ? 435 TYR A N   1 
ATOM   235  C CA  . TYR A 1 30 ? 10.27900 -24.35600 12.04700  1.000 18.43000 ? 435 TYR A CA  1 
ATOM   236  C C   . TYR A 1 30 ? 8.86600  -24.75900 11.65900  1.000 14.83000 ? 435 TYR A C   1 
ATOM   237  O O   . TYR A 1 30 ? 7.91400  -24.25300 12.26200  1.000 17.96000 ? 435 TYR A O   1 
ATOM   238  C CB  . TYR A 1 30 ? 10.39400 -22.83000 11.90700  1.000 17.63000 ? 435 TYR A CB  1 
ATOM   239  C CG  . TYR A 1 30 ? 11.46900 -22.18400 12.73700  1.000 19.62000 ? 435 TYR A CG  1 
ATOM   240  C CD1 . TYR A 1 30 ? 11.42900 -22.24300 14.12800  1.000 21.13000 ? 435 TYR A CD1 1 
ATOM   241  C CD2 . TYR A 1 30 ? 12.51800 -21.50800 12.13300  1.000 18.38000 ? 435 TYR A CD2 1 
ATOM   242  C CE1 . TYR A 1 30 ? 12.39400 -21.64900 14.89400  1.000 21.88000 ? 435 TYR A CE1 1 
ATOM   243  C CE2 . TYR A 1 30 ? 13.49800 -20.89500 12.89500  1.000 22.15000 ? 435 TYR A CE2 1 
ATOM   244  C CZ  . TYR A 1 30 ? 13.42200 -20.97000 14.27900  1.000 24.33000 ? 435 TYR A CZ  1 
ATOM   245  O OH  . TYR A 1 30 ? 14.38700 -20.37500 15.04900  1.000 26.27000 ? 435 TYR A OH  1 
ATOM   246  N N   . GLY A 1 31 ? 8.69500  -25.61600 10.66200  1.000 15.93000 ? 436 GLY A N   1 
ATOM   247  C CA  . GLY A 1 31 ? 7.37700  -26.01800 10.22200  1.000 15.61000 ? 436 GLY A CA  1 
ATOM   248  C C   . GLY A 1 31 ? 6.85900  -27.19500 11.02000  1.000 19.18000 ? 436 GLY A C   1 
ATOM   249  O O   . GLY A 1 31 ? 7.27600  -27.42500 12.16200  1.000 17.91000 ? 436 GLY A O   1 
ATOM   250  N N   . PRO A 1 32 ? 5.92100  -27.94900 10.44500  1.000 19.25000 ? 437 PRO A N   1 
ATOM   251  C CA  . PRO A 1 32 ? 5.44000  -29.15500 11.12400  1.000 22.21000 ? 437 PRO A CA  1 
ATOM   252  C C   . PRO A 1 32 ? 6.60000  -30.11500 11.31900  1.000 22.85000 ? 437 PRO A C   1 
ATOM   253  O O   . PRO A 1 32 ? 7.37400  -30.37600 10.39100  1.000 23.24000 ? 437 PRO A O   1 
ATOM   254  C CB  . PRO A 1 32 ? 4.37600  -29.71600 10.16900  1.000 25.83000 ? 437 PRO A CB  1 
ATOM   255  C CG  . PRO A 1 32 ? 4.47600  -28.94100 8.91500   1.000 27.74000 ? 437 PRO A CG  1 
ATOM   256  C CD  . PRO A 1 32 ? 5.20300  -27.67600 9.18700   1.000 22.29000 ? 437 PRO A CD  1 
ATOM   257  N N   . GLY A 1 33 ? 6.74900  -30.59700 12.55200  1.000 23.95000 ? 438 GLY A N   1 
ATOM   258  C CA  . GLY A 1 33 ? 7.88900  -31.42800 12.88600  1.000 27.26000 ? 438 GLY A CA  1 
ATOM   259  C C   . GLY A 1 33 ? 9.21400  -30.70800 12.80000  1.000 25.71000 ? 438 GLY A C   1 
ATOM   260  O O   . GLY A 1 33 ? 10.25000 -31.35300 12.59600  1.000 23.78000 ? 438 GLY A O   1 
ATOM   261  N N   . GLY A 1 34 ? 9.20600  -29.38700 12.94800  1.000 22.54000 ? 439 GLY A N   1 
ATOM   262  C CA  . GLY A 1 34 ? 10.41900 -28.61600 12.72700  1.000 20.27000 ? 439 GLY A CA  1 
ATOM   263  C C   . GLY A 1 34 ? 11.52900 -29.01000 13.68400  1.000 23.36000 ? 439 GLY A C   1 
ATOM   264  O O   . GLY A 1 34 ? 11.29500 -29.31500 14.85700  1.000 22.69000 ? 439 GLY A O   1 
ATOM   265  N N   . LYS A 1 35 ? 12.76200 -28.97700 13.17300  1.000 21.30000 ? 440 LYS A N   1 
ATOM   266  C CA  . LYS A 1 35 ? 13.91100 -29.38300 13.97900  1.000 21.32000 ? 440 LYS A CA  1 
ATOM   267  C C   . LYS A 1 35 ? 14.09800 -28.47400 15.18700  1.000 23.59000 ? 440 LYS A C   1 
ATOM   268  O O   . LYS A 1 35 ? 14.43100 -28.94700 16.28400  1.000 25.07000 ? 440 LYS A O   1 
ATOM   269  C CB  . LYS A 1 35 ? 15.16700 -29.40900 13.10800  1.000 23.97000 ? 440 LYS A CB  1 
ATOM   270  C CG  . LYS A 1 35 ? 15.10300 -30.46100 12.01700  1.000 28.99000 ? 440 LYS A CG  1 
ATOM   271  C CD  . LYS A 1 35 ? 14.54700 -31.77000 12.56600  1.000 34.03000 ? 440 LYS A CD  1 
ATOM   272  C CE  . LYS A 1 35 ? 14.53500 -32.87400 11.52100  1.000 34.93000 ? 440 LYS A CE  1 
ATOM   273  N NZ  . LYS A 1 35 ? 13.88200 -34.10700 12.06700  1.000 35.81000 ? 440 LYS A NZ  1 
ATOM   274  N N   . LYS A 1 36 ? 13.86300 -27.17000 15.02100  1.000 20.86000 ? 441 LYS A N   1 
ATOM   275  C CA  . LYS A 1 36 ? 13.99500 -26.22600 16.12700  1.000 20.20000 ? 441 LYS A CA  1 
ATOM   276  C C   . LYS A 1 36 ? 12.70200 -26.08800 16.93300  1.000 19.64000 ? 441 LYS A C   1 
ATOM   277  O O   . LYS A 1 36 ? 12.73300 -26.10900 18.16800  1.000 23.51000 ? 441 LYS A O   1 
ATOM   278  C CB  . LYS A 1 36 ? 14.43800 -24.84900 15.60600  1.000 22.95000 ? 441 LYS A CB  1 
ATOM   279  C CG  . LYS A 1 36 ? 15.86300 -24.82600 15.06900  1.000 26.68000 ? 441 LYS A CG  1 
ATOM   280  C CD  . LYS A 1 36 ? 16.38100 -23.41100 14.86300  1.000 26.23000 ? 441 LYS A CD  1 
ATOM   281  C CE  . LYS A 1 36 ? 16.46400 -22.63500 16.16300  1.000 28.82000 ? 441 LYS A CE  1 
ATOM   282  N NZ  . LYS A 1 36 ? 17.44100 -21.49900 16.05500  1.000 34.44000 ? 441 LYS A NZ  1 
ATOM   283  N N   . SER A 1 37 ? 11.57300 -25.91200 16.26000  1.000 20.34000 ? 442 SER A N   1 
ATOM   284  C CA  . SER A 1 37 ? 10.26700 -25.76000 16.90100  1.000 20.18000 ? 442 SER A CA  1 
ATOM   285  C C   . SER A 1 37 ? 9.21800  -25.86100 15.80400  1.000 19.14000 ? 442 SER A C   1 
ATOM   286  O O   . SER A 1 37 ? 9.54900  -26.00000 14.62300  1.000 18.60000 ? 442 SER A O   1 
ATOM   287  C CB  . SER A 1 37 ? 10.13900 -24.44000 17.67000  1.000 24.47000 ? 442 SER A CB  1 
ATOM   288  O OG  . SER A 1 37 ? 9.82600  -23.35300 16.80400  1.000 20.71000 ? 442 SER A OG  1 
ATOM   289  N N   . GLU A 1 38 ? 7.94100  -25.79200 16.20000  1.000 17.81000 ? 443 GLU A N   1 
ATOM   290  C CA  . GLU A 1 38 ? 6.84300  -25.81500 15.24400  1.000 18.27000 ? 443 GLU A CA  1 
ATOM   291  C C   . GLU A 1 38 ? 6.17700  -24.44600 15.10700  1.000 15.76000 ? 443 GLU A C   1 
ATOM   292  O O   . GLU A 1 38 ? 5.01900  -24.35600 14.71300  1.000 16.40000 ? 443 GLU A O   1 
ATOM   293  C CB  . GLU A 1 38 ? 5.81700  -26.88600 15.62600  1.000 20.88000 ? 443 GLU A CB  1 
ATOM   294  C CG  . GLU A 1 38 ? 6.34500  -28.33100 15.47600  1.000 21.75000 ? 443 GLU A CG  1 
ATOM   295  C CD  . GLU A 1 38 ? 5.23000  -29.38300 15.41700  1.000 27.60000 ? 443 GLU A CD  1 
ATOM   296  O OE1 . GLU A 1 38 ? 4.54000  -29.58500 16.43600  1.000 31.16000 ? 443 GLU A OE1 1 
ATOM   297  O OE2 . GLU A 1 38 ? 5.02500  -29.99700 14.34800  1.000 28.66000 ? 443 GLU A OE2 1 
ATOM   298  N N   . VAL A 1 39 ? 6.91200  -23.36700 15.37900  1.000 16.66000 ? 444 VAL A N   1 
ATOM   299  C CA  . VAL A 1 39 ? 6.25600  -22.06500 15.46400  1.000 15.52000 ? 444 VAL A CA  1 
ATOM   300  C C   . VAL A 1 39 ? 5.68000  -21.63400 14.11100  1.000 13.78000 ? 444 VAL A C   1 
ATOM   301  O O   . VAL A 1 39 ? 4.67600  -20.91500 14.06400  1.000 15.57000 ? 444 VAL A O   1 
ATOM   302  C CB  . VAL A 1 39 ? 7.22700  -21.02500 16.05200  1.000 19.33000 ? 444 VAL A CB  1 
ATOM   303  C CG1 . VAL A 1 39 ? 8.46300  -20.93900 15.23100  1.000 23.99000 ? 444 VAL A CG1 1 
ATOM   304  C CG2 . VAL A 1 39 ? 6.55000  -19.65200 16.16100  1.000 22.86000 ? 444 VAL A CG2 1 
ATOM   305  N N   . LEU A 1 40 ? 6.26600  -22.08800 13.00000  1.000 14.07000 ? 445 LEU A N   1 
ATOM   306  C CA  . LEU A 1 40 ? 5.75700  -21.78100 11.66400  1.000 12.75000 ? 445 LEU A CA  1 
ATOM   307  C C   . LEU A 1 40 ? 4.93900  -22.92700 11.07000  1.000 15.26000 ? 445 LEU A C   1 
ATOM   308  O O   . LEU A 1 40 ? 4.75600  -22.98300 9.85000   1.000 14.57000 ? 445 LEU A O   1 
ATOM   309  C CB  . LEU A 1 40 ? 6.91900  -21.41200 10.73100  1.000 13.90000 ? 445 LEU A CB  1 
ATOM   310  C CG  . LEU A 1 40 ? 7.62800  -20.09800 11.05800  1.000 16.01000 ? 445 LEU A CG  1 
ATOM   311  C CD1 . LEU A 1 40 ? 8.82300  -19.81300 10.10600  1.000 15.49000 ? 445 LEU A CD1 1 
ATOM   312  C CD2 . LEU A 1 40 ? 6.62300  -18.95200 11.04400  1.000 13.98000 ? 445 LEU A CD2 1 
ATOM   313  N N   . LYS A 1 41 ? 4.42300  -23.83900 11.90400  1.000 15.12000 ? 446 LYS A N   1 
ATOM   314  C CA  . LYS A 1 41 ? 3.74700  -25.00600 11.34600  1.000 15.75000 ? 446 LYS A CA  1 
ATOM   315  C C   . LYS A 1 41 ? 2.51000  -24.64900 10.52700  1.000 17.86000 ? 446 LYS A C   1 
ATOM   316  O O   . LYS A 1 41 ? 2.11200  -25.44300 9.67000   1.000 18.35000 ? 446 LYS A O   1 
ATOM   317  C CB  . LYS A 1 41 ? 3.38900  -26.00300 12.45300  1.000 20.39000 ? 446 LYS A CB  1 
ATOM   318  C CG  . LYS A 1 41 ? 2.36900  -25.54400 13.44500  1.000 22.80000 ? 446 LYS A CG  1 
ATOM   319  C CD  . LYS A 1 41 ? 1.92200  -26.73300 14.32200  1.000 27.05000 ? 446 LYS A CD  1 
ATOM   320  C CE  . LYS A 1 41 ? 1.28800  -27.82100 13.47000  1.000 27.96000 ? 446 LYS A CE  1 
ATOM   321  N NZ  . LYS A 1 41 ? 0.38300  -28.74400 14.24100  1.000 37.89000 ? 446 LYS A NZ  1 
ATOM   322  N N   . TYR A 1 42 ? 1.90100  -23.48200 10.73700  1.000 15.91000 ? 447 TYR A N   1 
ATOM   323  C CA  . TYR A 1 42 ? 0.70300  -23.11100 9.98900   1.000 15.20000 ? 447 TYR A CA  1 
ATOM   324  C C   . TYR A 1 42 ? 0.97700  -22.14000 8.84400   1.000 18.75000 ? 447 TYR A C   1 
ATOM   325  O O   . TYR A 1 42 ? 0.03500  -21.56000 8.29200   1.000 19.43000 ? 447 TYR A O   1 
ATOM   326  C CB  . TYR A 1 42 ? -0.35400 -22.53000 10.92700  1.000 17.28000 ? 447 TYR A CB  1 
ATOM   327  C CG  . TYR A 1 42 ? -0.79700 -23.55800 11.93200  1.000 17.18000 ? 447 TYR A CG  1 
ATOM   328  C CD1 . TYR A 1 42 ? -1.51500 -24.66900 11.52600  1.000 19.33000 ? 447 TYR A CD1 1 
ATOM   329  C CD2 . TYR A 1 42 ? -0.43500 -23.45300 13.26100  1.000 19.12000 ? 447 TYR A CD2 1 
ATOM   330  C CE1 . TYR A 1 42 ? -1.91000 -25.63900 12.44100  1.000 19.53000 ? 447 TYR A CE1 1 
ATOM   331  C CE2 . TYR A 1 42 ? -0.82700 -24.41500 14.18600  1.000 19.38000 ? 447 TYR A CE2 1 
ATOM   332  C CZ  . TYR A 1 42 ? -1.55700 -25.50000 13.76100  1.000 21.14000 ? 447 TYR A CZ  1 
ATOM   333  O OH  . TYR A 1 42 ? -1.94500 -26.46400 14.66500  1.000 28.31000 ? 447 TYR A OH  1 
ATOM   334  N N   . ARG A 1 43 ? 2.23100  -21.96200 8.45700   1.000 15.95000 ? 448 ARG A N   1 
ATOM   335  C CA  . ARG A 1 43 ? 2.57700  -21.13200 7.31000   1.000 14.75000 ? 448 ARG A CA  1 
ATOM   336  C C   . ARG A 1 43 ? 3.20300  -22.02400 6.24600   1.000 15.88000 ? 448 ARG A C   1 
ATOM   337  O O   . ARG A 1 43 ? 4.18800  -22.72200 6.52500   1.000 18.43000 ? 448 ARG A O   1 
ATOM   338  C CB  . ARG A 1 43 ? 3.54700  -20.01800 7.71900   1.000 14.33000 ? 448 ARG A CB  1 
ATOM   339  C CG  . ARG A 1 43 ? 3.11000  -19.18900 8.92200   1.000 14.49000 ? 448 ARG A CG  1 
ATOM   340  C CD  . ARG A 1 43 ? 1.76400  -18.49100 8.66700   1.000 14.94000 ? 448 ARG A CD  1 
ATOM   341  N NE  . ARG A 1 43 ? 1.33800  -17.75900 9.85500   1.000 15.55000 ? 448 ARG A NE  1 
ATOM   342  C CZ  . ARG A 1 43 ? 0.32000  -16.90500 9.88100   1.000 17.26000 ? 448 ARG A CZ  1 
ATOM   343  N NH1 . ARG A 1 43 ? -0.38600 -16.67500 8.77900   1.000 18.35000 ? 448 ARG A NH1 1 
ATOM   344  N NH2 . ARG A 1 43 ? 0.00900  -16.27900 11.00100  1.000 18.75000 ? 448 ARG A NH2 1 
ATOM   345  N N   . ASN A 1 44 ? 2.63900  -22.01400 5.03500   1.000 15.43000 ? 449 ASN A N   1 
ATOM   346  C CA  . ASN A 1 44 ? 3.23500  -22.81300 3.97200   1.000 17.36000 ? 449 ASN A CA  1 
ATOM   347  C C   . ASN A 1 44 ? 4.29700  -21.99600 3.22900   1.000 16.23000 ? 449 ASN A C   1 
ATOM   348  O O   . ASN A 1 44 ? 4.56600  -20.83000 3.54300   1.000 13.48000 ? 449 ASN A O   1 
ATOM   349  C CB  . ASN A 1 44 ? 2.16600  -23.38800 3.03400   1.000 18.68000 ? 449 ASN A CB  1 
ATOM   350  C CG  . ASN A 1 44 ? 1.35100  -22.33100 2.29700   1.000 19.68000 ? 449 ASN A CG  1 
ATOM   351  O OD1 . ASN A 1 44 ? 1.79000  -21.20200 2.08400   1.000 15.80000 ? 449 ASN A OD1 1 
ATOM   352  N ND2 . ASN A 1 44 ? 0.15100  -22.72000 1.87800   1.000 18.42000 ? 449 ASN A ND2 1 
ATOM   353  N N   . GLN A 1 45 ? 4.94200  -22.63200 2.25000   1.000 16.17000 ? 450 GLN A N   1 
ATOM   354  C CA  . GLN A 1 45 ? 6.05100  -21.97300 1.56700   1.000 17.32000 ? 450 GLN A CA  1 
ATOM   355  C C   . GLN A 1 45 ? 5.60400  -20.68500 0.88900   1.000 15.88000 ? 450 GLN A C   1 
ATOM   356  O O   . GLN A 1 45 ? 6.33700  -19.68700 0.90100   1.000 13.68000 ? 450 GLN A O   1 
ATOM   357  C CB  . GLN A 1 45 ? 6.67300  -22.91800 0.54900   1.000 19.24000 ? 450 GLN A CB  1 
ATOM   358  C CG  . GLN A 1 45 ? 7.47800  -24.02700 1.17800   1.000 23.29000 ? 450 GLN A CG  1 
ATOM   359  C CD  . GLN A 1 45 ? 8.20800  -24.83600 0.13500   1.000 34.76000 ? 450 GLN A CD  1 
ATOM   360  O OE1 . GLN A 1 45 ? 8.78600  -24.28000 -0.80200  1.000 35.14000 ? 450 GLN A OE1 1 
ATOM   361  N NE2 . GLN A 1 45 ? 8.17500  -26.15900 0.28100   1.000 35.15000 ? 450 GLN A NE2 1 
ATOM   362  N N   . VAL A 1 46 ? 4.41000  -20.69100 0.29000   1.000 13.97000 ? 451 VAL A N   1 
ATOM   363  C CA  . VAL A 1 46 ? 3.86500  -19.47800 -0.31200  1.000 13.96000 ? 451 VAL A CA  1 
ATOM   364  C C   . VAL A 1 46 ? 3.75400  -18.37700 0.73400   1.000 13.62000 ? 451 VAL A C   1 
ATOM   365  O O   . VAL A 1 46 ? 4.10900  -17.21900 0.47800   1.000 14.22000 ? 451 VAL A O   1 
ATOM   366  C CB  . VAL A 1 46 ? 2.50200  -19.77200 -0.97100  1.000 17.30000 ? 451 VAL A CB  1 
ATOM   367  C CG1 . VAL A 1 46 ? 1.64200  -18.51300 -0.98400  1.000 22.56000 ? 451 VAL A CG1 1 
ATOM   368  C CG2 . VAL A 1 46 ? 2.69200  -20.31600 -2.37600  1.000 22.41000 ? 451 VAL A CG2 1 
ATOM   369  N N   . GLN A 1 47 ? 3.29100  -18.72500 1.93900   1.000 12.22000 ? 452 GLN A N   1 
ATOM   370  C CA  . GLN A 1 47 ? 3.14100  -17.73200 3.00000   1.000 11.60000 ? 452 GLN A CA  1 
ATOM   371  C C   . GLN A 1 47 ? 4.48700  -17.22000 3.51000   1.000 12.71000 ? 452 GLN A C   1 
ATOM   372  O O   . GLN A 1 47 ? 4.61700  -16.03500 3.83800   1.000 11.87000 ? 452 GLN A O   1 
ATOM   373  C CB  . GLN A 1 47 ? 2.32500  -18.32300 4.14800   1.000 11.93000 ? 452 GLN A CB  1 
ATOM   374  C CG  . GLN A 1 47 ? 0.86200  -18.43600 3.76800   1.000 12.99000 ? 452 GLN A CG  1 
ATOM   375  C CD  . GLN A 1 47 ? 0.03200  -19.14200 4.79200   1.000 17.16000 ? 452 GLN A CD  1 
ATOM   376  O OE1 . GLN A 1 47 ? 0.29000  -20.29200 5.11800   1.000 16.48000 ? 452 GLN A OE1 1 
ATOM   377  N NE2 . GLN A 1 47 ? -1.01000 -18.47700 5.27200   1.000 21.74000 ? 452 GLN A NE2 1 
ATOM   378  N N   . LEU A 1 48 ? 5.48900  -18.09500 3.62300   1.000 12.16000 ? 453 LEU A N   1 
ATOM   379  C CA  . LEU A 1 48 ? 6.80500  -17.63900 4.06700   1.000 11.18000 ? 453 LEU A CA  1 
ATOM   380  C C   . LEU A 1 48 ? 7.38300  -16.64000 3.08200   1.000 11.60000 ? 453 LEU A C   1 
ATOM   381  O O   . LEU A 1 48 ? 7.91000  -15.58600 3.47600   1.000 12.49000 ? 453 LEU A O   1 
ATOM   382  C CB  . LEU A 1 48 ? 7.76600  -18.82400 4.20100   1.000 14.49000 ? 453 LEU A CB  1 
ATOM   383  C CG  . LEU A 1 48 ? 7.45200  -19.92300 5.20600   1.000 14.93000 ? 453 LEU A CG  1 
ATOM   384  C CD1 . LEU A 1 48 ? 8.70900  -20.80300 5.32800   1.000 16.38000 ? 453 LEU A CD1 1 
ATOM   385  C CD2 . LEU A 1 48 ? 7.03800  -19.33400 6.54300   1.000 14.67000 ? 453 LEU A CD2 1 
ATOM   386  N N   . LYS A 1 49 ? 7.29900  -16.97000 1.79100   1.000 11.37000 ? 454 LYS A N   1 
ATOM   387  C CA  . LYS A 1 49 ? 7.85200  -16.09900 0.76100   1.000 11.79000 ? 454 LYS A CA  1 
ATOM   388  C C   . LYS A 1 49 ? 7.15800  -14.74800 0.76100   1.000 11.82000 ? 454 LYS A C   1 
ATOM   389  O O   . LYS A 1 49 ? 7.81400  -13.70000 0.74500   1.000 12.35000 ? 454 LYS A O   1 
ATOM   390  C CB  . LYS A 1 49 ? 7.72200  -16.74800 -0.61000  1.000 15.08000 ? 454 LYS A CB  1 
ATOM   391  C CG  . LYS A 1 49 ? 8.35200  -15.89400 -1.71900  1.000 19.14000 ? 454 LYS A CG  1 
ATOM   392  C CD  . LYS A 1 49 ? 8.21600  -16.55600 -3.07900  1.000 21.56000 ? 454 LYS A CD  1 
ATOM   393  C CE  . LYS A 1 49 ? 8.88800  -15.72000 -4.15900  1.000 32.92000 ? 454 LYS A CE  1 
ATOM   394  N NZ  . LYS A 1 49 ? 8.47200  -14.29400 -4.04600  1.000 34.69000 ? 454 LYS A NZ  1 
ATOM   395  N N   . ASP A 1 50 ? 5.82700  -14.74500 0.80600   1.000 11.98000 ? 455 ASP A N   1 
ATOM   396  C CA  . ASP A 1 50 ? 5.15400  -13.45900 0.73200   1.000 11.89000 ? 455 ASP A CA  1 
ATOM   397  C C   . ASP A 1 50 ? 5.40700  -12.63600 1.98000   1.000 12.58000 ? 455 ASP A C   1 
ATOM   398  O O   . ASP A 1 50 ? 5.53900  -11.40800 1.90000   1.000 11.22000 ? 455 ASP A O   1 
ATOM   399  C CB  . ASP A 1 50 ? 3.66300  -13.61900 0.51600   1.000 12.30000 ? 455 ASP A CB  1 
ATOM   400  C CG  . ASP A 1 50 ? 3.03100  -12.29700 0.13700   1.000 15.31000 ? 455 ASP A CG  1 
ATOM   401  O OD1 . ASP A 1 50 ? 3.34900  -11.82200 -0.97100  1.000 17.32000 ? 455 ASP A OD1 1 
ATOM   402  O OD2 . ASP A 1 50 ? 2.29700  -11.71400 0.95300   1.000 16.49000 ? 455 ASP A OD2 1 
ATOM   403  N N   . LYS A 1 51 ? 5.46600  -13.28800 3.14200   1.000 9.86000  ? 456 LYS A N   1 
ATOM   404  C CA  . LYS A 1 51 ? 5.71300  -12.54500 4.37400   1.000 11.00000 ? 456 LYS A CA  1 
ATOM   405  C C   . LYS A 1 51 ? 7.11700  -11.96000 4.38800   1.000 12.17000 ? 456 LYS A C   1 
ATOM   406  O O   . LYS A 1 51 ? 7.31700  -10.83200 4.85600   1.000 10.46000 ? 456 LYS A O   1 
ATOM   407  C CB  . LYS A 1 51 ? 5.50100  -13.43900 5.58600   1.000 10.80000 ? 456 LYS A CB  1 
ATOM   408  C CG  . LYS A 1 51 ? 5.73000  -12.73400 6.92400   1.000 12.10000 ? 456 LYS A CG  1 
ATOM   409  C CD  . LYS A 1 51 ? 4.76400  -11.56500 7.10100   1.000 13.34000 ? 456 LYS A CD  1 
ATOM   410  C CE  . LYS A 1 51 ? 4.84600  -10.98100 8.50400   1.000 15.01000 ? 456 LYS A CE  1 
ATOM   411  N NZ  . LYS A 1 51 ? 3.88200  -9.82500  8.64300   1.000 15.70000 ? 456 LYS A NZ  1 
ATOM   412  N N   . ALA A 1 52 ? 8.11100  -12.70700 3.89200   1.000 10.22000 ? 457 ALA A N   1 
ATOM   413  C CA  . ALA A 1 52 ? 9.46100  -12.15400 3.84200   1.000 10.00000 ? 457 ALA A CA  1 
ATOM   414  C C   . ALA A 1 52 ? 9.50700  -10.91200 2.96100   1.000 11.76000 ? 457 ALA A C   1 
ATOM   415  O O   . ALA A 1 52 ? 10.13600 -9.90600  3.31800   1.000 11.57000 ? 457 ALA A O   1 
ATOM   416  C CB  . ALA A 1 52 ? 10.45600 -13.20100 3.34600   1.000 13.14000 ? 457 ALA A CB  1 
ATOM   417  N N   . ARG A 1 53 ? 8.82000  -10.95900 1.81900   1.000 10.86000 ? 458 ARG A N   1 
ATOM   418  C CA  . ARG A 1 53 ? 8.75500  -9.78900  0.95400   1.000 10.46000 ? 458 ARG A CA  1 
ATOM   419  C C   . ARG A 1 53 ? 8.00800  -8.64600  1.63500   1.000 13.56000 ? 458 ARG A C   1 
ATOM   420  O O   . ARG A 1 53 ? 8.41400  -7.48400  1.53100   1.000 11.59000 ? 458 ARG A O   1 
ATOM   421  C CB  . ARG A 1 53 ? 8.09600  -10.17200 -0.37600  1.000 11.44000 ? 458 ARG A CB  1 
ATOM   422  C CG  . ARG A 1 53 ? 8.89700  -11.20900 -1.18900  1.000 12.56000 ? 458 ARG A CG  1 
ATOM   423  C CD  . ARG A 1 53 ? 8.40500  -11.31800 -2.65000  1.000 19.49000 ? 458 ARG A CD  1 
ATOM   424  N NE  . ARG A 1 53 ? 6.96700  -11.57500 -2.71600  1.000 20.81000 ? 458 ARG A NE  1 
ATOM   425  C CZ  . ARG A 1 53 ? 6.09400  -10.88800 -3.45400  1.000 22.30000 ? 458 ARG A CZ  1 
ATOM   426  N NH1 . ARG A 1 53 ? 6.48200  -9.88800  -4.24600  1.000 19.79000 ? 458 ARG A NH1 1 
ATOM   427  N NH2 . ARG A 1 53 ? 4.80900  -11.22000 -3.41400  1.000 20.23000 ? 458 ARG A NH2 1 
ATOM   428  N N   . ASN A 1 54 ? 6.92600  -8.95400  2.35200   1.000 10.87000 ? 459 ASN A N   1 
ATOM   429  C CA  . ASN A 1 54 ? 6.15600  -7.89800  3.01000   1.000 13.06000 ? 459 ASN A CA  1 
ATOM   430  C C   . ASN A 1 54 ? 6.92200  -7.31200  4.19400   1.000 12.01000 ? 459 ASN A C   1 
ATOM   431  O O   . ASN A 1 54 ? 6.84300  -6.10800  4.45700   1.000 12.55000 ? 459 ASN A O   1 
ATOM   432  C CB  . ASN A 1 54 ? 4.79500  -8.44400  3.45700   1.000 11.32000 ? 459 ASN A CB  1 
ATOM   433  C CG  . ASN A 1 54 ? 3.78200  -7.33700  3.76500   1.000 16.73000 ? 459 ASN A CG  1 
ATOM   434  O OD1 . ASN A 1 54 ? 3.84800  -6.24000  3.20200   1.000 16.24000 ? 459 ASN A OD1 1 
ATOM   435  N ND2 . ASN A 1 54 ? 2.81800  -7.64100  4.63700   1.000 16.12000 ? 459 ASN A ND2 1 
ATOM   436  N N   . MET A 1 55 ? 7.69100  -8.13800  4.90300   1.000 11.83000 ? 460 MET A N   1 
ATOM   437  C CA  . MET A 1 55 ? 8.49900  -7.60500  5.98800   1.000 12.25000 ? 460 MET A CA  1 
ATOM   438  C C   . MET A 1 55 ? 9.60100  -6.71500  5.44700   1.000 12.70000 ? 460 MET A C   1 
ATOM   439  O O   . MET A 1 55 ? 9.89500  -5.66800  6.03100   1.000 12.85000 ? 460 MET A O   1 
ATOM   440  C CB  . MET A 1 55 ? 9.09600  -8.74300  6.82300   1.000 11.49000 ? 460 MET A CB  1 
ATOM   441  C CG  . MET A 1 55 ? 8.06600  -9.45500  7.67800   1.000 13.43000 ? 460 MET A CG  1 
ATOM   442  S SD  . MET A 1 55 ? 8.82400  -10.79400 8.63800   1.000 18.00000 ? 460 MET A SD  1 
ATOM   443  C CE  . MET A 1 55 ? 9.78300  -9.85400  9.81200   1.000 18.53000 ? 460 MET A CE  1 
ATOM   444  N N   . LYS A 1 56 ? 10.25200 -7.13300  4.35600   1.000 11.13000 ? 461 LYS A N   1 
ATOM   445  C CA  . LYS A 1 56 ? 11.28400 -6.28100  3.76900   1.000 11.01000 ? 461 LYS A CA  1 
ATOM   446  C C   . LYS A 1 56 ? 10.67000 -4.96300  3.32800   1.000 10.33000 ? 461 LYS A C   1 
ATOM   447  O O   . LYS A 1 56 ? 11.22900 -3.88500  3.57500   1.000 11.36000 ? 461 LYS A O   1 
ATOM   448  C CB  . LYS A 1 56 ? 11.96300 -6.97400  2.58700   1.000 10.54000 ? 461 LYS A CB  1 
ATOM   449  C CG  . LYS A 1 56 ? 13.23200 -6.23800  2.13700   1.000 13.09000 ? 461 LYS A CG  1 
ATOM   450  C CD  . LYS A 1 56 ? 13.78700 -6.81200  0.84200   1.000 12.60000 ? 461 LYS A CD  1 
ATOM   451  C CE  . LYS A 1 56 ? 15.15700 -6.19500  0.51600   1.000 14.04000 ? 461 LYS A CE  1 
ATOM   452  N NZ  . LYS A 1 56 ? 15.57600 -6.63600  -0.87200  1.000 14.79000 ? 461 LYS A NZ  1 
ATOM   453  N N   . LEU A 1 57 ? 9.49200  -5.03500  2.71800   1.000 10.55000 ? 462 LEU A N   1 
ATOM   454  C CA  . LEU A 1 57 ? 8.79200  -3.82600  2.30800   1.000 11.70000 ? 462 LEU A CA  1 
ATOM   455  C C   . LEU A 1 57 ? 8.44900  -2.95600  3.51100   1.000 12.19000 ? 462 LEU A C   1 
ATOM   456  O O   . LEU A 1 57 ? 8.54800  -1.72500  3.43500   1.000 13.53000 ? 462 LEU A O   1 
ATOM   457  C CB  . LEU A 1 57 ? 7.52700  -4.20200  1.53700   1.000 12.27000 ? 462 LEU A CB  1 
ATOM   458  C CG  . LEU A 1 57 ? 6.61400  -3.06800  1.04800   1.000 13.81000 ? 462 LEU A CG  1 
ATOM   459  C CD1 . LEU A 1 57 ? 7.42000  -2.08000  0.24200   1.000 15.61000 ? 462 LEU A CD1 1 
ATOM   460  C CD2 . LEU A 1 57 ? 5.46800  -3.63900  0.22600   1.000 17.64000 ? 462 LEU A CD2 1 
ATOM   461  N N   . PHE A 1 58 ? 8.05700  -3.57300  4.63500   1.000 12.96000 ? 463 PHE A N   1 
ATOM   462  C CA  . PHE A 1 58 ? 7.73200  -2.78600  5.82300   1.000 11.97000 ? 463 PHE A CA  1 
ATOM   463  C C   . PHE A 1 58 ? 8.93000  -1.97300  6.29700   1.000 12.94000 ? 463 PHE A C   1 
ATOM   464  O O   . PHE A 1 58 ? 8.80100  -0.78200  6.60800   1.000 13.36000 ? 463 PHE A O   1 
ATOM   465  C CB  . PHE A 1 58 ? 7.23700  -3.66000  6.97800   1.000 13.36000 ? 463 PHE A CB  1 
ATOM   466  C CG  . PHE A 1 58 ? 6.97000  -2.85800  8.21500   1.000 16.86000 ? 463 PHE A CG  1 
ATOM   467  C CD1 . PHE A 1 58 ? 5.78200  -2.15900  8.34500   1.000 19.83000 ? 463 PHE A CD1 1 
ATOM   468  C CD2 . PHE A 1 58 ? 7.93900  -2.72200  9.19700   1.000 22.17000 ? 463 PHE A CD2 1 
ATOM   469  C CE1 . PHE A 1 58 ? 5.54800  -1.37200  9.47000   1.000 24.72000 ? 463 PHE A CE1 1 
ATOM   470  C CE2 . PHE A 1 58 ? 7.70900  -1.93700  10.31500  1.000 26.07000 ? 463 PHE A CE2 1 
ATOM   471  C CZ  . PHE A 1 58 ? 6.51400  -1.26400  10.44000  1.000 25.29000 ? 463 PHE A CZ  1 
ATOM   472  N N   . PHE A 1 59 ? 10.10300 -2.60400  6.40400   1.000 12.07000 ? 464 PHE A N   1 
ATOM   473  C CA  . PHE A 1 59 ? 11.27000 -1.84400  6.84300   1.000 12.60000 ? 464 PHE A CA  1 
ATOM   474  C C   . PHE A 1 59 ? 11.60600 -0.74700  5.84000   1.000 12.57000 ? 464 PHE A C   1 
ATOM   475  O O   . PHE A 1 59 ? 11.92200 0.38300   6.22900   1.000 13.44000 ? 464 PHE A O   1 
ATOM   476  C CB  . PHE A 1 59 ? 12.47200 -2.76800  7.04600   1.000 13.52000 ? 464 PHE A CB  1 
ATOM   477  C CG  . PHE A 1 59 ? 12.30200 -3.73900  8.18400   1.000 15.37000 ? 464 PHE A CG  1 
ATOM   478  C CD1 . PHE A 1 59 ? 12.22500 -3.28600  9.49600   1.000 21.88000 ? 464 PHE A CD1 1 
ATOM   479  C CD2 . PHE A 1 59 ? 12.20900 -5.09700  7.93600   1.000 14.94000 ? 464 PHE A CD2 1 
ATOM   480  C CE1 . PHE A 1 59 ? 12.05900 -4.19200  10.55500  1.000 25.26000 ? 464 PHE A CE1 1 
ATOM   481  C CE2 . PHE A 1 59 ? 12.03100 -6.01600  8.98300   1.000 16.83000 ? 464 PHE A CE2 1 
ATOM   482  C CZ  . PHE A 1 59 ? 11.95800 -5.55700  10.29500  1.000 20.57000 ? 464 PHE A CZ  1 
ATOM   483  N N   . LEU A 1 60 ? 11.53500 -1.05800  4.54200   1.000 13.51000 ? 465 LEU A N   1 
ATOM   484  C CA  . LEU A 1 60 ? 11.85500 -0.05100  3.53000   1.000 12.46000 ? 465 LEU A CA  1 
ATOM   485  C C   . LEU A 1 60 ? 10.88100 1.12000   3.58800   1.000 13.71000 ? 465 LEU A C   1 
ATOM   486  O O   . LEU A 1 60 ? 11.28800 2.29300   3.54600   1.000 15.47000 ? 465 LEU A O   1 
ATOM   487  C CB  . LEU A 1 60 ? 11.84300 -0.68100  2.13600   1.000 11.86000 ? 465 LEU A CB  1 
ATOM   488  C CG  . LEU A 1 60 ? 13.02500 -1.62800  1.87100   1.000 12.11000 ? 465 LEU A CG  1 
ATOM   489  C CD1 . LEU A 1 60 ? 12.82300 -2.38800  0.56300   1.000 13.89000 ? 465 LEU A CD1 1 
ATOM   490  C CD2 . LEU A 1 60 ? 14.34400 -0.83700  1.84600   1.000 15.04000 ? 465 LEU A CD2 1 
ATOM   491  N N   . LYS A 1 61 ? 9.58600  0.82600   3.67200   1.000 13.75000 ? 466 LYS A N   1 
ATOM   492  C CA  . LYS A 1 61 ? 8.61000  1.90200   3.58100   1.000 11.79000 ? 466 LYS A CA  1 
ATOM   493  C C   . LYS A 1 61 ? 8.59300  2.75100   4.83500   1.000 14.60000 ? 466 LYS A C   1 
ATOM   494  O O   . LYS A 1 61 ? 8.21400  3.92400   4.76300   1.000 14.47000 ? 466 LYS A O   1 
ATOM   495  C CB  . LYS A 1 61 ? 7.21500  1.34200   3.29700   1.000 15.67000 ? 466 LYS A CB  1 
ATOM   496  C CG  . LYS A 1 61 ? 6.50900  0.72700   4.49000   1.000 12.86000 ? 466 LYS A CG  1 
ATOM   497  C CD  . LYS A 1 61 ? 5.18800  0.12200   4.04400   1.000 19.13000 ? 466 LYS A CD  1 
ATOM   498  C CE  . LYS A 1 61 ? 4.38300  -0.34700  5.24600   1.000 23.53000 ? 466 LYS A CE  1 
ATOM   499  N NZ  . LYS A 1 61 ? 3.20200  -1.10900  4.75800   1.000 24.73000 ? 466 LYS A NZ  1 
ATOM   500  N N   . SER A 1 62 ? 9.01200  2.19400   5.97100   1.000 12.80000 ? 467 SER A N   1 
ATOM   501  C CA  . SER A 1 62 ? 9.06600  2.92200   7.23400   1.000 15.42000 ? 467 SER A CA  1 
ATOM   502  C C   . SER A 1 62 ? 10.42000 3.57700   7.48300   1.000 16.32000 ? 467 SER A C   1 
ATOM   503  O O   . SER A 1 62 ? 10.60100 4.22600   8.52800   1.000 17.12000 ? 467 SER A O   1 
ATOM   504  C CB  . SER A 1 62 ? 8.72500  1.97900   8.39900   1.000 15.61000 ? 467 SER A CB  1 
ATOM   505  O OG  . SER A 1 62 ? 9.67400  0.92100   8.51700   1.000 16.75000 ? 467 SER A OG  1 
ATOM   506  N N   . GLY A 1 63 ? 11.36100 3.42700   6.55800   1.000 15.05000 ? 468 GLY A N   1 
ATOM   507  C CA  . GLY A 1 63 ? 12.68300 4.00100   6.72000   1.000 15.13000 ? 468 GLY A CA  1 
ATOM   508  C C   . GLY A 1 63 ? 13.52300 3.32700   7.78100   1.000 19.21000 ? 468 GLY A C   1 
ATOM   509  O O   . GLY A 1 63 ? 14.43700 3.95200   8.32800   1.000 20.61000 ? 468 GLY A O   1 
ATOM   510  N N   . GLN A 1 64 ? 13.24900 2.06400   8.08800   1.000 16.20000 ? 469 GLN A N   1 
ATOM   511  C CA  . GLN A 1 64 ? 14.00300 1.34100   9.10300   1.000 16.85000 ? 469 GLN A CA  1 
ATOM   512  C C   . GLN A 1 64 ? 15.05800 0.44100   8.46300   1.000 19.13000 ? 469 GLN A C   1 
ATOM   513  O O   . GLN A 1 64 ? 15.02500 0.14600   7.26600   1.000 15.59000 ? 469 GLN A O   1 
ATOM   514  C CB  . GLN A 1 64 ? 13.06200 0.51200   9.98200   1.000 17.70000 ? 469 GLN A CB  1 
ATOM   515  C CG  . GLN A 1 64 ? 12.08200 1.35200   10.79200  1.000 21.57000 ? 469 GLN A CG  1 
ATOM   516  C CD  . GLN A 1 64 ? 11.13400 0.49600   11.60700  1.000 29.20000 ? 469 GLN A CD  1 
ATOM   517  O OE1 . GLN A 1 64 ? 9.92300  0.69500   11.58200  1.000 33.73000 ? 469 GLN A OE1 1 
ATOM   518  N NE2 . GLN A 1 64 ? 11.68500 -0.45700  12.34300  1.000 35.26000 ? 469 GLN A NE2 1 
ATOM   519  N N   . VAL A 1 65 ? 16.00400 -0.00700  9.28900   1.000 19.81000 ? 470 VAL A N   1 
ATOM   520  C CA  . VAL A 1 65 ? 17.07900 -0.86300  8.79500   1.000 18.22000 ? 470 VAL A CA  1 
ATOM   521  C C   . VAL A 1 65 ? 16.51400 -2.21100  8.36100   1.000 15.68000 ? 470 VAL A C   1 
ATOM   522  O O   . VAL A 1 65 ? 15.73200 -2.84000  9.08400   1.000 17.50000 ? 470 VAL A O   1 
ATOM   523  C CB  . VAL A 1 65 ? 18.15700 -1.02600  9.87700   1.000 21.69000 ? 470 VAL A CB  1 
ATOM   524  C CG1 . VAL A 1 65 ? 19.22500 -2.00500  9.42300   1.000 24.61000 ? 470 VAL A CG1 1 
ATOM   525  C CG2 . VAL A 1 65 ? 18.77300 0.32700   10.19600  1.000 23.22000 ? 470 VAL A CG2 1 
ATOM   526  N N   . VAL A 1 66 ? 16.89000 -2.65300  7.16300   1.000 16.89000 ? 471 VAL A N   1 
ATOM   527  C CA  . VAL A 1 66 ? 16.55000 -3.99900  6.70100   1.000 13.72000 ? 471 VAL A CA  1 
ATOM   528  C C   . VAL A 1 66 ? 17.52500 -4.98900  7.33000   1.000 15.48000 ? 471 VAL A C   1 
ATOM   529  O O   . VAL A 1 66 ? 18.73000 -4.91200  7.06100   1.000 15.58000 ? 471 VAL A O   1 
ATOM   530  C CB  . VAL A 1 66 ? 16.60800 -4.09700  5.16900   1.000 16.55000 ? 471 VAL A CB  1 
ATOM   531  C CG1 . VAL A 1 66 ? 16.28300 -5.51400  4.72000   1.000 16.49000 ? 471 VAL A CG1 1 
ATOM   532  C CG2 . VAL A 1 66 ? 15.65900 -3.08800  4.53200   1.000 18.53000 ? 471 VAL A CG2 1 
ATOM   533  N N   . PRO A 1 67 ? 17.05500 -5.94500  8.12900   1.000 16.76000 ? 472 PRO A N   1 
ATOM   534  C CA  . PRO A 1 67 ? 17.96400 -6.95100  8.69600   1.000 19.53000 ? 472 PRO A CA  1 
ATOM   535  C C   . PRO A 1 67 ? 18.70800 -7.71700  7.61200   1.000 18.35000 ? 472 PRO A C   1 
ATOM   536  O O   . PRO A 1 67 ? 18.18600 -7.95600  6.52400   1.000 15.98000 ? 472 PRO A O   1 
ATOM   537  C CB  . PRO A 1 67 ? 17.02700 -7.88300  9.47500   1.000 20.25000 ? 472 PRO A CB  1 
ATOM   538  C CG  . PRO A 1 67 ? 15.74300 -7.14000  9.64500   1.000 21.87000 ? 472 PRO A CG  1 
ATOM   539  C CD  . PRO A 1 67 ? 15.64900 -6.14800  8.52400   1.000 16.78000 ? 472 PRO A CD  1 
ATOM   540  N N   . ALA A 1 68 ? 19.94100 -8.13500  7.93700   1.000 16.49000 ? 473 ALA A N   1 
ATOM   541  C CA  . ALA A 1 68 ? 20.75300 -8.87200  6.97400   1.000 17.57000 ? 473 ALA A CA  1 
ATOM   542  C C   . ALA A 1 68 ? 20.00200 -10.05700 6.38100   1.000 17.61000 ? 473 ALA A C   1 
ATOM   543  O O   . ALA A 1 68 ? 20.13600 -10.34700 5.18600   1.000 19.08000 ? 473 ALA A O   1 
ATOM   544  C CB  . ALA A 1 68 ? 22.05200 -9.35400  7.63300   1.000 17.98000 ? 473 ALA A CB  1 
ATOM   545  N N   . ALA A 1 69 ? 19.17500 -10.72600 7.19000   1.000 19.50000 ? 474 ALA A N   1 
ATOM   546  C CA  . ALA A 1 69 ? 18.49200 -11.93200 6.72600   1.000 23.62000 ? 474 ALA A CA  1 
ATOM   547  C C   . ALA A 1 69 ? 17.51600 -11.64600 5.58800   1.000 21.15000 ? 474 ALA A C   1 
ATOM   548  O O   . ALA A 1 69 ? 17.24800 -12.52900 4.76300   1.000 25.45000 ? 474 ALA A O   1 
ATOM   549  C CB  . ALA A 1 69 ? 17.75100 -12.59000 7.88700   1.000 24.55000 ? 474 ALA A CB  1 
ATOM   550  N N   . LEU A 1 70 ? 16.97000 -10.43700 5.53000   1.000 17.45000 ? 475 LEU A N   1 
ATOM   551  C CA  . LEU A 1 70 ? 16.02200 -10.09200 4.48900   1.000 16.23000 ? 475 LEU A CA  1 
ATOM   552  C C   . LEU A 1 70 ? 16.69300 -9.52800  3.25200   1.000 15.66000 ? 475 LEU A C   1 
ATOM   553  O O   . LEU A 1 70 ? 16.02700 -9.35500  2.23100   1.000 14.60000 ? 475 LEU A O   1 
ATOM   554  C CB  . LEU A 1 70 ? 14.99100 -9.07800  5.01200   1.000 16.43000 ? 475 LEU A CB  1 
ATOM   555  C CG  . LEU A 1 70 ? 13.89900 -9.65900  5.90200   1.000 16.44000 ? 475 LEU A CG  1 
ATOM   556  C CD1 . LEU A 1 70 ? 13.06500 -8.51600  6.46900   1.000 15.69000 ? 475 LEU A CD1 1 
ATOM   557  C CD2 . LEU A 1 70 ? 13.05200 -10.65900 5.11300   1.000 17.96000 ? 475 LEU A CD2 1 
ATOM   558  N N   . GLN A 1 71 ? 17.99300 -9.24000  3.30900   1.000 15.32000 ? 476 GLN A N   1 
ATOM   559  C CA  . GLN A 1 71 ? 18.63900 -8.67600  2.13300   1.000 15.54000 ? 476 GLN A CA  1 
ATOM   560  C C   . GLN A 1 71 ? 18.78700 -9.69900  1.01900   1.000 15.61000 ? 476 GLN A C   1 
ATOM   561  O O   . GLN A 1 71 ? 18.96500 -9.30800  -0.14200  1.000 17.73000 ? 476 GLN A O   1 
ATOM   562  C CB  . GLN A 1 71 ? 19.98600 -8.06300  2.53300   1.000 16.30000 ? 476 GLN A CB  1 
ATOM   563  C CG  . GLN A 1 71 ? 19.77900 -6.86800  3.45200   1.000 19.92000 ? 476 GLN A CG  1 
ATOM   564  C CD  . GLN A 1 71 ? 21.06100 -6.33200  4.04700   1.000 26.68000 ? 476 GLN A CD  1 
ATOM   565  O OE1 . GLN A 1 71 ? 22.14800 -6.52800  3.49000   1.000 25.49000 ? 476 GLN A OE1 1 
ATOM   566  N NE2 . GLN A 1 71 ? 20.94600 -5.64800  5.19700   1.000 21.14000 ? 476 GLN A NE2 1 
ATOM   567  N N   . CYS A 1 72 ? 18.64400 -10.96400 1.31800   1.000 16.59000 ? 477 CYS A N   1 
ATOM   568  C CA  . CYS A 1 72 ? 18.70200 -11.97800 0.30200   1.000 18.20000 ? 477 CYS A CA  1 
ATOM   569  C C   . CYS A 1 72 ? 17.36300 -12.14400 -0.41700  1.000 19.68000 ? 477 CYS A C   1 
ATOM   570  O O   . CYS A 1 72 ? 17.26100 -12.86400 -1.33100  1.000 20.98000 ? 477 CYS A O   1 
ATOM   571  C CB  . CYS A 1 72 ? 19.10300 -13.30900 0.86100   1.000 25.43000 ? 477 CYS A CB  1 
ATOM   572  S SG  . CYS A 1 72 ? 17.89400 -13.90000 2.02500   1.000 46.43000 ? 477 CYS A SG  1 
ATOM   573  N N   . VAL A 1 73 ? 16.33800 -11.50400 0.08900   1.000 16.16000 ? 478 VAL A N   1 
ATOM   574  C CA  . VAL A 1 73 ? 15.03000 -11.50100 -0.56800  1.000 15.87000 ? 478 VAL A CA  1 
ATOM   575  C C   . VAL A 1 73 ? 15.04200 -10.33300 -1.55100  1.000 16.95000 ? 478 VAL A C   1 
ATOM   576  O O   . VAL A 1 73 ? 14.91500 -9.17500  -1.15400  1.000 17.48000 ? 478 VAL A O   1 
ATOM   577  C CB  . VAL A 1 73 ? 13.89300 -11.37900 0.44900   1.000 16.74000 ? 478 VAL A CB  1 
ATOM   578  C CG1 . VAL A 1 73 ? 12.53800 -11.32600 -0.26000  1.000 18.08000 ? 478 VAL A CG1 1 
ATOM   579  C CG2 . VAL A 1 73 ? 13.93600 -12.54400 1.44200   1.000 17.67000 ? 478 VAL A CG2 1 
ATOM   580  N N   . THR A 1 74 ? 15.20000 -10.62600 -2.83500  1.000 16.19000 ? 479 THR A N   1 
ATOM   581  C CA  . THR A 1 74 ? 15.41900 -9.57700  -3.81900  1.000 16.36000 ? 479 THR A CA  1 
ATOM   582  C C   . THR A 1 74 ? 14.25600 -9.50700  -4.78900  1.000 17.56000 ? 479 THR A C   1 
ATOM   583  O O   . THR A 1 74 ? 13.37100 -10.36500 -4.80200  1.000 18.64000 ? 479 THR A O   1 
ATOM   584  C CB  . THR A 1 74 ? 16.73100 -9.79400  -4.59600  1.000 18.87000 ? 479 THR A CB  1 
ATOM   585  O OG1 . THR A 1 74 ? 16.64900 -11.02100 -5.32900  1.000 18.13000 ? 479 THR A OG1 1 
ATOM   586  C CG2 . THR A 1 74 ? 17.92300 -9.85300  -3.63300  1.000 20.79000 ? 479 THR A CG2 1 
ATOM   587  N N   . GLY A 1 75 ? 14.26800 -8.46300  -5.60300  1.000 16.78000 ? 480 GLY A N   1 
ATOM   588  C CA  . GLY A 1 75 ? 13.26200 -8.29900  -6.62800  1.000 16.85000 ? 480 GLY A CA  1 
ATOM   589  C C   . GLY A 1 75 ? 11.99400 -7.62000  -6.13900  1.000 15.17000 ? 480 GLY A C   1 
ATOM   590  O O   . GLY A 1 75 ? 11.94200 -6.94200  -5.11200  1.000 15.85000 ? 480 GLY A O   1 
ATOM   591  N N   . ASP A 1 76 ? 10.94900 -7.81700  -6.93100  1.000 12.50000 ? 481 ASP A N   1 
ATOM   592  C CA  . ASP A 1 76 ? 9.65700  -7.17700  -6.70800  1.000 13.51000 ? 481 ASP A CA  1 
ATOM   593  C C   . ASP A 1 76 ? 9.06500  -7.64100  -5.38100  1.000 14.41000 ? 481 ASP A C   1 
ATOM   594  O O   . ASP A 1 76 ? 9.00600  -8.84300  -5.10400  1.000 16.39000 ? 481 ASP A O   1 
ATOM   595  C CB  . ASP A 1 76 ? 8.75500  -7.54300  -7.88500  1.000 16.77000 ? 481 ASP A CB  1 
ATOM   596  C CG  . ASP A 1 76 ? 7.51700  -6.68700  -7.99800  1.000 19.41000 ? 481 ASP A CG  1 
ATOM   597  O OD1 . ASP A 1 76 ? 7.16000  -5.95000  -7.05900  1.000 15.26000 ? 481 ASP A OD1 1 
ATOM   598  O OD2 . ASP A 1 76 ? 6.87000  -6.78600  -9.06100  1.000 21.97000 ? 481 ASP A OD2 1 
ATOM   599  N N   . LEU A 1 77 ? 8.64800  -6.68900  -4.54500  1.000 11.40000 ? 482 LEU A N   1 
ATOM   600  C CA  . LEU A 1 77 ? 8.07100  -6.99900  -3.24500  1.000 11.21000 ? 482 LEU A CA  1 
ATOM   601  C C   . LEU A 1 77 ? 6.55800  -6.82700  -3.21600  1.000 13.37000 ? 482 LEU A C   1 
ATOM   602  O O   . LEU A 1 77 ? 5.94800  -7.03600  -2.16400  1.000 12.56000 ? 482 LEU A O   1 
ATOM   603  C CB  . LEU A 1 77 ? 8.68500  -6.11500  -2.16100  1.000 10.97000 ? 482 LEU A CB  1 
ATOM   604  C CG  . LEU A 1 77 ? 10.21200 -6.09100  -2.10700  1.000 11.15000 ? 482 LEU A CG  1 
ATOM   605  C CD1 . LEU A 1 77 ? 10.62400 -5.06800  -1.05100  1.000 14.67000 ? 482 LEU A CD1 1 
ATOM   606  C CD2 . LEU A 1 77 ? 10.78000 -7.48600  -1.79900  1.000 11.94000 ? 482 LEU A CD2 1 
ATOM   607  N N   . ARG A 1 78 ? 5.94900  -6.44100  -4.33000  1.000 12.95000 ? 483 ARG A N   1 
ATOM   608  C CA  . ARG A 1 78 ? 4.52100  -6.15400  -4.32700  1.000 10.93000 ? 483 ARG A CA  1 
ATOM   609  C C   . ARG A 1 78 ? 3.70400  -7.43200  -4.22200  1.000 13.06000 ? 483 ARG A C   1 
ATOM   610  O O   . ARG A 1 78 ? 4.10200  -8.50000  -4.69800  1.000 14.44000 ? 483 ARG A O   1 
ATOM   611  C CB  . ARG A 1 78 ? 4.12700  -5.38000  -5.58300  1.000 13.76000 ? 483 ARG A CB  1 
ATOM   612  C CG  . ARG A 1 78 ? 4.71300  -3.97700  -5.60200  1.000 12.94000 ? 483 ARG A CG  1 
ATOM   613  C CD  . ARG A 1 78 ? 4.50600  -3.30700  -6.94900  1.000 16.14000 ? 483 ARG A CD  1 
ATOM   614  N NE  . ARG A 1 78 ? 5.30800  -3.92900  -8.00500  1.000 15.20000 ? 483 ARG A NE  1 
ATOM   615  C CZ  . ARG A 1 78 ? 5.39900  -3.44000  -9.23500  1.000 20.18000 ? 483 ARG A CZ  1 
ATOM   616  N NH1 . ARG A 1 78 ? 4.72900  -2.33900  -9.54700  1.000 22.37000 ? 483 ARG A NH1 1 
ATOM   617  N NH2 . ARG A 1 78 ? 6.13800  -4.05600  -10.15200 1.000 18.45000 ? 483 ARG A NH2 1 
ATOM   618  N N   . ARG A 1 79 ? 2.54600  -7.28500  -3.57900  1.000 11.99000 ? 484 ARG A N   1 
ATOM   619  C CA  . ARG A 1 79 ? 1.56500  -8.35000  -3.42400  1.000 13.08000 ? 484 ARG A CA  1 
ATOM   620  C C   . ARG A 1 79 ? 1.07500  -8.84600  -4.77900  1.000 13.93000 ? 484 ARG A C   1 
ATOM   621  O O   . ARG A 1 79 ? 0.81500  -8.05200  -5.69100  1.000 14.20000 ? 484 ARG A O   1 
ATOM   622  C CB  . ARG A 1 79 ? 0.39200  -7.78700  -2.62200  1.000 11.22000 ? 484 ARG A CB  1 
ATOM   623  C CG  . ARG A 1 79 ? -0.55600 -8.80300  -2.02400  1.000 11.95000 ? 484 ARG A CG  1 
ATOM   624  C CD  . ARG A 1 79 ? -1.54200 -8.03100  -1.18400  1.000 12.95000 ? 484 ARG A CD  1 
ATOM   625  N NE  . ARG A 1 79 ? -2.50300 -8.88300  -0.49100  1.000 12.38000 ? 484 ARG A NE  1 
ATOM   626  C CZ  . ARG A 1 79 ? -3.51300 -8.39300  0.21500   1.000 14.69000 ? 484 ARG A CZ  1 
ATOM   627  N NH1 . ARG A 1 79 ? -3.67300 -7.08000  0.29500   1.000 13.67000 ? 484 ARG A NH1 1 
ATOM   628  N NH2 . ARG A 1 79 ? -4.34700 -9.20900  0.85600   1.000 13.62000 ? 484 ARG A NH2 1 
ATOM   629  N N   . ASP A 1 80 ? 0.92300  -10.16900 -4.90900  1.000 14.98000 ? 485 ASP A N   1 
ATOM   630  C CA  . ASP A 1 80 ? 0.41700  -10.74600 -6.15900  1.000 14.61000 ? 485 ASP A CA  1 
ATOM   631  C C   . ASP A 1 80 ? -1.00300 -10.23300 -6.47200  1.000 19.28000 ? 485 ASP A C   1 
ATOM   632  O O   . ASP A 1 80 ? -1.82700 -10.06200 -5.54600  1.000 17.45000 ? 485 ASP A O   1 
ATOM   633  C CB  . ASP A 1 80 ? 0.38700  -12.28600 -6.09300  1.000 16.49000 ? 485 ASP A CB  1 
ATOM   634  C CG  . ASP A 1 80 ? 1.77600  -12.91900 -6.00700  1.000 21.53000 ? 485 ASP A CG  1 
ATOM   635  O OD1 . ASP A 1 80 ? 2.78900  -12.22300 -6.24600  1.000 19.21000 ? 485 ASP A OD1 1 
ATOM   636  O OD2 . ASP A 1 80 ? 1.84700  -14.14000 -5.69600  1.000 19.72000 ? 485 ASP A OD2 1 
ATOM   637  N N   . SER B 1 2  ? -3.98200 -38.76100 28.40000  1.000 46.02000 ? 407 SER B N   1 
ATOM   638  C CA  . SER B 1 2  ? -3.16100 -39.40200 29.42200  1.000 40.42000 ? 407 SER B CA  1 
ATOM   639  C C   . SER B 1 2  ? -2.10100 -40.29700 28.78500  1.000 36.95000 ? 407 SER B C   1 
ATOM   640  O O   . SER B 1 2  ? -2.30500 -40.83500 27.69200  1.000 37.88000 ? 407 SER B O   1 
ATOM   641  C CB  . SER B 1 2  ? -4.03200 -40.21200 30.38000  1.000 42.80000 ? 407 SER B CB  1 
ATOM   642  O OG  . SER B 1 2  ? -3.24000 -41.02000 31.23100  1.000 47.18000 ? 407 SER B OG  1 
ATOM   643  N N   . TRP B 1 3  ? -0.98700 -40.47800 29.49500  1.000 31.60000 ? 408 TRP B N   1 
ATOM   644  C CA  . TRP B 1 3  ? 0.20600  -41.11700 28.95400  1.000 28.68000 ? 408 TRP B CA  1 
ATOM   645  C C   . TRP B 1 3  ? 0.24000  -42.59700 29.30100  1.000 30.95000 ? 408 TRP B C   1 
ATOM   646  O O   . TRP B 1 3  ? 0.07700  -42.97200 30.46700  1.000 33.23000 ? 408 TRP B O   1 
ATOM   647  C CB  . TRP B 1 3  ? 1.46400  -40.43800 29.50100  1.000 25.29000 ? 408 TRP B CB  1 
ATOM   648  C CG  . TRP B 1 3  ? 1.81100  -39.16700 28.80000  1.000 23.43000 ? 408 TRP B CG  1 
ATOM   649  C CD1 . TRP B 1 3  ? 1.10600  -38.00000 28.81400  1.000 24.21000 ? 408 TRP B CD1 1 
ATOM   650  C CD2 . TRP B 1 3  ? 2.95900  -38.93600 27.97500  1.000 21.35000 ? 408 TRP B CD2 1 
ATOM   651  N NE1 . TRP B 1 3  ? 1.74100  -37.05700 28.03800  1.000 21.59000 ? 408 TRP B NE1 1 
ATOM   652  C CE2 . TRP B 1 3  ? 2.88200  -37.60600 27.51600  1.000 19.42000 ? 408 TRP B CE2 1 
ATOM   653  C CE3 . TRP B 1 3  ? 4.04200  -39.72800 27.58200  1.000 19.82000 ? 408 TRP B CE3 1 
ATOM   654  C CZ2 . TRP B 1 3  ? 3.84300  -37.04900 26.67300  1.000 17.04000 ? 408 TRP B CZ2 1 
ATOM   655  C CZ3 . TRP B 1 3  ? 5.00200  -39.17400 26.75300  1.000 21.55000 ? 408 TRP B CZ3 1 
ATOM   656  C CH2 . TRP B 1 3  ? 4.89500  -37.84500 26.30800  1.000 20.22000 ? 408 TRP B CH2 1 
ATOM   657  N N   . THR B 1 4  ? 0.50000  -43.43000 28.30200  1.000 27.83000 ? 409 THR B N   1 
ATOM   658  C CA  . THR B 1 4  ? 0.68600  -44.84700 28.55500  1.000 31.66000 ? 409 THR B CA  1 
ATOM   659  C C   . THR B 1 4  ? 2.10600  -45.12900 29.05000  1.000 35.17000 ? 409 THR B C   1 
ATOM   660  O O   . THR B 1 4  ? 3.01700  -44.29800 28.95700  1.000 30.62000 ? 409 THR B O   1 
ATOM   661  C CB  . THR B 1 4  ? 0.40000  -45.66800 27.29900  1.000 33.78000 ? 409 THR B CB  1 
ATOM   662  O OG1 . THR B 1 4  ? 1.45800  -45.48300 26.35200  1.000 29.22000 ? 409 THR B OG1 1 
ATOM   663  C CG2 . THR B 1 4  ? -0.91800 -45.24700 26.66900  1.000 33.89000 ? 409 THR B CG2 1 
ATOM   664  N N   . LYS B 1 5  ? 2.28300  -46.33500 29.58500  1.000 32.70000 ? 410 LYS B N   1 
ATOM   665  C CA  . LYS B 1 5  ? 3.59600  -46.75200 30.06400  1.000 35.61000 ? 410 LYS B CA  1 
ATOM   666  C C   . LYS B 1 5  ? 4.59700  -46.84300 28.92100  1.000 34.51000 ? 410 LYS B C   1 
ATOM   667  O O   . LYS B 1 5  ? 5.78300  -46.52200 29.09700  1.000 31.89000 ? 410 LYS B O   1 
ATOM   668  C CB  . LYS B 1 5  ? 3.49100  -48.09800 30.79200  1.000 39.86000 ? 410 LYS B CB  1 
ATOM   669  C CG  . LYS B 1 5  ? 3.17800  -47.98800 32.28800  1.000 46.92000 ? 410 LYS B CG  1 
ATOM   670  C CD  . LYS B 1 5  ? 1.93300  -47.15100 32.56800  1.000 46.36000 ? 410 LYS B CD  1 
ATOM   671  C CE  . LYS B 1 5  ? 2.12000  -46.24300 33.77700  1.000 51.27000 ? 410 LYS B CE  1 
ATOM   672  N NZ  . LYS B 1 5  ? 0.95100  -45.32600 33.96700  1.000 50.38000 ? 410 LYS B NZ  1 
ATOM   673  N N   . GLU B 1 6  ? 4.14300  -47.28500 27.74400  1.000 29.10000 ? 411 GLU B N   1 
ATOM   674  C CA  . GLU B 1 6  ? 5.02100  -47.32500 26.58200  1.000 33.38000 ? 411 GLU B CA  1 
ATOM   675  C C   . GLU B 1 6  ? 5.42700  -45.92000 26.15500  1.000 28.24000 ? 411 GLU B C   1 
ATOM   676  O O   . GLU B 1 6  ? 6.57500  -45.70100 25.74700  1.000 27.75000 ? 411 GLU B O   1 
ATOM   677  C CB  . GLU B 1 6  ? 4.33900  -48.05500 25.42800  1.000 32.04000 ? 411 GLU B CB  1 
ATOM   678  C CG  . GLU B 1 6  ? 4.10400  -49.54200 25.67500  1.000 39.40000 ? 411 GLU B CG  1 
ATOM   679  C CD  . GLU B 1 6  ? 2.74000  -49.83400 26.29000  1.000 43.77000 ? 411 GLU B CD  1 
ATOM   680  O OE1 . GLU B 1 6  ? 2.30500  -51.00400 26.23300  1.000 51.11000 ? 411 GLU B OE1 1 
ATOM   681  O OE2 . GLU B 1 6  ? 2.10300  -48.90300 26.82900  1.000 41.70000 ? 411 GLU B OE2 1 
ATOM   682  N N   . GLU B 1 7  ? 4.49500  -44.96200 26.23000  1.000 26.30000 ? 412 GLU B N   1 
ATOM   683  C CA  . GLU B 1 7  ? 4.83100  -43.57300 25.91800  1.000 23.40000 ? 412 GLU B CA  1 
ATOM   684  C C   . GLU B 1 7  ? 5.86300  -43.03300 26.89800  1.000 25.37000 ? 412 GLU B C   1 
ATOM   685  O O   . GLU B 1 7  ? 6.83700  -42.38000 26.50500  1.000 20.03000 ? 412 GLU B O   1 
ATOM   686  C CB  . GLU B 1 7  ? 3.57700  -42.69800 25.95100  1.000 22.39000 ? 412 GLU B CB  1 
ATOM   687  C CG  . GLU B 1 7  ? 2.66300  -42.81300 24.74600  1.000 23.07000 ? 412 GLU B CG  1 
ATOM   688  C CD  . GLU B 1 7  ? 1.52000  -41.81500 24.80100  1.000 26.17000 ? 412 GLU B CD  1 
ATOM   689  O OE1 . GLU B 1 7  ? 0.72700  -41.85700 25.77200  1.000 27.04000 ? 412 GLU B OE1 1 
ATOM   690  O OE2 . GLU B 1 7  ? 1.41400  -40.98100 23.87500  1.000 25.77000 ? 412 GLU B OE2 1 
ATOM   691  N N   . GLU B 1 8  ? 5.65000  -43.27800 28.19200  1.000 24.72000 ? 413 GLU B N   1 
ATOM   692  C CA  . GLU B 1 8  ? 6.58200  -42.77900 29.19400  1.000 26.29000 ? 413 GLU B CA  1 
ATOM   693  C C   . GLU B 1 8  ? 7.95500  -43.40700 29.02500  1.000 26.10000 ? 413 GLU B C   1 
ATOM   694  O O   . GLU B 1 8  ? 8.97200  -42.71300 29.11600  1.000 24.42000 ? 413 GLU B O   1 
ATOM   695  C CB  . GLU B 1 8  ? 6.04000  -43.04300 30.60200  1.000 29.61000 ? 413 GLU B CB  1 
ATOM   696  C CG  . GLU B 1 8  ? 4.87000  -42.15600 30.99100  1.000 28.37000 ? 413 GLU B CG  1 
ATOM   697  C CD  . GLU B 1 8  ? 4.43900  -42.35500 32.43400  1.000 36.73000 ? 413 GLU B CD  1 
ATOM   698  O OE1 . GLU B 1 8  ? 5.07800  -43.16800 33.13700  1.000 41.14000 ? 413 GLU B OE1 1 
ATOM   699  O OE2 . GLU B 1 8  ? 3.46100  -41.70500 32.85900  1.000 36.84000 ? 413 GLU B OE2 1 
ATOM   700  N N   . GLU B 1 9  ? 8.00200  -44.72200 28.77800  1.000 27.22000 ? 414 GLU B N   1 
ATOM   701  C CA  . GLU B 1 9  ? 9.27600  -45.40200 28.56200  1.000 28.67000 ? 414 GLU B CA  1 
ATOM   702  C C   . GLU B 1 9  ? 9.99400  -44.85700 27.33900  1.000 27.03000 ? 414 GLU B C   1 
ATOM   703  O O   . GLU B 1 9  ? 11.22400 -44.71900 27.33800  1.000 23.30000 ? 414 GLU B O   1 
ATOM   704  C CB  . GLU B 1 9  ? 9.05100  -46.90300 28.39200  1.000 31.77000 ? 414 GLU B CB  1 
ATOM   705  C CG  . GLU B 1 9  ? 8.77400  -47.64500 29.67800  1.000 37.51000 ? 414 GLU B CG  1 
ATOM   706  C CD  . GLU B 1 9  ? 8.35300  -49.08400 29.44100  1.000 44.75000 ? 414 GLU B CD  1 
ATOM   707  O OE1 . GLU B 1 9  ? 8.09400  -49.45000 28.26900  1.000 45.53000 ? 414 GLU B OE1 1 
ATOM   708  O OE2 . GLU B 1 9  ? 8.27400  -49.84500 30.43100  1.000 48.20000 ? 414 GLU B OE2 1 
ATOM   709  N N   . ALA B 1 10 ? 9.24400  -44.57200 26.26900  1.000 23.69000 ? 415 ALA B N   1 
ATOM   710  C CA  . ALA B 1 10 ? 9.88500  -44.05200 25.07000  1.000 21.33000 ? 415 ALA B CA  1 
ATOM   711  C C   . ALA B 1 10 ? 10.44300 -42.66000 25.31200  1.000 19.56000 ? 415 ALA B C   1 
ATOM   712  O O   . ALA B 1 10 ? 11.50900 -42.31700 24.79400  1.000 19.74000 ? 415 ALA B O   1 
ATOM   713  C CB  . ALA B 1 10 ? 8.90300  -44.03800 23.90500  1.000 19.66000 ? 415 ALA B CB  1 
ATOM   714  N N   . LEU B 1 11 ? 9.73300  -41.84000 26.08200  1.000 18.07000 ? 416 LEU B N   1 
ATOM   715  C CA  . LEU B 1 11 ? 10.23200 -40.49900 26.35400  1.000 17.86000 ? 416 LEU B CA  1 
ATOM   716  C C   . LEU B 1 11 ? 11.50800 -40.56100 27.17800  1.000 18.82000 ? 416 LEU B C   1 
ATOM   717  O O   . LEU B 1 11 ? 12.48300 -39.86000 26.88600  1.000 19.30000 ? 416 LEU B O   1 
ATOM   718  C CB  . LEU B 1 11 ? 9.16800  -39.66500 27.06400  1.000 17.98000 ? 416 LEU B CB  1 
ATOM   719  C CG  . LEU B 1 11 ? 9.54900  -38.21100 27.36800  1.000 18.07000 ? 416 LEU B CG  1 
ATOM   720  C CD1 . LEU B 1 11 ? 10.18100 -37.50700 26.15000  1.000 16.28000 ? 416 LEU B CD1 1 
ATOM   721  C CD2 . LEU B 1 11 ? 8.29900  -37.45000 27.82000  1.000 22.92000 ? 416 LEU B CD2 1 
ATOM   722  N N   . LEU B 1 12 ? 11.52200 -41.40900 28.21300  1.000 22.09000 ? 417 LEU B N   1 
ATOM   723  C CA  . LEU B 1 12 ? 12.74000 -41.56600 29.00700  1.000 22.05000 ? 417 LEU B CA  1 
ATOM   724  C C   . LEU B 1 12 ? 13.88700 -42.09700 28.16200  1.000 23.74000 ? 417 LEU B C   1 
ATOM   725  O O   . LEU B 1 12 ? 15.01800 -41.60300 28.26300  1.000 24.00000 ? 417 LEU B O   1 
ATOM   726  C CB  . LEU B 1 12 ? 12.49800 -42.48500 30.20800  1.000 25.63000 ? 417 LEU B CB  1 
ATOM   727  C CG  . LEU B 1 12 ? 11.70900 -41.95500 31.40500  1.000 30.87000 ? 417 LEU B CG  1 
ATOM   728  C CD1 . LEU B 1 12 ? 12.36700 -40.72400 32.02000  1.000 32.48000 ? 417 LEU B CD1 1 
ATOM   729  C CD2 . LEU B 1 12 ? 10.27100 -41.70800 31.07400  1.000 35.97000 ? 417 LEU B CD2 1 
ATOM   730  N N   . ASP B 1 13 ? 13.62300 -43.10800 27.32800  1.000 21.87000 ? 418 ASP B N   1 
ATOM   731  C CA  . ASP B 1 13 ? 14.67800 -43.64700 26.47500  1.000 24.64000 ? 418 ASP B CA  1 
ATOM   732  C C   . ASP B 1 13 ? 15.15500 -42.60300 25.47700  1.000 23.73000 ? 418 ASP B C   1 
ATOM   733  O O   . ASP B 1 13 ? 16.36100 -42.44300 25.27200  1.000 25.97000 ? 418 ASP B O   1 
ATOM   734  C CB  . ASP B 1 13 ? 14.19000 -44.90200 25.75200  1.000 23.35000 ? 418 ASP B CB  1 
ATOM   735  C CG  . ASP B 1 13 ? 15.24600 -45.49400 24.84500  1.000 30.29000 ? 418 ASP B CG  1 
ATOM   736  O OD1 . ASP B 1 13 ? 16.36200 -45.75500 25.33900  1.000 33.12000 ? 418 ASP B OD1 1 
ATOM   737  O OD2 . ASP B 1 13 ? 14.97300 -45.69500 23.64300  1.000 33.49000 ? 418 ASP B OD2 1 
ATOM   738  N N   . GLY B 1 14 ? 14.22200 -41.86000 24.87200  1.000 20.34000 ? 419 GLY B N   1 
ATOM   739  C CA  . GLY B 1 14 ? 14.61800 -40.78700 23.97400  1.000 21.01000 ? 419 GLY B CA  1 
ATOM   740  C C   . GLY B 1 14 ? 15.46200 -39.73100 24.66200  1.000 19.14000 ? 419 GLY B C   1 
ATOM   741  O O   . GLY B 1 14 ? 16.49100 -39.29300 24.13300  1.000 20.49000 ? 419 GLY B O   1 
ATOM   742  N N   . LEU B 1 15 ? 15.02700 -39.29100 25.84600  1.000 19.93000 ? 420 LEU B N   1 
ATOM   743  C CA  . LEU B 1 15 ? 15.82000 -38.33300 26.61100  1.000 20.58000 ? 420 LEU B CA  1 
ATOM   744  C C   . LEU B 1 15 ? 17.22200 -38.86700 26.87200  1.000 23.65000 ? 420 LEU B C   1 
ATOM   745  O O   . LEU B 1 15 ? 18.20200 -38.12300 26.78900  1.000 24.99000 ? 420 LEU B O   1 
ATOM   746  C CB  . LEU B 1 15 ? 15.12300 -38.00900 27.93200  1.000 21.30000 ? 420 LEU B CB  1 
ATOM   747  C CG  . LEU B 1 15 ? 13.91100 -37.07700 27.85600  1.000 18.13000 ? 420 LEU B CG  1 
ATOM   748  C CD1 . LEU B 1 15 ? 13.04300 -37.23800 29.10200  1.000 21.71000 ? 420 LEU B CD1 1 
ATOM   749  C CD2 . LEU B 1 15 ? 14.35800 -35.63900 27.69300  1.000 21.70000 ? 420 LEU B CD2 1 
ATOM   750  N N   . ASP B 1 16 ? 17.32600 -40.15700 27.19700  1.000 25.04000 ? 421 ASP B N   1 
ATOM   751  C CA  . ASP B 1 16 ? 18.62400 -40.79600 27.40200  1.000 28.27000 ? 421 ASP B CA  1 
ATOM   752  C C   . ASP B 1 16 ? 19.48800 -40.73400 26.14700  1.000 27.94000 ? 421 ASP B C   1 
ATOM   753  O O   . ASP B 1 16 ? 20.68900 -40.44900 26.22400  1.000 30.17000 ? 421 ASP B O   1 
ATOM   754  C CB  . ASP B 1 16 ? 18.40100 -42.24900 27.82400  1.000 31.00000 ? 421 ASP B CB  1 
ATOM   755  C CG  . ASP B 1 16 ? 19.45900 -42.75900 28.78300  1.000 44.44000 ? 421 ASP B CG  1 
ATOM   756  O OD1 . ASP B 1 16 ? 20.37600 -41.98800 29.14600  1.000 42.74000 ? 421 ASP B OD1 1 
ATOM   757  O OD2 . ASP B 1 16 ? 19.36000 -43.94200 29.17800  1.000 48.98000 ? 421 ASP B OD2 1 
ATOM   758  N N   . LEU B 1 17 ? 18.89400 -40.99600 24.98000  1.000 27.79000 ? 422 LEU B N   1 
ATOM   759  C CA  . LEU B 1 17 ? 19.67100 -41.12300 23.75300  1.000 26.70000 ? 422 LEU B CA  1 
ATOM   760  C C   . LEU B 1 17 ? 20.11300 -39.77300 23.20300  1.000 31.95000 ? 422 LEU B C   1 
ATOM   761  O O   . LEU B 1 17 ? 21.19700 -39.66400 22.62000  1.000 30.73000 ? 422 LEU B O   1 
ATOM   762  C CB  . LEU B 1 17 ? 18.85800 -41.87600 22.70200  1.000 27.01000 ? 422 LEU B CB  1 
ATOM   763  C CG  . LEU B 1 17 ? 18.54700 -43.33200 23.06000  1.000 27.50000 ? 422 LEU B CG  1 
ATOM   764  C CD1 . LEU B 1 17 ? 17.55300 -43.91700 22.08500  1.000 26.89000 ? 422 LEU B CD1 1 
ATOM   765  C CD2 . LEU B 1 17 ? 19.82100 -44.16000 23.08600  1.000 32.01000 ? 422 LEU B CD2 1 
ATOM   766  N N   . VAL B 1 18 ? 19.27900 -38.73700 23.35200  1.000 28.34000 ? 423 VAL B N   1 
ATOM   767  C CA  . VAL B 1 18 ? 19.62700 -37.40400 22.87000  1.000 30.24000 ? 423 VAL B CA  1 
ATOM   768  C C   . VAL B 1 18 ? 20.25100 -36.55100 23.95800  1.000 31.85000 ? 423 VAL B C   1 
ATOM   769  O O   . VAL B 1 18 ? 20.49600 -35.35800 23.73500  1.000 35.65000 ? 423 VAL B O   1 
ATOM   770  C CB  . VAL B 1 18 ? 18.39300 -36.68600 22.27800  1.000 27.83000 ? 423 VAL B CB  1 
ATOM   771  C CG1 . VAL B 1 18 ? 17.64200 -37.61800 21.34500  1.000 28.57000 ? 423 VAL B CG1 1 
ATOM   772  C CG2 . VAL B 1 18 ? 17.47500 -36.17900 23.38900  1.000 27.26000 ? 423 VAL B CG2 1 
ATOM   773  N N   . LYS B 1 19 ? 20.56500 -37.09600 25.09400  1.000 30.04000 ? 424 LYS B N   1 
ATOM   774  C CA  . LYS B 1 19 ? 21.07400 -36.33500 26.18700  1.000 31.08000 ? 424 LYS B CA  1 
ATOM   775  C C   . LYS B 1 19 ? 22.48900 -35.76100 26.10300  1.000 40.31000 ? 424 LYS B C   1 
ATOM   776  O O   . LYS B 1 19 ? 22.81800 -34.87300 26.87900  1.000 41.45000 ? 424 LYS B O   1 
ATOM   777  C CB  . LYS B 1 19 ? 20.94300 -37.14500 27.43100  1.000 39.10000 ? 424 LYS B CB  1 
ATOM   778  C CG  . LYS B 1 19 ? 21.93200 -36.85500 28.49100  1.000 39.48000 ? 424 LYS B CG  1 
ATOM   779  C CD  . LYS B 1 19 ? 22.68000 -38.09900 28.78700  1.000 42.48000 ? 424 LYS B CD  1 
ATOM   780  C CE  . LYS B 1 19 ? 22.02000 -38.88500 29.87500  1.000 37.99000 ? 424 LYS B CE  1 
ATOM   781  N NZ  . LYS B 1 19 ? 22.63100 -40.21500 29.95600  1.000 44.83000 ? 424 LYS B NZ  1 
ATOM   782  N N   . GLY B 1 20 ? 18.54600 -27.36000 26.96900  1.000 46.45000 ? 425 GLY B N   1 
ATOM   783  C CA  . GLY B 1 20 ? 17.37200 -28.22000 27.08300  1.000 35.75000 ? 425 GLY B CA  1 
ATOM   784  C C   . GLY B 1 20 ? 17.40700 -29.29700 26.03700  1.000 34.68000 ? 425 GLY B C   1 
ATOM   785  O O   . GLY B 1 20 ? 18.10400 -29.15300 25.09200  1.000 34.92000 ? 425 GLY B O   1 
ATOM   786  N N   . PRO B 1 21 ? 16.64800 -30.38200 26.22400  1.000 29.87000 ? 426 PRO B N   1 
ATOM   787  C CA  . PRO B 1 21 ? 16.64200 -31.47800 25.27200  1.000 25.10000 ? 426 PRO B CA  1 
ATOM   788  C C   . PRO B 1 21 ? 16.13200 -31.09400 23.90100  1.000 24.84000 ? 426 PRO B C   1 
ATOM   789  O O   . PRO B 1 21 ? 15.35400 -30.24400 23.76000  1.000 25.10000 ? 426 PRO B O   1 
ATOM   790  C CB  . PRO B 1 21 ? 15.74200 -32.48700 25.92200  1.000 24.93000 ? 426 PRO B CB  1 
ATOM   791  C CG  . PRO B 1 21 ? 15.66600 -32.12300 27.30800  1.000 26.53000 ? 426 PRO B CG  1 
ATOM   792  C CD  . PRO B 1 21 ? 15.81700 -30.67000 27.37300  1.000 27.65000 ? 426 PRO B CD  1 
ATOM   793  N N   . ARG B 1 22 ? 16.66100 -31.72900 22.88900  1.000 23.25000 ? 427 ARG B N   1 
ATOM   794  C CA  . ARG B 1 22 ? 16.24400 -31.47400 21.54400  1.000 25.17000 ? 427 ARG B CA  1 
ATOM   795  C C   . ARG B 1 22 ? 15.02600 -32.34400 21.29600  1.000 22.80000 ? 427 ARG B C   1 
ATOM   796  O O   . ARG B 1 22 ? 15.14400 -33.44100 20.89000  1.000 21.07000 ? 427 ARG B O   1 
ATOM   797  C CB  . ARG B 1 22 ? 17.32000 -31.80900 20.54300  1.000 30.12000 ? 427 ARG B CB  1 
ATOM   798  C CG  . ARG B 1 22 ? 17.07000 -31.15600 19.20300  1.000 30.28000 ? 427 ARG B CG  1 
ATOM   799  C CD  . ARG B 1 22 ? 16.97600 -29.66000 19.30100  1.000 36.43000 ? 427 ARG B CD  1 
ATOM   800  N NE  . ARG B 1 22 ? 18.23500 -29.01700 19.67500  1.000 42.88000 ? 427 ARG B NE  1 
ATOM   801  C CZ  . ARG B 1 22 ? 18.40900 -28.23600 20.73100  1.000 41.08000 ? 427 ARG B CZ  1 
ATOM   802  N NH1 . ARG B 1 22 ? 17.39800 -27.98400 21.52200  1.000 39.88000 ? 427 ARG B NH1 1 
ATOM   803  N NH2 . ARG B 1 22 ? 19.59200 -27.70600 20.98000  1.000 40.90000 ? 427 ARG B NH2 1 
ATOM   804  N N   . TRP B 1 23 ? 13.86000 -31.75000 21.50600  1.000 20.22000 ? 428 TRP B N   1 
ATOM   805  C CA  . TRP B 1 23 ? 12.61700 -32.50900 21.42600  1.000 19.01000 ? 428 TRP B CA  1 
ATOM   806  C C   . TRP B 1 23 ? 12.39900 -33.10100 20.03800  1.000 17.11000 ? 428 TRP B C   1 
ATOM   807  O O   . TRP B 1 23 ? 11.84700 -34.19900 19.91000  1.000 16.55000 ? 428 TRP B O   1 
ATOM   808  C CB  . TRP B 1 23 ? 11.44400 -31.61500 21.83100  1.000 17.44000 ? 428 TRP B CB  1 
ATOM   809  C CG  . TRP B 1 23 ? 11.69000 -30.95300 23.14700  1.000 18.53000 ? 428 TRP B CG  1 
ATOM   810  C CD1 . TRP B 1 23 ? 11.94200 -29.63100 23.36100  1.000 22.08000 ? 428 TRP B CD1 1 
ATOM   811  C CD2 . TRP B 1 23 ? 11.74100 -31.58600 24.43400  1.000 18.64000 ? 428 TRP B CD2 1 
ATOM   812  N NE1 . TRP B 1 23 ? 12.14200 -29.40100 24.69900  1.000 21.47000 ? 428 TRP B NE1 1 
ATOM   813  C CE2 . TRP B 1 23 ? 12.02100 -30.58200 25.38000  1.000 19.07000 ? 428 TRP B CE2 1 
ATOM   814  C CE3 . TRP B 1 23 ? 11.58200 -32.90400 24.87500  1.000 18.44000 ? 428 TRP B CE3 1 
ATOM   815  C CZ2 . TRP B 1 23 ? 12.15000 -30.84900 26.74500  1.000 18.65000 ? 428 TRP B CZ2 1 
ATOM   816  C CZ3 . TRP B 1 23 ? 11.68900 -33.16900 26.23600  1.000 16.67000 ? 428 TRP B CZ3 1 
ATOM   817  C CH2 . TRP B 1 23 ? 11.97300 -32.14200 27.15400  1.000 19.05000 ? 428 TRP B CH2 1 
ATOM   818  N N   . SER B 1 24 ? 12.80300 -32.39000 18.98300  1.000 18.44000 ? 429 SER B N   1 
ATOM   819  C CA  . SER B 1 24 ? 12.60100 -32.93900 17.64500  1.000 17.08000 ? 429 SER B CA  1 
ATOM   820  C C   . SER B 1 24 ? 13.40400 -34.21400 17.43900  1.000 17.95000 ? 429 SER B C   1 
ATOM   821  O O   . SER B 1 24 ? 12.98300 -35.09200 16.67800  1.000 19.32000 ? 429 SER B O   1 
ATOM   822  C CB  . SER B 1 24 ? 12.96900 -31.90000 16.57900  1.000 21.05000 ? 429 SER B CB  1 
ATOM   823  O OG  . SER B 1 24 ? 14.35500 -31.58800 16.63000  1.000 22.43000 ? 429 SER B OG  1 
ATOM   824  N N   . GLN B 1 25 ? 14.55500 -34.33900 18.11100  1.000 18.74000 ? 430 GLN B N   1 
ATOM   825  C CA  . GLN B 1 25 ? 15.35700 -35.55100 17.98500  1.000 19.86000 ? 430 GLN B CA  1 
ATOM   826  C C   . GLN B 1 25 ? 14.69800 -36.74700 18.66400  1.000 17.88000 ? 430 GLN B C   1 
ATOM   827  O O   . GLN B 1 25 ? 14.85000 -37.88300 18.20000  1.000 18.03000 ? 430 GLN B O   1 
ATOM   828  C CB  . GLN B 1 25 ? 16.74700 -35.31900 18.56200  1.000 21.53000 ? 430 GLN B CB  1 
ATOM   829  C CG  . GLN B 1 25 ? 17.81100 -36.17500 17.93400  1.000 35.12000 ? 430 GLN B CG  1 
ATOM   830  C CD  . GLN B 1 25 ? 19.20000 -35.71100 18.31200  1.000 36.76000 ? 430 GLN B CD  1 
ATOM   831  O OE1 . GLN B 1 25 ? 19.54900 -34.53700 18.13000  1.000 40.89000 ? 430 GLN B OE1 1 
ATOM   832  N NE2 . GLN B 1 25 ? 19.99900 -36.62400 18.84800  1.000 38.49000 ? 430 GLN B NE2 1 
ATOM   833  N N   . ILE B 1 26 ? 13.98900 -36.52200 19.77100  1.000 16.36000 ? 431 ILE B N   1 
ATOM   834  C CA  . ILE B 1 26 ? 13.19900 -37.59500 20.36300  1.000 15.94000 ? 431 ILE B CA  1 
ATOM   835  C C   . ILE B 1 26 ? 12.11700 -38.04000 19.39300  1.000 14.69000 ? 431 ILE B C   1 
ATOM   836  O O   . ILE B 1 26 ? 11.81000 -39.23200 19.28100  1.000 15.61000 ? 431 ILE B O   1 
ATOM   837  C CB  . ILE B 1 26 ? 12.60900 -37.13600 21.70800  1.000 13.83000 ? 431 ILE B CB  1 
ATOM   838  C CG1 . ILE B 1 26 ? 13.76000 -36.90800 22.69200  1.000 16.36000 ? 431 ILE B CG1 1 
ATOM   839  C CG2 . ILE B 1 26 ? 11.61200 -38.15800 22.24500  1.000 15.21000 ? 431 ILE B CG2 1 
ATOM   840  C CD1 . ILE B 1 26 ? 13.36000 -36.25200 23.98500  1.000 18.06000 ? 431 ILE B CD1 1 
ATOM   841  N N   . LEU B 1 27 ? 11.51300 -37.08900 18.67900  1.000 14.12000 ? 432 LEU B N   1 
ATOM   842  C CA  . LEU B 1 27 ? 10.47800 -37.45800 17.72700  1.000 16.17000 ? 432 LEU B CA  1 
ATOM   843  C C   . LEU B 1 27 ? 11.06500 -38.09600 16.47100  1.000 17.95000 ? 432 LEU B C   1 
ATOM   844  O O   . LEU B 1 27 ? 10.35900 -38.83900 15.77800  1.000 17.70000 ? 432 LEU B O   1 
ATOM   845  C CB  . LEU B 1 27 ? 9.62100  -36.23100 17.39900  1.000 17.12000 ? 432 LEU B CB  1 
ATOM   846  C CG  . LEU B 1 27 ? 8.75800  -35.76900 18.59700  1.000 16.44000 ? 432 LEU B CG  1 
ATOM   847  C CD1 . LEU B 1 27 ? 8.07900  -34.43400 18.32600  1.000 20.85000 ? 432 LEU B CD1 1 
ATOM   848  C CD2 . LEU B 1 27 ? 7.70700  -36.81200 18.98000  1.000 16.28000 ? 432 LEU B CD2 1 
ATOM   849  N N   . GLU B 1 28 ? 12.34300 -37.85600 16.17400  1.000 17.98000 ? 433 GLU B N   1 
ATOM   850  C CA  . GLU B 1 28 ? 12.98100 -38.62400 15.10600  1.000 18.69000 ? 433 GLU B CA  1 
ATOM   851  C C   . GLU B 1 28 ? 13.06600 -40.09900 15.46600  1.000 20.06000 ? 433 GLU B C   1 
ATOM   852  O O   . GLU B 1 28 ? 13.02900 -40.96300 14.58100  1.000 20.25000 ? 433 GLU B O   1 
ATOM   853  C CB  . GLU B 1 28 ? 14.37000 -38.06800 14.80800  1.000 19.37000 ? 433 GLU B CB  1 
ATOM   854  C CG  . GLU B 1 28 ? 14.34900 -36.79800 14.00000  1.000 24.36000 ? 433 GLU B CG  1 
ATOM   855  C CD  . GLU B 1 28 ? 15.68700 -36.08300 14.00400  1.000 32.55000 ? 433 GLU B CD  1 
ATOM   856  O OE1 . GLU B 1 28 ? 16.70400 -36.72400 14.34700  1.000 33.85000 ? 433 GLU B OE1 1 
ATOM   857  O OE2 . GLU B 1 28 ? 15.72100 -34.87900 13.66500  1.000 35.58000 ? 433 GLU B OE2 1 
ATOM   858  N N   . LEU B 1 29 ? 13.16100 -40.40700 16.75700  1.000 17.01000 ? 434 LEU B N   1 
ATOM   859  C CA  . LEU B 1 29 ? 13.23200 -41.78700 17.21800  1.000 17.58000 ? 434 LEU B CA  1 
ATOM   860  C C   . LEU B 1 29 ? 11.85400 -42.40000 17.44300  1.000 17.80000 ? 434 LEU B C   1 
ATOM   861  O O   . LEU B 1 29 ? 11.65700 -43.59400 17.19400  1.000 18.89000 ? 434 LEU B O   1 
ATOM   862  C CB  . LEU B 1 29 ? 14.03400 -41.85700 18.51900  1.000 18.29000 ? 434 LEU B CB  1 
ATOM   863  C CG  . LEU B 1 29 ? 15.49700 -41.40800 18.45000  1.000 21.08000 ? 434 LEU B CG  1 
ATOM   864  C CD1 . LEU B 1 29 ? 16.03700 -41.19200 19.85200  1.000 21.43000 ? 434 LEU B CD1 1 
ATOM   865  C CD2 . LEU B 1 29 ? 16.33700 -42.43300 17.70300  1.000 23.05000 ? 434 LEU B CD2 1 
ATOM   866  N N   . TYR B 1 30 ? 10.89700 -41.60900 17.93600  1.000 16.01000 ? 435 TYR B N   1 
ATOM   867  C CA  . TYR B 1 30 ? 9.64800  -42.14800 18.43500  1.000 15.46000 ? 435 TYR B CA  1 
ATOM   868  C C   . TYR B 1 30 ? 8.40400  -41.46100 17.88400  1.000 15.65000 ? 435 TYR B C   1 
ATOM   869  O O   . TYR B 1 30 ? 7.29000  -41.84400 18.26700  1.000 17.66000 ? 435 TYR B O   1 
ATOM   870  C CB  . TYR B 1 30 ? 9.63500  -42.06600 19.96400  1.000 16.63000 ? 435 TYR B CB  1 
ATOM   871  C CG  . TYR B 1 30 ? 10.52000 -43.10700 20.61400  1.000 18.24000 ? 435 TYR B CG  1 
ATOM   872  C CD1 . TYR B 1 30 ? 10.22400 -44.45900 20.47900  1.000 21.65000 ? 435 TYR B CD1 1 
ATOM   873  C CD2 . TYR B 1 30 ? 11.63700 -42.74600 21.36200  1.000 19.12000 ? 435 TYR B CD2 1 
ATOM   874  C CE1 . TYR B 1 30 ? 11.01000 -45.43400 21.08200  1.000 24.11000 ? 435 TYR B CE1 1 
ATOM   875  C CE2 . TYR B 1 30 ? 12.42800 -43.71800 21.97500  1.000 23.09000 ? 435 TYR B CE2 1 
ATOM   876  C CZ  . TYR B 1 30 ? 12.10200 -45.06100 21.82800  1.000 26.33000 ? 435 TYR B CZ  1 
ATOM   877  O OH  . TYR B 1 30 ? 12.86400 -46.05300 22.41700  1.000 28.68000 ? 435 TYR B OH  1 
ATOM   878  N N   . GLY B 1 31 ? 8.55400  -40.45600 17.02100  1.000 14.82000 ? 436 GLY B N   1 
ATOM   879  C CA  . GLY B 1 31 ? 7.41700  -39.73400 16.47700  1.000 17.07000 ? 436 GLY B CA  1 
ATOM   880  C C   . GLY B 1 31 ? 6.87800  -40.36400 15.20800  1.000 16.64000 ? 436 GLY B C   1 
ATOM   881  O O   . GLY B 1 31 ? 7.06300  -41.55800 14.95500  1.000 18.54000 ? 436 GLY B O   1 
ATOM   882  N N   . PRO B 1 32 ? 6.18000  -39.57900 14.38900  1.000 18.89000 ? 437 PRO B N   1 
ATOM   883  C CA  . PRO B 1 32 ? 5.70100  -40.11300 13.10800  1.000 20.23000 ? 437 PRO B CA  1 
ATOM   884  C C   . PRO B 1 32 ? 6.88100  -40.52100 12.23600  1.000 20.94000 ? 437 PRO B C   1 
ATOM   885  O O   . PRO B 1 32 ? 7.82200  -39.74900 12.03300  1.000 21.22000 ? 437 PRO B O   1 
ATOM   886  C CB  . PRO B 1 32 ? 4.90900  -38.94600 12.50600  1.000 20.50000 ? 437 PRO B CB  1 
ATOM   887  C CG  . PRO B 1 32 ? 5.45300  -37.74300 13.14500  1.000 23.05000 ? 437 PRO B CG  1 
ATOM   888  C CD  . PRO B 1 32 ? 5.88600  -38.14300 14.53400  1.000 20.80000 ? 437 PRO B CD  1 
ATOM   889  N N   . GLY B 1 33 ? 6.84200  -41.76300 11.75300  1.000 23.51000 ? 438 GLY B N   1 
ATOM   890  C CA  . GLY B 1 33 ? 7.98000  -42.29700 11.02000  1.000 24.49000 ? 438 GLY B CA  1 
ATOM   891  C C   . GLY B 1 33 ? 9.22300  -42.45700 11.85900  1.000 24.59000 ? 438 GLY B C   1 
ATOM   892  O O   . GLY B 1 33 ? 10.33400 -42.46300 11.31900  1.000 22.57000 ? 438 GLY B O   1 
ATOM   893  N N   . GLY B 1 34 ? 9.06700  -42.58600 13.17400  1.000 20.34000 ? 439 GLY B N   1 
ATOM   894  C CA  . GLY B 1 34 ? 10.22600 -42.66700 14.04700  1.000 20.06000 ? 439 GLY B CA  1 
ATOM   895  C C   . GLY B 1 34 ? 11.06400 -43.90600 13.78800  1.000 24.38000 ? 439 GLY B C   1 
ATOM   896  O O   . GLY B 1 34 ? 10.56700 -44.96100 13.37500  1.000 24.77000 ? 439 GLY B O   1 
ATOM   897  N N   . LYS B 1 35 ? 12.36000 -43.77600 14.06900  1.000 22.28000 ? 440 LYS B N   1 
ATOM   898  C CA  . LYS B 1 35 ? 13.30400 -44.84200 13.74600  1.000 23.87000 ? 440 LYS B CA  1 
ATOM   899  C C   . LYS B 1 35 ? 13.13500 -46.05700 14.64900  1.000 22.65000 ? 440 LYS B C   1 
ATOM   900  O O   . LYS B 1 35 ? 13.37900 -47.18600 14.21000  1.000 27.66000 ? 440 LYS B O   1 
ATOM   901  C CB  . LYS B 1 35 ? 14.73200 -44.30200 13.82100  1.000 27.39000 ? 440 LYS B CB  1 
ATOM   902  C CG  . LYS B 1 35 ? 15.10100 -43.47100 12.59700  1.000 36.31000 ? 440 LYS B CG  1 
ATOM   903  C CD  . LYS B 1 35 ? 16.41100 -42.71700 12.77000  1.000 39.91000 ? 440 LYS B CD  1 
ATOM   904  C CE  . LYS B 1 35 ? 16.82900 -42.05600 11.45900  1.000 41.26000 ? 440 LYS B CE  1 
ATOM   905  N NZ  . LYS B 1 35 ? 17.11300 -43.06200 10.38500  1.000 44.46000 ? 440 LYS B NZ  1 
ATOM   906  N N   . LYS B 1 36 ? 12.74100 -45.86100 15.90600  1.000 20.77000 ? 441 LYS B N   1 
ATOM   907  C CA  . LYS B 1 36 ? 12.54600 -46.95800 16.84700  1.000 20.23000 ? 441 LYS B CA  1 
ATOM   908  C C   . LYS B 1 36 ? 11.09500 -47.40500 16.94000  1.000 23.70000 ? 441 LYS B C   1 
ATOM   909  O O   . LYS B 1 36 ? 10.81400 -48.60700 16.93400  1.000 27.10000 ? 441 LYS B O   1 
ATOM   910  C CB  . LYS B 1 36 ? 13.06600 -46.56400 18.23900  1.000 22.52000 ? 441 LYS B CB  1 
ATOM   911  C CG  . LYS B 1 36 ? 14.56700 -46.22000 18.24500  1.000 23.58000 ? 441 LYS B CG  1 
ATOM   912  C CD  . LYS B 1 36 ? 15.13300 -46.10900 19.65200  1.000 30.31000 ? 441 LYS B CD  1 
ATOM   913  C CE  . LYS B 1 36 ? 15.07000 -47.44600 20.38300  1.000 31.71000 ? 441 LYS B CE  1 
ATOM   914  N NZ  . LYS B 1 36 ? 15.85000 -47.41800 21.66200  1.000 38.40000 ? 441 LYS B NZ  1 
ATOM   915  N N   . SER B 1 37 ? 10.16100 -46.46900 17.02600  1.000 21.28000 ? 442 SER B N   1 
ATOM   916  C CA  . SER B 1 37 ? 8.73900  -46.77800 16.95400  1.000 21.80000 ? 442 SER B CA  1 
ATOM   917  C C   . SER B 1 37 ? 8.01500  -45.47600 16.66200  1.000 19.48000 ? 442 SER B C   1 
ATOM   918  O O   . SER B 1 37 ? 8.63900  -44.43800 16.44000  1.000 18.65000 ? 442 SER B O   1 
ATOM   919  C CB  . SER B 1 37 ? 8.22200  -47.44200 18.23700  1.000 20.75000 ? 442 SER B CB  1 
ATOM   920  O OG  . SER B 1 37 ? 7.98900  -46.51300 19.28900  1.000 21.81000 ? 442 SER B OG  1 
ATOM   921  N N   . GLU B 1 38 ? 6.68800  -45.54400 16.64400  1.000 18.12000 ? 443 GLU B N   1 
ATOM   922  C CA  . GLU B 1 38 ? 5.86500  -44.35100 16.48800  1.000 18.50000 ? 443 GLU B CA  1 
ATOM   923  C C   . GLU B 1 38 ? 5.02300  -44.06900 17.72200  1.000 15.57000 ? 443 GLU B C   1 
ATOM   924  O O   . GLU B 1 38 ? 4.02100  -43.35400 17.62800  1.000 16.48000 ? 443 GLU B O   1 
ATOM   925  C CB  . GLU B 1 38 ? 4.96100  -44.48700 15.26600  1.000 20.65000 ? 443 GLU B CB  1 
ATOM   926  C CG  . GLU B 1 38 ? 5.70700  -44.62300 13.96400  1.000 21.76000 ? 443 GLU B CG  1 
ATOM   927  C CD  . GLU B 1 38 ? 4.76300  -44.57200 12.80000  1.000 27.96000 ? 443 GLU B CD  1 
ATOM   928  O OE1 . GLU B 1 38 ? 3.94900  -45.51700 12.66600  1.000 29.00000 ? 443 GLU B OE1 1 
ATOM   929  O OE2 . GLU B 1 38 ? 4.81000  -43.58000 12.04400  1.000 29.47000 ? 443 GLU B OE2 1 
ATOM   930  N N   . VAL B 1 39 ? 5.41100  -44.60600 18.88000  1.000 18.29000 ? 444 VAL B N   1 
ATOM   931  C CA  . VAL B 1 39 ? 4.54200  -44.54500 20.05000  1.000 18.13000 ? 444 VAL B CA  1 
ATOM   932  C C   . VAL B 1 39 ? 4.28300  -43.10800 20.49300  1.000 16.38000 ? 444 VAL B C   1 
ATOM   933  O O   . VAL B 1 39 ? 3.25800  -42.82700 21.11900  1.000 17.24000 ? 444 VAL B O   1 
ATOM   934  C CB  . VAL B 1 39 ? 5.13100  -45.40100 21.18800  1.000 22.62000 ? 444 VAL B CB  1 
ATOM   935  C CG1 . VAL B 1 39 ? 6.40800  -44.79800 21.69200  1.000 23.16000 ? 444 VAL B CG1 1 
ATOM   936  C CG2 . VAL B 1 39 ? 4.12800  -45.56100 22.32500  1.000 28.23000 ? 444 VAL B CG2 1 
ATOM   937  N N   . LEU B 1 40 ? 5.18900  -42.17500 20.18400  1.000 16.50000 ? 445 LEU B N   1 
ATOM   938  C CA  . LEU B 1 40 ? 5.00500  -40.78300 20.58900  1.000 13.00000 ? 445 LEU B CA  1 
ATOM   939  C C   . LEU B 1 40 ? 4.47500  -39.91100 19.45400  1.000 14.43000 ? 445 LEU B C   1 
ATOM   940  O O   . LEU B 1 40 ? 4.54100  -38.68100 19.54900  1.000 12.86000 ? 445 LEU B O   1 
ATOM   941  C CB  . LEU B 1 40 ? 6.32300  -40.19300 21.12200  1.000 12.65000 ? 445 LEU B CB  1 
ATOM   942  C CG  . LEU B 1 40 ? 6.83600  -40.79600 22.43600  1.000 13.75000 ? 445 LEU B CG  1 
ATOM   943  C CD1 . LEU B 1 40 ? 8.16700  -40.12500 22.82300  1.000 16.19000 ? 445 LEU B CD1 1 
ATOM   944  C CD2 . LEU B 1 40 ? 5.79000  -40.65000 23.54400  1.000 16.02000 ? 445 LEU B CD2 1 
ATOM   945  N N   . LYS B 1 41 ? 3.94100  -40.51200 18.38300  1.000 13.02000 ? 446 LYS B N   1 
ATOM   946  C CA  . LYS B 1 41 ? 3.66900  -39.70500 17.19500  1.000 14.38000 ? 446 LYS B CA  1 
ATOM   947  C C   . LYS B 1 41 ? 2.61500  -38.62400 17.43700  1.000 13.95000 ? 446 LYS B C   1 
ATOM   948  O O   . LYS B 1 41 ? 2.64400  -37.58900 16.76000  1.000 14.56000 ? 446 LYS B O   1 
ATOM   949  C CB  . LYS B 1 41 ? 3.25800  -40.58900 16.00900  1.000 13.65000 ? 446 LYS B CB  1 
ATOM   950  C CG  . LYS B 1 41 ? 1.85400  -41.17700 16.04500  1.000 12.84000 ? 446 LYS B CG  1 
ATOM   951  C CD  . LYS B 1 41 ? 1.72800  -42.11200 14.83900  1.000 14.39000 ? 446 LYS B CD  1 
ATOM   952  C CE  . LYS B 1 41 ? 0.30700  -42.60200 14.60300  1.000 17.15000 ? 446 LYS B CE  1 
ATOM   953  N NZ  . LYS B 1 41 ? 0.35800  -43.53200 13.41200  1.000 15.99000 ? 446 LYS B NZ  1 
ATOM   954  N N   . TYR B 1 42 ? 1.68800  -38.82200 18.38500  1.000 13.68000 ? 447 TYR B N   1 
ATOM   955  C CA  . TYR B 1 42 ? 0.67200  -37.79500 18.61300  1.000 13.88000 ? 447 TYR B CA  1 
ATOM   956  C C   . TYR B 1 42 ? 1.13600  -36.69800 19.55600  1.000 15.57000 ? 447 TYR B C   1 
ATOM   957  O O   . TYR B 1 42 ? 0.41200  -35.71300 19.73300  1.000 14.84000 ? 447 TYR B O   1 
ATOM   958  C CB  . TYR B 1 42 ? -0.61800 -38.39800 19.17800  1.000 14.77000 ? 447 TYR B CB  1 
ATOM   959  C CG  . TYR B 1 42 ? -1.23900 -39.42200 18.26100  1.000 17.47000 ? 447 TYR B CG  1 
ATOM   960  C CD1 . TYR B 1 42 ? -1.98300 -39.03300 17.14600  1.000 17.12000 ? 447 TYR B CD1 1 
ATOM   961  C CD2 . TYR B 1 42 ? -1.07700 -40.78000 18.50900  1.000 15.22000 ? 447 TYR B CD2 1 
ATOM   962  C CE1 . TYR B 1 42 ? -2.55600 -39.98600 16.30700  1.000 16.45000 ? 447 TYR B CE1 1 
ATOM   963  C CE2 . TYR B 1 42 ? -1.63500 -41.73500 17.67900  1.000 15.88000 ? 447 TYR B CE2 1 
ATOM   964  C CZ  . TYR B 1 42 ? -2.37000 -41.33600 16.57900  1.000 16.63000 ? 447 TYR B CZ  1 
ATOM   965  O OH  . TYR B 1 42 ? -2.94200 -42.30900 15.77200  1.000 18.22000 ? 447 TYR B OH  1 
ATOM   966  N N   . ARG B 1 43 ? 2.32000  -36.82500 20.14400  1.000 14.04000 ? 448 ARG B N   1 
ATOM   967  C CA  . ARG B 1 43 ? 2.79300  -35.82400 21.09200  1.000 13.17000 ? 448 ARG B CA  1 
ATOM   968  C C   . ARG B 1 43 ? 3.62300  -34.79000 20.34600  1.000 15.43000 ? 448 ARG B C   1 
ATOM   969  O O   . ARG B 1 43 ? 4.61100  -35.14100 19.69900  1.000 16.57000 ? 448 ARG B O   1 
ATOM   970  C CB  . ARG B 1 43 ? 3.62100  -36.48500 22.19400  1.000 14.49000 ? 448 ARG B CB  1 
ATOM   971  C CG  . ARG B 1 43 ? 2.89600  -37.61300 22.91900  1.000 13.93000 ? 448 ARG B CG  1 
ATOM   972  C CD  . ARG B 1 43 ? 1.72400  -37.09100 23.75300  1.000 17.38000 ? 448 ARG B CD  1 
ATOM   973  N NE  . ARG B 1 43 ? 1.01000  -38.18300 24.41800  1.000 17.25000 ? 448 ARG B NE  1 
ATOM   974  C CZ  . ARG B 1 43 ? -0.03900 -38.00600 25.22400  1.000 21.04000 ? 448 ARG B CZ  1 
ATOM   975  N NH1 . ARG B 1 43 ? -0.48100 -36.78300 25.48800  1.000 19.99000 ? 448 ARG B NH1 1 
ATOM   976  N NH2 . ARG B 1 43 ? -0.63900 -39.05400 25.77800  1.000 23.44000 ? 448 ARG B NH2 1 
ATOM   977  N N   . ASN B 1 44 ? 3.24000  -33.52100 20.44200  1.000 12.36000 ? 449 ASN B N   1 
ATOM   978  C CA  . ASN B 1 44 ? 4.08800  -32.49700 19.84900  1.000 15.63000 ? 449 ASN B CA  1 
ATOM   979  C C   . ASN B 1 44 ? 5.20100  -32.12600 20.83400  1.000 15.27000 ? 449 ASN B C   1 
ATOM   980  O O   . ASN B 1 44 ? 5.27000  -32.63400 21.95800  1.000 12.85000 ? 449 ASN B O   1 
ATOM   981  C CB  . ASN B 1 44 ? 3.25600  -31.29400 19.37400  1.000 15.99000 ? 449 ASN B CB  1 
ATOM   982  C CG  . ASN B 1 44 ? 2.53200  -30.56100 20.50100  1.000 16.64000 ? 449 ASN B CG  1 
ATOM   983  O OD1 . ASN B 1 44 ? 3.03100  -30.44900 21.61400  1.000 15.22000 ? 449 ASN B OD1 1 
ATOM   984  N ND2 . ASN B 1 44 ? 1.34100  -30.02800 20.19100  1.000 15.70000 ? 449 ASN B ND2 1 
ATOM   985  N N   . GLN B 1 45 ? 6.11700  -31.25900 20.39100  1.000 15.29000 ? 450 GLN B N   1 
ATOM   986  C CA  . GLN B 1 45 ? 7.30500  -30.97500 21.19200  1.000 16.45000 ? 450 GLN B CA  1 
ATOM   987  C C   . GLN B 1 45 ? 6.94900  -30.30900 22.51100  1.000 14.99000 ? 450 GLN B C   1 
ATOM   988  O O   . GLN B 1 45 ? 7.62300  -30.53700 23.52300  1.000 17.61000 ? 450 GLN B O   1 
ATOM   989  C CB  . GLN B 1 45 ? 8.28900  -30.10600 20.39400  1.000 15.09000 ? 450 GLN B CB  1 
ATOM   990  C CG  . GLN B 1 45 ? 8.67300  -30.73100 19.05300  1.000 16.13000 ? 450 GLN B CG  1 
ATOM   991  C CD  . GLN B 1 45 ? 9.64400  -29.87900 18.23900  1.000 20.77000 ? 450 GLN B CD  1 
ATOM   992  O OE1 . GLN B 1 45 ? 10.37600 -29.07600 18.79300  1.000 21.71000 ? 450 GLN B OE1 1 
ATOM   993  N NE2 . GLN B 1 45 ? 9.65900  -30.07600 16.92500  1.000 19.01000 ? 450 GLN B NE2 1 
ATOM   994  N N   . VAL B 1 46 ? 5.89400  -29.49300 22.52600  1.000 15.10000 ? 451 VAL B N   1 
ATOM   995  C CA  . VAL B 1 46 ? 5.45500  -28.86300 23.76500  1.000 14.90000 ? 451 VAL B CA  1 
ATOM   996  C C   . VAL B 1 46 ? 4.91000  -29.90500 24.73800  1.000 18.01000 ? 451 VAL B C   1 
ATOM   997  O O   . VAL B 1 46 ? 5.18200  -29.85200 25.94100  1.000 14.70000 ? 451 VAL B O   1 
ATOM   998  C CB  . VAL B 1 46 ? 4.42600  -27.76000 23.44700  1.000 15.22000 ? 451 VAL B CB  1 
ATOM   999  C CG1 . VAL B 1 46 ? 3.79500  -27.20700 24.73300  1.000 17.53000 ? 451 VAL B CG1 1 
ATOM   1000 C CG2 . VAL B 1 46 ? 5.09900  -26.63400 22.65600  1.000 19.42000 ? 451 VAL B CG2 1 
ATOM   1001 N N   . GLN B 1 47 ? 4.15700  -30.88600 24.23600  1.000 13.02000 ? 452 GLN B N   1 
ATOM   1002 C CA  . GLN B 1 47 ? 3.69800  -31.95900 25.10800  1.000 13.19000 ? 452 GLN B CA  1 
ATOM   1003 C C   . GLN B 1 47 ? 4.85900  -32.76200 25.67500  1.000 14.70000 ? 452 GLN B C   1 
ATOM   1004 O O   . GLN B 1 47 ? 4.80300  -33.21300 26.82600  1.000 14.57000 ? 452 GLN B O   1 
ATOM   1005 C CB  . GLN B 1 47 ? 2.75400  -32.88700 24.34400  1.000 12.99000 ? 452 GLN B CB  1 
ATOM   1006 C CG  . GLN B 1 47 ? 1.38400  -32.24800 24.13600  1.000 11.25000 ? 452 GLN B CG  1 
ATOM   1007 C CD  . GLN B 1 47 ? 0.49800  -33.09900 23.26100  1.000 13.95000 ? 452 GLN B CD  1 
ATOM   1008 O OE1 . GLN B 1 47 ? 0.78400  -33.29400 22.07800  1.000 13.77000 ? 452 GLN B OE1 1 
ATOM   1009 N NE2 . GLN B 1 47 ? -0.58900 -33.59900 23.82900  1.000 15.77000 ? 452 GLN B NE2 1 
ATOM   1010 N N   . LEU B 1 48 ? 5.89500  -33.00500 24.85900  1.000 13.02000 ? 453 LEU B N   1 
ATOM   1011 C CA  . LEU B 1 48 ? 7.07000  -33.72900 25.34700  1.000 15.44000 ? 453 LEU B CA  1 
ATOM   1012 C C   . LEU B 1 48 ? 7.74600  -32.95900 26.47100  1.000 15.59000 ? 453 LEU B C   1 
ATOM   1013 O O   . LEU B 1 48 ? 8.09300  -33.53100 27.51200  1.000 17.65000 ? 453 LEU B O   1 
ATOM   1014 C CB  . LEU B 1 48 ? 8.06200  -33.97300 24.20300  1.000 12.76000 ? 453 LEU B CB  1 
ATOM   1015 C CG  . LEU B 1 48 ? 7.65500  -34.95500 23.09800  1.000 14.12000 ? 453 LEU B CG  1 
ATOM   1016 C CD1 . LEU B 1 48 ? 8.88500  -35.29100 22.25400  1.000 15.99000 ? 453 LEU B CD1 1 
ATOM   1017 C CD2 . LEU B 1 48 ? 7.03700  -36.21000 23.66000  1.000 15.47000 ? 453 LEU B CD2 1 
ATOM   1018 N N   . LYS B 1 49 ? 7.92000  -31.65400 26.27700  1.000 14.44000 ? 454 LYS B N   1 
ATOM   1019 C CA  . LYS B 1 49 ? 8.54100  -30.80700 27.29000  1.000 16.44000 ? 454 LYS B CA  1 
ATOM   1020 C C   . LYS B 1 49 ? 7.71900  -30.77700 28.57600  1.000 19.82000 ? 454 LYS B C   1 
ATOM   1021 O O   . LYS B 1 49 ? 8.25800  -30.94300 29.68000  1.000 17.64000 ? 454 LYS B O   1 
ATOM   1022 C CB  . LYS B 1 49 ? 8.72400  -29.40000 26.73100  1.000 19.71000 ? 454 LYS B CB  1 
ATOM   1023 C CG  . LYS B 1 49 ? 9.53300  -28.47500 27.65100  1.000 23.35000 ? 454 LYS B CG  1 
ATOM   1024 C CD  . LYS B 1 49 ? 9.58800  -27.07100 27.06900  1.000 27.26000 ? 454 LYS B CD  1 
ATOM   1025 C CE  . LYS B 1 49 ? 10.68600 -26.23200 27.71700  1.000 38.45000 ? 454 LYS B CE  1 
ATOM   1026 N NZ  . LYS B 1 49 ? 10.76500 -24.85500 27.13300  1.000 44.73000 ? 454 LYS B NZ  1 
ATOM   1027 N N   . ASP B 1 50 ? 6.40300  -30.58200 28.45400  1.000 17.87000 ? 455 ASP B N   1 
ATOM   1028 C CA  . ASP B 1 50 ? 5.56500  -30.53000 29.64700  1.000 19.69000 ? 455 ASP B CA  1 
ATOM   1029 C C   . ASP B 1 50 ? 5.56200  -31.86500 30.38800  1.000 20.31000 ? 455 ASP B C   1 
ATOM   1030 O O   . ASP B 1 50 ? 5.57900  -31.89700 31.62700  1.000 21.41000 ? 455 ASP B O   1 
ATOM   1031 C CB  . ASP B 1 50 ? 4.14200  -30.09400 29.26400  1.000 19.53000 ? 455 ASP B CB  1 
ATOM   1032 C CG  . ASP B 1 50 ? 4.07500  -28.63500 28.76400  1.000 25.85000 ? 455 ASP B CG  1 
ATOM   1033 O OD1 . ASP B 1 50 ? 5.05400  -27.87300 28.95500  1.000 28.25000 ? 455 ASP B OD1 1 
ATOM   1034 O OD2 . ASP B 1 50 ? 3.03000  -28.24000 28.18400  1.000 24.41000 ? 455 ASP B OD2 1 
ATOM   1035 N N   . LYS B 1 51 ? 5.56400  -32.98500 29.65800  1.000 17.19000 ? 456 LYS B N   1 
ATOM   1036 C CA  . LYS B 1 51 ? 5.59800  -34.28200 30.32300  1.000 16.66000 ? 456 LYS B CA  1 
ATOM   1037 C C   . LYS B 1 51 ? 6.95100  -34.53400 30.98000  1.000 19.60000 ? 456 LYS B C   1 
ATOM   1038 O O   . LYS B 1 51 ? 7.01600  -35.08000 32.08800  1.000 19.16000 ? 456 LYS B O   1 
ATOM   1039 C CB  . LYS B 1 51 ? 5.27100  -35.40100 29.33600  1.000 18.70000 ? 456 LYS B CB  1 
ATOM   1040 C CG  . LYS B 1 51 ? 5.35700  -36.79800 29.92200  1.000 18.07000 ? 456 LYS B CG  1 
ATOM   1041 C CD  . LYS B 1 51 ? 4.33300  -37.02900 31.05200  1.000 19.81000 ? 456 LYS B CD  1 
ATOM   1042 C CE  . LYS B 1 51 ? 4.29000  -38.49200 31.45200  1.000 23.45000 ? 456 LYS B CE  1 
ATOM   1043 N NZ  . LYS B 1 51 ? 3.40300  -38.73500 32.63600  1.000 24.29000 ? 456 LYS B NZ  1 
ATOM   1044 N N   . ALA B 1 52 ? 8.04100  -34.14400 30.31300  1.000 17.10000 ? 457 ALA B N   1 
ATOM   1045 C CA  . ALA B 1 52 ? 9.36100  -34.31500 30.91500  1.000 17.36000 ? 457 ALA B CA  1 
ATOM   1046 C C   . ALA B 1 52 ? 9.47100  -33.53000 32.21900  1.000 20.07000 ? 457 ALA B C   1 
ATOM   1047 O O   . ALA B 1 52 ? 10.05900 -34.01100 33.20100  1.000 21.97000 ? 457 ALA B O   1 
ATOM   1048 C CB  . ALA B 1 52 ? 10.44700 -33.87500 29.92900  1.000 19.44000 ? 457 ALA B CB  1 
ATOM   1049 N N   . ARG B 1 53 ? 8.91600  -32.32100 32.24200  1.000 21.28000 ? 458 ARG B N   1 
ATOM   1050 C CA  . ARG B 1 53 ? 8.89500  -31.53600 33.47200  1.000 25.29000 ? 458 ARG B CA  1 
ATOM   1051 C C   . ARG B 1 53 ? 8.10700  -32.25000 34.55900  1.000 26.57000 ? 458 ARG B C   1 
ATOM   1052 O O   . ARG B 1 53 ? 8.55100  -32.34000 35.71000  1.000 25.79000 ? 458 ARG B O   1 
ATOM   1053 C CB  . ARG B 1 53 ? 8.30700  -30.15600 33.20200  1.000 22.61000 ? 458 ARG B CB  1 
ATOM   1054 C CG  . ARG B 1 53 ? 9.17400  -29.28600 32.34800  1.000 27.60000 ? 458 ARG B CG  1 
ATOM   1055 C CD  . ARG B 1 53 ? 8.46600  -27.99900 32.01700  1.000 35.04000 ? 458 ARG B CD  1 
ATOM   1056 N NE  . ARG B 1 53 ? 9.41800  -26.94300 31.69700  1.000 42.25000 ? 458 ARG B NE  1 
ATOM   1057 C CZ  . ARG B 1 53 ? 9.16500  -25.93900 30.86600  1.000 42.53000 ? 458 ARG B CZ  1 
ATOM   1058 N NH1 . ARG B 1 53 ? 10.09100 -25.01700 30.63900  1.000 45.88000 ? 458 ARG B NH1 1 
ATOM   1059 N NH2 . ARG B 1 53 ? 7.98600  -25.86100 30.26000  1.000 47.62000 ? 458 ARG B NH2 1 
ATOM   1060 N N   . ASN B 1 54 ? 6.92300  -32.76600 34.21700  1.000 23.36000 ? 459 ASN B N   1 
ATOM   1061 C CA  . ASN B 1 54 ? 6.15100  -33.49600 35.21400  1.000 24.54000 ? 459 ASN B CA  1 
ATOM   1062 C C   . ASN B 1 54 ? 6.87300  -34.75600 35.67300  1.000 25.49000 ? 459 ASN B C   1 
ATOM   1063 O O   . ASN B 1 54 ? 6.75800  -35.14800 36.84300  1.000 27.76000 ? 459 ASN B O   1 
ATOM   1064 C CB  . ASN B 1 54 ? 4.76200  -33.82200 34.65900  1.000 23.88000 ? 459 ASN B CB  1 
ATOM   1065 C CG  . ASN B 1 54 ? 3.75800  -32.72900 34.95900  1.000 40.02000 ? 459 ASN B CG  1 
ATOM   1066 O OD1 . ASN B 1 54 ? 3.90600  -31.58900 34.50300  1.000 39.44000 ? 459 ASN B OD1 1 
ATOM   1067 N ND2 . ASN B 1 54 ? 2.73600  -33.06200 35.74700  1.000 45.28000 ? 459 ASN B ND2 1 
ATOM   1068 N N   . MET B 1 55 ? 7.65300  -35.38800 34.79300  1.000 22.42000 ? 460 MET B N   1 
ATOM   1069 C CA  . MET B 1 55 ? 8.37300  -36.58500 35.20100  1.000 20.75000 ? 460 MET B CA  1 
ATOM   1070 C C   . MET B 1 55 ? 9.51500  -36.22900 36.14700  1.000 26.10000 ? 460 MET B C   1 
ATOM   1071 O O   . MET B 1 55 ? 9.72000  -36.91000 37.16200  1.000 27.42000 ? 460 MET B O   1 
ATOM   1072 C CB  . MET B 1 55 ? 8.88600  -37.33200 33.97000  1.000 22.99000 ? 460 MET B CB  1 
ATOM   1073 C CG  . MET B 1 55 ? 7.76700  -37.92800 33.09800  1.000 23.31000 ? 460 MET B CG  1 
ATOM   1074 S SD  . MET B 1 55 ? 8.40500  -39.21300 32.03000  1.000 34.46000 ? 460 MET B SD  1 
ATOM   1075 C CE  . MET B 1 55 ? 9.29900  -38.18300 30.92300  1.000 36.15000 ? 460 MET B CE  1 
ATOM   1076 N N   . LYS B 1 56 ? 10.24700 -35.14800 35.84500  1.000 22.05000 ? 461 LYS B N   1 
ATOM   1077 C CA  . LYS B 1 56 ? 11.27000 -34.66700 36.77400  1.000 26.82000 ? 461 LYS B CA  1 
ATOM   1078 C C   . LYS B 1 56 ? 10.65900 -34.33300 38.12800  1.000 25.66000 ? 461 LYS B C   1 
ATOM   1079 O O   . LYS B 1 56 ? 11.15500 -34.77700 39.17300  1.000 26.37000 ? 461 LYS B O   1 
ATOM   1080 C CB  . LYS B 1 56 ? 11.99000 -33.43900 36.21000  1.000 23.88000 ? 461 LYS B CB  1 
ATOM   1081 C CG  . LYS B 1 56 ? 13.22900 -33.05000 37.05400  1.000 24.03000 ? 461 LYS B CG  1 
ATOM   1082 C CD  . LYS B 1 56 ? 13.75800 -31.69100 36.66400  1.000 25.44000 ? 461 LYS B CD  1 
ATOM   1083 C CE  . LYS B 1 56 ? 15.09500 -31.41000 37.34400  1.000 27.54000 ? 461 LYS B CE  1 
ATOM   1084 N NZ  . LYS B 1 56 ? 15.63900 -30.08700 36.92800  1.000 27.64000 ? 461 LYS B NZ  1 
ATOM   1085 N N   . LEU B 1 57 ? 9.57300  -33.55100 38.12400  1.000 24.44000 ? 462 LEU B N   1 
ATOM   1086 C CA  . LEU B 1 57 ? 8.89400  -33.20300 39.36700  1.000 27.58000 ? 462 LEU B CA  1 
ATOM   1087 C C   . LEU B 1 57 ? 8.53700  -34.44900 40.16700  1.000 28.80000 ? 462 LEU B C   1 
ATOM   1088 O O   . LEU B 1 57 ? 8.70300  -34.47200 41.39200  1.000 29.09000 ? 462 LEU B O   1 
ATOM   1089 C CB  . LEU B 1 57 ? 7.64200  -32.37300 39.07200  1.000 30.99000 ? 462 LEU B CB  1 
ATOM   1090 C CG  . LEU B 1 57 ? 6.83000  -31.86500 40.27200  1.000 33.49000 ? 462 LEU B CG  1 
ATOM   1091 C CD1 . LEU B 1 57 ? 7.75000  -31.21000 41.31000  1.000 28.38000 ? 462 LEU B CD1 1 
ATOM   1092 C CD2 . LEU B 1 57 ? 5.75300  -30.89100 39.81500  1.000 34.33000 ? 462 LEU B CD2 1 
ATOM   1093 N N   . PHE B 1 58 ? 8.07500  -35.50800 39.49300  1.000 28.93000 ? 463 PHE B N   1 
ATOM   1094 C CA  . PHE B 1 58 ? 7.68900  -36.72200 40.21000  1.000 29.53000 ? 463 PHE B CA  1 
ATOM   1095 C C   . PHE B 1 58 ? 8.84600  -37.28200 41.02400  1.000 34.13000 ? 463 PHE B C   1 
ATOM   1096 O O   . PHE B 1 58 ? 8.66700  -37.68800 42.17700  1.000 31.11000 ? 463 PHE B O   1 
ATOM   1097 C CB  . PHE B 1 58 ? 7.17500  -37.79200 39.25000  1.000 32.83000 ? 463 PHE B CB  1 
ATOM   1098 C CG  . PHE B 1 58 ? 7.07800  -39.15000 39.88500  1.000 37.96000 ? 463 PHE B CG  1 
ATOM   1099 C CD1 . PHE B 1 58 ? 6.01000  -39.46300 40.71200  1.000 39.84000 ? 463 PHE B CD1 1 
ATOM   1100 C CD2 . PHE B 1 58 ? 8.07100  -40.09900 39.69000  1.000 36.87000 ? 463 PHE B CD2 1 
ATOM   1101 C CE1 . PHE B 1 58 ? 5.92200  -40.70200 41.31700  1.000 39.33000 ? 463 PHE B CE1 1 
ATOM   1102 C CE2 . PHE B 1 58 ? 7.99000  -41.33900 40.29300  1.000 41.06000 ? 463 PHE B CE2 1 
ATOM   1103 C CZ  . PHE B 1 58 ? 6.91100  -41.64200 41.10500  1.000 39.33000 ? 463 PHE B CZ  1 
ATOM   1104 N N   . PHE B 1 59 ? 10.04000 -37.34500 40.42900  1.000 30.39000 ? 464 PHE B N   1 
ATOM   1105 C CA  . PHE B 1 59 ? 11.18700 -37.87700 41.15800  1.000 30.95000 ? 464 PHE B CA  1 
ATOM   1106 C C   . PHE B 1 59 ? 11.55500 -36.98000 42.33600  1.000 30.36000 ? 464 PHE B C   1 
ATOM   1107 O O   . PHE B 1 59 ? 11.81900 -37.47100 43.44200  1.000 31.98000 ? 464 PHE B O   1 
ATOM   1108 C CB  . PHE B 1 59 ? 12.37800 -38.04100 40.21500  1.000 33.25000 ? 464 PHE B CB  1 
ATOM   1109 C CG  . PHE B 1 59 ? 12.19900 -39.13600 39.20200  1.000 34.88000 ? 464 PHE B CG  1 
ATOM   1110 C CD1 . PHE B 1 59 ? 12.29800 -40.46500 39.57400  1.000 36.80000 ? 464 PHE B CD1 1 
ATOM   1111 C CD2 . PHE B 1 59 ? 11.93400 -38.83300 37.87500  1.000 35.73000 ? 464 PHE B CD2 1 
ATOM   1112 C CE1 . PHE B 1 59 ? 12.13500 -41.48000 38.63700  1.000 36.28000 ? 464 PHE B CE1 1 
ATOM   1113 C CE2 . PHE B 1 59 ? 11.76400 -39.83900 36.93400  1.000 33.50000 ? 464 PHE B CE2 1 
ATOM   1114 C CZ  . PHE B 1 59 ? 11.86800 -41.16300 37.31600  1.000 37.92000 ? 464 PHE B CZ  1 
ATOM   1115 N N   . LEU B 1 60 ? 11.56100 -35.66500 42.11400  1.000 25.83000 ? 465 LEU B N   1 
ATOM   1116 C CA  . LEU B 1 60 ? 11.85100 -34.71200 43.18200  1.000 26.26000 ? 465 LEU B CA  1 
ATOM   1117 C C   . LEU B 1 60 ? 10.81500 -34.79700 44.29200  1.000 30.84000 ? 465 LEU B C   1 
ATOM   1118 O O   . LEU B 1 60 ? 11.15900 -34.84700 45.47800  1.000 26.03000 ? 465 LEU B O   1 
ATOM   1119 C CB  . LEU B 1 60 ? 11.89100 -33.29900 42.61100  1.000 24.45000 ? 465 LEU B CB  1 
ATOM   1120 C CG  . LEU B 1 60 ? 13.01800 -33.04500 41.61900  1.000 23.91000 ? 465 LEU B CG  1 
ATOM   1121 C CD1 . LEU B 1 60 ? 12.88400 -31.67300 40.99700  1.000 22.26000 ? 465 LEU B CD1 1 
ATOM   1122 C CD2 . LEU B 1 60 ? 14.36500 -33.19900 42.33600  1.000 23.94000 ? 465 LEU B CD2 1 
ATOM   1123 N N   . LYS B 1 61 ? 9.53400  -34.79500 43.91500  1.000 26.61000 ? 466 LYS B N   1 
ATOM   1124 C CA  . LYS B 1 61 ? 8.44700  -34.84500 44.89100  1.000 31.13000 ? 466 LYS B CA  1 
ATOM   1125 C C   . LYS B 1 61 ? 8.52700  -36.09500 45.75200  1.000 30.27000 ? 466 LYS B C   1 
ATOM   1126 O O   . LYS B 1 61 ? 8.26900  -36.04700 46.96200  1.000 32.35000 ? 466 LYS B O   1 
ATOM   1127 C CB  . LYS B 1 61 ? 7.10700  -34.79200 44.15300  1.000 32.43000 ? 466 LYS B CB  1 
ATOM   1128 C CG  . LYS B 1 61 ? 5.91300  -34.45100 44.99800  1.000 40.63000 ? 466 LYS B CG  1 
ATOM   1129 C CD  . LYS B 1 61 ? 4.63500  -34.82300 44.25200  1.000 43.85000 ? 466 LYS B CD  1 
ATOM   1130 C CE  . LYS B 1 61 ? 4.35300  -33.85500 43.11000  1.000 45.34000 ? 466 LYS B CE  1 
ATOM   1131 N NZ  . LYS B 1 61 ? 3.58100  -32.66200 43.56900  1.000 50.53000 ? 466 LYS B NZ  1 
ATOM   1132 N N   . SER B 1 62 ? 8.87400  -37.22400 45.15200  1.000 30.64000 ? 467 SER B N   1 
ATOM   1133 C CA  . SER B 1 62 ? 8.92100  -38.48800 45.87000  1.000 36.29000 ? 467 SER B CA  1 
ATOM   1134 C C   . SER B 1 62 ? 10.26300 -38.73500 46.54600  1.000 34.75000 ? 467 SER B C   1 
ATOM   1135 O O   . SER B 1 62 ? 10.45300 -39.80100 47.14000  1.000 37.33000 ? 467 SER B O   1 
ATOM   1136 C CB  . SER B 1 62 ? 8.59500  -39.64500 44.91800  1.000 37.81000 ? 467 SER B CB  1 
ATOM   1137 O OG  . SER B 1 62 ? 9.48700  -39.67000 43.81400  1.000 38.28000 ? 467 SER B OG  1 
ATOM   1138 N N   . GLY B 1 63 ? 11.19300 -37.78600 46.47300  1.000 32.02000 ? 468 GLY B N   1 
ATOM   1139 C CA  . GLY B 1 63 ? 12.49000 -37.98200 47.08900  1.000 33.45000 ? 468 GLY B CA  1 
ATOM   1140 C C   . GLY B 1 63 ? 13.37600 -38.99700 46.40300  1.000 35.38000 ? 468 GLY B C   1 
ATOM   1141 O O   . GLY B 1 63 ? 14.27500 -39.55000 47.04100  1.000 36.91000 ? 468 GLY B O   1 
ATOM   1142 N N   . GLN B 1 64 ? 13.15500 -39.25900 45.11900  1.000 35.18000 ? 469 GLN B N   1 
ATOM   1143 C CA  . GLN B 1 64 ? 13.95000 -40.22100 44.37300  1.000 35.75000 ? 469 GLN B CA  1 
ATOM   1144 C C   . GLN B 1 64 ? 15.05200 -39.51400 43.59000  1.000 34.51000 ? 469 GLN B C   1 
ATOM   1145 O O   . GLN B 1 64 ? 15.02400 -38.29800 43.38700  1.000 31.87000 ? 469 GLN B O   1 
ATOM   1146 C CB  . GLN B 1 64 ? 13.07000 -41.03300 43.41900  1.000 36.26000 ? 469 GLN B CB  1 
ATOM   1147 C CG  . GLN B 1 64 ? 11.93500 -41.79700 44.08600  1.000 42.05000 ? 469 GLN B CG  1 
ATOM   1148 C CD  . GLN B 1 64 ? 11.19100 -42.70500 43.11400  1.000 47.87000 ? 469 GLN B CD  1 
ATOM   1149 O OE1 . GLN B 1 64 ? 11.73300 -43.70600 42.64200  1.000 53.57000 ? 469 GLN B OE1 1 
ATOM   1150 N NE2 . GLN B 1 64 ? 9.94400  -42.35800 42.81200  1.000 46.43000 ? 469 GLN B NE2 1 
ATOM   1151 N N   . VAL B 1 65 ? 16.03600 -40.30300 43.15500  1.000 33.15000 ? 470 VAL B N   1 
ATOM   1152 C CA  . VAL B 1 65 ? 17.10400 -39.78800 42.30700  1.000 32.67000 ? 470 VAL B CA  1 
ATOM   1153 C C   . VAL B 1 65 ? 16.52300 -39.37000 40.96300  1.000 34.73000 ? 470 VAL B C   1 
ATOM   1154 O O   . VAL B 1 65 ? 15.71200 -40.09100 40.36800  1.000 32.86000 ? 470 VAL B O   1 
ATOM   1155 C CB  . VAL B 1 65 ? 18.20100 -40.84800 42.13000  1.000 35.53000 ? 470 VAL B CB  1 
ATOM   1156 C CG1 . VAL B 1 65 ? 19.21300 -40.40600 41.07900  1.000 37.76000 ? 470 VAL B CG1 1 
ATOM   1157 C CG2 . VAL B 1 65 ? 18.88700 -41.12900 43.45500  1.000 39.16000 ? 470 VAL B CG2 1 
ATOM   1158 N N   . VAL B 1 66 ? 16.92300 -38.19700 40.48300  1.000 29.24000 ? 471 VAL B N   1 
ATOM   1159 C CA  . VAL B 1 66 ? 16.49600 -37.73200 39.16700  1.000 28.36000 ? 471 VAL B CA  1 
ATOM   1160 C C   . VAL B 1 66 ? 17.37900 -38.39100 38.11500  1.000 31.64000 ? 471 VAL B C   1 
ATOM   1161 O O   . VAL B 1 66 ? 18.60500 -38.21400 38.14800  1.000 32.78000 ? 471 VAL B O   1 
ATOM   1162 C CB  . VAL B 1 66 ? 16.57200 -36.20400 39.05700  1.000 28.47000 ? 471 VAL B CB  1 
ATOM   1163 C CG1 . VAL B 1 66 ? 16.26500 -35.75700 37.61600  1.000 30.37000 ? 471 VAL B CG1 1 
ATOM   1164 C CG2 . VAL B 1 66 ? 15.61900 -35.55400 40.05500  1.000 27.51000 ? 471 VAL B CG2 1 
ATOM   1165 N N   . PRO B 1 67 ? 16.80900 -39.14600 37.17400  1.000 33.61000 ? 472 PRO B N   1 
ATOM   1166 C CA  . PRO B 1 67 ? 17.62600 -39.74800 36.11200  1.000 31.38000 ? 472 PRO B CA  1 
ATOM   1167 C C   . PRO B 1 67 ? 18.44900 -38.69200 35.39100  1.000 28.17000 ? 472 PRO B C   1 
ATOM   1168 O O   . PRO B 1 67 ? 17.99400 -37.56700 35.18300  1.000 27.52000 ? 472 PRO B O   1 
ATOM   1169 C CB  . PRO B 1 67 ? 16.58700 -40.37900 35.17800  1.000 34.27000 ? 472 PRO B CB  1 
ATOM   1170 C CG  . PRO B 1 67 ? 15.38500 -40.59200 36.03400  1.000 35.45000 ? 472 PRO B CG  1 
ATOM   1171 C CD  . PRO B 1 67 ? 15.37900 -39.45900 37.02100  1.000 32.33000 ? 472 PRO B CD  1 
ATOM   1172 N N   . ALA B 1 68 ? 19.67100 -39.07500 35.00300  1.000 29.75000 ? 473 ALA B N   1 
ATOM   1173 C CA  . ALA B 1 68 ? 20.57500 -38.13200 34.35200  1.000 32.09000 ? 473 ALA B CA  1 
ATOM   1174 C C   . ALA B 1 68 ? 19.90100 -37.42200 33.18300  1.000 28.38000 ? 473 ALA B C   1 
ATOM   1175 O O   . ALA B 1 68 ? 20.06100 -36.21000 33.01000  1.000 29.10000 ? 473 ALA B O   1 
ATOM   1176 C CB  . ALA B 1 68 ? 21.83500 -38.85600 33.87900  1.000 30.66000 ? 473 ALA B CB  1 
ATOM   1177 N N   . ALA B 1 69 ? 19.11800 -38.16300 32.39000  1.000 31.07000 ? 474 ALA B N   1 
ATOM   1178 C CA  . ALA B 1 69 ? 18.49100 -37.58800 31.20200  1.000 35.47000 ? 474 ALA B CA  1 
ATOM   1179 C C   . ALA B 1 69 ? 17.49500 -36.49000 31.55200  1.000 35.68000 ? 474 ALA B C   1 
ATOM   1180 O O   . ALA B 1 69 ? 17.25900 -35.58700 30.74000  1.000 34.25000 ? 474 ALA B O   1 
ATOM   1181 C CB  . ALA B 1 69 ? 17.80400 -38.68500 30.39100  1.000 36.25000 ? 474 ALA B CB  1 
ATOM   1182 N N   . LEU B 1 70 ? 16.90900 -36.53700 32.75000  1.000 30.25000 ? 475 LEU B N   1 
ATOM   1183 C CA  . LEU B 1 70 ? 15.96300 -35.51600 33.17400  1.000 28.42000 ? 475 LEU B CA  1 
ATOM   1184 C C   . LEU B 1 70 ? 16.62500 -34.34800 33.89100  1.000 30.20000 ? 475 LEU B C   1 
ATOM   1185 O O   . LEU B 1 70 ? 15.96400 -33.33200 34.13400  1.000 27.45000 ? 475 LEU B O   1 
ATOM   1186 C CB  . LEU B 1 70 ? 14.89400 -36.13200 34.08500  1.000 31.96000 ? 475 LEU B CB  1 
ATOM   1187 C CG  . LEU B 1 70 ? 13.76700 -36.88800 33.37800  1.000 29.87000 ? 475 LEU B CG  1 
ATOM   1188 C CD1 . LEU B 1 70 ? 12.88600 -37.60600 34.39200  1.000 29.54000 ? 475 LEU B CD1 1 
ATOM   1189 C CD2 . LEU B 1 70 ? 12.95700 -35.93300 32.50500  1.000 27.01000 ? 475 LEU B CD2 1 
ATOM   1190 N N   . GLN B 1 71 ? 17.90900 -34.45500 34.23700  1.000 28.14000 ? 476 GLN B N   1 
ATOM   1191 C CA  . GLN B 1 71 ? 18.57700 -33.30100 34.81500  1.000 28.18000 ? 476 GLN B CA  1 
ATOM   1192 C C   . GLN B 1 71 ? 18.75300 -32.18900 33.79500  1.000 29.69000 ? 476 GLN B C   1 
ATOM   1193 O O   . GLN B 1 71 ? 18.89300 -31.02600 34.18000  1.000 31.74000 ? 476 GLN B O   1 
ATOM   1194 C CB  . GLN B 1 71 ? 19.91200 -33.72700 35.42100  1.000 28.58000 ? 476 GLN B CB  1 
ATOM   1195 C CG  . GLN B 1 71 ? 19.72700 -34.34200 36.80900  1.000 31.98000 ? 476 GLN B CG  1 
ATOM   1196 C CD  . GLN B 1 71 ? 20.94400 -35.09900 37.28300  1.000 35.42000 ? 476 GLN B CD  1 
ATOM   1197 O OE1 . GLN B 1 71 ? 22.07100 -34.66600 37.06100  1.000 37.30000 ? 476 GLN B OE1 1 
ATOM   1198 N NE2 . GLN B 1 71 ? 20.72600 -36.23200 37.94800  1.000 32.41000 ? 476 GLN B NE2 1 
ATOM   1199 N N   . CYS B 1 72 ? 18.70200 -32.51800 32.50300  1.000 29.59000 ? 477 CYS B N   1 
ATOM   1200 C CA  . CYS B 1 72 ? 18.75500 -31.50500 31.45900  1.000 30.51000 ? 477 CYS B CA  1 
ATOM   1201 C C   . CYS B 1 72 ? 17.46200 -30.70500 31.34600  1.000 33.60000 ? 477 CYS B C   1 
ATOM   1202 O O   . CYS B 1 72 ? 17.45600 -29.66300 30.68400  1.000 38.78000 ? 477 CYS B O   1 
ATOM   1203 C CB  . CYS B 1 72 ? 19.09300 -32.17100 30.12300  1.000 36.00000 ? 477 CYS B CB  1 
ATOM   1204 S SG  . CYS B 1 72 ? 20.50800 -33.34200 30.19900  1.000 46.38000 ? 477 CYS B SG  1 
ATOM   1205 N N   . VAL B 1 73 ? 16.37900 -31.14300 31.98000  1.000 28.83000 ? 478 VAL B N   1 
ATOM   1206 C CA  . VAL B 1 73 ? 15.12100 -30.40100 31.96100  1.000 33.70000 ? 478 VAL B CA  1 
ATOM   1207 C C   . VAL B 1 73 ? 15.11400 -29.48600 33.17800  1.000 30.07000 ? 478 VAL B C   1 
ATOM   1208 O O   . VAL B 1 73 ? 14.98200 -29.95100 34.31200  1.000 32.36000 ? 478 VAL B O   1 
ATOM   1209 C CB  . VAL B 1 73 ? 13.90900 -31.34200 31.95900  1.000 30.90000 ? 478 VAL B CB  1 
ATOM   1210 C CG1 . VAL B 1 73 ? 12.61500 -30.55800 32.12200  1.000 31.22000 ? 478 VAL B CG1 1 
ATOM   1211 C CG2 . VAL B 1 73 ? 13.89000 -32.16400 30.68000  1.000 31.08000 ? 478 VAL B CG2 1 
ATOM   1212 N N   . THR B 1 74 ? 15.26800 -28.18600 32.94800  1.000 30.83000 ? 479 THR B N   1 
ATOM   1213 C CA  . THR B 1 74 ? 15.44900 -27.21800 34.02100  1.000 30.95000 ? 479 THR B CA  1 
ATOM   1214 C C   . THR B 1 74 ? 14.30700 -26.20800 34.02900  1.000 33.83000 ? 479 THR B C   1 
ATOM   1215 O O   . THR B 1 74 ? 13.47200 -26.16100 33.12000  1.000 35.63000 ? 479 THR B O   1 
ATOM   1216 C CB  . THR B 1 74 ? 16.79900 -26.49300 33.89200  1.000 34.00000 ? 479 THR B CB  1 
ATOM   1217 O OG1 . THR B 1 74 ? 16.79400 -25.66000 32.72600  1.000 36.62000 ? 479 THR B OG1 1 
ATOM   1218 C CG2 . THR B 1 74 ? 17.94400 -27.50200 33.78200  1.000 34.96000 ? 479 THR B CG2 1 
ATOM   1219 N N   . GLY B 1 75 ? 14.27600 -25.40300 35.08200  1.000 31.19000 ? 480 GLY B N   1 
ATOM   1220 C CA  . GLY B 1 75 ? 13.25800 -24.38100 35.22100  1.000 34.78000 ? 480 GLY B CA  1 
ATOM   1221 C C   . GLY B 1 75 ? 12.02300 -24.83600 35.97600  1.000 32.84000 ? 480 GLY B C   1 
ATOM   1222 O O   . GLY B 1 75 ? 11.97700 -25.87900 36.63800  1.000 31.02000 ? 480 GLY B O   1 
ATOM   1223 N N   . ASP B 1 76 ? 10.98800 -24.00300 35.85300  1.000 32.58000 ? 481 ASP B N   1 
ATOM   1224 C CA  . ASP B 1 76 ? 9.70800  -24.23000 36.51500  1.000 31.84000 ? 481 ASP B CA  1 
ATOM   1225 C C   . ASP B 1 76 ? 9.07400  -25.53800 36.04800  1.000 33.70000 ? 481 ASP B C   1 
ATOM   1226 O O   . ASP B 1 76 ? 8.96400  -25.79500 34.84500  1.000 34.90000 ? 481 ASP B O   1 
ATOM   1227 C CB  . ASP B 1 76 ? 8.79300  -23.03700 36.22200  1.000 33.94000 ? 481 ASP B CB  1 
ATOM   1228 C CG  . ASP B 1 76 ? 7.54600  -23.00300 37.08700  1.000 35.43000 ? 481 ASP B CG  1 
ATOM   1229 O OD1 . ASP B 1 76 ? 7.24100  -23.99400 37.78000  1.000 38.14000 ? 481 ASP B OD1 1 
ATOM   1230 O OD2 . ASP B 1 76 ? 6.85500  -21.96400 37.05800  1.000 42.24000 ? 481 ASP B OD2 1 
ATOM   1231 N N   . LEU B 1 77 ? 8.64500  -26.37000 37.00200  1.000 28.80000 ? 482 LEU B N   1 
ATOM   1232 C CA  . LEU B 1 77 ? 8.12000  -27.69200 36.68100  1.000 31.04000 ? 482 LEU B CA  1 
ATOM   1233 C C   . LEU B 1 77 ? 6.61600  -27.81900 36.86800  1.000 33.50000 ? 482 LEU B C   1 
ATOM   1234 O O   . LEU B 1 77 ? 6.07600  -28.91600 36.67700  1.000 36.28000 ? 482 LEU B O   1 
ATOM   1235 C CB  . LEU B 1 77 ? 8.81400  -28.76700 37.52200  1.000 30.03000 ? 482 LEU B CB  1 
ATOM   1236 C CG  . LEU B 1 77 ? 10.34100 -28.78500 37.52000  1.000 28.60000 ? 482 LEU B CG  1 
ATOM   1237 C CD1 . LEU B 1 77 ? 10.80500 -29.86200 38.46500  1.000 24.80000 ? 482 LEU B CD1 1 
ATOM   1238 C CD2 . LEU B 1 77 ? 10.89200 -29.02900 36.11200  1.000 27.90000 ? 482 LEU B CD2 1 
ATOM   1239 N N   . ARG B 1 78 ? 5.92700  -26.74600 37.24200  1.000 37.75000 ? 483 ARG B N   1 
ATOM   1240 C CA  . ARG B 1 78 ? 4.49300  -26.83700 37.46800  1.000 41.66000 ? 483 ARG B CA  1 
ATOM   1241 C C   . ARG B 1 78 ? 3.75000  -27.00300 36.14000  1.000 46.89000 ? 483 ARG B C   1 
ATOM   1242 O O   . ARG B 1 78 ? 4.31500  -26.82700 35.05600  1.000 44.29000 ? 483 ARG B O   1 
ATOM   1243 C CB  . ARG B 1 78 ? 4.00000  -25.60200 38.22200  1.000 41.83000 ? 483 ARG B CB  1 
ATOM   1244 C CG  . ARG B 1 78 ? 4.84200  -25.26100 39.44100  1.000 40.32000 ? 483 ARG B CG  1 
ATOM   1245 C CD  . ARG B 1 78 ? 4.47800  -23.92000 40.03100  1.000 40.58000 ? 483 ARG B CD  1 
ATOM   1246 N NE  . ARG B 1 78 ? 5.39000  -22.86500 39.60400  1.000 39.70000 ? 483 ARG B NE  1 
ATOM   1247 C CZ  . ARG B 1 78 ? 5.54000  -21.70500 40.23600  1.000 42.16000 ? 483 ARG B CZ  1 
ATOM   1248 N NH1 . ARG B 1 78 ? 4.84000  -21.45100 41.33600  1.000 45.20000 ? 483 ARG B NH1 1 
ATOM   1249 N NH2 . ARG B 1 78 ? 6.39400  -20.79700 39.77500  1.000 43.15000 ? 483 ARG B NH2 1 
ATOM   1250 N N   . ARG B 1 79 ? 2.47600  -27.40000 36.24900  1.000 50.15000 ? 484 ARG B N   1 
ATOM   1251 C CA  . ARG B 1 79 ? 1.47600  -27.40200 35.16100  1.000 53.17000 ? 484 ARG B CA  1 
ATOM   1252 C C   . ARG B 1 79 ? 1.97600  -27.08400 33.74700  1.000 54.60000 ? 484 ARG B C   1 
ATOM   1253 O O   . ARG B 1 79 ? 1.50500  -27.65900 32.76200  1.000 55.02000 ? 484 ARG B O   1 
ATOM   1254 C CB  . ARG B 1 79 ? 0.37000  -26.40900 35.51800  1.000 54.16000 ? 484 ARG B CB  1 
ATOM   1255 C CG  . ARG B 1 79 ? 0.91300  -25.17100 36.20200  1.000 53.52000 ? 484 ARG B CG  1 
ATOM   1256 C CD  . ARG B 1 79 ? 0.07000  -23.93300 35.98200  1.000 56.69000 ? 484 ARG B CD  1 
ATOM   1257 N NE  . ARG B 1 79 ? 0.77000  -22.73800 36.45400  1.000 61.90000 ? 484 ARG B NE  1 
ATOM   1258 C CZ  . ARG B 1 79 ? 1.00600  -22.44900 37.73400  1.000 62.13000 ? 484 ARG B CZ  1 
ATOM   1259 N NH1 . ARG B 1 79 ? 0.59200  -23.26300 38.70000  1.000 60.65000 ? 484 ARG B NH1 1 
ATOM   1260 N NH2 . ARG B 1 79 ? 1.66000  -21.33700 38.05200  1.000 59.03000 ? 484 ARG B NH2 1 
HETATM 1261 C C1  . GOL C 2 .  ? 0.71700  -3.17400  -4.76500  1.000 30.02000 ? 501 GOL A C1  1 
HETATM 1262 O O1  . GOL C 2 .  ? -0.31100 -3.71300  -4.05000  1.000 30.38000 ? 501 GOL A O1  1 
HETATM 1263 C C2  . GOL C 2 .  ? 0.33000  -1.80500  -5.09400  1.000 26.65000 ? 501 GOL A C2  1 
HETATM 1264 O O2  . GOL C 2 .  ? 0.82700  -1.48300  -6.34300  1.000 39.77000 ? 501 GOL A O2  1 
HETATM 1265 C C3  . GOL C 2 .  ? 0.94500  -0.96400  -3.95500  1.000 35.81000 ? 501 GOL A C3  1 
HETATM 1266 O O3  . GOL C 2 .  ? -0.00000 -0.00000  -3.59200  1.000 35.02000 ? 501 GOL A O3  1 
HETATM 1267 O O   . HOH D 3 .  ? -1.947   -4.321    -2.656    1.000 24.49000 ? 601 HOH A O   1 
HETATM 1268 O O   . HOH D 3 .  ? 2.42100  -0.93500  -8.06400  1.000 25.97000 ? 602 HOH A O   1 
HETATM 1269 O O   . HOH D 3 .  ? 13.72700 3.13600   3.27900   1.000 18.16000 ? 603 HOH A O   1 
HETATM 1270 O O   . HOH D 3 .  ? -0.74200 -5.77900  -5.57600  1.000 24.16000 ? 604 HOH A O   1 
HETATM 1271 O O   . HOH D 3 .  ? 10.91400 -21.37200 18.11300  1.000 35.11000 ? 605 HOH A O   1 
HETATM 1272 O O   . HOH D 3 .  ? -2.46500 -11.86800 -3.76900  1.000 17.04000 ? 606 HOH A O   1 
HETATM 1273 O O   . HOH D 3 .  ? 15.39400 -3.22300  11.64800  1.000 29.81000 ? 607 HOH A O   1 
HETATM 1274 O O   . HOH D 3 .  ? 10.50300 -10.93600 -5.57700  1.000 28.94000 ? 608 HOH A O   1 
HETATM 1275 O O   . HOH D 3 .  ? 1.92400  -29.52400 16.40700  1.000 34.42000 ? 609 HOH A O   1 
HETATM 1276 O O   . HOH D 3 .  ? 3.71300  -9.94400  -7.14500  1.000 24.20000 ? 610 HOH A O   1 
HETATM 1277 O O   . HOH D 3 .  ? 23.53000 -21.84200 8.83900   1.000 39.27000 ? 611 HOH A O   1 
HETATM 1278 O O   . HOH D 3 .  ? 3.83900  -25.24100 7.24000   1.000 21.27000 ? 612 HOH A O   1 
HETATM 1279 O O   . HOH D 3 .  ? 3.52500  -17.73800 17.44300  1.000 21.35000 ? 613 HOH A O   1 
HETATM 1280 O O   . HOH D 3 .  ? 22.977   -6.807    0.972     1.000 18.88000 ? 614 HOH A O   1 
HETATM 1281 O O   . HOH D 3 .  ? 0.54100  -10.19300 10.00200  1.000 28.99000 ? 615 HOH A O   1 
HETATM 1282 O O   . HOH D 3 .  ? 1.35100  -11.95900 -2.75500  1.000 19.30000 ? 616 HOH A O   1 
HETATM 1283 O O   . HOH D 3 .  ? 15.15800 1.55500   4.98600   1.000 21.86000 ? 617 HOH A O   1 
HETATM 1284 O O   . HOH D 3 .  ? 19.63400 -19.35400 15.52000  1.000 33.82000 ? 618 HOH A O   1 
HETATM 1285 O O   . HOH D 3 .  ? 15.87700 -10.62400 -7.90600  1.000 25.84000 ? 619 HOH A O   1 
HETATM 1286 O O   . HOH D 3 .  ? 8.27200  -29.28100 8.06800   1.000 32.06000 ? 620 HOH A O   1 
HETATM 1287 O O   . HOH D 3 .  ? 4.17600  -7.11000  -9.36900  1.000 30.20000 ? 621 HOH A O   1 
HETATM 1288 O O   . HOH D 3 .  ? 9.87500  4.33400   11.16700  1.000 30.01000 ? 622 HOH A O   1 
HETATM 1289 O O   . HOH D 3 .  ? 14.96400 -13.66000 14.64200  1.000 27.68000 ? 623 HOH A O   1 
HETATM 1290 O O   . HOH D 3 .  ? 15.82500 6.12800   7.37400   1.000 27.44000 ? 624 HOH A O   1 
HETATM 1291 O O   . HOH D 3 .  ? 23.87400 -4.51500  2.75000   1.000 36.11000 ? 625 HOH A O   1 
HETATM 1292 O O   . HOH D 3 .  ? 11.57000 -12.23700 -3.89000  1.000 32.74000 ? 626 HOH A O   1 
HETATM 1293 O O   . HOH D 3 .  ? 1.94200  -15.85300 -3.54000  1.000 22.83000 ? 627 HOH A O   1 
HETATM 1294 O O   . HOH D 3 .  ? 5.53400  -13.93300 -2.63800  1.000 21.94000 ? 628 HOH A O   1 
HETATM 1295 O O   . HOH D 3 .  ? -0.50900 -15.58600 -5.85700  1.000 15.85000 ? 629 HOH A O   1 
HETATM 1296 O O   . HOH D 3 .  ? 2.44800  -21.06500 12.36500  1.000 16.17000 ? 630 HOH A O   1 
HETATM 1297 O O   . HOH D 3 .  ? -1.60200 -22.30800 5.46900   1.000 27.25000 ? 631 HOH A O   1 
HETATM 1298 O O   . HOH D 3 .  ? 2.22400  -14.61100 4.00300   1.000 13.94000 ? 632 HOH A O   1 
HETATM 1299 O O   . HOH D 3 .  ? 20.97500 -7.56300  10.50100  1.000 30.41000 ? 633 HOH A O   1 
HETATM 1300 O O   . HOH D 3 .  ? 10.03300 -28.65800 4.00400   1.000 32.16000 ? 634 HOH A O   1 
HETATM 1301 O O   . HOH D 3 .  ? 5.00800  -7.56800  7.36100   1.000 20.80000 ? 635 HOH A O   1 
HETATM 1302 O O   . HOH D 3 .  ? 11.55900 -23.79500 -1.20100  1.000 35.08000 ? 636 HOH A O   1 
HETATM 1303 O O   . HOH D 3 .  ? 19.48600 -10.64800 10.01900  1.000 23.36000 ? 637 HOH A O   1 
HETATM 1304 O O   . HOH D 3 .  ? 13.87100 -5.92500  -3.27900  1.000 18.15000 ? 638 HOH A O   1 
HETATM 1305 O O   . HOH D 3 .  ? 4.28300  -16.30300 -2.23300  1.000 16.70000 ? 639 HOH A O   1 
HETATM 1306 O O   . HOH D 3 .  ? 4.58300  -25.48400 1.85700   1.000 31.40000 ? 640 HOH A O   1 
HETATM 1307 O O   . HOH D 3 .  ? 4.72600  -3.84300  4.59300   1.000 20.59000 ? 641 HOH A O   1 
HETATM 1308 O O   . HOH D 3 .  ? 15.95400 0.97800   12.02600  1.000 28.91000 ? 642 HOH A O   1 
HETATM 1309 O O   . HOH D 3 .  ? 10.46700 -17.40300 17.45900  1.000 31.21000 ? 643 HOH A O   1 
HETATM 1310 O O   . HOH D 3 .  ? 2.09400  -4.58500  -2.53200  1.000 18.88000 ? 644 HOH A O   1 
HETATM 1311 O O   . HOH D 3 .  ? 24.89500 -6.49400  4.53200   1.000 25.96000 ? 645 HOH A O   1 
HETATM 1312 O O   . HOH D 3 .  ? 7.31900  -26.32200 19.02900  1.000 21.74000 ? 646 HOH A O   1 
HETATM 1313 O O   . HOH D 3 .  ? 5.33600  -13.57100 -5.62300  1.000 25.55000 ? 647 HOH A O   1 
HETATM 1314 O O   . HOH D 3 .  ? 11.87200 -31.37300 9.96600   1.000 36.95000 ? 648 HOH A O   1 
HETATM 1315 O O   . HOH D 3 .  ? 11.33700 -9.69900  -9.17300  1.000 27.83000 ? 649 HOH A O   1 
HETATM 1316 O O   . HOH D 3 .  ? 9.26700  -1.93100  13.25400  1.000 39.73000 ? 650 HOH A O   1 
HETATM 1317 O O   . HOH D 3 .  ? 14.99400 -13.51000 -3.55100  1.000 30.21000 ? 651 HOH A O   1 
HETATM 1318 O O   . HOH D 3 .  ? 7.00400  -6.15600  12.20700  1.000 39.02000 ? 652 HOH A O   1 
HETATM 1319 O O   . HOH D 3 .  ? 11.95600 -16.94900 -3.59100  1.000 30.39000 ? 653 HOH A O   1 
HETATM 1320 O O   . HOH D 3 .  ? -1.950   -1.949    -7.378    1.000 32.63000 ? 654 HOH A O   1 
HETATM 1321 O O   . HOH D 3 .  ? 4.76700  -1.30500  -12.37200 1.000 34.89000 ? 655 HOH A O   1 
HETATM 1322 O O   . HOH D 3 .  ? 2.89900  -23.20000 -0.43000  1.000 19.80000 ? 656 HOH A O   1 
HETATM 1323 O O   . HOH D 3 .  ? -0.00000 -13.45100 0.00000   0.50  29.54000 ? 657 HOH A O   1 
HETATM 1324 O O   . HOH D 3 .  ? 5.45300  -28.40700 19.07900  1.000 20.29000 ? 658 HOH A O   1 
HETATM 1325 O O   . HOH D 3 .  ? -2.43800 -28.69200 16.67000  1.000 31.55000 ? 659 HOH A O   1 
HETATM 1326 O O   . HOH D 3 .  ? 13.07600 -18.02100 16.50800  1.000 32.38000 ? 660 HOH A O   1 
HETATM 1327 O O   . HOH D 3 .  ? -1.581   -4.795    -0.043    1.000 24.25000 ? 661 HOH A O   1 
HETATM 1328 O O   . HOH D 3 .  ? 6.92500  -20.13600 -2.23800  1.000 33.16000 ? 662 HOH A O   1 
HETATM 1329 O O   . HOH D 3 .  ? 15.86800 -3.44100  -1.47900  1.000 22.45000 ? 663 HOH A O   1 
HETATM 1330 O O   . HOH D 3 .  ? 7.31600  -12.53400 -6.69300  1.000 31.88000 ? 664 HOH A O   1 
HETATM 1331 O O   . HOH D 3 .  ? 6.39800  -6.68700  9.97200   1.000 31.06000 ? 665 HOH A O   1 
HETATM 1332 O O   . HOH D 3 .  ? 3.08700  -5.19100  7.00100   1.000 32.55000 ? 666 HOH A O   1 
HETATM 1333 O O   . HOH D 3 .  ? 21.19700 -3.31600  2.23100   1.000 38.12000 ? 667 HOH A O   1 
HETATM 1334 O O   . HOH D 3 .  ? 11.18700 -36.54700 12.34000  1.000 36.58000 ? 668 HOH A O   1 
HETATM 1335 O O   . HOH D 3 .  ? 6.04800  -16.48800 -5.89900  1.000 37.87000 ? 669 HOH A O   1 
HETATM 1336 O O   . HOH D 3 .  ? 1.94000  -25.68100 0.36600   1.000 35.39000 ? 670 HOH A O   1 
HETATM 1337 O O   . HOH D 3 .  ? 6.31000  -10.40800 -7.98400  1.000 30.90000 ? 671 HOH A O   1 
HETATM 1338 O O   . HOH D 3 .  ? 16.142   -8.080    -8.916    1.000 28.83000 ? 672 HOH A O   1 
HETATM 1339 O O   . HOH D 3 .  ? 0.54000  -25.13300 5.84700   1.000 38.18000 ? 673 HOH A O   1 
HETATM 1340 O O   . HOH D 3 .  ? 17.17800 -12.79900 13.19100  1.000 35.23000 ? 674 HOH A O   1 
HETATM 1341 O O   . HOH D 3 .  ? 13.60500 -11.31200 -8.67000  1.000 34.64000 ? 675 HOH A O   1 
HETATM 1342 O O   . HOH D 3 .  ? 0.10300  -14.87800 2.13200   1.000 24.70000 ? 676 HOH A O   1 
HETATM 1343 O O   . HOH D 3 .  ? 3.14500  -2.25500  -2.17400  1.000 30.02000 ? 677 HOH A O   1 
HETATM 1344 O O   . HOH D 3 .  ? 14.13200 -11.71800 15.42000  1.000 37.30000 ? 678 HOH A O   1 
HETATM 1345 O O   . HOH D 3 .  ? 3.76200  -26.59900 5.13200   1.000 34.57000 ? 679 HOH A O   1 
HETATM 1346 O O   . HOH D 3 .  ? -5.929   -28.037   15.148    1.000 24.09000 ? 680 HOH A O   1 
HETATM 1347 O O   . HOH D 3 .  ? 12.82900 -14.32900 -2.74000  1.000 29.95000 ? 681 HOH A O   1 
HETATM 1348 O O   . HOH D 3 .  ? 9.50400  -9.78700  -11.05200 1.000 37.72000 ? 682 HOH A O   1 
HETATM 1349 O O   . HOH D 3 .  ? -5.274   -18.179   3.934     1.000 28.00000 ? 683 HOH A O   1 
HETATM 1350 O O   . HOH D 3 .  ? 4.32500  -5.10000  10.70500  1.000 39.05000 ? 684 HOH A O   1 
HETATM 1351 O O   . HOH D 3 .  ? 18.73600 -1.64800  2.91800   1.000 37.70000 ? 685 HOH A O   1 
HETATM 1352 O O   . HOH D 3 .  ? 23.56700 -8.17200  11.04000  1.000 30.81000 ? 686 HOH A O   1 
HETATM 1353 O O   . HOH D 3 .  ? 17.04900 -10.69600 11.88900  1.000 30.69000 ? 687 HOH A O   1 
HETATM 1354 O O   . HOH D 3 .  ? 16.06300 -8.81300  13.00100  1.000 35.51000 ? 688 HOH A O   1 
HETATM 1355 O O   . HOH E 3 .  ? 15.08100 -36.18200 44.72600  1.000 31.80000 ? 501 HOH B O   1 
HETATM 1356 O O   . HOH E 3 .  ? 16.28200 -32.93300 15.20100  1.000 33.40000 ? 502 HOH B O   1 
HETATM 1357 O O   . HOH E 3 .  ? 4.36500  -47.89800 13.59100  1.000 36.17000 ? 503 HOH B O   1 
HETATM 1358 O O   . HOH E 3 .  ? 13.04200 -40.32700 12.04200  1.000 33.51000 ? 504 HOH B O   1 
HETATM 1359 O O   . HOH E 3 .  ? 1.27500  -29.34800 26.56000  1.000 20.94000 ? 505 HOH B O   1 
HETATM 1360 O O   . HOH E 3 .  ? -0.73800 -40.40600 22.41900  1.000 21.96000 ? 506 HOH B O   1 
HETATM 1361 O O   . HOH E 3 .  ? 0.88000  -46.15100 23.82600  1.000 31.00000 ? 507 HOH B O   1 
HETATM 1362 O O   . HOH E 3 .  ? 12.77000 -45.95800 29.14600  1.000 32.06000 ? 508 HOH B O   1 
HETATM 1363 O O   . HOH E 3 .  ? 4.72600  -35.72100 17.06600  1.000 22.15000 ? 509 HOH B O   1 
HETATM 1364 O O   . HOH E 3 .  ? 18.53000 -30.35800 36.77900  1.000 32.54000 ? 510 HOH B O   1 
HETATM 1365 O O   . HOH E 3 .  ? 8.10500  -47.93200 21.59400  1.000 31.89000 ? 511 HOH B O   1 
HETATM 1366 O O   . HOH E 3 .  ? 9.16700  -37.89900 13.52700  1.000 29.48000 ? 512 HOH B O   1 
HETATM 1367 O O   . HOH E 3 .  ? 1.59800  -45.82400 14.20500  1.000 24.25000 ? 513 HOH B O   1 
HETATM 1368 O O   . HOH E 3 .  ? 19.09000 -35.38000 14.61900  1.000 40.26000 ? 514 HOH B O   1 
HETATM 1369 O O   . HOH E 3 .  ? 20.63900 -41.61200 35.48200  1.000 39.79000 ? 515 HOH B O   1 
HETATM 1370 O O   . HOH E 3 .  ? 1.10800  -44.39600 21.87000  1.000 27.53000 ? 516 HOH B O   1 
HETATM 1371 O O   . HOH E 3 .  ? 2.330    -25.610   27.667    1.000 30.07000 ? 517 HOH B O   1 
HETATM 1372 O O   . HOH E 3 .  ? 17.34400 -45.61100 28.26100  1.000 42.07000 ? 518 HOH B O   1 
HETATM 1373 O O   . HOH E 3 .  ? 2.07500  -42.83100 11.34700  1.000 23.14000 ? 519 HOH B O   1 
HETATM 1374 O O   . HOH E 3 .  ? 1.64100  -40.58200 20.75400  1.000 17.37000 ? 520 HOH B O   1 
HETATM 1375 O O   . HOH E 3 .  ? 13.19200 -29.47400 18.86600  1.000 24.62000 ? 521 HOH B O   1 
HETATM 1376 O O   . HOH E 3 .  ? 13.86500 -27.74000 37.67300  1.000 28.48000 ? 522 HOH B O   1 
HETATM 1377 O O   . HOH E 3 .  ? 23.18100 -37.65700 23.01300  1.000 40.72000 ? 523 HOH B O   1 
HETATM 1378 O O   . HOH E 3 .  ? 1.52700  -44.73200 17.44800  1.000 19.75000 ? 524 HOH B O   1 
HETATM 1379 O O   . HOH E 3 .  ? 8.20700  -47.53900 24.28800  1.000 31.94000 ? 525 HOH B O   1 
HETATM 1380 O O   . HOH E 3 .  ? 16.09300 -25.96600 37.22100  1.000 40.91000 ? 526 HOH B O   1 
HETATM 1381 O O   . HOH E 3 .  ? -1.65400 -35.57000 21.71100  1.000 15.52000 ? 527 HOH B O   1 
HETATM 1382 O O   . HOH E 3 .  ? 13.79800 -34.30800 46.46900  1.000 31.14000 ? 528 HOH B O   1 
HETATM 1383 O O   . HOH E 3 .  ? 9.83800  -27.02300 20.74100  1.000 34.47000 ? 529 HOH B O   1 
HETATM 1384 O O   . HOH E 3 .  ? 8.16300  -45.57800 11.86500  1.000 32.98000 ? 530 HOH B O   1 
HETATM 1385 O O   . HOH E 3 .  ? 4.85500  -47.85700 16.94700  1.000 28.65000 ? 531 HOH B O   1 
HETATM 1386 O O   . HOH E 3 .  ? 18.77800 -36.27400 41.81200  1.000 41.39000 ? 532 HOH B O   1 
HETATM 1387 O O   . HOH E 3 .  ? 18.92600 -41.14700 32.35100  1.000 40.09000 ? 533 HOH B O   1 
HETATM 1388 O O   . HOH E 3 .  ? 10.90600 -34.24300 14.66200  1.000 33.91000 ? 534 HOH B O   1 
HETATM 1389 O O   . HOH E 3 .  ? 13.45700 -27.25900 26.37900  1.000 32.68000 ? 535 HOH B O   1 
HETATM 1390 O O   . HOH E 3 .  ? -0.00000 -31.11500 17.67100  0.50  23.78000 ? 536 HOH B O   1 
HETATM 1391 O O   . HOH E 3 .  ? -1.635   -35.107   17.540    1.000 28.55000 ? 537 HOH B O   1 
HETATM 1392 O O   . HOH E 3 .  ? 15.48400 -29.62900 39.99400  1.000 33.92000 ? 538 HOH B O   1 
HETATM 1393 O O   . HOH E 3 .  ? 8.96200  -27.62700 23.40200  1.000 27.54000 ? 539 HOH B O   1 
HETATM 1394 O O   . HOH E 3 .  ? -0.91900 -48.53300 27.84300  1.000 58.25000 ? 540 HOH B O   1 
HETATM 1395 O O   . HOH E 3 .  ? 10.90700 -47.36800 24.71800  1.000 37.88000 ? 541 HOH B O   1 
HETATM 1396 O O   . HOH E 3 .  ? -2.28400 -38.24900 22.56600  1.000 19.84000 ? 542 HOH B O   1 
HETATM 1397 O O   . HOH E 3 .  ? -4.07500 -38.77800 24.36600  1.000 31.22000 ? 543 HOH B O   1 
HETATM 1398 O O   . HOH E 3 .  ? -3.433   -35.459   19.641    1.000 23.32000 ? 544 HOH B O   1 
HETATM 1399 O O   . HOH E 3 .  ? -1.69300 -42.71400 21.85900  1.000 36.01000 ? 545 HOH B O   1 
HETATM 1400 O O   . HOH E 3 .  ? 0.14800  -45.16000 19.60500  1.000 32.25000 ? 546 HOH B O   1 
HETATM 1401 O O   . HOH E 3 .  ? -0.00000 -31.11500 27.71800  0.50  29.20000 ? 547 HOH B O   1 
HETATM 1402 O O   . HOH E 3 .  ? 5.23900  -49.82900 18.94000  1.000 42.11000 ? 548 HOH B O   1 
HETATM 1403 O O   . HOH E 3 .  ? 8.29500  -35.27000 13.90700  1.000 29.24000 ? 549 HOH B O   1 
# 
