data_9GFK
# 
_entry.id   9GFK 
# 
_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   9GFK         pdb_00009gfk 10.2210/pdb9gfk/pdb 
WWPDB D_1292140919 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-03-26 ? 
2 'Structure model' 1 1 2025-04-16 ? 
# 
_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_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
_pdbx_audit_revision_item.ordinal             1 
_pdbx_audit_revision_item.revision_ordinal    2 
_pdbx_audit_revision_item.data_content_type   'Structure model' 
_pdbx_audit_revision_item.item                '_citation.journal_volume' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9GFK 
_pdbx_database_status.recvd_initial_deposition_date   2024-08-09 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_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           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              g.guichard@iecb.u-bordeaux.fr 
_pdbx_contact_author.name_first         gilles 
_pdbx_contact_author.name_last          guichard 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-2584-7502 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Neuville, M.'   1  ?                   
'Bourgeais, M.'  2  ?                   
'Buratto, J.'    3  ?                   
'Saragaglia, C.' 4  ?                   
'Bo, L.'         5  ?                   
'Mauran, L.'     6  ?                   
'Varajao, L.'    7  ?                   
'Goudreau, S.R.' 8  ?                   
'Kauffmann, B.'  9  0000-0002-2932-3255 
'Thinon, E.'     10 0000-0001-9248-5655 
'Pasco, M.'      11 0000-0002-1556-2802 
'Khatib, A.M.'   12 0000-0001-6957-0384 
# 
_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                   GE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Chemistry 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           0947-6539 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            31 
_citation.language                  ? 
_citation.page_first                e202403330 
_citation.page_last                 e202403330 
_citation.title                     
;Optimal Stapling of a Helical Peptide-Foldamer Hybrid Using a C-Terminal 4-Mercaptoproline Enhances Protein Surface Recognition and Cellular Activity.
;
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/chem.202403330 
_citation.pdbx_database_id_PubMed   40014761 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Neuville, M.'      1  ?                   
primary 'Bourgeais, M.'     2  0000-0002-6347-2190 
primary 'Buratto, J.'       3  ?                   
primary 'Saragaglia, C.'    4  0000-0002-9686-8992 
primary 'Li, B.'            5  0000-0003-4615-6898 
primary 'Galeano-Otero, I.' 6  0000-0003-3219-4201 
primary 'Mauran, L.'        7  0000-0001-8278-618X 
primary 'Varajao, L.'       8  ?                   
primary 'Goudreau, S.R.'    9  0000-0002-2803-876X 
primary 'Kauffmann, B.'     10 0000-0002-2932-3255 
primary 'Thinon, E.'        11 0000-0001-9248-5655 
primary 'Pasco, M.'         12 0000-0002-1556-2802 
primary 'Khatib, A.M.'      13 0000-0001-6957-0384 
primary 'Guichard, G.'      14 0000-0002-2584-7502 
# 
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 'E3 ubiquitin-protein ligase Mdm2' 11230.196 4   6.3.2.- ? 'TRUNCATED N-TERMINAL DOMAIN' ? 
2 polymer     syn 'Stapled foldamer'                 1501.834  4   ?       ? ?                             ? 
3 non-polymer syn 'SULFATE ION'                      96.063    3   ?       ? ?                             ? 
4 water       nat water                              18.015    412 ?       ? ?                             ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Double minute 2 protein,Hdm2,Oncoprotein Mdm2,p53-binding protein Mdm2' 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no  
;MSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKE
HRKIYTMIYRNLVVVN
;
;MSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKE
HRKIYTMIYRNLVVVN
;
A,B,C,D ? 
2 'polypeptide(L)' no yes 'TSFCEYWA(URL)(URL)(A1IL6)(NH2)'                                                                    
TSFCEYWAXXPX                                                                                        J,F,G,H ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 'SULFATE ION' SO4 
4 water         HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1  MET   n 
1 2  SER   n 
1 3  GLN   n 
1 4  ILE   n 
1 5  PRO   n 
1 6  ALA   n 
1 7  SER   n 
1 8  GLU   n 
1 9  GLN   n 
1 10 GLU   n 
1 11 THR   n 
1 12 LEU   n 
1 13 VAL   n 
1 14 ARG   n 
1 15 PRO   n 
1 16 LYS   n 
1 17 PRO   n 
1 18 LEU   n 
1 19 LEU   n 
1 20 LEU   n 
1 21 LYS   n 
1 22 LEU   n 
1 23 LEU   n 
1 24 LYS   n 
1 25 SER   n 
1 26 VAL   n 
1 27 GLY   n 
1 28 ALA   n 
1 29 GLN   n 
1 30 LYS   n 
1 31 ASP   n 
1 32 THR   n 
1 33 TYR   n 
1 34 THR   n 
1 35 MET   n 
1 36 LYS   n 
1 37 GLU   n 
1 38 VAL   n 
1 39 LEU   n 
1 40 PHE   n 
1 41 TYR   n 
1 42 LEU   n 
1 43 GLY   n 
1 44 GLN   n 
1 45 TYR   n 
1 46 ILE   n 
1 47 MET   n 
1 48 THR   n 
1 49 LYS   n 
1 50 ARG   n 
1 51 LEU   n 
1 52 TYR   n 
1 53 ASP   n 
1 54 GLU   n 
1 55 LYS   n 
1 56 GLN   n 
1 57 GLN   n 
1 58 HIS   n 
1 59 ILE   n 
1 60 VAL   n 
1 61 TYR   n 
1 62 CYS   n 
1 63 SER   n 
1 64 ASN   n 
1 65 ASP   n 
1 66 LEU   n 
1 67 LEU   n 
1 68 GLY   n 
1 69 ASP   n 
1 70 LEU   n 
1 71 PHE   n 
1 72 GLY   n 
1 73 VAL   n 
1 74 PRO   n 
1 75 SER   n 
1 76 PHE   n 
1 77 SER   n 
1 78 VAL   n 
1 79 LYS   n 
1 80 GLU   n 
1 81 HIS   n 
1 82 ARG   n 
1 83 LYS   n 
1 84 ILE   n 
1 85 TYR   n 
1 86 THR   n 
1 87 MET   n 
1 88 ILE   n 
1 89 TYR   n 
1 90 ARG   n 
1 91 ASN   n 
1 92 LEU   n 
1 93 VAL   n 
1 94 VAL   n 
1 95 VAL   n 
1 96 ASN   n 
2 1  THR   n 
2 2  SER   n 
2 3  PHE   n 
2 4  CYS   n 
2 5  GLU   n 
2 6  TYR   n 
2 7  TRP   n 
2 8  ALA   n 
2 9  URL   n 
2 10 URL   n 
2 11 A1IL6 n 
2 12 NH2   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                   96 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 MDM2 
_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      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_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-Gold(DE3)pLysS AG'
;
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     866768 
_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                   ? 
# 
_pdbx_entity_src_syn.entity_id              2 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       12 
_pdbx_entity_src_syn.organism_scientific    'synthetic construct' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       32630 
_pdbx_entity_src_syn.details                ? 
# 
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 
A1IL6 non-polymer         n '(2~{S},4~{S})-4-hexylsulfanylpyrrolidine-2-carboxylic acid' ? 'C11 H21 N O2 S' 231.355 
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  
HIS   'L-peptide linking' y HISTIDINE                                                    ? 'C6 H10 N3 O2 1' 156.162 
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 
NH2   non-polymer         . 'AMINO GROUP'                                                ? 'H2 N'           16.023  
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 
SO4   non-polymer         . 'SULFATE ION'                                                ? 'O4 S -2'        96.063  
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 
URL   non-polymer         . '[(2~{S})-2-azanyl-4-methyl-pentyl]carbamic acid'            ? 'C7 H16 N2 O2'   160.214 
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  MET   1  16  ?   ?     ?   A . n 
A 1 2  SER   2  17  17  SER   SER A . n 
A 1 3  GLN   3  18  18  GLN   GLN A . n 
A 1 4  ILE   4  19  19  ILE   ILE A . n 
A 1 5  PRO   5  20  20  PRO   PRO A . n 
A 1 6  ALA   6  21  21  ALA   ALA A . n 
A 1 7  SER   7  22  22  SER   SER A . n 
A 1 8  GLU   8  23  23  GLU   GLU A . n 
A 1 9  GLN   9  24  24  GLN   GLN A . n 
A 1 10 GLU   10 25  25  GLU   GLU A . n 
A 1 11 THR   11 26  26  THR   THR A . n 
A 1 12 LEU   12 27  27  LEU   LEU A . n 
A 1 13 VAL   13 28  28  VAL   VAL A . n 
A 1 14 ARG   14 29  29  ARG   ARG A . n 
A 1 15 PRO   15 30  30  PRO   PRO A . n 
A 1 16 LYS   16 31  31  LYS   LYS A . n 
A 1 17 PRO   17 32  32  PRO   PRO A . n 
A 1 18 LEU   18 33  33  LEU   LEU A . n 
A 1 19 LEU   19 34  34  LEU   LEU A . n 
A 1 20 LEU   20 35  35  LEU   LEU A . n 
A 1 21 LYS   21 36  36  LYS   LYS A . n 
A 1 22 LEU   22 37  37  LEU   LEU A . n 
A 1 23 LEU   23 38  38  LEU   LEU A . n 
A 1 24 LYS   24 39  39  LYS   LYS A . n 
A 1 25 SER   25 40  40  SER   SER A . n 
A 1 26 VAL   26 41  41  VAL   VAL A . n 
A 1 27 GLY   27 42  42  GLY   GLY A . n 
A 1 28 ALA   28 43  43  ALA   ALA A . n 
A 1 29 GLN   29 44  44  GLN   GLN A . n 
A 1 30 LYS   30 45  45  LYS   LYS A . n 
A 1 31 ASP   31 46  46  ASP   ASP A . n 
A 1 32 THR   32 47  47  THR   THR A . n 
A 1 33 TYR   33 48  48  TYR   TYR A . n 
A 1 34 THR   34 49  49  THR   THR A . n 
A 1 35 MET   35 50  50  MET   MET A . n 
A 1 36 LYS   36 51  51  LYS   LYS A . n 
A 1 37 GLU   37 52  52  GLU   GLU A . n 
A 1 38 VAL   38 53  53  VAL   VAL A . n 
A 1 39 LEU   39 54  54  LEU   LEU A . n 
A 1 40 PHE   40 55  55  PHE   PHE A . n 
A 1 41 TYR   41 56  56  TYR   TYR A . n 
A 1 42 LEU   42 57  57  LEU   LEU A . n 
A 1 43 GLY   43 58  58  GLY   GLY A . n 
A 1 44 GLN   44 59  59  GLN   GLN A . n 
A 1 45 TYR   45 60  60  TYR   TYR A . n 
A 1 46 ILE   46 61  61  ILE   ILE A . n 
A 1 47 MET   47 62  62  MET   MET A . n 
A 1 48 THR   48 63  63  THR   THR A . n 
A 1 49 LYS   49 64  64  LYS   LYS A . n 
A 1 50 ARG   50 65  65  ARG   ARG A . n 
A 1 51 LEU   51 66  66  LEU   LEU A . n 
A 1 52 TYR   52 67  67  TYR   TYR A . n 
A 1 53 ASP   53 68  68  ASP   ASP A . n 
A 1 54 GLU   54 69  69  GLU   GLU A . n 
A 1 55 LYS   55 70  70  LYS   LYS A . n 
A 1 56 GLN   56 71  71  GLN   GLN A . n 
A 1 57 GLN   57 72  72  GLN   GLN A . n 
A 1 58 HIS   58 73  73  HIS   HIS A . n 
A 1 59 ILE   59 74  74  ILE   ILE A . n 
A 1 60 VAL   60 75  75  VAL   VAL A . n 
A 1 61 TYR   61 76  76  TYR   TYR A . n 
A 1 62 CYS   62 77  77  CYS   CYS A . n 
A 1 63 SER   63 78  78  SER   SER A . n 
A 1 64 ASN   64 79  79  ASN   ASN A . n 
A 1 65 ASP   65 80  80  ASP   ASP A . n 
A 1 66 LEU   66 81  81  LEU   LEU A . n 
A 1 67 LEU   67 82  82  LEU   LEU A . n 
A 1 68 GLY   68 83  83  GLY   GLY A . n 
A 1 69 ASP   69 84  84  ASP   ASP A . n 
A 1 70 LEU   70 85  85  LEU   LEU A . n 
A 1 71 PHE   71 86  86  PHE   PHE A . n 
A 1 72 GLY   72 87  87  GLY   GLY A . n 
A 1 73 VAL   73 88  88  VAL   ALA A . n 
A 1 74 PRO   74 89  89  PRO   PRO A . n 
A 1 75 SER   75 90  90  SER   SER A . n 
A 1 76 PHE   76 91  91  PHE   PHE A . n 
A 1 77 SER   77 92  92  SER   SER A . n 
A 1 78 VAL   78 93  93  VAL   VAL A . n 
A 1 79 LYS   79 94  94  LYS   LYS A . n 
A 1 80 GLU   80 95  95  GLU   GLU A . n 
A 1 81 HIS   81 96  96  HIS   HIS A . n 
A 1 82 ARG   82 97  97  ARG   ARG A . n 
A 1 83 LYS   83 98  98  LYS   LYS A . n 
A 1 84 ILE   84 99  99  ILE   ILE A . n 
A 1 85 TYR   85 100 100 TYR   TYR A . n 
A 1 86 THR   86 101 101 THR   THR A . n 
A 1 87 MET   87 102 102 MET   MET A . n 
A 1 88 ILE   88 103 103 ILE   ILE A . n 
A 1 89 TYR   89 104 104 TYR   TYR A . n 
A 1 90 ARG   90 105 105 ARG   ARG A . n 
A 1 91 ASN   91 106 106 ASN   ASN A . n 
A 1 92 LEU   92 107 107 LEU   LEU A . n 
A 1 93 VAL   93 108 108 VAL   VAL A . n 
A 1 94 VAL   94 109 109 VAL   VAL A . n 
A 1 95 VAL   95 110 110 VAL   VAL A . n 
A 1 96 ASN   96 111 111 ASN   ASN A . n 
B 1 1  MET   1  16  16  MET   MET B . n 
B 1 2  SER   2  17  17  SER   SER B . n 
B 1 3  GLN   3  18  18  GLN   GLN B . n 
B 1 4  ILE   4  19  19  ILE   ILE B . n 
B 1 5  PRO   5  20  20  PRO   PRO B . n 
B 1 6  ALA   6  21  21  ALA   ALA B . n 
B 1 7  SER   7  22  22  SER   SER B . n 
B 1 8  GLU   8  23  23  GLU   GLU B . n 
B 1 9  GLN   9  24  24  GLN   GLN B . n 
B 1 10 GLU   10 25  25  GLU   GLU B . n 
B 1 11 THR   11 26  26  THR   THR B . n 
B 1 12 LEU   12 27  27  LEU   LEU B . n 
B 1 13 VAL   13 28  28  VAL   VAL B . n 
B 1 14 ARG   14 29  29  ARG   ARG B . n 
B 1 15 PRO   15 30  30  PRO   PRO B . n 
B 1 16 LYS   16 31  31  LYS   LYS B . n 
B 1 17 PRO   17 32  32  PRO   PRO B . n 
B 1 18 LEU   18 33  33  LEU   LEU B . n 
B 1 19 LEU   19 34  34  LEU   LEU B . n 
B 1 20 LEU   20 35  35  LEU   LEU B . n 
B 1 21 LYS   21 36  36  LYS   LYS B . n 
B 1 22 LEU   22 37  37  LEU   LEU B . n 
B 1 23 LEU   23 38  38  LEU   LEU B . n 
B 1 24 LYS   24 39  39  LYS   LYS B . n 
B 1 25 SER   25 40  40  SER   SER B . n 
B 1 26 VAL   26 41  41  VAL   VAL B . n 
B 1 27 GLY   27 42  42  GLY   GLY B . n 
B 1 28 ALA   28 43  43  ALA   ALA B . n 
B 1 29 GLN   29 44  44  GLN   GLN B . n 
B 1 30 LYS   30 45  45  LYS   LYS B . n 
B 1 31 ASP   31 46  46  ASP   ASP B . n 
B 1 32 THR   32 47  47  THR   THR B . n 
B 1 33 TYR   33 48  48  TYR   TYR B . n 
B 1 34 THR   34 49  49  THR   THR B . n 
B 1 35 MET   35 50  50  MET   MET B . n 
B 1 36 LYS   36 51  51  LYS   LYS B . n 
B 1 37 GLU   37 52  52  GLU   GLU B . n 
B 1 38 VAL   38 53  53  VAL   VAL B . n 
B 1 39 LEU   39 54  54  LEU   LEU B . n 
B 1 40 PHE   40 55  55  PHE   PHE B . n 
B 1 41 TYR   41 56  56  TYR   TYR B . n 
B 1 42 LEU   42 57  57  LEU   LEU B . n 
B 1 43 GLY   43 58  58  GLY   GLY B . n 
B 1 44 GLN   44 59  59  GLN   GLN B . n 
B 1 45 TYR   45 60  60  TYR   TYR B . n 
B 1 46 ILE   46 61  61  ILE   ILE B . n 
B 1 47 MET   47 62  62  MET   MET B . n 
B 1 48 THR   48 63  63  THR   THR B . n 
B 1 49 LYS   49 64  64  LYS   LYS B . n 
B 1 50 ARG   50 65  65  ARG   ARG B . n 
B 1 51 LEU   51 66  66  LEU   LEU B . n 
B 1 52 TYR   52 67  67  TYR   TYR B . n 
B 1 53 ASP   53 68  68  ASP   ASP B . n 
B 1 54 GLU   54 69  69  GLU   GLU B . n 
B 1 55 LYS   55 70  70  LYS   LYS B . n 
B 1 56 GLN   56 71  71  GLN   GLN B . n 
B 1 57 GLN   57 72  72  GLN   GLN B . n 
B 1 58 HIS   58 73  73  HIS   HIS B . n 
B 1 59 ILE   59 74  74  ILE   ILE B . n 
B 1 60 VAL   60 75  75  VAL   VAL B . n 
B 1 61 TYR   61 76  76  TYR   TYR B . n 
B 1 62 CYS   62 77  77  CYS   CYS B . n 
B 1 63 SER   63 78  78  SER   SER B . n 
B 1 64 ASN   64 79  79  ASN   ASN B . n 
B 1 65 ASP   65 80  80  ASP   ASP B . n 
B 1 66 LEU   66 81  81  LEU   LEU B . n 
B 1 67 LEU   67 82  82  LEU   LEU B . n 
B 1 68 GLY   68 83  83  GLY   GLY B . n 
B 1 69 ASP   69 84  84  ASP   ASP B . n 
B 1 70 LEU   70 85  85  LEU   LEU B . n 
B 1 71 PHE   71 86  86  PHE   PHE B . n 
B 1 72 GLY   72 87  87  GLY   GLY B . n 
B 1 73 VAL   73 88  88  VAL   ALA B . n 
B 1 74 PRO   74 89  89  PRO   PRO B . n 
B 1 75 SER   75 90  90  SER   SER B . n 
B 1 76 PHE   76 91  91  PHE   PHE B . n 
B 1 77 SER   77 92  92  SER   SER B . n 
B 1 78 VAL   78 93  93  VAL   VAL B . n 
B 1 79 LYS   79 94  94  LYS   LYS B . n 
B 1 80 GLU   80 95  95  GLU   GLU B . n 
B 1 81 HIS   81 96  96  HIS   HIS B . n 
B 1 82 ARG   82 97  97  ARG   ARG B . n 
B 1 83 LYS   83 98  98  LYS   LYS B . n 
B 1 84 ILE   84 99  99  ILE   ILE B . n 
B 1 85 TYR   85 100 100 TYR   TYR B . n 
B 1 86 THR   86 101 101 THR   THR B . n 
B 1 87 MET   87 102 102 MET   MET B . n 
B 1 88 ILE   88 103 103 ILE   ILE B . n 
B 1 89 TYR   89 104 104 TYR   TYR B . n 
B 1 90 ARG   90 105 105 ARG   ARG B . n 
B 1 91 ASN   91 106 106 ASN   ASN B . n 
B 1 92 LEU   92 107 107 LEU   LEU B . n 
B 1 93 VAL   93 108 108 VAL   VAL B . n 
B 1 94 VAL   94 109 109 VAL   VAL B . n 
B 1 95 VAL   95 110 110 VAL   VAL B . n 
B 1 96 ASN   96 111 111 ASN   ASN B . n 
C 1 1  MET   1  16  ?   ?     ?   C . n 
C 1 2  SER   2  17  ?   ?     ?   C . n 
C 1 3  GLN   3  18  18  GLN   GLN C . n 
C 1 4  ILE   4  19  19  ILE   ILE C . n 
C 1 5  PRO   5  20  20  PRO   PRO C . n 
C 1 6  ALA   6  21  21  ALA   ALA C . n 
C 1 7  SER   7  22  22  SER   SER C . n 
C 1 8  GLU   8  23  23  GLU   GLU C . n 
C 1 9  GLN   9  24  24  GLN   GLN C . n 
C 1 10 GLU   10 25  25  GLU   GLU C . n 
C 1 11 THR   11 26  26  THR   THR C . n 
C 1 12 LEU   12 27  27  LEU   LEU C . n 
C 1 13 VAL   13 28  28  VAL   VAL C . n 
C 1 14 ARG   14 29  29  ARG   ARG C . n 
C 1 15 PRO   15 30  30  PRO   PRO C . n 
C 1 16 LYS   16 31  31  LYS   LYS C . n 
C 1 17 PRO   17 32  32  PRO   PRO C . n 
C 1 18 LEU   18 33  33  LEU   LEU C . n 
C 1 19 LEU   19 34  34  LEU   LEU C . n 
C 1 20 LEU   20 35  35  LEU   LEU C . n 
C 1 21 LYS   21 36  36  LYS   LYS C . n 
C 1 22 LEU   22 37  37  LEU   LEU C . n 
C 1 23 LEU   23 38  38  LEU   LEU C . n 
C 1 24 LYS   24 39  39  LYS   LYS C . n 
C 1 25 SER   25 40  40  SER   SER C . n 
C 1 26 VAL   26 41  41  VAL   VAL C . n 
C 1 27 GLY   27 42  42  GLY   GLY C . n 
C 1 28 ALA   28 43  43  ALA   ALA C . n 
C 1 29 GLN   29 44  44  GLN   GLN C . n 
C 1 30 LYS   30 45  45  LYS   LYS C . n 
C 1 31 ASP   31 46  46  ASP   ASP C . n 
C 1 32 THR   32 47  47  THR   THR C . n 
C 1 33 TYR   33 48  48  TYR   TYR C . n 
C 1 34 THR   34 49  49  THR   THR C . n 
C 1 35 MET   35 50  50  MET   MET C . n 
C 1 36 LYS   36 51  51  LYS   LYS C . n 
C 1 37 GLU   37 52  52  GLU   GLU C . n 
C 1 38 VAL   38 53  53  VAL   VAL C . n 
C 1 39 LEU   39 54  54  LEU   LEU C . n 
C 1 40 PHE   40 55  55  PHE   PHE C . n 
C 1 41 TYR   41 56  56  TYR   TYR C . n 
C 1 42 LEU   42 57  57  LEU   LEU C . n 
C 1 43 GLY   43 58  58  GLY   GLY C . n 
C 1 44 GLN   44 59  59  GLN   GLN C . n 
C 1 45 TYR   45 60  60  TYR   TYR C . n 
C 1 46 ILE   46 61  61  ILE   ILE C . n 
C 1 47 MET   47 62  62  MET   MET C . n 
C 1 48 THR   48 63  63  THR   THR C . n 
C 1 49 LYS   49 64  64  LYS   LYS C . n 
C 1 50 ARG   50 65  65  ARG   ARG C . n 
C 1 51 LEU   51 66  66  LEU   LEU C . n 
C 1 52 TYR   52 67  67  TYR   TYR C . n 
C 1 53 ASP   53 68  68  ASP   ASP C . n 
C 1 54 GLU   54 69  69  GLU   GLU C . n 
C 1 55 LYS   55 70  70  LYS   LYS C . n 
C 1 56 GLN   56 71  71  GLN   GLN C . n 
C 1 57 GLN   57 72  72  GLN   GLN C . n 
C 1 58 HIS   58 73  73  HIS   HIS C . n 
C 1 59 ILE   59 74  74  ILE   ILE C . n 
C 1 60 VAL   60 75  75  VAL   VAL C . n 
C 1 61 TYR   61 76  76  TYR   TYR C . n 
C 1 62 CYS   62 77  77  CYS   CYS C . n 
C 1 63 SER   63 78  78  SER   SER C . n 
C 1 64 ASN   64 79  79  ASN   ASN C . n 
C 1 65 ASP   65 80  80  ASP   ASP C . n 
C 1 66 LEU   66 81  81  LEU   LEU C . n 
C 1 67 LEU   67 82  82  LEU   LEU C . n 
C 1 68 GLY   68 83  83  GLY   GLY C . n 
C 1 69 ASP   69 84  84  ASP   ASP C . n 
C 1 70 LEU   70 85  85  LEU   LEU C . n 
C 1 71 PHE   71 86  86  PHE   PHE C . n 
C 1 72 GLY   72 87  87  GLY   GLY C . n 
C 1 73 VAL   73 88  88  VAL   ALA C . n 
C 1 74 PRO   74 89  89  PRO   PRO C . n 
C 1 75 SER   75 90  90  SER   SER C . n 
C 1 76 PHE   76 91  91  PHE   PHE C . n 
C 1 77 SER   77 92  92  SER   SER C . n 
C 1 78 VAL   78 93  93  VAL   VAL C . n 
C 1 79 LYS   79 94  94  LYS   LYS C . n 
C 1 80 GLU   80 95  95  GLU   GLU C . n 
C 1 81 HIS   81 96  96  HIS   HIS C . n 
C 1 82 ARG   82 97  97  ARG   ARG C . n 
C 1 83 LYS   83 98  98  LYS   LYS C . n 
C 1 84 ILE   84 99  99  ILE   ILE C . n 
C 1 85 TYR   85 100 100 TYR   TYR C . n 
C 1 86 THR   86 101 101 THR   THR C . n 
C 1 87 MET   87 102 102 MET   MET C . n 
C 1 88 ILE   88 103 103 ILE   ILE C . n 
C 1 89 TYR   89 104 104 TYR   TYR C . n 
C 1 90 ARG   90 105 105 ARG   ARG C . n 
C 1 91 ASN   91 106 106 ASN   ASN C . n 
C 1 92 LEU   92 107 107 LEU   LEU C . n 
C 1 93 VAL   93 108 108 VAL   VAL C . n 
C 1 94 VAL   94 109 109 VAL   VAL C . n 
C 1 95 VAL   95 110 110 VAL   VAL C . n 
C 1 96 ASN   96 111 111 ASN   ASN C . n 
D 1 1  MET   1  16  ?   ?     ?   D . n 
D 1 2  SER   2  17  17  SER   SER D . n 
D 1 3  GLN   3  18  18  GLN   GLN D . n 
D 1 4  ILE   4  19  19  ILE   ILE D . n 
D 1 5  PRO   5  20  20  PRO   PRO D . n 
D 1 6  ALA   6  21  21  ALA   ALA D . n 
D 1 7  SER   7  22  22  SER   SER D . n 
D 1 8  GLU   8  23  23  GLU   GLU D . n 
D 1 9  GLN   9  24  24  GLN   GLN D . n 
D 1 10 GLU   10 25  25  GLU   GLU D . n 
D 1 11 THR   11 26  26  THR   THR D . n 
D 1 12 LEU   12 27  27  LEU   LEU D . n 
D 1 13 VAL   13 28  28  VAL   VAL D . n 
D 1 14 ARG   14 29  29  ARG   ARG D . n 
D 1 15 PRO   15 30  30  PRO   PRO D . n 
D 1 16 LYS   16 31  31  LYS   LYS D . n 
D 1 17 PRO   17 32  32  PRO   PRO D . n 
D 1 18 LEU   18 33  33  LEU   LEU D . n 
D 1 19 LEU   19 34  34  LEU   LEU D . n 
D 1 20 LEU   20 35  35  LEU   LEU D . n 
D 1 21 LYS   21 36  36  LYS   LYS D . n 
D 1 22 LEU   22 37  37  LEU   LEU D . n 
D 1 23 LEU   23 38  38  LEU   LEU D . n 
D 1 24 LYS   24 39  39  LYS   LYS D . n 
D 1 25 SER   25 40  40  SER   SER D . n 
D 1 26 VAL   26 41  41  VAL   VAL D . n 
D 1 27 GLY   27 42  42  GLY   GLY D . n 
D 1 28 ALA   28 43  43  ALA   ALA D . n 
D 1 29 GLN   29 44  44  GLN   GLN D . n 
D 1 30 LYS   30 45  45  LYS   LYS D . n 
D 1 31 ASP   31 46  46  ASP   ASP D . n 
D 1 32 THR   32 47  47  THR   THR D . n 
D 1 33 TYR   33 48  48  TYR   TYR D . n 
D 1 34 THR   34 49  49  THR   THR D . n 
D 1 35 MET   35 50  50  MET   MET D . n 
D 1 36 LYS   36 51  51  LYS   LYS D . n 
D 1 37 GLU   37 52  52  GLU   GLU D . n 
D 1 38 VAL   38 53  53  VAL   VAL D . n 
D 1 39 LEU   39 54  54  LEU   LEU D . n 
D 1 40 PHE   40 55  55  PHE   PHE D . n 
D 1 41 TYR   41 56  56  TYR   TYR D . n 
D 1 42 LEU   42 57  57  LEU   LEU D . n 
D 1 43 GLY   43 58  58  GLY   GLY D . n 
D 1 44 GLN   44 59  59  GLN   GLN D . n 
D 1 45 TYR   45 60  60  TYR   TYR D . n 
D 1 46 ILE   46 61  61  ILE   ILE D . n 
D 1 47 MET   47 62  62  MET   MET D . n 
D 1 48 THR   48 63  63  THR   THR D . n 
D 1 49 LYS   49 64  64  LYS   LYS D . n 
D 1 50 ARG   50 65  65  ARG   ARG D . n 
D 1 51 LEU   51 66  66  LEU   LEU D . n 
D 1 52 TYR   52 67  67  TYR   TYR D . n 
D 1 53 ASP   53 68  68  ASP   ASP D . n 
D 1 54 GLU   54 69  69  GLU   GLU D . n 
D 1 55 LYS   55 70  70  LYS   LYS D . n 
D 1 56 GLN   56 71  71  GLN   GLN D . n 
D 1 57 GLN   57 72  72  GLN   GLN D . n 
D 1 58 HIS   58 73  73  HIS   HIS D . n 
D 1 59 ILE   59 74  74  ILE   ILE D . n 
D 1 60 VAL   60 75  75  VAL   VAL D . n 
D 1 61 TYR   61 76  76  TYR   TYR D . n 
D 1 62 CYS   62 77  77  CYS   CYS D . n 
D 1 63 SER   63 78  78  SER   SER D . n 
D 1 64 ASN   64 79  79  ASN   ASN D . n 
D 1 65 ASP   65 80  80  ASP   ASP D . n 
D 1 66 LEU   66 81  81  LEU   LEU D . n 
D 1 67 LEU   67 82  82  LEU   LEU D . n 
D 1 68 GLY   68 83  83  GLY   GLY D . n 
D 1 69 ASP   69 84  84  ASP   ASP D . n 
D 1 70 LEU   70 85  85  LEU   LEU D . n 
D 1 71 PHE   71 86  86  PHE   PHE D . n 
D 1 72 GLY   72 87  87  GLY   GLY D . n 
D 1 73 VAL   73 88  88  VAL   ALA D . n 
D 1 74 PRO   74 89  89  PRO   PRO D . n 
D 1 75 SER   75 90  90  SER   SER D . n 
D 1 76 PHE   76 91  91  PHE   PHE D . n 
D 1 77 SER   77 92  92  SER   SER D . n 
D 1 78 VAL   78 93  93  VAL   VAL D . n 
D 1 79 LYS   79 94  94  LYS   LYS D . n 
D 1 80 GLU   80 95  95  GLU   GLU D . n 
D 1 81 HIS   81 96  96  HIS   HIS D . n 
D 1 82 ARG   82 97  97  ARG   ARG D . n 
D 1 83 LYS   83 98  98  LYS   LYS D . n 
D 1 84 ILE   84 99  99  ILE   ILE D . n 
D 1 85 TYR   85 100 100 TYR   TYR D . n 
D 1 86 THR   86 101 101 THR   THR D . n 
D 1 87 MET   87 102 102 MET   MET D . n 
D 1 88 ILE   88 103 103 ILE   ILE D . n 
D 1 89 TYR   89 104 104 TYR   TYR D . n 
D 1 90 ARG   90 105 105 ARG   ARG D . n 
D 1 91 ASN   91 106 106 ASN   ASN D . n 
D 1 92 LEU   92 107 107 LEU   LEU D . n 
D 1 93 VAL   93 108 108 VAL   VAL D . n 
D 1 94 VAL   94 109 109 VAL   VAL D . n 
D 1 95 VAL   95 110 110 VAL   VAL D . n 
D 1 96 ASN   96 111 111 ASN   ASN D . n 
E 2 1  THR   1  1   1   THR   191 J . n 
E 2 2  SER   2  2   1   SER   191 J . n 
E 2 3  PHE   3  3   1   PHE   191 J . n 
E 2 4  CYS   4  4   1   CYS   191 J . n 
E 2 5  GLU   5  5   1   GLU   191 J . n 
E 2 6  TYR   6  6   1   TYR   191 J . n 
E 2 7  TRP   7  7   1   TRP   191 J . n 
E 2 8  ALA   8  8   1   ALA   191 J . n 
E 2 9  URL   9  9   1   URL   191 J . n 
E 2 10 URL   10 10  1   URL   191 J . n 
E 2 11 A1IL6 11 11  1   A1IL6 191 J . n 
E 2 12 NH2   12 12  1   NH2   191 J . n 
F 2 1  THR   1  1   1   THR   191 F . n 
F 2 2  SER   2  2   1   SER   191 F . n 
F 2 3  PHE   3  3   1   PHE   191 F . n 
F 2 4  CYS   4  4   1   CYS   191 F . n 
F 2 5  GLU   5  5   1   GLU   191 F . n 
F 2 6  TYR   6  6   1   TYR   191 F . n 
F 2 7  TRP   7  7   1   TRP   191 F . n 
F 2 8  ALA   8  8   1   ALA   191 F . n 
F 2 9  URL   9  9   1   URL   191 F . n 
F 2 10 URL   10 10  1   URL   191 F . n 
F 2 11 A1IL6 11 11  1   A1IL6 191 F . n 
F 2 12 NH2   12 12  1   NH2   191 F . n 
G 2 1  THR   1  1   1   THR   191 G . n 
G 2 2  SER   2  2   1   SER   191 G . n 
G 2 3  PHE   3  3   1   PHE   191 G . n 
G 2 4  CYS   4  4   1   CYS   191 G . n 
G 2 5  GLU   5  5   1   GLU   191 G . n 
G 2 6  TYR   6  6   1   TYR   191 G . n 
G 2 7  TRP   7  7   1   TRP   191 G . n 
G 2 8  ALA   8  8   1   ALA   191 G . n 
G 2 9  URL   9  9   1   URL   191 G . n 
G 2 10 URL   10 10  1   URL   191 G . n 
G 2 11 A1IL6 11 11  1   A1IL6 191 G . n 
G 2 12 NH2   12 12  1   NH2   191 G . n 
H 2 1  THR   1  1   1   THR   191 H . n 
H 2 2  SER   2  2   1   SER   191 H . n 
H 2 3  PHE   3  3   1   PHE   191 H . n 
H 2 4  CYS   4  4   1   CYS   191 H . n 
H 2 5  GLU   5  5   1   GLU   191 H . n 
H 2 6  TYR   6  6   1   TYR   191 H . n 
H 2 7  TRP   7  7   1   TRP   191 H . n 
H 2 8  ALA   8  8   1   ALA   191 H . n 
H 2 9  URL   9  9   1   URL   191 H . n 
H 2 10 URL   10 10  1   URL   191 H . n 
H 2 11 A1IL6 11 11  1   A1IL6 191 H . n 
H 2 12 NH2   12 12  1   NH2   191 H . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 URL ? ? URL ? ? 'SUBJECT OF INVESTIGATION' ? 
2 URL ? ? URL ? ? 'SUBJECT OF INVESTIGATION' ? 
3 NH2 ? ? NH2 ? ? 'SUBJECT OF INVESTIGATION' ? 
4 URL ? ? URL ? ? 'SUBJECT OF INVESTIGATION' ? 
5 URL ? ? URL ? ? 'SUBJECT OF INVESTIGATION' ? 
6 URL ? ? URL ? ? 'SUBJECT OF INVESTIGATION' ? 
7 SO4 ? ? SO4 ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 
I 3 SO4 1   201 1   SO4 SO4 B . 
J 3 SO4 1   201 2   SO4 SO4 C . 
K 3 SO4 1   201 3   SO4 SO4 D . 
L 4 HOH 1   201 190 HOH HOH A . 
L 4 HOH 2   202 358 HOH HOH A . 
L 4 HOH 3   203 267 HOH HOH A . 
L 4 HOH 4   204 39  HOH HOH A . 
L 4 HOH 5   205 83  HOH HOH A . 
L 4 HOH 6   206 221 HOH HOH A . 
L 4 HOH 7   207 96  HOH HOH A . 
L 4 HOH 8   208 60  HOH HOH A . 
L 4 HOH 9   209 97  HOH HOH A . 
L 4 HOH 10  210 277 HOH HOH A . 
L 4 HOH 11  211 215 HOH HOH A . 
L 4 HOH 12  212 155 HOH HOH A . 
L 4 HOH 13  213 248 HOH HOH A . 
L 4 HOH 14  214 114 HOH HOH A . 
L 4 HOH 15  215 360 HOH HOH A . 
L 4 HOH 16  216 90  HOH HOH A . 
L 4 HOH 17  217 182 HOH HOH A . 
L 4 HOH 18  218 3   HOH HOH A . 
L 4 HOH 19  219 41  HOH HOH A . 
L 4 HOH 20  220 115 HOH HOH A . 
L 4 HOH 21  221 85  HOH HOH A . 
L 4 HOH 22  222 64  HOH HOH A . 
L 4 HOH 23  223 224 HOH HOH A . 
L 4 HOH 24  224 37  HOH HOH A . 
L 4 HOH 25  225 4   HOH HOH A . 
L 4 HOH 26  226 133 HOH HOH A . 
L 4 HOH 27  227 71  HOH HOH A . 
L 4 HOH 28  228 174 HOH HOH A . 
L 4 HOH 29  229 169 HOH HOH A . 
L 4 HOH 30  230 283 HOH HOH A . 
L 4 HOH 31  231 379 HOH HOH A . 
L 4 HOH 32  232 196 HOH HOH A . 
L 4 HOH 33  233 209 HOH HOH A . 
L 4 HOH 34  234 311 HOH HOH A . 
L 4 HOH 35  235 146 HOH HOH A . 
L 4 HOH 36  236 252 HOH HOH A . 
L 4 HOH 37  237 310 HOH HOH A . 
L 4 HOH 38  238 268 HOH HOH A . 
L 4 HOH 39  239 170 HOH HOH A . 
L 4 HOH 40  240 139 HOH HOH A . 
L 4 HOH 41  241 219 HOH HOH A . 
L 4 HOH 42  242 237 HOH HOH A . 
L 4 HOH 43  243 159 HOH HOH A . 
L 4 HOH 44  244 154 HOH HOH A . 
L 4 HOH 45  245 152 HOH HOH A . 
L 4 HOH 46  246 103 HOH HOH A . 
L 4 HOH 47  247 136 HOH HOH A . 
L 4 HOH 48  248 287 HOH HOH A . 
L 4 HOH 49  249 389 HOH HOH A . 
L 4 HOH 50  250 349 HOH HOH A . 
L 4 HOH 51  251 372 HOH HOH A . 
L 4 HOH 52  252 240 HOH HOH A . 
L 4 HOH 53  253 345 HOH HOH A . 
L 4 HOH 54  254 326 HOH HOH A . 
L 4 HOH 55  255 249 HOH HOH A . 
L 4 HOH 56  256 398 HOH HOH A . 
L 4 HOH 57  257 331 HOH HOH A . 
L 4 HOH 58  258 309 HOH HOH A . 
L 4 HOH 59  259 183 HOH HOH A . 
L 4 HOH 60  260 247 HOH HOH A . 
L 4 HOH 61  261 162 HOH HOH A . 
L 4 HOH 62  262 102 HOH HOH A . 
L 4 HOH 63  263 370 HOH HOH A . 
L 4 HOH 64  264 164 HOH HOH A . 
L 4 HOH 65  265 201 HOH HOH A . 
L 4 HOH 66  266 5   HOH HOH A . 
L 4 HOH 67  267 338 HOH HOH A . 
L 4 HOH 68  268 22  HOH HOH A . 
L 4 HOH 69  269 105 HOH HOH A . 
L 4 HOH 70  270 225 HOH HOH A . 
L 4 HOH 71  271 24  HOH HOH A . 
L 4 HOH 72  272 266 HOH HOH A . 
L 4 HOH 73  273 412 HOH HOH A . 
L 4 HOH 74  274 163 HOH HOH A . 
L 4 HOH 75  275 243 HOH HOH A . 
L 4 HOH 76  276 118 HOH HOH A . 
L 4 HOH 77  277 300 HOH HOH A . 
L 4 HOH 78  278 63  HOH HOH A . 
L 4 HOH 79  279 78  HOH HOH A . 
L 4 HOH 80  280 66  HOH HOH A . 
L 4 HOH 81  281 61  HOH HOH A . 
L 4 HOH 82  282 238 HOH HOH A . 
M 4 HOH 1   301 141 HOH HOH B . 
M 4 HOH 2   302 173 HOH HOH B . 
M 4 HOH 3   303 210 HOH HOH B . 
M 4 HOH 4   304 47  HOH HOH B . 
M 4 HOH 5   305 341 HOH HOH B . 
M 4 HOH 6   306 304 HOH HOH B . 
M 4 HOH 7   307 236 HOH HOH B . 
M 4 HOH 8   308 2   HOH HOH B . 
M 4 HOH 9   309 13  HOH HOH B . 
M 4 HOH 10  310 251 HOH HOH B . 
M 4 HOH 11  311 19  HOH HOH B . 
M 4 HOH 12  312 108 HOH HOH B . 
M 4 HOH 13  313 356 HOH HOH B . 
M 4 HOH 14  314 187 HOH HOH B . 
M 4 HOH 15  315 77  HOH HOH B . 
M 4 HOH 16  316 415 HOH HOH B . 
M 4 HOH 17  317 55  HOH HOH B . 
M 4 HOH 18  318 86  HOH HOH B . 
M 4 HOH 19  319 33  HOH HOH B . 
M 4 HOH 20  320 138 HOH HOH B . 
M 4 HOH 21  321 124 HOH HOH B . 
M 4 HOH 22  322 200 HOH HOH B . 
M 4 HOH 23  323 113 HOH HOH B . 
M 4 HOH 24  324 288 HOH HOH B . 
M 4 HOH 25  325 346 HOH HOH B . 
M 4 HOH 26  326 222 HOH HOH B . 
M 4 HOH 27  327 32  HOH HOH B . 
M 4 HOH 28  328 134 HOH HOH B . 
M 4 HOH 29  329 234 HOH HOH B . 
M 4 HOH 30  330 417 HOH HOH B . 
M 4 HOH 31  331 93  HOH HOH B . 
M 4 HOH 32  332 72  HOH HOH B . 
M 4 HOH 33  333 318 HOH HOH B . 
M 4 HOH 34  334 231 HOH HOH B . 
M 4 HOH 35  335 317 HOH HOH B . 
M 4 HOH 36  336 153 HOH HOH B . 
M 4 HOH 37  337 91  HOH HOH B . 
M 4 HOH 38  338 177 HOH HOH B . 
M 4 HOH 39  339 373 HOH HOH B . 
M 4 HOH 40  340 367 HOH HOH B . 
M 4 HOH 41  341 38  HOH HOH B . 
M 4 HOH 42  342 175 HOH HOH B . 
M 4 HOH 43  343 89  HOH HOH B . 
M 4 HOH 44  344 121 HOH HOH B . 
M 4 HOH 45  345 125 HOH HOH B . 
M 4 HOH 46  346 335 HOH HOH B . 
M 4 HOH 47  347 95  HOH HOH B . 
M 4 HOH 48  348 149 HOH HOH B . 
M 4 HOH 49  349 31  HOH HOH B . 
M 4 HOH 50  350 84  HOH HOH B . 
M 4 HOH 51  351 262 HOH HOH B . 
M 4 HOH 52  352 202 HOH HOH B . 
M 4 HOH 53  353 111 HOH HOH B . 
M 4 HOH 54  354 178 HOH HOH B . 
M 4 HOH 55  355 295 HOH HOH B . 
M 4 HOH 56  356 186 HOH HOH B . 
M 4 HOH 57  357 106 HOH HOH B . 
M 4 HOH 58  358 208 HOH HOH B . 
M 4 HOH 59  359 387 HOH HOH B . 
M 4 HOH 60  360 53  HOH HOH B . 
M 4 HOH 61  361 142 HOH HOH B . 
M 4 HOH 62  362 144 HOH HOH B . 
M 4 HOH 63  363 228 HOH HOH B . 
M 4 HOH 64  364 246 HOH HOH B . 
M 4 HOH 65  365 192 HOH HOH B . 
M 4 HOH 66  366 165 HOH HOH B . 
M 4 HOH 67  367 157 HOH HOH B . 
M 4 HOH 68  368 339 HOH HOH B . 
M 4 HOH 69  369 299 HOH HOH B . 
M 4 HOH 70  370 100 HOH HOH B . 
M 4 HOH 71  371 116 HOH HOH B . 
M 4 HOH 72  372 327 HOH HOH B . 
M 4 HOH 73  373 330 HOH HOH B . 
M 4 HOH 74  374 385 HOH HOH B . 
M 4 HOH 75  375 347 HOH HOH B . 
M 4 HOH 76  376 371 HOH HOH B . 
M 4 HOH 77  377 384 HOH HOH B . 
M 4 HOH 78  378 191 HOH HOH B . 
M 4 HOH 79  379 271 HOH HOH B . 
M 4 HOH 80  380 414 HOH HOH B . 
M 4 HOH 81  381 303 HOH HOH B . 
M 4 HOH 82  382 312 HOH HOH B . 
M 4 HOH 83  383 260 HOH HOH B . 
M 4 HOH 84  384 411 HOH HOH B . 
M 4 HOH 85  385 253 HOH HOH B . 
M 4 HOH 86  386 342 HOH HOH B . 
M 4 HOH 87  387 336 HOH HOH B . 
M 4 HOH 88  388 306 HOH HOH B . 
M 4 HOH 89  389 366 HOH HOH B . 
M 4 HOH 90  390 319 HOH HOH B . 
M 4 HOH 91  391 220 HOH HOH B . 
M 4 HOH 92  392 188 HOH HOH B . 
M 4 HOH 93  393 399 HOH HOH B . 
M 4 HOH 94  394 359 HOH HOH B . 
M 4 HOH 95  395 203 HOH HOH B . 
M 4 HOH 96  396 292 HOH HOH B . 
M 4 HOH 97  397 259 HOH HOH B . 
M 4 HOH 98  398 302 HOH HOH B . 
M 4 HOH 99  399 407 HOH HOH B . 
M 4 HOH 100 400 258 HOH HOH B . 
M 4 HOH 101 401 395 HOH HOH B . 
M 4 HOH 102 402 227 HOH HOH B . 
M 4 HOH 103 403 131 HOH HOH B . 
N 4 HOH 1   301 323 HOH HOH C . 
N 4 HOH 2   302 270 HOH HOH C . 
N 4 HOH 3   303 198 HOH HOH C . 
N 4 HOH 4   304 296 HOH HOH C . 
N 4 HOH 5   305 48  HOH HOH C . 
N 4 HOH 6   306 402 HOH HOH C . 
N 4 HOH 7   307 26  HOH HOH C . 
N 4 HOH 8   308 213 HOH HOH C . 
N 4 HOH 9   309 229 HOH HOH C . 
N 4 HOH 10  310 74  HOH HOH C . 
N 4 HOH 11  311 410 HOH HOH C . 
N 4 HOH 12  312 73  HOH HOH C . 
N 4 HOH 13  313 69  HOH HOH C . 
N 4 HOH 14  314 244 HOH HOH C . 
N 4 HOH 15  315 6   HOH HOH C . 
N 4 HOH 16  316 98  HOH HOH C . 
N 4 HOH 17  317 375 HOH HOH C . 
N 4 HOH 18  318 119 HOH HOH C . 
N 4 HOH 19  319 403 HOH HOH C . 
N 4 HOH 20  320 140 HOH HOH C . 
N 4 HOH 21  321 17  HOH HOH C . 
N 4 HOH 22  322 67  HOH HOH C . 
N 4 HOH 23  323 168 HOH HOH C . 
N 4 HOH 24  324 413 HOH HOH C . 
N 4 HOH 25  325 62  HOH HOH C . 
N 4 HOH 26  326 54  HOH HOH C . 
N 4 HOH 27  327 381 HOH HOH C . 
N 4 HOH 28  328 363 HOH HOH C . 
N 4 HOH 29  329 171 HOH HOH C . 
N 4 HOH 30  330 45  HOH HOH C . 
N 4 HOH 31  331 396 HOH HOH C . 
N 4 HOH 32  332 289 HOH HOH C . 
N 4 HOH 33  333 20  HOH HOH C . 
N 4 HOH 34  334 419 HOH HOH C . 
N 4 HOH 35  335 391 HOH HOH C . 
N 4 HOH 36  336 421 HOH HOH C . 
N 4 HOH 37  337 377 HOH HOH C . 
N 4 HOH 38  338 406 HOH HOH C . 
N 4 HOH 39  339 320 HOH HOH C . 
N 4 HOH 40  340 184 HOH HOH C . 
N 4 HOH 41  341 80  HOH HOH C . 
N 4 HOH 42  342 180 HOH HOH C . 
N 4 HOH 43  343 156 HOH HOH C . 
N 4 HOH 44  344 117 HOH HOH C . 
N 4 HOH 45  345 104 HOH HOH C . 
N 4 HOH 46  346 204 HOH HOH C . 
N 4 HOH 47  347 383 HOH HOH C . 
N 4 HOH 48  348 284 HOH HOH C . 
N 4 HOH 49  349 158 HOH HOH C . 
N 4 HOH 50  350 257 HOH HOH C . 
N 4 HOH 51  351 361 HOH HOH C . 
N 4 HOH 52  352 265 HOH HOH C . 
N 4 HOH 53  353 59  HOH HOH C . 
N 4 HOH 54  354 316 HOH HOH C . 
N 4 HOH 55  355 350 HOH HOH C . 
N 4 HOH 56  356 176 HOH HOH C . 
N 4 HOH 57  357 307 HOH HOH C . 
N 4 HOH 58  358 52  HOH HOH C . 
N 4 HOH 59  359 294 HOH HOH C . 
N 4 HOH 60  360 401 HOH HOH C . 
N 4 HOH 61  361 314 HOH HOH C . 
N 4 HOH 62  362 143 HOH HOH C . 
N 4 HOH 63  363 94  HOH HOH C . 
N 4 HOH 64  364 333 HOH HOH C . 
N 4 HOH 65  365 386 HOH HOH C . 
N 4 HOH 66  366 329 HOH HOH C . 
N 4 HOH 67  367 364 HOH HOH C . 
N 4 HOH 68  368 355 HOH HOH C . 
N 4 HOH 69  369 344 HOH HOH C . 
N 4 HOH 70  370 390 HOH HOH C . 
N 4 HOH 71  371 416 HOH HOH C . 
N 4 HOH 72  372 286 HOH HOH C . 
N 4 HOH 73  373 250 HOH HOH C . 
N 4 HOH 74  374 400 HOH HOH C . 
N 4 HOH 75  375 393 HOH HOH C . 
N 4 HOH 76  376 392 HOH HOH C . 
N 4 HOH 77  377 315 HOH HOH C . 
N 4 HOH 78  378 81  HOH HOH C . 
N 4 HOH 79  379 269 HOH HOH C . 
N 4 HOH 80  380 205 HOH HOH C . 
N 4 HOH 81  381 405 HOH HOH C . 
N 4 HOH 82  382 30  HOH HOH C . 
N 4 HOH 83  383 130 HOH HOH C . 
N 4 HOH 84  384 388 HOH HOH C . 
O 4 HOH 1   301 321 HOH HOH D . 
O 4 HOH 2   302 340 HOH HOH D . 
O 4 HOH 3   303 65  HOH HOH D . 
O 4 HOH 4   304 193 HOH HOH D . 
O 4 HOH 5   305 57  HOH HOH D . 
O 4 HOH 6   306 218 HOH HOH D . 
O 4 HOH 7   307 43  HOH HOH D . 
O 4 HOH 8   308 49  HOH HOH D . 
O 4 HOH 9   309 167 HOH HOH D . 
O 4 HOH 10  310 18  HOH HOH D . 
O 4 HOH 11  311 23  HOH HOH D . 
O 4 HOH 12  312 120 HOH HOH D . 
O 4 HOH 13  313 275 HOH HOH D . 
O 4 HOH 14  314 70  HOH HOH D . 
O 4 HOH 15  315 290 HOH HOH D . 
O 4 HOH 16  316 44  HOH HOH D . 
O 4 HOH 17  317 282 HOH HOH D . 
O 4 HOH 18  318 404 HOH HOH D . 
O 4 HOH 19  319 21  HOH HOH D . 
O 4 HOH 20  320 382 HOH HOH D . 
O 4 HOH 21  321 408 HOH HOH D . 
O 4 HOH 22  322 216 HOH HOH D . 
O 4 HOH 23  323 313 HOH HOH D . 
O 4 HOH 24  324 378 HOH HOH D . 
O 4 HOH 25  325 281 HOH HOH D . 
O 4 HOH 26  326 189 HOH HOH D . 
O 4 HOH 27  327 75  HOH HOH D . 
O 4 HOH 28  328 185 HOH HOH D . 
O 4 HOH 29  329 112 HOH HOH D . 
O 4 HOH 30  330 352 HOH HOH D . 
O 4 HOH 31  331 214 HOH HOH D . 
O 4 HOH 32  332 109 HOH HOH D . 
O 4 HOH 33  333 16  HOH HOH D . 
O 4 HOH 34  334 293 HOH HOH D . 
O 4 HOH 35  335 128 HOH HOH D . 
O 4 HOH 36  336 325 HOH HOH D . 
O 4 HOH 37  337 122 HOH HOH D . 
O 4 HOH 38  338 206 HOH HOH D . 
O 4 HOH 39  339 123 HOH HOH D . 
O 4 HOH 40  340 343 HOH HOH D . 
O 4 HOH 41  341 29  HOH HOH D . 
O 4 HOH 42  342 348 HOH HOH D . 
O 4 HOH 43  343 172 HOH HOH D . 
O 4 HOH 44  344 126 HOH HOH D . 
O 4 HOH 45  345 394 HOH HOH D . 
O 4 HOH 46  346 369 HOH HOH D . 
O 4 HOH 47  347 276 HOH HOH D . 
O 4 HOH 48  348 12  HOH HOH D . 
O 4 HOH 49  349 242 HOH HOH D . 
O 4 HOH 50  350 58  HOH HOH D . 
O 4 HOH 51  351 50  HOH HOH D . 
O 4 HOH 52  352 374 HOH HOH D . 
O 4 HOH 53  353 25  HOH HOH D . 
O 4 HOH 54  354 132 HOH HOH D . 
O 4 HOH 55  355 280 HOH HOH D . 
O 4 HOH 56  356 217 HOH HOH D . 
O 4 HOH 57  357 261 HOH HOH D . 
O 4 HOH 58  358 34  HOH HOH D . 
O 4 HOH 59  359 264 HOH HOH D . 
O 4 HOH 60  360 241 HOH HOH D . 
O 4 HOH 61  361 161 HOH HOH D . 
O 4 HOH 62  362 332 HOH HOH D . 
O 4 HOH 63  363 150 HOH HOH D . 
O 4 HOH 64  364 397 HOH HOH D . 
O 4 HOH 65  365 368 HOH HOH D . 
O 4 HOH 66  366 420 HOH HOH D . 
O 4 HOH 67  367 298 HOH HOH D . 
O 4 HOH 68  368 376 HOH HOH D . 
O 4 HOH 69  369 308 HOH HOH D . 
O 4 HOH 70  370 254 HOH HOH D . 
O 4 HOH 71  371 255 HOH HOH D . 
O 4 HOH 72  372 273 HOH HOH D . 
O 4 HOH 73  373 232 HOH HOH D . 
O 4 HOH 74  374 68  HOH HOH D . 
O 4 HOH 75  375 365 HOH HOH D . 
O 4 HOH 76  376 135 HOH HOH D . 
O 4 HOH 77  377 272 HOH HOH D . 
O 4 HOH 78  378 226 HOH HOH D . 
O 4 HOH 79  379 129 HOH HOH D . 
O 4 HOH 80  380 137 HOH HOH D . 
O 4 HOH 81  381 195 HOH HOH D . 
O 4 HOH 82  382 194 HOH HOH D . 
O 4 HOH 83  383 211 HOH HOH D . 
O 4 HOH 84  384 328 HOH HOH D . 
O 4 HOH 85  385 239 HOH HOH D . 
P 4 HOH 1   101 46  HOH HOH J . 
P 4 HOH 2   102 40  HOH HOH J . 
P 4 HOH 3   103 179 HOH HOH J . 
P 4 HOH 4   104 199 HOH HOH J . 
P 4 HOH 5   105 42  HOH HOH J . 
P 4 HOH 6   106 7   HOH HOH J . 
P 4 HOH 7   107 166 HOH HOH J . 
P 4 HOH 8   108 10  HOH HOH J . 
P 4 HOH 9   109 148 HOH HOH J . 
P 4 HOH 10  110 274 HOH HOH J . 
P 4 HOH 11  111 334 HOH HOH J . 
P 4 HOH 12  112 233 HOH HOH J . 
P 4 HOH 13  113 145 HOH HOH J . 
P 4 HOH 14  114 76  HOH HOH J . 
Q 4 HOH 1   101 197 HOH HOH F . 
Q 4 HOH 2   102 291 HOH HOH F . 
Q 4 HOH 3   103 27  HOH HOH F . 
Q 4 HOH 4   104 278 HOH HOH F . 
Q 4 HOH 5   105 101 HOH HOH F . 
Q 4 HOH 6   106 324 HOH HOH F . 
Q 4 HOH 7   107 1   HOH HOH F . 
Q 4 HOH 8   108 235 HOH HOH F . 
Q 4 HOH 9   109 285 HOH HOH F . 
Q 4 HOH 10  110 230 HOH HOH F . 
Q 4 HOH 11  111 301 HOH HOH F . 
Q 4 HOH 12  112 380 HOH HOH F . 
Q 4 HOH 13  113 99  HOH HOH F . 
Q 4 HOH 14  114 147 HOH HOH F . 
R 4 HOH 1   101 297 HOH HOH G . 
R 4 HOH 2   102 56  HOH HOH G . 
R 4 HOH 3   103 207 HOH HOH G . 
R 4 HOH 4   104 28  HOH HOH G . 
R 4 HOH 5   105 110 HOH HOH G . 
R 4 HOH 6   106 14  HOH HOH G . 
R 4 HOH 7   107 107 HOH HOH G . 
R 4 HOH 8   108 87  HOH HOH G . 
R 4 HOH 9   109 305 HOH HOH G . 
R 4 HOH 10  110 223 HOH HOH G . 
R 4 HOH 11  111 362 HOH HOH G . 
R 4 HOH 12  112 418 HOH HOH G . 
R 4 HOH 13  113 263 HOH HOH G . 
R 4 HOH 14  114 82  HOH HOH G . 
R 4 HOH 15  115 409 HOH HOH G . 
S 4 HOH 1   101 15  HOH HOH H . 
S 4 HOH 2   102 212 HOH HOH H . 
S 4 HOH 3   103 51  HOH HOH H . 
S 4 HOH 4   104 279 HOH HOH H . 
S 4 HOH 5   105 88  HOH HOH H . 
S 4 HOH 6   106 8   HOH HOH H . 
S 4 HOH 7   107 79  HOH HOH H . 
S 4 HOH 8   108 9   HOH HOH H . 
S 4 HOH 9   109 35  HOH HOH H . 
S 4 HOH 10  110 245 HOH HOH H . 
S 4 HOH 11  111 92  HOH HOH H . 
S 4 HOH 12  112 11  HOH HOH H . 
S 4 HOH 13  113 337 HOH HOH H . 
S 4 HOH 14  114 36  HOH HOH H . 
S 4 HOH 15  115 256 HOH HOH H . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1 1 Y 1 A VAL 88 ? CG1 ? A VAL 73 CG1 
2 1 Y 1 A VAL 88 ? CG2 ? A VAL 73 CG2 
3 1 Y 1 B VAL 88 ? CG1 ? B VAL 73 CG1 
4 1 Y 1 B VAL 88 ? CG2 ? B VAL 73 CG2 
5 1 Y 1 C VAL 88 ? CG1 ? C VAL 73 CG1 
6 1 Y 1 C VAL 88 ? CG2 ? C VAL 73 CG2 
7 1 Y 1 D VAL 88 ? CG1 ? D VAL 73 CG1 
8 1 Y 1 D VAL 88 ? CG2 ? D VAL 73 CG2 
# 
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       ? ? ? ? ? ? ? ? ? ? ? BUSTER ? ? ? 2.10.4 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .      2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .      3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .      4 
# 
_cell.angle_alpha                  90 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   96.97 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9GFK 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     39.565 
_cell.length_a_esd                 ? 
_cell.length_b                     109.557 
_cell.length_b_esd                 ? 
_cell.length_c                     58.713 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_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                         9GFK 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_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                   9GFK 
_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             2.48 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          50.48 
_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, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              5.5 
_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    'Ammonium Sulfate 2.5M + MES 0.1M pH5.5' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            290 
# 
_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         2021-09-12 
_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   0.978566 
_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                        'SOLEIL BEAMLINE PROXIMA 1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.978566 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   'PROXIMA 1' 
_diffrn_source.pdbx_synchrotron_site       SOLEIL 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9GFK 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.84 
_reflns.d_resolution_low                               34.57 
_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                                     224410 
_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                           99.2 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                2.64 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          8.53 
_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                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_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                              0.0715 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_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                                    1.84 
_reflns_shell.d_res_low                                     1.94 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             11910 
_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                               2.49 
_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                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  ? 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          98 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  0.5679 
_reflns_shell.pdbx_Rsym_value                               ? 
_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]                            -0.1339 
_refine.aniso_B[1][2]                            0 
_refine.aniso_B[1][3]                            -0.0547 
_refine.aniso_B[2][2]                            0.205 
_refine.aniso_B[2][3]                            0 
_refine.aniso_B[3][3]                            -0.0711 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               33.03 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.956 
_refine.correlation_coeff_Fo_to_Fc_free          0.939 
_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                                 9GFK 
_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                            1.841 
_refine.ls_d_res_low                             34.57 
_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                     42753 
_refine.ls_number_reflns_R_free                  2059 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.6 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2023 
_refine.ls_R_factor_R_free                       0.2394 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2004 
_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                    ? 
_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                          ? 
_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               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_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                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   0.134 
_refine.pdbx_overall_SU_R_free_Blow_DPI          0.137 
_refine.pdbx_overall_SU_R_Blow_DPI               0.149 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            ? 
_refine.overall_SU_R_Cruickshank_DPI             0.142 
_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_analyze.entry_id                        9GFK 
_refine_analyze.pdbx_refine_id                  'X-RAY DIFFRACTION' 
_refine_analyze.Luzzati_coordinate_error_free   ? 
_refine_analyze.Luzzati_coordinate_error_obs    0.23 
_refine_analyze.Luzzati_d_res_low_free          ? 
_refine_analyze.Luzzati_d_res_low_obs           ? 
_refine_analyze.Luzzati_sigma_a_free            ? 
_refine_analyze.Luzzati_sigma_a_free_details    ? 
_refine_analyze.Luzzati_sigma_a_obs             ? 
_refine_analyze.Luzzati_sigma_a_obs_details     ? 
_refine_analyze.number_disordered_residues      ? 
_refine_analyze.occupancy_sum_hydrogen          ? 
_refine_analyze.occupancy_sum_non_hydrogen      ? 
_refine_analyze.RG_d_res_high                   ? 
_refine_analyze.RG_d_res_low                    ? 
_refine_analyze.RG_free                         ? 
_refine_analyze.RG_work                         ? 
_refine_analyze.RG_free_work_ratio              ? 
_refine_analyze.pdbx_Luzzati_d_res_high_obs     ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.841 
_refine_hist.d_res_low                        34.57 
_refine_hist.number_atoms_solvent             412 
_refine_hist.number_atoms_total               3957 
_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        3110 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         435 
_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' ? 0.008 ? 3660 ? t_bond_d                  2  HARMONIC     
'X-RAY DIFFRACTION' ? 0.9   ? 4945 ? t_angle_deg               2  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 1421 ? t_dihedral_angle_d        2  SINUSOIDAL   
'X-RAY DIFFRACTION' ? ?     ? 693  ? t_gen_planes              5  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 3660 ? t_it                      10 HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 460  ? t_chiral_improper_torsion 5  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? ?     ? 3530 ? t_ideal_dist_contact      4  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? 3.65  ? ?    ? t_omega_torsion           ?  ?            
'X-RAY DIFFRACTION' ? 18.11 ? ?    ? t_other_torsion           ?  ?            
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       1.841 
_refine_ls_shell.d_res_low                        1.85 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             34 
_refine_ls_shell.number_reflns_R_work             ? 
_refine_ls_shell.percent_reflns_obs               84.58 
_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                  0.3198 
_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                  0.376 
# 
_struct.entry_id                     9GFK 
_struct.title                        'human MDM2 complex with stapled foldamer' 
_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        9GFK 
_struct_keywords.text            'HDM2, staple peptide, helical Peptide-foldamer, LIGASE' 
_struct_keywords.pdbx_keywords   LIGASE 
# 
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 1 ? 
D N N 1 ? 
E N N 2 ? 
F N N 2 ? 
G N N 2 ? 
H N N 2 ? 
I N N 3 ? 
J N N 3 ? 
K N N 3 ? 
L N N 4 ? 
M N N 4 ? 
N N N 4 ? 
O N N 4 ? 
P N N 4 ? 
Q N N 4 ? 
R N N 4 ? 
S N N 4 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP MDM2_HUMAN Q00987 ? 1 
;SQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEH
RKIYTMIYRNLVVVN
;
17 
2 PDB 9GFK       9GFK   ? 2 ?                                                                                                  1  
# 
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 9GFK A 2 ? 96 ? Q00987 17 ? 111 ? 17 111 
2 1 9GFK B 2 ? 96 ? Q00987 17 ? 111 ? 17 111 
3 1 9GFK C 2 ? 96 ? Q00987 17 ? 111 ? 17 111 
4 1 9GFK D 2 ? 96 ? Q00987 17 ? 111 ? 17 111 
5 2 9GFK J 1 ? 12 ? 9GFK   1  ? 12  ? 1  12  
6 2 9GFK F 1 ? 12 ? 9GFK   1  ? 12  ? 1  12  
7 2 9GFK G 1 ? 12 ? 9GFK   1  ? 12  ? 1  12  
8 2 9GFK H 1 ? 12 ? 9GFK   1  ? 12  ? 1  12  
# 
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 9GFK MET A 1 ? UNP Q00987 ? ? 'initiating methionine' 16 1 
2 9GFK MET B 1 ? UNP Q00987 ? ? 'initiating methionine' 16 2 
3 9GFK MET C 1 ? UNP Q00987 ? ? 'initiating methionine' 16 3 
4 9GFK MET D 1 ? UNP Q00987 ? ? 'initiating methionine' 16 4 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   octameric 
_pdbx_struct_assembly.oligomeric_count     8 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'NMR Distance Restraints' 
_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 SER A 7  ? GLU A 10 ? SER A 22 GLU A 25  5 ? 4  
HELX_P HELX_P2  AA2 LYS A 16 ? VAL A 26 ? LYS A 31 VAL A 41  1 ? 11 
HELX_P HELX_P3  AA3 MET A 35 ? LYS A 49 ? MET A 50 LYS A 64  1 ? 15 
HELX_P HELX_P4  AA4 ASP A 65 ? GLY A 72 ? ASP A 80 GLY A 87  1 ? 8  
HELX_P HELX_P5  AA5 GLU A 80 ? ASN A 91 ? GLU A 95 ASN A 106 1 ? 12 
HELX_P HELX_P6  AA6 SER B 7  ? GLU B 10 ? SER B 22 GLU B 25  5 ? 4  
HELX_P HELX_P7  AA7 LYS B 16 ? VAL B 26 ? LYS B 31 VAL B 41  1 ? 11 
HELX_P HELX_P8  AA8 MET B 35 ? ARG B 50 ? MET B 50 ARG B 65  1 ? 16 
HELX_P HELX_P9  AA9 ASP B 65 ? GLY B 72 ? ASP B 80 GLY B 87  1 ? 8  
HELX_P HELX_P10 AB1 GLU B 80 ? ASN B 91 ? GLU B 95 ASN B 106 1 ? 12 
HELX_P HELX_P11 AB2 LYS C 16 ? VAL C 26 ? LYS C 31 VAL C 41  1 ? 11 
HELX_P HELX_P12 AB3 MET C 35 ? LYS C 49 ? MET C 50 LYS C 64  1 ? 15 
HELX_P HELX_P13 AB4 ASP C 65 ? GLY C 72 ? ASP C 80 GLY C 87  1 ? 8  
HELX_P HELX_P14 AB5 GLU C 80 ? ASN C 91 ? GLU C 95 ASN C 106 1 ? 12 
HELX_P HELX_P15 AB6 SER D 7  ? GLU D 10 ? SER D 22 GLU D 25  5 ? 4  
HELX_P HELX_P16 AB7 LYS D 16 ? VAL D 26 ? LYS D 31 VAL D 41  1 ? 11 
HELX_P HELX_P17 AB8 MET D 35 ? LYS D 49 ? MET D 50 LYS D 64  1 ? 15 
HELX_P HELX_P18 AB9 ASP D 65 ? GLY D 72 ? ASP D 80 GLY D 87  1 ? 8  
HELX_P HELX_P19 AC1 GLU D 80 ? ARG D 90 ? GLU D 95 ARG D 105 1 ? 11 
HELX_P HELX_P20 AC2 SER E 2  ? URL E 9  ? SER J 2  URL J 9   1 ? 8  
HELX_P HELX_P21 AC3 SER F 2  ? URL F 9  ? SER F 2  URL F 9   1 ? 8  
HELX_P HELX_P22 AC4 SER G 2  ? URL G 9  ? SER G 2  URL G 9   1 ? 8  
HELX_P HELX_P23 AC5 SER H 2  ? URL H 9  ? SER H 2  URL H 9   1 ? 8  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1  covale one  ? E CYS   4  SG ? ? ? 1_555 E A1IL6 11 C17 ? ? J CYS   4  J A1IL6 11 1_555 ? ? ? ? ? ? ? 1.809 ? ? 
covale2  covale both ? E ALA   8  C  ? ? ? 1_555 E URL   9  N   ? ? J ALA   8  J URL   9  1_555 ? ? ? ? ? ? ? 1.341 ? ? 
covale3  covale both ? E URL   9  C  ? ? ? 1_555 E URL   10 N   ? ? J URL   9  J URL   10 1_555 ? ? ? ? ? ? ? 1.349 ? ? 
covale4  covale both ? E URL   10 C  ? ? ? 1_555 E A1IL6 11 N   ? ? J URL   10 J A1IL6 11 1_555 ? ? ? ? ? ? ? 1.372 ? ? 
covale5  covale both ? E A1IL6 11 C  ? ? ? 1_555 E NH2   12 N   ? ? J A1IL6 11 J NH2   12 1_555 ? ? ? ? ? ? ? 1.325 ? ? 
covale6  covale one  ? F CYS   4  SG ? ? ? 1_555 F A1IL6 11 C17 ? ? F CYS   4  F A1IL6 11 1_555 ? ? ? ? ? ? ? 1.821 ? ? 
covale7  covale both ? F ALA   8  C  ? ? ? 1_555 F URL   9  N   ? ? F ALA   8  F URL   9  1_555 ? ? ? ? ? ? ? 1.340 ? ? 
covale8  covale both ? F URL   9  C  ? ? ? 1_555 F URL   10 N   ? ? F URL   9  F URL   10 1_555 ? ? ? ? ? ? ? 1.354 ? ? 
covale9  covale both ? F URL   10 C  ? ? ? 1_555 F A1IL6 11 N   ? ? F URL   10 F A1IL6 11 1_555 ? ? ? ? ? ? ? 1.378 ? ? 
covale10 covale both ? F A1IL6 11 C  ? ? ? 1_555 F NH2   12 N   ? ? F A1IL6 11 F NH2   12 1_555 ? ? ? ? ? ? ? 1.325 ? ? 
covale11 covale one  ? G CYS   4  SG ? ? ? 1_555 G A1IL6 11 C17 ? ? G CYS   4  G A1IL6 11 1_555 ? ? ? ? ? ? ? 1.821 ? ? 
covale12 covale both ? G ALA   8  C  ? ? ? 1_555 G URL   9  N   ? ? G ALA   8  G URL   9  1_555 ? ? ? ? ? ? ? 1.342 ? ? 
covale13 covale both ? G URL   9  C  ? ? ? 1_555 G URL   10 N   ? ? G URL   9  G URL   10 1_555 ? ? ? ? ? ? ? 1.354 ? ? 
covale14 covale both ? G URL   10 C  ? ? ? 1_555 G A1IL6 11 N   ? ? G URL   10 G A1IL6 11 1_555 ? ? ? ? ? ? ? 1.378 ? ? 
covale15 covale both ? G A1IL6 11 C  ? ? ? 1_555 G NH2   12 N   ? ? G A1IL6 11 G NH2   12 1_555 ? ? ? ? ? ? ? 1.324 ? ? 
covale16 covale one  ? H CYS   4  SG ? ? ? 1_555 H A1IL6 11 C17 ? ? H CYS   4  H A1IL6 11 1_555 ? ? ? ? ? ? ? 1.818 ? ? 
covale17 covale both ? H ALA   8  C  ? ? ? 1_555 H URL   9  N   ? ? H ALA   8  H URL   9  1_555 ? ? ? ? ? ? ? 1.343 ? ? 
covale18 covale both ? H URL   9  C  ? ? ? 1_555 H URL   10 N   ? ? H URL   9  H URL   10 1_555 ? ? ? ? ? ? ? 1.350 ? ? 
covale19 covale both ? H URL   10 C  ? ? ? 1_555 H A1IL6 11 N   ? ? H URL   10 H A1IL6 11 1_555 ? ? ? ? ? ? ? 1.380 ? ? 
covale20 covale both ? H A1IL6 11 C  ? ? ? 1_555 H NH2   12 N   ? ? H A1IL6 11 H NH2   12 1_555 ? ? ? ? ? ? ? 1.322 ? ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1  URL   E 9  ? .     . .  . URL   J 9  ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
2  URL   E 10 ? .     . .  . URL   J 10 ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
3  A1IL6 E 11 ? .     . .  . A1IL6 J 11 ? 1_555 .     . .  . .     .  .   PRO   1  A1IL6 None 'Non-standard residue' 
4  URL   F 9  ? .     . .  . URL   F 9  ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
5  URL   F 10 ? .     . .  . URL   F 10 ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
6  A1IL6 F 11 ? .     . .  . A1IL6 F 11 ? 1_555 .     . .  . .     .  .   PRO   1  A1IL6 None 'Non-standard residue' 
7  URL   G 9  ? .     . .  . URL   G 9  ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
8  URL   G 10 ? .     . .  . URL   G 10 ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
9  A1IL6 G 11 ? .     . .  . A1IL6 G 11 ? 1_555 .     . .  . .     .  .   PRO   1  A1IL6 None 'Non-standard residue' 
10 URL   H 9  ? .     . .  . URL   H 9  ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
11 URL   H 10 ? .     . .  . URL   H 10 ? 1_555 .     . .  . .     .  .   ?     1  URL   None 'Non-standard residue' 
12 A1IL6 H 11 ? .     . .  . A1IL6 H 11 ? 1_555 .     . .  . .     .  .   PRO   1  A1IL6 None 'Non-standard residue' 
13 NH2   E 12 ? A1IL6 E 11 ? NH2   J 12 ? 1_555 A1IL6 J 11 ? 1_555 .  .   A1IL6 42 NH2   None 'Terminal amidation'   
14 NH2   F 12 ? A1IL6 F 11 ? NH2   F 12 ? 1_555 A1IL6 F 11 ? 1_555 .  .   A1IL6 42 NH2   None 'Terminal amidation'   
15 NH2   G 12 ? A1IL6 G 11 ? NH2   G 12 ? 1_555 A1IL6 G 11 ? 1_555 .  .   A1IL6 42 NH2   None 'Terminal amidation'   
16 NH2   H 12 ? A1IL6 H 11 ? NH2   H 12 ? 1_555 A1IL6 H 11 ? 1_555 .  .   A1IL6 42 NH2   None 'Terminal amidation'   
17 CYS   E 4  ? A1IL6 E 11 ? CYS   J 4  ? 1_555 A1IL6 J 11 ? 1_555 SG C17 .     .  .     None 'Non-standard linkage' 
18 CYS   F 4  ? A1IL6 F 11 ? CYS   F 4  ? 1_555 A1IL6 F 11 ? 1_555 SG C17 .     .  .     None 'Non-standard linkage' 
19 CYS   G 4  ? A1IL6 G 11 ? CYS   G 4  ? 1_555 A1IL6 G 11 ? 1_555 SG C17 .     .  .     None 'Non-standard linkage' 
20 CYS   H 4  ? A1IL6 H 11 ? CYS   H 4  ? 1_555 A1IL6 H 11 ? 1_555 SG C17 .     .  .     None 'Non-standard linkage' 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 3 ? 
AA2 ? 2 ? 
AA3 ? 3 ? 
AA4 ? 2 ? 
AA5 ? 3 ? 
AA6 ? 2 ? 
AA7 ? 3 ? 
AA8 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA3 2 3 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? anti-parallel 
AA5 2 3 ? anti-parallel 
AA6 1 2 ? anti-parallel 
AA7 1 2 ? anti-parallel 
AA7 2 3 ? anti-parallel 
AA8 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 TYR A 33 ? THR A 34 ? TYR A 48  THR A 49  
AA1 2 LEU A 12 ? PRO A 15 ? LEU A 27  PRO A 30  
AA1 3 LEU A 92 ? VAL A 94 ? LEU A 107 VAL A 109 
AA2 1 ILE A 59 ? TYR A 61 ? ILE A 74  TYR A 76  
AA2 2 SER A 75 ? SER A 77 ? SER A 90  SER A 92  
AA3 1 TYR B 33 ? THR B 34 ? TYR B 48  THR B 49  
AA3 2 LEU B 12 ? PRO B 15 ? LEU B 27  PRO B 30  
AA3 3 LEU B 92 ? VAL B 94 ? LEU B 107 VAL B 109 
AA4 1 ILE B 59 ? TYR B 61 ? ILE B 74  TYR B 76  
AA4 2 SER B 75 ? SER B 77 ? SER B 90  SER B 92  
AA5 1 TYR C 33 ? THR C 34 ? TYR C 48  THR C 49  
AA5 2 LEU C 12 ? PRO C 15 ? LEU C 27  PRO C 30  
AA5 3 LEU C 92 ? VAL C 94 ? LEU C 107 VAL C 109 
AA6 1 ILE C 59 ? TYR C 61 ? ILE C 74  TYR C 76  
AA6 2 SER C 75 ? SER C 77 ? SER C 90  SER C 92  
AA7 1 TYR D 33 ? THR D 34 ? TYR D 48  THR D 49  
AA7 2 LEU D 12 ? PRO D 15 ? LEU D 27  PRO D 30  
AA7 3 LEU D 92 ? VAL D 94 ? LEU D 107 VAL D 109 
AA8 1 ILE D 59 ? TYR D 61 ? ILE D 74  TYR D 76  
AA8 2 SER D 75 ? SER D 77 ? SER D 90  SER D 92  
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O TYR A 33 ? O TYR A 48 N VAL A 13 ? N VAL A 28  
AA1 2 3 N ARG A 14 ? N ARG A 29 O VAL A 93 ? O VAL A 108 
AA2 1 2 N VAL A 60 ? N VAL A 75 O PHE A 76 ? O PHE A 91  
AA3 1 2 O TYR B 33 ? O TYR B 48 N VAL B 13 ? N VAL B 28  
AA3 2 3 N ARG B 14 ? N ARG B 29 O VAL B 93 ? O VAL B 108 
AA4 1 2 N VAL B 60 ? N VAL B 75 O PHE B 76 ? O PHE B 91  
AA5 1 2 O TYR C 33 ? O TYR C 48 N VAL C 13 ? N VAL C 28  
AA5 2 3 N ARG C 14 ? N ARG C 29 O VAL C 93 ? O VAL C 108 
AA6 1 2 N VAL C 60 ? N VAL C 75 O PHE C 76 ? O PHE C 91  
AA7 1 2 O TYR D 33 ? O TYR D 48 N VAL D 13 ? N VAL D 28  
AA7 2 3 N ARG D 14 ? N ARG D 29 O VAL D 93 ? O VAL D 108 
AA8 1 2 N VAL D 60 ? N VAL D 75 O PHE D 76 ? O PHE D 91  
# 
_pdbx_entry_details.entry_id                   9GFK 
_pdbx_entry_details.has_ligand_of_interest     Y 
_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   Y 
# 
_pdbx_validate_rmsd_bond.id                        1 
_pdbx_validate_rmsd_bond.PDB_model_num             1 
_pdbx_validate_rmsd_bond.auth_atom_id_1            CD 
_pdbx_validate_rmsd_bond.auth_asym_id_1            G 
_pdbx_validate_rmsd_bond.auth_comp_id_1            GLU 
_pdbx_validate_rmsd_bond.auth_seq_id_1             5 
_pdbx_validate_rmsd_bond.PDB_ins_code_1            ? 
_pdbx_validate_rmsd_bond.label_alt_id_1            ? 
_pdbx_validate_rmsd_bond.auth_atom_id_2            OE1 
_pdbx_validate_rmsd_bond.auth_asym_id_2            G 
_pdbx_validate_rmsd_bond.auth_comp_id_2            GLU 
_pdbx_validate_rmsd_bond.auth_seq_id_2             5 
_pdbx_validate_rmsd_bond.PDB_ins_code_2            ? 
_pdbx_validate_rmsd_bond.label_alt_id_2            ? 
_pdbx_validate_rmsd_bond.bond_value                1.318 
_pdbx_validate_rmsd_bond.bond_target_value         1.252 
_pdbx_validate_rmsd_bond.bond_deviation            0.066 
_pdbx_validate_rmsd_bond.bond_standard_deviation   0.011 
_pdbx_validate_rmsd_bond.linker_flag               N 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 CA J URL 9  ? ? C J URL 9  ? ? N J URL   10 ? ? 135.53 117.20 18.33 2.20 Y 
2 1 CA J URL 10 ? ? C J URL 10 ? ? N J A1IL6 11 ? ? 135.73 117.20 18.53 2.20 Y 
3 1 CA F URL 9  ? ? C F URL 9  ? ? N F URL   10 ? ? 135.60 117.20 18.40 2.20 Y 
4 1 CA F URL 10 ? ? C F URL 10 ? ? N F A1IL6 11 ? ? 135.04 117.20 17.84 2.20 Y 
5 1 CA G URL 9  ? ? C G URL 9  ? ? N G URL   10 ? ? 139.18 117.20 21.98 2.20 Y 
6 1 CA G URL 10 ? ? C G URL 10 ? ? N G A1IL6 11 ? ? 134.43 117.20 17.23 2.20 Y 
7 1 CA H URL 9  ? ? C H URL 9  ? ? N H URL   10 ? ? 135.83 117.20 18.63 2.20 Y 
8 1 CA H URL 10 ? ? C H URL 10 ? ? N H A1IL6 11 ? ? 134.69 117.20 17.49 2.20 Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 GLN A 18 ? ? 71.08   -61.79 
2 1 CYS A 77 ? ? -140.03 17.13  
3 1 GLN B 72 ? ? -69.43  2.24   
4 1 ARG C 65 ? A 39.69   52.99  
5 1 GLN D 18 ? ? -69.82  15.10  
# 
loop_
_pdbx_validate_peptide_omega.id 
_pdbx_validate_peptide_omega.PDB_model_num 
_pdbx_validate_peptide_omega.auth_comp_id_1 
_pdbx_validate_peptide_omega.auth_asym_id_1 
_pdbx_validate_peptide_omega.auth_seq_id_1 
_pdbx_validate_peptide_omega.PDB_ins_code_1 
_pdbx_validate_peptide_omega.label_alt_id_1 
_pdbx_validate_peptide_omega.auth_comp_id_2 
_pdbx_validate_peptide_omega.auth_asym_id_2 
_pdbx_validate_peptide_omega.auth_seq_id_2 
_pdbx_validate_peptide_omega.PDB_ins_code_2 
_pdbx_validate_peptide_omega.label_alt_id_2 
_pdbx_validate_peptide_omega.omega 
1 1 URL J 9 ? ? URL J 10 ? ? 129.57 
2 1 URL F 9 ? ? URL F 10 ? ? 126.25 
3 1 URL G 9 ? ? URL G 10 ? ? 128.19 
4 1 URL H 9 ? ? URL H 10 ? ? 128.78 
# 
loop_
_pdbx_validate_main_chain_plane.id 
_pdbx_validate_main_chain_plane.PDB_model_num 
_pdbx_validate_main_chain_plane.auth_comp_id 
_pdbx_validate_main_chain_plane.auth_asym_id 
_pdbx_validate_main_chain_plane.auth_seq_id 
_pdbx_validate_main_chain_plane.PDB_ins_code 
_pdbx_validate_main_chain_plane.label_alt_id 
_pdbx_validate_main_chain_plane.improper_torsion_angle 
1 1 URL J 9  ? ? -23.14 
2 1 URL F 9  ? ? -21.58 
3 1 URL F 10 ? ? 11.19  
4 1 URL G 9  ? ? -25.26 
5 1 URL G 10 ? ? 10.77  
6 1 URL H 9  ? ? -22.70 
7 1 URL H 10 ? ? 11.63  
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? C HOH 383 ? 6.42 .    
2 1 O ? C HOH 384 ? .    9.17 
# 
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 A MET 16 ? A MET 1 
2 1 Y 1 C MET 16 ? C MET 1 
3 1 Y 1 C SER 17 ? C SER 2 
4 1 Y 1 D MET 16 ? D MET 1 
# 
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 
A1IL6 C17  C N N 1   
A1IL6 C18  C N N 2   
A1IL6 C19  C N N 3   
A1IL6 C20  C N N 4   
A1IL6 C21  C N N 5   
A1IL6 C22  C N N 6   
A1IL6 CD   C N N 7   
A1IL6 CA   C N S 8   
A1IL6 O    O N N 9   
A1IL6 N    N N N 10  
A1IL6 C    C N N 11  
A1IL6 CB   C N N 12  
A1IL6 CG   C N S 13  
A1IL6 S1   S N N 14  
A1IL6 H1   H N N 15  
A1IL6 H2   H N N 16  
A1IL6 H3   H N N 17  
A1IL6 H4   H N N 18  
A1IL6 H5   H N N 19  
A1IL6 H6   H N N 20  
A1IL6 H7   H N N 21  
A1IL6 H8   H N N 22  
A1IL6 H9   H N N 23  
A1IL6 H10  H N N 24  
A1IL6 H11  H N N 25  
A1IL6 H12  H N N 26  
A1IL6 H13  H N N 27  
A1IL6 HD2  H N N 28  
A1IL6 HD3  H N N 29  
A1IL6 HA   H N N 30  
A1IL6 H    H N N 31  
A1IL6 HB2  H N N 32  
A1IL6 HB3  H N N 33  
A1IL6 HG2  H N N 34  
A1IL6 OXT  O N N 35  
A1IL6 HXT  H N N 36  
ALA   N    N N N 37  
ALA   CA   C N S 38  
ALA   C    C N N 39  
ALA   O    O N N 40  
ALA   CB   C N N 41  
ALA   OXT  O N N 42  
ALA   H    H N N 43  
ALA   H2   H N N 44  
ALA   HA   H N N 45  
ALA   HB1  H N N 46  
ALA   HB2  H N N 47  
ALA   HB3  H N N 48  
ALA   HXT  H N N 49  
ARG   N    N N N 50  
ARG   CA   C N S 51  
ARG   C    C N N 52  
ARG   O    O N N 53  
ARG   CB   C N N 54  
ARG   CG   C N N 55  
ARG   CD   C N N 56  
ARG   NE   N N N 57  
ARG   CZ   C N N 58  
ARG   NH1  N N N 59  
ARG   NH2  N N N 60  
ARG   OXT  O N N 61  
ARG   H    H N N 62  
ARG   H2   H N N 63  
ARG   HA   H N N 64  
ARG   HB2  H N N 65  
ARG   HB3  H N N 66  
ARG   HG2  H N N 67  
ARG   HG3  H N N 68  
ARG   HD2  H N N 69  
ARG   HD3  H N N 70  
ARG   HE   H N N 71  
ARG   HH11 H N N 72  
ARG   HH12 H N N 73  
ARG   HH21 H N N 74  
ARG   HH22 H N N 75  
ARG   HXT  H N N 76  
ASN   N    N N N 77  
ASN   CA   C N S 78  
ASN   C    C N N 79  
ASN   O    O N N 80  
ASN   CB   C N N 81  
ASN   CG   C N N 82  
ASN   OD1  O N N 83  
ASN   ND2  N N N 84  
ASN   OXT  O N N 85  
ASN   H    H N N 86  
ASN   H2   H N N 87  
ASN   HA   H N N 88  
ASN   HB2  H N N 89  
ASN   HB3  H N N 90  
ASN   HD21 H N N 91  
ASN   HD22 H N N 92  
ASN   HXT  H N N 93  
ASP   N    N N N 94  
ASP   CA   C N S 95  
ASP   C    C N N 96  
ASP   O    O N N 97  
ASP   CB   C N N 98  
ASP   CG   C N N 99  
ASP   OD1  O N N 100 
ASP   OD2  O N N 101 
ASP   OXT  O N N 102 
ASP   H    H N N 103 
ASP   H2   H N N 104 
ASP   HA   H N N 105 
ASP   HB2  H N N 106 
ASP   HB3  H N N 107 
ASP   HD2  H N N 108 
ASP   HXT  H N N 109 
CYS   N    N N N 110 
CYS   CA   C N R 111 
CYS   C    C N N 112 
CYS   O    O N N 113 
CYS   CB   C N N 114 
CYS   SG   S N N 115 
CYS   OXT  O N N 116 
CYS   H    H N N 117 
CYS   H2   H N N 118 
CYS   HA   H N N 119 
CYS   HB2  H N N 120 
CYS   HB3  H N N 121 
CYS   HG   H N N 122 
CYS   HXT  H N N 123 
GLN   N    N N N 124 
GLN   CA   C N S 125 
GLN   C    C N N 126 
GLN   O    O N N 127 
GLN   CB   C N N 128 
GLN   CG   C N N 129 
GLN   CD   C N N 130 
GLN   OE1  O N N 131 
GLN   NE2  N N N 132 
GLN   OXT  O N N 133 
GLN   H    H N N 134 
GLN   H2   H N N 135 
GLN   HA   H N N 136 
GLN   HB2  H N N 137 
GLN   HB3  H N N 138 
GLN   HG2  H N N 139 
GLN   HG3  H N N 140 
GLN   HE21 H N N 141 
GLN   HE22 H N N 142 
GLN   HXT  H N N 143 
GLU   N    N N N 144 
GLU   CA   C N S 145 
GLU   C    C N N 146 
GLU   O    O N N 147 
GLU   CB   C N N 148 
GLU   CG   C N N 149 
GLU   CD   C N N 150 
GLU   OE1  O N N 151 
GLU   OE2  O N N 152 
GLU   OXT  O N N 153 
GLU   H    H N N 154 
GLU   H2   H N N 155 
GLU   HA   H N N 156 
GLU   HB2  H N N 157 
GLU   HB3  H N N 158 
GLU   HG2  H N N 159 
GLU   HG3  H N N 160 
GLU   HE2  H N N 161 
GLU   HXT  H N N 162 
GLY   N    N N N 163 
GLY   CA   C N N 164 
GLY   C    C N N 165 
GLY   O    O N N 166 
GLY   OXT  O N N 167 
GLY   H    H N N 168 
GLY   H2   H N N 169 
GLY   HA2  H N N 170 
GLY   HA3  H N N 171 
GLY   HXT  H N N 172 
HIS   N    N N N 173 
HIS   CA   C N S 174 
HIS   C    C N N 175 
HIS   O    O N N 176 
HIS   CB   C N N 177 
HIS   CG   C Y N 178 
HIS   ND1  N Y N 179 
HIS   CD2  C Y N 180 
HIS   CE1  C Y N 181 
HIS   NE2  N Y N 182 
HIS   OXT  O N N 183 
HIS   H    H N N 184 
HIS   H2   H N N 185 
HIS   HA   H N N 186 
HIS   HB2  H N N 187 
HIS   HB3  H N N 188 
HIS   HD1  H N N 189 
HIS   HD2  H N N 190 
HIS   HE1  H N N 191 
HIS   HE2  H N N 192 
HIS   HXT  H N N 193 
HOH   O    O N N 194 
HOH   H1   H N N 195 
HOH   H2   H N N 196 
ILE   N    N N N 197 
ILE   CA   C N S 198 
ILE   C    C N N 199 
ILE   O    O N N 200 
ILE   CB   C N S 201 
ILE   CG1  C N N 202 
ILE   CG2  C N N 203 
ILE   CD1  C N N 204 
ILE   OXT  O N N 205 
ILE   H    H N N 206 
ILE   H2   H N N 207 
ILE   HA   H N N 208 
ILE   HB   H N N 209 
ILE   HG12 H N N 210 
ILE   HG13 H N N 211 
ILE   HG21 H N N 212 
ILE   HG22 H N N 213 
ILE   HG23 H N N 214 
ILE   HD11 H N N 215 
ILE   HD12 H N N 216 
ILE   HD13 H N N 217 
ILE   HXT  H N N 218 
LEU   N    N N N 219 
LEU   CA   C N S 220 
LEU   C    C N N 221 
LEU   O    O N N 222 
LEU   CB   C N N 223 
LEU   CG   C N N 224 
LEU   CD1  C N N 225 
LEU   CD2  C N N 226 
LEU   OXT  O N N 227 
LEU   H    H N N 228 
LEU   H2   H N N 229 
LEU   HA   H N N 230 
LEU   HB2  H N N 231 
LEU   HB3  H N N 232 
LEU   HG   H N N 233 
LEU   HD11 H N N 234 
LEU   HD12 H N N 235 
LEU   HD13 H N N 236 
LEU   HD21 H N N 237 
LEU   HD22 H N N 238 
LEU   HD23 H N N 239 
LEU   HXT  H N N 240 
LYS   N    N N N 241 
LYS   CA   C N S 242 
LYS   C    C N N 243 
LYS   O    O N N 244 
LYS   CB   C N N 245 
LYS   CG   C N N 246 
LYS   CD   C N N 247 
LYS   CE   C N N 248 
LYS   NZ   N N N 249 
LYS   OXT  O N N 250 
LYS   H    H N N 251 
LYS   H2   H N N 252 
LYS   HA   H N N 253 
LYS   HB2  H N N 254 
LYS   HB3  H N N 255 
LYS   HG2  H N N 256 
LYS   HG3  H N N 257 
LYS   HD2  H N N 258 
LYS   HD3  H N N 259 
LYS   HE2  H N N 260 
LYS   HE3  H N N 261 
LYS   HZ1  H N N 262 
LYS   HZ2  H N N 263 
LYS   HZ3  H N N 264 
LYS   HXT  H N N 265 
MET   N    N N N 266 
MET   CA   C N S 267 
MET   C    C N N 268 
MET   O    O N N 269 
MET   CB   C N N 270 
MET   CG   C N N 271 
MET   SD   S N N 272 
MET   CE   C N N 273 
MET   OXT  O N N 274 
MET   H    H N N 275 
MET   H2   H N N 276 
MET   HA   H N N 277 
MET   HB2  H N N 278 
MET   HB3  H N N 279 
MET   HG2  H N N 280 
MET   HG3  H N N 281 
MET   HE1  H N N 282 
MET   HE2  H N N 283 
MET   HE3  H N N 284 
MET   HXT  H N N 285 
NH2   N    N N N 286 
NH2   HN1  H N N 287 
NH2   HN2  H N N 288 
PHE   N    N N N 289 
PHE   CA   C N S 290 
PHE   C    C N N 291 
PHE   O    O N N 292 
PHE   CB   C N N 293 
PHE   CG   C Y N 294 
PHE   CD1  C Y N 295 
PHE   CD2  C Y N 296 
PHE   CE1  C Y N 297 
PHE   CE2  C Y N 298 
PHE   CZ   C Y N 299 
PHE   OXT  O N N 300 
PHE   H    H N N 301 
PHE   H2   H N N 302 
PHE   HA   H N N 303 
PHE   HB2  H N N 304 
PHE   HB3  H N N 305 
PHE   HD1  H N N 306 
PHE   HD2  H N N 307 
PHE   HE1  H N N 308 
PHE   HE2  H N N 309 
PHE   HZ   H N N 310 
PHE   HXT  H N N 311 
PRO   N    N N N 312 
PRO   CA   C N S 313 
PRO   C    C N N 314 
PRO   O    O N N 315 
PRO   CB   C N N 316 
PRO   CG   C N N 317 
PRO   CD   C N N 318 
PRO   OXT  O N N 319 
PRO   H    H N N 320 
PRO   HA   H N N 321 
PRO   HB2  H N N 322 
PRO   HB3  H N N 323 
PRO   HG2  H N N 324 
PRO   HG3  H N N 325 
PRO   HD2  H N N 326 
PRO   HD3  H N N 327 
PRO   HXT  H N N 328 
SER   N    N N N 329 
SER   CA   C N S 330 
SER   C    C N N 331 
SER   O    O N N 332 
SER   CB   C N N 333 
SER   OG   O N N 334 
SER   OXT  O N N 335 
SER   H    H N N 336 
SER   H2   H N N 337 
SER   HA   H N N 338 
SER   HB2  H N N 339 
SER   HB3  H N N 340 
SER   HG   H N N 341 
SER   HXT  H N N 342 
SO4   S    S N N 343 
SO4   O1   O N N 344 
SO4   O2   O N N 345 
SO4   O3   O N N 346 
SO4   O4   O N N 347 
THR   N    N N N 348 
THR   CA   C N S 349 
THR   C    C N N 350 
THR   O    O N N 351 
THR   CB   C N R 352 
THR   OG1  O N N 353 
THR   CG2  C N N 354 
THR   OXT  O N N 355 
THR   H    H N N 356 
THR   H2   H N N 357 
THR   HA   H N N 358 
THR   HB   H N N 359 
THR   HG1  H N N 360 
THR   HG21 H N N 361 
THR   HG22 H N N 362 
THR   HG23 H N N 363 
THR   HXT  H N N 364 
TRP   N    N N N 365 
TRP   CA   C N S 366 
TRP   C    C N N 367 
TRP   O    O N N 368 
TRP   CB   C N N 369 
TRP   CG   C Y N 370 
TRP   CD1  C Y N 371 
TRP   CD2  C Y N 372 
TRP   NE1  N Y N 373 
TRP   CE2  C Y N 374 
TRP   CE3  C Y N 375 
TRP   CZ2  C Y N 376 
TRP   CZ3  C Y N 377 
TRP   CH2  C Y N 378 
TRP   OXT  O N N 379 
TRP   H    H N N 380 
TRP   H2   H N N 381 
TRP   HA   H N N 382 
TRP   HB2  H N N 383 
TRP   HB3  H N N 384 
TRP   HD1  H N N 385 
TRP   HE1  H N N 386 
TRP   HE3  H N N 387 
TRP   HZ2  H N N 388 
TRP   HZ3  H N N 389 
TRP   HH2  H N N 390 
TRP   HXT  H N N 391 
TYR   N    N N N 392 
TYR   CA   C N S 393 
TYR   C    C N N 394 
TYR   O    O N N 395 
TYR   CB   C N N 396 
TYR   CG   C Y N 397 
TYR   CD1  C Y N 398 
TYR   CD2  C Y N 399 
TYR   CE1  C Y N 400 
TYR   CE2  C Y N 401 
TYR   CZ   C Y N 402 
TYR   OH   O N N 403 
TYR   OXT  O N N 404 
TYR   H    H N N 405 
TYR   H2   H N N 406 
TYR   HA   H N N 407 
TYR   HB2  H N N 408 
TYR   HB3  H N N 409 
TYR   HD1  H N N 410 
TYR   HD2  H N N 411 
TYR   HE1  H N N 412 
TYR   HE2  H N N 413 
TYR   HH   H N N 414 
TYR   HXT  H N N 415 
URL   CA   C N S 416 
URL   C    C N N 417 
URL   O    O N N 418 
URL   CB   C N N 419 
URL   C2   C N N 420 
URL   N    N N N 421 
URL   N2   N N N 422 
URL   OXT  O N N 423 
URL   HA   H N N 424 
URL   H1   H N N 425 
URL   H3   H N N 426 
URL   H5   H N N 427 
URL   H6   H N N 428 
URL   H    H N N 429 
URL   H2   H N N 430 
URL   H10  H N N 431 
URL   HXT  H N N 432 
URL   C1   C N N 433 
URL   C3   C N N 434 
URL   C4   C N N 435 
URL   H4   H N N 436 
URL   H9   H N N 437 
URL   H12  H N N 438 
URL   H13  H N N 439 
URL   H14  H N N 440 
URL   H15  H N N 441 
URL   H16  H N N 442 
VAL   N    N N N 443 
VAL   CA   C N S 444 
VAL   C    C N N 445 
VAL   O    O N N 446 
VAL   CB   C N N 447 
VAL   CG1  C N N 448 
VAL   CG2  C N N 449 
VAL   OXT  O N N 450 
VAL   H    H N N 451 
VAL   H2   H N N 452 
VAL   HA   H N N 453 
VAL   HB   H N N 454 
VAL   HG11 H N N 455 
VAL   HG12 H N N 456 
VAL   HG13 H N N 457 
VAL   HG21 H N N 458 
VAL   HG22 H N N 459 
VAL   HG23 H N N 460 
VAL   HXT  H N N 461 
# 
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 
A1IL6 O   C    doub N N 1   
A1IL6 C   CA   sing N N 2   
A1IL6 CA  N    sing N N 3   
A1IL6 CA  CB   sing N N 4   
A1IL6 N   CD   sing N N 5   
A1IL6 CB  CG   sing N N 6   
A1IL6 CD  CG   sing N N 7   
A1IL6 CG  S1   sing N N 8   
A1IL6 S1  C22  sing N N 9   
A1IL6 C22 C21  sing N N 10  
A1IL6 C21 C20  sing N N 11  
A1IL6 C20 C19  sing N N 12  
A1IL6 C19 C18  sing N N 13  
A1IL6 C18 C17  sing N N 14  
A1IL6 C17 H1   sing N N 15  
A1IL6 C17 H2   sing N N 16  
A1IL6 C17 H3   sing N N 17  
A1IL6 C18 H4   sing N N 18  
A1IL6 C18 H5   sing N N 19  
A1IL6 C19 H6   sing N N 20  
A1IL6 C19 H7   sing N N 21  
A1IL6 C20 H8   sing N N 22  
A1IL6 C20 H9   sing N N 23  
A1IL6 C21 H10  sing N N 24  
A1IL6 C21 H11  sing N N 25  
A1IL6 C22 H12  sing N N 26  
A1IL6 C22 H13  sing N N 27  
A1IL6 CD  HD2  sing N N 28  
A1IL6 CD  HD3  sing N N 29  
A1IL6 CA  HA   sing N N 30  
A1IL6 N   H    sing N N 31  
A1IL6 CB  HB2  sing N N 32  
A1IL6 CB  HB3  sing N N 33  
A1IL6 CG  HG2  sing N N 34  
A1IL6 C   OXT  sing N N 35  
A1IL6 OXT HXT  sing N N 36  
ALA   N   CA   sing N N 37  
ALA   N   H    sing N N 38  
ALA   N   H2   sing N N 39  
ALA   CA  C    sing N N 40  
ALA   CA  CB   sing N N 41  
ALA   CA  HA   sing N N 42  
ALA   C   O    doub N N 43  
ALA   C   OXT  sing N N 44  
ALA   CB  HB1  sing N N 45  
ALA   CB  HB2  sing N N 46  
ALA   CB  HB3  sing N N 47  
ALA   OXT HXT  sing N N 48  
ARG   N   CA   sing N N 49  
ARG   N   H    sing N N 50  
ARG   N   H2   sing N N 51  
ARG   CA  C    sing N N 52  
ARG   CA  CB   sing N N 53  
ARG   CA  HA   sing N N 54  
ARG   C   O    doub N N 55  
ARG   C   OXT  sing N N 56  
ARG   CB  CG   sing N N 57  
ARG   CB  HB2  sing N N 58  
ARG   CB  HB3  sing N N 59  
ARG   CG  CD   sing N N 60  
ARG   CG  HG2  sing N N 61  
ARG   CG  HG3  sing N N 62  
ARG   CD  NE   sing N N 63  
ARG   CD  HD2  sing N N 64  
ARG   CD  HD3  sing N N 65  
ARG   NE  CZ   sing N N 66  
ARG   NE  HE   sing N N 67  
ARG   CZ  NH1  sing N N 68  
ARG   CZ  NH2  doub N N 69  
ARG   NH1 HH11 sing N N 70  
ARG   NH1 HH12 sing N N 71  
ARG   NH2 HH21 sing N N 72  
ARG   NH2 HH22 sing N N 73  
ARG   OXT HXT  sing N N 74  
ASN   N   CA   sing N N 75  
ASN   N   H    sing N N 76  
ASN   N   H2   sing N N 77  
ASN   CA  C    sing N N 78  
ASN   CA  CB   sing N N 79  
ASN   CA  HA   sing N N 80  
ASN   C   O    doub N N 81  
ASN   C   OXT  sing N N 82  
ASN   CB  CG   sing N N 83  
ASN   CB  HB2  sing N N 84  
ASN   CB  HB3  sing N N 85  
ASN   CG  OD1  doub N N 86  
ASN   CG  ND2  sing N N 87  
ASN   ND2 HD21 sing N N 88  
ASN   ND2 HD22 sing N N 89  
ASN   OXT HXT  sing N N 90  
ASP   N   CA   sing N N 91  
ASP   N   H    sing N N 92  
ASP   N   H2   sing N N 93  
ASP   CA  C    sing N N 94  
ASP   CA  CB   sing N N 95  
ASP   CA  HA   sing N N 96  
ASP   C   O    doub N N 97  
ASP   C   OXT  sing N N 98  
ASP   CB  CG   sing N N 99  
ASP   CB  HB2  sing N N 100 
ASP   CB  HB3  sing N N 101 
ASP   CG  OD1  doub N N 102 
ASP   CG  OD2  sing N N 103 
ASP   OD2 HD2  sing N N 104 
ASP   OXT HXT  sing N N 105 
CYS   N   CA   sing N N 106 
CYS   N   H    sing N N 107 
CYS   N   H2   sing N N 108 
CYS   CA  C    sing N N 109 
CYS   CA  CB   sing N N 110 
CYS   CA  HA   sing N N 111 
CYS   C   O    doub N N 112 
CYS   C   OXT  sing N N 113 
CYS   CB  SG   sing N N 114 
CYS   CB  HB2  sing N N 115 
CYS   CB  HB3  sing N N 116 
CYS   SG  HG   sing N N 117 
CYS   OXT HXT  sing N N 118 
GLN   N   CA   sing N N 119 
GLN   N   H    sing N N 120 
GLN   N   H2   sing N N 121 
GLN   CA  C    sing N N 122 
GLN   CA  CB   sing N N 123 
GLN   CA  HA   sing N N 124 
GLN   C   O    doub N N 125 
GLN   C   OXT  sing N N 126 
GLN   CB  CG   sing N N 127 
GLN   CB  HB2  sing N N 128 
GLN   CB  HB3  sing N N 129 
GLN   CG  CD   sing N N 130 
GLN   CG  HG2  sing N N 131 
GLN   CG  HG3  sing N N 132 
GLN   CD  OE1  doub N N 133 
GLN   CD  NE2  sing N N 134 
GLN   NE2 HE21 sing N N 135 
GLN   NE2 HE22 sing N N 136 
GLN   OXT HXT  sing N N 137 
GLU   N   CA   sing N N 138 
GLU   N   H    sing N N 139 
GLU   N   H2   sing N N 140 
GLU   CA  C    sing N N 141 
GLU   CA  CB   sing N N 142 
GLU   CA  HA   sing N N 143 
GLU   C   O    doub N N 144 
GLU   C   OXT  sing N N 145 
GLU   CB  CG   sing N N 146 
GLU   CB  HB2  sing N N 147 
GLU   CB  HB3  sing N N 148 
GLU   CG  CD   sing N N 149 
GLU   CG  HG2  sing N N 150 
GLU   CG  HG3  sing N N 151 
GLU   CD  OE1  doub N N 152 
GLU   CD  OE2  sing N N 153 
GLU   OE2 HE2  sing N N 154 
GLU   OXT HXT  sing N N 155 
GLY   N   CA   sing N N 156 
GLY   N   H    sing N N 157 
GLY   N   H2   sing N N 158 
GLY   CA  C    sing N N 159 
GLY   CA  HA2  sing N N 160 
GLY   CA  HA3  sing N N 161 
GLY   C   O    doub N N 162 
GLY   C   OXT  sing N N 163 
GLY   OXT HXT  sing N N 164 
HIS   N   CA   sing N N 165 
HIS   N   H    sing N N 166 
HIS   N   H2   sing N N 167 
HIS   CA  C    sing N N 168 
HIS   CA  CB   sing N N 169 
HIS   CA  HA   sing N N 170 
HIS   C   O    doub N N 171 
HIS   C   OXT  sing N N 172 
HIS   CB  CG   sing N N 173 
HIS   CB  HB2  sing N N 174 
HIS   CB  HB3  sing N N 175 
HIS   CG  ND1  sing Y N 176 
HIS   CG  CD2  doub Y N 177 
HIS   ND1 CE1  doub Y N 178 
HIS   ND1 HD1  sing N N 179 
HIS   CD2 NE2  sing Y N 180 
HIS   CD2 HD2  sing N N 181 
HIS   CE1 NE2  sing Y N 182 
HIS   CE1 HE1  sing N N 183 
HIS   NE2 HE2  sing N N 184 
HIS   OXT HXT  sing N N 185 
HOH   O   H1   sing N N 186 
HOH   O   H2   sing N N 187 
ILE   N   CA   sing N N 188 
ILE   N   H    sing N N 189 
ILE   N   H2   sing N N 190 
ILE   CA  C    sing N N 191 
ILE   CA  CB   sing N N 192 
ILE   CA  HA   sing N N 193 
ILE   C   O    doub N N 194 
ILE   C   OXT  sing N N 195 
ILE   CB  CG1  sing N N 196 
ILE   CB  CG2  sing N N 197 
ILE   CB  HB   sing N N 198 
ILE   CG1 CD1  sing N N 199 
ILE   CG1 HG12 sing N N 200 
ILE   CG1 HG13 sing N N 201 
ILE   CG2 HG21 sing N N 202 
ILE   CG2 HG22 sing N N 203 
ILE   CG2 HG23 sing N N 204 
ILE   CD1 HD11 sing N N 205 
ILE   CD1 HD12 sing N N 206 
ILE   CD1 HD13 sing N N 207 
ILE   OXT HXT  sing N N 208 
LEU   N   CA   sing N N 209 
LEU   N   H    sing N N 210 
LEU   N   H2   sing N N 211 
LEU   CA  C    sing N N 212 
LEU   CA  CB   sing N N 213 
LEU   CA  HA   sing N N 214 
LEU   C   O    doub N N 215 
LEU   C   OXT  sing N N 216 
LEU   CB  CG   sing N N 217 
LEU   CB  HB2  sing N N 218 
LEU   CB  HB3  sing N N 219 
LEU   CG  CD1  sing N N 220 
LEU   CG  CD2  sing N N 221 
LEU   CG  HG   sing N N 222 
LEU   CD1 HD11 sing N N 223 
LEU   CD1 HD12 sing N N 224 
LEU   CD1 HD13 sing N N 225 
LEU   CD2 HD21 sing N N 226 
LEU   CD2 HD22 sing N N 227 
LEU   CD2 HD23 sing N N 228 
LEU   OXT HXT  sing N N 229 
LYS   N   CA   sing N N 230 
LYS   N   H    sing N N 231 
LYS   N   H2   sing N N 232 
LYS   CA  C    sing N N 233 
LYS   CA  CB   sing N N 234 
LYS   CA  HA   sing N N 235 
LYS   C   O    doub N N 236 
LYS   C   OXT  sing N N 237 
LYS   CB  CG   sing N N 238 
LYS   CB  HB2  sing N N 239 
LYS   CB  HB3  sing N N 240 
LYS   CG  CD   sing N N 241 
LYS   CG  HG2  sing N N 242 
LYS   CG  HG3  sing N N 243 
LYS   CD  CE   sing N N 244 
LYS   CD  HD2  sing N N 245 
LYS   CD  HD3  sing N N 246 
LYS   CE  NZ   sing N N 247 
LYS   CE  HE2  sing N N 248 
LYS   CE  HE3  sing N N 249 
LYS   NZ  HZ1  sing N N 250 
LYS   NZ  HZ2  sing N N 251 
LYS   NZ  HZ3  sing N N 252 
LYS   OXT HXT  sing N N 253 
MET   N   CA   sing N N 254 
MET   N   H    sing N N 255 
MET   N   H2   sing N N 256 
MET   CA  C    sing N N 257 
MET   CA  CB   sing N N 258 
MET   CA  HA   sing N N 259 
MET   C   O    doub N N 260 
MET   C   OXT  sing N N 261 
MET   CB  CG   sing N N 262 
MET   CB  HB2  sing N N 263 
MET   CB  HB3  sing N N 264 
MET   CG  SD   sing N N 265 
MET   CG  HG2  sing N N 266 
MET   CG  HG3  sing N N 267 
MET   SD  CE   sing N N 268 
MET   CE  HE1  sing N N 269 
MET   CE  HE2  sing N N 270 
MET   CE  HE3  sing N N 271 
MET   OXT HXT  sing N N 272 
NH2   N   HN1  sing N N 273 
NH2   N   HN2  sing N N 274 
PHE   N   CA   sing N N 275 
PHE   N   H    sing N N 276 
PHE   N   H2   sing N N 277 
PHE   CA  C    sing N N 278 
PHE   CA  CB   sing N N 279 
PHE   CA  HA   sing N N 280 
PHE   C   O    doub N N 281 
PHE   C   OXT  sing N N 282 
PHE   CB  CG   sing N N 283 
PHE   CB  HB2  sing N N 284 
PHE   CB  HB3  sing N N 285 
PHE   CG  CD1  doub Y N 286 
PHE   CG  CD2  sing Y N 287 
PHE   CD1 CE1  sing Y N 288 
PHE   CD1 HD1  sing N N 289 
PHE   CD2 CE2  doub Y N 290 
PHE   CD2 HD2  sing N N 291 
PHE   CE1 CZ   doub Y N 292 
PHE   CE1 HE1  sing N N 293 
PHE   CE2 CZ   sing Y N 294 
PHE   CE2 HE2  sing N N 295 
PHE   CZ  HZ   sing N N 296 
PHE   OXT HXT  sing N N 297 
PRO   N   CA   sing N N 298 
PRO   N   CD   sing N N 299 
PRO   N   H    sing N N 300 
PRO   CA  C    sing N N 301 
PRO   CA  CB   sing N N 302 
PRO   CA  HA   sing N N 303 
PRO   C   O    doub N N 304 
PRO   C   OXT  sing N N 305 
PRO   CB  CG   sing N N 306 
PRO   CB  HB2  sing N N 307 
PRO   CB  HB3  sing N N 308 
PRO   CG  CD   sing N N 309 
PRO   CG  HG2  sing N N 310 
PRO   CG  HG3  sing N N 311 
PRO   CD  HD2  sing N N 312 
PRO   CD  HD3  sing N N 313 
PRO   OXT HXT  sing N N 314 
SER   N   CA   sing N N 315 
SER   N   H    sing N N 316 
SER   N   H2   sing N N 317 
SER   CA  C    sing N N 318 
SER   CA  CB   sing N N 319 
SER   CA  HA   sing N N 320 
SER   C   O    doub N N 321 
SER   C   OXT  sing N N 322 
SER   CB  OG   sing N N 323 
SER   CB  HB2  sing N N 324 
SER   CB  HB3  sing N N 325 
SER   OG  HG   sing N N 326 
SER   OXT HXT  sing N N 327 
SO4   S   O1   doub N N 328 
SO4   S   O2   doub N N 329 
SO4   S   O3   sing N N 330 
SO4   S   O4   sing N N 331 
THR   N   CA   sing N N 332 
THR   N   H    sing N N 333 
THR   N   H2   sing N N 334 
THR   CA  C    sing N N 335 
THR   CA  CB   sing N N 336 
THR   CA  HA   sing N N 337 
THR   C   O    doub N N 338 
THR   C   OXT  sing N N 339 
THR   CB  OG1  sing N N 340 
THR   CB  CG2  sing N N 341 
THR   CB  HB   sing N N 342 
THR   OG1 HG1  sing N N 343 
THR   CG2 HG21 sing N N 344 
THR   CG2 HG22 sing N N 345 
THR   CG2 HG23 sing N N 346 
THR   OXT HXT  sing N N 347 
TRP   N   CA   sing N N 348 
TRP   N   H    sing N N 349 
TRP   N   H2   sing N N 350 
TRP   CA  C    sing N N 351 
TRP   CA  CB   sing N N 352 
TRP   CA  HA   sing N N 353 
TRP   C   O    doub N N 354 
TRP   C   OXT  sing N N 355 
TRP   CB  CG   sing N N 356 
TRP   CB  HB2  sing N N 357 
TRP   CB  HB3  sing N N 358 
TRP   CG  CD1  doub Y N 359 
TRP   CG  CD2  sing Y N 360 
TRP   CD1 NE1  sing Y N 361 
TRP   CD1 HD1  sing N N 362 
TRP   CD2 CE2  doub Y N 363 
TRP   CD2 CE3  sing Y N 364 
TRP   NE1 CE2  sing Y N 365 
TRP   NE1 HE1  sing N N 366 
TRP   CE2 CZ2  sing Y N 367 
TRP   CE3 CZ3  doub Y N 368 
TRP   CE3 HE3  sing N N 369 
TRP   CZ2 CH2  doub Y N 370 
TRP   CZ2 HZ2  sing N N 371 
TRP   CZ3 CH2  sing Y N 372 
TRP   CZ3 HZ3  sing N N 373 
TRP   CH2 HH2  sing N N 374 
TRP   OXT HXT  sing N N 375 
TYR   N   CA   sing N N 376 
TYR   N   H    sing N N 377 
TYR   N   H2   sing N N 378 
TYR   CA  C    sing N N 379 
TYR   CA  CB   sing N N 380 
TYR   CA  HA   sing N N 381 
TYR   C   O    doub N N 382 
TYR   C   OXT  sing N N 383 
TYR   CB  CG   sing N N 384 
TYR   CB  HB2  sing N N 385 
TYR   CB  HB3  sing N N 386 
TYR   CG  CD1  doub Y N 387 
TYR   CG  CD2  sing Y N 388 
TYR   CD1 CE1  sing Y N 389 
TYR   CD1 HD1  sing N N 390 
TYR   CD2 CE2  doub Y N 391 
TYR   CD2 HD2  sing N N 392 
TYR   CE1 CZ   doub Y N 393 
TYR   CE1 HE1  sing N N 394 
TYR   CE2 CZ   sing Y N 395 
TYR   CE2 HE2  sing N N 396 
TYR   CZ  OH   sing N N 397 
TYR   OH  HH   sing N N 398 
TYR   OXT HXT  sing N N 399 
URL   N   CA   sing N N 400 
URL   CB  CA   sing N N 401 
URL   CA  C2   sing N N 402 
URL   C2  N2   sing N N 403 
URL   N2  C    sing N N 404 
URL   C   O    doub N N 405 
URL   C   OXT  sing N N 406 
URL   CA  HA   sing N N 407 
URL   CB  H1   sing N N 408 
URL   CB  H3   sing N N 409 
URL   C2  H5   sing N N 410 
URL   C2  H6   sing N N 411 
URL   N   H    sing N N 412 
URL   N   H2   sing N N 413 
URL   N2  H10  sing N N 414 
URL   OXT HXT  sing N N 415 
URL   CB  C1   sing N N 416 
URL   C1  C3   sing N N 417 
URL   C1  C4   sing N N 418 
URL   C1  H4   sing N N 419 
URL   C3  H9   sing N N 420 
URL   C3  H12  sing N N 421 
URL   C3  H13  sing N N 422 
URL   C4  H14  sing N N 423 
URL   C4  H15  sing N N 424 
URL   C4  H16  sing N N 425 
VAL   N   CA   sing N N 426 
VAL   N   H    sing N N 427 
VAL   N   H2   sing N N 428 
VAL   CA  C    sing N N 429 
VAL   CA  CB   sing N N 430 
VAL   CA  HA   sing N N 431 
VAL   C   O    doub N N 432 
VAL   C   OXT  sing N N 433 
VAL   CB  CG1  sing N N 434 
VAL   CB  CG2  sing N N 435 
VAL   CB  HB   sing N N 436 
VAL   CG1 HG11 sing N N 437 
VAL   CG1 HG12 sing N N 438 
VAL   CG1 HG13 sing N N 439 
VAL   CG2 HG21 sing N N 440 
VAL   CG2 HG22 sing N N 441 
VAL   CG2 HG23 sing N N 442 
VAL   OXT HXT  sing N N 443 
# 
_pdbx_audit_support.funding_organization   'Agence Nationale de la Recherche (ANR)' 
_pdbx_audit_support.country                France 
_pdbx_audit_support.grant_number           ANR-15-CE07-0010 
_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   3EQS 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9GFK 
_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]   0.025275 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.003090 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.009128 
_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]   0.017159 
_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 
C 
N 
O 
S 
# 
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   . SER   A 1 2  ? -7.76   -11.288 36.124 1   54.41 ? 17  SER   A N   1 
ATOM   2    C CA  . SER   A 1 2  ? -6.843  -12.106 35.323 1   54.31 ? 17  SER   A CA  1 
ATOM   3    C C   . SER   A 1 2  ? -6.068  -13.142 36.129 1   52.97 ? 17  SER   A C   1 
ATOM   4    O O   . SER   A 1 2  ? -5.426  -13.993 35.525 1   53.63 ? 17  SER   A O   1 
ATOM   5    C CB  . SER   A 1 2  ? -5.86   -11.228 34.556 1   56.6  ? 17  SER   A CB  1 
ATOM   6    O OG  . SER   A 1 2  ? -6.499  -10.55  33.487 1   59.85 ? 17  SER   A OG  1 
ATOM   7    N N   . GLN   A 1 3  ? -6.097  -13.057 37.471 1   50.91 ? 18  GLN   A N   1 
ATOM   8    C CA  . GLN   A 1 3  ? -5.4    -13.941 38.409 1   48.69 ? 18  GLN   A CA  1 
ATOM   9    C C   . GLN   A 1 3  ? -3.881  -13.722 38.403 1   44.49 ? 18  GLN   A C   1 
ATOM   10   O O   . GLN   A 1 3  ? -3.351  -13.347 39.447 1   45.03 ? 18  GLN   A O   1 
ATOM   11   C CB  . GLN   A 1 3  ? -5.776  -15.423 38.239 1   51.93 ? 18  GLN   A CB  1 
ATOM   12   C CG  . GLN   A 1 3  ? -6.758  -15.926 39.294 1   57.18 ? 18  GLN   A CG  1 
ATOM   13   C CD  . GLN   A 1 3  ? -8.191  -15.561 38.986 1   63.8  ? 18  GLN   A CD  1 
ATOM   14   O OE1 . GLN   A 1 3  ? -8.562  -15.285 37.836 1   65.7  ? 18  GLN   A OE1 1 
ATOM   15   N NE2 . GLN   A 1 3  ? -9.032  -15.561 40.014 1   65.15 ? 18  GLN   A NE2 1 
ATOM   16   N N   . ILE   A 1 4  ? -3.174  -13.944 37.265 1   40.09 ? 19  ILE   A N   1 
ATOM   17   C CA  . ILE   A 1 4  ? -1.734  -13.701 37.247 1   35.83 ? 19  ILE   A CA  1 
ATOM   18   C C   . ILE   A 1 4  ? -1.501  -12.169 37.23  1   31.54 ? 19  ILE   A C   1 
ATOM   19   O O   . ILE   A 1 4  ? -2.29   -11.431 36.647 1   30.1  ? 19  ILE   A O   1 
ATOM   20   C CB  . ILE   A 1 4  ? -0.919  -14.514 36.188 1   36.05 ? 19  ILE   A CB  1 
ATOM   21   C CG1 . ILE   A 1 4  ? -0.665  -13.735 34.882 1   37.17 ? 19  ILE   A CG1 1 
ATOM   22   C CG2 . ILE   A 1 4  ? -1.541  -15.89  35.905 1   36.65 ? 19  ILE   A CG2 1 
ATOM   23   C CD1 . ILE   A 1 4  ? 0.514   -14.308 34.077 1   38.19 ? 19  ILE   A CD1 1 
ATOM   24   N N   . PRO   A 1 5  ? -0.468  -11.696 37.942 1   29.5  ? 20  PRO   A N   1 
ATOM   25   C CA  . PRO   A 1 5  ? -0.22   -10.251 38.017 1   28.58 ? 20  PRO   A CA  1 
ATOM   26   C C   . PRO   A 1 5  ? 0.009   -9.614  36.663 1   28.05 ? 20  PRO   A C   1 
ATOM   27   O O   . PRO   A 1 5  ? 0.639   -10.211 35.792 1   28.45 ? 20  PRO   A O   1 
ATOM   28   C CB  . PRO   A 1 5  ? 1.064   -10.143 38.851 1   29.32 ? 20  PRO   A CB  1 
ATOM   29   C CG  . PRO   A 1 5  ? 1.21    -11.441 39.525 1   30.01 ? 20  PRO   A CG  1 
ATOM   30   C CD  . PRO   A 1 5  ? 0.533   -12.464 38.7   1   28.35 ? 20  PRO   A CD  1 
ATOM   31   N N   . ALA   A 1 6  ? -0.438  -8.382  36.523 1   27.81 ? 21  ALA   A N   1 
ATOM   32   C CA  . ALA   A 1 6  ? -0.275  -7.679  35.268 1   28.2  ? 21  ALA   A CA  1 
ATOM   33   C C   . ALA   A 1 6  ? 1.075   -6.979  35.192 1   28.18 ? 21  ALA   A C   1 
ATOM   34   O O   . ALA   A 1 6  ? 1.621   -6.569  36.203 1   28.63 ? 21  ALA   A O   1 
ATOM   35   C CB  . ALA   A 1 6  ? -1.407  -6.688  35.078 1   28.32 ? 21  ALA   A CB  1 
ATOM   36   N N   . SER   A 1 7  ? 1.634   -6.887  33.996 1   27.73 ? 22  SER   A N   1 
ATOM   37   C CA  . SER   A 1 7  ? 2.87    -6.145  33.765 1   27.55 ? 22  SER   A CA  1 
ATOM   38   C C   . SER   A 1 7  ? 2.48    -4.702  33.367 1   26.23 ? 22  SER   A C   1 
ATOM   39   O O   . SER   A 1 7  ? 1.301   -4.434  33.088 1   26.3  ? 22  SER   A O   1 
ATOM   40   C CB  . SER   A 1 7  ? 3.684   -6.805  32.655 1   29.98 ? 22  SER   A CB  1 
ATOM   41   O OG  . SER   A 1 7  ? 3.07    -6.601  31.39  1   33.48 ? 22  SER   A OG  1 
ATOM   42   N N   . GLU   A 1 8  ? 3.451   -3.789  33.304 1   24.69 ? 23  GLU   A N   1 
ATOM   43   C CA  . GLU   A 1 8  ? 3.158   -2.39   32.951 1   23.5  ? 23  GLU   A CA  1 
ATOM   44   C C   . GLU   A 1 8  ? 2.496   -2.27   31.566 1   23.9  ? 23  GLU   A C   1 
ATOM   45   O O   . GLU   A 1 8  ? 1.52    -1.534  31.428 1   24.36 ? 23  GLU   A O   1 
ATOM   46   C CB  . GLU   A 1 8  ? 4.414   -1.527  33.012 1   23.05 ? 23  GLU   A CB  1 
ATOM   47   C CG  . GLU   A 1 8  ? 4.093   -0.05   32.821 1   24.2  ? 23  GLU   A CG  1 
ATOM   48   C CD  . GLU   A 1 8  ? 5.287   0.874   32.917 1   27.61 ? 23  GLU   A CD  1 
ATOM   49   O OE1 . GLU   A 1 8  ? 6.436   0.381   32.847 1   27.43 ? 23  GLU   A OE1 1 
ATOM   50   O OE2 . GLU   A 1 8  ? 5.069   2.097   33.069 1   29.15 ? 23  GLU   A OE2 1 
ATOM   51   N N   . GLN   A 1 9  ? 2.956   -3.043  30.574 1   23.15 ? 24  GLN   A N   1 
ATOM   52   C CA  . GLN   A 1 9  ? 2.368   -2.983  29.224 1   24.43 ? 24  GLN   A CA  1 
ATOM   53   C C   . GLN   A 1 9  ? 0.912   -3.46   29.165 1   24.54 ? 24  GLN   A C   1 
ATOM   54   O O   . GLN   A 1 9  ? 0.205   -3.158  28.201 1   24.74 ? 24  GLN   A O   1 
ATOM   55   C CB  . GLN   A 1 9  ? 3.209   -3.8    28.237 1   27.87 ? 24  GLN   A CB  1 
ATOM   56   C CG  . GLN   A 1 9  ? 4.693   -3.426  28.25  1   35.41 ? 24  GLN   A CG  1 
ATOM   57   C CD  . GLN   A 1 9  ? 5.091   -2.591  27.082 1   41.98 ? 24  GLN   A CD  1 
ATOM   58   O OE1 . GLN   A 1 9  ? 4.519   -2.697  25.998 1   44.39 ? 24  GLN   A OE1 1 
ATOM   59   N NE2 . GLN   A 1 9  ? 6.091   -1.745  27.281 1   43.25 ? 24  GLN   A NE2 1 
ATOM   60   N N   . GLU   A 1 10 ? 0.469   -4.241  30.172 1   24.75 ? 25  GLU   A N   1 
ATOM   61   C CA  . GLU   A 1 10 ? -0.912  -4.714  30.239 1   25.47 ? 25  GLU   A CA  1 
ATOM   62   C C   . GLU   A 1 10 ? -1.872  -3.735  30.942 1   26.22 ? 25  GLU   A C   1 
ATOM   63   O O   . GLU   A 1 10 ? -3.085  -3.99   30.993 1   27.4  ? 25  GLU   A O   1 
ATOM   64   C CB  . GLU   A 1 10 ? -0.956  -6.089  30.93  1   27.8  ? 25  GLU   A CB  1 
ATOM   65   C CG  . GLU   A 1 10 ? -0.422  -7.195  30.038 1   30.65 ? 25  GLU   A CG  1 
ATOM   66   C CD  . GLU   A 1 10 ? -0.203  -8.51   30.751 1   39.33 ? 25  GLU   A CD  1 
ATOM   67   O OE1 . GLU   A 1 10 ? 0.015   -8.489  31.983 1   39.25 ? 25  GLU   A OE1 1 
ATOM   68   O OE2 . GLU   A 1 10 ? -0.237  -9.565  30.077 1   44.8  ? 25  GLU   A OE2 1 
ATOM   69   N N   . THR   A 1 11 ? -1.356  -2.616  31.455 1   25.66 ? 26  THR   A N   1 
ATOM   70   C CA  . THR   A 1 11 ? -2.155  -1.609  32.167 1   26.09 ? 26  THR   A CA  1 
ATOM   71   C C   . THR   A 1 11 ? -3.273  -1.087  31.279 1   25.42 ? 26  THR   A C   1 
ATOM   72   O O   . THR   A 1 11 ? -2.993  -0.716  30.141 1   24.36 ? 26  THR   A O   1 
ATOM   73   C CB  . THR   A 1 11 ? -1.262  -0.438  32.59  1   27.87 ? 26  THR   A CB  1 
ATOM   74   O OG1 . THR   A 1 11 ? -0.197  -0.939  33.379 1   30.52 ? 26  THR   A OG1 1 
ATOM   75   C CG2 . THR   A 1 11 ? -2.026  0.638   33.382 1   28.7  ? 26  THR   A CG2 1 
ATOM   76   N N   . LEU   A 1 12 ? -4.525  -1.09   31.768 1   24.77 ? 27  LEU   A N   1 
ATOM   77   C CA  . LEU   A 1 12 ? -5.631  -0.533  30.981 1   25.14 ? 27  LEU   A CA  1 
ATOM   78   C C   . LEU   A 1 12 ? -5.682  0.971   31.241 1   23.96 ? 27  LEU   A C   1 
ATOM   79   O O   . LEU   A 1 12 ? -5.604  1.41    32.379 1   23.9  ? 27  LEU   A O   1 
ATOM   80   C CB  . LEU   A 1 12 ? -6.981  -1.193  31.317 1   26.75 ? 27  LEU   A CB  1 
ATOM   81   C CG  . LEU   A 1 12 ? -7.185  -2.579  30.677 1   31.34 ? 27  LEU   A CG  1 
ATOM   82   C CD1 . LEU   A 1 12 ? -8.367  -3.32   31.319 1   32.94 ? 27  LEU   A CD1 1 
ATOM   83   C CD2 . LEU   A 1 12 ? -7.364  -2.458  29.147 1   32.25 ? 27  LEU   A CD2 1 
ATOM   84   N N   . VAL   A 1 13 ? -5.771  1.751   30.187 1   23.2  ? 28  VAL   A N   1 
ATOM   85   C CA  . VAL   A 1 13 ? -5.762  3.201   30.263 1   22.01 ? 28  VAL   A CA  1 
ATOM   86   C C   . VAL   A 1 13 ? -6.879  3.834   29.438 1   22.35 ? 28  VAL   A C   1 
ATOM   87   O O   . VAL   A 1 13 ? -7.317  3.293   28.408 1   22.31 ? 28  VAL   A O   1 
ATOM   88   C CB  . VAL   A 1 13 ? -4.386  3.767   29.807 1   22.02 ? 28  VAL   A CB  1 
ATOM   89   C CG1 . VAL   A 1 13 ? -3.23   3.206   30.639 1   21.93 ? 28  VAL   A CG1 1 
ATOM   90   C CG2 . VAL   A 1 13 ? -4.144  3.544   28.313 1   22.17 ? 28  VAL   A CG2 1 
ATOM   91   N N   . ARG   A 1 14 ? -7.257  5.044   29.834 1   22.88 ? 29  ARG   A N   1 
ATOM   92   C CA  . ARG   A 1 14 ? -8.224  5.818   29.105 1   24.53 ? 29  ARG   A CA  1 
ATOM   93   C C   . ARG   A 1 14 ? -7.53   7.084   28.684 1   24.16 ? 29  ARG   A C   1 
ATOM   94   O O   . ARG   A 1 14 ? -7.379  7.997   29.506 1   24.75 ? 29  ARG   A O   1 
ATOM   95   C CB  . ARG   A 1 14 ? -9.444  6.136   29.98  1   28.68 ? 29  ARG   A CB  1 
ATOM   96   C CG  . ARG   A 1 14 ? -10.477 5.014   29.923 1   35.41 ? 29  ARG   A CG  1 
ATOM   97   C CD  . ARG   A 1 14 ? -11.706 5.566   29.234 1   42.63 ? 29  ARG   A CD  1 
ATOM   98   N NE  . ARG   A 1 14 ? -12.53  4.543   28.593 1   49.05 ? 29  ARG   A NE  1 
ATOM   99   C CZ  . ARG   A 1 14 ? -13.712 4.784   28.028 1   53.7  ? 29  ARG   A CZ  1 
ATOM   100  N NH1 . ARG   A 1 14 ? -14.228 6.009   28.044 1   53.12 ? 29  ARG   A NH1 1 
ATOM   101  N NH2 . ARG   A 1 14 ? -14.397 3.798   27.463 1   55.45 ? 29  ARG   A NH2 1 
ATOM   102  N N   . PRO   A 1 15 ? -7.074  7.148   27.424 1   23.26 ? 30  PRO   A N   1 
ATOM   103  C CA  . PRO   A 1 15 ? -6.394  8.358   26.966 1   23.14 ? 30  PRO   A CA  1 
ATOM   104  C C   . PRO   A 1 15 ? -7.277  9.596   27.031 1   23.02 ? 30  PRO   A C   1 
ATOM   105  O O   . PRO   A 1 15 ? -8.485  9.552   26.728 1   22.74 ? 30  PRO   A O   1 
ATOM   106  C CB  . PRO   A 1 15 ? -6.016  8.034   25.505 1   23.62 ? 30  PRO   A CB  1 
ATOM   107  C CG  . PRO   A 1 15 ? -5.977  6.501   25.448 1   24.58 ? 30  PRO   A CG  1 
ATOM   108  C CD  . PRO   A 1 15 ? -7.13   6.119   26.359 1   22.79 ? 30  PRO   A CD  1 
ATOM   109  N N   . LYS   A 1 16 ? -6.656  10.697  27.446 1   23.34 ? 31  LYS   A N   1 
ATOM   110  C CA  . LYS   A 1 16 ? -7.248  12.035  27.474 1   23.58 ? 31  LYS   A CA  1 
ATOM   111  C C   . LYS   A 1 16 ? -7.458  12.533  26.03  1   24.59 ? 31  LYS   A C   1 
ATOM   112  O O   . LYS   A 1 16 ? -6.945  11.929  25.094 1   24.08 ? 31  LYS   A O   1 
ATOM   113  C CB  . LYS   A 1 16 ? -6.37   12.979  28.313 1   24.88 ? 31  LYS   A CB  1 
ATOM   114  C CG  . LYS   A 1 16 ? -6.464  12.681  29.804 1   27.52 ? 31  LYS   A CG  1 
ATOM   115  C CD  . LYS   A 1 16 ? -5.519  13.565  30.577 1   32.09 ? 31  LYS   A CD  1 
ATOM   116  C CE  . LYS   A 1 16 ? -5.665  13.344  32.065 1   36.31 ? 31  LYS   A CE  1 
ATOM   117  N NZ  . LYS   A 1 16 ? -4.411  13.705  32.775 1   39.35 ? 31  LYS   A NZ  1 
ATOM   118  N N   . PRO   A 1 17 ? -8.258  13.599  25.815 1   24.78 ? 32  PRO   A N   1 
ATOM   119  C CA  . PRO   A 1 17 ? -8.623  13.976  24.443 1   24.36 ? 32  PRO   A CA  1 
ATOM   120  C C   . PRO   A 1 17 ? -7.494  14.173  23.421 1   23.66 ? 32  PRO   A C   1 
ATOM   121  O O   . PRO   A 1 17 ? -7.68   13.703  22.312 1   23.19 ? 32  PRO   A O   1 
ATOM   122  C CB  . PRO   A 1 17 ? -9.435  15.256  24.637 1   25.81 ? 32  PRO   A CB  1 
ATOM   123  C CG  . PRO   A 1 17 ? -10.095 15.056  25.986 1   26.22 ? 32  PRO   A CG  1 
ATOM   124  C CD  . PRO   A 1 17 ? -9.037  14.365  26.816 1   24.98 ? 32  PRO   A CD  1 
ATOM   125  N N   . LEU   A 1 18 ? -6.371  14.855  23.746 1   23.95 ? 33  LEU   A N   1 
ATOM   126  C CA  . LEU   A 1 18 ? -5.303  15.042  22.749 1   23.82 ? 33  LEU   A CA  1 
ATOM   127  C C   . LEU   A 1 18 ? -4.717  13.694  22.312 1   22.81 ? 33  LEU   A C   1 
ATOM   128  O O   . LEU   A 1 18 ? -4.584  13.44   21.112 1   22.74 ? 33  LEU   A O   1 
ATOM   129  C CB  . LEU   A 1 18 ? -4.199  15.97   23.255 1   23.9  ? 33  LEU   A CB  1 
ATOM   130  C CG  . LEU   A 1 18 ? -4.618  17.386  23.631 1   25.82 ? 33  LEU   A CG  1 
ATOM   131  C CD1 . LEU   A 1 18 ? -3.467  18.1    24.317 1   26.33 ? 33  LEU   A CD1 1 
ATOM   132  C CD2 . LEU   A 1 18 ? -5.059  18.169  22.403 1   26.68 ? 33  LEU   A CD2 1 
ATOM   133  N N   . LEU   A 1 19 ? -4.383  12.84   23.273 1   22.49 ? 34  LEU   A N   1 
ATOM   134  C CA  . LEU   A 1 19 ? -3.814  11.509  22.975 1   23.44 ? 34  LEU   A CA  1 
ATOM   135  C C   . LEU   A 1 19 ? -4.827  10.586  22.283 1   24.14 ? 34  LEU   A C   1 
ATOM   136  O O   . LEU   A 1 19 ? -4.455  9.834   21.379 1   24.71 ? 34  LEU   A O   1 
ATOM   137  C CB  . LEU   A 1 19 ? -3.226  10.855  24.235 1   23.28 ? 34  LEU   A CB  1 
ATOM   138  C CG  . LEU   A 1 19 ? -2.666  9.427   24.037 1   25.07 ? 34  LEU   A CG  1 
ATOM   139  C CD1 . LEU   A 1 19 ? -1.477  9.441   23.096 1   26.21 ? 34  LEU   A CD1 1 
ATOM   140  C CD2 . LEU   A 1 19 ? -2.295  8.798   25.365 1   25.39 ? 34  LEU   A CD2 1 
ATOM   141  N N   . LEU   A 1 20 ? -6.113  10.685  22.659 1   23.31 ? 35  LEU   A N   1 
ATOM   142  C CA  . LEU   A 1 20 ? -7.149  9.88    22.017 1   23.73 ? 35  LEU   A CA  1 
ATOM   143  C C   . LEU   A 1 20 ? -7.282  10.249  20.547 1   22.82 ? 35  LEU   A C   1 
ATOM   144  O O   . LEU   A 1 20 ? -7.364  9.366   19.704 1   24.13 ? 35  LEU   A O   1 
ATOM   145  C CB  . LEU   A 1 20 ? -8.506  10.043  22.729 1   24.39 ? 35  LEU   A CB  1 
ATOM   146  C CG  . LEU   A 1 20 ? -9.578  9.047   22.312 1   26.85 ? 35  LEU   A CG  1 
ATOM   147  C CD1 . LEU   A 1 20 ? -9.093  7.57    22.505 1   27.35 ? 35  LEU   A CD1 1 
ATOM   148  C CD2 . LEU   A 1 20 ? -10.875 9.326   23.074 1   28.4  ? 35  LEU   A CD2 1 
ATOM   149  N N   . LYS   A 1 21 ? -7.203  11.541  20.228 1   21.75 ? 36  LYS   A N   1 
ATOM   150  C CA  . LYS   A 1 21 ? -7.272  12.017  18.851 1   22.21 ? 36  LYS   A CA  1 
ATOM   151  C C   . LYS   A 1 21 ? -6.09   11.482  18.027 1   22.37 ? 36  LYS   A C   1 
ATOM   152  O O   . LYS   A 1 21 ? -6.274  11.019  16.888 1   22.87 ? 36  LYS   A O   1 
ATOM   153  C CB  . LYS   A 1 21 ? -7.299  13.564  18.83  1   23.77 ? 36  LYS   A CB  1 
ATOM   154  C CG  . LYS   A 1 21 ? -7.369  14.161  17.423 1   26.89 ? 36  LYS   A CG  1 
ATOM   155  C CD  . LYS   A 1 21 ? -7.426  15.698  17.528 1   31.86 ? 36  LYS   A CD  1 
ATOM   156  C CE  . LYS   A 1 21 ? -7.413  16.391  16.188 1   37.27 ? 36  LYS   A CE  1 
ATOM   157  N NZ  . LYS   A 1 21 ? -8.643  16.099  15.423 1   40.31 ? 36  LYS   A NZ  1 
ATOM   158  N N   . LEU   A 1 22 ? -4.894  11.492  18.622 1   21.99 ? 37  LEU   A N   1 
ATOM   159  C CA  . LEU   A 1 22 ? -3.692  10.965  17.993 1   22.16 ? 37  LEU   A CA  1 
ATOM   160  C C   . LEU   A 1 22 ? -3.877  9.464   17.68  1   22.79 ? 37  LEU   A C   1 
ATOM   161  O O   . LEU   A 1 22 ? -3.663  9.046   16.541 1   22.66 ? 37  LEU   A O   1 
ATOM   162  C CB  . LEU   A 1 22 ? -2.464  11.195  18.921 1   22.11 ? 37  LEU   A CB  1 
ATOM   163  C CG  . LEU   A 1 22 ? -1.071  10.775  18.354 1   23.56 ? 37  LEU   A CG  1 
ATOM   164  C CD1 . LEU   A 1 22 ? 0.04    11.519  19.049 1   24.73 ? 37  LEU   A CD1 1 
ATOM   165  C CD2 . LEU   A 1 22 ? -0.818  9.261   18.505 1   23.89 ? 37  LEU   A CD2 1 
ATOM   166  N N   . LEU   A 1 23 ? -4.277  8.681   18.686 1   24.11 ? 38  LEU   A N   1 
ATOM   167  C CA  . LEU   A 1 23 ? -4.477  7.228   18.558 1   26.11 ? 38  LEU   A CA  1 
ATOM   168  C C   . LEU   A 1 23 ? -5.507  6.864   17.512 1   27.88 ? 38  LEU   A C   1 
ATOM   169  O O   . LEU   A 1 23 ? -5.266  5.961   16.703 1   28.66 ? 38  LEU   A O   1 
ATOM   170  C CB  . LEU   A 1 23 ? -4.82   6.596   19.911 1   25.94 ? 38  LEU   A CB  1 
ATOM   171  C CG  . LEU   A 1 23 ? -3.696  6.721   20.959 1   26.63 ? 38  LEU   A CG  1 
ATOM   172  C CD1 . LEU   A 1 23 ? -4.165  6.277   22.328 1   27.01 ? 38  LEU   A CD1 1 
ATOM   173  C CD2 . LEU   A 1 23 ? -2.459  5.96    20.55  1   27.59 ? 38  LEU   A CD2 1 
ATOM   174  N N   . LYS   A 1 24 ? -6.618  7.598   17.476 1   27.85 ? 39  LYS   A N   1 
ATOM   175  C CA  . LYS   A 1 24 ? -7.678  7.35    16.517 1   29.3  ? 39  LYS   A CA  1 
ATOM   176  C C   . LYS   A 1 24 ? -7.305  7.782   15.094 1   30.46 ? 39  LYS   A C   1 
ATOM   177  O O   . LYS   A 1 24 ? -7.831  7.209   14.135 1   31.2  ? 39  LYS   A O   1 
ATOM   178  C CB  . LYS   A 1 24 ? -9.021  7.97    16.981 1   31.32 ? 39  LYS   A CB  1 
ATOM   179  C CG  . LYS   A 1 24 ? -9.614  7.27    18.208 1   35.71 ? 39  LYS   A CG  1 
ATOM   180  C CD  . LYS   A 1 24 ? -11.048 7.721   18.479 1   39.61 ? 39  LYS   A CD  1 
ATOM   181  C CE  . LYS   A 1 24 ? -11.664 6.974   19.627 1   42.68 ? 39  LYS   A CE  1 
ATOM   182  N NZ  . LYS   A 1 24 ? -13.136 7.166   19.676 1   45.33 ? 39  LYS   A NZ  1 
ATOM   183  N N   . SER   A 1 25 ? -6.35   8.729   14.937 1   30.38 ? 40  SER   A N   1 
ATOM   184  C CA  . SER   A 1 25 ? -5.931  9.14    13.597 1   30.23 ? 40  SER   A CA  1 
ATOM   185  C C   . SER   A 1 25 ? -5.197  8.016   12.839 1   30.46 ? 40  SER   A C   1 
ATOM   186  O O   . SER   A 1 25 ? -5.141  8.056   11.613 1   30.77 ? 40  SER   A O   1 
ATOM   187  C CB  . SER   A 1 25 ? -5.096  10.415  13.636 1   31.02 ? 40  SER   A CB  1 
ATOM   188  O OG  . SER   A 1 25 ? -3.789  10.165  14.131 1   32.6  ? 40  SER   A OG  1 
ATOM   189  N N   . VAL   A 1 26 ? -4.643  7.025   13.543 1   30.82 ? 41  VAL   A N   1 
ATOM   190  C CA  . VAL   A 1 26 ? -3.981  5.903   12.875 1   32.15 ? 41  VAL   A CA  1 
ATOM   191  C C   . VAL   A 1 26 ? -4.887  4.673   12.785 1   35.16 ? 41  VAL   A C   1 
ATOM   192  O O   . VAL   A 1 26 ? -4.386  3.56    12.641 1   35.33 ? 41  VAL   A O   1 
ATOM   193  C CB  . VAL   A 1 26 ? -2.573  5.547   13.424 1   32.52 ? 41  VAL   A CB  1 
ATOM   194  C CG1 . VAL   A 1 26 ? -1.547  6.575   12.992 1   32.77 ? 41  VAL   A CG1 1 
ATOM   195  C CG2 . VAL   A 1 26 ? -2.569  5.381   14.94  1   33.11 ? 41  VAL   A CG2 1 
ATOM   196  N N   . GLY   A 1 27 ? -6.205  4.874   12.839 1   37.02 ? 42  GLY   A N   1 
ATOM   197  C CA  . GLY   A 1 27 ? -7.162  3.79    12.684 1   39.12 ? 42  GLY   A CA  1 
ATOM   198  C C   . GLY   A 1 27 ? -7.635  3.068   13.928 1   40.35 ? 42  GLY   A C   1 
ATOM   199  O O   . GLY   A 1 27 ? -8.563  2.267   13.822 1   41.43 ? 42  GLY   A O   1 
ATOM   200  N N   . ALA   A 1 28 ? -7.028  3.313   15.109 1   40.43 ? 43  ALA   A N   1 
ATOM   201  C CA  . ALA   A 1 28 ? -7.501  2.668   16.345 1   41.7  ? 43  ALA   A CA  1 
ATOM   202  C C   . ALA   A 1 28 ? -8.903  3.249   16.656 1   42.54 ? 43  ALA   A C   1 
ATOM   203  O O   . ALA   A 1 28 ? -9.094  4.46    16.529 1   43.08 ? 43  ALA   A O   1 
ATOM   204  C CB  . ALA   A 1 28 ? -6.542  2.938   17.492 1   41.92 ? 43  ALA   A CB  1 
ATOM   205  N N   . GLN   A 1 29 ? -9.893  2.394   16.928 1   41.88 ? 44  GLN   A N   1 
ATOM   206  C CA  . GLN   A 1 29 ? -11.267 2.876   17.073 1   41.98 ? 44  GLN   A CA  1 
ATOM   207  C C   . GLN   A 1 29 ? -11.91  2.536   18.409 1   40.17 ? 44  GLN   A C   1 
ATOM   208  O O   . GLN   A 1 29 ? -13.083 2.146   18.457 1   41.14 ? 44  GLN   A O   1 
ATOM   209  C CB  . GLN   A 1 29 ? -12.156 2.425   15.887 1   45.53 ? 44  GLN   A CB  1 
ATOM   210  C CG  . GLN   A 1 29 ? -11.591 1.265   15.045 1   52.26 ? 44  GLN   A CG  1 
ATOM   211  C CD  . GLN   A 1 29 ? -12.185 1.175   13.654 1   60    ? 44  GLN   A CD  1 
ATOM   212  O OE1 . GLN   A 1 29 ? -11.508 0.783   12.691 1   62.63 ? 44  GLN   A OE1 1 
ATOM   213  N NE2 . GLN   A 1 29 ? -13.462 1.532   13.508 1   61.24 ? 44  GLN   A NE2 1 
ATOM   214  N N   . LYS   A 1 30 ? -11.173 2.739   19.493 1   37.36 ? 45  LYS   A N   1 
ATOM   215  C CA  . LYS   A 1 30 ? -11.721 2.521   20.825 1   36.27 ? 45  LYS   A CA  1 
ATOM   216  C C   . LYS   A 1 30 ? -11.295 3.614   21.793 1   35.16 ? 45  LYS   A C   1 
ATOM   217  O O   . LYS   A 1 30 ? -10.535 4.512   21.417 1   35.26 ? 45  LYS   A O   1 
ATOM   218  C CB  . LYS   A 1 30 ? -11.398 1.113   21.336 1   37.12 ? 45  LYS   A CB  1 
ATOM   219  C CG  . LYS   A 1 30 ? -9.925  0.83    21.494 1   38    ? 45  LYS   A CG  1 
ATOM   220  C CD  . LYS   A 1 30 ? -9.743  -0.677  21.493 1   40.5  ? 45  LYS   A CD  1 
ATOM   221  C CE  . LYS   A 1 30 ? -8.344  -1.109  21.827 1   42.17 ? 45  LYS   A CE  1 
ATOM   222  N NZ  . LYS   A 1 30 ? -8.285  -2.572  22.077 1   43.42 ? 45  LYS   A NZ  1 
ATOM   223  N N   . ASP   A 1 31 ? -11.819 3.579   23.013 1   34.12 ? 46  ASP   A N   1 
ATOM   224  C CA  . ASP   A 1 31 ? -11.506 4.579   24.013 1   34.19 ? 46  ASP   A CA  1 
ATOM   225  C C   . ASP   A 1 31 ? -10.67  4.014   25.168 1   32.5  ? 46  ASP   A C   1 
ATOM   226  O O   . ASP   A 1 31 ? -10.102 4.79    25.914 1   32.88 ? 46  ASP   A O   1 
ATOM   227  C CB  . ASP   A 1 31 ? -12.797 5.244   24.528 1   37.9  ? 46  ASP   A CB  1 
ATOM   228  C CG  . ASP   A 1 31 ? -13.737 5.694   23.413 1   45.72 ? 46  ASP   A CG  1 
ATOM   229  O OD1 . ASP   A 1 31 ? -13.469 6.745   22.799 1   46.08 ? 46  ASP   A OD1 1 
ATOM   230  O OD2 . ASP   A 1 31 ? -14.745 4.986   23.158 1   49.89 ? 46  ASP   A OD2 1 
ATOM   231  N N   . THR   A 1 32 ? -10.645 2.681   25.361 1   30.79 ? 47  THR   A N   1 
ATOM   232  C CA  . THR   A 1 32 ? -9.86   2.021   26.402 1   30.08 ? 47  THR   A CA  1 
ATOM   233  C C   . THR   A 1 32 ? -8.756  1.209   25.717 1   27.92 ? 47  THR   A C   1 
ATOM   234  O O   . THR   A 1 32 ? -9.03   0.46    24.783 1   27.69 ? 47  THR   A O   1 
ATOM   235  C CB  . THR   A 1 32 ? -10.739 1.099   27.27  1   32.61 ? 47  THR   A CB  1 
ATOM   236  O OG1 . THR   A 1 32 ? -11.902 1.812   27.677 1   34.75 ? 47  THR   A OG1 1 
ATOM   237  C CG2 . THR   A 1 32 ? -10.024 0.627   28.508 1   32.85 ? 47  THR   A CG2 1 
ATOM   238  N N   . TYR   A 1 33 ? -7.514  1.383   26.164 1   25.89 ? 48  TYR   A N   1 
ATOM   239  C CA  . TYR   A 1 33 ? -6.35   0.729   25.57  1   25.56 ? 48  TYR   A CA  1 
ATOM   240  C C   . TYR   A 1 33 ? -5.475  0.103   26.623 1   24.33 ? 48  TYR   A C   1 
ATOM   241  O O   . TYR   A 1 33 ? -5.538  0.499   27.78  1   24.65 ? 48  TYR   A O   1 
ATOM   242  C CB  . TYR   A 1 33 ? -5.469  1.81    24.886 1   26.01 ? 48  TYR   A CB  1 
ATOM   243  C CG  . TYR   A 1 33 ? -6.1    2.456   23.676 1   28.37 ? 48  TYR   A CG  1 
ATOM   244  C CD1 . TYR   A 1 33 ? -7.014  3.49    23.813 1   29.8  ? 48  TYR   A CD1 1 
ATOM   245  C CD2 . TYR   A 1 33 ? -5.772  2.046   22.396 1   30.77 ? 48  TYR   A CD2 1 
ATOM   246  C CE1 . TYR   A 1 33 ? -7.618  4.07    22.711 1   31.12 ? 48  TYR   A CE1 1 
ATOM   247  C CE2 . TYR   A 1 33 ? -6.387  2.604   21.281 1   32.15 ? 48  TYR   A CE2 1 
ATOM   248  C CZ  . TYR   A 1 33 ? -7.3    3.627   21.444 1   32.86 ? 48  TYR   A CZ  1 
ATOM   249  O OH  . TYR   A 1 33 ? -7.911  4.213   20.357 1   35.03 ? 48  TYR   A OH  1 
ATOM   250  N N   . THR   A 1 34 ? -4.609  -0.832  26.234 1   22.98 ? 49  THR   A N   1 
ATOM   251  C CA  . THR   A 1 34 ? -3.558  -1.278  27.139 1   22.4  ? 49  THR   A CA  1 
ATOM   252  C C   . THR   A 1 34 ? -2.358  -0.336  26.838 1   21.02 ? 49  THR   A C   1 
ATOM   253  O O   . THR   A 1 34 ? -2.278  0.235   25.74  1   21.3  ? 49  THR   A O   1 
ATOM   254  C CB  . THR   A 1 34 ? -3.126  -2.714  26.915 1   24.79 ? 49  THR   A CB  1 
ATOM   255  O OG1 . THR   A 1 34 ? -2.653  -2.853  25.563 1   26.47 ? 49  THR   A OG1 1 
ATOM   256  C CG2 . THR   A 1 34 ? -4.213  -3.719  27.273 1   26.01 ? 49  THR   A CG2 1 
ATOM   257  N N   . MET   A 1 35 ? -1.396  -0.225  27.762 1   19.87 ? 50  MET   A N   1 
ATOM   258  C CA  . MET   A 1 35 ? -0.197  0.587   27.527 1   20.8  ? 50  MET   A CA  1 
ATOM   259  C C   . MET   A 1 35 ? 0.562   0.089   26.281 1   20.8  ? 50  MET   A C   1 
ATOM   260  O O   . MET   A 1 35 ? 1.096   0.9     25.537 1   20.47 ? 50  MET   A O   1 
ATOM   261  C CB  . MET   A 1 35 ? 0.724   0.554   28.762 1   21.97 ? 50  MET   A CB  1 
ATOM   262  C CG  . MET   A 1 35 ? 0.311   1.573   29.822 1   26.05 ? 50  MET   A CG  1 
ATOM   263  S SD  . MET   A 1 35 ? 0.465   3.286   29.192 1   32.54 ? 50  MET   A SD  1 
ATOM   264  C CE  . MET   A 1 35 ? 2.122   3.219   28.438 1   19.38 ? 50  MET   A CE  1 
ATOM   265  N N   . LYS   A 1 36 ? 0.519   -1.254  26.021 1   20.06 ? 51  LYS   A N   1 
ATOM   266  C CA  . LYS   A 1 36 ? 1.137   -1.843  24.827 1   20.65 ? 51  LYS   A CA  1 
ATOM   267  C C   . LYS   A 1 36 ? 0.504   -1.288  23.557 1   21.01 ? 51  LYS   A C   1 
ATOM   268  O O   . LYS   A 1 36 ? 1.215   -0.951  22.608 1   22.19 ? 51  LYS   A O   1 
ATOM   269  C CB  . LYS   A 1 36 ? 0.981   -3.385  24.83  1   22.96 ? 51  LYS   A CB  1 
ATOM   270  C CG  . LYS   A 1 36 ? 1.624   -4.062  23.617 1   28.9  ? 51  LYS   A CG  1 
ATOM   271  C CD  . LYS   A 1 36 ? 1.382   -5.576  23.588 1   35.52 ? 51  LYS   A CD  1 
ATOM   272  C CE  . LYS   A 1 36 ? 2.321   -6.318  24.507 1   40.72 ? 51  LYS   A CE  1 
ATOM   273  N NZ  . LYS   A 1 36 ? 2.46    -7.746  24.115 1   43.87 ? 51  LYS   A NZ  1 
ATOM   274  N N   . GLU   A 1 37 ? -0.822  -1.145  23.544 1   20.04 ? 52  GLU   A N   1 
ATOM   275  C CA  . GLU   A 1 37 ? -1.513  -0.594  22.389 1   20.36 ? 52  GLU   A CA  1 
ATOM   276  C C   . GLU   A 1 37 ? -1.175  0.871   22.205 1   20.31 ? 52  GLU   A C   1 
ATOM   277  O O   . GLU   A 1 37 ? -0.864  1.299   21.085 1   20.24 ? 52  GLU   A O   1 
ATOM   278  C CB  . GLU   A 1 37 ? -3.029  -0.775  22.528 1   22.19 ? 52  GLU   A CB  1 
ATOM   279  C CG  . GLU   A 1 37 ? -3.447  -2.219  22.384 1   24.35 ? 52  GLU   A CG  1 
ATOM   280  C CD  . GLU   A 1 37 ? -4.926  -2.43   22.59  1   31.12 ? 52  GLU   A CD  1 
ATOM   281  O OE1 . GLU   A 1 37 ? -5.557  -3.112  21.748 1   36.35 ? 52  GLU   A OE1 1 
ATOM   282  O OE2 . GLU   A 1 37 ? -5.456  -1.919  23.601 1   30.23 ? 52  GLU   A OE2 1 
ATOM   283  N N   . VAL   A 1 38 ? -1.144  1.644   23.29  1   19.97 ? 53  VAL   A N   1 
ATOM   284  C CA  . VAL   A 1 38 ? -0.749  3.07    23.213 1   20.05 ? 53  VAL   A CA  1 
ATOM   285  C C   . VAL   A 1 38 ? 0.646   3.204   22.574 1   20.84 ? 53  VAL   A C   1 
ATOM   286  O O   . VAL   A 1 38 ? 0.788   3.92    21.592 1   21.63 ? 53  VAL   A O   1 
ATOM   287  C CB  . VAL   A 1 38 ? -0.791  3.768   24.593 1   19.52 ? 53  VAL   A CB  1 
ATOM   288  C CG1 . VAL   A 1 38 ? -0.314  5.232   24.472 1   19.89 ? 53  VAL   A CG1 1 
ATOM   289  C CG2 . VAL   A 1 38 ? -2.204  3.721   25.193 1   19.98 ? 53  VAL   A CG2 1 
ATOM   290  N N   . LEU   A 1 39 ? 1.624   2.413   23.041 1   21.25 ? 54  LEU   A N   1 
ATOM   291  C CA  . LEU   A 1 39 ? 2.977   2.433   22.479 1   21.77 ? 54  LEU   A CA  1 
ATOM   292  C C   . LEU   A 1 39 ? 2.966   2.043   21.003 1   22.44 ? 54  LEU   A C   1 
ATOM   293  O O   . LEU   A 1 39 ? 3.608   2.681   20.171 1   23.74 ? 54  LEU   A O   1 
ATOM   294  C CB  . LEU   A 1 39 ? 3.918   1.513   23.28  1   21.85 ? 54  LEU   A CB  1 
ATOM   295  C CG  . LEU   A 1 39 ? 4.355   2.058   24.653 1   24.53 ? 54  LEU   A CG  1 
ATOM   296  C CD1 . LEU   A 1 39 ? 5.209   1.041   25.386 1   25.6  ? 54  LEU   A CD1 1 
ATOM   297  C CD2 . LEU   A 1 39 ? 5.124   3.358   24.501 1   25.62 ? 54  LEU   A CD2 1 
ATOM   298  N N   . PHE   A 1 40 ? 2.222   1.006   20.682 1   21.78 ? 55  PHE   A N   1 
ATOM   299  C CA  . PHE   A 1 40 ? 2.106   0.52    19.317 1   22.28 ? 55  PHE   A CA  1 
ATOM   300  C C   . PHE   A 1 40 ? 1.561   1.586   18.339 1   21.97 ? 55  PHE   A C   1 
ATOM   301  O O   . PHE   A 1 40 ? 2.176   1.846   17.298 1   21.46 ? 55  PHE   A O   1 
ATOM   302  C CB  . PHE   A 1 40 ? 1.236   -0.753  19.316 1   21.97 ? 55  PHE   A CB  1 
ATOM   303  C CG  . PHE   A 1 40 ? 1.185   -1.447  17.988 1   22.78 ? 55  PHE   A CG  1 
ATOM   304  C CD1 . PHE   A 1 40 ? 0.21    -1.122  17.056 1   23.16 ? 55  PHE   A CD1 1 
ATOM   305  C CD2 . PHE   A 1 40 ? 2.116   -2.424  17.664 1   23.45 ? 55  PHE   A CD2 1 
ATOM   306  C CE1 . PHE   A 1 40 ? 0.155   -1.779  15.831 1   23.57 ? 55  PHE   A CE1 1 
ATOM   307  C CE2 . PHE   A 1 40 ? 2.066   -3.07   16.432 1   24.36 ? 55  PHE   A CE2 1 
ATOM   308  C CZ  . PHE   A 1 40 ? 1.088   -2.737  15.526 1   23.93 ? 55  PHE   A CZ  1 
ATOM   309  N N   . TYR   A 1 41 ? 0.398   2.172   18.655 1   21.85 ? 56  TYR   A N   1 
ATOM   310  C CA  . TYR   A 1 41 ? -0.247  3.169   17.795 1   21.25 ? 56  TYR   A CA  1 
ATOM   311  C C   . TYR   A 1 41 ? 0.522   4.502   17.808 1   21.11 ? 56  TYR   A C   1 
ATOM   312  O O   . TYR   A 1 41 ? 0.563   5.18    16.791 1   20.68 ? 56  TYR   A O   1 
ATOM   313  C CB  . TYR   A 1 41 ? -1.734  3.344   18.153 1   22.03 ? 56  TYR   A CB  1 
ATOM   314  C CG  . TYR   A 1 41 ? -2.54   2.106   17.836 1   24.55 ? 56  TYR   A CG  1 
ATOM   315  C CD1 . TYR   A 1 41 ? -2.548  1.568   16.559 1   26.03 ? 56  TYR   A CD1 1 
ATOM   316  C CD2 . TYR   A 1 41 ? -3.217  1.418   18.835 1   26.67 ? 56  TYR   A CD2 1 
ATOM   317  C CE1 . TYR   A 1 41 ? -3.189  0.363   16.286 1   27.82 ? 56  TYR   A CE1 1 
ATOM   318  C CE2 . TYR   A 1 41 ? -3.922  0.252   18.559 1   28.22 ? 56  TYR   A CE2 1 
ATOM   319  C CZ  . TYR   A 1 41 ? -3.905  -0.274  17.281 1   29.73 ? 56  TYR   A CZ  1 
ATOM   320  O OH  . TYR   A 1 41 ? -4.582  -1.444  17.013 1   33.32 ? 56  TYR   A OH  1 
ATOM   321  N N   . LEU   A 1 42 ? 1.173   4.851   18.931 1   20.76 ? 57  LEU   A N   1 
ATOM   322  C CA  . LEU   A 1 42 ? 2.019   6.047   18.978 1   21.04 ? 57  LEU   A CA  1 
ATOM   323  C C   . LEU   A 1 42 ? 3.225   5.839   18.015 1   20.71 ? 57  LEU   A C   1 
ATOM   324  O O   . LEU   A 1 42 ? 3.558   6.742   17.242 1   20.84 ? 57  LEU   A O   1 
ATOM   325  C CB  . LEU   A 1 42 ? 2.488   6.34    20.419 1   20.96 ? 57  LEU   A CB  1 
ATOM   326  C CG  . LEU   A 1 42 ? 3.439   7.523   20.601 1   23.33 ? 57  LEU   A CG  1 
ATOM   327  C CD1 . LEU   A 1 42 ? 2.843   8.829   20.001 1   23.42 ? 57  LEU   A CD1 1 
ATOM   328  C CD2 . LEU   A 1 42 ? 3.732   7.759   22.099 1   23.84 ? 57  LEU   A CD2 1 
ATOM   329  N N   . GLY   A 1 43 ? 3.812   4.637   18.025 1   18.8  ? 58  GLY   A N   1 
ATOM   330  C CA  . GLY   A 1 43 ? 4.908   4.286   17.124 1   19.61 ? 58  GLY   A CA  1 
ATOM   331  C C   . GLY   A 1 43 ? 4.478   4.351   15.669 1   20.34 ? 58  GLY   A C   1 
ATOM   332  O O   . GLY   A 1 43 ? 5.196   4.902   14.83  1   19.72 ? 58  GLY   A O   1 
ATOM   333  N N   . GLN   A 1 44 ? 3.257   3.876   15.372 1   20.9  ? 59  GLN   A N   1 
ATOM   334  C CA  . GLN   A 1 44 ? 2.683   3.95    14.023 1   21.91 ? 59  GLN   A CA  1 
ATOM   335  C C   . GLN   A 1 44 ? 2.472   5.374   13.581 1   23.04 ? 59  GLN   A C   1 
ATOM   336  O O   . GLN   A 1 44 ? 2.684   5.681   12.417 1   24.88 ? 59  GLN   A O   1 
ATOM   337  C CB  . GLN   A 1 44 ? 1.328   3.245   13.956 1   23.71 ? 59  GLN   A CB  1 
ATOM   338  C CG  . GLN   A 1 44 ? 1.402   1.746   13.845 1   26.7  ? 59  GLN   A CG  1 
ATOM   339  C CD  . GLN   A 1 44 ? 0.075   1.153   13.408 1   30.08 ? 59  GLN   A CD  1 
ATOM   340  O OE1 . GLN   A 1 44 ? -1.003  1.769   13.521 1   32.22 ? 59  GLN   A OE1 1 
ATOM   341  N NE2 . GLN   A 1 44 ? 0.13    -0.058  12.88  1   28.79 ? 59  GLN   A NE2 1 
ATOM   342  N N   . TYR   A 1 45 ? 1.974   6.221   14.467 1   22.1  ? 60  TYR   A N   1 
ATOM   343  C CA  . TYR   A 1 45 ? 1.717   7.631   14.177 1   21.75 ? 60  TYR   A CA  1 
ATOM   344  C C   . TYR   A 1 45 ? 3.013   8.347   13.795 1   22.02 ? 60  TYR   A C   1 
ATOM   345  O O   . TYR   A 1 45 ? 3.053   9.022   12.767 1   23.58 ? 60  TYR   A O   1 
ATOM   346  C CB  . TYR   A 1 45 ? 1.071   8.276   15.398 1   22.09 ? 60  TYR   A CB  1 
ATOM   347  C CG  . TYR   A 1 45 ? 0.772   9.745   15.237 1   23.21 ? 60  TYR   A CG  1 
ATOM   348  C CD1 . TYR   A 1 45 ? -0.449  10.176  14.732 1   24.33 ? 60  TYR   A CD1 1 
ATOM   349  C CD2 . TYR   A 1 45 ? 1.693   10.707  15.62  1   24.25 ? 60  TYR   A CD2 1 
ATOM   350  C CE1 . TYR   A 1 45 ? -0.75   11.528  14.629 1   24.9  ? 60  TYR   A CE1 1 
ATOM   351  C CE2 . TYR   A 1 45 ? 1.43    12.065  15.453 1   25.16 ? 60  TYR   A CE2 1 
ATOM   352  C CZ  . TYR   A 1 45 ? 0.192   12.471  14.989 1   26.32 ? 60  TYR   A CZ  1 
ATOM   353  O OH  . TYR   A 1 45 ? -0.089  13.813  14.855 1   27.22 ? 60  TYR   A OH  1 
ATOM   354  N N   . ILE   A 1 46 ? 4.086   8.206   14.599 1   21.08 ? 61  ILE   A N   1 
ATOM   355  C CA  . ILE   A 1 46 ? 5.348   8.866   14.288 1   20.59 ? 61  ILE   A CA  1 
ATOM   356  C C   . ILE   A 1 46 ? 5.896   8.375   12.945 1   21.37 ? 61  ILE   A C   1 
ATOM   357  O O   . ILE   A 1 46 ? 6.384   9.161   12.144 1   21.01 ? 61  ILE   A O   1 
ATOM   358  C CB  . ILE   A 1 46 ? 6.356   8.649   15.423 1   20.04 ? 61  ILE   A CB  1 
ATOM   359  C CG1 . ILE   A 1 46 ? 5.832   9.362   16.707 1   20.06 ? 61  ILE   A CG1 1 
ATOM   360  C CG2 . ILE   A 1 46 ? 7.764   9.172   15.025 1   20.33 ? 61  ILE   A CG2 1 
ATOM   361  C CD1 . ILE   A 1 46 ? 6.543   8.891   18.06  1   21.01 ? 61  ILE   A CD1 1 
ATOM   362  N N   . MET   A 1 47 ? 5.835   7.058   12.735 1   21.48 ? 62  MET   A N   1 
ATOM   363  C CA  . MET   A 1 47 ? 6.345   6.443   11.527 1   23.08 ? 62  MET   A CA  1 
ATOM   364  C C   . MET   A 1 47 ? 5.514   6.861   10.308 1   25.09 ? 62  MET   A C   1 
ATOM   365  O O   . MET   A 1 47 ? 6.098   7.312   9.333  1   25.51 ? 62  MET   A O   1 
ATOM   366  C CB  . MET   A 1 47 ? 6.39    4.901   11.708 1   23.82 ? 62  MET   A CB  1 
ATOM   367  C CG  . MET   A 1 47 ? 6.902   4.15    10.498 1   29.11 ? 62  MET   A CG  1 
ATOM   368  S SD  . MET   A 1 47 ? 8.613   4.557   10.058 1   34.62 ? 62  MET   A SD  1 
ATOM   369  C CE  . MET   A 1 47 ? 8.802   3.504   8.576  1   33.47 ? 62  MET   A CE  1 
ATOM   370  N N   . THR   A 1 48 ? 4.175   6.799   10.369 1   26.01 ? 63  THR   A N   1 
ATOM   371  C CA  . THR   A 1 48 ? 3.347   7.151   9.198  1   27.44 ? 63  THR   A CA  1 
ATOM   372  C C   . THR   A 1 48 ? 3.475   8.604   8.811  1   27.21 ? 63  THR   A C   1 
ATOM   373  O O   . THR   A 1 48 ? 3.487   8.923   7.614  1   27.65 ? 63  THR   A O   1 
ATOM   374  C CB  . THR   A 1 48 ? 1.873   6.759   9.334  1   29.47 ? 63  THR   A CB  1 
ATOM   375  O OG1 . THR   A 1 48 ? 1.242   7.56    10.322 1   32.17 ? 63  THR   A OG1 1 
ATOM   376  C CG2 . THR   A 1 48 ? 1.668   5.301   9.621  1   29.22 ? 63  THR   A CG2 1 
ATOM   377  N N   . LYS   A 1 49 ? 3.579   9.48    9.801  1   25.84 ? 64  LYS   A N   1 
ATOM   378  C CA  . LYS   A 1 49 ? 3.71    10.906  9.536  1   26.43 ? 64  LYS   A CA  1 
ATOM   379  C C   . LYS   A 1 49 ? 5.134   11.375  9.271  1   27.08 ? 64  LYS   A C   1 
ATOM   380  O O   . LYS   A 1 49 ? 5.335   12.568  9.036  1   27.59 ? 64  LYS   A O   1 
ATOM   381  C CB  . LYS   A 1 49 ? 3.086   11.734  10.664 1   28.12 ? 64  LYS   A CB  1 
ATOM   382  C CG  . LYS   A 1 49 ? 1.593   11.453  10.81  1   32.04 ? 64  LYS   A CG  1 
ATOM   383  C CD  . LYS   A 1 49 ? 0.888   12.528  11.617 1   36.65 ? 64  LYS   A CD  1 
ATOM   384  C CE  . LYS   A 1 49 ? 0.902   13.881  10.951 1   39.68 ? 64  LYS   A CE  1 
ATOM   385  N NZ  . LYS   A 1 49 ? 0.32    14.926  11.829 1   41.77 ? 64  LYS   A NZ  1 
ATOM   386  N N   . ARG   A 1 50 ? 6.121   10.461  9.365  1   26.84 ? 65  ARG   A N   1 
ATOM   387  C CA  . ARG   A 1 50 ? 7.544   10.707  9.161  1   27.57 ? 65  ARG   A CA  1 
ATOM   388  C C   . ARG   A 1 50 ? 8.014   11.868  10.037 1   26.19 ? 65  ARG   A C   1 
ATOM   389  O O   . ARG   A 1 50 ? 8.634   12.805  9.532  1   25.84 ? 65  ARG   A O   1 
ATOM   390  C CB  . ARG   A 1 50 ? 7.843   10.994  7.664  1   31.15 ? 65  ARG   A CB  1 
ATOM   391  C CG  . ARG   A 1 50 ? 7.217   10.01   6.718  1   39.01 ? 65  ARG   A CG  1 
ATOM   392  C CD  . ARG   A 1 50 ? 7.975   8.718   6.772  1   46.78 ? 65  ARG   A CD  1 
ATOM   393  N NE  . ARG   A 1 50 ? 7.067   7.571   6.752  1   53.12 ? 65  ARG   A NE  1 
ATOM   394  C CZ  . ARG   A 1 50 ? 7.443   6.325   6.492  1   57.08 ? 65  ARG   A CZ  1 
ATOM   395  N NH1 . ARG   A 1 50 ? 8.703   6.059   6.164  1   57.9  ? 65  ARG   A NH1 1 
ATOM   396  N NH2 . ARG   A 1 50 ? 6.553   5.343   6.503  1   57.6  ? 65  ARG   A NH2 1 
ATOM   397  N N   . LEU   A 1 51 ? 7.691   11.826  11.344 1   24.72 ? 66  LEU   A N   1 
ATOM   398  C CA  . LEU   A 1 51 ? 8.119   12.903  12.241 1   24.71 ? 66  LEU   A CA  1 
ATOM   399  C C   . LEU   A 1 51 ? 9.574   12.767  12.702 1   25.22 ? 66  LEU   A C   1 
ATOM   400  O O   . LEU   A 1 51 ? 10.14   13.719  13.229 1   26.15 ? 66  LEU   A O   1 
ATOM   401  C CB  . LEU   A 1 51 ? 7.166   13.049  13.427 1   23.67 ? 66  LEU   A CB  1 
ATOM   402  C CG  . LEU   A 1 51 ? 5.729   13.349  13.013 1   23.91 ? 66  LEU   A CG  1 
ATOM   403  C CD1 . LEU   A 1 51 ? 4.798   13.277  14.212 1   23.54 ? 66  LEU   A CD1 1 
ATOM   404  C CD2 . LEU   A 1 51 ? 5.634   14.734  12.318 1   24.24 ? 66  LEU   A CD2 1 
ATOM   405  N N   . TYR   A 1 52 ? 10.171  11.583  12.528 1   25.03 ? 67  TYR   A N   1 
ATOM   406  C CA  . TYR   A 1 52 ? 11.544  11.356  12.925 1   25.08 ? 67  TYR   A CA  1 
ATOM   407  C C   . TYR   A 1 52 ? 12.549  12.023  11.972 1   25.5  ? 67  TYR   A C   1 
ATOM   408  O O   . TYR   A 1 52 ? 12.255  12.244  10.791 1   25.74 ? 67  TYR   A O   1 
ATOM   409  C CB  . TYR   A 1 52 ? 11.826  9.843   13.056 1   24.66 ? 67  TYR   A CB  1 
ATOM   410  C CG  . TYR   A 1 52 ? 11.57   9.079   11.775 1   26.04 ? 67  TYR   A CG  1 
ATOM   411  C CD1 . TYR   A 1 52 ? 10.335  8.491   11.525 1   26.86 ? 67  TYR   A CD1 1 
ATOM   412  C CD2 . TYR   A 1 52 ? 12.571  8.925   10.819 1   27.58 ? 67  TYR   A CD2 1 
ATOM   413  C CE1 . TYR   A 1 52 ? 10.095  7.786   10.352 1   27.96 ? 67  TYR   A CE1 1 
ATOM   414  C CE2 . TYR   A 1 52 ? 12.34   8.216   9.641  1   28.47 ? 67  TYR   A CE2 1 
ATOM   415  C CZ  . TYR   A 1 52 ? 11.099  7.658   9.409  1   29.08 ? 67  TYR   A CZ  1 
ATOM   416  O OH  . TYR   A 1 52 ? 10.859  6.979   8.238  1   30.95 ? 67  TYR   A OH  1 
ATOM   417  N N   . ASP   A 1 53 ? 13.752  12.28   12.472 1   25.63 ? 68  ASP   A N   1 
ATOM   418  C CA  . ASP   A 1 53 ? 14.824  12.851  11.671 1   26.66 ? 68  ASP   A CA  1 
ATOM   419  C C   . ASP   A 1 53 ? 15.375  11.73   10.787 1   28    ? 68  ASP   A C   1 
ATOM   420  O O   . ASP   A 1 53 ? 15.679  10.668  11.31  1   27.91 ? 68  ASP   A O   1 
ATOM   421  C CB  . ASP   A 1 53 ? 15.933  13.358  12.61  1   28.53 ? 68  ASP   A CB  1 
ATOM   422  C CG  . ASP   A 1 53 ? 17.096  14.013  11.877 1   32.92 ? 68  ASP   A CG  1 
ATOM   423  O OD1 . ASP   A 1 53 ? 17.141  15.242  11.83  1   34.33 ? 68  ASP   A OD1 1 
ATOM   424  O OD2 . ASP   A 1 53 ? 17.959  13.288  11.372 1   34.53 ? 68  ASP   A OD2 1 
ATOM   425  N N   . GLU   A 1 54 ? 15.499  11.95   9.458  1   28.97 ? 69  GLU   A N   1 
ATOM   426  C CA  . GLU   A 1 54 ? 16.049  10.949  8.533  1   30.26 ? 69  GLU   A CA  1 
ATOM   427  C C   . GLU   A 1 54 ? 17.443  10.426  8.9    1   30.66 ? 69  GLU   A C   1 
ATOM   428  O O   . GLU   A 1 54 ? 17.693  9.228   8.789  1   30.43 ? 69  GLU   A O   1 
ATOM   429  C CB  . GLU   A 1 54 ? 16.065  11.501  7.099  1   34.55 ? 69  GLU   A CB  1 
ATOM   430  C CG  . GLU   A 1 54 ? 16.383  10.447  6.052  1   41.3  ? 69  GLU   A CG  1 
ATOM   431  C CD  . GLU   A 1 54 ? 15.302  9.397   5.898  1   50.94 ? 69  GLU   A CD  1 
ATOM   432  O OE1 . GLU   A 1 54 ? 14.125  9.706   6.2    1   53.12 ? 69  GLU   A OE1 1 
ATOM   433  O OE2 . GLU   A 1 54 ? 15.629  8.266   5.464  1   54.82 ? 69  GLU   A OE2 1 
ATOM   434  N N   . LYS   A 1 55 ? 18.339  11.296  9.36   1   31.45 ? 70  LYS   A N   1 
ATOM   435  C CA  . LYS   A 1 55 ? 19.712  10.896  9.705  1   32.74 ? 70  LYS   A CA  1 
ATOM   436  C C   . LYS   A 1 55 ? 19.864  10.295  11.118 1   32.38 ? 70  LYS   A C   1 
ATOM   437  O O   . LYS   A 1 55 ? 20.612  9.334   11.29  1   33.31 ? 70  LYS   A O   1 
ATOM   438  C CB  . LYS   A 1 55 ? 20.688  12.079  9.501  1   35.6  ? 70  LYS   A CB  1 
ATOM   439  C CG  . LYS   A 1 55 ? 22.142  11.74   9.82   1   42.56 ? 70  LYS   A CG  1 
ATOM   440  C CD  . LYS   A 1 55 ? 22.818  12.834  10.65  1   49.08 ? 70  LYS   A CD  1 
ATOM   441  C CE  . LYS   A 1 55 ? 23.791  13.652  9.836  1   53.7  ? 70  LYS   A CE  1 
ATOM   442  N NZ  . LYS   A 1 55 ? 25.109  12.973  9.714  1   57.32 ? 70  LYS   A NZ  1 
ATOM   443  N N   . GLN   A 1 56 ? 19.148  10.841  12.121 1   30.78 ? 71  GLN   A N   1 
ATOM   444  C CA  . GLN   A 1 56 ? 19.199  10.361  13.509 1   29.17 ? 71  GLN   A CA  1 
ATOM   445  C C   . GLN   A 1 56 ? 17.751  9.976   13.837 1   26.68 ? 71  GLN   A C   1 
ATOM   446  O O   . GLN   A 1 56 ? 16.971  10.797  14.326 1   25.34 ? 71  GLN   A O   1 
ATOM   447  C CB  . GLN   A 1 56 ? 19.611  11.5    14.435 1   31.22 ? 71  GLN   A CB  1 
ATOM   448  C CG  . GLN   A 1 56 ? 21.022  11.965  14.331 1   36.4  ? 71  GLN   A CG  1 
ATOM   449  C CD  . GLN   A 1 56 ? 21.122  13.103  15.3   1   40.2  ? 71  GLN   A CD  1 
ATOM   450  O OE1 . GLN   A 1 56 ? 20.557  14.175  15.063 1   40.39 ? 71  GLN   A OE1 1 
ATOM   451  N NE2 . GLN   A 1 56 ? 21.776  12.867  16.433 1   39.48 ? 71  GLN   A NE2 1 
ATOM   452  N N   . GLN   A 1 57 ? 17.391  8.728   13.545 1   25.22 ? 72  GLN   A N   1 
ATOM   453  C CA  . GLN   A 1 57 ? 16.003  8.312   13.593 1   24.05 ? 72  GLN   A CA  1 
ATOM   454  C C   . GLN   A 1 57 ? 15.411  8.162   14.991 1   22.59 ? 72  GLN   A C   1 
ATOM   455  O O   . GLN   A 1 57 ? 14.213  7.931   15.095 1   23.05 ? 72  GLN   A O   1 
ATOM   456  C CB  . GLN   A 1 57 ? 15.812  7.073   12.723 1   24.81 ? 72  GLN   A CB  1 
ATOM   457  C CG  . GLN   A 1 57 ? 16.174  7.408   11.261 1   26.76 ? 72  GLN   A CG  1 
ATOM   458  C CD  . GLN   A 1 57 ? 15.47   6.612   10.18  1   28.31 ? 72  GLN   A CD  1 
ATOM   459  O OE1 . GLN   A 1 57 ? 14.642  5.718   10.435 1   27.05 ? 72  GLN   A OE1 1 
ATOM   460  N NE2 . GLN   A 1 57 ? 15.801  6.932   8.912  1   28.83 ? 72  GLN   A NE2 1 
ATOM   461  N N   . HIS   A 1 58 ? 16.19   8.423   16.048 1   21.19 ? 73  HIS   A N   1 
ATOM   462  C CA  . HIS   A 1 58 ? 15.642  8.463   17.394 1   21.42 ? 73  HIS   A CA  1 
ATOM   463  C C   . HIS   A 1 58 ? 15.061  9.864   17.723 1   21.36 ? 73  HIS   A C   1 
ATOM   464  O O   . HIS   A 1 58 ? 14.386  10.013  18.73  1   22.11 ? 73  HIS   A O   1 
ATOM   465  C CB  . HIS   A 1 58 ? 16.686  8.054   18.448 1   22.56 ? 73  HIS   A CB  1 
ATOM   466  C CG  . HIS   A 1 58 ? 17.925  8.892   18.456 1   25.73 ? 73  HIS   A CG  1 
ATOM   467  N ND1 . HIS   A 1 58 ? 18.092  9.915   19.361 1   28    ? 73  HIS   A ND1 1 
ATOM   468  C CD2 . HIS   A 1 58 ? 19.035  8.799   17.69  1   27.47 ? 73  HIS   A CD2 1 
ATOM   469  C CE1 . HIS   A 1 58 ? 19.283  10.431  19.098 1   28.45 ? 73  HIS   A CE1 1 
ATOM   470  N NE2 . HIS   A 1 58 ? 19.885  9.788   18.101 1   28.06 ? 73  HIS   A NE2 1 
ATOM   471  N N   . ILE   A 1 59 ? 15.381  10.882  16.928 1   20.72 ? 74  ILE   A N   1 
ATOM   472  C CA  . ILE   A 1 59 ? 14.907  12.238  17.175 1   20.7  ? 74  ILE   A CA  1 
ATOM   473  C C   . ILE   A 1 59 ? 13.574  12.424  16.493 1   21.94 ? 74  ILE   A C   1 
ATOM   474  O O   . ILE   A 1 59 ? 13.442  12.142  15.294 1   22.34 ? 74  ILE   A O   1 
ATOM   475  C CB  . ILE   A 1 59 ? 15.939  13.268  16.661 1   21.06 ? 74  ILE   A CB  1 
ATOM   476  C CG1 . ILE   A 1 59 ? 17.298  13.091  17.346 1   21.51 ? 74  ILE   A CG1 1 
ATOM   477  C CG2 . ILE   A 1 59 ? 15.401  14.722  16.812 1   22.11 ? 74  ILE   A CG2 1 
ATOM   478  C CD1 . ILE   A 1 59 ? 17.238  13.274  18.881 1   23.76 ? 74  ILE   A CD1 1 
ATOM   479  N N   . VAL   A 1 60 ? 12.578  12.897  17.243 1   21.68 ? 75  VAL   A N   1 
ATOM   480  C CA  . VAL   A 1 60 ? 11.257  13.122  16.681 1   22.4  ? 75  VAL   A CA  1 
ATOM   481  C C   . VAL   A 1 60 ? 10.961  14.598  16.764 1   24.56 ? 75  VAL   A C   1 
ATOM   482  O O   . VAL   A 1 60 ? 11.086  15.184  17.835 1   24.76 ? 75  VAL   A O   1 
ATOM   483  C CB  . VAL   A 1 60 ? 10.202  12.314  17.445 1   21.8  ? 75  VAL   A CB  1 
ATOM   484  C CG1 . VAL   A 1 60 ? 8.808   12.568  16.882 1   22.8  ? 75  VAL   A CG1 1 
ATOM   485  C CG2 . VAL   A 1 60 ? 10.543  10.827  17.401 1   21.15 ? 75  VAL   A CG2 1 
ATOM   486  N N   . TYR   A 1 61 ? 10.565  15.194  15.652 1   25.19 ? 76  TYR   A N   1 
ATOM   487  C CA  . TYR   A 1 61 ? 10.222  16.608  15.619 1   26.96 ? 76  TYR   A CA  1 
ATOM   488  C C   . TYR   A 1 61 ? 8.727   16.738  15.789 1   28.19 ? 76  TYR   A C   1 
ATOM   489  O O   . TYR   A 1 61 ? 7.97    16.018  15.126 1   28.93 ? 76  TYR   A O   1 
ATOM   490  C CB  . TYR   A 1 61 ? 10.627  17.194  14.275 1   27.6  ? 76  TYR   A CB  1 
ATOM   491  C CG  . TYR   A 1 61 ? 12.113  17.161  14.064 1   29.42 ? 76  TYR   A CG  1 
ATOM   492  C CD1 . TYR   A 1 61 ? 12.956  17.985  14.795 1   30.57 ? 76  TYR   A CD1 1 
ATOM   493  C CD2 . TYR   A 1 61 ? 12.678  16.321  13.119 1   30.87 ? 76  TYR   A CD2 1 
ATOM   494  C CE1 . TYR   A 1 61 ? 14.325  17.964  14.6   1   32.1  ? 76  TYR   A CE1 1 
ATOM   495  C CE2 . TYR   A 1 61 ? 14.046  16.306  12.898 1   32.27 ? 76  TYR   A CE2 1 
ATOM   496  C CZ  . TYR   A 1 61 ? 14.868  17.117  13.647 1   33.33 ? 76  TYR   A CZ  1 
ATOM   497  O OH  . TYR   A 1 61 ? 16.219  17.091  13.427 1   35.44 ? 76  TYR   A OH  1 
ATOM   498  N N   . CYS   A 1 62 ? 8.295   17.617  16.682 1   27.95 ? 77  CYS   A N   1 
ATOM   499  C CA  . CYS   A 1 62 ? 6.864   17.729  16.938 1   28.78 ? 77  CYS   A CA  1 
ATOM   500  C C   . CYS   A 1 62 ? 6.371   19.157  17.125 1   29.21 ? 77  CYS   A C   1 
ATOM   501  O O   . CYS   A 1 62 ? 5.209   19.346  17.48  1   28.01 ? 77  CYS   A O   1 
ATOM   502  C CB  . CYS   A 1 62 ? 6.455   16.827  18.095 1   29.29 ? 77  CYS   A CB  1 
ATOM   503  S SG  . CYS   A 1 62 ? 7.511   16.972  19.549 1   32.94 ? 77  CYS   A SG  1 
ATOM   504  N N   . SER   A 1 63 ? 7.167   20.161  16.701 1   30.91 ? 78  SER   A N   1 
ATOM   505  C CA  . SER   A 1 63 ? 6.687   21.547  16.684 1   33.69 ? 78  SER   A CA  1 
ATOM   506  C C   . SER   A 1 63 ? 5.605   21.586  15.57  1   36.38 ? 78  SER   A C   1 
ATOM   507  O O   . SER   A 1 63 ? 5.787   20.959  14.522 1   37.86 ? 78  SER   A O   1 
ATOM   508  C CB  . SER   A 1 63 ? 7.827   22.499  16.316 1   36.18 ? 78  SER   A CB  1 
ATOM   509  O OG  . SER   A 1 63 ? 7.667   23.782  16.903 1   40.33 ? 78  SER   A OG  1 
ATOM   510  N N   . ASN   A 1 64 ? 4.456   22.18   15.846 1   37.12 ? 79  ASN   A N   1 
ATOM   511  C CA  . ASN   A 1 64 ? 3.371   22.266  14.849 1   37.72 ? 79  ASN   A CA  1 
ATOM   512  C C   . ASN   A 1 64 ? 2.67    20.919  14.563 1   36.06 ? 79  ASN   A C   1 
ATOM   513  O O   . ASN   A 1 64 ? 1.975   20.777  13.559 1   37    ? 79  ASN   A O   1 
ATOM   514  C CB  . ASN   A 1 64 ? 3.853   22.941  13.566 1   41.08 ? 79  ASN   A CB  1 
ATOM   515  C CG  . ASN   A 1 64 ? 4.526   24.265  13.871 1   47.55 ? 79  ASN   A CG  1 
ATOM   516  O OD1 . ASN   A 1 64 ? 4.006   25.083  14.647 1   49.51 ? 79  ASN   A OD1 1 
ATOM   517  N ND2 . ASN   A 1 64 ? 5.723   24.475  13.322 1   49.14 ? 79  ASN   A ND2 1 
ATOM   518  N N   . ASP   A 1 65 ? 2.825   19.947  15.463 1   33.03 ? 80  ASP   A N   1 
ATOM   519  C CA  . ASP   A 1 65 ? 2.11    18.684  15.36  1   29.98 ? 80  ASP   A CA  1 
ATOM   520  C C   . ASP   A 1 65 ? 1.367   18.485  16.651 1   28.23 ? 80  ASP   A C   1 
ATOM   521  O O   . ASP   A 1 65 ? 1.797   18.941  17.72  1   26.87 ? 80  ASP   A O   1 
ATOM   522  C CB  . ASP   A 1 65 ? 3.07    17.497  15.116 1   28.9  ? 80  ASP   A CB  1 
ATOM   523  C CG  . ASP   A 1 65 ? 2.377   16.211  14.701 1   29.79 ? 80  ASP   A CG  1 
ATOM   524  O OD1 . ASP   A 1 65 ? 1.965   15.438  15.6   1   29.11 ? 80  ASP   A OD1 1 
ATOM   525  O OD2 . ASP   A 1 65 ? 2.249   15.969  13.481 1   30.53 ? 80  ASP   A OD2 1 
ATOM   526  N N   . LEU   A 1 66 ? 0.267   17.711  16.597 1   28.1  ? 81  LEU   A N   1 
ATOM   527  C CA  . LEU   A 1 66 ? -0.495  17.3    17.776 1   28.61 ? 81  LEU   A CA  1 
ATOM   528  C C   . LEU   A 1 66 ? 0.459   16.691  18.837 1   27.92 ? 81  LEU   A C   1 
ATOM   529  O O   . LEU   A 1 66 ? 0.307   16.95   20.021 1   27.79 ? 81  LEU   A O   1 
ATOM   530  C CB  . LEU   A 1 66 ? -1.495  16.206  17.341 1   29.35 ? 81  LEU   A CB  1 
ATOM   531  C CG  . LEU   A 1 66 ? -2.907  16.122  17.957 1   31.72 ? 81  LEU   A CG  1 
ATOM   532  C CD1 . LEU   A 1 66 ? -3.405  14.713  17.942 1   32.21 ? 81  LEU   A CD1 1 
ATOM   533  C CD2 . LEU   A 1 66 ? -3.032  16.72   19.348 1   32.42 ? 81  LEU   A CD2 1 
ATOM   534  N N   . LEU   A 1 67 ? 1.49    15.949  18.391 1   27.44 ? 82  LEU   A N   1 
ATOM   535  C CA  . LEU   A 1 67 ? 2.46    15.339  19.308 1   27.95 ? 82  LEU   A CA  1 
ATOM   536  C C   . LEU   A 1 67 ? 3.2     16.373  20.166 1   27.5  ? 82  LEU   A C   1 
ATOM   537  O O   . LEU   A 1 67 ? 3.447   16.14   21.354 1   27.59 ? 82  LEU   A O   1 
ATOM   538  C CB  . LEU   A 1 67 ? 3.458   14.459  18.517 1   28.8  ? 82  LEU   A CB  1 
ATOM   539  C CG  . LEU   A 1 67 ? 4.307   13.491  19.329 1   30.48 ? 82  LEU   A CG  1 
ATOM   540  C CD1 . LEU   A 1 67 ? 3.448   12.608  20.219 1   31.19 ? 82  LEU   A CD1 1 
ATOM   541  C CD2 . LEU   A 1 67 ? 5.143   12.616  18.4   1   30.63 ? 82  LEU   A CD2 1 
ATOM   542  N N   . GLY   A 1 68 ? 3.45    17.544  19.593 1   26.97 ? 83  GLY   A N   1 
ATOM   543  C CA  . GLY   A 1 68 ? 4.054   18.665  20.293 1   27.54 ? 83  GLY   A CA  1 
ATOM   544  C C   . GLY   A 1 68 ? 3.163   19.204  21.396 1   28.12 ? 83  GLY   A C   1 
ATOM   545  O O   . GLY   A 1 68 ? 3.663   19.658  22.421 1   28.42 ? 83  GLY   A O   1 
ATOM   546  N N   . ASP   A 1 69 ? 1.836   19.128  21.207 1   27.82 ? 84  ASP   A N   1 
ATOM   547  C CA  . ASP   A 1 69 ? 0.862   19.538  22.223 1   29.44 ? 84  ASP   A CA  1 
ATOM   548  C C   . ASP   A 1 69 ? 0.81    18.549  23.389 1   31.56 ? 84  ASP   A C   1 
ATOM   549  O O   . ASP   A 1 69 ? 0.41    18.934  24.482 1   32.95 ? 84  ASP   A O   1 
ATOM   550  C CB  . ASP   A 1 69 ? -0.521  19.659  21.587 1   30.85 ? 84  ASP   A CB  1 
ATOM   551  C CG  . ASP   A 1 69 ? -0.544  20.696  20.498 1   36.07 ? 84  ASP   A CG  1 
ATOM   552  O OD1 . ASP   A 1 69 ? -0.111  21.831  20.761 1   38.83 ? 84  ASP   A OD1 1 
ATOM   553  O OD2 . ASP   A 1 69 ? -1.002  20.375  19.376 1   36.95 ? 84  ASP   A OD2 1 
ATOM   554  N N   . LEU   A 1 70 ? 1.2     17.284  23.165 1   31.55 ? 85  LEU   A N   1 
ATOM   555  C CA  . LEU   A 1 70 ? 1.233   16.231  24.182 1   33.32 ? 85  LEU   A CA  1 
ATOM   556  C C   . LEU   A 1 70 ? 2.562   16.309  24.949 1   34.36 ? 85  LEU   A C   1 
ATOM   557  O O   . LEU   A 1 70 ? 2.585   16.224  26.182 1   34.59 ? 85  LEU   A O   1 
ATOM   558  C CB  . LEU   A 1 70 ? 1.132   14.842  23.489 1   33.61 ? 85  LEU   A CB  1 
ATOM   559  C CG  . LEU   A 1 70 ? -0.243  14.244  23.187 1   36.21 ? 85  LEU   A CG  1 
ATOM   560  C CD1 . LEU   A 1 70 ? -0.975  15.01   22.152 1   37.79 ? 85  LEU   A CD1 1 
ATOM   561  C CD2 . LEU   A 1 70 ? -0.11   12.867  22.611 1   36.41 ? 85  LEU   A CD2 1 
ATOM   562  N N   . PHE   A 1 71 ? 3.673   16.456  24.217 1   35.2  ? 86  PHE   A N   1 
ATOM   563  C CA  . PHE   A 1 71 ? 5.009   16.491  24.799 1   37.65 ? 86  PHE   A CA  1 
ATOM   564  C C   . PHE   A 1 71 ? 5.378   17.795  25.467 1   38.75 ? 86  PHE   A C   1 
ATOM   565  O O   . PHE   A 1 71 ? 6.13    17.797  26.446 1   38.11 ? 86  PHE   A O   1 
ATOM   566  C CB  . PHE   A 1 71 ? 6.058   16.161  23.738 1   39.09 ? 86  PHE   A CB  1 
ATOM   567  C CG  . PHE   A 1 71 ? 6.723   14.864  24.066 1   41.56 ? 86  PHE   A CG  1 
ATOM   568  C CD1 . PHE   A 1 71 ? 7.587   14.766  25.146 1   43.16 ? 86  PHE   A CD1 1 
ATOM   569  C CD2 . PHE   A 1 71 ? 6.391   13.709  23.385 1   43.13 ? 86  PHE   A CD2 1 
ATOM   570  C CE1 . PHE   A 1 71 ? 8.142   13.551  25.5   1   44.01 ? 86  PHE   A CE1 1 
ATOM   571  C CE2 . PHE   A 1 71 ? 6.954   12.493  23.74  1   44.12 ? 86  PHE   A CE2 1 
ATOM   572  C CZ  . PHE   A 1 71 ? 7.831   12.423  24.788 1   44.08 ? 86  PHE   A CZ  1 
ATOM   573  N N   . GLY   A 1 72 ? 4.911   18.896  24.889 1   39.51 ? 87  GLY   A N   1 
ATOM   574  C CA  . GLY   A 1 72 ? 5.212   20.234  25.383 1   40.5  ? 87  GLY   A CA  1 
ATOM   575  C C   . GLY   A 1 72 ? 6.656   20.626  25.133 1   40.5  ? 87  GLY   A C   1 
ATOM   576  O O   . GLY   A 1 72 ? 7.254   21.342  25.935 1   40.41 ? 87  GLY   A O   1 
ATOM   577  N N   . VAL   A 1 73 ? 7.218   20.161  24.006 1   39.99 ? 88  VAL   A N   1 
ATOM   578  C CA  . VAL   A 1 73 ? 8.604   20.385  23.591 1   39.64 ? 88  VAL   A CA  1 
ATOM   579  C C   . VAL   A 1 73 ? 8.695   20.38   22.045 1   38.03 ? 88  VAL   A C   1 
ATOM   580  O O   . VAL   A 1 73 ? 7.842   19.766  21.404 1   38.6  ? 88  VAL   A O   1 
ATOM   581  C CB  . VAL   A 1 73 ? 9.478   19.275  24.161 1   40.52 ? 88  VAL   A CB  1 
ATOM   582  N N   . PRO   A 1 74 ? 9.69    21.044  21.418 1   36.53 ? 89  PRO   A N   1 
ATOM   583  C CA  . PRO   A 1 74 ? 9.767   21.016  19.941 1   34.99 ? 89  PRO   A CA  1 
ATOM   584  C C   . PRO   A 1 74 ? 10.306  19.704  19.349 1   31.78 ? 89  PRO   A C   1 
ATOM   585  O O   . PRO   A 1 74 ? 10.064  19.39   18.184 1   30.97 ? 89  PRO   A O   1 
ATOM   586  C CB  . PRO   A 1 74 ? 10.657  22.214  19.602 1   36.38 ? 89  PRO   A CB  1 
ATOM   587  C CG  . PRO   A 1 74 ? 11.489  22.435  20.805 1   37.18 ? 89  PRO   A CG  1 
ATOM   588  C CD  . PRO   A 1 74 ? 10.794  21.834  22.004 1   35.75 ? 89  PRO   A CD  1 
ATOM   589  N N   . SER   A 1 75 ? 11.065  18.972  20.134 1   30.1  ? 90  SER   A N   1 
ATOM   590  C CA  . SER   A 1 75 ? 11.603  17.685  19.708 1   29.8  ? 90  SER   A CA  1 
ATOM   591  C C   . SER   A 1 75 ? 11.979  16.837  20.899 1   28.45 ? 90  SER   A C   1 
ATOM   592  O O   . SER   A 1 75 ? 12.169  17.362  21.991 1   28.62 ? 90  SER   A O   1 
ATOM   593  C CB  . SER   A 1 75 ? 12.754  17.841  18.71  1   32.2  ? 90  SER   A CB  1 
ATOM   594  O OG  . SER   A 1 75 ? 14.039  17.86   19.304 1   36.36 ? 90  SER   A OG  1 
ATOM   595  N N   . PHE   A 1 76 ? 12.066  15.524  20.702 1   26.39 ? 91  PHE   A N   1 
ATOM   596  C CA  . PHE   A 1 76 ? 12.448  14.628  21.788 1   25.33 ? 91  PHE   A CA  1 
ATOM   597  C C   . PHE   A 1 76 ? 13.212  13.429  21.216 1   24.21 ? 91  PHE   A C   1 
ATOM   598  O O   . PHE   A 1 76 ? 13.161  13.177  20.001 1   24.02 ? 91  PHE   A O   1 
ATOM   599  C CB  . PHE   A 1 76 ? 11.215  14.188  22.606 1   25.31 ? 91  PHE   A CB  1 
ATOM   600  C CG  . PHE   A 1 76 ? 10.229  13.329  21.865 1   25.82 ? 91  PHE   A CG  1 
ATOM   601  C CD1 . PHE   A 1 76 ? 10.323  11.945  21.901 1   26.92 ? 91  PHE   A CD1 1 
ATOM   602  C CD2 . PHE   A 1 76 ? 9.186   13.895  21.159 1   27.06 ? 91  PHE   A CD2 1 
ATOM   603  C CE1 . PHE   A 1 76 ? 9.401   11.15   21.228 1   27.99 ? 91  PHE   A CE1 1 
ATOM   604  C CE2 . PHE   A 1 76 ? 8.264   13.093  20.484 1   28.06 ? 91  PHE   A CE2 1 
ATOM   605  C CZ  . PHE   A 1 76 ? 8.364   11.729  20.545 1   27.76 ? 91  PHE   A CZ  1 
ATOM   606  N N   . SER   A 1 77 ? 13.943  12.724  22.079 1   22.95 ? 92  SER   A N   1 
ATOM   607  C CA  . SER   A 1 77 ? 14.688  11.54   21.678 1   22.26 ? 92  SER   A CA  1 
ATOM   608  C C   . SER   A 1 77 ? 14.011  10.305  22.261 1   22.73 ? 92  SER   A C   1 
ATOM   609  O O   . SER   A 1 77 ? 13.811  10.238  23.485 1   23.25 ? 92  SER   A O   1 
ATOM   610  C CB  . SER   A 1 77 ? 16.124  11.591  22.197 1   22.68 ? 92  SER   A CB  1 
ATOM   611  O OG  . SER   A 1 77 ? 16.779  10.375  21.852 1   24.81 ? 92  SER   A OG  1 
ATOM   612  N N   . VAL   A 1 78 ? 13.789  9.285   21.428 1   23.1  ? 93  VAL   A N   1 
ATOM   613  C CA  . VAL   A 1 78 ? 13.167  8.052   21.931 1   24.63 ? 93  VAL   A CA  1 
ATOM   614  C C   . VAL   A 1 78 ? 14.171  7.152   22.712 1   24.45 ? 93  VAL   A C   1 
ATOM   615  O O   . VAL   A 1 78 ? 13.774  6.109   23.245 1   24.58 ? 93  VAL   A O   1 
ATOM   616  C CB  . VAL   A 1 78 ? 12.359  7.287   20.856 1   27.33 ? 93  VAL   A CB  1 
ATOM   617  C CG1 . VAL   A 1 78 ? 11.301  8.203   20.219 1   29.18 ? 93  VAL   A CG1 1 
ATOM   618  C CG2 . VAL   A 1 78 ? 13.251  6.715   19.787 1   27.81 ? 93  VAL   A CG2 1 
ATOM   619  N N   . LYS   A 1 79 ? 15.437  7.585   22.859 1   23.75 ? 94  LYS   A N   1 
ATOM   620  C CA  . LYS   A 1 79 ? 16.422  6.901   23.705 1   24.23 ? 94  LYS   A CA  1 
ATOM   621  C C   . LYS   A 1 79 ? 16.126  7.173   25.196 1   25.03 ? 94  LYS   A C   1 
ATOM   622  O O   . LYS   A 1 79 ? 16.528  6.374   26.049 1   25.69 ? 94  LYS   A O   1 
ATOM   623  C CB  . LYS   A 1 79 ? 17.841  7.415   23.401 1   25.66 ? 94  LYS   A CB  1 
ATOM   624  C CG  . LYS   A 1 79 ? 18.413  6.941   22.075 1   27.73 ? 94  LYS   A CG  1 
ATOM   625  C CD  . LYS   A 1 79 ? 19.916  7.273   21.976 1   32.49 ? 94  LYS   A CD  1 
ATOM   626  C CE  . LYS   A 1 79 ? 20.383  7.221   20.541 1   37.72 ? 94  LYS   A CE  1 
ATOM   627  N NZ  . LYS   A 1 79 ? 21.873  7.313   20.399 1   40.62 ? 94  LYS   A NZ  1 
ATOM   628  N N   . GLU   A 1 80 ? 15.438  8.297   25.52  1   23.99 ? 95  GLU   A N   1 
ATOM   629  C CA  . GLU   A 1 80 ? 15.098  8.669   26.902 1   24.29 ? 95  GLU   A CA  1 
ATOM   630  C C   . GLU   A 1 80 ? 13.747  8.048   27.252 1   24.53 ? 95  GLU   A C   1 
ATOM   631  O O   . GLU   A 1 80 ? 12.734  8.744   27.317 1   24.01 ? 95  GLU   A O   1 
ATOM   632  C CB  . GLU   A 1 80 ? 15.047  10.197  27.021 1   26.59 ? 95  GLU   A CB  1 
ATOM   633  C CG  . GLU   A 1 80 ? 16.29   10.856  26.444 1   32.02 ? 95  GLU   A CG  1 
ATOM   634  C CD  . GLU   A 1 80 ? 16.54   12.273  26.915 1   43.12 ? 95  GLU   A CD  1 
ATOM   635  O OE1 . GLU   A 1 80 ? 16.824  12.455  28.121 1   47.38 ? 95  GLU   A OE1 1 
ATOM   636  O OE2 . GLU   A 1 80 ? 16.466  13.202  26.077 1   45    ? 95  GLU   A OE2 1 
ATOM   637  N N   . HIS   A 1 81 ? 13.725  6.708   27.432 1   24.28 ? 96  HIS   A N   1 
ATOM   638  C CA  . HIS   A 1 81 ? 12.502  5.947   27.675 1   24.94 ? 96  HIS   A CA  1 
ATOM   639  C C   . HIS   A 1 81 ? 11.59   6.545   28.744 1   26.42 ? 96  HIS   A C   1 
ATOM   640  O O   . HIS   A 1 81 ? 10.404  6.766   28.482 1   25.83 ? 96  HIS   A O   1 
ATOM   641  C CB  . HIS   A 1 81 ? 12.831  4.476   27.998 1   24.71 ? 96  HIS   A CB  1 
ATOM   642  C CG  . HIS   A 1 81 ? 13.765  3.825   27.019 1   27.17 ? 96  HIS   A CG  1 
ATOM   643  N ND1 . HIS   A 1 81 ? 15.135  3.777   27.249 1   28.04 ? 96  HIS   A ND1 1 
ATOM   644  C CD2 . HIS   A 1 81 ? 13.493  3.157   25.873 1   28.58 ? 96  HIS   A CD2 1 
ATOM   645  C CE1 . HIS   A 1 81 ? 15.647  3.115   26.23  1   28.46 ? 96  HIS   A CE1 1 
ATOM   646  N NE2 . HIS   A 1 81 ? 14.7    2.709   25.381 1   29.18 ? 96  HIS   A NE2 1 
ATOM   647  N N   . ARG   A 1 82 ? 12.139  6.819   29.943 1   27.96 ? 97  ARG   A N   1 
ATOM   648  C CA  . ARG   A 1 82 ? 11.383  7.411   31.059 1   29.47 ? 97  ARG   A CA  1 
ATOM   649  C C   . ARG   A 1 82 ? 10.61   8.663   30.672 1   28.49 ? 97  ARG   A C   1 
ATOM   650  O O   . ARG   A 1 82 ? 9.482   8.842   31.131 1   27.89 ? 97  ARG   A O   1 
ATOM   651  C CB  . ARG   A 1 82 ? 12.31   7.733   32.268 1   32.33 ? 97  ARG   A CB  1 
ATOM   652  C CG  . ARG   A 1 82 ? 13.202  8.987   32.073 1   37.96 ? 97  ARG   A CG  1 
ATOM   653  C CD  . ARG   A 1 82 ? 14.484  8.959   32.89  1   43.9  ? 97  ARG   A CD  1 
ATOM   654  N NE  . ARG   A 1 82 ? 15.461  9.991   32.522 1   47.26 ? 97  ARG   A NE  1 
ATOM   655  C CZ  . ARG   A 1 82 ? 16.406  9.835   31.597 1   50.83 ? 97  ARG   A CZ  1 
ATOM   656  N NH1 . ARG   A 1 82 ? 16.493  8.702   30.911 1   50.64 ? 97  ARG   A NH1 1 
ATOM   657  N NH2 . ARG   A 1 82 ? 17.268  10.813  31.348 1   51.51 ? 97  ARG   A NH2 1 
ATOM   658  N N   . LYS   A 1 83 ? 11.21   9.545   29.869 1   28.11 ? 98  LYS   A N   1 
ATOM   659  C CA  . LYS   A 1 83 ? 10.569  10.802  29.498 1   28.08 ? 98  LYS   A CA  1 
ATOM   660  C C   . LYS   A 1 83 ? 9.366   10.586  28.573 1   27.41 ? 98  LYS   A C   1 
ATOM   661  O O   . LYS   A 1 83 ? 8.354   11.273  28.729 1   26.5  ? 98  LYS   A O   1 
ATOM   662  C CB  . LYS   A 1 83 ? 11.588  11.782  28.906 1   30.85 ? 98  LYS   A CB  1 
ATOM   663  C CG  . LYS   A 1 83 ? 12.689  12.13   29.908 1   35.08 ? 98  LYS   A CG  1 
ATOM   664  C CD  . LYS   A 1 83 ? 13.661  13.133  29.343 1   40.46 ? 98  LYS   A CD  1 
ATOM   665  C CE  . LYS   A 1 83 ? 14.634  13.612  30.386 1   45.13 ? 98  LYS   A CE  1 
ATOM   666  N NZ  . LYS   A 1 83 ? 15.768  14.37   29.774 1   48.29 ? 98  LYS   A NZ  1 
ATOM   667  N N   . ILE   A 1 84 ? 9.42    9.552   27.713 1   26.67 ? 99  ILE   A N   1 
ATOM   668  C CA  . ILE   A 1 84 ? 8.274   9.223   26.873 1   27.07 ? 99  ILE   A CA  1 
ATOM   669  C C   . ILE   A 1 84 ? 7.162   8.625   27.721 1   26.68 ? 99  ILE   A C   1 
ATOM   670  O O   . ILE   A 1 84 ? 6.006   9.002   27.549 1   26.61 ? 99  ILE   A O   1 
ATOM   671  C CB  . ILE   A 1 84 ? 8.661   8.304   25.702 1   27.94 ? 99  ILE   A CB  1 
ATOM   672  C CG1 . ILE   A 1 84 ? 9.723   9.003   24.832 1   29.19 ? 99  ILE   A CG1 1 
ATOM   673  C CG2 . ILE   A 1 84 ? 7.428   7.91    24.895 1   27.82 ? 99  ILE   A CG2 1 
ATOM   674  C CD1 . ILE   A 1 84 ? 10.353  8.107   23.962 1   31.05 ? 99  ILE   A CD1 1 
ATOM   675  N N   . TYR   A 1 85 ? 7.502   7.737   28.683 1   26.35 ? 100 TYR   A N   1 
ATOM   676  C CA  . TYR   A 1 85 ? 6.487   7.185   29.58  1   26.79 ? 100 TYR   A CA  1 
ATOM   677  C C   . TYR   A 1 85 ? 5.837   8.296   30.413 1   26.43 ? 100 TYR   A C   1 
ATOM   678  O O   . TYR   A 1 85 ? 4.618   8.288   30.586 1   24.85 ? 100 TYR   A O   1 
ATOM   679  C CB  . TYR   A 1 85 ? 7.057   6.119   30.491 1   27.46 ? 100 TYR   A CB  1 
ATOM   680  C CG  . TYR   A 1 85 ? 7.2     4.792   29.795 1   28.87 ? 100 TYR   A CG  1 
ATOM   681  C CD1 . TYR   A 1 85 ? 6.084   4.07    29.4   1   29.74 ? 100 TYR   A CD1 1 
ATOM   682  C CD2 . TYR   A 1 85 ? 8.446   4.234   29.576 1   30.13 ? 100 TYR   A CD2 1 
ATOM   683  C CE1 . TYR   A 1 85 ? 6.208   2.831   28.787 1   30.6  ? 100 TYR   A CE1 1 
ATOM   684  C CE2 . TYR   A 1 85 ? 8.582   2.98    28.996 1   30.91 ? 100 TYR   A CE2 1 
ATOM   685  C CZ  . TYR   A 1 85 ? 7.461   2.3     28.564 1   31.44 ? 100 TYR   A CZ  1 
ATOM   686  O OH  . TYR   A 1 85 ? 7.589   1.077   27.967 1   32.53 ? 100 TYR   A OH  1 
ATOM   687  N N   . THR   A 1 86 ? 6.627   9.292   30.839 1   27.54 ? 101 THR   A N   1 
ATOM   688  C CA  . THR   A 1 86 ? 6.093   10.423  31.622 1   28.4  ? 101 THR   A CA  1 
ATOM   689  C C   . THR   A 1 86 ? 5.046   11.182  30.823 1   26.99 ? 101 THR   A C   1 
ATOM   690  O O   . THR   A 1 86 ? 3.952   11.474  31.345 1   26.28 ? 101 THR   A O   1 
ATOM   691  C CB  . THR   A 1 86 ? 7.228   11.302  32.158 1   31.24 ? 101 THR   A CB  1 
ATOM   692  O OG1 . THR   A 1 86 ? 7.998   10.501  33.061 1   33.11 ? 101 THR   A OG1 1 
ATOM   693  C CG2 . THR   A 1 86 ? 6.709   12.542  32.882 1   31.91 ? 101 THR   A CG2 1 
ATOM   694  N N   A MET   A 1 87 ? 5.357   11.456  29.554 0.5 27.22 ? 102 MET   A N   1 
ATOM   695  N N   B MET   A 1 87 ? 5.341   11.467  29.536 0.5 26.52 ? 102 MET   A N   1 
ATOM   696  C CA  A MET   A 1 87 ? 4.446   12.147  28.648 0.5 27.32 ? 102 MET   A CA  1 
ATOM   697  C CA  B MET   A 1 87 ? 4.391   12.155  28.649 0.5 25.88 ? 102 MET   A CA  1 
ATOM   698  C C   A MET   A 1 87 ? 3.167   11.346  28.454 0.5 25.84 ? 102 MET   A C   1 
ATOM   699  C C   B MET   A 1 87 ? 3.132   11.335  28.504 0.5 25.17 ? 102 MET   A C   1 
ATOM   700  O O   A MET   A 1 87 ? 2.083   11.909  28.528 0.5 25.92 ? 102 MET   A O   1 
ATOM   701  O O   B MET   A 1 87 ? 2.034   11.869  28.635 0.5 25.24 ? 102 MET   A O   1 
ATOM   702  C CB  A MET   A 1 87 ? 5.13    12.435  27.301 0.5 29.44 ? 102 MET   A CB  1 
ATOM   703  C CB  B MET   A 1 87 ? 4.995   12.448  27.252 0.5 26.28 ? 102 MET   A CB  1 
ATOM   704  C CG  A MET   A 1 87 ? 4.276   13.269  26.365 0.5 34.45 ? 102 MET   A CG  1 
ATOM   705  C CG  B MET   A 1 87 ? 3.974   13.051  26.239 0.5 27.46 ? 102 MET   A CG  1 
ATOM   706  S SD  A MET   A 1 87 ? 4.049   12.51   24.738 0.5 45.97 ? 102 MET   A SD  1 
ATOM   707  S SD  B MET   A 1 87 ? 2.752   11.898  25.505 0.5 25.86 ? 102 MET   A SD  1 
ATOM   708  C CE  A MET   A 1 87 ? 2.525   11.593  25.007 0.5 44.01 ? 102 MET   A CE  1 
ATOM   709  C CE  B MET   A 1 87 ? 3.84    10.915  24.424 0.5 24.74 ? 102 MET   A CE  1 
ATOM   710  N N   . ILE   A 1 88 ? 3.281   10.031  28.231 1   24.61 ? 103 ILE   A N   1 
ATOM   711  C CA  . ILE   A 1 88 ? 2.136   9.162   28.061 1   23.84 ? 103 ILE   A CA  1 
ATOM   712  C C   . ILE   A 1 88 ? 1.207   9.142   29.264 1   24.22 ? 103 ILE   A C   1 
ATOM   713  O O   . ILE   A 1 88 ? -0.005  9.345   29.089 1   24.4  ? 103 ILE   A O   1 
ATOM   714  C CB  . ILE   A 1 88 ? 2.574   7.728   27.656 1   23.64 ? 103 ILE   A CB  1 
ATOM   715  C CG1 . ILE   A 1 88 ? 3.241   7.784   26.286 1   24.43 ? 103 ILE   A CG1 1 
ATOM   716  C CG2 . ILE   A 1 88 ? 1.343   6.799   27.618 1   24.24 ? 103 ILE   A CG2 1 
ATOM   717  C CD1 . ILE   A 1 88 ? 3.966   6.494   25.829 1   25.48 ? 103 ILE   A CD1 1 
ATOM   718  N N   . TYR   A 1 89 ? 1.759   8.963   30.475 1   24.13 ? 104 TYR   A N   1 
ATOM   719  C CA  . TYR   A 1 89 ? 0.923   8.889   31.662 1   24.86 ? 104 TYR   A CA  1 
ATOM   720  C C   . TYR   A 1 89 ? 0.22    10.207  31.983 1   25.81 ? 104 TYR   A C   1 
ATOM   721  O O   . TYR   A 1 89 ? -0.909  10.197  32.464 1   26.49 ? 104 TYR   A O   1 
ATOM   722  C CB  . TYR   A 1 89 ? 1.708   8.373   32.875 1   24.37 ? 104 TYR   A CB  1 
ATOM   723  C CG  . TYR   A 1 89 ? 1.884   6.872   32.877 1   23.84 ? 104 TYR   A CG  1 
ATOM   724  C CD1 . TYR   A 1 89 ? 0.865   6.035   33.288 1   23.94 ? 104 TYR   A CD1 1 
ATOM   725  C CD2 . TYR   A 1 89 ? 3.069   6.292   32.457 1   24.81 ? 104 TYR   A CD2 1 
ATOM   726  C CE1 . TYR   A 1 89 ? 1.032   4.658   33.321 1   24.17 ? 104 TYR   A CE1 1 
ATOM   727  C CE2 . TYR   A 1 89 ? 3.236   4.913   32.45  1   25.07 ? 104 TYR   A CE2 1 
ATOM   728  C CZ  . TYR   A 1 89 ? 2.231   4.105   32.925 1   24.96 ? 104 TYR   A CZ  1 
ATOM   729  O OH  . TYR   A 1 89 ? 2.402   2.748   32.962 1   25.64 ? 104 TYR   A OH  1 
ATOM   730  N N   . ARG   A 1 90 ? 0.868   11.327  31.69  1   26.32 ? 105 ARG   A N   1 
ATOM   731  C CA  . ARG   A 1 90 ? 0.252   12.644  31.878 1   27.52 ? 105 ARG   A CA  1 
ATOM   732  C C   . ARG   A 1 90 ? -0.926  12.874  30.895 1   27.53 ? 105 ARG   A C   1 
ATOM   733  O O   . ARG   A 1 90 ? -1.729  13.787  31.103 1   28.34 ? 105 ARG   A O   1 
ATOM   734  C CB  . ARG   A 1 90 ? 1.299   13.733  31.64  1   30.17 ? 105 ARG   A CB  1 
ATOM   735  C CG  . ARG   A 1 90 ? 2.153   14.009  32.863 1   36.96 ? 105 ARG   A CG  1 
ATOM   736  C CD  . ARG   A 1 90 ? 3.263   15.004  32.569 1   43.5  ? 105 ARG   A CD  1 
ATOM   737  N NE  . ARG   A 1 90 ? 4.1     15.193  33.755 1   49.58 ? 105 ARG   A NE  1 
ATOM   738  C CZ  . ARG   A 1 90 ? 5.291   15.78   33.752 1   53.63 ? 105 ARG   A CZ  1 
ATOM   739  N NH1 . ARG   A 1 90 ? 5.825   16.207  32.615 1   54.46 ? 105 ARG   A NH1 1 
ATOM   740  N NH2 . ARG   A 1 90 ? 5.978   15.905  34.881 1   54.26 ? 105 ARG   A NH2 1 
ATOM   741  N N   . ASN   A 1 91 ? -1.024  12.061  29.83  1   26.15 ? 106 ASN   A N   1 
ATOM   742  C CA  . ASN   A 1 91 ? -2.06   12.172  28.807 1   25.83 ? 106 ASN   A CA  1 
ATOM   743  C C   . ASN   A 1 91 ? -3.101  11.055  28.837 1   25.18 ? 106 ASN   A C   1 
ATOM   744  O O   . ASN   A 1 91 ? -3.783  10.815  27.844 1   24.97 ? 106 ASN   A O   1 
ATOM   745  C CB  . ASN   A 1 91 ? -1.412  12.286  27.435 1   27.04 ? 106 ASN   A CB  1 
ATOM   746  C CG  . ASN   A 1 91 ? -0.899  13.679  27.208 1   31.17 ? 106 ASN   A CG  1 
ATOM   747  O OD1 . ASN   A 1 91 ? -1.669  14.597  26.918 1   34.02 ? 106 ASN   A OD1 1 
ATOM   748  N ND2 . ASN   A 1 91 ? 0.399   13.891  27.375 1   30.93 ? 106 ASN   A ND2 1 
ATOM   749  N N   . LEU   A 1 92 ? -3.255  10.407  29.989 1   24.77 ? 107 LEU   A N   1 
ATOM   750  C CA  . LEU   A 1 92 ? -4.225  9.344   30.184 1   25.15 ? 107 LEU   A CA  1 
ATOM   751  C C   . LEU   A 1 92 ? -4.604  9.207   31.651 1   27.09 ? 107 LEU   A C   1 
ATOM   752  O O   . LEU   A 1 92 ? -3.895  9.703   32.528 1   28.41 ? 107 LEU   A O   1 
ATOM   753  C CB  . LEU   A 1 92 ? -3.7    7.986   29.636 1   25.38 ? 107 LEU   A CB  1 
ATOM   754  C CG  . LEU   A 1 92 ? -2.371  7.413   30.182 1   27.22 ? 107 LEU   A CG  1 
ATOM   755  C CD1 . LEU   A 1 92 ? -2.549  6.709   31.535 1   28.29 ? 107 LEU   A CD1 1 
ATOM   756  C CD2 . LEU   A 1 92 ? -1.83   6.391   29.244 1   27.4  ? 107 LEU   A CD2 1 
ATOM   757  N N   . VAL   A 1 93 ? -5.69   8.473   31.915 1   27.43 ? 108 VAL   A N   1 
ATOM   758  C CA  . VAL   A 1 93 ? -6.134  8.113   33.244 1   28.82 ? 108 VAL   A CA  1 
ATOM   759  C C   . VAL   A 1 93 ? -6.047  6.584   33.302 1   28.52 ? 108 VAL   A C   1 
ATOM   760  O O   . VAL   A 1 93 ? -6.62   5.912   32.448 1   28.08 ? 108 VAL   A O   1 
ATOM   761  C CB  . VAL   A 1 93 ? -7.584  8.586   33.518 1   30.79 ? 108 VAL   A CB  1 
ATOM   762  C CG1 . VAL   A 1 93 ? -8.109  7.986   34.816 1   32.29 ? 108 VAL   A CG1 1 
ATOM   763  C CG2 . VAL   A 1 93 ? -7.664  10.11   33.556 1   31.22 ? 108 VAL   A CG2 1 
ATOM   764  N N   . VAL   A 1 94 ? -5.325  6.04    34.289 1   28.93 ? 109 VAL   A N   1 
ATOM   765  C CA  . VAL   A 1 94 ? -5.17   4.602   34.471 1   29.79 ? 109 VAL   A CA  1 
ATOM   766  C C   . VAL   A 1 94 ? -6.473  4.008   35.009 1   32.16 ? 109 VAL   A C   1 
ATOM   767  O O   . VAL   A 1 94 ? -7.056  4.564   35.934 1   32.88 ? 109 VAL   A O   1 
ATOM   768  C CB  . VAL   A 1 94 ? -3.986  4.324   35.431 1   29.92 ? 109 VAL   A CB  1 
ATOM   769  C CG1 . VAL   A 1 94 ? -3.938  2.859   35.867 1   30.23 ? 109 VAL   A CG1 1 
ATOM   770  C CG2 . VAL   A 1 94 ? -2.665  4.752   34.8   1   30.43 ? 109 VAL   A CG2 1 
ATOM   771  N N   . VAL   A 1 95 ? -6.944  2.902   34.422 1   33.36 ? 110 VAL   A N   1 
ATOM   772  C CA  . VAL   A 1 95 ? -8.127  2.215   34.917 1   36.04 ? 110 VAL   A CA  1 
ATOM   773  C C   . VAL   A 1 95 ? -7.616  1.31    36.029 1   39.05 ? 110 VAL   A C   1 
ATOM   774  O O   . VAL   A 1 95 ? -7.156  0.19    35.766 1   38.84 ? 110 VAL   A O   1 
ATOM   775  C CB  . VAL   A 1 95 ? -8.818  1.401   33.81  1   36.67 ? 110 VAL   A CB  1 
ATOM   776  C CG1 . VAL   A 1 95 ? -10.018 0.644   34.367 1   37.62 ? 110 VAL   A CG1 1 
ATOM   777  C CG2 . VAL   A 1 95 ? -9.228  2.303   32.65  1   36.84 ? 110 VAL   A CG2 1 
ATOM   778  N N   . ASN   A 1 96 ? -7.637  1.832   37.271 1   41.04 ? 111 ASN   A N   1 
ATOM   779  C CA  . ASN   A 1 96 ? -7.105  1.146   38.451 1   43.24 ? 111 ASN   A CA  1 
ATOM   780  C C   . ASN   A 1 96 ? -8.175  0.689   39.44  1   44.45 ? 111 ASN   A C   1 
ATOM   781  O O   . ASN   A 1 96 ? -9.354  0.985   39.266 1   45.04 ? 111 ASN   A O   1 
ATOM   782  C CB  . ASN   A 1 96 ? -6.072  2.031   39.153 1   45.66 ? 111 ASN   A CB  1 
ATOM   783  C CG  . ASN   A 1 96 ? -6.553  3.437   39.438 1   51.84 ? 111 ASN   A CG  1 
ATOM   784  O OD1 . ASN   A 1 96 ? -7.74   3.778   39.261 1   54.52 ? 111 ASN   A OD1 1 
ATOM   785  N ND2 . ASN   A 1 96 ? -5.645  4.293   39.898 1   53.08 ? 111 ASN   A ND2 1 
ATOM   786  N N   . MET   B 1 1  ? 28.16   -2.653  26.095 1   54.82 ? 16  MET   B N   1 
ATOM   787  C CA  . MET   B 1 1  ? 26.95   -2.509  25.285 1   54.9  ? 16  MET   B CA  1 
ATOM   788  C C   . MET   B 1 1  ? 27.218  -2.814  23.782 1   53.78 ? 16  MET   B C   1 
ATOM   789  O O   . MET   B 1 1  ? 28.295  -3.317  23.449 1   54.36 ? 16  MET   B O   1 
ATOM   790  C CB  . MET   B 1 1  ? 26.273  -1.137  25.529 1   56.42 ? 16  MET   B CB  1 
ATOM   791  C CG  . MET   B 1 1  ? 26.805  0.003   24.678 1   60.15 ? 16  MET   B CG  1 
ATOM   792  S SD  . MET   B 1 1  ? 25.789  1.5     24.835 1   70.54 ? 16  MET   B SD  1 
ATOM   793  C CE  . MET   B 1 1  ? 24.559  1.216   23.582 1   68.01 ? 16  MET   B CE  1 
ATOM   794  N N   . SER   B 1 2  ? 26.232  -2.583  22.89  1   52    ? 17  SER   B N   1 
ATOM   795  C CA  . SER   B 1 2  ? 26.398  -2.894  21.477 1   51.02 ? 17  SER   B CA  1 
ATOM   796  C C   . SER   B 1 2  ? 25.664  -1.908  20.54  1   49.78 ? 17  SER   B C   1 
ATOM   797  O O   . SER   B 1 2  ? 24.988  -1      21.021 1   50.34 ? 17  SER   B O   1 
ATOM   798  C CB  . SER   B 1 2  ? 25.959  -4.333  21.227 1   52.4  ? 17  SER   B CB  1 
ATOM   799  O OG  . SER   B 1 2  ? 24.59   -4.519  21.548 1   54.11 ? 17  SER   B OG  1 
ATOM   800  N N   . GLN   B 1 3  ? 25.821  -2.077  19.206 1   48.23 ? 18  GLN   B N   1 
ATOM   801  C CA  . GLN   B 1 3  ? 25.235  -1.262  18.129 1   46.81 ? 18  GLN   B CA  1 
ATOM   802  C C   . GLN   B 1 3  ? 23.701  -1.172  18.178 1   43.6  ? 18  GLN   B C   1 
ATOM   803  O O   . GLN   B 1 3  ? 23.11   -0.197  17.726 1   44.8  ? 18  GLN   B O   1 
ATOM   804  C CB  . GLN   B 1 3  ? 25.65   -1.848  16.768 1   49.95 ? 18  GLN   B CB  1 
ATOM   805  C CG  . GLN   B 1 3  ? 25.157  -1.038  15.573 1   55.79 ? 18  GLN   B CG  1 
ATOM   806  C CD  . GLN   B 1 3  ? 24.707  -1.905  14.431 1   63.39 ? 18  GLN   B CD  1 
ATOM   807  O OE1 . GLN   B 1 3  ? 25.477  -2.245  13.517 1   65.76 ? 18  GLN   B OE1 1 
ATOM   808  N NE2 . GLN   B 1 3  ? 23.441  -2.286  14.462 1   64.98 ? 18  GLN   B NE2 1 
ATOM   809  N N   . ILE   B 1 4  ? 23.073  -2.215  18.675 1   39.87 ? 19  ILE   B N   1 
ATOM   810  C CA  . ILE   B 1 4  ? 21.625  -2.357  18.816 1   36.24 ? 19  ILE   B CA  1 
ATOM   811  C C   . ILE   B 1 4  ? 21.13   -1.34   19.838 1   31.65 ? 19  ILE   B C   1 
ATOM   812  O O   . ILE   B 1 4  ? 21.814  -1.107  20.833 1   30.86 ? 19  ILE   B O   1 
ATOM   813  C CB  . ILE   B 1 4  ? 21.406  -3.81   19.296 1   37.24 ? 19  ILE   B CB  1 
ATOM   814  C CG1 . ILE   B 1 4  ? 21.848  -4.799  18.224 1   38.71 ? 19  ILE   B CG1 1 
ATOM   815  C CG2 . ILE   B 1 4  ? 20.014  -4.11   19.823 1   38.13 ? 19  ILE   B CG2 1 
ATOM   816  C CD1 . ILE   B 1 4  ? 23.211  -5.185  18.429 1   40.88 ? 19  ILE   B CD1 1 
ATOM   817  N N   . PRO   B 1 5  ? 19.968  -0.71   19.599 1   28.59 ? 20  PRO   B N   1 
ATOM   818  C CA  . PRO   B 1 5  ? 19.443  0.26    20.579 1   26.16 ? 20  PRO   B CA  1 
ATOM   819  C C   . PRO   B 1 5  ? 19.24   -0.341  21.971 1   24.63 ? 20  PRO   B C   1 
ATOM   820  O O   . PRO   B 1 5  ? 18.827  -1.503  22.1   1   24.11 ? 20  PRO   B O   1 
ATOM   821  C CB  . PRO   B 1 5  ? 18.069  0.663   20.006 1   27.26 ? 20  PRO   B CB  1 
ATOM   822  C CG  . PRO   B 1 5  ? 18.009  0.14    18.634 1   28.44 ? 20  PRO   B CG  1 
ATOM   823  C CD  . PRO   B 1 5  ? 19.07   -0.889  18.435 1   27.64 ? 20  PRO   B CD  1 
ATOM   824  N N   . ALA   B 1 6  ? 19.478  0.448   23.01  1   23.96 ? 21  ALA   B N   1 
ATOM   825  C CA  . ALA   B 1 6  ? 19.278  -0.025  24.384 1   24.76 ? 21  ALA   B CA  1 
ATOM   826  C C   . ALA   B 1 6  ? 17.818  0.098   24.795 1   25.04 ? 21  ALA   B C   1 
ATOM   827  O O   . ALA   B 1 6  ? 17.117  1.033   24.386 1   25.05 ? 21  ALA   B O   1 
ATOM   828  C CB  . ALA   B 1 6  ? 20.13   0.791   25.349 1   25.37 ? 21  ALA   B CB  1 
ATOM   829  N N   . SER   B 1 7  ? 17.379  -0.817  25.66  1   24.1  ? 22  SER   B N   1 
ATOM   830  C CA  . SER   B 1 7  ? 16.041  -0.765  26.23  1   24.94 ? 22  SER   B CA  1 
ATOM   831  C C   . SER   B 1 7  ? 16.159  -0.014  27.61  1   24.35 ? 22  SER   B C   1 
ATOM   832  O O   . SER   B 1 7  ? 17.268  0.274   28.066 1   24.38 ? 22  SER   B O   1 
ATOM   833  C CB  . SER   B 1 7  ? 15.53   -2.186  26.434 1   26.97 ? 22  SER   B CB  1 
ATOM   834  O OG  . SER   B 1 7  ? 16.268  -2.771  27.49  1   31.24 ? 22  SER   B OG  1 
ATOM   835  N N   . GLU   B 1 8  ? 15.04   0.303   28.24  1   24.17 ? 23  GLU   B N   1 
ATOM   836  C CA  . GLU   B 1 8  ? 15.042  1.007   29.527 1   24.06 ? 23  GLU   B CA  1 
ATOM   837  C C   . GLU   B 1 8  ? 15.739  0.189   30.619 1   25.3  ? 23  GLU   B C   1 
ATOM   838  O O   . GLU   B 1 8  ? 16.431  0.759   31.464 1   25.93 ? 23  GLU   B O   1 
ATOM   839  C CB  . GLU   B 1 8  ? 13.599  1.353   29.933 1   23.65 ? 23  GLU   B CB  1 
ATOM   840  C CG  . GLU   B 1 8  ? 13.534  2.278   31.128 1   25.04 ? 23  GLU   B CG  1 
ATOM   841  C CD  . GLU   B 1 8  ? 12.142  2.652   31.595 1   27.94 ? 23  GLU   B CD  1 
ATOM   842  O OE1 . GLU   B 1 8  ? 11.183  1.967   31.184 1   27.67 ? 23  GLU   B OE1 1 
ATOM   843  O OE2 . GLU   B 1 8  ? 12.01   3.632   32.364 1   29.41 ? 23  GLU   B OE2 1 
ATOM   844  N N   . GLN   B 1 9  ? 15.588  -1.153  30.61  1   25.6  ? 24  GLN   B N   1 
ATOM   845  C CA  . GLN   B 1 9  ? 16.253  -1.995  31.628 1   26.13 ? 24  GLN   B CA  1 
ATOM   846  C C   . GLN   B 1 9  ? 17.775  -1.953  31.519 1   25.65 ? 24  GLN   B C   1 
ATOM   847  O O   . GLN   B 1 9  ? 18.46   -2.23   32.499 1   26.09 ? 24  GLN   B O   1 
ATOM   848  C CB  . GLN   B 1 9  ? 15.786  -3.46   31.548 1   28.83 ? 24  GLN   B CB  1 
ATOM   849  C CG  . GLN   B 1 9  ? 14.275  -3.621  31.698 1   34.19 ? 24  GLN   B CG  1 
ATOM   850  C CD  . GLN   B 1 9  ? 13.786  -3.957  33.091 1   39.79 ? 24  GLN   B CD  1 
ATOM   851  O OE1 . GLN   B 1 9  ? 12.666  -3.595  33.484 1   43.21 ? 24  GLN   B OE1 1 
ATOM   852  N NE2 . GLN   B 1 9  ? 14.579  -4.684  33.855 1   37.62 ? 24  GLN   B NE2 1 
ATOM   853  N N   . GLU   B 1 10 ? 18.306  -1.617  30.34  1   24.7  ? 25  GLU   B N   1 
ATOM   854  C CA  . GLU   B 1 10 ? 19.742  -1.518  30.118 1   24.95 ? 25  GLU   B CA  1 
ATOM   855  C C   . GLU   B 1 10 ? 20.336  -0.163  30.492 1   25.37 ? 25  GLU   B C   1 
ATOM   856  O O   . GLU   B 1 10 ? 21.56   -0.007  30.444 1   25.88 ? 25  GLU   B O   1 
ATOM   857  C CB  . GLU   B 1 10 ? 20.063  -1.858  28.645 1   26.83 ? 25  GLU   B CB  1 
ATOM   858  C CG  . GLU   B 1 10 ? 19.929  -3.344  28.392 1   31.08 ? 25  GLU   B CG  1 
ATOM   859  C CD  . GLU   B 1 10 ? 19.781  -3.768  26.945 1   39.38 ? 25  GLU   B CD  1 
ATOM   860  O OE1 . GLU   B 1 10 ? 19.457  -2.905  26.098 1   35.55 ? 25  GLU   B OE1 1 
ATOM   861  O OE2 . GLU   B 1 10 ? 19.963  -4.976  26.663 1   44.6  ? 25  GLU   B OE2 1 
ATOM   862  N N   . THR   B 1 11 ? 19.495  0.835   30.819 1   24.71 ? 26  THR   B N   1 
ATOM   863  C CA  . THR   B 1 11 ? 19.976  2.172   31.159 1   24.67 ? 26  THR   B CA  1 
ATOM   864  C C   . THR   B 1 11 ? 20.944  2.155   32.353 1   24.72 ? 26  THR   B C   1 
ATOM   865  O O   . THR   B 1 11 ? 20.595  1.611   33.394 1   24.25 ? 26  THR   B O   1 
ATOM   866  C CB  . THR   B 1 11 ? 18.79   3.067   31.475 1   26.2  ? 26  THR   B CB  1 
ATOM   867  O OG1 . THR   B 1 11 ? 17.868  3.041   30.368 1   27.64 ? 26  THR   B OG1 1 
ATOM   868  C CG2 . THR   B 1 11 ? 19.216  4.5     31.827 1   26.82 ? 26  THR   B CG2 1 
ATOM   869  N N   . LEU   B 1 12 ? 22.136  2.769   32.205 1   24.39 ? 27  LEU   B N   1 
ATOM   870  C CA  . LEU   B 1 12 ? 23.145  2.861   33.252 1   25.11 ? 27  LEU   B CA  1 
ATOM   871  C C   . LEU   B 1 12 ? 22.818  4.05    34.157 1   24.75 ? 27  LEU   B C   1 
ATOM   872  O O   . LEU   B 1 12 ? 22.593  5.17    33.694 1   25.8  ? 27  LEU   B O   1 
ATOM   873  C CB  . LEU   B 1 12 ? 24.559  3.029   32.643 1   26.49 ? 27  LEU   B CB  1 
ATOM   874  C CG  . LEU   B 1 12 ? 25.177  1.766   32.025 1   29.94 ? 27  LEU   B CG  1 
ATOM   875  C CD1 . LEU   B 1 12 ? 26.484  2.091   31.32  1   31.35 ? 27  LEU   B CD1 1 
ATOM   876  C CD2 . LEU   B 1 12 ? 25.473  0.728   33.092 1   31.44 ? 27  LEU   B CD2 1 
ATOM   877  N N   . VAL   B 1 13 ? 22.808  3.804   35.453 1   23.93 ? 28  VAL   B N   1 
ATOM   878  C CA  . VAL   B 1 13 ? 22.417  4.791   36.433 1   24.34 ? 28  VAL   B CA  1 
ATOM   879  C C   . VAL   B 1 13 ? 23.384  4.824   37.586 1   25.95 ? 28  VAL   B C   1 
ATOM   880  O O   . VAL   B 1 13 ? 24.012  3.826   37.916 1   26.04 ? 28  VAL   B O   1 
ATOM   881  C CB  . VAL   B 1 13 ? 20.959  4.522   36.926 1   24.08 ? 28  VAL   B CB  1 
ATOM   882  C CG1 . VAL   B 1 13 ? 19.958  4.614   35.77  1   24.54 ? 28  VAL   B CG1 1 
ATOM   883  C CG2 . VAL   B 1 13 ? 20.834  3.15    37.606 1   24.41 ? 28  VAL   B CG2 1 
ATOM   884  N N   . ARG   B 1 14 ? 23.465  5.972   38.226 1   27.08 ? 29  ARG   B N   1 
ATOM   885  C CA  . ARG   B 1 14 ? 24.293  6.179   39.399 1   28.85 ? 29  ARG   B CA  1 
ATOM   886  C C   . ARG   B 1 14 ? 23.353  6.546   40.558 1   27.91 ? 29  ARG   B C   1 
ATOM   887  O O   . ARG   B 1 14 ? 22.941  7.707   40.7   1   27.47 ? 29  ARG   B O   1 
ATOM   888  C CB  . ARG   B 1 14 ? 25.292  7.323   39.119 1   32.76 ? 29  ARG   B CB  1 
ATOM   889  C CG  . ARG   B 1 14 ? 26.522  7.312   40.013 1   39.94 ? 29  ARG   B CG  1 
ATOM   890  C CD  . ARG   B 1 14 ? 27.613  8.233   39.498 1   45    ? 29  ARG   B CD  1 
ATOM   891  N NE  . ARG   B 1 14 ? 28.38   7.617   38.417 1   50.78 ? 29  ARG   B NE  1 
ATOM   892  C CZ  . ARG   B 1 14 ? 29.513  6.941   38.593 1   55.55 ? 29  ARG   B CZ  1 
ATOM   893  N NH1 . ARG   B 1 14 ? 30.015  6.776   39.811 1   56.83 ? 29  ARG   B NH1 1 
ATOM   894  N NH2 . ARG   B 1 14 ? 30.142  6.406   37.555 1   56.22 ? 29  ARG   B NH2 1 
ATOM   895  N N   . PRO   B 1 15 ? 22.986  5.561   41.383 1   27.35 ? 30  PRO   B N   1 
ATOM   896  C CA  . PRO   B 1 15 ? 22.111  5.855   42.529 1   27.62 ? 30  PRO   B CA  1 
ATOM   897  C C   . PRO   B 1 15 ? 22.658  6.933   43.475 1   28.48 ? 30  PRO   B C   1 
ATOM   898  O O   . PRO   B 1 15 ? 23.863  7.01    43.72  1   28.69 ? 30  PRO   B O   1 
ATOM   899  C CB  . PRO   B 1 15 ? 22.003  4.503   43.242 1   27.83 ? 30  PRO   B CB  1 
ATOM   900  C CG  . PRO   B 1 15 ? 22.28   3.484   42.173 1   28.37 ? 30  PRO   B CG  1 
ATOM   901  C CD  . PRO   B 1 15 ? 23.339  4.127   41.324 1   26.65 ? 30  PRO   B CD  1 
ATOM   902  N N   . LYS   B 1 16 ? 21.765  7.786   43.968 1   28.57 ? 31  LYS   B N   1 
ATOM   903  C CA  . LYS   B 1 16 ? 22.055  8.808   44.969 1   29.66 ? 31  LYS   B CA  1 
ATOM   904  C C   . LYS   B 1 16 ? 22.373  8.093   46.325 1   30.66 ? 31  LYS   B C   1 
ATOM   905  O O   . LYS   B 1 16 ? 22.19   6.869   46.438 1   30.81 ? 31  LYS   B O   1 
ATOM   906  C CB  . LYS   B 1 16 ? 20.868  9.78    45.07  1   31.19 ? 31  LYS   B CB  1 
ATOM   907  C CG  . LYS   B 1 16 ? 20.728  10.684  43.858 1   33.77 ? 31  LYS   B CG  1 
ATOM   908  C CD  . LYS   B 1 16 ? 19.468  11.495  43.898 1   37.26 ? 31  LYS   B CD  1 
ATOM   909  C CE  . LYS   B 1 16 ? 19.413  12.507  42.778 1   41.02 ? 31  LYS   B CE  1 
ATOM   910  N NZ  . LYS   B 1 16 ? 18.054  13.094  42.652 1   43.03 ? 31  LYS   B NZ  1 
ATOM   911  N N   . PRO   B 1 17 ? 22.912  8.802   47.347 1   31.05 ? 32  PRO   B N   1 
ATOM   912  C CA  . PRO   B 1 17 ? 23.366  8.099   48.559 1   30.71 ? 32  PRO   B CA  1 
ATOM   913  C C   . PRO   B 1 17 ? 22.371  7.156   49.258 1   30.56 ? 32  PRO   B C   1 
ATOM   914  O O   . PRO   B 1 17 ? 22.805  6.067   49.628 1   29.76 ? 32  PRO   B O   1 
ATOM   915  C CB  . PRO   B 1 17 ? 23.836  9.227   49.487 1   31.64 ? 32  PRO   B CB  1 
ATOM   916  C CG  . PRO   B 1 17 ? 24.211  10.337  48.573 1   32.44 ? 32  PRO   B CG  1 
ATOM   917  C CD  . PRO   B 1 17 ? 23.28   10.237  47.381 1   30.73 ? 32  PRO   B CD  1 
ATOM   918  N N   . LEU   B 1 18 ? 21.08   7.525   49.426 1   30.79 ? 33  LEU   B N   1 
ATOM   919  C CA  . LEU   B 1 18 ? 20.122  6.643   50.107 1   31.5  ? 33  LEU   B CA  1 
ATOM   920  C C   . LEU   B 1 18 ? 19.854  5.374   49.311 1   30.24 ? 33  LEU   B C   1 
ATOM   921  O O   . LEU   B 1 18 ? 19.93   4.274   49.873 1   30.63 ? 33  LEU   B O   1 
ATOM   922  C CB  . LEU   B 1 18 ? 18.801  7.356   50.412 1   33.51 ? 33  LEU   B CB  1 
ATOM   923  C CG  . LEU   B 1 18 ? 18.851  8.563   51.358 1   37.61 ? 33  LEU   B CG  1 
ATOM   924  C CD1 . LEU   B 1 18 ? 17.46   9.13    51.556 1   39.28 ? 33  LEU   B CD1 1 
ATOM   925  C CD2 . LEU   B 1 18 ? 19.446  8.19    52.691 1   38.93 ? 33  LEU   B CD2 1 
ATOM   926  N N   . LEU   B 1 19 ? 19.6    5.503   47.989 1   28.94 ? 34  LEU   B N   1 
ATOM   927  C CA  . LEU   B 1 19 ? 19.372  4.312   47.172 1   28.83 ? 34  LEU   B CA  1 
ATOM   928  C C   . LEU   B 1 19 ? 20.612  3.444   47.125 1   29.09 ? 34  LEU   B C   1 
ATOM   929  O O   . LEU   B 1 19 ? 20.492  2.229   47.251 1   29.88 ? 34  LEU   B O   1 
ATOM   930  C CB  . LEU   B 1 19 ? 18.843  4.657   45.766 1   28.62 ? 34  LEU   B CB  1 
ATOM   931  C CG  . LEU   B 1 19 ? 18.662  3.491   44.779 1   29.61 ? 34  LEU   B CG  1 
ATOM   932  C CD1 . LEU   B 1 19 ? 17.683  2.418   45.339 1   29.75 ? 34  LEU   B CD1 1 
ATOM   933  C CD2 . LEU   B 1 19 ? 18.143  4.007   43.424 1   29.13 ? 34  LEU   B CD2 1 
ATOM   934  N N   . LEU   B 1 20 ? 21.809  4.051   47.047 1   29.46 ? 35  LEU   B N   1 
ATOM   935  C CA  . LEU   B 1 20 ? 23.063  3.286   47.029 1   30.64 ? 35  LEU   B CA  1 
ATOM   936  C C   . LEU   B 1 20 ? 23.263  2.502   48.325 1   30.9  ? 35  LEU   B C   1 
ATOM   937  O O   . LEU   B 1 20 ? 23.628  1.327   48.289 1   30.23 ? 35  LEU   B O   1 
ATOM   938  C CB  . LEU   B 1 20 ? 24.278  4.198   46.743 1   31.85 ? 35  LEU   B CB  1 
ATOM   939  C CG  . LEU   B 1 20 ? 25.585  3.47    46.408 1   34.73 ? 35  LEU   B CG  1 
ATOM   940  C CD1 . LEU   B 1 20 ? 25.417  2.578   45.179 1   35.73 ? 35  LEU   B CD1 1 
ATOM   941  C CD2 . LEU   B 1 20 ? 26.73   4.458   46.194 1   35.91 ? 35  LEU   B CD2 1 
ATOM   942  N N   . LYS   B 1 21 ? 22.936  3.121   49.464 1   30.99 ? 36  LYS   B N   1 
ATOM   943  C CA  . LYS   B 1 21 ? 23.034  2.465   50.779 1   31.13 ? 36  LYS   B CA  1 
ATOM   944  C C   . LYS   B 1 21 ? 22.072  1.245   50.838 1   30.32 ? 36  LYS   B C   1 
ATOM   945  O O   . LYS   B 1 21 ? 22.452  0.18    51.325 1   30.44 ? 36  LYS   B O   1 
ATOM   946  C CB  . LYS   B 1 21 ? 22.716  3.5     51.871 1   32.83 ? 36  LYS   B CB  1 
ATOM   947  C CG  . LYS   B 1 21 ? 22.679  2.963   53.29  1   38.18 ? 36  LYS   B CG  1 
ATOM   948  C CD  . LYS   B 1 21 ? 22.632  4.142   54.246 1   42.82 ? 36  LYS   B CD  1 
ATOM   949  C CE  . LYS   B 1 21 ? 22.262  3.768   55.653 1   47.76 ? 36  LYS   B CE  1 
ATOM   950  N NZ  . LYS   B 1 21 ? 21.904  4.976   56.442 1   50.21 ? 36  LYS   B NZ  1 
ATOM   951  N N   . LEU   B 1 22 ? 20.869  1.377   50.264 1   29.25 ? 37  LEU   B N   1 
ATOM   952  C CA  . LEU   B 1 22 ? 19.906  0.264   50.21  1   29.2  ? 37  LEU   B CA  1 
ATOM   953  C C   . LEU   B 1 22 ? 20.475  -0.868  49.356 1   29    ? 37  LEU   B C   1 
ATOM   954  O O   . LEU   B 1 22 ? 20.43   -2.025  49.77  1   28.3  ? 37  LEU   B O   1 
ATOM   955  C CB  . LEU   B 1 22 ? 18.554  0.756   49.63  1   29.04 ? 37  LEU   B CB  1 
ATOM   956  C CG  . LEU   B 1 22 ? 17.388  -0.24   49.545 1   31.11 ? 37  LEU   B CG  1 
ATOM   957  C CD1 . LEU   B 1 22 ? 16.047  0.492   49.552 1   30.82 ? 37  LEU   B CD1 1 
ATOM   958  C CD2 . LEU   B 1 22 ? 17.472  -1.128  48.27  1   32.26 ? 37  LEU   B CD2 1 
ATOM   959  N N   . LEU   B 1 23 ? 21.005  -0.53   48.158 1   29.33 ? 38  LEU   B N   1 
ATOM   960  C CA  . LEU   B 1 23 ? 21.567  -1.525  47.24  1   29.99 ? 38  LEU   B CA  1 
ATOM   961  C C   . LEU   B 1 23 ? 22.76   -2.274  47.843 1   31.8  ? 38  LEU   B C   1 
ATOM   962  O O   . LEU   B 1 23 ? 22.842  -3.498  47.722 1   32.4  ? 38  LEU   B O   1 
ATOM   963  C CB  . LEU   B 1 23 ? 21.97   -0.845  45.927 1   29.29 ? 38  LEU   B CB  1 
ATOM   964  C CG  . LEU   B 1 23 ? 20.829  -0.244  45.12  1   29.44 ? 38  LEU   B CG  1 
ATOM   965  C CD1 . LEU   B 1 23 ? 21.363  0.574   43.961 1   30.13 ? 38  LEU   B CD1 1 
ATOM   966  C CD2 . LEU   B 1 23 ? 19.896  -1.305  44.63  1   28.83 ? 38  LEU   B CD2 1 
ATOM   967  N N   . LYS   B 1 24 ? 23.656  -1.557  48.525 1   31.94 ? 39  LYS   B N   1 
ATOM   968  C CA  . LYS   B 1 24 ? 24.823  -2.191  49.151 1   32.94 ? 39  LYS   B CA  1 
ATOM   969  C C   . LYS   B 1 24 ? 24.457  -3.049  50.358 1   33.75 ? 39  LYS   B C   1 
ATOM   970  O O   . LYS   B 1 24 ? 25.14   -4.037  50.616 1   33.99 ? 39  LYS   B O   1 
ATOM   971  C CB  . LYS   B 1 24 ? 25.914  -1.162  49.489 1   34.77 ? 39  LYS   B CB  1 
ATOM   972  C CG  . LYS   B 1 24 ? 26.488  -0.53   48.218 1   38.4  ? 39  LYS   B CG  1 
ATOM   973  C CD  . LYS   B 1 24 ? 27.796  0.202   48.429 1   41.78 ? 39  LYS   B CD  1 
ATOM   974  C CE  . LYS   B 1 24 ? 28.347  0.675   47.108 1   45.94 ? 39  LYS   B CE  1 
ATOM   975  N NZ  . LYS   B 1 24 ? 29.681  1.32    47.25  1   48.6  ? 39  LYS   B NZ  1 
ATOM   976  N N   . SER   B 1 25 ? 23.325  -2.755  51.018 1   33.72 ? 40  SER   B N   1 
ATOM   977  C CA  . SER   B 1 25 ? 22.835  -3.549  52.153 1   34.04 ? 40  SER   B CA  1 
ATOM   978  C C   . SER   B 1 25 ? 22.499  -4.989  51.762 1   34.63 ? 40  SER   B C   1 
ATOM   979  O O   . SER   B 1 25 ? 22.48   -5.862  52.626 1   34.19 ? 40  SER   B O   1 
ATOM   980  C CB  . SER   B 1 25 ? 21.63   -2.87   52.797 1   35.31 ? 40  SER   B CB  1 
ATOM   981  O OG  . SER   B 1 25 ? 20.404  -3.219  52.175 1   36.78 ? 40  SER   B OG  1 
ATOM   982  N N   . VAL   B 1 26 ? 22.192  -5.243  50.465 1   35.05 ? 41  VAL   B N   1 
ATOM   983  C CA  . VAL   B 1 26 ? 21.922  -6.608  50.015 1   36.26 ? 41  VAL   B CA  1 
ATOM   984  C C   . VAL   B 1 26 ? 23.088  -7.21   49.22  1   38.23 ? 41  VAL   B C   1 
ATOM   985  O O   . VAL   B 1 26 ? 22.892  -8.215  48.538 1   38.4  ? 41  VAL   B O   1 
ATOM   986  C CB  . VAL   B 1 26 ? 20.582  -6.798  49.261 1   36.76 ? 41  VAL   B CB  1 
ATOM   987  C CG1 . VAL   B 1 26 ? 19.395  -6.649  50.208 1   37.03 ? 41  VAL   B CG1 1 
ATOM   988  C CG2 . VAL   B 1 26 ? 20.467  -5.842  48.075 1   36.95 ? 41  VAL   B CG2 1 
ATOM   989  N N   . GLY   B 1 27 ? 24.286  -6.643  49.346 1   39.35 ? 42  GLY   B N   1 
ATOM   990  C CA  . GLY   B 1 27 ? 25.466  -7.231  48.731 1   41.15 ? 42  GLY   B CA  1 
ATOM   991  C C   . GLY   B 1 27 ? 25.957  -6.674  47.416 1   42.8  ? 42  GLY   B C   1 
ATOM   992  O O   . GLY   B 1 27 ? 26.951  -7.178  46.901 1   43.75 ? 42  GLY   B O   1 
ATOM   993  N N   . ALA   B 1 28 ? 25.293  -5.653  46.856 1   43.36 ? 43  ALA   B N   1 
ATOM   994  C CA  . ALA   B 1 28 ? 25.761  -5.055  45.604 1   44.78 ? 43  ALA   B CA  1 
ATOM   995  C C   . ALA   B 1 28 ? 27.003  -4.218  45.944 1   46.38 ? 43  ALA   B C   1 
ATOM   996  O O   . ALA   B 1 28 ? 27.01   -3.53   46.959 1   46.83 ? 43  ALA   B O   1 
ATOM   997  C CB  . ALA   B 1 28 ? 24.671  -4.198  44.986 1   44.54 ? 43  ALA   B CB  1 
ATOM   998  N N   . GLN   B 1 29 ? 28.086  -4.353  45.166 1   47.09 ? 44  GLN   B N   1 
ATOM   999  C CA  . GLN   B 1 29 ? 29.348  -3.678  45.49  1   47.83 ? 44  GLN   B CA  1 
ATOM   1000 C C   . GLN   B 1 29 ? 29.84   -2.69   44.421 1   47.37 ? 44  GLN   B C   1 
ATOM   1001 O O   . GLN   B 1 29 ? 31.054  -2.603  44.182 1   48.83 ? 44  GLN   B O   1 
ATOM   1002 C CB  . GLN   B 1 29 ? 30.444  -4.722  45.8   1   50.63 ? 44  GLN   B CB  1 
ATOM   1003 C CG  . GLN   B 1 29 ? 30.084  -5.726  46.892 1   55.94 ? 44  GLN   B CG  1 
ATOM   1004 C CD  . GLN   B 1 29 ? 31.083  -6.86   47.011 1   61.89 ? 44  GLN   B CD  1 
ATOM   1005 O OE1 . GLN   B 1 29 ? 32.217  -6.791  46.51  1   64.16 ? 44  GLN   B OE1 1 
ATOM   1006 N NE2 . GLN   B 1 29 ? 30.681  -7.932  47.685 1   62.42 ? 44  GLN   B NE2 1 
ATOM   1007 N N   . LYS   B 1 30 ? 28.93   -1.927  43.799 1   44.69 ? 45  LYS   B N   1 
ATOM   1008 C CA  . LYS   B 1 30 ? 29.353  -0.943  42.802 1   42.68 ? 45  LYS   B CA  1 
ATOM   1009 C C   . LYS   B 1 30 ? 28.58   0.368   42.921 1   40.21 ? 45  LYS   B C   1 
ATOM   1010 O O   . LYS   B 1 30 ? 27.668  0.468   43.74  1   40.89 ? 45  LYS   B O   1 
ATOM   1011 C CB  . LYS   B 1 30 ? 29.321  -1.535  41.387 1   44.44 ? 45  LYS   B CB  1 
ATOM   1012 C CG  . LYS   B 1 30 ? 28.04   -2.248  41.035 1   48.29 ? 45  LYS   B CG  1 
ATOM   1013 C CD  . LYS   B 1 30 ? 28.217  -2.96   39.721 1   52.13 ? 45  LYS   B CD  1 
ATOM   1014 C CE  . LYS   B 1 30 ? 26.934  -3.558  39.222 1   55.21 ? 45  LYS   B CE  1 
ATOM   1015 N NZ  . LYS   B 1 30 ? 27.107  -4.108  37.851 1   57.51 ? 45  LYS   B NZ  1 
ATOM   1016 N N   . ASP   B 1 31 ? 29.01   1.405   42.208 1   37.19 ? 46  ASP   B N   1 
ATOM   1017 C CA  . ASP   B 1 31 ? 28.338  2.694   42.244 1   35.8  ? 46  ASP   B CA  1 
ATOM   1018 C C   . ASP   B 1 31 ? 27.434  2.931   41.018 1   33.13 ? 46  ASP   B C   1 
ATOM   1019 O O   . ASP   B 1 31 ? 26.619  3.851   41.054 1   32.51 ? 46  ASP   B O   1 
ATOM   1020 C CB  . ASP   B 1 31 ? 29.365  3.83    42.347 1   38.96 ? 46  ASP   B CB  1 
ATOM   1021 C CG  . ASP   B 1 31 ? 30.1    3.9     43.675 1   46.63 ? 46  ASP   B CG  1 
ATOM   1022 O OD1 . ASP   B 1 31 ? 29.673  3.208   44.635 1   47.76 ? 46  ASP   B OD1 1 
ATOM   1023 O OD2 . ASP   B 1 31 ? 31.093  4.652   43.76  1   49.69 ? 46  ASP   B OD2 1 
ATOM   1024 N N   . THR   B 1 32 ? 27.624  2.149   39.933 1   31.18 ? 47  THR   B N   1 
ATOM   1025 C CA  . THR   B 1 32 ? 26.909  2.27    38.652 1   29.92 ? 47  THR   B CA  1 
ATOM   1026 C C   . THR   B 1 32 ? 26.187  0.99    38.365 1   28.65 ? 47  THR   B C   1 
ATOM   1027 O O   . THR   B 1 32 ? 26.773  -0.084  38.46  1   28.79 ? 47  THR   B O   1 
ATOM   1028 C CB  . THR   B 1 32 ? 27.9    2.596   37.52  1   31.15 ? 47  THR   B CB  1 
ATOM   1029 O OG1 . THR   B 1 32 ? 28.564  3.798   37.87  1   32.46 ? 47  THR   B OG1 1 
ATOM   1030 C CG2 . THR   B 1 32 ? 27.21   2.836   36.193 1   31.92 ? 47  THR   B CG2 1 
ATOM   1031 N N   . TYR   B 1 33 ? 24.892  1.081   38.07  1   27.37 ? 48  TYR   B N   1 
ATOM   1032 C CA  . TYR   B 1 33 ? 24.081  -0.11   37.825 1   26.7  ? 48  TYR   B CA  1 
ATOM   1033 C C   . TYR   B 1 33 ? 23.272  0.041   36.55  1   25.19 ? 48  TYR   B C   1 
ATOM   1034 O O   . TYR   B 1 33 ? 23.103  1.155   36.081 1   25.79 ? 48  TYR   B O   1 
ATOM   1035 C CB  . TYR   B 1 33 ? 23.04   -0.245  38.97  1   26.87 ? 48  TYR   B CB  1 
ATOM   1036 C CG  . TYR   B 1 33 ? 23.659  -0.496  40.318 1   28.17 ? 48  TYR   B CG  1 
ATOM   1037 C CD1 . TYR   B 1 33 ? 24.148  0.547   41.082 1   29.42 ? 48  TYR   B CD1 1 
ATOM   1038 C CD2 . TYR   B 1 33 ? 23.775  -1.783  40.822 1   30.17 ? 48  TYR   B CD2 1 
ATOM   1039 C CE1 . TYR   B 1 33 ? 24.756  0.319   42.307 1   30.49 ? 48  TYR   B CE1 1 
ATOM   1040 C CE2 . TYR   B 1 33 ? 24.357  -2.022  42.06  1   31.27 ? 48  TYR   B CE2 1 
ATOM   1041 C CZ  . TYR   B 1 33 ? 24.837  -0.966  42.801 1   31.76 ? 48  TYR   B CZ  1 
ATOM   1042 O OH  . TYR   B 1 33 ? 25.466  -1.194  43.993 1   33.91 ? 48  TYR   B OH  1 
ATOM   1043 N N   . THR   B 1 34 ? 22.73   -1.051  36.023 1   24.02 ? 49  THR   B N   1 
ATOM   1044 C CA  . THR   B 1 34 ? 21.708  -0.95   34.994 1   23.95 ? 49  THR   B CA  1 
ATOM   1045 C C   . THR   B 1 34 ? 20.37   -0.845  35.778 1   23.58 ? 49  THR   B C   1 
ATOM   1046 O O   . THR   B 1 34 ? 20.299  -1.212  36.965 1   23.55 ? 49  THR   B O   1 
ATOM   1047 C CB  . THR   B 1 34 ? 21.666  -2.142  34.051 1   25.36 ? 49  THR   B CB  1 
ATOM   1048 O OG1 . THR   B 1 34 ? 21.367  -3.338  34.798 1   25.48 ? 49  THR   B OG1 1 
ATOM   1049 C CG2 . THR   B 1 34 ? 22.943  -2.272  33.203 1   26.8  ? 49  THR   B CG2 1 
ATOM   1050 N N   . MET   B 1 35 ? 19.308  -0.37   35.121 1   22.74 ? 50  MET   B N   1 
ATOM   1051 C CA  . MET   B 1 35 ? 17.985  -0.303  35.749 1   22.71 ? 50  MET   B CA  1 
ATOM   1052 C C   . MET   B 1 35 ? 17.517  -1.728  36.14  1   21.97 ? 50  MET   B C   1 
ATOM   1053 O O   . MET   B 1 35 ? 16.975  -1.901  37.23  1   22.19 ? 50  MET   B O   1 
ATOM   1054 C CB  . MET   B 1 35 ? 16.964  0.398   34.831 1   23.9  ? 50  MET   B CB  1 
ATOM   1055 C CG  . MET   B 1 35 ? 17.038  1.939   34.896 1   28.09 ? 50  MET   B CG  1 
ATOM   1056 S SD  . MET   B 1 35 ? 16.526  2.675   36.501 1   37    ? 50  MET   B SD  1 
ATOM   1057 C CE  . MET   B 1 35 ? 15.085  1.689   36.858 1   27.93 ? 50  MET   B CE  1 
ATOM   1058 N N   . LYS   B 1 36 ? 17.865  -2.761  35.314 1   20.83 ? 51  LYS   B N   1 
ATOM   1059 C CA  . LYS   B 1 36 ? 17.56   -4.16   35.653 1   21.38 ? 51  LYS   B CA  1 
ATOM   1060 C C   . LYS   B 1 36 ? 18.177  -4.54   37.008 1   21.19 ? 51  LYS   B C   1 
ATOM   1061 O O   . LYS   B 1 36 ? 17.509  -5.174  37.827 1   21.1  ? 51  LYS   B O   1 
ATOM   1062 C CB  . LYS   B 1 36 ? 18.072  -5.123  34.559 1   23.72 ? 51  LYS   B CB  1 
ATOM   1063 C CG  . LYS   B 1 36 ? 17.949  -6.592  34.917 1   31.12 ? 51  LYS   B CG  1 
ATOM   1064 C CD  . LYS   B 1 36 ? 18.487  -7.479  33.812 1   38.36 ? 51  LYS   B CD  1 
ATOM   1065 C CE  . LYS   B 1 36 ? 17.447  -7.707  32.755 1   44.69 ? 51  LYS   B CE  1 
ATOM   1066 N NZ  . LYS   B 1 36 ? 17.203  -9.166  32.53  1   47.84 ? 51  LYS   B NZ  1 
ATOM   1067 N N   . GLU   B 1 37 ? 19.459  -4.199  37.219 1   20.58 ? 52  GLU   B N   1 
ATOM   1068 C CA  . GLU   B 1 37 ? 20.132  -4.495  38.476 1   20.92 ? 52  GLU   B CA  1 
ATOM   1069 C C   . GLU   B 1 37 ? 19.476  -3.791  39.656 1   21.62 ? 52  GLU   B C   1 
ATOM   1070 O O   . GLU   B 1 37 ? 19.24   -4.412  40.683 1   22.49 ? 52  GLU   B O   1 
ATOM   1071 C CB  . GLU   B 1 37 ? 21.621  -4.117  38.376 1   22.57 ? 52  GLU   B CB  1 
ATOM   1072 C CG  . GLU   B 1 37 ? 22.424  -5.03   37.457 1   27.42 ? 52  GLU   B CG  1 
ATOM   1073 C CD  . GLU   B 1 37 ? 23.859  -4.568  37.316 1   33.67 ? 52  GLU   B CD  1 
ATOM   1074 O OE1 . GLU   B 1 37 ? 24.767  -5.424  37.238 1   38.29 ? 52  GLU   B OE1 1 
ATOM   1075 O OE2 . GLU   B 1 37 ? 24.077  -3.339  37.304 1   31.58 ? 52  GLU   B OE2 1 
ATOM   1076 N N   . VAL   B 1 38 ? 19.131  -2.503  39.527 1   21.95 ? 53  VAL   B N   1 
ATOM   1077 C CA  . VAL   B 1 38 ? 18.436  -1.779  40.597 1   22.12 ? 53  VAL   B CA  1 
ATOM   1078 C C   . VAL   B 1 38 ? 17.116  -2.49   40.972 1   22.68 ? 53  VAL   B C   1 
ATOM   1079 O O   . VAL   B 1 38 ? 16.859  -2.753  42.15  1   23.08 ? 53  VAL   B O   1 
ATOM   1080 C CB  . VAL   B 1 38 ? 18.194  -0.307  40.199 1   22.92 ? 53  VAL   B CB  1 
ATOM   1081 C CG1 . VAL   B 1 38 ? 17.38   0.419   41.279 1   23.81 ? 53  VAL   B CG1 1 
ATOM   1082 C CG2 . VAL   B 1 38 ? 19.515  0.405   39.915 1   23.29 ? 53  VAL   B CG2 1 
ATOM   1083 N N   . LEU   B 1 39 ? 16.322  -2.859  39.968 1   22.1  ? 54  LEU   B N   1 
ATOM   1084 C CA  . LEU   B 1 39 ? 15.065  -3.55   40.197 1   22.53 ? 54  LEU   B CA  1 
ATOM   1085 C C   . LEU   B 1 39 ? 15.309  -4.912  40.845 1   22.24 ? 54  LEU   B C   1 
ATOM   1086 O O   . LEU   B 1 39 ? 14.563  -5.292  41.741 1   22.13 ? 54  LEU   B O   1 
ATOM   1087 C CB  . LEU   B 1 39 ? 14.294  -3.733  38.883 1   22.92 ? 54  LEU   B CB  1 
ATOM   1088 C CG  . LEU   B 1 39 ? 13.646  -2.487  38.285 1   24.34 ? 54  LEU   B CG  1 
ATOM   1089 C CD1 . LEU   B 1 39 ? 13.049  -2.824  36.882 1   24.33 ? 54  LEU   B CD1 1 
ATOM   1090 C CD2 . LEU   B 1 39 ? 12.558  -1.941  39.205 1   24.94 ? 54  LEU   B CD2 1 
ATOM   1091 N N   . PHE   B 1 40 ? 16.375  -5.617  40.432 1   22.08 ? 55  PHE   B N   1 
ATOM   1092 C CA  . PHE   B 1 40 ? 16.718  -6.925  40.993 1   22.59 ? 55  PHE   B CA  1 
ATOM   1093 C C   . PHE   B 1 40 ? 17.069  -6.807  42.493 1   23.22 ? 55  PHE   B C   1 
ATOM   1094 O O   . PHE   B 1 40 ? 16.516  -7.547  43.318 1   23.02 ? 55  PHE   B O   1 
ATOM   1095 C CB  . PHE   B 1 40 ? 17.882  -7.58   40.21  1   22.04 ? 55  PHE   B CB  1 
ATOM   1096 C CG  . PHE   B 1 40 ? 18.202  -9.006  40.628 1   22.57 ? 55  PHE   B CG  1 
ATOM   1097 C CD1 . PHE   B 1 40 ? 17.527  -10.078 40.069 1   23.79 ? 55  PHE   B CD1 1 
ATOM   1098 C CD2 . PHE   B 1 40 ? 19.189  -9.268  41.565 1   22.92 ? 55  PHE   B CD2 1 
ATOM   1099 C CE1 . PHE   B 1 40 ? 17.82   -11.394 40.455 1   24.55 ? 55  PHE   B CE1 1 
ATOM   1100 C CE2 . PHE   B 1 40 ? 19.483  -10.582 41.947 1   24.16 ? 55  PHE   B CE2 1 
ATOM   1101 C CZ  . PHE   B 1 40 ? 18.792  -11.636 41.392 1   23.85 ? 55  PHE   B CZ  1 
ATOM   1102 N N   . TYR   B 1 41 ? 17.977  -5.891  42.833 1   23.71 ? 56  TYR   B N   1 
ATOM   1103 C CA  . TYR   B 1 41 ? 18.415  -5.727  44.215 1   25.24 ? 56  TYR   B CA  1 
ATOM   1104 C C   . TYR   B 1 41 ? 17.338  -5.119  45.102 1   24.8  ? 56  TYR   B C   1 
ATOM   1105 O O   . TYR   B 1 41 ? 17.247  -5.473  46.265 1   24.57 ? 56  TYR   B O   1 
ATOM   1106 C CB  . TYR   B 1 41 ? 19.739  -4.954  44.312 1   26.72 ? 56  TYR   B CB  1 
ATOM   1107 C CG  . TYR   B 1 41 ? 20.907  -5.703  43.717 1   29.03 ? 56  TYR   B CG  1 
ATOM   1108 C CD1 . TYR   B 1 41 ? 21.237  -6.977  44.155 1   30.72 ? 56  TYR   B CD1 1 
ATOM   1109 C CD2 . TYR   B 1 41 ? 21.649  -5.16   42.678 1   30.7  ? 56  TYR   B CD2 1 
ATOM   1110 C CE1 . TYR   B 1 41 ? 22.301  -7.676  43.602 1   32.16 ? 56  TYR   B CE1 1 
ATOM   1111 C CE2 . TYR   B 1 41 ? 22.691  -5.866  42.089 1   32.16 ? 56  TYR   B CE2 1 
ATOM   1112 C CZ  . TYR   B 1 41 ? 23.018  -7.122  42.559 1   33.62 ? 56  TYR   B CZ  1 
ATOM   1113 O OH  . TYR   B 1 41 ? 24.056  -7.815  41.994 1   36.35 ? 56  TYR   B OH  1 
ATOM   1114 N N   . LEU   B 1 42 ? 16.511  -4.239  44.555 1   25.02 ? 57  LEU   B N   1 
ATOM   1115 C CA  . LEU   B 1 42 ? 15.395  -3.639  45.285 1   25.66 ? 57  LEU   B CA  1 
ATOM   1116 C C   . LEU   B 1 42 ? 14.364  -4.728  45.667 1   25.45 ? 57  LEU   B C   1 
ATOM   1117 O O   . LEU   B 1 42 ? 13.873  -4.749  46.803 1   25.55 ? 57  LEU   B O   1 
ATOM   1118 C CB  . LEU   B 1 42 ? 14.759  -2.506  44.466 1   26.04 ? 57  LEU   B CB  1 
ATOM   1119 C CG  . LEU   B 1 42 ? 13.58   -1.765  45.112 1   28.74 ? 57  LEU   B CG  1 
ATOM   1120 C CD1 . LEU   B 1 42 ? 13.944  -1.226  46.509 1   29.06 ? 57  LEU   B CD1 1 
ATOM   1121 C CD2 . LEU   B 1 42 ? 13.102  -0.634  44.214 1   29.57 ? 57  LEU   B CD2 1 
ATOM   1122 N N   . GLY   B 1 43 ? 14.146  -5.69   44.772 1   24.17 ? 58  GLY   B N   1 
ATOM   1123 C CA  . GLY   B 1 43 ? 13.275  -6.83   45.041 1   24.06 ? 58  GLY   B CA  1 
ATOM   1124 C C   . GLY   B 1 43 ? 13.843  -7.725  46.137 1   24.04 ? 58  GLY   B C   1 
ATOM   1125 O O   . GLY   B 1 43 ? 13.11   -8.165  47.023 1   23.57 ? 58  GLY   B O   1 
ATOM   1126 N N   . GLN   B 1 44 ? 15.163  -7.951  46.117 1   23.98 ? 59  GLN   B N   1 
ATOM   1127 C CA  . GLN   B 1 44 ? 15.86   -8.712  47.157 1   23.63 ? 59  GLN   B CA  1 
ATOM   1128 C C   . GLN   B 1 44 ? 15.733  -7.978  48.487 1   23.82 ? 59  GLN   B C   1 
ATOM   1129 O O   . GLN   B 1 44 ? 15.475  -8.609  49.504 1   23.86 ? 59  GLN   B O   1 
ATOM   1130 C CB  . GLN   B 1 44 ? 17.354  -8.881  46.818 1   25.19 ? 59  GLN   B CB  1 
ATOM   1131 C CG  . GLN   B 1 44 ? 17.609  -9.867  45.69  1   28.47 ? 59  GLN   B CG  1 
ATOM   1132 C CD  . GLN   B 1 44 ? 19.059  -10.308 45.68  1   31.65 ? 59  GLN   B CD  1 
ATOM   1133 O OE1 . GLN   B 1 44 ? 19.969  -9.541  45.997 1   32.8  ? 59  GLN   B OE1 1 
ATOM   1134 N NE2 . GLN   B 1 44 ? 19.294  -11.551 45.318 1   31.34 ? 59  GLN   B NE2 1 
ATOM   1135 N N   . TYR   B 1 45 ? 15.881  -6.655  48.479 1   23.48 ? 60  TYR   B N   1 
ATOM   1136 C CA  . TYR   B 1 45 ? 15.768  -5.859  49.69  1   23.75 ? 60  TYR   B CA  1 
ATOM   1137 C C   . TYR   B 1 45 ? 14.381  -6.001  50.327 1   23.77 ? 60  TYR   B C   1 
ATOM   1138 O O   . TYR   B 1 45 ? 14.284  -6.292  51.521 1   24.74 ? 60  TYR   B O   1 
ATOM   1139 C CB  . TYR   B 1 45 ? 16.099  -4.392  49.399 1   24.22 ? 60  TYR   B CB  1 
ATOM   1140 C CG  . TYR   B 1 45 ? 16.032  -3.505  50.625 1   25.41 ? 60  TYR   B CG  1 
ATOM   1141 C CD1 . TYR   B 1 45 ? 17.138  -3.336  51.446 1   26.1  ? 60  TYR   B CD1 1 
ATOM   1142 C CD2 . TYR   B 1 45 ? 14.887  -2.772  50.917 1   26.8  ? 60  TYR   B CD2 1 
ATOM   1143 C CE1 . TYR   B 1 45 ? 17.092  -2.502  52.555 1   27.03 ? 60  TYR   B CE1 1 
ATOM   1144 C CE2 . TYR   B 1 45 ? 14.826  -1.943  52.027 1   27.59 ? 60  TYR   B CE2 1 
ATOM   1145 C CZ  . TYR   B 1 45 ? 15.939  -1.793  52.833 1   28.56 ? 60  TYR   B CZ  1 
ATOM   1146 O OH  . TYR   B 1 45 ? 15.874  -0.957  53.929 1   29.56 ? 60  TYR   B OH  1 
ATOM   1147 N N   . ILE   B 1 46 ? 13.313  -5.806  49.546 1   22.48 ? 61  ILE   B N   1 
ATOM   1148 C CA  . ILE   B 1 46 ? 11.953  -5.905  50.063 1   23.18 ? 61  ILE   B CA  1 
ATOM   1149 C C   . ILE   B 1 46 ? 11.668  -7.321  50.572 1   24.78 ? 61  ILE   B C   1 
ATOM   1150 O O   . ILE   B 1 46 ? 10.978  -7.485  51.57  1   25.04 ? 61  ILE   B O   1 
ATOM   1151 C CB  . ILE   B 1 46 ? 10.931  -5.434  48.999 1   22.48 ? 61  ILE   B CB  1 
ATOM   1152 C CG1 . ILE   B 1 46 ? 11.136  -3.948  48.689 1   22.47 ? 61  ILE   B CG1 1 
ATOM   1153 C CG2 . ILE   B 1 46 ? 9.494   -5.685  49.465 1   22.87 ? 61  ILE   B CG2 1 
ATOM   1154 C CD1 . ILE   B 1 46 ? 10.579  -3.557  47.338 1   24.03 ? 61  ILE   B CD1 1 
ATOM   1155 N N   . MET   B 1 47 ? 12.195  -8.333  49.889 1   25.62 ? 62  MET   B N   1 
ATOM   1156 C CA  . MET   B 1 47 ? 12.049  -9.721  50.33  1   27.95 ? 62  MET   B CA  1 
ATOM   1157 C C   . MET   B 1 47 ? 12.778  -10.005 51.644 1   28.94 ? 62  MET   B C   1 
ATOM   1158 O O   . MET   B 1 47 ? 12.193  -10.601 52.564 1   29.32 ? 62  MET   B O   1 
ATOM   1159 C CB  . MET   B 1 47 ? 12.552  -10.687 49.247 1   29.91 ? 62  MET   B CB  1 
ATOM   1160 C CG  . MET   B 1 47 ? 11.473  -11.139 48.308 1   34.81 ? 62  MET   B CG  1 
ATOM   1161 S SD  . MET   B 1 47 ? 10.308  -12.193 49.205 1   40.76 ? 62  MET   B SD  1 
ATOM   1162 C CE  . MET   B 1 47 ? 11.123  -13.764 49.082 1   42.23 ? 62  MET   B CE  1 
ATOM   1163 N N   . THR   B 1 48 ? 14.023  -9.541  51.751 1   29.16 ? 63  THR   B N   1 
ATOM   1164 C CA  . THR   B 1 48 ? 14.869  -9.749  52.918 1   30.5  ? 63  THR   B CA  1 
ATOM   1165 C C   . THR   B 1 48 ? 14.289  -9.051  54.129 1   29.23 ? 63  THR   B C   1 
ATOM   1166 O O   . THR   B 1 48 ? 14.246  -9.627  55.219 1   29.66 ? 63  THR   B O   1 
ATOM   1167 C CB  . THR   B 1 48 ? 16.298  -9.266  52.619 1   33.63 ? 63  THR   B CB  1 
ATOM   1168 O OG1 . THR   B 1 48 ? 16.8    -10.078 51.572 1   36.22 ? 63  THR   B OG1 1 
ATOM   1169 C CG2 . THR   B 1 48 ? 17.201  -9.376  53.829 1   35.23 ? 63  THR   B CG2 1 
ATOM   1170 N N   . LYS   B 1 49 ? 13.852  -7.812  53.947 1   27.86 ? 64  LYS   B N   1 
ATOM   1171 C CA  . LYS   B 1 49 ? 13.238  -7.071  55.041 1   27.79 ? 64  LYS   B CA  1 
ATOM   1172 C C   . LYS   B 1 49 ? 11.78   -7.481  55.297 1   27.15 ? 64  LYS   B C   1 
ATOM   1173 O O   . LYS   B 1 49 ? 11.213  -7.071  56.314 1   27.37 ? 64  LYS   B O   1 
ATOM   1174 C CB  . LYS   B 1 49 ? 13.389  -5.571  54.83  1   29.81 ? 64  LYS   B CB  1 
ATOM   1175 C CG  . LYS   B 1 49 ? 14.878  -5.228  54.698 1   35.22 ? 64  LYS   B CG  1 
ATOM   1176 C CD  . LYS   B 1 49 ? 15.23   -3.925  55.304 1   39.8  ? 64  LYS   B CD  1 
ATOM   1177 C CE  . LYS   B 1 49 ? 15.307  -3.872  56.797 1   43.25 ? 64  LYS   B CE  1 
ATOM   1178 N NZ  . LYS   B 1 49 ? 15.703  -2.49   57.212 1   45.47 ? 64  LYS   B NZ  1 
ATOM   1179 N N   . ARG   B 1 50 ? 11.16   -8.227  54.353 1   25.9  ? 65  ARG   B N   1 
ATOM   1180 C CA  . ARG   B 1 50 ? 9.795   -8.73   54.446 1   25.38 ? 65  ARG   B CA  1 
ATOM   1181 C C   . ARG   B 1 50 ? 8.838   -7.546  54.649 1   25.32 ? 65  ARG   B C   1 
ATOM   1182 O O   . ARG   B 1 50 ? 7.978   -7.545  55.536 1   25.07 ? 65  ARG   B O   1 
ATOM   1183 C CB  . ARG   B 1 50 ? 9.733   -9.791  55.576 1   25.84 ? 65  ARG   B CB  1 
ATOM   1184 C CG  . ARG   B 1 50 ? 8.481   -10.66  55.58  1   26.66 ? 65  ARG   B CG  1 
ATOM   1185 C CD  . ARG   B 1 50 ? 8.811   -12.119 55.626 1   28.09 ? 65  ARG   B CD  1 
ATOM   1186 N NE  . ARG   B 1 50 ? 7.594   -12.925 55.689 1   28.96 ? 65  ARG   B NE  1 
ATOM   1187 C CZ  . ARG   B 1 50 ? 7.571   -14.25  55.657 1   28.03 ? 65  ARG   B CZ  1 
ATOM   1188 N NH1 . ARG   B 1 50 ? 8.695   -14.936 55.517 1   26.12 ? 65  ARG   B NH1 1 
ATOM   1189 N NH2 . ARG   B 1 50 ? 6.422   -14.9   55.763 1   26.88 ? 65  ARG   B NH2 1 
ATOM   1190 N N   . LEU   B 1 51 ? 9.029   -6.499  53.835 1   24.5  ? 66  LEU   B N   1 
ATOM   1191 C CA  . LEU   B 1 51 ? 8.239   -5.286  53.956 1   24.99 ? 66  LEU   B CA  1 
ATOM   1192 C C   . LEU   B 1 51 ? 6.811   -5.386  53.377 1   25.84 ? 66  LEU   B C   1 
ATOM   1193 O O   . LEU   B 1 51 ? 5.972   -4.523  53.644 1   25.68 ? 66  LEU   B O   1 
ATOM   1194 C CB  . LEU   B 1 51 ? 9.008   -4.105  53.334 1   25.23 ? 66  LEU   B CB  1 
ATOM   1195 C CG  . LEU   B 1 51 ? 10.404  -3.826  53.946 1   26.15 ? 66  LEU   B CG  1 
ATOM   1196 C CD1 . LEU   B 1 51 ? 11.078  -2.638  53.253 1   26.91 ? 66  LEU   B CD1 1 
ATOM   1197 C CD2 . LEU   B 1 51 ? 10.289  -3.529  55.45  1   26.45 ? 66  LEU   B CD2 1 
ATOM   1198 N N   . TYR   B 1 52 ? 6.528   -6.442  52.625 1   26.35 ? 67  TYR   B N   1 
ATOM   1199 C CA  . TYR   B 1 52 ? 5.218   -6.623  52.003 1   26.85 ? 67  TYR   B CA  1 
ATOM   1200 C C   . TYR   B 1 52 ? 4.139   -7.077  52.992 1   27.49 ? 67  TYR   B C   1 
ATOM   1201 O O   . TYR   B 1 52 ? 4.44    -7.736  53.983 1   28.44 ? 67  TYR   B O   1 
ATOM   1202 C CB  . TYR   B 1 52 ? 5.317   -7.633  50.834 1   26.52 ? 67  TYR   B CB  1 
ATOM   1203 C CG  . TYR   B 1 52 ? 5.988   -8.932  51.212 1   26.75 ? 67  TYR   B CG  1 
ATOM   1204 C CD1 . TYR   B 1 52 ? 7.364   -9.083  51.108 1   27.46 ? 67  TYR   B CD1 1 
ATOM   1205 C CD2 . TYR   B 1 52 ? 5.247   -10.011 51.671 1   27.33 ? 67  TYR   B CD2 1 
ATOM   1206 C CE1 . TYR   B 1 52 ? 7.991   -10.267 51.475 1   28.54 ? 67  TYR   B CE1 1 
ATOM   1207 C CE2 . TYR   B 1 52 ? 5.863   -11.194 52.061 1   28.53 ? 67  TYR   B CE2 1 
ATOM   1208 C CZ  . TYR   B 1 52 ? 7.236   -11.324 51.948 1   29.75 ? 67  TYR   B CZ  1 
ATOM   1209 O OH  . TYR   B 1 52 ? 7.842   -12.5   52.295 1   31.41 ? 67  TYR   B OH  1 
ATOM   1210 N N   . ASP   B 1 53 ? 2.882   -6.777  52.695 1   27.27 ? 68  ASP   B N   1 
ATOM   1211 C CA  . ASP   B 1 53 ? 1.764   -7.253  53.502 1   26.84 ? 68  ASP   B CA  1 
ATOM   1212 C C   . ASP   B 1 53 ? 1.664   -8.771  53.331 1   26.46 ? 68  ASP   B C   1 
ATOM   1213 O O   . ASP   B 1 53 ? 1.723   -9.259  52.2   1   25.79 ? 68  ASP   B O   1 
ATOM   1214 C CB  . ASP   B 1 53 ? 0.467   -6.601  53.046 1   29.07 ? 68  ASP   B CB  1 
ATOM   1215 C CG  . ASP   B 1 53 ? -0.673  -6.965  53.964 1   35.48 ? 68  ASP   B CG  1 
ATOM   1216 O OD1 . ASP   B 1 53 ? -0.812  -6.32   55.018 1   38.24 ? 68  ASP   B OD1 1 
ATOM   1217 O OD2 . ASP   B 1 53 ? -1.382  -7.928  53.666 1   37.5  ? 68  ASP   B OD2 1 
ATOM   1218 N N   . GLU   B 1 54 ? 1.531   -9.522  54.434 1   26.25 ? 69  GLU   B N   1 
ATOM   1219 C CA  . GLU   B 1 54 ? 1.495   -10.982 54.345 1   27.09 ? 69  GLU   B CA  1 
ATOM   1220 C C   . GLU   B 1 54 ? 0.314   -11.5   53.514 1   28.37 ? 69  GLU   B C   1 
ATOM   1221 O O   . GLU   B 1 54 ? 0.453   -12.488 52.803 1   28.34 ? 69  GLU   B O   1 
ATOM   1222 C CB  . GLU   B 1 54 ? 1.485   -11.623 55.743 1   27.73 ? 69  GLU   B CB  1 
ATOM   1223 C CG  . GLU   B 1 54 ? 2.787   -11.457 56.507 1   27.53 ? 69  GLU   B CG  1 
ATOM   1224 C CD  . GLU   B 1 54 ? 3.995   -12.146 55.904 1   30.47 ? 69  GLU   B CD  1 
ATOM   1225 O OE1 . GLU   B 1 54 ? 3.87    -13.322 55.486 1   29.72 ? 69  GLU   B OE1 1 
ATOM   1226 O OE2 . GLU   B 1 54 ? 5.078   -11.518 55.883 1   31.02 ? 69  GLU   B OE2 1 
ATOM   1227 N N   . LYS   B 1 55 ? -0.833  -10.829 53.605 1   28.77 ? 70  LYS   B N   1 
ATOM   1228 C CA  . LYS   B 1 55 ? -2.03   -11.252 52.899 1   29.94 ? 70  LYS   B CA  1 
ATOM   1229 C C   . LYS   B 1 55 ? -2.185  -10.667 51.495 1   30.08 ? 70  LYS   B C   1 
ATOM   1230 O O   . LYS   B 1 55 ? -2.799  -11.313 50.651 1   31.18 ? 70  LYS   B O   1 
ATOM   1231 C CB  . LYS   B 1 55 ? -3.277  -10.934 53.74  1   32.61 ? 70  LYS   B CB  1 
ATOM   1232 C CG  . LYS   B 1 55 ? -3.305  -11.656 55.073 1   37.78 ? 70  LYS   B CG  1 
ATOM   1233 C CD  . LYS   B 1 55 ? -3.315  -13.182 54.906 1   43.62 ? 70  LYS   B CD  1 
ATOM   1234 C CE  . LYS   B 1 55 ? -4.578  -13.666 54.237 1   48.96 ? 70  LYS   B CE  1 
ATOM   1235 N NZ  . LYS   B 1 55 ? -4.465  -15.088 53.831 1   52.07 ? 70  LYS   B NZ  1 
ATOM   1236 N N   . GLN   B 1 56 ? -1.734  -9.43   51.274 1   28.62 ? 71  GLN   B N   1 
ATOM   1237 C CA  . GLN   B 1 56 ? -1.822  -8.747  49.97  1   28.54 ? 71  GLN   B CA  1 
ATOM   1238 C C   . GLN   B 1 56 ? -0.398  -8.332  49.644 1   27.11 ? 71  GLN   B C   1 
ATOM   1239 O O   . GLN   B 1 56 ? 0.003   -7.209  49.921 1   27.15 ? 71  GLN   B O   1 
ATOM   1240 C CB  . GLN   B 1 56 ? -2.72   -7.503  50.069 1   30.88 ? 71  GLN   B CB  1 
ATOM   1241 C CG  . GLN   B 1 56 ? -4.163  -7.845  50.424 1   37.84 ? 71  GLN   B CG  1 
ATOM   1242 C CD  . GLN   B 1 56 ? -4.968  -6.593  50.608 1   45.98 ? 71  GLN   B CD  1 
ATOM   1243 O OE1 . GLN   B 1 56 ? -5.112  -6.078  51.727 1   48.96 ? 71  GLN   B OE1 1 
ATOM   1244 N NE2 . GLN   B 1 56 ? -5.489  -6.063  49.511 1   47.04 ? 71  GLN   B NE2 1 
ATOM   1245 N N   . GLN   B 1 57 ? 0.376   -9.254  49.115 1   25.8  ? 72  GLN   B N   1 
ATOM   1246 C CA  . GLN   B 1 57 ? 1.816   -9.097  48.939 1   25.41 ? 72  GLN   B CA  1 
ATOM   1247 C C   . GLN   B 1 57 ? 2.272   -8.068  47.873 1   26.16 ? 72  GLN   B C   1 
ATOM   1248 O O   . GLN   B 1 57 ? 3.474   -7.852  47.722 1   26.58 ? 72  GLN   B O   1 
ATOM   1249 C CB  . GLN   B 1 57 ? 2.453   -10.457 48.708 1   25.81 ? 72  GLN   B CB  1 
ATOM   1250 C CG  . GLN   B 1 57 ? 2.09    -11.447 49.838 1   27.76 ? 72  GLN   B CG  1 
ATOM   1251 C CD  . GLN   B 1 57 ? 3.18    -12.424 50.161 1   29.72 ? 72  GLN   B CD  1 
ATOM   1252 O OE1 . GLN   B 1 57 ? 4.185   -12.561 49.436 1   29.77 ? 72  GLN   B OE1 1 
ATOM   1253 N NE2 . GLN   B 1 57 ? 2.998   -13.144 51.263 1   28.89 ? 72  GLN   B NE2 1 
ATOM   1254 N N   . HIS   B 1 58 ? 1.335   -7.37   47.228 1   26.18 ? 73  HIS   B N   1 
ATOM   1255 C CA  . HIS   B 1 58 ? 1.688   -6.248  46.357 1   26.02 ? 73  HIS   B CA  1 
ATOM   1256 C C   . HIS   B 1 58 ? 1.807   -4.95   47.202 1   26.94 ? 73  HIS   B C   1 
ATOM   1257 O O   . HIS   B 1 58 ? 2.344   -3.968  46.707 1   27.09 ? 73  HIS   B O   1 
ATOM   1258 C CB  . HIS   B 1 58 ? 0.648   -6.049  45.238 1   25.81 ? 73  HIS   B CB  1 
ATOM   1259 C CG  . HIS   B 1 58 ? -0.705  -5.646  45.731 1   26.86 ? 73  HIS   B CG  1 
ATOM   1260 N ND1 . HIS   B 1 58 ? -1.094  -4.32   45.76  1   28.99 ? 73  HIS   B ND1 1 
ATOM   1261 C CD2 . HIS   B 1 58 ? -1.729  -6.409  46.171 1   27.69 ? 73  HIS   B CD2 1 
ATOM   1262 C CE1 . HIS   B 1 58 ? -2.338  -4.317  46.207 1   29.24 ? 73  HIS   B CE1 1 
ATOM   1263 N NE2 . HIS   B 1 58 ? -2.754  -5.546  46.493 1   28.61 ? 73  HIS   B NE2 1 
ATOM   1264 N N   . ILE   B 1 59 ? 1.277   -4.922  48.449 1   26.62 ? 74  ILE   B N   1 
ATOM   1265 C CA  . ILE   B 1 59 ? 1.372   -3.727  49.279 1   27.28 ? 74  ILE   B CA  1 
ATOM   1266 C C   . ILE   B 1 59 ? 2.663   -3.791  50.052 1   27.38 ? 74  ILE   B C   1 
ATOM   1267 O O   . ILE   B 1 59 ? 2.906   -4.79   50.721 1   27.94 ? 74  ILE   B O   1 
ATOM   1268 C CB  . ILE   B 1 59 ? 0.174   -3.597  50.261 1   28.56 ? 74  ILE   B CB  1 
ATOM   1269 C CG1 . ILE   B 1 59 ? -1.164  -3.597  49.501 1   30.3  ? 74  ILE   B CG1 1 
ATOM   1270 C CG2 . ILE   B 1 59 ? 0.334   -2.326  51.11  1   29.06 ? 74  ILE   B CG2 1 
ATOM   1271 C CD1 . ILE   B 1 59 ? -2.366  -3.671  50.401 1   32.63 ? 74  ILE   B CD1 1 
ATOM   1272 N N   . VAL   B 1 60 ? 3.481   -2.748  49.98  1   26.07 ? 75  VAL   B N   1 
ATOM   1273 C CA  . VAL   B 1 60 ? 4.736   -2.71   50.697 1   26.76 ? 75  VAL   B CA  1 
ATOM   1274 C C   . VAL   B 1 60 ? 4.671   -1.604  51.732 1   27.59 ? 75  VAL   B C   1 
ATOM   1275 O O   . VAL   B 1 60 ? 4.4     -0.471  51.371 1   26.74 ? 75  VAL   B O   1 
ATOM   1276 C CB  . VAL   B 1 60 ? 5.924   -2.506  49.731 1   27.5  ? 75  VAL   B CB  1 
ATOM   1277 C CG1 . VAL   B 1 60 ? 7.242   -2.349  50.51  1   27.75 ? 75  VAL   B CG1 1 
ATOM   1278 C CG2 . VAL   B 1 60 ? 6.009   -3.663  48.72  1   27.69 ? 75  VAL   B CG2 1 
ATOM   1279 N N   . TYR   B 1 61 ? 4.914   -1.924  53.016 1   29.07 ? 76  TYR   B N   1 
ATOM   1280 C CA  . TYR   B 1 61 ? 4.949   -0.93   54.082 1   30.97 ? 76  TYR   B CA  1 
ATOM   1281 C C   . TYR   B 1 61 ? 6.388   -0.515  54.291 1   31.94 ? 76  TYR   B C   1 
ATOM   1282 O O   . TYR   B 1 61 ? 7.248   -1.364  54.529 1   32.16 ? 76  TYR   B O   1 
ATOM   1283 C CB  . TYR   B 1 61 ? 4.435   -1.51   55.395 1   32.05 ? 76  TYR   B CB  1 
ATOM   1284 C CG  . TYR   B 1 61 ? 3.065   -2.113  55.271 1   33.95 ? 76  TYR   B CG  1 
ATOM   1285 C CD1 . TYR   B 1 61 ? 1.953   -1.317  55.059 1   35.28 ? 76  TYR   B CD1 1 
ATOM   1286 C CD2 . TYR   B 1 61 ? 2.889   -3.484  55.288 1   35.89 ? 76  TYR   B CD2 1 
ATOM   1287 C CE1 . TYR   B 1 61 ? 0.692   -1.871  54.908 1   37    ? 76  TYR   B CE1 1 
ATOM   1288 C CE2 . TYR   B 1 61 ? 1.629   -4.046  55.184 1   37.23 ? 76  TYR   B CE2 1 
ATOM   1289 C CZ  . TYR   B 1 61 ? 0.536   -3.239  54.961 1   38.23 ? 76  TYR   B CZ  1 
ATOM   1290 O OH  . TYR   B 1 61 ? -0.711  -3.798  54.844 1   41.13 ? 76  TYR   B OH  1 
ATOM   1291 N N   . CYS   B 1 62 ? 6.66    0.778   54.174 1   32.25 ? 77  CYS   B N   1 
ATOM   1292 C CA  . CYS   B 1 62 ? 8.034   1.267   54.296 1   33.84 ? 77  CYS   B CA  1 
ATOM   1293 C C   . CYS   B 1 62 ? 8.21    2.365   55.319 1   35.24 ? 77  CYS   B C   1 
ATOM   1294 O O   . CYS   B 1 62 ? 9.256   2.999   55.347 1   35.09 ? 77  CYS   B O   1 
ATOM   1295 C CB  . CYS   B 1 62 ? 8.58    1.68    52.937 1   34.64 ? 77  CYS   B CB  1 
ATOM   1296 S SG  . CYS   B 1 62 ? 7.397   2.582   51.908 1   36.68 ? 77  CYS   B SG  1 
ATOM   1297 N N   . SER   B 1 63 ? 7.229   2.557   56.212 1   36.81 ? 78  SER   B N   1 
ATOM   1298 C CA  . SER   B 1 63 ? 7.365   3.492   57.326 1   38.79 ? 78  SER   B CA  1 
ATOM   1299 C C   . SER   B 1 63 ? 8.431   2.903   58.269 1   39.92 ? 78  SER   B C   1 
ATOM   1300 O O   . SER   B 1 63 ? 8.533   1.681   58.38  1   40.55 ? 78  SER   B O   1 
ATOM   1301 C CB  . SER   B 1 63 ? 6.04    3.607   58.078 1   41.52 ? 78  SER   B CB  1 
ATOM   1302 O OG  . SER   B 1 63 ? 5.575   4.945   58.04  1   46.34 ? 78  SER   B OG  1 
ATOM   1303 N N   . ASN   B 1 64 ? 9.259   3.745   58.881 1   40.7  ? 79  ASN   B N   1 
ATOM   1304 C CA  . ASN   B 1 64 ? 10.323  3.257   59.772 1   41.71 ? 79  ASN   B CA  1 
ATOM   1305 C C   . ASN   B 1 64 ? 11.326  2.361   59.025 1   40.75 ? 79  ASN   B C   1 
ATOM   1306 O O   . ASN   B 1 64 ? 11.873  1.425   59.604 1   41.36 ? 79  ASN   B O   1 
ATOM   1307 C CB  . ASN   B 1 64 ? 9.736   2.549   61.007 1   44.92 ? 79  ASN   B CB  1 
ATOM   1308 C CG  . ASN   B 1 64 ? 8.624   3.338   61.674 1   51.02 ? 79  ASN   B CG  1 
ATOM   1309 O OD1 . ASN   B 1 64 ? 8.798   4.502   62.079 1   53.64 ? 79  ASN   B OD1 1 
ATOM   1310 N ND2 . ASN   B 1 64 ? 7.443   2.734   61.772 1   51.78 ? 79  ASN   B ND2 1 
ATOM   1311 N N   . ASP   B 1 65 ? 11.55   2.649   57.723 1   38.84 ? 80  ASP   B N   1 
ATOM   1312 C CA  . ASP   B 1 65 ? 12.508  1.945   56.876 1   37.11 ? 80  ASP   B CA  1 
ATOM   1313 C C   . ASP   B 1 65 ? 13.112  2.928   55.887 1   36.09 ? 80  ASP   B C   1 
ATOM   1314 O O   . ASP   B 1 65 ? 12.44   3.871   55.468 1   35.4  ? 80  ASP   B O   1 
ATOM   1315 C CB  . ASP   B 1 65 ? 11.872  0.76    56.12  1   36.66 ? 80  ASP   B CB  1 
ATOM   1316 C CG  . ASP   B 1 65 ? 12.904  -0.168  55.494 1   36.37 ? 80  ASP   B CG  1 
ATOM   1317 O OD1 . ASP   B 1 65 ? 13.341  0.107   54.355 1   36.19 ? 80  ASP   B OD1 1 
ATOM   1318 O OD2 . ASP   B 1 65 ? 13.281  -1.157  56.144 1   36.27 ? 80  ASP   B OD2 1 
ATOM   1319 N N   . LEU   B 1 66 ? 14.389  2.696   55.511 1   35.74 ? 81  LEU   B N   1 
ATOM   1320 C CA  . LEU   B 1 66 ? 15.182  3.458   54.546 1   36.13 ? 81  LEU   B CA  1 
ATOM   1321 C C   . LEU   B 1 66 ? 14.37   3.679   53.256 1   35.36 ? 81  LEU   B C   1 
ATOM   1322 O O   . LEU   B 1 66 ? 14.323  4.798   52.742 1   35.12 ? 81  LEU   B O   1 
ATOM   1323 C CB  . LEU   B 1 66 ? 16.437  2.609   54.205 1   37.19 ? 81  LEU   B CB  1 
ATOM   1324 C CG  . LEU   B 1 66 ? 17.817  3.26    53.949 1   39.21 ? 81  LEU   B CG  1 
ATOM   1325 C CD1 . LEU   B 1 66 ? 18.621  2.417   52.984 1   39.68 ? 81  LEU   B CD1 1 
ATOM   1326 C CD2 . LEU   B 1 66 ? 17.742  4.736   53.487 1   39.76 ? 81  LEU   B CD2 1 
ATOM   1327 N N   . LEU   B 1 67 ? 13.67   2.628   52.784 1   34.81 ? 82  LEU   B N   1 
ATOM   1328 C CA  . LEU   B 1 67 ? 12.842  2.681   51.572 1   34.45 ? 82  LEU   B CA  1 
ATOM   1329 C C   . LEU   B 1 67 ? 11.76   3.756   51.646 1   35.17 ? 82  LEU   B C   1 
ATOM   1330 O O   . LEU   B 1 67 ? 11.427  4.363   50.631 1   35.31 ? 82  LEU   B O   1 
ATOM   1331 C CB  . LEU   B 1 67 ? 12.225  1.298   51.299 1   33.82 ? 82  LEU   B CB  1 
ATOM   1332 C CG  . LEU   B 1 67 ? 11.498  1.074   49.976 1   33.65 ? 82  LEU   B CG  1 
ATOM   1333 C CD1 . LEU   B 1 67 ? 12.357  1.506   48.774 1   33.44 ? 82  LEU   B CD1 1 
ATOM   1334 C CD2 . LEU   B 1 67 ? 11.09   -0.375  49.847 1   33.59 ? 82  LEU   B CD2 1 
ATOM   1335 N N   . GLY   B 1 68 ? 11.236  4.003   52.843 1   35.22 ? 83  GLY   B N   1 
ATOM   1336 C CA  . GLY   B 1 68 ? 10.231  5.035   53.058 1   36.36 ? 83  GLY   B CA  1 
ATOM   1337 C C   . GLY   B 1 68 ? 10.791  6.434   52.889 1   37.44 ? 83  GLY   B C   1 
ATOM   1338 O O   . GLY   B 1 68 ? 10.071  7.338   52.476 1   38.07 ? 83  GLY   B O   1 
ATOM   1339 N N   . ASP   B 1 69 ? 12.071  6.628   53.206 1   38.21 ? 84  ASP   B N   1 
ATOM   1340 C CA  . ASP   B 1 69 ? 12.745  7.908   52.981 1   39.89 ? 84  ASP   B CA  1 
ATOM   1341 C C   . ASP   B 1 69 ? 12.965  8.126   51.472 1   41.23 ? 84  ASP   B C   1 
ATOM   1342 O O   . ASP   B 1 69 ? 12.83   9.253   51.005 1   41.37 ? 84  ASP   B O   1 
ATOM   1343 C CB  . ASP   B 1 69 ? 14.062  7.98    53.768 1   41.45 ? 84  ASP   B CB  1 
ATOM   1344 C CG  . ASP   B 1 69 ? 13.848  7.828   55.261 1   46.59 ? 84  ASP   B CG  1 
ATOM   1345 O OD1 . ASP   B 1 69 ? 12.756  8.193   55.745 1   47.65 ? 84  ASP   B OD1 1 
ATOM   1346 O OD2 . ASP   B 1 69 ? 14.762  7.334   55.943 1   49.28 ? 84  ASP   B OD2 1 
ATOM   1347 N N   . LEU   B 1 70 ? 13.228  7.031   50.704 1   41.8  ? 85  LEU   B N   1 
ATOM   1348 C CA  . LEU   B 1 70 ? 13.381  7.035   49.244 1   43.15 ? 85  LEU   B CA  1 
ATOM   1349 C C   . LEU   B 1 70 ? 12.04   7.386   48.563 1   44.18 ? 85  LEU   B C   1 
ATOM   1350 O O   . LEU   B 1 70 ? 12.012  8.194   47.635 1   44.52 ? 85  LEU   B O   1 
ATOM   1351 C CB  . LEU   B 1 70 ? 13.811  5.629   48.756 1   43.76 ? 85  LEU   B CB  1 
ATOM   1352 C CG  . LEU   B 1 70 ? 15.276  5.324   48.53  1   45.86 ? 85  LEU   B CG  1 
ATOM   1353 C CD1 . LEU   B 1 70 ? 15.998  5.135   49.831 1   46.45 ? 85  LEU   B CD1 1 
ATOM   1354 C CD2 . LEU   B 1 70 ? 15.42   4.01    47.783 1   46.86 ? 85  LEU   B CD2 1 
ATOM   1355 N N   . PHE   B 1 71 ? 10.937  6.749   48.987 1   44.31 ? 86  PHE   B N   1 
ATOM   1356 C CA  . PHE   B 1 71 ? 9.633   6.986   48.373 1   44.69 ? 86  PHE   B CA  1 
ATOM   1357 C C   . PHE   B 1 71 ? 8.991   8.29    48.828 1   45.06 ? 86  PHE   B C   1 
ATOM   1358 O O   . PHE   B 1 71 ? 8.231   8.902   48.077 1   45.71 ? 86  PHE   B O   1 
ATOM   1359 C CB  . PHE   B 1 71 ? 8.663   5.822   48.679 1   44.66 ? 86  PHE   B CB  1 
ATOM   1360 C CG  . PHE   B 1 71 ? 8.339   4.95    47.495 1   45.17 ? 86  PHE   B CG  1 
ATOM   1361 C CD1 . PHE   B 1 71 ? 7.428   5.366   46.534 1   45.72 ? 86  PHE   B CD1 1 
ATOM   1362 C CD2 . PHE   B 1 71 ? 8.985   3.738   47.308 1   45.72 ? 86  PHE   B CD2 1 
ATOM   1363 C CE1 . PHE   B 1 71 ? 7.126   4.562   45.444 1   46.11 ? 86  PHE   B CE1 1 
ATOM   1364 C CE2 . PHE   B 1 71 ? 8.712   2.958   46.191 1   46.2  ? 86  PHE   B CE2 1 
ATOM   1365 C CZ  . PHE   B 1 71 ? 7.773   3.369   45.275 1   45.97 ? 86  PHE   B CZ  1 
ATOM   1366 N N   . GLY   B 1 72 ? 9.258   8.677   50.068 1   44.21 ? 87  GLY   B N   1 
ATOM   1367 C CA  . GLY   B 1 72 ? 8.617   9.831   50.683 1   43.37 ? 87  GLY   B CA  1 
ATOM   1368 C C   . GLY   B 1 72 ? 7.177   9.51    51.049 1   42.36 ? 87  GLY   B C   1 
ATOM   1369 O O   . GLY   B 1 72 ? 6.35    10.41   51.174 1   42.39 ? 87  GLY   B O   1 
ATOM   1370 N N   . VAL   B 1 73 ? 6.872   8.216   51.254 1   41.44 ? 88  VAL   B N   1 
ATOM   1371 C CA  . VAL   B 1 73 ? 5.544   7.716   51.573 1   40.57 ? 88  VAL   B CA  1 
ATOM   1372 C C   . VAL   B 1 73 ? 5.638   6.525   52.549 1   38.67 ? 88  VAL   B C   1 
ATOM   1373 O O   . VAL   B 1 73 ? 6.666   5.853   52.609 1   38.8  ? 88  VAL   B O   1 
ATOM   1374 C CB  . VAL   B 1 73 ? 4.855   7.289   50.277 1   40.94 ? 88  VAL   B CB  1 
ATOM   1375 N N   . PRO   B 1 74 ? 4.576   6.234   53.316 1   37.59 ? 89  PRO   B N   1 
ATOM   1376 C CA  . PRO   B 1 74 ? 4.642   5.107   54.264 1   36.77 ? 89  PRO   B CA  1 
ATOM   1377 C C   . PRO   B 1 74 ? 4.349   3.732   53.643 1   35.13 ? 89  PRO   B C   1 
ATOM   1378 O O   . PRO   B 1 74 ? 4.484   2.716   54.309 1   34.55 ? 89  PRO   B O   1 
ATOM   1379 C CB  . PRO   B 1 74 ? 3.564   5.467   55.281 1   37.93 ? 89  PRO   B CB  1 
ATOM   1380 C CG  . PRO   B 1 74 ? 2.543   6.192   54.463 1   38.71 ? 89  PRO   B CG  1 
ATOM   1381 C CD  . PRO   B 1 74 ? 3.275   6.934   53.393 1   37.03 ? 89  PRO   B CD  1 
ATOM   1382 N N   . SER   B 1 75 ? 3.86    3.709   52.398 1   33.79 ? 90  SER   B N   1 
ATOM   1383 C CA  . SER   B 1 75 ? 3.545   2.462   51.715 1   32.33 ? 90  SER   B CA  1 
ATOM   1384 C C   . SER   B 1 75 ? 3.36    2.72    50.231 1   31.15 ? 90  SER   B C   1 
ATOM   1385 O O   . SER   B 1 75 ? 3.197   3.865   49.796 1   31.89 ? 90  SER   B O   1 
ATOM   1386 C CB  . SER   B 1 75 ? 2.281   1.806   52.287 1   33.65 ? 90  SER   B CB  1 
ATOM   1387 O OG  . SER   B 1 75 ? 1.134   2.584   51.994 1   36.1  ? 90  SER   B OG  1 
ATOM   1388 N N   . PHE   B 1 76 ? 3.427   1.659   49.452 1   29.4  ? 91  PHE   B N   1 
ATOM   1389 C CA  . PHE   B 1 76 ? 3.186   1.745   48.016 1   29.13 ? 91  PHE   B CA  1 
ATOM   1390 C C   . PHE   B 1 76 ? 2.686   0.387   47.51  1   27.65 ? 91  PHE   B C   1 
ATOM   1391 O O   . PHE   B 1 76 ? 2.78    -0.614  48.224 1   27.61 ? 91  PHE   B O   1 
ATOM   1392 C CB  . PHE   B 1 76 ? 4.448   2.227   47.272 1   29.01 ? 91  PHE   B CB  1 
ATOM   1393 C CG  . PHE   B 1 76 ? 5.617   1.272   47.31  1   30.35 ? 91  PHE   B CG  1 
ATOM   1394 C CD1 . PHE   B 1 76 ? 6.561   1.346   48.32  1   30.86 ? 91  PHE   B CD1 1 
ATOM   1395 C CD2 . PHE   B 1 76 ? 5.762   0.287   46.344 1   31.49 ? 91  PHE   B CD2 1 
ATOM   1396 C CE1 . PHE   B 1 76 ? 7.636   0.48    48.348 1   31.67 ? 91  PHE   B CE1 1 
ATOM   1397 C CE2 . PHE   B 1 76 ? 6.832   -0.592  46.385 1   31.9  ? 91  PHE   B CE2 1 
ATOM   1398 C CZ  . PHE   B 1 76 ? 7.775   -0.475  47.375 1   31.6  ? 91  PHE   B CZ  1 
ATOM   1399 N N   . SER   B 1 77 ? 2.14    0.352   46.29  1   26.7  ? 92  SER   B N   1 
ATOM   1400 C CA  . SER   B 1 77 ? 1.68    -0.886  45.702 1   25.96 ? 92  SER   B CA  1 
ATOM   1401 C C   . SER   B 1 77 ? 2.564   -1.222  44.526 1   25.75 ? 92  SER   B C   1 
ATOM   1402 O O   . SER   B 1 77 ? 2.766   -0.37   43.675 1   25.54 ? 92  SER   B O   1 
ATOM   1403 C CB  . SER   B 1 77 ? 0.25    -0.762  45.193 1   26.34 ? 92  SER   B CB  1 
ATOM   1404 O OG  . SER   B 1 77 ? -0.135  -1.991  44.58  1   27.89 ? 92  SER   B OG  1 
ATOM   1405 N N   . VAL   B 1 78 ? 3.02    -2.477  44.454 1   25.25 ? 93  VAL   B N   1 
ATOM   1406 C CA  . VAL   B 1 78 ? 3.814   -3.025  43.353 1   26.46 ? 93  VAL   B CA  1 
ATOM   1407 C C   . VAL   B 1 78 ? 2.985   -3.029  42.047 1   26.16 ? 93  VAL   B C   1 
ATOM   1408 O O   . VAL   B 1 78 ? 3.555   -3.145  40.971 1   26.11 ? 93  VAL   B O   1 
ATOM   1409 C CB  . VAL   B 1 78 ? 4.326   -4.474  43.672 1   28.17 ? 93  VAL   B CB  1 
ATOM   1410 C CG1 . VAL   B 1 78 ? 5.339   -4.935  42.638 1   29.74 ? 93  VAL   B CG1 1 
ATOM   1411 C CG2 . VAL   B 1 78 ? 4.939   -4.567  45.064 1   29.29 ? 93  VAL   B CG2 1 
ATOM   1412 N N   . LYS   B 1 79 ? 1.636   -2.992  42.137 1   25.99 ? 94  LYS   B N   1 
ATOM   1413 C CA  . LYS   B 1 79 ? 0.793   -2.981  40.946 1   26.7  ? 94  LYS   B CA  1 
ATOM   1414 C C   . LYS   B 1 79 ? 0.95    -1.653  40.158 1   27.26 ? 94  LYS   B C   1 
ATOM   1415 O O   . LYS   B 1 79 ? 0.671   -1.629  38.961 1   28.4  ? 94  LYS   B O   1 
ATOM   1416 C CB  . LYS   B 1 79 ? -0.679  -3.147  41.354 1   28.16 ? 94  LYS   B CB  1 
ATOM   1417 C CG  . LYS   B 1 79 ? -1.038  -4.544  41.829 1   32.49 ? 94  LYS   B CG  1 
ATOM   1418 C CD  . LYS   B 1 79 ? -2.553  -4.628  42.04  1   35.75 ? 94  LYS   B CD  1 
ATOM   1419 C CE  . LYS   B 1 79 ? -2.99   -5.994  42.492 1   38.44 ? 94  LYS   B CE  1 
ATOM   1420 N NZ  . LYS   B 1 79 ? -4.418  -5.998  42.912 1   39    ? 94  LYS   B NZ  1 
ATOM   1421 N N   . GLU   B 1 80 ? 1.379   -0.564  40.817 1   26.22 ? 95  GLU   B N   1 
ATOM   1422 C CA  . GLU   B 1 80 ? 1.493   0.732   40.145 1   26.47 ? 95  GLU   B CA  1 
ATOM   1423 C C   . GLU   B 1 80 ? 2.902   0.912   39.592 1   25.98 ? 95  GLU   B C   1 
ATOM   1424 O O   . GLU   B 1 80 ? 3.692   1.691   40.121 1   25.45 ? 95  GLU   B O   1 
ATOM   1425 C CB  . GLU   B 1 80 ? 1.072   1.858   41.095 1   29.08 ? 95  GLU   B CB  1 
ATOM   1426 C CG  . GLU   B 1 80 ? -0.316  1.58    41.659 1   35.61 ? 95  GLU   B CG  1 
ATOM   1427 C CD  . GLU   B 1 80 ? -0.986  2.704   42.419 1   45.4  ? 95  GLU   B CD  1 
ATOM   1428 O OE1 . GLU   B 1 80 ? -0.662  2.891   43.613 1   47.96 ? 95  GLU   B OE1 1 
ATOM   1429 O OE2 . GLU   B 1 80 ? -1.843  3.393   41.821 1   49.11 ? 95  GLU   B OE2 1 
ATOM   1430 N N   . HIS   B 1 81 ? 3.215   0.142   38.537 1   25.26 ? 96  HIS   B N   1 
ATOM   1431 C CA  . HIS   B 1 81 ? 4.558   0.056   37.959 1   25.43 ? 96  HIS   B CA  1 
ATOM   1432 C C   . HIS   B 1 81 ? 5.281   1.38    37.775 1   26.99 ? 96  HIS   B C   1 
ATOM   1433 O O   . HIS   B 1 81 ? 6.386   1.532   38.287 1   26.55 ? 96  HIS   B O   1 
ATOM   1434 C CB  . HIS   B 1 81 ? 4.532   -0.708  36.628 1   24.36 ? 96  HIS   B CB  1 
ATOM   1435 C CG  . HIS   B 1 81 ? 3.864   -2.036  36.73  1   24.22 ? 96  HIS   B CG  1 
ATOM   1436 N ND1 . HIS   B 1 81 ? 2.52    -2.169  36.517 1   24.57 ? 96  HIS   B ND1 1 
ATOM   1437 C CD2 . HIS   B 1 81 ? 4.401   -3.262  36.943 1   25.73 ? 96  HIS   B CD2 1 
ATOM   1438 C CE1 . HIS   B 1 81 ? 2.255   -3.457  36.676 1   25.97 ? 96  HIS   B CE1 1 
ATOM   1439 N NE2 . HIS   B 1 81 ? 3.357   -4.154  36.932 1   26.48 ? 96  HIS   B NE2 1 
ATOM   1440 N N   . ARG   B 1 82 ? 4.668   2.34    37.068 1   27.94 ? 97  ARG   B N   1 
ATOM   1441 C CA  . ARG   B 1 82 ? 5.36    3.59    36.746 1   28.76 ? 97  ARG   B CA  1 
ATOM   1442 C C   . ARG   B 1 82 ? 5.577   4.498   37.973 1   29.15 ? 97  ARG   B C   1 
ATOM   1443 O O   . ARG   B 1 82 ? 6.596   5.198   38.013 1   29.15 ? 97  ARG   B O   1 
ATOM   1444 C CB  . ARG   B 1 82 ? 4.681   4.304   35.577 1   29.38 ? 97  ARG   B CB  1 
ATOM   1445 C CG  . ARG   B 1 82 ? 5.482   5.448   34.899 1   31.02 ? 97  ARG   B CG  1 
ATOM   1446 C CD  . ARG   B 1 82 ? 6.921   5.208   34.439 1   30.75 ? 97  ARG   B CD  1 
ATOM   1447 N NE  . ARG   B 1 82 ? 7.189   3.98    33.671 1   27.01 ? 97  ARG   B NE  1 
ATOM   1448 C CZ  . ARG   B 1 82 ? 8.39    3.664   33.175 1   27.64 ? 97  ARG   B CZ  1 
ATOM   1449 N NH1 . ARG   B 1 82 ? 9.396   4.53    33.247 1   26.08 ? 97  ARG   B NH1 1 
ATOM   1450 N NH2 . ARG   B 1 82 ? 8.583   2.492   32.574 1   26.02 ? 97  ARG   B NH2 1 
ATOM   1451 N N   . LYS   B 1 83 ? 4.737   4.384   39.031 1   28.96 ? 98  LYS   B N   1 
ATOM   1452 C CA  . LYS   B 1 83 ? 5.006   5.135   40.27  1   28.28 ? 98  LYS   B CA  1 
ATOM   1453 C C   . LYS   B 1 83 ? 6.3     4.642   40.926 1   27.25 ? 98  LYS   B C   1 
ATOM   1454 O O   . LYS   B 1 83 ? 7.017   5.434   41.537 1   27.37 ? 98  LYS   B O   1 
ATOM   1455 C CB  . LYS   B 1 83 ? 3.836   5.045   41.252 1   31.15 ? 98  LYS   B CB  1 
ATOM   1456 C CG  . LYS   B 1 83 ? 2.581   5.751   40.751 1   36.16 ? 98  LYS   B CG  1 
ATOM   1457 C CD  . LYS   B 1 83 ? 1.503   5.76    41.827 1   40.72 ? 98  LYS   B CD  1 
ATOM   1458 C CE  . LYS   B 1 83 ? 0.195   6.346   41.361 1   44.7  ? 98  LYS   B CE  1 
ATOM   1459 N NZ  . LYS   B 1 83 ? -0.865  6.191   42.393 1   46.63 ? 98  LYS   B NZ  1 
ATOM   1460 N N   . ILE   B 1 84 ? 6.612   3.331   40.796 1   26.16 ? 99  ILE   B N   1 
ATOM   1461 C CA  . ILE   B 1 84 ? 7.843   2.75    41.333 1   26.16 ? 99  ILE   B CA  1 
ATOM   1462 C C   . ILE   B 1 84 ? 9.041   3.223   40.527 1   26.26 ? 99  ILE   B C   1 
ATOM   1463 O O   . ILE   B 1 84 ? 10.06   3.589   41.106 1   26.96 ? 99  ILE   B O   1 
ATOM   1464 C CB  . ILE   B 1 84 ? 7.731   1.202   41.387 1   26.87 ? 99  ILE   B CB  1 
ATOM   1465 C CG1 . ILE   B 1 84 ? 6.532   0.795   42.293 1   27.39 ? 99  ILE   B CG1 1 
ATOM   1466 C CG2 . ILE   B 1 84 ? 9.069   0.56    41.809 1   27.55 ? 99  ILE   B CG2 1 
ATOM   1467 C CD1 . ILE   B 1 84 ? 6.372   -0.669  42.536 1   28.96 ? 99  ILE   B CD1 1 
ATOM   1468 N N   . TYR   B 1 85 ? 8.921   3.277   39.184 1   25.88 ? 100 TYR   B N   1 
ATOM   1469 C CA  . TYR   B 1 85 ? 10.009  3.795   38.347 1   25.93 ? 100 TYR   B CA  1 
ATOM   1470 C C   . TYR   B 1 85 ? 10.232  5.275   38.684 1   26.11 ? 100 TYR   B C   1 
ATOM   1471 O O   . TYR   B 1 85 ? 11.373  5.697   38.799 1   25.75 ? 100 TYR   B O   1 
ATOM   1472 C CB  . TYR   B 1 85 ? 9.692   3.673   36.843 1   25.5  ? 100 TYR   B CB  1 
ATOM   1473 C CG  . TYR   B 1 85 ? 9.872   2.276   36.296 1   27.15 ? 100 TYR   B CG  1 
ATOM   1474 C CD1 . TYR   B 1 85 ? 11.135  1.775   36.017 1   28.92 ? 100 TYR   B CD1 1 
ATOM   1475 C CD2 . TYR   B 1 85 ? 8.776   1.475   36.008 1   27.93 ? 100 TYR   B CD2 1 
ATOM   1476 C CE1 . TYR   B 1 85 ? 11.307  0.494   35.511 1   29.97 ? 100 TYR   B CE1 1 
ATOM   1477 C CE2 . TYR   B 1 85 ? 8.935   0.191   35.501 1   29.16 ? 100 TYR   B CE2 1 
ATOM   1478 C CZ  . TYR   B 1 85 ? 10.201  -0.302  35.269 1   30.54 ? 100 TYR   B CZ  1 
ATOM   1479 O OH  . TYR   B 1 85 ? 10.366  -1.56   34.746 1   32.72 ? 100 TYR   B OH  1 
ATOM   1480 N N   . THR   B 1 86 ? 9.158   6.037   38.892 1   26.76 ? 101 THR   B N   1 
ATOM   1481 C CA  . THR   B 1 86 ? 9.265   7.462   39.234 1   28.33 ? 101 THR   B CA  1 
ATOM   1482 C C   . THR   B 1 86 ? 10.072  7.659   40.528 1   28.31 ? 101 THR   B C   1 
ATOM   1483 O O   . THR   B 1 86 ? 10.989  8.477   40.569 1   27.83 ? 101 THR   B O   1 
ATOM   1484 C CB  . THR   B 1 86 ? 7.882   8.089   39.292 1   30.83 ? 101 THR   B CB  1 
ATOM   1485 O OG1 . THR   B 1 86 ? 7.34    8.014   37.973 1   33.08 ? 101 THR   B OG1 1 
ATOM   1486 C CG2 . THR   B 1 86 ? 7.921   9.538   39.749 1   31.64 ? 101 THR   B CG2 1 
ATOM   1487 N N   . MET   B 1 87 ? 9.801   6.83    41.544 1   27.72 ? 102 MET   B N   1 
ATOM   1488 C CA  . MET   B 1 87 ? 10.563  6.883   42.795 1   28.04 ? 102 MET   B CA  1 
ATOM   1489 C C   . MET   B 1 87 ? 12.023  6.55    42.528 1   27.64 ? 102 MET   B C   1 
ATOM   1490 O O   . MET   B 1 87 ? 12.904  7.224   43.055 1   27.71 ? 102 MET   B O   1 
ATOM   1491 C CB  . MET   B 1 87 ? 9.977   5.888   43.822 1   29.84 ? 102 MET   B CB  1 
ATOM   1492 C CG  . MET   B 1 87 ? 10.836  5.702   45.09  1   34.86 ? 102 MET   B CG  1 
ATOM   1493 S SD  . MET   B 1 87 ? 12.403  4.756   44.927 1   43.25 ? 102 MET   B SD  1 
ATOM   1494 C CE  . MET   B 1 87 ? 11.825  3.084   45     1   35.94 ? 102 MET   B CE  1 
ATOM   1495 N N   . ILE   B 1 88 ? 12.284  5.484   41.739 1   26.51 ? 103 ILE   B N   1 
ATOM   1496 C CA  . ILE   B 1 88 ? 13.639  5.062   41.445 1   26.79 ? 103 ILE   B CA  1 
ATOM   1497 C C   . ILE   B 1 88 ? 14.44   6.153   40.741 1   27.34 ? 103 ILE   B C   1 
ATOM   1498 O O   . ILE   B 1 88 ? 15.565  6.46    41.179 1   27.6  ? 103 ILE   B O   1 
ATOM   1499 C CB  . ILE   B 1 88 ? 13.655  3.704   40.675 1   26.74 ? 103 ILE   B CB  1 
ATOM   1500 C CG1 . ILE   B 1 88 ? 13.158  2.577   41.591 1   27.34 ? 103 ILE   B CG1 1 
ATOM   1501 C CG2 . ILE   B 1 88 ? 15.073  3.396   40.186 1   27.49 ? 103 ILE   B CG2 1 
ATOM   1502 C CD1 . ILE   B 1 88 ? 12.846  1.241   40.92  1   28.42 ? 103 ILE   B CD1 1 
ATOM   1503 N N   . TYR   B 1 89 ? 13.875  6.751   39.663 1   27.09 ? 104 TYR   B N   1 
ATOM   1504 C CA  . TYR   B 1 89 ? 14.568  7.786   38.887 1   27.62 ? 104 TYR   B CA  1 
ATOM   1505 C C   . TYR   B 1 89 ? 14.858  9.031   39.727 1   28.99 ? 104 TYR   B C   1 
ATOM   1506 O O   . TYR   B 1 89 ? 15.873  9.695   39.504 1   29    ? 104 TYR   B O   1 
ATOM   1507 C CB  . TYR   B 1 89 ? 13.797  8.162   37.605 1   27.09 ? 104 TYR   B CB  1 
ATOM   1508 C CG  . TYR   B 1 89 ? 13.947  7.164   36.474 1   26.67 ? 104 TYR   B CG  1 
ATOM   1509 C CD1 . TYR   B 1 89 ? 15.144  7.042   35.782 1   27.03 ? 104 TYR   B CD1 1 
ATOM   1510 C CD2 . TYR   B 1 89 ? 12.867  6.416   36.034 1   27.42 ? 104 TYR   B CD2 1 
ATOM   1511 C CE1 . TYR   B 1 89 ? 15.29   6.127   34.748 1   27.61 ? 104 TYR   B CE1 1 
ATOM   1512 C CE2 . TYR   B 1 89 ? 13.003  5.488   35.006 1   27.92 ? 104 TYR   B CE2 1 
ATOM   1513 C CZ  . TYR   B 1 89 ? 14.204  5.383   34.334 1   28.47 ? 104 TYR   B CZ  1 
ATOM   1514 O OH  . TYR   B 1 89 ? 14.329  4.514   33.28  1   30.05 ? 104 TYR   B OH  1 
ATOM   1515 N N   . ARG   B 1 90 ? 13.993  9.338   40.718 1   29.5  ? 105 ARG   B N   1 
ATOM   1516 C CA  . ARG   B 1 90 ? 14.248  10.496  41.597 1   29.82 ? 105 ARG   B CA  1 
ATOM   1517 C C   . ARG   B 1 90 ? 15.461  10.257  42.516 1   29.33 ? 105 ARG   B C   1 
ATOM   1518 O O   . ARG   B 1 90 ? 16.026  11.217  43.035 1   29.73 ? 105 ARG   B O   1 
ATOM   1519 C CB  . ARG   B 1 90 ? 13.035  10.78   42.49  1   33.02 ? 105 ARG   B CB  1 
ATOM   1520 C CG  . ARG   B 1 90 ? 11.876  11.401  41.747 1   41.15 ? 105 ARG   B CG  1 
ATOM   1521 C CD  . ARG   B 1 90 ? 10.852  11.943  42.723 1   49.11 ? 105 ARG   B CD  1 
ATOM   1522 N NE  . ARG   B 1 90 ? 9.508   11.951  42.147 1   56.14 ? 105 ARG   B NE  1 
ATOM   1523 C CZ  . ARG   B 1 90 ? 8.997   12.957  41.444 1   60.83 ? 105 ARG   B CZ  1 
ATOM   1524 N NH1 . ARG   B 1 90 ? 9.722   14.044  41.201 1   62.1  ? 105 ARG   B NH1 1 
ATOM   1525 N NH2 . ARG   B 1 90 ? 7.762   12.878  40.965 1   61.01 ? 105 ARG   B NH2 1 
ATOM   1526 N N   . ASN   B 1 91 ? 15.804  8.978   42.76  1   28.01 ? 106 ASN   B N   1 
ATOM   1527 C CA  . ASN   B 1 91 ? 16.885  8.535   43.61  1   27.88 ? 106 ASN   B CA  1 
ATOM   1528 C C   . ASN   B 1 91 ? 18.154  8.124   42.848 1   27.84 ? 106 ASN   B C   1 
ATOM   1529 O O   . ASN   B 1 91 ? 19.002  7.415   43.392 1   27.18 ? 106 ASN   B O   1 
ATOM   1530 C CB  . ASN   B 1 91 ? 16.383  7.429   44.499 1   28.98 ? 106 ASN   B CB  1 
ATOM   1531 C CG  . ASN   B 1 91 ? 15.544  8.002   45.61  1   32.13 ? 106 ASN   B CG  1 
ATOM   1532 O OD1 . ASN   B 1 91 ? 16.083  8.49    46.616 1   33.95 ? 106 ASN   B OD1 1 
ATOM   1533 N ND2 . ASN   B 1 91 ? 14.225  7.961   45.449 1   31.41 ? 106 ASN   B ND2 1 
ATOM   1534 N N   . LEU   B 1 92 ? 18.298  8.593   41.601 1   28.1  ? 107 LEU   B N   1 
ATOM   1535 C CA  . LEU   B 1 92 ? 19.503  8.293   40.822 1   28.82 ? 107 LEU   B CA  1 
ATOM   1536 C C   . LEU   B 1 92 ? 19.804  9.365   39.789 1   29.5  ? 107 LEU   B C   1 
ATOM   1537 O O   . LEU   B 1 92 ? 18.996  10.253  39.565 1   30.31 ? 107 LEU   B O   1 
ATOM   1538 C CB  . LEU   B 1 92 ? 19.429  6.889   40.191 1   28.6  ? 107 LEU   B CB  1 
ATOM   1539 C CG  . LEU   B 1 92 ? 18.271  6.606   39.25  1   29.23 ? 107 LEU   B CG  1 
ATOM   1540 C CD1 . LEU   B 1 92 ? 18.513  7.2     37.849 1   28.88 ? 107 LEU   B CD1 1 
ATOM   1541 C CD2 . LEU   B 1 92 ? 18.063  5.11    39.143 1   30.19 ? 107 LEU   B CD2 1 
ATOM   1542 N N   . VAL   B 1 93 ? 20.979  9.279   39.159 1   29.57 ? 108 VAL   B N   1 
ATOM   1543 C CA  . VAL   B 1 93 ? 21.368  10.14   38.069 1   30.16 ? 108 VAL   B CA  1 
ATOM   1544 C C   . VAL   B 1 93 ? 21.632  9.198   36.89  1   30.06 ? 108 VAL   B C   1 
ATOM   1545 O O   . VAL   B 1 93 ? 22.399  8.258   37.031 1   30.27 ? 108 VAL   B O   1 
ATOM   1546 C CB  . VAL   B 1 93 ? 22.621  10.973  38.431 1   31.28 ? 108 VAL   B CB  1 
ATOM   1547 C CG1 . VAL   B 1 93 ? 23.161  11.698  37.211 1   31.38 ? 108 VAL   B CG1 1 
ATOM   1548 C CG2 . VAL   B 1 93 ? 22.304  11.967  39.545 1   32.23 ? 108 VAL   B CG2 1 
ATOM   1549 N N   . VAL   B 1 94 ? 20.968  9.41    35.756 1   29.59 ? 109 VAL   B N   1 
ATOM   1550 C CA  . VAL   B 1 94 ? 21.188  8.594   34.568 1   30.19 ? 109 VAL   B CA  1 
ATOM   1551 C C   . VAL   B 1 94 ? 22.564  8.979   34.001 1   30.96 ? 109 VAL   B C   1 
ATOM   1552 O O   . VAL   B 1 94 ? 22.856  10.165  33.852 1   30.28 ? 109 VAL   B O   1 
ATOM   1553 C CB  . VAL   B 1 94 ? 20.055  8.836   33.541 1   30.48 ? 109 VAL   B CB  1 
ATOM   1554 C CG1 . VAL   B 1 94 ? 20.334  8.102   32.23  1   31.01 ? 109 VAL   B CG1 1 
ATOM   1555 C CG2 . VAL   B 1 94 ? 18.704  8.428   34.127 1   30.5  ? 109 VAL   B CG2 1 
ATOM   1556 N N   . VAL   B 1 95 ? 23.424  7.996   33.756 1   32.22 ? 110 VAL   B N   1 
ATOM   1557 C CA  . VAL   B 1 95 ? 24.766  8.265   33.245 1   35.02 ? 110 VAL   B CA  1 
ATOM   1558 C C   . VAL   B 1 95 ? 24.665  8.751   31.798 1   37.35 ? 110 VAL   B C   1 
ATOM   1559 O O   . VAL   B 1 95 ? 23.94   8.142   31.007 1   36.76 ? 110 VAL   B O   1 
ATOM   1560 C CB  . VAL   B 1 95 ? 25.646  7.001   33.386 1   36.27 ? 110 VAL   B CB  1 
ATOM   1561 C CG1 . VAL   B 1 95 ? 26.957  7.142   32.618 1   37.3  ? 110 VAL   B CG1 1 
ATOM   1562 C CG2 . VAL   B 1 95 ? 25.908  6.694   34.857 1   37.01 ? 110 VAL   B CG2 1 
ATOM   1563 N N   . ASN   B 1 96 ? 25.351  9.87    31.453 1   39.88 ? 111 ASN   B N   1 
ATOM   1564 C CA  . ASN   B 1 96 ? 25.311  10.376  30.076 1   42.42 ? 111 ASN   B CA  1 
ATOM   1565 C C   . ASN   B 1 96 ? 25.836  9.339   29.078 1   42.94 ? 111 ASN   B C   1 
ATOM   1566 O O   . ASN   B 1 96 ? 26.737  8.572   29.414 1   43.3  ? 111 ASN   B O   1 
ATOM   1567 C CB  . ASN   B 1 96 ? 26.047  11.723  29.926 1   45.59 ? 111 ASN   B CB  1 
ATOM   1568 C CG  . ASN   B 1 96 ? 27.555  11.642  29.8   1   51.73 ? 111 ASN   B CG  1 
ATOM   1569 O OD1 . ASN   B 1 96 ? 28.123  11.476  28.699 1   52.95 ? 111 ASN   B OD1 1 
ATOM   1570 N ND2 . ASN   B 1 96 ? 28.24   11.76   30.933 1   53.53 ? 111 ASN   B ND2 1 
ATOM   1571 N N   . GLN   C 1 3  ? 25.876  -12.601 39.872 1   45.88 ? 18  GLN   C N   1 
ATOM   1572 C CA  . GLN   C 1 3  ? 24.777  -13.179 40.646 1   45.59 ? 18  GLN   C CA  1 
ATOM   1573 C C   . GLN   C 1 3  ? 23.393  -12.965 40.022 1   43.35 ? 18  GLN   C C   1 
ATOM   1574 O O   . GLN   C 1 3  ? 22.415  -13.512 40.54  1   44.34 ? 18  GLN   C O   1 
ATOM   1575 C CB  . GLN   C 1 3  ? 24.798  -12.688 42.101 1   48.95 ? 18  GLN   C CB  1 
ATOM   1576 C CG  . GLN   C 1 3  ? 24.287  -11.268 42.319 1   54.78 ? 18  GLN   C CG  1 
ATOM   1577 C CD  . GLN   C 1 3  ? 24.609  -10.797 43.721 1   62.45 ? 18  GLN   C CD  1 
ATOM   1578 O OE1 . GLN   C 1 3  ? 25.33   -9.807  43.93  1   64.56 ? 18  GLN   C OE1 1 
ATOM   1579 N NE2 . GLN   C 1 3  ? 24.091  -11.503 44.722 1   64.05 ? 18  GLN   C NE2 1 
ATOM   1580 N N   . ILE   C 1 4  ? 23.288  -12.149 38.952 1   39.97 ? 19  ILE   C N   1 
ATOM   1581 C CA  . ILE   C 1 4  ? 21.99   -11.939 38.315 1   37.34 ? 19  ILE   C CA  1 
ATOM   1582 C C   . ILE   C 1 4  ? 21.87   -12.892 37.145 1   33.7  ? 19  ILE   C C   1 
ATOM   1583 O O   . ILE   C 1 4  ? 22.666  -12.83  36.214 1   32.32 ? 19  ILE   C O   1 
ATOM   1584 C CB  . ILE   C 1 4  ? 21.731  -10.477 37.903 1   38.14 ? 19  ILE   C CB  1 
ATOM   1585 C CG1 . ILE   C 1 4  ? 21.744  -9.571  39.146 1   39.25 ? 19  ILE   C CG1 1 
ATOM   1586 C CG2 . ILE   C 1 4  ? 20.408  -10.372 37.123 1   38.76 ? 19  ILE   C CG2 1 
ATOM   1587 C CD1 . ILE   C 1 4  ? 21.485  -8.103  38.892 1   40.3  ? 19  ILE   C CD1 1 
ATOM   1588 N N   . PRO   C 1 5  ? 20.882  -13.795 37.193 1   32.32 ? 20  PRO   C N   1 
ATOM   1589 C CA  . PRO   C 1 5  ? 20.756  -14.781 36.113 1   31.03 ? 20  PRO   C CA  1 
ATOM   1590 C C   . PRO   C 1 5  ? 20.394  -14.164 34.772 1   30.2  ? 20  PRO   C C   1 
ATOM   1591 O O   . PRO   C 1 5  ? 19.685  -13.158 34.699 1   30.39 ? 20  PRO   C O   1 
ATOM   1592 C CB  . PRO   C 1 5  ? 19.71   -15.77  36.632 1   31.57 ? 20  PRO   C CB  1 
ATOM   1593 C CG  . PRO   C 1 5  ? 18.982  -15.053 37.696 1   32.73 ? 20  PRO   C CG  1 
ATOM   1594 C CD  . PRO   C 1 5  ? 19.867  -13.989 38.252 1   31.45 ? 20  PRO   C CD  1 
ATOM   1595 N N   . ALA   C 1 6  ? 20.929  -14.747 33.712 1   29.48 ? 21  ALA   C N   1 
ATOM   1596 C CA  . ALA   C 1 6  ? 20.674  -14.264 32.366 1   29.41 ? 21  ALA   C CA  1 
ATOM   1597 C C   . ALA   C 1 6  ? 19.303  -14.735 31.895 1   28.39 ? 21  ALA   C C   1 
ATOM   1598 O O   . ALA   C 1 6  ? 18.857  -15.838 32.231 1   28.34 ? 21  ALA   C O   1 
ATOM   1599 C CB  . ALA   C 1 6  ? 21.743  -14.804 31.422 1   29.93 ? 21  ALA   C CB  1 
ATOM   1600 N N   . SER   C 1 7  ? 18.658  -13.919 31.093 1   27.64 ? 22  SER   C N   1 
ATOM   1601 C CA  . SER   C 1 7  ? 17.413  -14.309 30.443 1   27.96 ? 22  SER   C CA  1 
ATOM   1602 C C   . SER   C 1 7  ? 17.779  -14.944 29.06  1   27.44 ? 22  SER   C C   1 
ATOM   1603 O O   . SER   C 1 7  ? 18.946  -14.906 28.641 1   27.27 ? 22  SER   C O   1 
ATOM   1604 C CB  . SER   C 1 7  ? 16.53   -13.08  30.239 1   29.33 ? 22  SER   C CB  1 
ATOM   1605 O OG  . SER   C 1 7  ? 17.024  -12.299 29.159 1   30.66 ? 22  SER   C OG  1 
ATOM   1606 N N   . GLU   C 1 8  ? 16.796  -15.511 28.349 1   27.08 ? 23  GLU   C N   1 
ATOM   1607 C CA  . GLU   C 1 8  ? 17.044  -16.094 27.022 1   27.12 ? 23  GLU   C CA  1 
ATOM   1608 C C   . GLU   C 1 8  ? 17.619  -15.056 26.044 1   26.94 ? 23  GLU   C C   1 
ATOM   1609 O O   . GLU   C 1 8  ? 18.583  -15.352 25.344 1   27.55 ? 23  GLU   C O   1 
ATOM   1610 C CB  . GLU   C 1 8  ? 15.758  -16.719 26.45  1   29    ? 23  GLU   C CB  1 
ATOM   1611 C CG  . GLU   C 1 8  ? 15.998  -17.469 25.149 1   31.35 ? 23  GLU   C CG  1 
ATOM   1612 C CD  . GLU   C 1 8  ? 14.789  -18.165 24.551 1   33.38 ? 23  GLU   C CD  1 
ATOM   1613 O OE1 . GLU   C 1 8  ? 13.644  -17.799 24.906 1   34.34 ? 23  GLU   C OE1 1 
ATOM   1614 O OE2 . GLU   C 1 8  ? 14.99   -19.089 23.728 1   34.46 ? 23  GLU   C OE2 1 
ATOM   1615 N N   . GLN   C 1 9  ? 17.07   -13.829 26.036 1   26.41 ? 24  GLN   C N   1 
ATOM   1616 C CA  . GLN   C 1 9  ? 17.554  -12.742 25.162 1   27.14 ? 24  GLN   C CA  1 
ATOM   1617 C C   . GLN   C 1 9  ? 19.017  -12.331 25.429 1   26.05 ? 24  GLN   C C   1 
ATOM   1618 O O   . GLN   C 1 9  ? 19.72   -11.906 24.509 1   25.83 ? 24  GLN   C O   1 
ATOM   1619 C CB  . GLN   C 1 9  ? 16.643  -11.516 25.268 1   29.9  ? 24  GLN   C CB  1 
ATOM   1620 C CG  . GLN   C 1 9  ? 15.213  -11.799 24.84  1   35.19 ? 24  GLN   C CG  1 
ATOM   1621 C CD  . GLN   C 1 9  ? 15.089  -11.831 23.341 1   38.84 ? 24  GLN   C CD  1 
ATOM   1622 O OE1 . GLN   C 1 9  ? 15.56   -10.926 22.644 1   38.63 ? 24  GLN   C OE1 1 
ATOM   1623 N NE2 . GLN   C 1 9  ? 14.442  -12.87  22.824 1   39.28 ? 24  GLN   C NE2 1 
ATOM   1624 N N   . GLU   C 1 10 ? 19.467  -12.472 26.669 1   25.65 ? 25  GLU   C N   1 
ATOM   1625 C CA  . GLU   C 1 10 ? 20.838  -12.153 27.067 1   26.45 ? 25  GLU   C CA  1 
ATOM   1626 C C   . GLU   C 1 10 ? 21.828  -13.312 26.872 1   27.37 ? 25  GLU   C C   1 
ATOM   1627 O O   . GLU   C 1 10 ? 23.029  -13.132 27.119 1   28.3  ? 25  GLU   C O   1 
ATOM   1628 C CB  . GLU   C 1 10 ? 20.88   -11.69  28.539 1   28.56 ? 25  GLU   C CB  1 
ATOM   1629 C CG  . GLU   C 1 10 ? 20.177  -10.375 28.8   1   33.62 ? 25  GLU   C CG  1 
ATOM   1630 C CD  . GLU   C 1 10 ? 19.947  -10.115 30.279 1   44.44 ? 25  GLU   C CD  1 
ATOM   1631 O OE1 . GLU   C 1 10 ? 19.791  -11.096 31.042 1   43.66 ? 25  GLU   C OE1 1 
ATOM   1632 O OE2 . GLU   C 1 10 ? 19.917  -8.929  30.678 1   49.92 ? 25  GLU   C OE2 1 
ATOM   1633 N N   . THR   C 1 11 ? 21.361  -14.483 26.437 1   27.52 ? 26  THR   C N   1 
ATOM   1634 C CA  . THR   C 1 11 ? 22.238  -15.632 26.244 1   28.58 ? 26  THR   C CA  1 
ATOM   1635 C C   . THR   C 1 11 ? 23.239  -15.392 25.112 1   28    ? 26  THR   C C   1 
ATOM   1636 O O   . THR   C 1 11 ? 22.856  -14.956 24.026 1   27.08 ? 26  THR   C O   1 
ATOM   1637 C CB  . THR   C 1 11 ? 21.419  -16.9   26.001 1   30.39 ? 26  THR   C CB  1 
ATOM   1638 O OG1 . THR   C 1 11 ? 20.603  -17.155 27.153 1   31.58 ? 26  THR   C OG1 1 
ATOM   1639 C CG2 . THR   C 1 11 ? 22.294  -18.107 25.703 1   31.3  ? 26  THR   C CG2 1 
ATOM   1640 N N   . LEU   C 1 12 ? 24.521  -15.665 25.382 1   27.48 ? 27  LEU   C N   1 
ATOM   1641 C CA  . LEU   C 1 12 ? 25.571  -15.531 24.385 1   27.52 ? 27  LEU   C CA  1 
ATOM   1642 C C   . LEU   C 1 12 ? 25.599  -16.757 23.512 1   26.52 ? 27  LEU   C C   1 
ATOM   1643 O O   . LEU   C 1 12 ? 25.473  -17.881 23.99  1   26.26 ? 27  LEU   C O   1 
ATOM   1644 C CB  . LEU   C 1 12 ? 26.945  -15.345 25.052 1   29.5  ? 27  LEU   C CB  1 
ATOM   1645 C CG  . LEU   C 1 12 ? 27.211  -13.978 25.646 1   33.22 ? 27  LEU   C CG  1 
ATOM   1646 C CD1 . LEU   C 1 12 ? 28.607  -13.949 26.308 1   35.24 ? 27  LEU   C CD1 1 
ATOM   1647 C CD2 . LEU   C 1 12 ? 27.149  -12.883 24.559 1   34.35 ? 27  LEU   C CD2 1 
ATOM   1648 N N   . VAL   C 1 13 ? 25.739  -16.542 22.206 1   25.94 ? 28  VAL   C N   1 
ATOM   1649 C CA  . VAL   C 1 13 ? 25.735  -17.6   21.229 1   25.84 ? 28  VAL   C CA  1 
ATOM   1650 C C   . VAL   C 1 13 ? 26.853  -17.367 20.228 1   26.73 ? 28  VAL   C C   1 
ATOM   1651 O O   . VAL   C 1 13 ? 27.294  -16.223 19.995 1   27.54 ? 28  VAL   C O   1 
ATOM   1652 C CB  . VAL   C 1 13 ? 24.35   -17.72  20.504 1   26.05 ? 28  VAL   C CB  1 
ATOM   1653 C CG1 . VAL   C 1 13 ? 23.207  -18.023 21.48  1   25.88 ? 28  VAL   C CG1 1 
ATOM   1654 C CG2 . VAL   C 1 13 ? 24.038  -16.474 19.666 1   26.26 ? 28  VAL   C CG2 1 
ATOM   1655 N N   . ARG   C 1 14 ? 27.269  -18.461 19.604 1   27    ? 29  ARG   C N   1 
ATOM   1656 C CA  . ARG   C 1 14 ? 28.277  -18.527 18.561 1   28.86 ? 29  ARG   C CA  1 
ATOM   1657 C C   . ARG   C 1 14 ? 27.589  -19.031 17.309 1   29.27 ? 29  ARG   C C   1 
ATOM   1658 O O   . ARG   C 1 14 ? 27.483  -20.241 17.118 1   29.69 ? 29  ARG   C O   1 
ATOM   1659 C CB  . ARG   C 1 14 ? 29.362  -19.519 18.99  1   32.27 ? 29  ARG   C CB  1 
ATOM   1660 C CG  . ARG   C 1 14 ? 30.504  -18.827 19.67  1   37.47 ? 29  ARG   C CG  1 
ATOM   1661 C CD  . ARG   C 1 14 ? 31.581  -18.551 18.642 1   43.51 ? 29  ARG   C CD  1 
ATOM   1662 N NE  . ARG   C 1 14 ? 32.412  -17.432 19.056 1   48.61 ? 29  ARG   C NE  1 
ATOM   1663 C CZ  . ARG   C 1 14 ? 33.618  -17.168 18.574 1   52.29 ? 29  ARG   C CZ  1 
ATOM   1664 N NH1 . ARG   C 1 14 ? 34.163  -17.957 17.656 1   52.06 ? 29  ARG   C NH1 1 
ATOM   1665 N NH2 . ARG   C 1 14 ? 34.293  -16.116 19.009 1   53.59 ? 29  ARG   C NH2 1 
ATOM   1666 N N   . PRO   C 1 15 ? 27.079  -18.134 16.442 1   29.17 ? 30  PRO   C N   1 
ATOM   1667 C CA  . PRO   C 1 15 ? 26.375  -18.606 15.241 1   29.83 ? 30  PRO   C CA  1 
ATOM   1668 C C   . PRO   C 1 15 ? 27.249  -19.493 14.362 1   31.43 ? 30  PRO   C C   1 
ATOM   1669 O O   . PRO   C 1 15 ? 28.46   -19.259 14.254 1   31.95 ? 30  PRO   C O   1 
ATOM   1670 C CB  . PRO   C 1 15 ? 25.98   -17.303 14.515 1   30.15 ? 30  PRO   C CB  1 
ATOM   1671 C CG  . PRO   C 1 15 ? 25.964  -16.28  15.564 1   30.16 ? 30  PRO   C CG  1 
ATOM   1672 C CD  . PRO   C 1 15 ? 27.078  -16.661 16.522 1   28.54 ? 30  PRO   C CD  1 
ATOM   1673 N N   . LYS   C 1 16 ? 26.648  -20.539 13.786 1   31.54 ? 31  LYS   C N   1 
ATOM   1674 C CA  . LYS   C 1 16 ? 27.322  -21.444 12.85  1   32.8  ? 31  LYS   C CA  1 
ATOM   1675 C C   . LYS   C 1 16 ? 27.655  -20.691 11.538 1   33.95 ? 31  LYS   C C   1 
ATOM   1676 O O   . LYS   C 1 16 ? 27.268  -19.521 11.405 1   33.94 ? 31  LYS   C O   1 
ATOM   1677 C CB  . LYS   C 1 16 ? 26.488  -22.726 12.655 1   34.23 ? 31  LYS   C CB  1 
ATOM   1678 C CG  . LYS   C 1 16 ? 26.583  -23.657 13.856 1   37.33 ? 31  LYS   C CG  1 
ATOM   1679 C CD  . LYS   C 1 16 ? 25.582  -24.796 13.816 1   41.15 ? 31  LYS   C CD  1 
ATOM   1680 C CE  . LYS   C 1 16 ? 25.889  -25.765 14.93  1   45.86 ? 31  LYS   C CE  1 
ATOM   1681 N NZ  . LYS   C 1 16 ? 24.728  -26.624 15.264 1   49.42 ? 31  LYS   C NZ  1 
ATOM   1682 N N   . PRO   C 1 17 ? 28.472  -21.26  10.609 1   34.42 ? 32  PRO   C N   1 
ATOM   1683 C CA  . PRO   C 1 17 ? 28.93   -20.469 9.453  1   34.24 ? 32  PRO   C CA  1 
ATOM   1684 C C   . PRO   C 1 17 ? 27.857  -19.789 8.595  1   33.17 ? 32  PRO   C C   1 
ATOM   1685 O O   . PRO   C 1 17 ? 28.024  -18.619 8.267  1   33.12 ? 32  PRO   C O   1 
ATOM   1686 C CB  . PRO   C 1 17 ? 29.751  -21.478 8.63   1   35.35 ? 32  PRO   C CB  1 
ATOM   1687 C CG  . PRO   C 1 17 ? 30.243  -22.454 9.645  1   35.98 ? 32  PRO   C CG  1 
ATOM   1688 C CD  . PRO   C 1 17 ? 29.108  -22.597 10.627 1   34.38 ? 32  PRO   C CD  1 
ATOM   1689 N N   . LEU   C 1 18 ? 26.78   -20.488 8.239  1   32.49 ? 33  LEU   C N   1 
ATOM   1690 C CA  . LEU   C 1 18 ? 25.73   -19.902 7.402  1   32.84 ? 33  LEU   C CA  1 
ATOM   1691 C C   . LEU   C 1 18 ? 25.009  -18.726 8.099  1   30.69 ? 33  LEU   C C   1 
ATOM   1692 O O   . LEU   C 1 18 ? 24.888  -17.653 7.52   1   29.96 ? 33  LEU   C O   1 
ATOM   1693 C CB  . LEU   C 1 18 ? 24.742  -20.986 6.96   1   34.22 ? 33  LEU   C CB  1 
ATOM   1694 C CG  . LEU   C 1 18 ? 24.738  -21.443 5.486  1   37.82 ? 33  LEU   C CG  1 
ATOM   1695 C CD1 . LEU   C 1 18 ? 26.137  -21.415 4.831  1   38.97 ? 33  LEU   C CD1 1 
ATOM   1696 C CD2 . LEU   C 1 18 ? 24.126  -22.808 5.36   1   38.42 ? 33  LEU   C CD2 1 
ATOM   1697 N N   . LEU   C 1 19 ? 24.586  -18.919 9.352  1   29.63 ? 34  LEU   C N   1 
ATOM   1698 C CA  . LEU   C 1 19 ? 23.953  -17.845 10.117 1   28.79 ? 34  LEU   C CA  1 
ATOM   1699 C C   . LEU   C 1 19 ? 24.944  -16.685 10.353 1   28.02 ? 34  LEU   C C   1 
ATOM   1700 O O   . LEU   C 1 19 ? 24.558  -15.519 10.275 1   27.04 ? 34  LEU   C O   1 
ATOM   1701 C CB  . LEU   C 1 19 ? 23.424  -18.383 11.457 1   28.75 ? 34  LEU   C CB  1 
ATOM   1702 C CG  . LEU   C 1 19 ? 22.761  -17.331 12.359 1   29.29 ? 34  LEU   C CG  1 
ATOM   1703 C CD1 . LEU   C 1 19 ? 21.551  -16.726 11.685 1   29.18 ? 34  LEU   C CD1 1 
ATOM   1704 C CD2 . LEU   C 1 19 ? 22.331  -17.952 13.688 1   29.69 ? 34  LEU   C CD2 1 
ATOM   1705 N N   . LEU   C 1 20 ? 26.222  -17     10.597 1   28.45 ? 35  LEU   C N   1 
ATOM   1706 C CA  . LEU   C 1 20 ? 27.239  -15.968 10.807 1   29.46 ? 35  LEU   C CA  1 
ATOM   1707 C C   . LEU   C 1 20 ? 27.403  -15.107 9.564  1   29.65 ? 35  LEU   C C   1 
ATOM   1708 O O   . LEU   C 1 20 ? 27.511  -13.891 9.684  1   30.01 ? 35  LEU   C O   1 
ATOM   1709 C CB  . LEU   C 1 20 ? 28.595  -16.559 11.213 1   30.07 ? 35  LEU   C CB  1 
ATOM   1710 C CG  . LEU   C 1 20 ? 29.609  -15.543 11.72  1   32.33 ? 35  LEU   C CG  1 
ATOM   1711 C CD1 . LEU   C 1 20 ? 29.163  -14.936 13.044 1   32.56 ? 35  LEU   C CD1 1 
ATOM   1712 C CD2 . LEU   C 1 20 ? 30.98   -16.18  11.882 1   33.51 ? 35  LEU   C CD2 1 
ATOM   1713 N N   . LYS   C 1 21 ? 27.391  -15.732 8.381  1   29.64 ? 36  LYS   C N   1 
ATOM   1714 C CA  . LYS   C 1 21 ? 27.498  -15.035 7.096  1   30.12 ? 36  LYS   C CA  1 
ATOM   1715 C C   . LYS   C 1 21 ? 26.291  -14.079 6.954  1   29.37 ? 36  LYS   C C   1 
ATOM   1716 O O   . LYS   C 1 21 ? 26.459  -12.906 6.637  1   29.85 ? 36  LYS   C O   1 
ATOM   1717 C CB  . LYS   C 1 21 ? 27.511  -16.072 5.953  1   32.46 ? 36  LYS   C CB  1 
ATOM   1718 C CG  . LYS   C 1 21 ? 27.743  -15.474 4.57   1   38.94 ? 36  LYS   C CG  1 
ATOM   1719 C CD  . LYS   C 1 21 ? 27.629  -16.544 3.467  1   43.77 ? 36  LYS   C CD  1 
ATOM   1720 C CE  . LYS   C 1 21 ? 27.803  -15.929 2.104  1   48.59 ? 36  LYS   C CE  1 
ATOM   1721 N NZ  . LYS   C 1 21 ? 28.084  -16.959 1.065  1   51.62 ? 36  LYS   C NZ  1 
ATOM   1722 N N   . LEU   C 1 22 ? 25.093  -14.565 7.281  1   28.62 ? 37  LEU   C N   1 
ATOM   1723 C CA  . LEU   C 1 22 ? 23.877  -13.742 7.242  1   28.22 ? 37  LEU   C CA  1 
ATOM   1724 C C   . LEU   C 1 22 ? 23.995  -12.531 8.151  1   27.7  ? 37  LEU   C C   1 
ATOM   1725 O O   . LEU   C 1 22 ? 23.755  -11.407 7.706  1   26.82 ? 37  LEU   C O   1 
ATOM   1726 C CB  . LEU   C 1 22 ? 22.626  -14.595 7.578  1   27.95 ? 37  LEU   C CB  1 
ATOM   1727 C CG  . LEU   C 1 22 ? 21.249  -13.884 7.478  1   28.33 ? 37  LEU   C CG  1 
ATOM   1728 C CD1 . LEU   C 1 22 ? 20.139  -14.886 7.223  1   28.14 ? 37  LEU   C CD1 1 
ATOM   1729 C CD2 . LEU   C 1 22 ? 20.933  -13.083 8.743  1   28.96 ? 37  LEU   C CD2 1 
ATOM   1730 N N   . LEU   C 1 23 ? 24.381  -12.748 9.416  1   28.54 ? 38  LEU   C N   1 
ATOM   1731 C CA  . LEU   C 1 23 ? 24.502  -11.657 10.379 1   30    ? 38  LEU   C CA  1 
ATOM   1732 C C   . LEU   C 1 23 ? 25.558  -10.641 9.952  1   31.69 ? 38  LEU   C C   1 
ATOM   1733 O O   . LEU   C 1 23 ? 25.328  -9.433  10.038 1   32.01 ? 38  LEU   C O   1 
ATOM   1734 C CB  . LEU   C 1 23 ? 24.838  -12.21  11.769 1   30.68 ? 38  LEU   C CB  1 
ATOM   1735 C CG  . LEU   C 1 23 ? 23.795  -13.126 12.38  1   32.83 ? 38  LEU   C CG  1 
ATOM   1736 C CD1 . LEU   C 1 23 ? 24.313  -13.721 13.66  1   33.57 ? 38  LEU   C CD1 1 
ATOM   1737 C CD2 . LEU   C 1 23 ? 22.487  -12.394 12.617 1   33.37 ? 38  LEU   C CD2 1 
ATOM   1738 N N   . LYS   C 1 24 ? 26.705  -11.124 9.47   1   32.35 ? 39  LYS   C N   1 
ATOM   1739 C CA  . LYS   C 1 24 ? 27.767  -10.227 9.024  1   33.42 ? 39  LYS   C CA  1 
ATOM   1740 C C   . LYS   C 1 24 ? 27.386  -9.449  7.756  1   32.8  ? 39  LYS   C C   1 
ATOM   1741 O O   . LYS   C 1 24 ? 27.835  -8.317  7.592  1   32.86 ? 39  LYS   C O   1 
ATOM   1742 C CB  . LYS   C 1 24 ? 29.102  -10.975 8.873  1   36.49 ? 39  LYS   C CB  1 
ATOM   1743 C CG  . LYS   C 1 24 ? 29.677  -11.405 10.217 1   41.83 ? 39  LYS   C CG  1 
ATOM   1744 C CD  . LYS   C 1 24 ? 31.016  -12.128 10.049 1   47.22 ? 39  LYS   C CD  1 
ATOM   1745 C CE  . LYS   C 1 24 ? 31.866  -11.985 11.288 1   51.08 ? 39  LYS   C CE  1 
ATOM   1746 N NZ  . LYS   C 1 24 ? 33.234  -12.536 11.096 1   52.91 ? 39  LYS   C NZ  1 
ATOM   1747 N N   . SER   C 1 25 ? 26.495  -10.004 6.912  1   31.98 ? 40  SER   C N   1 
ATOM   1748 C CA  . SER   C 1 25 ? 26.052  -9.306  5.703  1   32.31 ? 40  SER   C CA  1 
ATOM   1749 C C   . SER   C 1 25 ? 25.273  -8.009  5.986  1   33.1  ? 40  SER   C C   1 
ATOM   1750 O O   . SER   C 1 25 ? 25.203  -7.154  5.109  1   32.37 ? 40  SER   C O   1 
ATOM   1751 C CB  . SER   C 1 25 ? 25.266  -10.236 4.781  1   33.01 ? 40  SER   C CB  1 
ATOM   1752 O OG  . SER   C 1 25 ? 23.912  -10.418 5.178  1   34.75 ? 40  SER   C OG  1 
ATOM   1753 N N   . VAL   C 1 26 ? 24.697  -7.844  7.206  1   33.81 ? 41  VAL   C N   1 
ATOM   1754 C CA  . VAL   C 1 26 ? 23.972  -6.604  7.511  1   35.11 ? 41  VAL   C CA  1 
ATOM   1755 C C   . VAL   C 1 26 ? 24.793  -5.618  8.368  1   37.55 ? 41  VAL   C C   1 
ATOM   1756 O O   . VAL   C 1 26 ? 24.23   -4.662  8.901  1   38.32 ? 41  VAL   C O   1 
ATOM   1757 C CB  . VAL   C 1 26 ? 22.554  -6.818  8.089  1   35.4  ? 41  VAL   C CB  1 
ATOM   1758 C CG1 . VAL   C 1 26 ? 21.562  -7.141  6.98   1   35.89 ? 41  VAL   C CG1 1 
ATOM   1759 C CG2 . VAL   C 1 26 ? 22.538  -7.895  9.164  1   35.53 ? 41  VAL   C CG2 1 
ATOM   1760 N N   . GLY   C 1 27 ? 26.109  -5.801  8.433  1   39.03 ? 42  GLY   C N   1 
ATOM   1761 C CA  . GLY   C 1 27 ? 26.968  -4.879  9.164  1   40.84 ? 42  GLY   C CA  1 
ATOM   1762 C C   . GLY   C 1 27 ? 27.327  -5.272  10.583 1   42.6  ? 42  GLY   C C   1 
ATOM   1763 O O   . GLY   C 1 27 ? 27.997  -4.495  11.261 1   43.46 ? 42  GLY   C O   1 
ATOM   1764 N N   . ALA   C 1 28 ? 26.873  -6.442  11.071 1   43.21 ? 43  ALA   C N   1 
ATOM   1765 C CA  . ALA   C 1 28 ? 27.299  -6.908  12.402 1   45.08 ? 43  ALA   C CA  1 
ATOM   1766 C C   . ALA   C 1 28 ? 28.74   -7.41   12.185 1   46.93 ? 43  ALA   C C   1 
ATOM   1767 O O   . ALA   C 1 28 ? 28.996  -8.093  11.182 1   48.32 ? 43  ALA   C O   1 
ATOM   1768 C CB  . ALA   C 1 28 ? 26.413  -8.04   12.885 1   45.19 ? 43  ALA   C CB  1 
ATOM   1769 N N   . GLN   C 1 29 ? 29.693  -6.993  13.025 1   46.75 ? 44  GLN   C N   1 
ATOM   1770 C CA  . GLN   C 1 29 ? 31.098  -7.317  12.752 1   47.64 ? 44  GLN   C CA  1 
ATOM   1771 C C   . GLN   C 1 29 ? 31.76   -8.234  13.766 1   47.39 ? 44  GLN   C C   1 
ATOM   1772 O O   . GLN   C 1 29 ? 32.996  -8.271  13.838 1   48.96 ? 44  GLN   C O   1 
ATOM   1773 C CB  . GLN   C 1 29 ? 31.911  -6.021  12.592 1   50.33 ? 44  GLN   C CB  1 
ATOM   1774 C CG  . GLN   C 1 29 ? 31.284  -5.021  11.619 1   55.43 ? 44  GLN   C CG  1 
ATOM   1775 C CD  . GLN   C 1 29 ? 32.146  -3.811  11.358 1   61.58 ? 44  GLN   C CD  1 
ATOM   1776 O OE1 . GLN   C 1 29 ? 33.254  -3.915  10.82  1   64.61 ? 44  GLN   C OE1 1 
ATOM   1777 N NE2 . GLN   C 1 29 ? 31.644  -2.632  11.705 1   61.69 ? 44  GLN   C NE2 1 
ATOM   1778 N N   . LYS   C 1 30 ? 30.967  -9.007  14.507 1   44.99 ? 45  LYS   C N   1 
ATOM   1779 C CA  . LYS   C 1 30 ? 31.532  -9.877  15.524 1   43.28 ? 45  LYS   C CA  1 
ATOM   1780 C C   . LYS   C 1 30 ? 31.176  -11.356 15.33  1   41.52 ? 45  LYS   C C   1 
ATOM   1781 O O   . LYS   C 1 30 ? 30.476  -11.705 14.384 1   42.04 ? 45  LYS   C O   1 
ATOM   1782 C CB  . LYS   C 1 30 ? 31.16   -9.36   16.918 1   44.32 ? 45  LYS   C CB  1 
ATOM   1783 C CG  . LYS   C 1 30 ? 29.687  -9.085  17.099 1   47.04 ? 45  LYS   C CG  1 
ATOM   1784 C CD  . LYS   C 1 30 ? 29.479  -8.501  18.466 1   50.9  ? 45  LYS   C CD  1 
ATOM   1785 C CE  . LYS   C 1 30 ? 28.065  -8.059  18.697 1   52.8  ? 45  LYS   C CE  1 
ATOM   1786 N NZ  . LYS   C 1 30 ? 27.934  -7.416  20.028 1   54.15 ? 45  LYS   C NZ  1 
ATOM   1787 N N   . ASP   C 1 31 ? 31.731  -12.228 16.173 1   39.54 ? 46  ASP   C N   1 
ATOM   1788 C CA  . ASP   C 1 31 ? 31.492  -13.664 16.096 1   38.49 ? 46  ASP   C CA  1 
ATOM   1789 C C   . ASP   C 1 31 ? 30.633  -14.188 17.259 1   35.01 ? 46  ASP   C C   1 
ATOM   1790 O O   . ASP   C 1 31 ? 30.117  -15.296 17.178 1   34.88 ? 46  ASP   C O   1 
ATOM   1791 C CB  . ASP   C 1 31 ? 32.827  -14.417 16.038 1   42    ? 46  ASP   C CB  1 
ATOM   1792 C CG  . ASP   C 1 31 ? 33.662  -14.012 14.838 1   49.76 ? 46  ASP   C CG  1 
ATOM   1793 O OD1 . ASP   C 1 31 ? 33.138  -14.063 13.708 1   50.5  ? 46  ASP   C OD1 1 
ATOM   1794 O OD2 . ASP   C 1 31 ? 34.837  -13.633 15.035 1   53.74 ? 46  ASP   C OD2 1 
ATOM   1795 N N   . THR   C 1 32 ? 30.499  -13.419 18.332 1   32.78 ? 47  THR   C N   1 
ATOM   1796 C CA  . THR   C 1 32 ? 29.678  -13.801 19.47  1   32.25 ? 47  THR   C CA  1 
ATOM   1797 C C   . THR   C 1 32 ? 28.539  -12.796 19.601 1   30.72 ? 47  THR   C C   1 
ATOM   1798 O O   . THR   C 1 32 ? 28.751  -11.584 19.471 1   30.92 ? 47  THR   C O   1 
ATOM   1799 C CB  . THR   C 1 32 ? 30.528  -13.9   20.732 1   34.57 ? 47  THR   C CB  1 
ATOM   1800 O OG1 . THR   C 1 32 ? 31.637  -14.752 20.439 1   37.03 ? 47  THR   C OG1 1 
ATOM   1801 C CG2 . THR   C 1 32 ? 29.761  -14.469 21.907 1   34.83 ? 47  THR   C CG2 1 
ATOM   1802 N N   . TYR   C 1 33 ? 27.334  -13.288 19.802 1   29.44 ? 48  TYR   C N   1 
ATOM   1803 C CA  . TYR   C 1 33 ? 26.153  -12.422 19.876 1   28.26 ? 48  TYR   C CA  1 
ATOM   1804 C C   . TYR   C 1 33 ? 25.256  -12.785 21.036 1   27.14 ? 48  TYR   C C   1 
ATOM   1805 O O   . TYR   C 1 33 ? 25.263  -13.934 21.454 1   27.54 ? 48  TYR   C O   1 
ATOM   1806 C CB  . TYR   C 1 33 ? 25.3    -12.635 18.605 1   28.3  ? 48  TYR   C CB  1 
ATOM   1807 C CG  . TYR   C 1 33 ? 25.953  -12.19  17.316 1   30.53 ? 48  TYR   C CG  1 
ATOM   1808 C CD1 . TYR   C 1 33 ? 26.846  -13.012 16.647 1   31.7  ? 48  TYR   C CD1 1 
ATOM   1809 C CD2 . TYR   C 1 33 ? 25.633  -10.97  16.736 1   32.38 ? 48  TYR   C CD2 1 
ATOM   1810 C CE1 . TYR   C 1 33 ? 27.446  -12.612 15.459 1   33.06 ? 48  TYR   C CE1 1 
ATOM   1811 C CE2 . TYR   C 1 33 ? 26.234  -10.555 15.556 1   33.54 ? 48  TYR   C CE2 1 
ATOM   1812 C CZ  . TYR   C 1 33 ? 27.134  -11.383 14.915 1   34.43 ? 48  TYR   C CZ  1 
ATOM   1813 O OH  . TYR   C 1 33 ? 27.738  -10.985 13.747 1   36.26 ? 48  TYR   C OH  1 
ATOM   1814 N N   . THR   C 1 34 ? 24.399  -11.854 21.491 1   25.4  ? 49  THR   C N   1 
ATOM   1815 C CA  . THR   C 1 34 ? 23.328  -12.256 22.402 1   25.05 ? 49  THR   C CA  1 
ATOM   1816 C C   . THR   C 1 34 ? 22.186  -12.748 21.478 1   24.8  ? 49  THR   C C   1 
ATOM   1817 O O   . THR   C 1 34 ? 22.154  -12.413 20.282 1   24.54 ? 49  THR   C O   1 
ATOM   1818 C CB  . THR   C 1 34 ? 22.837  -11.133 23.309 1   26.13 ? 49  THR   C CB  1 
ATOM   1819 O OG1 . THR   C 1 34 ? 22.28   -10.087 22.526 1   25.77 ? 49  THR   C OG1 1 
ATOM   1820 C CG2 . THR   C 1 34 ? 23.919  -10.611 24.265 1   27.13 ? 49  THR   C CG2 1 
ATOM   1821 N N   . MET   C 1 35 ? 21.234  -13.523 22.019 1   24.29 ? 50  MET   C N   1 
ATOM   1822 C CA  . MET   C 1 35 ? 20.058  -13.937 21.249 1   24.04 ? 50  MET   C CA  1 
ATOM   1823 C C   . MET   C 1 35 ? 19.263  -12.686 20.77  1   22.93 ? 50  MET   C C   1 
ATOM   1824 O O   . MET   C 1 35 ? 18.758  -12.67  19.647 1   22.3  ? 50  MET   C O   1 
ATOM   1825 C CB  . MET   C 1 35 ? 19.171  -14.849 22.087 1   25.23 ? 50  MET   C CB  1 
ATOM   1826 C CG  . MET   C 1 35 ? 19.617  -16.296 22.038 1   29.83 ? 50  MET   C CG  1 
ATOM   1827 S SD  . MET   C 1 35 ? 19.444  -17.049 20.392 1   36.56 ? 50  MET   C SD  1 
ATOM   1828 C CE  . MET   C 1 35 ? 17.786  -16.578 19.935 1   26.81 ? 50  MET   C CE  1 
ATOM   1829 N N   . LYS   C 1 36 ? 19.232  -11.62  21.6   1   22.49 ? 51  LYS   C N   1 
ATOM   1830 C CA  . LYS   C 1 36 ? 18.586  -10.347 21.224 1   22.68 ? 51  LYS   C CA  1 
ATOM   1831 C C   . LYS   C 1 36 ? 19.238  -9.783  19.954 1   21.19 ? 51  LYS   C C   1 
ATOM   1832 O O   . LYS   C 1 36 ? 18.534  -9.431  19.009 1   20.6  ? 51  LYS   C O   1 
ATOM   1833 C CB  . LYS   C 1 36 ? 18.581  -9.322  22.386 1   25.86 ? 51  LYS   C CB  1 
ATOM   1834 C CG  . LYS   C 1 36 ? 18.165  -7.918  21.942 1   32.65 ? 51  LYS   C CG  1 
ATOM   1835 C CD  . LYS   C 1 36 ? 17.372  -7.135  22.977 1   39.59 ? 51  LYS   C CD  1 
ATOM   1836 C CE  . LYS   C 1 36 ? 18.053  -6.907  24.289 1   44.41 ? 51  LYS   C CE  1 
ATOM   1837 N NZ  . LYS   C 1 36 ? 17.275  -5.925  25.116 1   46.95 ? 51  LYS   C NZ  1 
ATOM   1838 N N   . GLU   C 1 37 ? 20.58   -9.76   19.903 1   20.62 ? 52  GLU   C N   1 
ATOM   1839 C CA  . GLU   C 1 37 ? 21.279  -9.296  18.724 1   20.66 ? 52  GLU   C CA  1 
ATOM   1840 C C   . GLU   C 1 37 ? 21.009  -10.168 17.534 1   20.03 ? 52  GLU   C C   1 
ATOM   1841 O O   . GLU   C 1 37 ? 20.775  -9.633  16.465 1   20.26 ? 52  GLU   C O   1 
ATOM   1842 C CB  . GLU   C 1 37 ? 22.792  -9.21   18.966 1   23.44 ? 52  GLU   C CB  1 
ATOM   1843 C CG  . GLU   C 1 37 ? 23.133  -8.113  19.94  1   28.18 ? 52  GLU   C CG  1 
ATOM   1844 C CD  . GLU   C 1 37 ? 24.6    -8.138  20.306 1   33.48 ? 52  GLU   C CD  1 
ATOM   1845 O OE1 . GLU   C 1 37 ? 25.23   -7.06   20.334 1   34.39 ? 52  GLU   C OE1 1 
ATOM   1846 O OE2 . GLU   C 1 37 ? 25.124  -9.245  20.551 1   33.55 ? 52  GLU   C OE2 1 
ATOM   1847 N N   . VAL   C 1 38 ? 20.978  -11.508 17.695 1   19.34 ? 53  VAL   C N   1 
ATOM   1848 C CA  . VAL   C 1 38 ? 20.668  -12.391 16.562 1   19.38 ? 53  VAL   C CA  1 
ATOM   1849 C C   . VAL   C 1 38 ? 19.278  -12.031 15.941 1   20.27 ? 53  VAL   C C   1 
ATOM   1850 O O   . VAL   C 1 38 ? 19.155  -11.898 14.725 1   20.13 ? 53  VAL   C O   1 
ATOM   1851 C CB  . VAL   C 1 38 ? 20.726  -13.905 16.967 1   19.47 ? 53  VAL   C CB  1 
ATOM   1852 C CG1 . VAL   C 1 38 ? 20.219  -14.777 15.828 1   19.83 ? 53  VAL   C CG1 1 
ATOM   1853 C CG2 . VAL   C 1 38 ? 22.147  -14.308 17.332 1   20.71 ? 53  VAL   C CG2 1 
ATOM   1854 N N   . LEU   C 1 39 ? 18.248  -11.875 16.798 1   20.72 ? 54  LEU   C N   1 
ATOM   1855 C CA  . LEU   C 1 39 ? 16.899  -11.511 16.354 1   20.62 ? 54  LEU   C CA  1 
ATOM   1856 C C   . LEU   C 1 39 ? 16.91   -10.14  15.666 1   20.29 ? 54  LEU   C C   1 
ATOM   1857 O O   . LEU   C 1 39 ? 16.253  -9.954  14.638 1   19.44 ? 54  LEU   C O   1 
ATOM   1858 C CB  . LEU   C 1 39 ? 15.925  -11.481 17.55  1   20.94 ? 54  LEU   C CB  1 
ATOM   1859 C CG  . LEU   C 1 39 ? 15.638  -12.855 18.211 1   23.15 ? 54  LEU   C CG  1 
ATOM   1860 C CD1 . LEU   C 1 39 ? 14.702  -12.679 19.426 1   24.03 ? 54  LEU   C CD1 1 
ATOM   1861 C CD2 . LEU   C 1 39 ? 15.056  -13.82  17.216 1   24.67 ? 54  LEU   C CD2 1 
ATOM   1862 N N   . PHE   C 1 40 ? 17.643  -9.194  16.241 1   20.59 ? 55  PHE   C N   1 
ATOM   1863 C CA  . PHE   C 1 40 ? 17.745  -7.839  15.686 1   21.72 ? 55  PHE   C CA  1 
ATOM   1864 C C   . PHE   C 1 40 ? 18.342  -7.853  14.261 1   22.55 ? 55  PHE   C C   1 
ATOM   1865 O O   . PHE   C 1 40 ? 17.794  -7.237  13.36  1   22.82 ? 55  PHE   C O   1 
ATOM   1866 C CB  . PHE   C 1 40 ? 18.624  -6.973  16.596 1   21.4  ? 55  PHE   C CB  1 
ATOM   1867 C CG  . PHE   C 1 40 ? 18.698  -5.526  16.164 1   21.84 ? 55  PHE   C CG  1 
ATOM   1868 C CD1 . PHE   C 1 40 ? 17.683  -4.643  16.482 1   21.84 ? 55  PHE   C CD1 1 
ATOM   1869 C CD2 . PHE   C 1 40 ? 19.727  -5.079  15.358 1   23.45 ? 55  PHE   C CD2 1 
ATOM   1870 C CE1 . PHE   C 1 40 ? 17.747  -3.315  16.081 1   22.56 ? 55  PHE   C CE1 1 
ATOM   1871 C CE2 . PHE   C 1 40 ? 19.795  -3.747  14.963 1   24.02 ? 55  PHE   C CE2 1 
ATOM   1872 C CZ  . PHE   C 1 40 ? 18.799  -2.877  15.316 1   22.79 ? 55  PHE   C CZ  1 
ATOM   1873 N N   . TYR   C 1 41 ? 19.493  -8.524  14.08  1   22.38 ? 56  TYR   C N   1 
ATOM   1874 C CA  . TYR   C 1 41 ? 20.155  -8.568  12.782 1   22.42 ? 56  TYR   C CA  1 
ATOM   1875 C C   . TYR   C 1 41 ? 19.401  -9.43   11.781 1   22.02 ? 56  TYR   C C   1 
ATOM   1876 O O   . TYR   C 1 41 ? 19.344  -9.061  10.608 1   21.96 ? 56  TYR   C O   1 
ATOM   1877 C CB  . TYR   C 1 41 ? 21.625  -8.964  12.931 1   22.88 ? 56  TYR   C CB  1 
ATOM   1878 C CG  . TYR   C 1 41 ? 22.434  -7.905  13.637 1   24.92 ? 56  TYR   C CG  1 
ATOM   1879 C CD1 . TYR   C 1 41 ? 22.455  -6.6    13.175 1   26.96 ? 56  TYR   C CD1 1 
ATOM   1880 C CD2 . TYR   C 1 41 ? 23.135  -8.195  14.798 1   26.71 ? 56  TYR   C CD2 1 
ATOM   1881 C CE1 . TYR   C 1 41 ? 23.199  -5.622  13.816 1   29.03 ? 56  TYR   C CE1 1 
ATOM   1882 C CE2 . TYR   C 1 41 ? 23.88   -7.225  15.452 1   28.32 ? 56  TYR   C CE2 1 
ATOM   1883 C CZ  . TYR   C 1 41 ? 23.887  -5.931  14.973 1   29.91 ? 56  TYR   C CZ  1 
ATOM   1884 O OH  . TYR   C 1 41 ? 24.634  -4.969  15.601 1   31.95 ? 56  TYR   C OH  1 
ATOM   1885 N N   . LEU   C 1 42 ? 18.743  -10.518 12.235 1   21.62 ? 57  LEU   C N   1 
ATOM   1886 C CA  . LEU   C 1 42 ? 17.908  -11.333 11.356 1   22.72 ? 57  LEU   C CA  1 
ATOM   1887 C C   . LEU   C 1 42 ? 16.717  -10.502 10.86  1   21.92 ? 57  LEU   C C   1 
ATOM   1888 O O   . LEU   C 1 42 ? 16.396  -10.531 9.675  1   21.48 ? 57  LEU   C O   1 
ATOM   1889 C CB  . LEU   C 1 42 ? 17.4    -12.589 12.101 1   23.76 ? 57  LEU   C CB  1 
ATOM   1890 C CG  . LEU   C 1 42 ? 16.579  -13.559 11.27  1   26.35 ? 57  LEU   C CG  1 
ATOM   1891 C CD1 . LEU   C 1 42 ? 17.385  -14.056 10.043 1   27.17 ? 57  LEU   C CD1 1 
ATOM   1892 C CD2 . LEU   C 1 42 ? 16.15   -14.753 12.109 1   27.16 ? 57  LEU   C CD2 1 
ATOM   1893 N N   . GLY   C 1 43 ? 16.11   -9.707  11.746 1   21.68 ? 58  GLY   C N   1 
ATOM   1894 C CA  . GLY   C 1 43 ? 15.021  -8.813  11.344 1   21.62 ? 58  GLY   C CA  1 
ATOM   1895 C C   . GLY   C 1 43 ? 15.5    -7.779  10.333 1   21.75 ? 58  GLY   C C   1 
ATOM   1896 O O   . GLY   C 1 43 ? 14.821  -7.511  9.331  1   21.47 ? 58  GLY   C O   1 
ATOM   1897 N N   . GLN   C 1 44 ? 16.72   -7.262  10.532 1   21.7  ? 59  GLN   C N   1 
ATOM   1898 C CA  . GLN   C 1 44 ? 17.324  -6.297  9.608  1   22.5  ? 59  GLN   C CA  1 
ATOM   1899 C C   . GLN   C 1 44 ? 17.567  -6.899  8.25   1   22.47 ? 59  GLN   C C   1 
ATOM   1900 O O   . GLN   C 1 44 ? 17.4    -6.227  7.25   1   22.58 ? 59  GLN   C O   1 
ATOM   1901 C CB  . GLN   C 1 44 ? 18.679  -5.803  10.122 1   25.61 ? 59  GLN   C CB  1 
ATOM   1902 C CG  . GLN   C 1 44 ? 18.584  -4.721  11.154 1   27.29 ? 59  GLN   C CG  1 
ATOM   1903 C CD  . GLN   C 1 44 ? 19.822  -3.858  11.179 1   29.89 ? 59  GLN   C CD  1 
ATOM   1904 O OE1 . GLN   C 1 44 ? 20.932  -4.263  10.791 1   31.14 ? 59  GLN   C OE1 1 
ATOM   1905 N NE2 . GLN   C 1 44 ? 19.648  -2.648  11.639 1   28.83 ? 59  GLN   C NE2 1 
ATOM   1906 N N   . TYR   C 1 45 ? 17.996  -8.16   8.213  1   22.59 ? 60  TYR   C N   1 
ATOM   1907 C CA  . TYR   C 1 45 ? 18.267  -8.877  6.973  1   22.74 ? 60  TYR   C CA  1 
ATOM   1908 C C   . TYR   C 1 45 ? 16.966  -9.06   6.169  1   22.68 ? 60  TYR   C C   1 
ATOM   1909 O O   . TYR   C 1 45 ? 16.922  -8.756  4.98   1   22.46 ? 60  TYR   C O   1 
ATOM   1910 C CB  . TYR   C 1 45 ? 18.883  -10.227 7.318  1   23.03 ? 60  TYR   C CB  1 
ATOM   1911 C CG  . TYR   C 1 45 ? 19.214  -11.063 6.104  1   24.91 ? 60  TYR   C CG  1 
ATOM   1912 C CD1 . TYR   C 1 45 ? 20.427  -10.914 5.447  1   26.15 ? 60  TYR   C CD1 1 
ATOM   1913 C CD2 . TYR   C 1 45 ? 18.324  -12.023 5.627  1   25.98 ? 60  TYR   C CD2 1 
ATOM   1914 C CE1 . TYR   C 1 45 ? 20.769  -11.728 4.376  1   27.53 ? 60  TYR   C CE1 1 
ATOM   1915 C CE2 . TYR   C 1 45 ? 18.644  -12.823 4.532  1   26.89 ? 60  TYR   C CE2 1 
ATOM   1916 C CZ  . TYR   C 1 45 ? 19.877  -12.677 3.919  1   28.68 ? 60  TYR   C CZ  1 
ATOM   1917 O OH  . TYR   C 1 45 ? 20.227  -13.417 2.817  1   30.66 ? 60  TYR   C OH  1 
ATOM   1918 N N   . ILE   C 1 46 ? 15.896  -9.533  6.823  1   22.46 ? 61  ILE   C N   1 
ATOM   1919 C CA  . ILE   C 1 46 ? 14.609  -9.715  6.155  1   22.4  ? 61  ILE   C CA  1 
ATOM   1920 C C   . ILE   C 1 46 ? 14.076  -8.362  5.634  1   22.98 ? 61  ILE   C C   1 
ATOM   1921 O O   . ILE   C 1 46 ? 13.538  -8.288  4.522  1   22.51 ? 61  ILE   C O   1 
ATOM   1922 C CB  . ILE   C 1 46 ? 13.604  -10.391 7.122  1   21.97 ? 61  ILE   C CB  1 
ATOM   1923 C CG1 . ILE   C 1 46 ? 14.051  -11.845 7.452  1   22.82 ? 61  ILE   C CG1 1 
ATOM   1924 C CG2 . ILE   C 1 46 ? 12.179  -10.352 6.548  1   22.06 ? 61  ILE   C CG2 1 
ATOM   1925 C CD1 . ILE   C 1 46 ? 13.42   -12.405 8.735  1   23.09 ? 61  ILE   C CD1 1 
ATOM   1926 N N   . MET   C 1 47 ? 14.231  -7.297  6.432  1   23.33 ? 62  MET   C N   1 
ATOM   1927 C CA  . MET   C 1 47 ? 13.77   -5.96   6.02   1   24.47 ? 62  MET   C CA  1 
ATOM   1928 C C   . MET   C 1 47 ? 14.604  -5.377  4.878  1   24.66 ? 62  MET   C C   1 
ATOM   1929 O O   . MET   C 1 47 ? 14.035  -4.848  3.913  1   25.11 ? 62  MET   C O   1 
ATOM   1930 C CB  . MET   C 1 47 ? 13.792  -4.995  7.218  1   26.34 ? 62  MET   C CB  1 
ATOM   1931 C CG  . MET   C 1 47 ? 12.471  -4.888  7.925  1   31.48 ? 62  MET   C CG  1 
ATOM   1932 S SD  . MET   C 1 47 ? 11.327  -3.928  6.913  1   37.97 ? 62  MET   C SD  1 
ATOM   1933 C CE  . MET   C 1 47 ? 11.644  -2.301  7.524  1   40.62 ? 62  MET   C CE  1 
ATOM   1934 N N   . THR   C 1 48 ? 15.945  -5.483  4.949  1   24    ? 63  THR   C N   1 
ATOM   1935 C CA  . THR   C 1 48 ? 16.819  -4.945  3.895  1   24.93 ? 63  THR   C CA  1 
ATOM   1936 C C   . THR   C 1 48 ? 16.589  -5.668  2.553  1   24.96 ? 63  THR   C C   1 
ATOM   1937 O O   . THR   C 1 48 ? 16.544  -5.024  1.51   1   25.76 ? 63  THR   C O   1 
ATOM   1938 C CB  . THR   C 1 48 ? 18.292  -4.97   4.346  1   27.37 ? 63  THR   C CB  1 
ATOM   1939 O OG1 . THR   C 1 48 ? 18.406  -4.144  5.523  1   29.28 ? 63  THR   C OG1 1 
ATOM   1940 C CG2 . THR   C 1 48 ? 19.237  -4.436  3.276  1   28.09 ? 63  THR   C CG2 1 
ATOM   1941 N N   . LYS   C 1 49 ? 16.458  -6.999  2.584  1   23.79 ? 64  LYS   C N   1 
ATOM   1942 C CA  . LYS   C 1 49 ? 16.168  -7.766  1.378  1   23.73 ? 64  LYS   C CA  1 
ATOM   1943 C C   . LYS   C 1 49 ? 14.67   -7.873  1.053  1   24.14 ? 64  LYS   C C   1 
ATOM   1944 O O   . LYS   C 1 49 ? 14.318  -8.598  0.132  1   25.27 ? 64  LYS   C O   1 
ATOM   1945 C CB  . LYS   C 1 49 ? 16.798  -9.169  1.413  1   23.52 ? 64  LYS   C CB  1 
ATOM   1946 C CG  . LYS   C 1 49 ? 18.325  -9.13   1.296  1   27.5  ? 64  LYS   C CG  1 
ATOM   1947 C CD  . LYS   C 1 49 ? 18.898  -10.518 1.268  1   30.03 ? 64  LYS   C CD  1 
ATOM   1948 C CE  . LYS   C 1 49 ? 19.667  -10.766 0.006  1   31.91 ? 64  LYS   C CE  1 
ATOM   1949 N NZ  . LYS   C 1 49 ? 20.413  -12.038 0.068  1   33    ? 64  LYS   C NZ  1 
ATOM   1950 N N   A ARG   C 1 50 ? 13.796  -7.177  1.804  0.5 23.93 ? 65  ARG   C N   1 
ATOM   1951 N N   B ARG   C 1 50 ? 13.797  -7.181  1.811  0.5 24.2  ? 65  ARG   C N   1 
ATOM   1952 C CA  A ARG   C 1 50 ? 12.335  -7.17   1.633  0.5 24.16 ? 65  ARG   C CA  1 
ATOM   1953 C CA  B ARG   C 1 50 ? 12.339  -7.154  1.635  0.5 24.72 ? 65  ARG   C CA  1 
ATOM   1954 C C   A ARG   C 1 50 ? 11.76   -8.542  1.295  0.5 23.74 ? 65  ARG   C C   1 
ATOM   1955 C C   B ARG   C 1 50 ? 11.755  -8.531  1.302  0.5 24    ? 65  ARG   C C   1 
ATOM   1956 O O   A ARG   C 1 50 ? 11.087  -8.714  0.28   0.5 23.29 ? 65  ARG   C O   1 
ATOM   1957 O O   B ARG   C 1 50 ? 11.071  -8.696  0.293  0.5 23.56 ? 65  ARG   C O   1 
ATOM   1958 C CB  A ARG   C 1 50 ? 11.89   -6.112  0.617  0.5 25.72 ? 65  ARG   C CB  1 
ATOM   1959 C CB  B ARG   C 1 50 ? 11.943  -6.11   0.581  0.5 27.08 ? 65  ARG   C CB  1 
ATOM   1960 C CG  A ARG   C 1 50 ? 11.669  -4.779  1.291  0.5 28.56 ? 65  ARG   C CG  1 
ATOM   1961 C CG  B ARG   C 1 50 ? 12.298  -4.699  1.013  0.5 31.63 ? 65  ARG   C CG  1 
ATOM   1962 C CD  A ARG   C 1 50 ? 11.103  -3.732  0.374  0.5 30.38 ? 65  ARG   C CD  1 
ATOM   1963 C CD  B ARG   C 1 50 ? 12.14   -3.714  -0.114 0.5 36.12 ? 65  ARG   C CD  1 
ATOM   1964 N NE  A ARG   C 1 50 ? 9.64    -3.707  0.388  0.5 31.16 ? 65  ARG   C NE  1 
ATOM   1965 N NE  B ARG   C 1 50 ? 13.179  -2.678  -0.094 0.5 39.44 ? 65  ARG   C NE  1 
ATOM   1966 C CZ  A ARG   C 1 50 ? 8.911   -2.597  0.409  0.5 30.99 ? 65  ARG   C CZ  1 
ATOM   1967 C CZ  B ARG   C 1 50 ? 12.994  -1.436  0.343  0.5 40.15 ? 65  ARG   C CZ  1 
ATOM   1968 N NH1 A ARG   C 1 50 ? 9.5     -1.408  0.461  0.5 29.7  ? 65  ARG   C NH1 1 
ATOM   1969 N NH1 B ARG   C 1 50 ? 11.803  -1.049  0.773  0.5 39.7  ? 65  ARG   C NH1 1 
ATOM   1970 N NH2 A ARG   C 1 50 ? 7.59    -2.666  0.408  0.5 30.51 ? 65  ARG   C NH2 1 
ATOM   1971 N NH2 B ARG   C 1 50 ? 13.992  -0.563  0.322  0.5 39.83 ? 65  ARG   C NH2 1 
ATOM   1972 N N   . LEU   C 1 51 ? 12.095  -9.526  2.121  1   23.42 ? 66  LEU   C N   1 
ATOM   1973 C CA  . LEU   C 1 51 ? 11.68   -10.899 1.882  1   23.3  ? 66  LEU   C CA  1 
ATOM   1974 C C   . LEU   C 1 51 ? 10.211  -11.194 2.225  1   24.79 ? 66  LEU   C C   1 
ATOM   1975 O O   . LEU   C 1 51 ? 9.681   -12.218 1.818  1   25.72 ? 66  LEU   C O   1 
ATOM   1976 C CB  . LEU   C 1 51 ? 12.624  -11.838 2.627  1   22.81 ? 66  LEU   C CB  1 
ATOM   1977 C CG  . LEU   C 1 51 ? 14.096  -11.736 2.236  1   23.77 ? 66  LEU   C CG  1 
ATOM   1978 C CD1 . LEU   C 1 51 ? 14.957  -12.626 3.118  1   24.55 ? 66  LEU   C CD1 1 
ATOM   1979 C CD2 . LEU   C 1 51 ? 14.3    -12.022 0.725  1   23.54 ? 66  LEU   C CD2 1 
ATOM   1980 N N   . TYR   C 1 52 ? 9.537   -10.273 2.902  1   25    ? 67  TYR   C N   1 
ATOM   1981 C CA  . TYR   C 1 52 ? 8.151   -10.468 3.289  1   24.62 ? 67  TYR   C CA  1 
ATOM   1982 C C   . TYR   C 1 52 ? 7.159   -10.26  2.142  1   24.92 ? 67  TYR   C C   1 
ATOM   1983 O O   . TYR   C 1 52 ? 7.397   -9.461  1.223  1   25.6  ? 67  TYR   C O   1 
ATOM   1984 C CB  . TYR   C 1 52 ? 7.797   -9.568  4.476  1   23.69 ? 67  TYR   C CB  1 
ATOM   1985 C CG  . TYR   C 1 52 ? 8.134   -8.11   4.266  1   24.29 ? 67  TYR   C CG  1 
ATOM   1986 C CD1 . TYR   C 1 52 ? 9.385   -7.612  4.603  1   24.55 ? 67  TYR   C CD1 1 
ATOM   1987 C CD2 . TYR   C 1 52 ? 7.198   -7.225  3.749  1   26.07 ? 67  TYR   C CD2 1 
ATOM   1988 C CE1 . TYR   C 1 52 ? 9.703   -6.276  4.419  1   26.89 ? 67  TYR   C CE1 1 
ATOM   1989 C CE2 . TYR   C 1 52 ? 7.503   -5.88   3.561  1   27.41 ? 67  TYR   C CE2 1 
ATOM   1990 C CZ  . TYR   C 1 52 ? 8.763   -5.411  3.894  1   28.71 ? 67  TYR   C CZ  1 
ATOM   1991 O OH  . TYR   C 1 52 ? 9.096   -4.086  3.724  1   31.8  ? 67  TYR   C OH  1 
ATOM   1992 N N   . ASP   C 1 53 ? 6.026   -10.948 2.236  1   24.55 ? 68  ASP   C N   1 
ATOM   1993 C CA  . ASP   C 1 53 ? 4.897   -10.796 1.315  1   24.81 ? 68  ASP   C CA  1 
ATOM   1994 C C   . ASP   C 1 53 ? 4.314   -9.421  1.609  1   25.24 ? 68  ASP   C C   1 
ATOM   1995 O O   . ASP   C 1 53 ? 3.944   -9.146  2.735  1   24.4  ? 68  ASP   C O   1 
ATOM   1996 C CB  . ASP   C 1 53 ? 3.858   -11.885 1.596  1   26.74 ? 68  ASP   C CB  1 
ATOM   1997 C CG  . ASP   C 1 53 ? 2.701   -11.923 0.607  1   31.88 ? 68  ASP   C CG  1 
ATOM   1998 O OD1 . ASP   C 1 53 ? 1.925   -10.956 0.568  1   32.32 ? 68  ASP   C OD1 1 
ATOM   1999 O OD2 . ASP   C 1 53 ? 2.586   -12.916 -0.122 1   34.23 ? 68  ASP   C OD2 1 
ATOM   2000 N N   . GLU   C 1 54 ? 4.268   -8.541  0.623  1   26.65 ? 69  GLU   C N   1 
ATOM   2001 C CA  . GLU   C 1 54 ? 3.771   -7.174  0.785  1   28.3  ? 69  GLU   C CA  1 
ATOM   2002 C C   . GLU   C 1 54 ? 2.326   -7.087  1.356  1   29.95 ? 69  GLU   C C   1 
ATOM   2003 O O   . GLU   C 1 54 ? 1.997   -6.138  2.073  1   30.07 ? 69  GLU   C O   1 
ATOM   2004 C CB  . GLU   C 1 54 ? 3.841   -6.464  -0.579 1   30.22 ? 69  GLU   C CB  1 
ATOM   2005 C CG  . GLU   C 1 54 ? 3.361   -5.022  -0.572 1   35.41 ? 69  GLU   C CG  1 
ATOM   2006 C CD  . GLU   C 1 54 ? 4.266   -4.053  0.156  1   44.28 ? 69  GLU   C CD  1 
ATOM   2007 O OE1 . GLU   C 1 54 ? 5.425   -4.421  0.462  1   43.99 ? 69  GLU   C OE1 1 
ATOM   2008 O OE2 . GLU   C 1 54 ? 3.815   -2.912  0.412  1   49.74 ? 69  GLU   C OE2 1 
ATOM   2009 N N   . LYS   C 1 55 ? 1.484   -8.079  1.061  1   30.86 ? 70  LYS   C N   1 
ATOM   2010 C CA  . LYS   C 1 55 ? 0.097   -8.063  1.527  1   31.56 ? 70  LYS   C CA  1 
ATOM   2011 C C   . LYS   C 1 55 ? -0.103  -8.777  2.859  1   31.5  ? 70  LYS   C C   1 
ATOM   2012 O O   . LYS   C 1 55 ? -1.025  -8.425  3.597  1   32.19 ? 70  LYS   C O   1 
ATOM   2013 C CB  . LYS   C 1 55 ? -0.846  -8.611  0.447  1   34.21 ? 70  LYS   C CB  1 
ATOM   2014 C CG  . LYS   C 1 55 ? -0.874  -7.741  -0.802 1   39.91 ? 70  LYS   C CG  1 
ATOM   2015 C CD  . LYS   C 1 55 ? -2.105  -8.049  -1.658 1   46.42 ? 70  LYS   C CD  1 
ATOM   2016 C CE  . LYS   C 1 55 ? -2.227  -7.098  -2.828 1   51.23 ? 70  LYS   C CE  1 
ATOM   2017 N NZ  . LYS   C 1 55 ? -3.405  -7.42   -3.681 1   54.34 ? 70  LYS   C NZ  1 
ATOM   2018 N N   . GLN   C 1 56 ? 0.746   -9.768  3.17   1   30.5  ? 71  GLN   C N   1 
ATOM   2019 C CA  . GLN   C 1 56 ? 0.7     -10.55  4.424  1   30.27 ? 71  GLN   C CA  1 
ATOM   2020 C C   . GLN   C 1 56 ? 2.13    -10.588 4.96   1   27.95 ? 71  GLN   C C   1 
ATOM   2021 O O   . GLN   C 1 56 ? 2.845   -11.579 4.805  1   27.18 ? 71  GLN   C O   1 
ATOM   2022 C CB  . GLN   C 1 56 ? 0.208   -11.97  4.139  1   33.77 ? 71  GLN   C CB  1 
ATOM   2023 C CG  . GLN   C 1 56 ? -1.265  -12.021 3.737  1   40.28 ? 71  GLN   C CG  1 
ATOM   2024 C CD  . GLN   C 1 56 ? -1.664  -13.419 3.35   1   47.62 ? 71  GLN   C CD  1 
ATOM   2025 O OE1 . GLN   C 1 56 ? -1.531  -13.82  2.184  1   50.24 ? 71  GLN   C OE1 1 
ATOM   2026 N NE2 . GLN   C 1 56 ? -2.14   -14.198 4.325  1   47.85 ? 71  GLN   C NE2 1 
ATOM   2027 N N   . GLN   C 1 57 ? 2.545   -9.477  5.555  1   27.22 ? 72  GLN   C N   1 
ATOM   2028 C CA  . GLN   C 1 57 ? 3.923   -9.196  5.957  1   26.08 ? 72  GLN   C CA  1 
ATOM   2029 C C   . GLN   C 1 57 ? 4.5     -10.09  7.064  1   25.8  ? 72  GLN   C C   1 
ATOM   2030 O O   . GLN   C 1 57 ? 5.681   -9.968  7.376  1   25.54 ? 72  GLN   C O   1 
ATOM   2031 C CB  . GLN   C 1 57 ? 4.082   -7.715  6.29   1   25.64 ? 72  GLN   C CB  1 
ATOM   2032 C CG  . GLN   C 1 57 ? 3.592   -6.815  5.151  1   26.67 ? 72  GLN   C CG  1 
ATOM   2033 C CD  . GLN   C 1 57 ? 4.274   -5.468  5.08   1   28.21 ? 72  GLN   C CD  1 
ATOM   2034 O OE1 . GLN   C 1 57 ? 5.085   -5.102  5.934  1   27.42 ? 72  GLN   C OE1 1 
ATOM   2035 N NE2 . GLN   C 1 57 ? 3.993   -4.702  4.02   1   27.91 ? 72  GLN   C NE2 1 
ATOM   2036 N N   . HIS   C 1 58 ? 3.714   -11.047 7.594  1   25.58 ? 73  HIS   C N   1 
ATOM   2037 C CA  . HIS   C 1 58 ? 4.251   -12.053 8.503  1   24.69 ? 73  HIS   C CA  1 
ATOM   2038 C C   . HIS   C 1 58 ? 4.809   -13.248 7.675  1   25.27 ? 73  HIS   C C   1 
ATOM   2039 O O   . HIS   C 1 58 ? 5.55    -14.055 8.201  1   24.78 ? 73  HIS   C O   1 
ATOM   2040 C CB  . HIS   C 1 58 ? 3.164   -12.537 9.492  1   24.81 ? 73  HIS   C CB  1 
ATOM   2041 C CG  . HIS   C 1 58 ? 2.011   -13.204 8.818  1   27.34 ? 73  HIS   C CG  1 
ATOM   2042 N ND1 . HIS   C 1 58 ? 1.978   -14.58  8.635  1   28.81 ? 73  HIS   C ND1 1 
ATOM   2043 C CD2 . HIS   C 1 58 ? 0.878   -12.672 8.314  1   28.26 ? 73  HIS   C CD2 1 
ATOM   2044 C CE1 . HIS   C 1 58 ? 0.826   -14.831 8.038  1   29.21 ? 73  HIS   C CE1 1 
ATOM   2045 N NE2 . HIS   C 1 58 ? 0.141   -13.716 7.816  1   29.65 ? 73  HIS   C NE2 1 
ATOM   2046 N N   . ILE   C 1 59 ? 4.474   -13.352 6.378  1   26.11 ? 74  ILE   C N   1 
ATOM   2047 C CA  . ILE   C 1 59 ? 4.969   -14.423 5.521  1   26.99 ? 74  ILE   C CA  1 
ATOM   2048 C C   . ILE   C 1 59 ? 6.286   -13.958 4.933  1   26.68 ? 74  ILE   C C   1 
ATOM   2049 O O   . ILE   C 1 59 ? 6.314   -12.92  4.279  1   26.73 ? 74  ILE   C O   1 
ATOM   2050 C CB  . ILE   C 1 59 ? 3.947   -14.726 4.39   1   28.48 ? 74  ILE   C CB  1 
ATOM   2051 C CG1 . ILE   C 1 59 ? 2.613   -15.228 5.002  1   30.93 ? 74  ILE   C CG1 1 
ATOM   2052 C CG2 . ILE   C 1 59 ? 4.546   -15.751 3.405  1   28.57 ? 74  ILE   C CG2 1 
ATOM   2053 C CD1 . ILE   C 1 59 ? 1.494   -15.601 3.963  1   32.23 ? 74  ILE   C CD1 1 
ATOM   2054 N N   . VAL   C 1 60 ? 7.368   -14.693 5.191  1   25.97 ? 75  VAL   C N   1 
ATOM   2055 C CA  . VAL   C 1 60 ? 8.689   -14.367 4.676  1   25.72 ? 75  VAL   C CA  1 
ATOM   2056 C C   . VAL   C 1 60 ? 9.051   -15.38  3.606  1   27.14 ? 75  VAL   C C   1 
ATOM   2057 O O   . VAL   C 1 60 ? 8.909   -16.578 3.822  1   27.2  ? 75  VAL   C O   1 
ATOM   2058 C CB  . VAL   C 1 60 ? 9.727   -14.359 5.829  1   25.97 ? 75  VAL   C CB  1 
ATOM   2059 C CG1 . VAL   C 1 60 ? 11.149  -14.104 5.305  1   25.74 ? 75  VAL   C CG1 1 
ATOM   2060 C CG2 . VAL   C 1 60 ? 9.335   -13.333 6.889  1   26.86 ? 75  VAL   C CG2 1 
ATOM   2061 N N   . TYR   C 1 61 ? 9.478   -14.907 2.446  1   27.58 ? 76  TYR   C N   1 
ATOM   2062 C CA  . TYR   C 1 61 ? 9.9     -15.78  1.356  1   29.09 ? 76  TYR   C CA  1 
ATOM   2063 C C   . TYR   C 1 61 ? 11.409  -15.839 1.359  1   30.03 ? 76  TYR   C C   1 
ATOM   2064 O O   . TYR   C 1 61 ? 12.069  -14.797 1.433  1   30.86 ? 76  TYR   C O   1 
ATOM   2065 C CB  . TYR   C 1 61 ? 9.413   -15.245 0.015  1   29.35 ? 76  TYR   C CB  1 
ATOM   2066 C CG  . TYR   C 1 61 ? 7.908   -15.222 -0.079 1   30.14 ? 76  TYR   C CG  1 
ATOM   2067 C CD1 . TYR   C 1 61 ? 7.174   -16.399 -0.053 1   31.4  ? 76  TYR   C CD1 1 
ATOM   2068 C CD2 . TYR   C 1 61 ? 7.218   -14.029 -0.204 1   30.56 ? 76  TYR   C CD2 1 
ATOM   2069 C CE1 . TYR   C 1 61 ? 5.788   -16.388 -0.145 1   32.29 ? 76  TYR   C CE1 1 
ATOM   2070 C CE2 . TYR   C 1 61 ? 5.837   -14.007 -0.329 1   31.58 ? 76  TYR   C CE2 1 
ATOM   2071 C CZ  . TYR   C 1 61 ? 5.124   -15.191 -0.283 1   32.83 ? 76  TYR   C CZ  1 
ATOM   2072 O OH  . TYR   C 1 61 ? 3.759   -15.191 -0.38  1   34.83 ? 76  TYR   C OH  1 
ATOM   2073 N N   . CYS   C 1 62 ? 11.964  -17.048 1.314  1   30.1  ? 77  CYS   C N   1 
ATOM   2074 C CA  . CYS   C 1 62 ? 13.406  -17.208 1.369  1   31.03 ? 77  CYS   C CA  1 
ATOM   2075 C C   . CYS   C 1 62 ? 13.946  -18.282 0.426  1   31.83 ? 77  CYS   C C   1 
ATOM   2076 O O   . CYS   C 1 62 ? 15.045  -18.773 0.649  1   32.25 ? 77  CYS   C O   1 
ATOM   2077 C CB  . CYS   C 1 62 ? 13.876  -17.425 2.806  1   31.92 ? 77  CYS   C CB  1 
ATOM   2078 S SG  . CYS   C 1 62 ? 12.958  -18.693 3.732  1   34.08 ? 77  CYS   C SG  1 
ATOM   2079 N N   . SER   C 1 63 ? 13.215  -18.604 -0.644 1   32.33 ? 78  SER   C N   1 
ATOM   2080 C CA  . SER   C 1 63 ? 13.717  -19.559 -1.625 1   33.56 ? 78  SER   C CA  1 
ATOM   2081 C C   . SER   C 1 63 ? 14.893  -18.897 -2.388 1   33.54 ? 78  SER   C C   1 
ATOM   2082 O O   . SER   C 1 63 ? 14.884  -17.679 -2.616 1   33.37 ? 78  SER   C O   1 
ATOM   2083 C CB  . SER   C 1 63 ? 12.605  -20.006 -2.569 1   35.94 ? 78  SER   C CB  1 
ATOM   2084 O OG  . SER   C 1 63 ? 12.126  -18.916 -3.337 1   39.91 ? 78  SER   C OG  1 
ATOM   2085 N N   . ASN   C 1 64 ? 15.935  -19.688 -2.673 1   33.48 ? 79  ASN   C N   1 
ATOM   2086 C CA  . ASN   C 1 64 ? 17.154  -19.248 -3.358 1   34.47 ? 79  ASN   C CA  1 
ATOM   2087 C C   . ASN   C 1 64 ? 17.855  -18.117 -2.604 1   33.64 ? 79  ASN   C C   1 
ATOM   2088 O O   . ASN   C 1 64 ? 18.317  -17.122 -3.184 1   33.73 ? 79  ASN   C O   1 
ATOM   2089 C CB  . ASN   C 1 64 ? 16.879  -18.908 -4.82  1   37.51 ? 79  ASN   C CB  1 
ATOM   2090 C CG  . ASN   C 1 64 ? 16.167  -20.042 -5.509 1   44.4  ? 79  ASN   C CG  1 
ATOM   2091 O OD1 . ASN   C 1 64 ? 16.631  -21.201 -5.506 1   47.18 ? 79  ASN   C OD1 1 
ATOM   2092 N ND2 . ASN   C 1 64 ? 15.004  -19.758 -6.076 1   45.92 ? 79  ASN   C ND2 1 
ATOM   2093 N N   . ASP   C 1 65 ? 17.906  -18.278 -1.287 1   32.22 ? 80  ASP   C N   1 
ATOM   2094 C CA  . ASP   C 1 65 ? 18.53   -17.327 -0.397 1   31.64 ? 80  ASP   C CA  1 
ATOM   2095 C C   . ASP   C 1 65 ? 19.19   -18.067 0.751  1   31.39 ? 80  ASP   C C   1 
ATOM   2096 O O   . ASP   C 1 65 ? 18.741  -19.141 1.149  1   30.88 ? 80  ASP   C O   1 
ATOM   2097 C CB  . ASP   C 1 65 ? 17.486  -16.339 0.177  1   31.92 ? 80  ASP   C CB  1 
ATOM   2098 C CG  . ASP   C 1 65 ? 18.137  -15.17  0.909  1   33.6  ? 80  ASP   C CG  1 
ATOM   2099 O OD1 . ASP   C 1 65 ? 18.565  -14.214 0.239  1   34.33 ? 80  ASP   C OD1 1 
ATOM   2100 O OD2 . ASP   C 1 65 ? 18.267  -15.241 2.144  1   33.14 ? 80  ASP   C OD2 1 
ATOM   2101 N N   . LEU   C 1 66 ? 20.227  -17.455 1.322  1   31.91 ? 81  LEU   C N   1 
ATOM   2102 C CA  . LEU   C 1 66 ? 20.964  -17.906 2.503  1   32.47 ? 81  LEU   C CA  1 
ATOM   2103 C C   . LEU   C 1 66 ? 19.97   -18.274 3.645  1   32.13 ? 81  LEU   C C   1 
ATOM   2104 O O   . LEU   C 1 66 ? 20.111  -19.32  4.267  1   31.91 ? 81  LEU   C O   1 
ATOM   2105 C CB  . LEU   C 1 66 ? 21.88   -16.731 2.904  1   33.34 ? 81  LEU   C CB  1 
ATOM   2106 C CG  . LEU   C 1 66 ? 22.744  -16.798 4.176  1   35.16 ? 81  LEU   C CG  1 
ATOM   2107 C CD1 . LEU   C 1 66 ? 23.51   -18.09  4.264  1   36.82 ? 81  LEU   C CD1 1 
ATOM   2108 C CD2 . LEU   C 1 66 ? 23.737  -15.674 4.174  1   35.32 ? 81  LEU   C CD2 1 
ATOM   2109 N N   . LEU   C 1 67 ? 18.916  -17.462 3.838  1   31.72 ? 82  LEU   C N   1 
ATOM   2110 C CA  . LEU   C 1 67 ? 17.899  -17.702 4.874  1   31.85 ? 82  LEU   C CA  1 
ATOM   2111 C C   . LEU   C 1 67 ? 17.073  -18.976 4.638  1   32.9  ? 82  LEU   C C   1 
ATOM   2112 O O   . LEU   C 1 67 ? 16.767  -19.705 5.586  1   33.44 ? 82  LEU   C O   1 
ATOM   2113 C CB  . LEU   C 1 67 ? 16.994  -16.466 5.025  1   31.17 ? 82  LEU   C CB  1 
ATOM   2114 C CG  . LEU   C 1 67 ? 15.933  -16.515 6.126  1   31.54 ? 82  LEU   C CG  1 
ATOM   2115 C CD1 . LEU   C 1 67 ? 16.565  -16.805 7.498  1   32.48 ? 82  LEU   C CD1 1 
ATOM   2116 C CD2 . LEU   C 1 67 ? 15.13   -15.216 6.146  1   31.04 ? 82  LEU   C CD2 1 
ATOM   2117 N N   . GLY   C 1 68 ? 16.818  -19.299 3.374  1   33.24 ? 83  GLY   C N   1 
ATOM   2118 C CA  . GLY   C 1 68 ? 16.108  -20.524 3.026  1   34.32 ? 83  GLY   C CA  1 
ATOM   2119 C C   . GLY   C 1 68 ? 16.938  -21.766 3.281  1   35.91 ? 83  GLY   C C   1 
ATOM   2120 O O   . GLY   C 1 68 ? 16.381  -22.832 3.55   1   36.27 ? 83  GLY   C O   1 
ATOM   2121 N N   . ASP   C 1 69 ? 18.271  -21.64  3.173  1   36.78 ? 84  ASP   C N   1 
ATOM   2122 C CA  . ASP   C 1 69 ? 19.225  -22.693 3.489  1   38.76 ? 84  ASP   C CA  1 
ATOM   2123 C C   . ASP   C 1 69 ? 19.145  -22.979 4.996  1   40.05 ? 84  ASP   C C   1 
ATOM   2124 O O   . ASP   C 1 69 ? 19.152  -24.143 5.387  1   40.24 ? 84  ASP   C O   1 
ATOM   2125 C CB  . ASP   C 1 69 ? 20.656  -22.266 3.115  1   41.46 ? 84  ASP   C CB  1 
ATOM   2126 C CG  . ASP   C 1 69 ? 20.892  -22.193 1.62   1   46.92 ? 84  ASP   C CG  1 
ATOM   2127 O OD1 . ASP   C 1 69 ? 20.302  -23.013 0.888  1   48.61 ? 84  ASP   C OD1 1 
ATOM   2128 O OD2 . ASP   C 1 69 ? 21.651  -21.302 1.181  1   49.16 ? 84  ASP   C OD2 1 
ATOM   2129 N N   . LEU   C 1 70 ? 19.044  -21.919 5.836  1   40.28 ? 85  LEU   C N   1 
ATOM   2130 C CA  . LEU   C 1 70 ? 18.923  -22.018 7.297  1   41.24 ? 85  LEU   C CA  1 
ATOM   2131 C C   . LEU   C 1 70 ? 17.632  -22.7   7.722  1   42.43 ? 85  LEU   C C   1 
ATOM   2132 O O   . LEU   C 1 70 ? 17.656  -23.592 8.562  1   42.95 ? 85  LEU   C O   1 
ATOM   2133 C CB  . LEU   C 1 70 ? 18.982  -20.612 7.953  1   41.5  ? 85  LEU   C CB  1 
ATOM   2134 C CG  . LEU   C 1 70 ? 20.321  -19.952 8.339  1   43.15 ? 85  LEU   C CG  1 
ATOM   2135 C CD1 . LEU   C 1 70 ? 21.525  -20.823 8.068  1   43.82 ? 85  LEU   C CD1 1 
ATOM   2136 C CD2 . LEU   C 1 70 ? 20.466  -18.593 7.703  1   44.14 ? 85  LEU   C CD2 1 
ATOM   2137 N N   . PHE   C 1 71 ? 16.501  -22.247 7.194  1   42.99 ? 86  PHE   C N   1 
ATOM   2138 C CA  . PHE   C 1 71 ? 15.2    -22.812 7.531  1   44.04 ? 86  PHE   C CA  1 
ATOM   2139 C C   . PHE   C 1 71 ? 14.93   -24.159 6.879  1   45.14 ? 86  PHE   C C   1 
ATOM   2140 O O   . PHE   C 1 71 ? 14.055  -24.885 7.341  1   45.93 ? 86  PHE   C O   1 
ATOM   2141 C CB  . PHE   C 1 71 ? 14.084  -21.84  7.121  1   44.08 ? 86  PHE   C CB  1 
ATOM   2142 C CG  . PHE   C 1 71 ? 13.6    -20.987 8.256  1   44.84 ? 86  PHE   C CG  1 
ATOM   2143 C CD1 . PHE   C 1 71 ? 12.654  -21.465 9.146  1   45.66 ? 86  PHE   C CD1 1 
ATOM   2144 C CD2 . PHE   C 1 71 ? 14.119  -19.723 8.463  1   45.7  ? 86  PHE   C CD2 1 
ATOM   2145 C CE1 . PHE   C 1 71 ? 12.223  -20.687 10.206 1   46.31 ? 86  PHE   C CE1 1 
ATOM   2146 C CE2 . PHE   C 1 71 ? 13.69   -18.951 9.529  1   46.45 ? 86  PHE   C CE2 1 
ATOM   2147 C CZ  . PHE   C 1 71 ? 12.749  -19.438 10.395 1   46.2  ? 86  PHE   C CZ  1 
ATOM   2148 N N   . GLY   C 1 72 ? 15.631  -24.458 5.785  1   44.86 ? 87  GLY   C N   1 
ATOM   2149 C CA  . GLY   C 1 72 ? 15.402  -25.669 5.008  1   44.8  ? 87  GLY   C CA  1 
ATOM   2150 C C   . GLY   C 1 72 ? 14.031  -25.628 4.363  1   44.31 ? 87  GLY   C C   1 
ATOM   2151 O O   . GLY   C 1 72 ? 13.409  -26.674 4.166  1   44.8  ? 87  GLY   C O   1 
ATOM   2152 N N   . VAL   C 1 73 ? 13.535  -24.406 4.049  1   42.92 ? 88  VAL   C N   1 
ATOM   2153 C CA  . VAL   C 1 73 ? 12.2    -24.197 3.514  1   41.93 ? 88  VAL   C CA  1 
ATOM   2154 C C   . VAL   C 1 73 ? 12.139  -22.932 2.649  1   40.82 ? 88  VAL   C C   1 
ATOM   2155 O O   . VAL   C 1 73 ? 12.896  -21.986 2.869  1   41.51 ? 88  VAL   C O   1 
ATOM   2156 C CB  . VAL   C 1 73 ? 11.21   -24.086 4.677  1   42.18 ? 88  VAL   C CB  1 
ATOM   2157 N N   . PRO   C 1 74 ? 11.226  -22.882 1.669  1   39.18 ? 89  PRO   C N   1 
ATOM   2158 C CA  . PRO   C 1 74 ? 11.121  -21.675 0.823  1   37.96 ? 89  PRO   C CA  1 
ATOM   2159 C C   . PRO   C 1 74 ? 10.397  -20.488 1.475  1   35.77 ? 89  PRO   C C   1 
ATOM   2160 O O   . PRO   C 1 74 ? 10.37   -19.406 0.91   1   35.61 ? 89  PRO   C O   1 
ATOM   2161 C CB  . PRO   C 1 74 ? 10.325  -22.17  -0.381 1   38.84 ? 89  PRO   C CB  1 
ATOM   2162 C CG  . PRO   C 1 74 ? 9.445   -23.24  0.195  1   40    ? 89  PRO   C CG  1 
ATOM   2163 C CD  . PRO   C 1 74 ? 10.27   -23.926 1.252  1   38.67 ? 89  PRO   C CD  1 
ATOM   2164 N N   . SER   C 1 75 ? 9.76    -20.706 2.62   1   34.23 ? 90  SER   C N   1 
ATOM   2165 C CA  . SER   C 1 75 ? 9.017   -19.665 3.313  1   32.57 ? 90  SER   C CA  1 
ATOM   2166 C C   . SER   C 1 75 ? 8.757   -20.078 4.773  1   30.52 ? 90  SER   C C   1 
ATOM   2167 O O   . SER   C 1 75 ? 8.89    -21.254 5.135  1   30.19 ? 90  SER   C O   1 
ATOM   2168 C CB  . SER   C 1 75 ? 7.685   -19.398 2.603  1   33.8  ? 90  SER   C CB  1 
ATOM   2169 O OG  . SER   C 1 75 ? 6.76    -20.454 2.815  1   36.75 ? 90  SER   C OG  1 
ATOM   2170 N N   . PHE   C 1 76 ? 8.358   -19.112 5.59   1   28.5  ? 91  PHE   C N   1 
ATOM   2171 C CA  . PHE   C 1 76 ? 7.969   -19.318 6.987  1   28.53 ? 91  PHE   C CA  1 
ATOM   2172 C C   . PHE   C 1 76 ? 7.077   -18.134 7.424  1   28.3  ? 91  PHE   C C   1 
ATOM   2173 O O   . PHE   C 1 76 ? 7.009   -17.123 6.727  1   28.04 ? 91  PHE   C O   1 
ATOM   2174 C CB  . PHE   C 1 76 ? 9.197   -19.505 7.92   1   28.15 ? 91  PHE   C CB  1 
ATOM   2175 C CG  . PHE   C 1 76 ? 10.115  -18.309 8.041  1   29.65 ? 91  PHE   C CG  1 
ATOM   2176 C CD1 . PHE   C 1 76 ? 11.158  -18.121 7.148  1   30.86 ? 91  PHE   C CD1 1 
ATOM   2177 C CD2 . PHE   C 1 76 ? 9.962   -17.398 9.075  1   30.52 ? 91  PHE   C CD2 1 
ATOM   2178 C CE1 . PHE   C 1 76 ? 11.986  -17.01  7.249  1   31.48 ? 91  PHE   C CE1 1 
ATOM   2179 C CE2 . PHE   C 1 76 ? 10.803  -16.296 9.178  1   31.5  ? 91  PHE   C CE2 1 
ATOM   2180 C CZ  . PHE   C 1 76 ? 11.813  -16.115 8.274  1   31.06 ? 91  PHE   C CZ  1 
ATOM   2181 N N   . SER   C 1 77 ? 6.346   -18.277 8.533  1   28.06 ? 92  SER   C N   1 
ATOM   2182 C CA  . SER   C 1 77 ? 5.523   -17.19  9.056  1   26.72 ? 92  SER   C CA  1 
ATOM   2183 C C   . SER   C 1 77 ? 6.131   -16.733 10.379 1   25.88 ? 92  SER   C C   1 
ATOM   2184 O O   . SER   C 1 77 ? 6.43    -17.574 11.221 1   26.18 ? 92  SER   C O   1 
ATOM   2185 C CB  . SER   C 1 77 ? 4.079   -17.65  9.275  1   27.46 ? 92  SER   C CB  1 
ATOM   2186 O OG  . SER   C 1 77 ? 3.34    -16.646 9.959  1   27.37 ? 92  SER   C OG  1 
ATOM   2187 N N   A VAL   C 1 78 ? 6.276   -15.403 10.555 0.5 25.55 ? 93  VAL   C N   1 
ATOM   2188 N N   B VAL   C 1 78 ? 6.304   -15.41  10.586 0.5 25.24 ? 93  VAL   C N   1 
ATOM   2189 C CA  A VAL   C 1 78 ? 6.789   -14.748 11.76  0.5 25.31 ? 93  VAL   C CA  1 
ATOM   2190 C CA  B VAL   C 1 78 ? 6.879   -14.933 11.845 0.5 24.65 ? 93  VAL   C CA  1 
ATOM   2191 C C   A VAL   C 1 78 ? 5.878   -15.021 12.992 0.5 25.45 ? 93  VAL   C C   1 
ATOM   2192 C C   B VAL   C 1 78 ? 5.85    -14.942 13.013 0.5 25.11 ? 93  VAL   C C   1 
ATOM   2193 O O   A VAL   C 1 78 ? 6.342   -14.971 14.134 0.5 25.56 ? 93  VAL   C O   1 
ATOM   2194 O O   B VAL   C 1 78 ? 6.213   -14.629 14.149 0.5 25.12 ? 93  VAL   C O   1 
ATOM   2195 C CB  A VAL   C 1 78 ? 6.969   -13.211 11.513 0.5 25.75 ? 93  VAL   C CB  1 
ATOM   2196 C CB  B VAL   C 1 78 ? 7.637   -13.602 11.72  0.5 24.62 ? 93  VAL   C CB  1 
ATOM   2197 C CG1 A VAL   C 1 78 ? 7.619   -12.537 12.709 0.5 25.98 ? 93  VAL   C CG1 1 
ATOM   2198 C CG1 B VAL   C 1 78 ? 8.751   -13.727 10.681 0.5 25.19 ? 93  VAL   C CG1 1 
ATOM   2199 C CG2 A VAL   C 1 78 ? 7.792   -12.941 10.255 0.5 26.58 ? 93  VAL   C CG2 1 
ATOM   2200 C CG2 B VAL   C 1 78 ? 6.695   -12.471 11.369 0.5 23.79 ? 93  VAL   C CG2 1 
ATOM   2201 N N   . LYS   C 1 79 ? 4.598   -15.35  12.758 1   25.49 ? 94  LYS   C N   1 
ATOM   2202 C CA  . LYS   C 1 79 ? 3.621   -15.585 13.824 1   26.92 ? 94  LYS   C CA  1 
ATOM   2203 C C   . LYS   C 1 79 ? 3.95    -16.857 14.641 1   27.86 ? 94  LYS   C C   1 
ATOM   2204 O O   . LYS   C 1 79 ? 3.507   -16.982 15.78  1   28.13 ? 94  LYS   C O   1 
ATOM   2205 C CB  . LYS   C 1 79 ? 2.228   -15.77  13.222 1   29.46 ? 94  LYS   C CB  1 
ATOM   2206 C CG  . LYS   C 1 79 ? 1.621   -14.505 12.653 1   32.95 ? 94  LYS   C CG  1 
ATOM   2207 C CD  . LYS   C 1 79 ? 0.254   -14.839 12.061 1   35.95 ? 94  LYS   C CD  1 
ATOM   2208 C CE  . LYS   C 1 79 ? -0.471  -13.609 11.612 1   39.81 ? 94  LYS   C CE  1 
ATOM   2209 N NZ  . LYS   C 1 79 ? -1.744  -13.953 10.913 1   43.13 ? 94  LYS   C NZ  1 
ATOM   2210 N N   . GLU   C 1 80 ? 4.679   -17.811 14.044 1   28.19 ? 95  GLU   C N   1 
ATOM   2211 C CA  . GLU   C 1 80 ? 5.043   -19.063 14.694 1   29.29 ? 95  GLU   C CA  1 
ATOM   2212 C C   . GLU   C 1 80 ? 6.396   -18.918 15.406 1   28.62 ? 95  GLU   C C   1 
ATOM   2213 O O   . GLU   C 1 80 ? 7.403   -19.448 14.952 1   28.49 ? 95  GLU   C O   1 
ATOM   2214 C CB  . GLU   C 1 80 ? 5.09    -20.172 13.64  1   33    ? 95  GLU   C CB  1 
ATOM   2215 C CG  . GLU   C 1 80 ? 3.785   -20.299 12.868 1   39.6  ? 95  GLU   C CG  1 
ATOM   2216 C CD  . GLU   C 1 80 ? 3.621   -21.666 12.238 1   51.77 ? 95  GLU   C CD  1 
ATOM   2217 O OE1 . GLU   C 1 80 ? 4.207   -21.902 11.155 1   53.62 ? 95  GLU   C OE1 1 
ATOM   2218 O OE2 . GLU   C 1 80 ? 2.931   -22.515 12.848 1   56.21 ? 95  GLU   C OE2 1 
ATOM   2219 N N   . HIS   C 1 81 ? 6.397   -18.168 16.504 1   28.68 ? 96  HIS   C N   1 
ATOM   2220 C CA  . HIS   C 1 81 ? 7.574   -17.818 17.285 1   28.95 ? 96  HIS   C CA  1 
ATOM   2221 C C   . HIS   C 1 81 ? 8.514   -19     17.58  1   30.83 ? 96  HIS   C C   1 
ATOM   2222 O O   . HIS   C 1 81 ? 9.688   -18.921 17.224 1   30.1  ? 96  HIS   C O   1 
ATOM   2223 C CB  . HIS   C 1 81 ? 7.185   -17.078 18.573 1   28.04 ? 96  HIS   C CB  1 
ATOM   2224 C CG  . HIS   C 1 81 ? 6.247   -15.924 18.373 1   28.44 ? 96  HIS   C CG  1 
ATOM   2225 N ND1 . HIS   C 1 81 ? 4.905   -16.039 18.635 1   29.45 ? 96  HIS   C ND1 1 
ATOM   2226 C CD2 . HIS   C 1 81 ? 6.497   -14.659 17.954 1   29.7  ? 96  HIS   C CD2 1 
ATOM   2227 C CE1 . HIS   C 1 81 ? 4.379   -14.851 18.379 1   30.15 ? 96  HIS   C CE1 1 
ATOM   2228 N NE2 . HIS   C 1 81 ? 5.297   -13.991 17.969 1   30.01 ? 96  HIS   C NE2 1 
ATOM   2229 N N   . ARG   C 1 82 ? 8.014   -20.092 18.193 1   32.09 ? 97  ARG   C N   1 
ATOM   2230 C CA  . ARG   C 1 82 ? 8.844   -21.262 18.523 1   33.39 ? 97  ARG   C CA  1 
ATOM   2231 C C   . ARG   C 1 82 ? 9.547   -21.882 17.307 1   32.28 ? 97  ARG   C C   1 
ATOM   2232 O O   . ARG   C 1 82 ? 10.713  -22.258 17.414 1   32.71 ? 97  ARG   C O   1 
ATOM   2233 C CB  . ARG   C 1 82 ? 8.057   -22.339 19.307 1   37.2  ? 97  ARG   C CB  1 
ATOM   2234 C CG  . ARG   C 1 82 ? 7.317   -23.337 18.4   1   43    ? 97  ARG   C CG  1 
ATOM   2235 C CD  . ARG   C 1 82 ? 6.65    -24.475 19.141 1   48.66 ? 97  ARG   C CD  1 
ATOM   2236 N NE  . ARG   C 1 82 ? 5.61    -25.141 18.349 1   54.45 ? 97  ARG   C NE  1 
ATOM   2237 C CZ  . ARG   C 1 82 ? 4.416   -24.615 18.075 1   58.71 ? 97  ARG   C CZ  1 
ATOM   2238 N NH1 . ARG   C 1 82 ? 3.527   -25.301 17.369 1   58.7  ? 97  ARG   C NH1 1 
ATOM   2239 N NH2 . ARG   C 1 82 ? 4.104   -23.398 18.506 1   59.97 ? 97  ARG   C NH2 1 
ATOM   2240 N N   . LYS   C 1 83 ? 8.873   -21.945 16.154 1   30.76 ? 98  LYS   C N   1 
ATOM   2241 C CA  . LYS   C 1 83 ? 9.474   -22.486 14.945 1   30.51 ? 98  LYS   C CA  1 
ATOM   2242 C C   . LYS   C 1 83 ? 10.702  -21.676 14.532 1   28.18 ? 98  LYS   C C   1 
ATOM   2243 O O   . LYS   C 1 83 ? 11.72   -22.247 14.153 1   27.37 ? 98  LYS   C O   1 
ATOM   2244 C CB  . LYS   C 1 83 ? 8.449   -22.56  13.821 1   34.3  ? 98  LYS   C CB  1 
ATOM   2245 C CG  . LYS   C 1 83 ? 7.269   -23.45  14.193 1   41.18 ? 98  LYS   C CG  1 
ATOM   2246 C CD  . LYS   C 1 83 ? 6.523   -23.935 12.961 1   47.56 ? 98  LYS   C CD  1 
ATOM   2247 C CE  . LYS   C 1 83 ? 5.387   -24.854 13.331 1   53.42 ? 98  LYS   C CE  1 
ATOM   2248 N NZ  . LYS   C 1 83 ? 4.683   -25.36  12.121 1   57.34 ? 98  LYS   C NZ  1 
ATOM   2249 N N   . ILE   C 1 84 ? 10.633  -20.349 14.683 1   26.43 ? 99  ILE   C N   1 
ATOM   2250 C CA  . ILE   C 1 84 ? 11.764  -19.5   14.353 1   26.19 ? 99  ILE   C CA  1 
ATOM   2251 C C   . ILE   C 1 84 ? 12.909  -19.694 15.338 1   26.15 ? 99  ILE   C C   1 
ATOM   2252 O O   . ILE   C 1 84 ? 14.064  -19.762 14.922 1   26.47 ? 99  ILE   C O   1 
ATOM   2253 C CB  . ILE   C 1 84 ? 11.309  -18.043 14.241 1   27.18 ? 99  ILE   C CB  1 
ATOM   2254 C CG1 . ILE   C 1 84 ? 10.247  -17.936 13.126 1   28.87 ? 99  ILE   C CG1 1 
ATOM   2255 C CG2 . ILE   C 1 84 ? 12.525  -17.135 13.972 1   27.1  ? 99  ILE   C CG2 1 
ATOM   2256 C CD1 . ILE   C 1 84 ? 9.647   -16.656 13.069 1   31.57 ? 99  ILE   C CD1 1 
ATOM   2257 N N   . TYR   C 1 85 ? 12.599  -19.843 16.648 1   26.6  ? 100 TYR   C N   1 
ATOM   2258 C CA  . TYR   C 1 85 ? 13.649  -20.109 17.631 1   27.68 ? 100 TYR   C CA  1 
ATOM   2259 C C   . TYR   C 1 85 ? 14.319  -21.453 17.34  1   28.93 ? 100 TYR   C C   1 
ATOM   2260 O O   . TYR   C 1 85 ? 15.538  -21.526 17.365 1   29.37 ? 100 TYR   C O   1 
ATOM   2261 C CB  . TYR   C 1 85 ? 13.104  -20.095 19.061 1   27.68 ? 100 TYR   C CB  1 
ATOM   2262 C CG  . TYR   C 1 85 ? 12.929  -18.701 19.61  1   27.99 ? 100 TYR   C CG  1 
ATOM   2263 C CD1 . TYR   C 1 85 ? 14.024  -17.912 19.916 1   28.91 ? 100 TYR   C CD1 1 
ATOM   2264 C CD2 . TYR   C 1 85 ? 11.667  -18.163 19.793 1   29.08 ? 100 TYR   C CD2 1 
ATOM   2265 C CE1 . TYR   C 1 85 ? 13.867  -16.613 20.396 1   30.26 ? 100 TYR   C CE1 1 
ATOM   2266 C CE2 . TYR   C 1 85 ? 11.496  -16.872 20.265 1   29.83 ? 100 TYR   C CE2 1 
ATOM   2267 C CZ  . TYR   C 1 85 ? 12.598  -16.107 20.586 1   30.31 ? 100 TYR   C CZ  1 
ATOM   2268 O OH  . TYR   C 1 85 ? 12.406  -14.854 21.094 1   32.03 ? 100 TYR   C OH  1 
ATOM   2269 N N   . THR   C 1 86 ? 13.548  -22.464 16.963 1   29.73 ? 101 THR   C N   1 
ATOM   2270 C CA  . THR   C 1 86 ? 14.096  -23.79  16.652 1   31.54 ? 101 THR   C CA  1 
ATOM   2271 C C   . THR   C 1 86 ? 15.103  -23.714 15.488 1   31.79 ? 101 THR   C C   1 
ATOM   2272 O O   . THR   C 1 86 ? 16.199  -24.267 15.603 1   32.03 ? 101 THR   C O   1 
ATOM   2273 C CB  . THR   C 1 86 ? 12.962  -24.781 16.409 1   34.83 ? 101 THR   C CB  1 
ATOM   2274 O OG1 . THR   C 1 86 ? 12.138  -24.825 17.575 1   36.55 ? 101 THR   C OG1 1 
ATOM   2275 C CG2 . THR   C 1 86 ? 13.472  -26.184 16.077 1   36.13 ? 101 THR   C CG2 1 
ATOM   2276 N N   . MET   C 1 87 ? 14.774  -22.953 14.418 1   31.46 ? 102 MET   C N   1 
ATOM   2277 C CA  . MET   C 1 87 ? 15.713  -22.741 13.296 1   31.03 ? 102 MET   C CA  1 
ATOM   2278 C C   . MET   C 1 87 ? 17.009  -22.093 13.815 1   29.22 ? 102 MET   C C   1 
ATOM   2279 O O   . MET   C 1 87 ? 18.094  -22.55  13.471 1   28.93 ? 102 MET   C O   1 
ATOM   2280 C CB  . MET   C 1 87 ? 15.085  -21.857 12.183 1   32.35 ? 102 MET   C CB  1 
ATOM   2281 C CG  . MET   C 1 87 ? 16.078  -21.453 11.029 1   35.97 ? 102 MET   C CG  1 
ATOM   2282 S SD  . MET   C 1 87 ? 17.375  -20.178 11.348 1   42.93 ? 102 MET   C SD  1 
ATOM   2283 C CE  . MET   C 1 87 ? 16.4    -18.677 11.357 1   36.84 ? 102 MET   C CE  1 
ATOM   2284 N N   . ILE   C 1 88 ? 16.888  -20.993 14.607 1   27.38 ? 103 ILE   C N   1 
ATOM   2285 C CA  . ILE   C 1 88 ? 18.026  -20.261 15.141 1   26.48 ? 103 ILE   C CA  1 
ATOM   2286 C C   . ILE   C 1 88 ? 18.925  -21.128 16.005 1   27.7  ? 103 ILE   C C   1 
ATOM   2287 O O   . ILE   C 1 88 ? 20.151  -21.163 15.779 1   27.95 ? 103 ILE   C O   1 
ATOM   2288 C CB  . ILE   C 1 88 ? 17.557  -18.971 15.886 1   25.29 ? 103 ILE   C CB  1 
ATOM   2289 C CG1 . ILE   C 1 88 ? 16.93   -17.991 14.892 1   25.18 ? 103 ILE   C CG1 1 
ATOM   2290 C CG2 . ILE   C 1 88 ? 18.692  -18.323 16.659 1   25.24 ? 103 ILE   C CG2 1 
ATOM   2291 C CD1 . ILE   C 1 88 ? 16.188  -16.74  15.593 1   25.24 ? 103 ILE   C CD1 1 
ATOM   2292 N N   . TYR   C 1 89 ? 18.344  -21.843 16.977 1   27.25 ? 104 TYR   C N   1 
ATOM   2293 C CA  . TYR   C 1 89 ? 19.138  -22.707 17.841 1   28.42 ? 104 TYR   C CA  1 
ATOM   2294 C C   . TYR   C 1 89 ? 19.871  -23.801 17.068 1   29.71 ? 104 TYR   C C   1 
ATOM   2295 O O   . TYR   C 1 89 ? 21.016  -24.091 17.395 1   29.57 ? 104 TYR   C O   1 
ATOM   2296 C CB  . TYR   C 1 89 ? 18.311  -23.289 18.978 1   28.61 ? 104 TYR   C CB  1 
ATOM   2297 C CG  . TYR   C 1 89 ? 18.113  -22.307 20.107 1   29.7  ? 104 TYR   C CG  1 
ATOM   2298 C CD1 . TYR   C 1 89 ? 19.125  -22.055 21.021 1   30.46 ? 104 TYR   C CD1 1 
ATOM   2299 C CD2 . TYR   C 1 89 ? 16.9    -21.66  20.287 1   30.82 ? 104 TYR   C CD2 1 
ATOM   2300 C CE1 . TYR   C 1 89 ? 18.941  -21.168 22.072 1   31.31 ? 104 TYR   C CE1 1 
ATOM   2301 C CE2 . TYR   C 1 89 ? 16.708  -20.767 21.33  1   31.35 ? 104 TYR   C CE2 1 
ATOM   2302 C CZ  . TYR   C 1 89 ? 17.72   -20.547 22.238 1   32.26 ? 104 TYR   C CZ  1 
ATOM   2303 O OH  . TYR   C 1 89 ? 17.522  -19.669 23.274 1   34.07 ? 104 TYR   C OH  1 
ATOM   2304 N N   . ARG   C 1 90 ? 19.27   -24.329 15.996 1   30.55 ? 105 ARG   C N   1 
ATOM   2305 C CA  . ARG   C 1 90 ? 19.956  -25.341 15.165 1   31.85 ? 105 ARG   C CA  1 
ATOM   2306 C C   . ARG   C 1 90 ? 21.179  -24.752 14.424 1   32.56 ? 105 ARG   C C   1 
ATOM   2307 O O   . ARG   C 1 90 ? 22.053  -25.492 13.973 1   32.9  ? 105 ARG   C O   1 
ATOM   2308 C CB  . ARG   C 1 90 ? 18.989  -25.912 14.117 1   34.39 ? 105 ARG   C CB  1 
ATOM   2309 C CG  . ARG   C 1 90 ? 18.074  -26.995 14.648 1   39.74 ? 105 ARG   C CG  1 
ATOM   2310 C CD  . ARG   C 1 90 ? 17.029  -27.413 13.636 1   45.6  ? 105 ARG   C CD  1 
ATOM   2311 N NE  . ARG   C 1 90 ? 16.108  -28.394 14.221 1   52.35 ? 105 ARG   C NE  1 
ATOM   2312 C CZ  . ARG   C 1 90 ? 14.891  -28.654 13.754 1   55.68 ? 105 ARG   C CZ  1 
ATOM   2313 N NH1 . ARG   C 1 90 ? 14.42   -27.994 12.704 1   56.73 ? 105 ARG   C NH1 1 
ATOM   2314 N NH2 . ARG   C 1 90 ? 14.117  -29.545 14.361 1   55.12 ? 105 ARG   C NH2 1 
ATOM   2315 N N   . ASN   C 1 91 ? 21.236  -23.426 14.306 1   31.86 ? 106 ASN   C N   1 
ATOM   2316 C CA  . ASN   C 1 91 ? 22.281  -22.732 13.593 1   31.36 ? 106 ASN   C CA  1 
ATOM   2317 C C   . ASN   C 1 91 ? 23.257  -21.983 14.476 1   29.87 ? 106 ASN   C C   1 
ATOM   2318 O O   . ASN   C 1 91 ? 23.869  -21.032 14.015 1   29.54 ? 106 ASN   C O   1 
ATOM   2319 C CB  . ASN   C 1 91 ? 21.639  -21.817 12.566 1   32.66 ? 106 ASN   C CB  1 
ATOM   2320 C CG  . ASN   C 1 91 ? 21.217  -22.646 11.383 1   35.56 ? 106 ASN   C CG  1 
ATOM   2321 O OD1 . ASN   C 1 91 ? 22.057  -23.079 10.598 1   35.98 ? 106 ASN   C OD1 1 
ATOM   2322 N ND2 . ASN   C 1 91 ? 19.929  -22.963 11.276 1   35.6  ? 106 ASN   C ND2 1 
ATOM   2323 N N   . LEU   C 1 92 ? 23.399  -22.388 15.737 1   29.29 ? 107 LEU   C N   1 
ATOM   2324 C CA  . LEU   C 1 92 ? 24.348  -21.757 16.641 1   29.48 ? 107 LEU   C CA  1 
ATOM   2325 C C   . LEU   C 1 92 ? 24.786  -22.704 17.765 1   30.4  ? 107 LEU   C C   1 
ATOM   2326 O O   . LEU   C 1 92 ? 24.199  -23.776 17.954 1   30.88 ? 107 LEU   C O   1 
ATOM   2327 C CB  . LEU   C 1 92 ? 23.767  -20.444 17.231 1   29.54 ? 107 LEU   C CB  1 
ATOM   2328 C CG  . LEU   C 1 92 ? 22.448  -20.538 18.017 1   29.57 ? 107 LEU   C CG  1 
ATOM   2329 C CD1 . LEU   C 1 92 ? 22.682  -20.99  19.456 1   30.25 ? 107 LEU   C CD1 1 
ATOM   2330 C CD2 . LEU   C 1 92 ? 21.787  -19.181 18.092 1   29.83 ? 107 LEU   C CD2 1 
ATOM   2331 N N   . VAL   C 1 93 ? 25.802  -22.285 18.53  1   30.28 ? 108 VAL   C N   1 
ATOM   2332 C CA  . VAL   C 1 93 ? 26.247  -22.999 19.707 1   31.12 ? 108 VAL   C CA  1 
ATOM   2333 C C   . VAL   C 1 93 ? 26.112  -22.027 20.872 1   29.7  ? 108 VAL   C C   1 
ATOM   2334 O O   . VAL   C 1 93 ? 26.614  -20.905 20.807 1   29.47 ? 108 VAL   C O   1 
ATOM   2335 C CB  . VAL   C 1 93 ? 27.7    -23.505 19.54  1   33.39 ? 108 VAL   C CB  1 
ATOM   2336 C CG1 . VAL   C 1 93 ? 28.253  -24.006 20.868 1   34.31 ? 108 VAL   C CG1 1 
ATOM   2337 C CG2 . VAL   C 1 93 ? 27.77   -24.597 18.476 1   34.2  ? 108 VAL   C CG2 1 
ATOM   2338 N N   . VAL   C 1 94 ? 25.355  -22.407 21.895 1   28.8  ? 109 VAL   C N   1 
ATOM   2339 C CA  . VAL   C 1 94 ? 25.168  -21.552 23.06  1   29.29 ? 109 VAL   C CA  1 
ATOM   2340 C C   . VAL   C 1 94 ? 26.46   -21.546 23.891 1   31.01 ? 109 VAL   C C   1 
ATOM   2341 O O   . VAL   C 1 94 ? 27.047  -22.612 24.098 1   31.25 ? 109 VAL   C O   1 
ATOM   2342 C CB  . VAL   C 1 94 ? 23.96   -22.044 23.883 1   29.16 ? 109 VAL   C CB  1 
ATOM   2343 C CG1 . VAL   C 1 94 ? 23.893  -21.362 25.242 1   29.56 ? 109 VAL   C CG1 1 
ATOM   2344 C CG2 . VAL   C 1 94 ? 22.662  -21.837 23.104 1   29.19 ? 109 VAL   C CG2 1 
ATOM   2345 N N   . VAL   C 1 95 ? 26.919  -20.357 24.325 1   31.83 ? 110 VAL   C N   1 
ATOM   2346 C CA  . VAL   C 1 95 ? 28.099  -20.207 25.179 1   34.01 ? 110 VAL   C CA  1 
ATOM   2347 C C   . VAL   C 1 95 ? 27.585  -20.413 26.608 1   36.77 ? 110 VAL   C C   1 
ATOM   2348 O O   . VAL   C 1 95 ? 27.114  -19.478 27.252 1   38.01 ? 110 VAL   C O   1 
ATOM   2349 C CB  . VAL   C 1 95 ? 28.791  -18.83  24.975 1   34.88 ? 110 VAL   C CB  1 
ATOM   2350 C CG1 . VAL   C 1 95 ? 30.003  -18.679 25.905 1   35.87 ? 110 VAL   C CG1 1 
ATOM   2351 C CG2 . VAL   C 1 95 ? 29.217  -18.65  23.52  1   34.7  ? 110 VAL   C CG2 1 
ATOM   2352 N N   . ASN   C 1 96 ? 27.565  -21.674 27.05  1   37.72 ? 111 ASN   C N   1 
ATOM   2353 C CA  . ASN   C 1 96 ? 26.987  -22.081 28.331 1   38.8  ? 111 ASN   C CA  1 
ATOM   2354 C C   . ASN   C 1 96 ? 28.01   -22.382 29.439 1   39.24 ? 111 ASN   C C   1 
ATOM   2355 O O   . ASN   C 1 96 ? 29.182  -22.039 29.306 1   39.33 ? 111 ASN   C O   1 
ATOM   2356 C CB  . ASN   C 1 96 ? 26.074  -23.297 28.112 1   39.62 ? 111 ASN   C CB  1 
ATOM   2357 C CG  . ASN   C 1 96 ? 26.793  -24.576 27.72  1   43.32 ? 111 ASN   C CG  1 
ATOM   2358 O OD1 . ASN   C 1 96 ? 26.298  -25.683 27.964 1   45.17 ? 111 ASN   C OD1 1 
ATOM   2359 N ND2 . ASN   C 1 96 ? 27.978  -24.479 27.113 1   43.74 ? 111 ASN   C ND2 1 
ATOM   2360 N N   . SER   D 1 2  ? -6.46   -3.784  18.103 1   52.13 ? 17  SER   D N   1 
ATOM   2361 C CA  . SER   D 1 2  ? -6.947  -5.052  17.547 1   51.71 ? 17  SER   D CA  1 
ATOM   2362 C C   . SER   D 1 2  ? -5.932  -5.671  16.588 1   50.1  ? 17  SER   D C   1 
ATOM   2363 O O   . SER   D 1 2  ? -5.544  -6.818  16.795 1   50.63 ? 17  SER   D O   1 
ATOM   2364 C CB  . SER   D 1 2  ? -8.294  -4.867  16.855 1   53.74 ? 17  SER   D CB  1 
ATOM   2365 O OG  . SER   D 1 2  ? -8.159  -4.117  15.659 1   56.76 ? 17  SER   D OG  1 
ATOM   2366 N N   . GLN   D 1 3  ? -5.473  -4.911  15.561 1   47.82 ? 18  GLN   D N   1 
ATOM   2367 C CA  . GLN   D 1 3  ? -4.493  -5.378  14.555 1   45.6  ? 18  GLN   D CA  1 
ATOM   2368 C C   . GLN   D 1 3  ? -3.074  -5.576  15.104 1   41.99 ? 18  GLN   D C   1 
ATOM   2369 O O   . GLN   D 1 3  ? -2.111  -5.658  14.326 1   43.01 ? 18  GLN   D O   1 
ATOM   2370 C CB  . GLN   D 1 3  ? -4.426  -4.38   13.384 1   47.83 ? 18  GLN   D CB  1 
ATOM   2371 C CG  . GLN   D 1 3  ? -3.99   -2.971  13.776 1   53.08 ? 18  GLN   D CG  1 
ATOM   2372 C CD  . GLN   D 1 3  ? -3.097  -2.353  12.72  1   60.53 ? 18  GLN   D CD  1 
ATOM   2373 O OE1 . GLN   D 1 3  ? -3.489  -2.159  11.557 1   63.91 ? 18  GLN   D OE1 1 
ATOM   2374 N NE2 . GLN   D 1 3  ? -1.867  -2.042  13.092 1   60.81 ? 18  GLN   D NE2 1 
ATOM   2375 N N   . ILE   D 1 4  ? -2.926  -5.619  16.42  1   37.76 ? 19  ILE   D N   1 
ATOM   2376 C CA  . ILE   D 1 4  ? -1.628  -5.734  17.054 1   34.34 ? 19  ILE   D CA  1 
ATOM   2377 C C   . ILE   D 1 4  ? -1.201  -7.178  17.176 1   30.89 ? 19  ILE   D C   1 
ATOM   2378 O O   . ILE   D 1 4  ? -1.93   -7.987  17.749 1   30.31 ? 19  ILE   D O   1 
ATOM   2379 C CB  . ILE   D 1 4  ? -1.645  -4.992  18.389 1   34.58 ? 19  ILE   D CB  1 
ATOM   2380 C CG1 . ILE   D 1 4  ? -1.935  -3.517  18.132 1   35.19 ? 19  ILE   D CG1 1 
ATOM   2381 C CG2 . ILE   D 1 4  ? -0.35   -5.208  19.183 1   35    ? 19  ILE   D CG2 1 
ATOM   2382 C CD1 . ILE   D 1 4  ? -2.157  -2.752  19.316 1   36.48 ? 19  ILE   D CD1 1 
ATOM   2383 N N   . PRO   D 1 5  ? -0.036  -7.526  16.603 1   27.85 ? 20  PRO   D N   1 
ATOM   2384 C CA  . PRO   D 1 5  ? 0.409   -8.925  16.664 1   26.74 ? 20  PRO   D CA  1 
ATOM   2385 C C   . PRO   D 1 5  ? 0.702   -9.417  18.079 1   26.09 ? 20  PRO   D C   1 
ATOM   2386 O O   . PRO   D 1 5  ? 1.093   -8.636  18.942 1   26.07 ? 20  PRO   D O   1 
ATOM   2387 C CB  . PRO   D 1 5  ? 1.663   -8.969  15.775 1   27.66 ? 20  PRO   D CB  1 
ATOM   2388 C CG  . PRO   D 1 5  ? 2.043   -7.568  15.506 1   28.18 ? 20  PRO   D CG  1 
ATOM   2389 C CD  . PRO   D 1 5  ? 0.917   -6.654  15.879 1   26.86 ? 20  PRO   D CD  1 
ATOM   2390 N N   . ALA   D 1 6  ? 0.482   -10.701 18.313 1   25.65 ? 21  ALA   D N   1 
ATOM   2391 C CA  . ALA   D 1 6  ? 0.713   -11.284 19.624 1   25.37 ? 21  ALA   D CA  1 
ATOM   2392 C C   . ALA   D 1 6  ? 2.176   -11.668 19.787 1   24.59 ? 21  ALA   D C   1 
ATOM   2393 O O   . ALA   D 1 6  ? 2.813   -12.126 18.824 1   23.91 ? 21  ALA   D O   1 
ATOM   2394 C CB  . ALA   D 1 6  ? -0.14   -12.538 19.794 1   25.57 ? 21  ALA   D CB  1 
ATOM   2395 N N   . SER   D 1 7  ? 2.685   -11.561 21.016 1   23.68 ? 22  SER   D N   1 
ATOM   2396 C CA  . SER   D 1 7  ? 4.04    -12.043 21.297 1   24.23 ? 22  SER   D CA  1 
ATOM   2397 C C   . SER   D 1 7  ? 3.922   -13.586 21.6   1   24.43 ? 22  SER   D C   1 
ATOM   2398 O O   . SER   D 1 7  ? 2.804   -14.121 21.69  1   24.39 ? 22  SER   D O   1 
ATOM   2399 C CB  . SER   D 1 7  ? 4.586   -11.303 22.509 1   26.32 ? 22  SER   D CB  1 
ATOM   2400 O OG  . SER   D 1 7  ? 3.725   -11.538 23.614 1   29.01 ? 22  SER   D OG  1 
ATOM   2401 N N   . GLU   D 1 8  ? 5.05    -14.286 21.788 1   23.82 ? 23  GLU   D N   1 
ATOM   2402 C CA  . GLU   D 1 8  ? 5.032   -15.709 22.135 1   23.8  ? 23  GLU   D CA  1 
ATOM   2403 C C   . GLU   D 1 8  ? 4.305   -15.94  23.462 1   24.54 ? 23  GLU   D C   1 
ATOM   2404 O O   . GLU   D 1 8  ? 3.598   -16.943 23.612 1   25.16 ? 23  GLU   D O   1 
ATOM   2405 C CB  . GLU   D 1 8  ? 6.461   -16.262 22.246 1   24.7  ? 23  GLU   D CB  1 
ATOM   2406 C CG  . GLU   D 1 8  ? 6.501   -17.779 22.406 1   26.39 ? 23  GLU   D CG  1 
ATOM   2407 C CD  . GLU   D 1 8  ? 7.881   -18.407 22.494 1   29.52 ? 23  GLU   D CD  1 
ATOM   2408 O OE1 . GLU   D 1 8  ? 8.872   -17.654 22.638 1   29.07 ? 23  GLU   D OE1 1 
ATOM   2409 O OE2 . GLU   D 1 8  ? 7.971   -19.656 22.401 1   29.25 ? 23  GLU   D OE2 1 
ATOM   2410 N N   . GLN   D 1 9  ? 4.496   -15.04  24.445 1   23.46 ? 24  GLN   D N   1 
ATOM   2411 C CA  . GLN   D 1 9  ? 3.854   -15.21  25.753 1   25.25 ? 24  GLN   D CA  1 
ATOM   2412 C C   . GLN   D 1 9  ? 2.335   -14.982 25.707 1   24.97 ? 24  GLN   D C   1 
ATOM   2413 O O   . GLN   D 1 9  ? 1.63    -15.463 26.59  1   25.92 ? 24  GLN   D O   1 
ATOM   2414 C CB  . GLN   D 1 9  ? 4.536   -14.383 26.842 1   28.34 ? 24  GLN   D CB  1 
ATOM   2415 C CG  . GLN   D 1 9  ? 6.032   -14.754 26.956 1   34.14 ? 24  GLN   D CG  1 
ATOM   2416 C CD  . GLN   D 1 9  ? 6.585   -14.935 28.353 1   38.51 ? 24  GLN   D CD  1 
ATOM   2417 O OE1 . GLN   D 1 9  ? 7.795   -15.13  28.544 1   41.05 ? 24  GLN   D OE1 1 
ATOM   2418 N NE2 . GLN   D 1 9  ? 5.746   -14.869 29.358 1   38.19 ? 24  GLN   D NE2 1 
ATOM   2419 N N   . GLU   D 1 10 ? 1.82    -14.352 24.642 1   23.64 ? 25  GLU   D N   1 
ATOM   2420 C CA  . GLU   D 1 10 ? 0.374   -14.199 24.48  1   24.47 ? 25  GLU   D CA  1 
ATOM   2421 C C   . GLU   D 1 10 ? -0.27   -15.366 23.716 1   25.28 ? 25  GLU   D C   1 
ATOM   2422 O O   . GLU   D 1 10 ? -1.494  -15.394 23.591 1   25.79 ? 25  GLU   D O   1 
ATOM   2423 C CB  . GLU   D 1 10 ? 0.052   -12.857 23.819 1   26.22 ? 25  GLU   D CB  1 
ATOM   2424 C CG  . GLU   D 1 10 ? 0.378   -11.697 24.731 1   31.99 ? 25  GLU   D CG  1 
ATOM   2425 C CD  . GLU   D 1 10 ? 0.508   -10.372 24.01  1   43.1  ? 25  GLU   D CD  1 
ATOM   2426 O OE1 . GLU   D 1 10 ? 0.802   -10.386 22.793 1   44.03 ? 25  GLU   D OE1 1 
ATOM   2427 O OE2 . GLU   D 1 10 ? 0.316   -9.319  24.658 1   47.89 ? 25  GLU   D OE2 1 
ATOM   2428 N N   . THR   D 1 11 ? 0.527   -16.343 23.234 1   24.68 ? 26  THR   D N   1 
ATOM   2429 C CA  . THR   D 1 11 ? 0.008   -17.489 22.469 1   25.35 ? 26  THR   D CA  1 
ATOM   2430 C C   . THR   D 1 11 ? -0.969  -18.275 23.31  1   24.84 ? 26  THR   D C   1 
ATOM   2431 O O   . THR   D 1 11 ? -0.648  -18.599 24.458 1   24.19 ? 26  THR   D O   1 
ATOM   2432 C CB  . THR   D 1 11 ? 1.145   -18.42  22.034 1   26.63 ? 26  THR   D CB  1 
ATOM   2433 O OG1 . THR   D 1 11 ? 2.124   -17.668 21.331 1   28.01 ? 26  THR   D OG1 1 
ATOM   2434 C CG2 . THR   D 1 11 ? 0.665   -19.586 21.153 1   26.82 ? 26  THR   D CG2 1 
ATOM   2435 N N   . LEU   D 1 12 ? -2.163  -18.551 22.761 1   24.51 ? 27  LEU   D N   1 
ATOM   2436 C CA  . LEU   D 1 12 ? -3.166  -19.323 23.488 1   24.08 ? 27  LEU   D CA  1 
ATOM   2437 C C   . LEU   D 1 12 ? -2.881  -20.811 23.296 1   23.6  ? 27  LEU   D C   1 
ATOM   2438 O O   . LEU   D 1 12 ? -2.626  -21.275 22.181 1   24.66 ? 27  LEU   D O   1 
ATOM   2439 C CB  . LEU   D 1 12 ? -4.579  -18.978 23.024 1   25.09 ? 27  LEU   D CB  1 
ATOM   2440 C CG  . LEU   D 1 12 ? -5.102  -17.615 23.442 1   28.8  ? 27  LEU   D CG  1 
ATOM   2441 C CD1 . LEU   D 1 12 ? -6.481  -17.347 22.769 1   30.37 ? 27  LEU   D CD1 1 
ATOM   2442 C CD2 . LEU   D 1 12 ? -5.241  -17.548 24.966 1   29.43 ? 27  LEU   D CD2 1 
ATOM   2443 N N   . VAL   D 1 13 ? -2.915  -21.561 24.386 1   22.45 ? 28  VAL   D N   1 
ATOM   2444 C CA  . VAL   D 1 13 ? -2.588  -22.967 24.369 1   22.68 ? 28  VAL   D CA  1 
ATOM   2445 C C   . VAL   D 1 13 ? -3.563  -23.799 25.184 1   24.09 ? 28  VAL   D C   1 
ATOM   2446 O O   . VAL   D 1 13 ? -4.161  -23.332 26.16  1   23.8  ? 28  VAL   D O   1 
ATOM   2447 C CB  . VAL   D 1 13 ? -1.109  -23.191 24.845 1   22.94 ? 28  VAL   D CB  1 
ATOM   2448 C CG1 . VAL   D 1 13 ? -0.1    -22.459 23.951 1   23.65 ? 28  VAL   D CG1 1 
ATOM   2449 C CG2 . VAL   D 1 13 ? -0.918  -22.786 26.309 1   23.07 ? 28  VAL   D CG2 1 
ATOM   2450 N N   . ARG   D 1 14 ? -3.693  -25.07  24.796 1   24.98 ? 29  ARG   D N   1 
ATOM   2451 C CA  . ARG   D 1 14 ? -4.514  -26.008 25.523 1   26.85 ? 29  ARG   D CA  1 
ATOM   2452 C C   . ARG   D 1 14 ? -3.611  -27.113 26.032 1   26.71 ? 29  ARG   D C   1 
ATOM   2453 O O   . ARG   D 1 14 ? -3.266  -28.022 25.276 1   26.98 ? 29  ARG   D O   1 
ATOM   2454 C CB  . ARG   D 1 14 ? -5.618  -26.598 24.643 1   30.71 ? 29  ARG   D CB  1 
ATOM   2455 C CG  . ARG   D 1 14 ? -6.973  -25.895 24.795 1   37.77 ? 29  ARG   D CG  1 
ATOM   2456 C CD  . ARG   D 1 14 ? -8.146  -26.73  24.269 1   43.49 ? 29  ARG   D CD  1 
ATOM   2457 N NE  . ARG   D 1 14 ? -7.828  -27.372 22.994 1   49.12 ? 29  ARG   D NE  1 
ATOM   2458 C CZ  . ARG   D 1 14 ? -7.96   -26.795 21.804 1   52.76 ? 29  ARG   D CZ  1 
ATOM   2459 N NH1 . ARG   D 1 14 ? -8.466  -25.573 21.704 1   52.44 ? 29  ARG   D NH1 1 
ATOM   2460 N NH2 . ARG   D 1 14 ? -7.615  -27.449 20.703 1   53.87 ? 29  ARG   D NH2 1 
ATOM   2461 N N   . PRO   D 1 15 ? -3.187  -27.021 27.308 1   25.71 ? 30  PRO   D N   1 
ATOM   2462 C CA  . PRO   D 1 15 ? -2.361  -28.078 27.888 1   25.47 ? 30  PRO   D CA  1 
ATOM   2463 C C   . PRO   D 1 15 ? -3.024  -29.46  27.807 1   25.86 ? 30  PRO   D C   1 
ATOM   2464 O O   . PRO   D 1 15 ? -4.245  -29.597 28.006 1   25.9  ? 30  PRO   D O   1 
ATOM   2465 C CB  . PRO   D 1 15 ? -2.258  -27.659 29.363 1   26.03 ? 30  PRO   D CB  1 
ATOM   2466 C CG  . PRO   D 1 15 ? -2.412  -26.16  29.327 1   26.77 ? 30  PRO   D CG  1 
ATOM   2467 C CD  . PRO   D 1 15 ? -3.492  -25.972 28.301 1   24.93 ? 30  PRO   D CD  1 
ATOM   2468 N N   . LYS   D 1 16 ? -2.208  -30.471 27.504 1   25.36 ? 31  LYS   D N   1 
ATOM   2469 C CA  . LYS   D 1 16 ? -2.589  -31.892 27.501 1   25.55 ? 31  LYS   D CA  1 
ATOM   2470 C C   . LYS   D 1 16 ? -2.852  -32.307 28.972 1   26.32 ? 31  LYS   D C   1 
ATOM   2471 O O   . LYS   D 1 16 ? -2.564  -31.518 29.877 1   26.9  ? 31  LYS   D O   1 
ATOM   2472 C CB  . LYS   D 1 16 ? -1.472  -32.711 26.858 1   28.05 ? 31  LYS   D CB  1 
ATOM   2473 C CG  . LYS   D 1 16 ? -1.312  -32.425 25.374 1   32.51 ? 31  LYS   D CG  1 
ATOM   2474 C CD  . LYS   D 1 16 ? -0.192  -33.247 24.772 1   37.26 ? 31  LYS   D CD  1 
ATOM   2475 C CE  . LYS   D 1 16 ? -0.048  -32.969 23.301 1   42.09 ? 31  LYS   D CE  1 
ATOM   2476 N NZ  . LYS   D 1 16 ? 1.291   -33.389 22.805 1   46.27 ? 31  LYS   D NZ  1 
ATOM   2477 N N   . PRO   D 1 17 ? -3.466  -33.484 29.266 1   26.49 ? 32  PRO   D N   1 
ATOM   2478 C CA  . PRO   D 1 17 ? -3.918  -33.743 30.645 1   25.85 ? 32  PRO   D CA  1 
ATOM   2479 C C   . PRO   D 1 17 ? -2.882  -33.623 31.762 1   24.46 ? 32  PRO   D C   1 
ATOM   2480 O O   . PRO   D 1 17 ? -3.245  -33.14  32.825 1   23.79 ? 32  PRO   D O   1 
ATOM   2481 C CB  . PRO   D 1 17 ? -4.509  -35.166 30.562 1   27.37 ? 32  PRO   D CB  1 
ATOM   2482 C CG  . PRO   D 1 17 ? -5.051  -35.227 29.164 1   28.03 ? 32  PRO   D CG  1 
ATOM   2483 C CD  . PRO   D 1 17 ? -4.002  -34.497 28.335 1   26.51 ? 32  PRO   D CD  1 
ATOM   2484 N N   . LEU   D 1 18 ? -1.629  -34.085 31.56  1   25.14 ? 33  LEU   D N   1 
ATOM   2485 C CA  . LEU   D 1 18 ? -0.64   -34.014 32.641 1   25.91 ? 33  LEU   D CA  1 
ATOM   2486 C C   . LEU   D 1 18 ? -0.3    -32.554 33.004 1   25.36 ? 33  LEU   D C   1 
ATOM   2487 O O   . LEU   D 1 18 ? -0.411  -32.165 34.167 1   25.19 ? 33  LEU   D O   1 
ATOM   2488 C CB  . LEU   D 1 18 ? 0.607   -34.843 32.294 1   27.69 ? 33  LEU   D CB  1 
ATOM   2489 C CG  . LEU   D 1 18 ? 1.779   -34.751 33.267 1   30.77 ? 33  LEU   D CG  1 
ATOM   2490 C CD1 . LEU   D 1 18 ? 1.387   -35.174 34.651 1   32.1  ? 33  LEU   D CD1 1 
ATOM   2491 C CD2 . LEU   D 1 18 ? 2.882   -35.639 32.814 1   32.79 ? 33  LEU   D CD2 1 
ATOM   2492 N N   . LEU   D 1 19 ? 0.037   -31.74  32.013 1   25.4  ? 34  LEU   D N   1 
ATOM   2493 C CA  . LEU   D 1 19 ? 0.342   -30.317 32.256 1   25.1  ? 34  LEU   D CA  1 
ATOM   2494 C C   . LEU   D 1 19 ? -0.871  -29.59  32.84  1   25.46 ? 34  LEU   D C   1 
ATOM   2495 O O   . LEU   D 1 19 ? -0.746  -28.864 33.83  1   25.98 ? 34  LEU   D O   1 
ATOM   2496 C CB  . LEU   D 1 19 ? 0.819   -29.639 30.969 1   25.49 ? 34  LEU   D CB  1 
ATOM   2497 C CG  . LEU   D 1 19 ? 1.093   -28.122 31.073 1   26.43 ? 34  LEU   D CG  1 
ATOM   2498 C CD1 . LEU   D 1 19 ? 2.172   -27.829 32.127 1   26.82 ? 34  LEU   D CD1 1 
ATOM   2499 C CD2 . LEU   D 1 19 ? 1.516   -27.56  29.71  1   26.36 ? 34  LEU   D CD2 1 
ATOM   2500 N N   . LEU   D 1 20 ? -2.079  -29.866 32.311 1   25.57 ? 35  LEU   D N   1 
ATOM   2501 C CA  . LEU   D 1 20 ? -3.298  -29.26  32.845 1   26.05 ? 35  LEU   D CA  1 
ATOM   2502 C C   . LEU   D 1 20 ? -3.486  -29.571 34.319 1   25.3  ? 35  LEU   D C   1 
ATOM   2503 O O   . LEU   D 1 20 ? -3.777  -28.675 35.099 1   25.49 ? 35  LEU   D O   1 
ATOM   2504 C CB  . LEU   D 1 20 ? -4.509  -29.724 32.031 1   26.99 ? 35  LEU   D CB  1 
ATOM   2505 C CG  . LEU   D 1 20 ? -5.826  -29.073 32.388 1   29.16 ? 35  LEU   D CG  1 
ATOM   2506 C CD1 . LEU   D 1 20 ? -5.783  -27.554 32.09  1   29.57 ? 35  LEU   D CD1 1 
ATOM   2507 C CD2 . LEU   D 1 20 ? -6.95   -29.741 31.616 1   28.93 ? 35  LEU   D CD2 1 
ATOM   2508 N N   . LYS   D 1 21 ? -3.26   -30.833 34.728 1   24.88 ? 36  LYS   D N   1 
ATOM   2509 C CA  . LYS   D 1 21 ? -3.384  -31.203 36.142 1   24.89 ? 36  LYS   D CA  1 
ATOM   2510 C C   . LYS   D 1 21 ? -2.389  -30.39  37.016 1   25.32 ? 36  LYS   D C   1 
ATOM   2511 O O   . LYS   D 1 21 ? -2.752  -29.925 38.101 1   26.07 ? 36  LYS   D O   1 
ATOM   2512 C CB  . LYS   D 1 21 ? -3.132  -32.722 36.313 1   26.19 ? 36  LYS   D CB  1 
ATOM   2513 C CG  . LYS   D 1 21 ? -3.344  -33.194 37.744 1   31.03 ? 36  LYS   D CG  1 
ATOM   2514 C CD  . LYS   D 1 21 ? -2.095  -33.656 38.436 1   36.56 ? 36  LYS   D CD  1 
ATOM   2515 C CE  . LYS   D 1 21 ? -2.409  -34.563 39.609 1   39.46 ? 36  LYS   D CE  1 
ATOM   2516 N NZ  . LYS   D 1 21 ? -3.567  -34.074 40.402 1   41.32 ? 36  LYS   D NZ  1 
ATOM   2517 N N   . LEU   D 1 22 ? -1.154  -30.197 36.538 1   25.65 ? 37  LEU   D N   1 
ATOM   2518 C CA  . LEU   D 1 22 ? -0.158  -29.419 37.293 1   26.33 ? 37  LEU   D CA  1 
ATOM   2519 C C   . LEU   D 1 22 ? -0.619  -27.981 37.497 1   26.45 ? 37  LEU   D C   1 
ATOM   2520 O O   . LEU   D 1 22 ? -0.529  -27.447 38.611 1   26.22 ? 37  LEU   D O   1 
ATOM   2521 C CB  . LEU   D 1 22 ? 1.221   -29.448 36.6   1   26.6  ? 37  LEU   D CB  1 
ATOM   2522 C CG  . LEU   D 1 22 ? 1.831   -30.831 36.323 1   28.5  ? 37  LEU   D CG  1 
ATOM   2523 C CD1 . LEU   D 1 22 ? 3.261   -30.703 35.824 1   29.85 ? 37  LEU   D CD1 1 
ATOM   2524 C CD2 . LEU   D 1 22 ? 1.776   -31.738 37.565 1   29.18 ? 37  LEU   D CD2 1 
ATOM   2525 N N   . LEU   D 1 23 ? -1.137  -27.369 36.435 1   26.91 ? 38  LEU   D N   1 
ATOM   2526 C CA  . LEU   D 1 23 ? -1.631  -25.996 36.505 1   28.26 ? 38  LEU   D CA  1 
ATOM   2527 C C   . LEU   D 1 23 ? -2.828  -25.912 37.436 1   28.97 ? 38  LEU   D C   1 
ATOM   2528 O O   . LEU   D 1 23 ? -2.895  -24.985 38.233 1   29.51 ? 38  LEU   D O   1 
ATOM   2529 C CB  . LEU   D 1 23 ? -2.009  -25.469 35.112 1   28.6  ? 38  LEU   D CB  1 
ATOM   2530 C CG  . LEU   D 1 23 ? -0.921  -25.572 34.03  1   30.71 ? 38  LEU   D CG  1 
ATOM   2531 C CD1 . LEU   D 1 23 ? -1.426  -25.105 32.668 1   30.93 ? 38  LEU   D CD1 1 
ATOM   2532 C CD2 . LEU   D 1 23 ? 0.368   -24.922 34.443 1   31.26 ? 38  LEU   D CD2 1 
ATOM   2533 N N   . LYS   D 1 24 ? -3.755  -26.887 37.37  1   28.49 ? 39  LYS   D N   1 
ATOM   2534 C CA  . LYS   D 1 24 ? -4.931  -26.847 38.254 1   29.41 ? 39  LYS   D CA  1 
ATOM   2535 C C   . LYS   D 1 24 ? -4.576  -27.088 39.727 1   30.79 ? 39  LYS   D C   1 
ATOM   2536 O O   . LYS   D 1 24 ? -5.247  -26.558 40.614 1   31.38 ? 39  LYS   D O   1 
ATOM   2537 C CB  . LYS   D 1 24 ? -6.03   -27.809 37.77  1   29.88 ? 39  LYS   D CB  1 
ATOM   2538 C CG  . LYS   D 1 24 ? -6.566  -27.428 36.399 1   32.55 ? 39  LYS   D CG  1 
ATOM   2539 C CD  . LYS   D 1 24 ? -7.848  -28.18  36.06  1   35.96 ? 39  LYS   D CD  1 
ATOM   2540 C CE  . LYS   D 1 24 ? -8.474  -27.658 34.79  1   39.98 ? 39  LYS   D CE  1 
ATOM   2541 N NZ  . LYS   D 1 24 ? -9.752  -28.352 34.478 1   42.19 ? 39  LYS   D NZ  1 
ATOM   2542 N N   . SER   D 1 25 ? -3.483  -27.82  39.984 1   31.24 ? 40  SER   D N   1 
ATOM   2543 C CA  . SER   D 1 25 ? -3.03   -28.108 41.338 1   32.53 ? 40  SER   D CA  1 
ATOM   2544 C C   . SER   D 1 25 ? -2.609  -26.841 42.094 1   33.89 ? 40  SER   D C   1 
ATOM   2545 O O   . SER   D 1 25 ? -2.722  -26.804 43.321 1   34.21 ? 40  SER   D O   1 
ATOM   2546 C CB  . SER   D 1 25 ? -1.923  -29.158 41.322 1   33.4  ? 40  SER   D CB  1 
ATOM   2547 O OG  . SER   D 1 25 ? -0.685  -28.598 40.919 1   35.09 ? 40  SER   D OG  1 
ATOM   2548 N N   . VAL   D 1 26 ? -2.155  -25.794 41.376 1   34.12 ? 41  VAL   D N   1 
ATOM   2549 C CA  . VAL   D 1 26 ? -1.802  -24.538 42.031 1   35.45 ? 41  VAL   D CA  1 
ATOM   2550 C C   . VAL   D 1 26 ? -2.929  -23.488 41.978 1   37.24 ? 41  VAL   D C   1 
ATOM   2551 O O   . VAL   D 1 26 ? -2.673  -22.32  42.261 1   38.21 ? 41  VAL   D O   1 
ATOM   2552 C CB  . VAL   D 1 26 ? -0.452  -23.939 41.575 1   35.57 ? 41  VAL   D CB  1 
ATOM   2553 C CG1 . VAL   D 1 26 ? 0.713   -24.728 42.161 1   35.74 ? 41  VAL   D CG1 1 
ATOM   2554 C CG2 . VAL   D 1 26 ? -0.358  -23.875 40.062 1   35.78 ? 41  VAL   D CG2 1 
ATOM   2555 N N   . GLY   D 1 27 ? -4.157  -23.897 41.673 1   37.92 ? 42  GLY   D N   1 
ATOM   2556 C CA  . GLY   D 1 27 ? -5.292  -22.978 41.7   1   39.02 ? 42  GLY   D CA  1 
ATOM   2557 C C   . GLY   D 1 27 ? -5.885  -22.512 40.383 1   39.48 ? 42  GLY   D C   1 
ATOM   2558 O O   . GLY   D 1 27 ? -6.935  -21.863 40.4   1   39.49 ? 42  GLY   D O   1 
ATOM   2559 N N   . ALA   D 1 28 ? -5.23   -22.792 39.238 1   39.65 ? 43  ALA   D N   1 
ATOM   2560 C CA  . ALA   D 1 28 ? -5.806  -22.393 37.948 1   40.43 ? 43  ALA   D CA  1 
ATOM   2561 C C   . ALA   D 1 28 ? -7.106  -23.208 37.691 1   41.21 ? 43  ALA   D C   1 
ATOM   2562 O O   . ALA   D 1 28 ? -7.178  -24.394 38.033 1   41.43 ? 43  ALA   D O   1 
ATOM   2563 C CB  . ALA   D 1 28 ? -4.805  -22.591 36.831 1   40.21 ? 43  ALA   D CB  1 
ATOM   2564 N N   . GLN   D 1 29 ? -8.157  -22.545 37.204 1   41.34 ? 44  GLN   D N   1 
ATOM   2565 C CA  . GLN   D 1 29 ? -9.446  -23.198 37.006 1   41.51 ? 44  GLN   D CA  1 
ATOM   2566 C C   . GLN   D 1 29 ? -9.956  -23.13  35.562 1   40.42 ? 44  GLN   D C   1 
ATOM   2567 O O   . GLN   D 1 29 ? -11.165 -22.992 35.337 1   41.84 ? 44  GLN   D O   1 
ATOM   2568 C CB  . GLN   D 1 29 ? -10.482 -22.613 37.972 1   45.12 ? 44  GLN   D CB  1 
ATOM   2569 C CG  . GLN   D 1 29 ? -11.419 -23.665 38.553 1   51.41 ? 44  GLN   D CG  1 
ATOM   2570 C CD  . GLN   D 1 29 ? -12.149 -23.153 39.764 1   58.8  ? 44  GLN   D CD  1 
ATOM   2571 O OE1 . GLN   D 1 29 ? -13.37  -22.936 39.742 1   61.01 ? 44  GLN   D OE1 1 
ATOM   2572 N NE2 . GLN   D 1 29 ? -11.418 -22.978 40.859 1   60.17 ? 44  GLN   D NE2 1 
ATOM   2573 N N   . LYS   D 1 30 ? -9.051  -23.21  34.588 1   37.46 ? 45  LYS   D N   1 
ATOM   2574 C CA  . LYS   D 1 30 ? -9.463  -23.192 33.182 1   35.26 ? 45  LYS   D CA  1 
ATOM   2575 C C   . LYS   D 1 30 ? -8.712  -24.22  32.355 1   32.53 ? 45  LYS   D C   1 
ATOM   2576 O O   . LYS   D 1 30 ? -7.825  -24.87  32.868 1   31.87 ? 45  LYS   D O   1 
ATOM   2577 C CB  . LYS   D 1 30 ? -9.377  -21.785 32.596 1   36.21 ? 45  LYS   D CB  1 
ATOM   2578 C CG  . LYS   D 1 30 ? -8      -21.188 32.652 1   37.85 ? 45  LYS   D CG  1 
ATOM   2579 C CD  . LYS   D 1 30 ? -8.092  -19.691 32.438 1   39.9  ? 45  LYS   D CD  1 
ATOM   2580 C CE  . LYS   D 1 30 ? -6.72   -19.08  32.374 1   42.55 ? 45  LYS   D CE  1 
ATOM   2581 N NZ  . LYS   D 1 30 ? -6.797  -17.607 32.199 1   43.73 ? 45  LYS   D NZ  1 
ATOM   2582 N N   . ASP   D 1 31 ? -9.133  -24.436 31.111 1   31    ? 46  ASP   D N   1 
ATOM   2583 C CA  . ASP   D 1 31 ? -8.553  -25.409 30.206 1   30.19 ? 46  ASP   D CA  1 
ATOM   2584 C C   . ASP   D 1 31 ? -7.664  -24.787 29.123 1   28.29 ? 46  ASP   D C   1 
ATOM   2585 O O   . ASP   D 1 31 ? -6.868  -25.506 28.518 1   27.92 ? 46  ASP   D O   1 
ATOM   2586 C CB  . ASP   D 1 31 ? -9.671  -26.231 29.563 1   32.52 ? 46  ASP   D CB  1 
ATOM   2587 C CG  . ASP   D 1 31 ? -10.372 -27.201 30.512 1   38.85 ? 46  ASP   D CG  1 
ATOM   2588 O OD1 . ASP   D 1 31 ? -9.89   -27.377 31.658 1   38.95 ? 46  ASP   D OD1 1 
ATOM   2589 O OD2 . ASP   D 1 31 ? -11.404 -27.776 30.111 1   42.59 ? 46  ASP   D OD2 1 
ATOM   2590 N N   . THR   D 1 32 ? -7.815  -23.471 28.869 1   26.96 ? 47  THR   D N   1 
ATOM   2591 C CA  . THR   D 1 32 ? -7.056  -22.713 27.871 1   27.11 ? 47  THR   D CA  1 
ATOM   2592 C C   . THR   D 1 32 ? -6.283  -21.6   28.564 1   26.86 ? 47  THR   D C   1 
ATOM   2593 O O   . THR   D 1 32 ? -6.825  -20.895 29.421 1   27.83 ? 47  THR   D O   1 
ATOM   2594 C CB  . THR   D 1 32 ? -7.971  -22.164 26.755 1   28.57 ? 47  THR   D CB  1 
ATOM   2595 O OG1 . THR   D 1 32 ? -8.851  -23.194 26.305 1   29.09 ? 47  THR   D OG1 1 
ATOM   2596 C CG2 . THR   D 1 32 ? -7.182  -21.648 25.567 1   28.58 ? 47  THR   D CG2 1 
ATOM   2597 N N   . TYR   D 1 33 ? -5.007  -21.463 28.222 1   25.6  ? 48  TYR   D N   1 
ATOM   2598 C CA  . TYR   D 1 33 ? -4.085  -20.524 28.866 1   25.02 ? 48  TYR   D CA  1 
ATOM   2599 C C   . TYR   D 1 33 ? -3.256  -19.756 27.838 1   23.55 ? 48  TYR   D C   1 
ATOM   2600 O O   . TYR   D 1 33 ? -3.185  -20.163 26.693 1   24.19 ? 48  TYR   D O   1 
ATOM   2601 C CB  . TYR   D 1 33 ? -3.079  -21.347 29.714 1   24.74 ? 48  TYR   D CB  1 
ATOM   2602 C CG  . TYR   D 1 33 ? -3.709  -22.084 30.87  1   25.36 ? 48  TYR   D CG  1 
ATOM   2603 C CD1 . TYR   D 1 33 ? -4.34   -23.308 30.683 1   25.82 ? 48  TYR   D CD1 1 
ATOM   2604 C CD2 . TYR   D 1 33 ? -3.666  -21.564 32.156 1   27.12 ? 48  TYR   D CD2 1 
ATOM   2605 C CE1 . TYR   D 1 33 ? -4.961  -23.965 31.738 1   26.45 ? 48  TYR   D CE1 1 
ATOM   2606 C CE2 . TYR   D 1 33 ? -4.29   -22.207 33.215 1   27.77 ? 48  TYR   D CE2 1 
ATOM   2607 C CZ  . TYR   D 1 33 ? -4.913  -23.421 33.007 1   28.28 ? 48  TYR   D CZ  1 
ATOM   2608 O OH  . TYR   D 1 33 ? -5.553  -24.052 34.051 1   29.82 ? 48  TYR   D OH  1 
ATOM   2609 N N   . THR   D 1 34 ? -2.58   -18.698 28.257 1   22.49 ? 49  THR   D N   1 
ATOM   2610 C CA  . THR   D 1 34 ? -1.541  -18.083 27.436 1   22.35 ? 49  THR   D CA  1 
ATOM   2611 C C   . THR   D 1 34 ? -0.226  -18.793 27.865 1   22.16 ? 49  THR   D C   1 
ATOM   2612 O O   . THR   D 1 34 ? -0.153  -19.357 28.979 1   22.68 ? 49  THR   D O   1 
ATOM   2613 C CB  . THR   D 1 34 ? -1.437  -16.578 27.672 1   23.21 ? 49  THR   D CB  1 
ATOM   2614 O OG1 . THR   D 1 34 ? -0.966  -16.342 28.998 1   23.63 ? 49  THR   D OG1 1 
ATOM   2615 C CG2 . THR   D 1 34 ? -2.763  -15.882 27.465 1   24.88 ? 49  THR   D CG2 1 
ATOM   2616 N N   . MET   D 1 35 ? 0.81    -18.739 27.035 1   20.42 ? 50  MET   D N   1 
ATOM   2617 C CA  . MET   D 1 35 ? 2.127   -19.277 27.407 1   20.79 ? 50  MET   D CA  1 
ATOM   2618 C C   . MET   D 1 35 ? 2.666   -18.604 28.694 1   21.12 ? 50  MET   D C   1 
ATOM   2619 O O   . MET   D 1 35 ? 3.239   -19.274 29.556 1   21.46 ? 50  MET   D O   1 
ATOM   2620 C CB  . MET   D 1 35 ? 3.12    -19.101 26.251 1   21.7  ? 50  MET   D CB  1 
ATOM   2621 C CG  . MET   D 1 35 ? 2.986   -20.157 25.191 1   24.72 ? 50  MET   D CG  1 
ATOM   2622 S SD  . MET   D 1 35 ? 3.341   -21.833 25.774 1   30.61 ? 50  MET   D SD  1 
ATOM   2623 C CE  . MET   D 1 35 ? 4.996   -21.629 26.316 1   27.42 ? 50  MET   D CE  1 
ATOM   2624 N N   . LYS   D 1 36 ? 2.425   -17.294 28.851 1   20.82 ? 51  LYS   D N   1 
ATOM   2625 C CA  . LYS   D 1 36 ? 2.809   -16.58  30.069 1   20.84 ? 51  LYS   D CA  1 
ATOM   2626 C C   . LYS   D 1 36 ? 2.162   -17.219 31.327 1   20.11 ? 51  LYS   D C   1 
ATOM   2627 O O   . LYS   D 1 36 ? 2.85    -17.464 32.336 1   20.24 ? 51  LYS   D O   1 
ATOM   2628 C CB  . LYS   D 1 36 ? 2.364   -15.11  29.956 1   22.31 ? 51  LYS   D CB  1 
ATOM   2629 C CG  . LYS   D 1 36 ? 2.786   -14.283 31.141 1   27.49 ? 51  LYS   D CG  1 
ATOM   2630 C CD  . LYS   D 1 36 ? 2.284   -12.867 31.008 1   32.66 ? 51  LYS   D CD  1 
ATOM   2631 C CE  . LYS   D 1 36 ? 3.408   -11.888 30.959 1   37.07 ? 51  LYS   D CE  1 
ATOM   2632 N NZ  . LYS   D 1 36 ? 2.895   -10.484 31.033 1   41.77 ? 51  LYS   D NZ  1 
ATOM   2633 N N   . GLU   D 1 37 ? 0.863   -17.548 31.243 1   19.45 ? 52  GLU   D N   1 
ATOM   2634 C CA  . GLU   D 1 37 ? 0.189   -18.187 32.386 1   20.34 ? 52  GLU   D CA  1 
ATOM   2635 C C   . GLU   D 1 37 ? 0.766   -19.577 32.647 1   20.66 ? 52  GLU   D C   1 
ATOM   2636 O O   . GLU   D 1 37 ? 0.948   -19.944 33.819 1   21.25 ? 52  GLU   D O   1 
ATOM   2637 C CB  . GLU   D 1 37 ? -1.321  -18.276 32.167 1   23.09 ? 52  GLU   D CB  1 
ATOM   2638 C CG  . GLU   D 1 37 ? -2.04   -16.951 32.259 1   26.58 ? 52  GLU   D CG  1 
ATOM   2639 C CD  . GLU   D 1 37 ? -3.502  -17.084 31.874 1   31.63 ? 52  GLU   D CD  1 
ATOM   2640 O OE1 . GLU   D 1 37 ? -4.35   -16.406 32.5   1   31.92 ? 52  GLU   D OE1 1 
ATOM   2641 O OE2 . GLU   D 1 37 ? -3.802  -17.891 30.967 1   30.93 ? 52  GLU   D OE2 1 
ATOM   2642 N N   . VAL   D 1 38 ? 1.122   -20.315 31.587 1   20.42 ? 53  VAL   D N   1 
ATOM   2643 C CA  . VAL   D 1 38 ? 1.715   -21.654 31.748 1   20.84 ? 53  VAL   D CA  1 
ATOM   2644 C C   . VAL   D 1 38 ? 3.071   -21.536 32.507 1   21.18 ? 53  VAL   D C   1 
ATOM   2645 O O   . VAL   D 1 38 ? 3.275   -22.232 33.501 1   20.16 ? 53  VAL   D O   1 
ATOM   2646 C CB  . VAL   D 1 38 ? 1.856   -22.419 30.396 1   21.56 ? 53  VAL   D CB  1 
ATOM   2647 C CG1 . VAL   D 1 38 ? 2.66    -23.721 30.57  1   21.66 ? 53  VAL   D CG1 1 
ATOM   2648 C CG2 . VAL   D 1 38 ? 0.479   -22.729 29.803 1   21.44 ? 53  VAL   D CG2 1 
ATOM   2649 N N   . LEU   D 1 39 ? 3.914   -20.561 32.12  1   21.42 ? 54  LEU   D N   1 
ATOM   2650 C CA  . LEU   D 1 39 ? 5.212   -20.312 32.764 1   21.57 ? 54  LEU   D CA  1 
ATOM   2651 C C   . LEU   D 1 39 ? 4.988   -19.88  34.229 1   21.65 ? 54  LEU   D C   1 
ATOM   2652 O O   . LEU   D 1 39 ? 5.675   -20.358 35.134 1   21.27 ? 54  LEU   D O   1 
ATOM   2653 C CB  . LEU   D 1 39 ? 5.983   -19.216 31.991 1   22.16 ? 54  LEU   D CB  1 
ATOM   2654 C CG  . LEU   D 1 39 ? 6.508   -19.622 30.601 1   25.1  ? 54  LEU   D CG  1 
ATOM   2655 C CD1 . LEU   D 1 39 ? 7.183   -18.43  29.876 1   26.17 ? 54  LEU   D CD1 1 
ATOM   2656 C CD2 . LEU   D 1 39 ? 7.477   -20.757 30.704 1   26.33 ? 54  LEU   D CD2 1 
ATOM   2657 N N   . PHE   D 1 40 ? 4.007   -18.995 34.45  1   22.12 ? 55  PHE   D N   1 
ATOM   2658 C CA  . PHE   D 1 40 ? 3.676   -18.48  35.779 1   22.68 ? 55  PHE   D CA  1 
ATOM   2659 C C   . PHE   D 1 40 ? 3.28    -19.628 36.731 1   22.55 ? 55  PHE   D C   1 
ATOM   2660 O O   . PHE   D 1 40 ? 3.893   -19.782 37.794 1   21.54 ? 55  PHE   D O   1 
ATOM   2661 C CB  . PHE   D 1 40 ? 2.558   -17.429 35.707 1   22.87 ? 55  PHE   D CB  1 
ATOM   2662 C CG  . PHE   D 1 40 ? 2.217   -16.86  37.068 1   24.82 ? 55  PHE   D CG  1 
ATOM   2663 C CD1 . PHE   D 1 40 ? 2.943   -15.809 37.597 1   26.49 ? 55  PHE   D CD1 1 
ATOM   2664 C CD2 . PHE   D 1 40 ? 1.178   -17.389 37.817 1   26.05 ? 55  PHE   D CD2 1 
ATOM   2665 C CE1 . PHE   D 1 40 ? 2.612   -15.275 38.839 1   27.44 ? 55  PHE   D CE1 1 
ATOM   2666 C CE2 . PHE   D 1 40 ? 0.851   -16.856 39.055 1   27.39 ? 55  PHE   D CE2 1 
ATOM   2667 C CZ  . PHE   D 1 40 ? 1.589   -15.817 39.568 1   27.36 ? 55  PHE   D CZ  1 
ATOM   2668 N N   . TYR   D 1 41 ? 2.316   -20.446 36.321 1   22.63 ? 56  TYR   D N   1 
ATOM   2669 C CA  . TYR   D 1 41 ? 1.817   -21.546 37.154 1   24.3  ? 56  TYR   D CA  1 
ATOM   2670 C C   . TYR   D 1 41 ? 2.831   -22.681 37.326 1   24.15 ? 56  TYR   D C   1 
ATOM   2671 O O   . TYR   D 1 41 ? 2.86    -23.304 38.394 1   25.39 ? 56  TYR   D O   1 
ATOM   2672 C CB  . TYR   D 1 41 ? 0.464   -22.052 36.654 1   24.75 ? 56  TYR   D CB  1 
ATOM   2673 C CG  . TYR   D 1 41 ? -0.645  -21.041 36.861 1   25.29 ? 56  TYR   D CG  1 
ATOM   2674 C CD1 . TYR   D 1 41 ? -0.891  -20.494 38.113 1   26.75 ? 56  TYR   D CD1 1 
ATOM   2675 C CD2 . TYR   D 1 41 ? -1.483  -20.675 35.816 1   26.44 ? 56  TYR   D CD2 1 
ATOM   2676 C CE1 . TYR   D 1 41 ? -1.907  -19.561 38.308 1   28.04 ? 56  TYR   D CE1 1 
ATOM   2677 C CE2 . TYR   D 1 41 ? -2.503  -19.752 35.997 1   28.28 ? 56  TYR   D CE2 1 
ATOM   2678 C CZ  . TYR   D 1 41 ? -2.721  -19.204 37.248 1   30.05 ? 56  TYR   D CZ  1 
ATOM   2679 O OH  . TYR   D 1 41 ? -3.742  -18.298 37.419 1   32.92 ? 56  TYR   D OH  1 
ATOM   2680 N N   A LEU   D 1 42 ? 3.661   -22.94  36.313 0.5 23.69 ? 57  LEU   D N   1 
ATOM   2681 N N   B LEU   D 1 42 ? 3.657   -22.936 36.316 0.5 23.89 ? 57  LEU   D N   1 
ATOM   2682 C CA  A LEU   D 1 42 ? 4.698   -23.974 36.419 0.5 23.95 ? 57  LEU   D CA  1 
ATOM   2683 C CA  B LEU   D 1 42 ? 4.693   -23.967 36.409 0.5 24.36 ? 57  LEU   D CA  1 
ATOM   2684 C C   A LEU   D 1 42 ? 5.758   -23.55  37.445 0.5 24.45 ? 57  LEU   D C   1 
ATOM   2685 C C   B LEU   D 1 42 ? 5.763   -23.552 37.43  0.5 24.65 ? 57  LEU   D C   1 
ATOM   2686 O O   A LEU   D 1 42 ? 6.213   -24.375 38.232 0.5 24.34 ? 57  LEU   D O   1 
ATOM   2687 O O   B LEU   D 1 42 ? 6.228   -24.386 38.2   0.5 24.56 ? 57  LEU   D O   1 
ATOM   2688 C CB  A LEU   D 1 42 ? 5.343   -24.249 35.055 0.5 23.59 ? 57  LEU   D CB  1 
ATOM   2689 C CB  B LEU   D 1 42 ? 5.318   -24.214 35.026 0.5 24.36 ? 57  LEU   D CB  1 
ATOM   2690 C CG  A LEU   D 1 42 ? 6.298   -25.437 34.985 0.5 25.05 ? 57  LEU   D CG  1 
ATOM   2691 C CG  B LEU   D 1 42 ? 5.287   -25.624 34.397 0.5 26.38 ? 57  LEU   D CG  1 
ATOM   2692 C CD1 A LEU   D 1 42 ? 5.577   -26.732 35.348 0.5 25.6  ? 57  LEU   D CD1 1 
ATOM   2693 C CD1 B LEU   D 1 42 ? 4.2     -26.551 34.989 0.5 26.96 ? 57  LEU   D CD1 1 
ATOM   2694 C CD2 A LEU   D 1 42 ? 6.915   -25.546 33.596 0.5 25.56 ? 57  LEU   D CD2 1 
ATOM   2695 C CD2 B LEU   D 1 42 ? 5.132   -25.535 32.896 0.5 26.87 ? 57  LEU   D CD2 1 
ATOM   2696 N N   . GLY   D 1 43 ? 6.116   -22.265 37.453 1   24.66 ? 58  GLY   D N   1 
ATOM   2697 C CA  . GLY   D 1 43 ? 7.073   -21.728 38.423 1   25.54 ? 58  GLY   D CA  1 
ATOM   2698 C C   . GLY   D 1 43 ? 6.494   -21.762 39.829 1   25.88 ? 58  GLY   D C   1 
ATOM   2699 O O   . GLY   D 1 43 ? 7.178   -22.128 40.79  1   26.07 ? 58  GLY   D O   1 
ATOM   2700 N N   . GLN   D 1 44 ? 5.193   -21.458 39.945 1   25.57 ? 59  GLN   D N   1 
ATOM   2701 C CA  . GLN   D 1 44 ? 4.457   -21.524 41.212 1   26.76 ? 59  GLN   D CA  1 
ATOM   2702 C C   . GLN   D 1 44 ? 4.387   -22.98  41.73  1   26.14 ? 59  GLN   D C   1 
ATOM   2703 O O   . GLN   D 1 44 ? 4.553   -23.244 42.922 1   25.88 ? 59  GLN   D O   1 
ATOM   2704 C CB  . GLN   D 1 44 ? 3.051   -20.956 40.987 1   30.1  ? 59  GLN   D CB  1 
ATOM   2705 C CG  . GLN   D 1 44 ? 2.328   -20.564 42.24  1   35.02 ? 59  GLN   D CG  1 
ATOM   2706 C CD  . GLN   D 1 44 ? 1.094   -19.795 41.865 1   38.53 ? 59  GLN   D CD  1 
ATOM   2707 O OE1 . GLN   D 1 44 ? 0.134   -20.348 41.332 1   41.62 ? 59  GLN   D OE1 1 
ATOM   2708 N NE2 . GLN   D 1 44 ? 1.098   -18.51  42.106 1   37.56 ? 59  GLN   D NE2 1 
ATOM   2709 N N   . TYR   D 1 45 ? 4.223   -23.914 40.821 1   25.38 ? 60  TYR   D N   1 
ATOM   2710 C CA  . TYR   D 1 45 ? 4.197   -25.342 41.143 1   25.79 ? 60  TYR   D CA  1 
ATOM   2711 C C   . TYR   D 1 45 ? 5.546   -25.788 41.719 1   25.8  ? 60  TYR   D C   1 
ATOM   2712 O O   . TYR   D 1 45 ? 5.563   -26.383 42.785 1   25.94 ? 60  TYR   D O   1 
ATOM   2713 C CB  . TYR   D 1 45 ? 3.863   -26.129 39.886 1   25.29 ? 60  TYR   D CB  1 
ATOM   2714 C CG  . TYR   D 1 45 ? 3.778   -27.62  40.109 1   26.02 ? 60  TYR   D CG  1 
ATOM   2715 C CD1 . TYR   D 1 45 ? 2.577   -28.22  40.457 1   26.95 ? 60  TYR   D CD1 1 
ATOM   2716 C CD2 . TYR   D 1 45 ? 4.882   -28.435 39.917 1   27.09 ? 60  TYR   D CD2 1 
ATOM   2717 C CE1 . TYR   D 1 45 ? 2.486   -29.59  40.651 1   27.77 ? 60  TYR   D CE1 1 
ATOM   2718 C CE2 . TYR   D 1 45 ? 4.799   -29.81  40.089 1   28    ? 60  TYR   D CE2 1 
ATOM   2719 C CZ  . TYR   D 1 45 ? 3.593   -30.384 40.452 1   28.66 ? 60  TYR   D CZ  1 
ATOM   2720 O OH  . TYR   D 1 45 ? 3.472   -31.739 40.636 1   29.21 ? 60  TYR   D OH  1 
ATOM   2721 N N   . ILE   D 1 46 ? 6.675   -25.504 41.018 1   25.42 ? 61  ILE   D N   1 
ATOM   2722 C CA  . ILE   D 1 46 ? 8.006   -25.883 41.475 1   25.96 ? 61  ILE   D CA  1 
ATOM   2723 C C   . ILE   D 1 46 ? 8.323   -25.261 42.826 1   28.49 ? 61  ILE   D C   1 
ATOM   2724 O O   . ILE   D 1 46 ? 8.821   -25.946 43.724 1   30.09 ? 61  ILE   D O   1 
ATOM   2725 C CB  . ILE   D 1 46 ? 9.089   -25.604 40.417 1   25.49 ? 61  ILE   D CB  1 
ATOM   2726 C CG1 . ILE   D 1 46 ? 8.834   -26.442 39.155 1   26.3  ? 61  ILE   D CG1 1 
ATOM   2727 C CG2 . ILE   D 1 46 ? 10.507  -25.871 40.977 1   25.16 ? 61  ILE   D CG2 1 
ATOM   2728 C CD1 . ILE   D 1 46 ? 9.404   -25.828 37.809 1   27.58 ? 61  ILE   D CD1 1 
ATOM   2729 N N   . MET   D 1 47 ? 8.016   -23.978 42.971 1   28.43 ? 62  MET   D N   1 
ATOM   2730 C CA  . MET   D 1 47 ? 8.248   -23.253 44.199 1   29.74 ? 62  MET   D CA  1 
ATOM   2731 C C   . MET   D 1 47 ? 7.428   -23.83  45.365 1   30.72 ? 62  MET   D C   1 
ATOM   2732 O O   . MET   D 1 47 ? 8.027   -24.242 46.35  1   31.13 ? 62  MET   D O   1 
ATOM   2733 C CB  . MET   D 1 47 ? 8.003   -21.741 44.006 1   30.87 ? 62  MET   D CB  1 
ATOM   2734 C CG  . MET   D 1 47 ? 8.272   -20.921 45.257 1   33.4  ? 62  MET   D CG  1 
ATOM   2735 S SD  . MET   D 1 47 ? 10.009  -21.021 45.77  1   36.56 ? 62  MET   D SD  1 
ATOM   2736 C CE  . MET   D 1 47 ? 9.887   -20.249 47.38  1   35.49 ? 62  MET   D CE  1 
ATOM   2737 N N   . THR   D 1 48 ? 6.09    -23.931 45.248 1   31.12 ? 63  THR   D N   1 
ATOM   2738 C CA  . THR   D 1 48 ? 5.242   -24.445 46.327 1   32.72 ? 63  THR   D CA  1 
ATOM   2739 C C   . THR   D 1 48 ? 5.66    -25.855 46.784 1   32.82 ? 63  THR   D C   1 
ATOM   2740 O O   . THR   D 1 48 ? 5.736   -26.14  47.992 1   32.55 ? 63  THR   D O   1 
ATOM   2741 C CB  . THR   D 1 48 ? 3.758   -24.437 45.871 1   35.24 ? 63  THR   D CB  1 
ATOM   2742 O OG1 . THR   D 1 48 ? 3.332   -23.078 45.731 1   37.41 ? 63  THR   D OG1 1 
ATOM   2743 C CG2 . THR   D 1 48 ? 2.844   -25.147 46.844 1   35.88 ? 63  THR   D CG2 1 
ATOM   2744 N N   . LYS   D 1 49 ? 5.928   -26.727 45.809 1   31.91 ? 64  LYS   D N   1 
ATOM   2745 C CA  . LYS   D 1 49 ? 6.308   -28.101 46.096 1   32.29 ? 64  LYS   D CA  1 
ATOM   2746 C C   . LYS   D 1 49 ? 7.768   -28.292 46.464 1   31.54 ? 64  LYS   D C   1 
ATOM   2747 O O   . LYS   D 1 49 ? 8.151   -29.431 46.681 1   31.18 ? 64  LYS   D O   1 
ATOM   2748 C CB  . LYS   D 1 49 ? 5.941   -29.016 44.928 1   33.84 ? 64  LYS   D CB  1 
ATOM   2749 C CG  . LYS   D 1 49 ? 4.441   -28.97  44.662 1   36.13 ? 64  LYS   D CG  1 
ATOM   2750 C CD  . LYS   D 1 49 ? 3.973   -30.168 43.913 1   37.67 ? 64  LYS   D CD  1 
ATOM   2751 C CE  . LYS   D 1 49 ? 3.906   -31.402 44.778 1   39.17 ? 64  LYS   D CE  1 
ATOM   2752 N NZ  . LYS   D 1 49 ? 3.396   -32.561 43.998 1   39.82 ? 64  LYS   D NZ  1 
ATOM   2753 N N   . ARG   D 1 50 ? 8.573   -27.208 46.481 1   30.51 ? 65  ARG   D N   1 
ATOM   2754 C CA  . ARG   D 1 50 ? 9.997   -27.203 46.812 1   31.4  ? 65  ARG   D CA  1 
ATOM   2755 C C   . ARG   D 1 50 ? 10.797  -28.262 46.068 1   31.24 ? 65  ARG   D C   1 
ATOM   2756 O O   . ARG   D 1 50 ? 11.595  -28.986 46.67  1   32.03 ? 65  ARG   D O   1 
ATOM   2757 C CB  . ARG   D 1 50 ? 10.215  -27.293 48.332 1   33.95 ? 65  ARG   D CB  1 
ATOM   2758 C CG  . ARG   D 1 50 ? 9.465   -26.232 49.111 1   40.08 ? 65  ARG   D CG  1 
ATOM   2759 C CD  . ARG   D 1 50 ? 10.085  -24.864 48.954 1   46.36 ? 65  ARG   D CD  1 
ATOM   2760 N NE  . ARG   D 1 50 ? 9.587   -23.931 49.968 1   52.06 ? 65  ARG   D NE  1 
ATOM   2761 C CZ  . ARG   D 1 50 ? 8.579   -23.082 49.776 1   55.52 ? 65  ARG   D CZ  1 
ATOM   2762 N NH1 . ARG   D 1 50 ? 7.964   -23.023 48.603 1   54.09 ? 65  ARG   D NH1 1 
ATOM   2763 N NH2 . ARG   D 1 50 ? 8.178   -22.289 50.757 1   56.79 ? 65  ARG   D NH2 1 
ATOM   2764 N N   . LEU   D 1 51 ? 10.61   -28.337 44.751 1   29.42 ? 66  LEU   D N   1 
ATOM   2765 C CA  . LEU   D 1 51 ? 11.307  -29.326 43.929 1   28.42 ? 66  LEU   D CA  1 
ATOM   2766 C C   . LEU   D 1 51 ? 12.715  -28.906 43.544 1   29.16 ? 66  LEU   D C   1 
ATOM   2767 O O   . LEU   D 1 51 ? 13.504  -29.742 43.113 1   28.7  ? 66  LEU   D O   1 
ATOM   2768 C CB  . LEU   D 1 51 ? 10.484  -29.713 42.698 1   27.84 ? 66  LEU   D CB  1 
ATOM   2769 C CG  . LEU   D 1 51 ? 9.057   -30.172 43     1   29.37 ? 66  LEU   D CG  1 
ATOM   2770 C CD1 . LEU   D 1 51 ? 8.256   -30.343 41.704 1   30.74 ? 66  LEU   D CD1 1 
ATOM   2771 C CD2 . LEU   D 1 51 ? 9.054   -31.463 43.812 1   30    ? 66  LEU   D CD2 1 
ATOM   2772 N N   . TYR   D 1 52 ? 13.042  -27.611 43.697 1   29.51 ? 67  TYR   D N   1 
ATOM   2773 C CA  . TYR   D 1 52 ? 14.378  -27.134 43.434 1   30.29 ? 67  TYR   D CA  1 
ATOM   2774 C C   . TYR   D 1 52 ? 15.286  -27.571 44.599 1   32.16 ? 67  TYR   D C   1 
ATOM   2775 O O   . TYR   D 1 52 ? 14.825  -27.763 45.729 1   32.4  ? 67  TYR   D O   1 
ATOM   2776 C CB  . TYR   D 1 52 ? 14.399  -25.591 43.306 1   29.11 ? 67  TYR   D CB  1 
ATOM   2777 C CG  . TYR   D 1 52 ? 13.885  -24.887 44.539 1   29.19 ? 67  TYR   D CG  1 
ATOM   2778 C CD1 . TYR   D 1 52 ? 12.537  -24.6   44.686 1   29.39 ? 67  TYR   D CD1 1 
ATOM   2779 C CD2 . TYR   D 1 52 ? 14.75   -24.494 45.555 1   29.95 ? 67  TYR   D CD2 1 
ATOM   2780 C CE1 . TYR   D 1 52 ? 12.053  -23.977 45.824 1   30.65 ? 67  TYR   D CE1 1 
ATOM   2781 C CE2 . TYR   D 1 52 ? 14.277  -23.875 46.701 1   31.17 ? 67  TYR   D CE2 1 
ATOM   2782 C CZ  . TYR   D 1 52 ? 12.927  -23.619 46.833 1   32.04 ? 67  TYR   D CZ  1 
ATOM   2783 O OH  . TYR   D 1 52 ? 12.455  -22.98  47.949 1   34.63 ? 67  TYR   D OH  1 
ATOM   2784 N N   . ASP   D 1 53 ? 16.571  -27.672 44.315 1   33.48 ? 68  ASP   D N   1 
ATOM   2785 C CA  . ASP   D 1 53 ? 17.569  -27.987 45.316 1   35.77 ? 68  ASP   D CA  1 
ATOM   2786 C C   . ASP   D 1 53 ? 17.819  -26.73  46.168 1   36.77 ? 68  ASP   D C   1 
ATOM   2787 O O   . ASP   D 1 53 ? 18.131  -25.685 45.616 1   37.09 ? 68  ASP   D O   1 
ATOM   2788 C CB  . ASP   D 1 53 ? 18.859  -28.387 44.61  1   37.86 ? 68  ASP   D CB  1 
ATOM   2789 C CG  . ASP   D 1 53 ? 19.941  -28.796 45.582 1   44.6  ? 68  ASP   D CG  1 
ATOM   2790 O OD1 . ASP   D 1 53 ? 19.66   -29.64  46.465 1   47.27 ? 68  ASP   D OD1 1 
ATOM   2791 O OD2 . ASP   D 1 53 ? 21.059  -28.276 45.467 1   46.1  ? 68  ASP   D OD2 1 
ATOM   2792 N N   . GLU   D 1 54 ? 17.728  -26.841 47.487 1   37.36 ? 69  GLU   D N   1 
ATOM   2793 C CA  . GLU   D 1 54 ? 17.945  -25.732 48.413 1   38.52 ? 69  GLU   D CA  1 
ATOM   2794 C C   . GLU   D 1 54 ? 19.279  -24.989 48.222 1   39.12 ? 69  GLU   D C   1 
ATOM   2795 O O   . GLU   D 1 54 ? 19.307  -23.761 48.33  1   39.06 ? 69  GLU   D O   1 
ATOM   2796 C CB  . GLU   D 1 54 ? 17.802  -26.223 49.856 1   42.02 ? 69  GLU   D CB  1 
ATOM   2797 C CG  . GLU   D 1 54 ? 17.804  -25.117 50.896 1   49.58 ? 69  GLU   D CG  1 
ATOM   2798 C CD  . GLU   D 1 54 ? 16.603  -24.191 50.867 1   57.9  ? 69  GLU   D CD  1 
ATOM   2799 O OE1 . GLU   D 1 54 ? 15.53   -24.613 50.377 1   59.75 ? 69  GLU   D OE1 1 
ATOM   2800 O OE2 . GLU   D 1 54 ? 16.733  -23.043 51.35  1   61.31 ? 69  GLU   D OE2 1 
ATOM   2801 N N   . LYS   D 1 55 ? 20.365  -25.72  47.905 1   39.3  ? 70  LYS   D N   1 
ATOM   2802 C CA  . LYS   D 1 55 ? 21.708  -25.155 47.732 1   40.29 ? 70  LYS   D CA  1 
ATOM   2803 C C   . LYS   D 1 55 ? 22.015  -24.68  46.321 1   40.27 ? 70  LYS   D C   1 
ATOM   2804 O O   . LYS   D 1 55 ? 22.716  -23.679 46.149 1   41.57 ? 70  LYS   D O   1 
ATOM   2805 C CB  . LYS   D 1 55 ? 22.797  -26.139 48.21  1   43.06 ? 70  LYS   D CB  1 
ATOM   2806 C CG  . LYS   D 1 55 ? 22.551  -26.691 49.609 1   49.47 ? 70  LYS   D CG  1 
ATOM   2807 C CD  . LYS   D 1 55 ? 22.558  -25.596 50.678 1   56.15 ? 70  LYS   D CD  1 
ATOM   2808 C CE  . LYS   D 1 55 ? 22.112  -26.122 52.024 1   61.12 ? 70  LYS   D CE  1 
ATOM   2809 N NZ  . LYS   D 1 55 ? 22.754  -27.428 52.339 1   63.98 ? 70  LYS   D NZ  1 
ATOM   2810 N N   . GLN   D 1 56 ? 21.524  -25.392 45.308 1   38.6  ? 71  GLN   D N   1 
ATOM   2811 C CA  . GLN   D 1 56 ? 21.733  -24.991 43.924 1   37.88 ? 71  GLN   D CA  1 
ATOM   2812 C C   . GLN   D 1 56 ? 20.325  -24.859 43.312 1   36.62 ? 71  GLN   D C   1 
ATOM   2813 O O   . GLN   D 1 56 ? 19.841  -25.776 42.654 1   36.35 ? 71  GLN   D O   1 
ATOM   2814 C CB  . GLN   D 1 56 ? 22.601  -26.02  43.201 1   39.87 ? 71  GLN   D CB  1 
ATOM   2815 C CG  . GLN   D 1 56 ? 23.289  -25.439 41.973 1   44.73 ? 71  GLN   D CG  1 
ATOM   2816 C CD  . GLN   D 1 56 ? 24.566  -26.163 41.592 1   51.79 ? 71  GLN   D CD  1 
ATOM   2817 O OE1 . GLN   D 1 56 ? 24.911  -27.226 42.133 1   53.67 ? 71  GLN   D OE1 1 
ATOM   2818 N NE2 . GLN   D 1 56 ? 25.299  -25.602 40.637 1   53.28 ? 71  GLN   D NE2 1 
ATOM   2819 N N   . GLN   D 1 57 ? 19.658  -23.714 43.586 1   34.78 ? 72  GLN   D N   1 
ATOM   2820 C CA  . GLN   D 1 57 ? 18.245  -23.462 43.304 1   32.71 ? 72  GLN   D CA  1 
ATOM   2821 C C   . GLN   D 1 57 ? 17.818  -23.427 41.818 1   30.47 ? 72  GLN   D C   1 
ATOM   2822 O O   . GLN   D 1 57 ? 16.605  -23.391 41.542 1   29.82 ? 72  GLN   D O   1 
ATOM   2823 C CB  . GLN   D 1 57 ? 17.768  -22.213 44.042 1   33.16 ? 72  GLN   D CB  1 
ATOM   2824 C CG  . GLN   D 1 57 ? 18.05   -22.316 45.534 1   33.51 ? 72  GLN   D CG  1 
ATOM   2825 C CD  . GLN   D 1 57 ? 17.062  -21.632 46.43  1   36.28 ? 72  GLN   D CD  1 
ATOM   2826 O OE1 . GLN   D 1 57 ? 16.103  -21.003 45.993 1   35.98 ? 72  GLN   D OE1 1 
ATOM   2827 N NE2 . GLN   D 1 57 ? 17.263  -21.757 47.735 1   36.89 ? 72  GLN   D NE2 1 
ATOM   2828 N N   . HIS   D 1 58 ? 18.762  -23.526 40.875 1   29.1  ? 73  HIS   D N   1 
ATOM   2829 C CA  . HIS   D 1 58 ? 18.396  -23.675 39.462 1   28.79 ? 73  HIS   D CA  1 
ATOM   2830 C C   . HIS   D 1 58 ? 18.177  -25.162 39.078 1   28.98 ? 73  HIS   D C   1 
ATOM   2831 O O   . HIS   D 1 58 ? 17.654  -25.446 38.011 1   29.38 ? 73  HIS   D O   1 
ATOM   2832 C CB  . HIS   D 1 58 ? 19.416  -23.036 38.527 1   29.84 ? 73  HIS   D CB  1 
ATOM   2833 C CG  . HIS   D 1 58 ? 20.734  -23.734 38.473 1   32.27 ? 73  HIS   D CG  1 
ATOM   2834 N ND1 . HIS   D 1 58 ? 21.029  -24.645 37.47  1   34.37 ? 73  HIS   D ND1 1 
ATOM   2835 C CD2 . HIS   D 1 58 ? 21.825  -23.572 39.252 1   33.64 ? 73  HIS   D CD2 1 
ATOM   2836 C CE1 . HIS   D 1 58 ? 22.273  -25.035 37.695 1   35.05 ? 73  HIS   D CE1 1 
ATOM   2837 N NE2 . HIS   D 1 58 ? 22.791  -24.425 38.761 1   34.7  ? 73  HIS   D NE2 1 
ATOM   2838 N N   . ILE   D 1 59 ? 18.593  -26.092 39.927 1   28.55 ? 74  ILE   D N   1 
ATOM   2839 C CA  . ILE   D 1 59 ? 18.419  -27.521 39.67  1   29.01 ? 74  ILE   D CA  1 
ATOM   2840 C C   . ILE   D 1 59 ? 17.09   -27.956 40.257 1   28.53 ? 74  ILE   D C   1 
ATOM   2841 O O   . ILE   D 1 59 ? 16.84   -27.741 41.44  1   28.98 ? 74  ILE   D O   1 
ATOM   2842 C CB  . ILE   D 1 59 ? 19.59   -28.318 40.293 1   30.48 ? 74  ILE   D CB  1 
ATOM   2843 C CG1 . ILE   D 1 59 ? 20.924  -27.99  39.574 1   31.72 ? 74  ILE   D CG1 1 
ATOM   2844 C CG2 . ILE   D 1 59 ? 19.298  -29.832 40.269 1   31.25 ? 74  ILE   D CG2 1 
ATOM   2845 C CD1 . ILE   D 1 59 ? 22.136  -28.61  40.244 1   33.43 ? 74  ILE   D CD1 1 
ATOM   2846 N N   . VAL   D 1 60 ? 16.254  -28.586 39.438 1   28.24 ? 75  VAL   D N   1 
ATOM   2847 C CA  . VAL   D 1 60 ? 14.973  -29.089 39.896 1   28.13 ? 75  VAL   D CA  1 
ATOM   2848 C C   . VAL   D 1 60 ? 15.047  -30.619 39.949 1   28.2  ? 75  VAL   D C   1 
ATOM   2849 O O   . VAL   D 1 60 ? 15.372  -31.221 38.946 1   28.2  ? 75  VAL   D O   1 
ATOM   2850 C CB  . VAL   D 1 60 ? 13.828  -28.599 38.978 1   28.58 ? 75  VAL   D CB  1 
ATOM   2851 C CG1 . VAL   D 1 60 ? 12.48   -29.167 39.431 1   28.68 ? 75  VAL   D CG1 1 
ATOM   2852 C CG2 . VAL   D 1 60 ? 13.788  -27.065 38.937 1   29.23 ? 75  VAL   D CG2 1 
ATOM   2853 N N   . TYR   D 1 61 ? 14.764  -31.225 41.105 1   28.22 ? 76  TYR   D N   1 
ATOM   2854 C CA  . TYR   D 1 61 ? 14.739  -32.686 41.284 1   29.03 ? 76  TYR   D CA  1 
ATOM   2855 C C   . TYR   D 1 61 ? 13.252  -33.105 41.317 1   29.96 ? 76  TYR   D C   1 
ATOM   2856 O O   . TYR   D 1 61 ? 12.516  -32.778 42.263 1   30.44 ? 76  TYR   D O   1 
ATOM   2857 C CB  . TYR   D 1 61 ? 15.425  -33.068 42.584 1   28.74 ? 76  TYR   D CB  1 
ATOM   2858 C CG  . TYR   D 1 61 ? 16.92   -32.848 42.54  1   29.39 ? 76  TYR   D CG  1 
ATOM   2859 C CD1 . TYR   D 1 61 ? 17.727  -33.604 41.703 1   30.12 ? 76  TYR   D CD1 1 
ATOM   2860 C CD2 . TYR   D 1 61 ? 17.533  -31.927 43.38  1   29.57 ? 76  TYR   D CD2 1 
ATOM   2861 C CE1 . TYR   D 1 61 ? 19.107  -33.427 41.68  1   31.17 ? 76  TYR   D CE1 1 
ATOM   2862 C CE2 . TYR   D 1 61 ? 18.91   -31.75  43.374 1   29.88 ? 76  TYR   D CE2 1 
ATOM   2863 C CZ  . TYR   D 1 61 ? 19.696  -32.507 42.528 1   31    ? 76  TYR   D CZ  1 
ATOM   2864 O OH  . TYR   D 1 61 ? 21.051  -32.289 42.461 1   31.68 ? 76  TYR   D OH  1 
ATOM   2865 N N   . CYS   D 1 62 ? 12.806  -33.765 40.26  1   30.4  ? 77  CYS   D N   1 
ATOM   2866 C CA  . CYS   D 1 62 ? 11.397  -34.11  40.108 1   31.53 ? 77  CYS   D CA  1 
ATOM   2867 C C   . CYS   D 1 62 ? 11.139  -35.599 39.855 1   32.26 ? 77  CYS   D C   1 
ATOM   2868 O O   . CYS   D 1 62 ? 10.158  -35.919 39.18  1   31.46 ? 77  CYS   D O   1 
ATOM   2869 C CB  . CYS   D 1 62 ? 10.81   -33.264 38.986 1   32.51 ? 77  CYS   D CB  1 
ATOM   2870 S SG  . CYS   D 1 62 ? 11.794  -33.27  37.467 1   37.06 ? 77  CYS   D SG  1 
ATOM   2871 N N   . SER   D 1 63 ? 11.978  -36.507 40.409 1   32.71 ? 78  SER   D N   1 
ATOM   2872 C CA  . SER   D 1 63 ? 11.85   -37.951 40.166 1   33.18 ? 78  SER   D CA  1 
ATOM   2873 C C   . SER   D 1 63 ? 10.614  -38.585 40.795 1   34.15 ? 78  SER   D C   1 
ATOM   2874 O O   . SER   D 1 63 ? 10.08   -39.558 40.256 1   34.87 ? 78  SER   D O   1 
ATOM   2875 C CB  . SER   D 1 63 ? 13.117  -38.685 40.6   1   34.23 ? 78  SER   D CB  1 
ATOM   2876 O OG  . SER   D 1 63 ? 13.168  -38.826 42.013 1   35.96 ? 78  SER   D OG  1 
ATOM   2877 N N   . ASN   D 1 64 ? 10.186  -38.082 41.949 1   33.46 ? 79  ASN   D N   1 
ATOM   2878 C CA  . ASN   D 1 64 ? 8.974   -38.589 42.588 1   33.72 ? 79  ASN   D CA  1 
ATOM   2879 C C   . ASN   D 1 64 ? 7.791   -37.617 42.373 1   32.47 ? 79  ASN   D C   1 
ATOM   2880 O O   . ASN   D 1 64 ? 6.87    -37.556 43.196 1   32.99 ? 79  ASN   D O   1 
ATOM   2881 C CB  . ASN   D 1 64 ? 9.212   -38.837 44.083 1   35.83 ? 79  ASN   D CB  1 
ATOM   2882 C CG  . ASN   D 1 64 ? 8.143   -39.7   44.714 1   40.61 ? 79  ASN   D CG  1 
ATOM   2883 O OD1 . ASN   D 1 64 ? 7.606   -39.391 45.792 1   42.17 ? 79  ASN   D OD1 1 
ATOM   2884 N ND2 . ASN   D 1 64 ? 7.774   -40.768 44.022 1   41.98 ? 79  ASN   D ND2 1 
ATOM   2885 N N   . ASP   D 1 65 ? 7.815   -36.848 41.276 1   30.72 ? 80  ASP   D N   1 
ATOM   2886 C CA  . ASP   D 1 65 ? 6.753   -35.891 41     1   29.21 ? 80  ASP   D CA  1 
ATOM   2887 C C   . ASP   D 1 65 ? 6.313   -36.018 39.546 1   27.75 ? 80  ASP   D C   1 
ATOM   2888 O O   . ASP   D 1 65 ? 7.105   -36.383 38.688 1   26.9  ? 80  ASP   D O   1 
ATOM   2889 C CB  . ASP   D 1 65 ? 7.237   -34.455 41.314 1   29.57 ? 80  ASP   D CB  1 
ATOM   2890 C CG  . ASP   D 1 65 ? 6.114   -33.46  41.382 1   31.34 ? 80  ASP   D CG  1 
ATOM   2891 O OD1 . ASP   D 1 65 ? 5.667   -33.002 40.311 1   32.69 ? 80  ASP   D OD1 1 
ATOM   2892 O OD2 . ASP   D 1 65 ? 5.653   -33.158 42.501 1   32.17 ? 80  ASP   D OD2 1 
ATOM   2893 N N   . LEU   D 1 66 ? 5.041   -35.734 39.273 1   27.36 ? 81  LEU   D N   1 
ATOM   2894 C CA  . LEU   D 1 66 ? 4.524   -35.767 37.909 1   28.08 ? 81  LEU   D CA  1 
ATOM   2895 C C   . LEU   D 1 66 ? 5.267   -34.821 36.957 1   28.67 ? 81  LEU   D C   1 
ATOM   2896 O O   . LEU   D 1 66 ? 5.194   -35.01  35.748 1   28.9  ? 81  LEU   D O   1 
ATOM   2897 C CB  . LEU   D 1 66 ? 3.043   -35.406 37.926 1   28.67 ? 81  LEU   D CB  1 
ATOM   2898 C CG  . LEU   D 1 66 ? 2.123   -36.504 38.425 1   30.38 ? 81  LEU   D CG  1 
ATOM   2899 C CD1 . LEU   D 1 66 ? 0.713   -35.974 38.574 1   31.04 ? 81  LEU   D CD1 1 
ATOM   2900 C CD2 . LEU   D 1 66 ? 2.141   -37.698 37.474 1   30.49 ? 81  LEU   D CD2 1 
ATOM   2901 N N   . LEU   D 1 67 ? 5.948   -33.796 37.498 1   29.15 ? 82  LEU   D N   1 
ATOM   2902 C CA  . LEU   D 1 67 ? 6.765   -32.857 36.726 1   29.9  ? 82  LEU   D CA  1 
ATOM   2903 C C   . LEU   D 1 67 ? 7.887   -33.598 35.993 1   30.41 ? 82  LEU   D C   1 
ATOM   2904 O O   . LEU   D 1 67 ? 8.237   -33.221 34.879 1   30.7  ? 82  LEU   D O   1 
ATOM   2905 C CB  . LEU   D 1 67 ? 7.373   -31.798 37.654 1   30.54 ? 82  LEU   D CB  1 
ATOM   2906 C CG  . LEU   D 1 67 ? 8.2     -30.723 36.944 1   32.5  ? 82  LEU   D CG  1 
ATOM   2907 C CD1 . LEU   D 1 67 ? 7.292   -29.82  36.16  1   33.61 ? 82  LEU   D CD1 1 
ATOM   2908 C CD2 . LEU   D 1 67 ? 9.04    -29.933 37.947 1   32.81 ? 82  LEU   D CD2 1 
ATOM   2909 N N   . GLY   D 1 68 ? 8.415   -34.665 36.591 1   30.29 ? 83  GLY   D N   1 
ATOM   2910 C CA  . GLY   D 1 68 ? 9.442   -35.481 35.96  1   30.49 ? 83  GLY   D CA  1 
ATOM   2911 C C   . GLY   D 1 68 ? 8.943   -36.154 34.702 1   30.86 ? 83  GLY   D C   1 
ATOM   2912 O O   . GLY   D 1 68 ? 9.691   -36.302 33.729 1   30.15 ? 83  GLY   D O   1 
ATOM   2913 N N   . ASP   D 1 69 ? 7.653   -36.544 34.698 1   31.95 ? 84  ASP   D N   1 
ATOM   2914 C CA  . ASP   D 1 69 ? 6.993   -37.103 33.518 1   33.51 ? 84  ASP   D CA  1 
ATOM   2915 C C   . ASP   D 1 69 ? 6.836   -36.039 32.435 1   35.43 ? 84  ASP   D C   1 
ATOM   2916 O O   . ASP   D 1 69 ? 7.052   -36.32  31.255 1   36.1  ? 84  ASP   D O   1 
ATOM   2917 C CB  . ASP   D 1 69 ? 5.638   -37.692 33.9   1   34.48 ? 84  ASP   D CB  1 
ATOM   2918 C CG  . ASP   D 1 69 ? 5.803   -38.851 34.853 1   37.62 ? 84  ASP   D CG  1 
ATOM   2919 O OD1 . ASP   D 1 69 ? 6.149   -39.949 34.386 1   38.15 ? 84  ASP   D OD1 1 
ATOM   2920 O OD2 . ASP   D 1 69 ? 5.625   -38.649 36.066 1   39.42 ? 84  ASP   D OD2 1 
ATOM   2921 N N   . LEU   D 1 70 ? 6.495   -34.814 32.844 1   36.33 ? 85  LEU   D N   1 
ATOM   2922 C CA  . LEU   D 1 70 ? 6.349   -33.634 31.992 1   38.24 ? 85  LEU   D CA  1 
ATOM   2923 C C   . LEU   D 1 70 ? 7.669   -33.417 31.2   1   38.78 ? 85  LEU   D C   1 
ATOM   2924 O O   . LEU   D 1 70 ? 7.641   -33.294 29.988 1   38.1  ? 85  LEU   D O   1 
ATOM   2925 C CB  . LEU   D 1 70 ? 6.057   -32.428 32.919 1   39.32 ? 85  LEU   D CB  1 
ATOM   2926 C CG  . LEU   D 1 70 ? 5.327   -31.185 32.392 1   42.16 ? 85  LEU   D CG  1 
ATOM   2927 C CD1 . LEU   D 1 70 ? 6.234   -30.293 31.576 1   43.75 ? 85  LEU   D CD1 1 
ATOM   2928 C CD2 . LEU   D 1 70 ? 4.051   -31.535 31.692 1   42.67 ? 85  LEU   D CD2 1 
ATOM   2929 N N   . PHE   D 1 71 ? 8.817   -33.461 31.885 1   39.5  ? 86  PHE   D N   1 
ATOM   2930 C CA  . PHE   D 1 71 ? 10.108  -33.227 31.248 1   41.06 ? 86  PHE   D CA  1 
ATOM   2931 C C   . PHE   D 1 71 ? 10.753  -34.441 30.611 1   40.92 ? 86  PHE   D C   1 
ATOM   2932 O O   . PHE   D 1 71 ? 11.593  -34.291 29.73  1   41.91 ? 86  PHE   D O   1 
ATOM   2933 C CB  . PHE   D 1 71 ? 11.068  -32.586 32.252 1   42.24 ? 86  PHE   D CB  1 
ATOM   2934 C CG  . PHE   D 1 71 ? 10.822  -31.107 32.32  1   44.32 ? 86  PHE   D CG  1 
ATOM   2935 C CD1 . PHE   D 1 71 ? 9.821   -30.593 33.12  1   45.6  ? 86  PHE   D CD1 1 
ATOM   2936 C CD2 . PHE   D 1 71 ? 11.557  -30.231 31.541 1   45.95 ? 86  PHE   D CD2 1 
ATOM   2937 C CE1 . PHE   D 1 71 ? 9.563   -29.233 33.147 1   46.9  ? 86  PHE   D CE1 1 
ATOM   2938 C CE2 . PHE   D 1 71 ? 11.288  -28.874 31.56  1   47.06 ? 86  PHE   D CE2 1 
ATOM   2939 C CZ  . PHE   D 1 71 ? 10.293  -28.383 32.362 1   47.03 ? 86  PHE   D CZ  1 
ATOM   2940 N N   . GLY   D 1 72 ? 10.364  -35.631 31.041 1   39.51 ? 87  GLY   D N   1 
ATOM   2941 C CA  . GLY   D 1 72 ? 10.976  -36.855 30.554 1   39.05 ? 87  GLY   D CA  1 
ATOM   2942 C C   . GLY   D 1 72 ? 12.368  -37.042 31.141 1   38.13 ? 87  GLY   D C   1 
ATOM   2943 O O   . GLY   D 1 72 ? 13.244  -37.587 30.473 1   38.1  ? 87  GLY   D O   1 
ATOM   2944 N N   . VAL   D 1 73 ? 12.588  -36.573 32.387 1   37.02 ? 88  VAL   D N   1 
ATOM   2945 C CA  . VAL   D 1 73 ? 13.883  -36.68  33.072 1   36.37 ? 88  VAL   D CA  1 
ATOM   2946 C C   . VAL   D 1 73 ? 13.692  -36.631 34.586 1   35.39 ? 88  VAL   D C   1 
ATOM   2947 O O   . VAL   D 1 73 ? 12.718  -36.039 35.064 1   35.39 ? 88  VAL   D O   1 
ATOM   2948 C CB  . VAL   D 1 73 ? 14.797  -35.54  32.626 1   36.73 ? 88  VAL   D CB  1 
ATOM   2949 N N   . PRO   D 1 74 ? 14.602  -37.242 35.378 1   34.43 ? 89  PRO   D N   1 
ATOM   2950 C CA  . PRO   D 1 74 ? 14.452  -37.166 36.843 1   34    ? 89  PRO   D CA  1 
ATOM   2951 C C   . PRO   D 1 74 ? 14.851  -35.788 37.429 1   33.39 ? 89  PRO   D C   1 
ATOM   2952 O O   . PRO   D 1 74 ? 14.47   -35.452 38.546 1   34.08 ? 89  PRO   D O   1 
ATOM   2953 C CB  . PRO   D 1 74 ? 15.34   -38.305 37.341 1   35.31 ? 89  PRO   D CB  1 
ATOM   2954 C CG  . PRO   D 1 74 ? 16.459  -38.361 36.31  1   35.48 ? 89  PRO   D CG  1 
ATOM   2955 C CD  . PRO   D 1 74 ? 15.808  -38.006 34.985 1   33.75 ? 89  PRO   D CD  1 
ATOM   2956 N N   . SER   D 1 75 ? 15.602  -34.989 36.668 1   31.94 ? 90  SER   D N   1 
ATOM   2957 C CA  . SER   D 1 75 ? 15.981  -33.646 37.083 1   31.66 ? 90  SER   D CA  1 
ATOM   2958 C C   . SER   D 1 75 ? 16.247  -32.738 35.863 1   31.5  ? 90  SER   D C   1 
ATOM   2959 O O   . SER   D 1 75 ? 16.29   -33.22  34.738 1   32.42 ? 90  SER   D O   1 
ATOM   2960 C CB  . SER   D 1 75 ? 17.172  -33.681 38.047 1   33.18 ? 90  SER   D CB  1 
ATOM   2961 O OG  . SER   D 1 75 ? 18.256  -34.445 37.544 1   35.44 ? 90  SER   D OG  1 
ATOM   2962 N N   . PHE   D 1 76 ? 16.37   -31.414 36.069 1   30.37 ? 91  PHE   D N   1 
ATOM   2963 C CA  . PHE   D 1 76 ? 16.642  -30.48  34.965 1   29.69 ? 91  PHE   D CA  1 
ATOM   2964 C C   . PHE   D 1 76 ? 17.151  -29.125 35.498 1   29.58 ? 91  PHE   D C   1 
ATOM   2965 O O   . PHE   D 1 76 ? 17.098  -28.884 36.702 1   30.45 ? 91  PHE   D O   1 
ATOM   2966 C CB  . PHE   D 1 76 ? 15.428  -30.306 34.02  1   29.56 ? 91  PHE   D CB  1 
ATOM   2967 C CG  . PHE   D 1 76 ? 14.235  -29.589 34.611 1   29.69 ? 91  PHE   D CG  1 
ATOM   2968 C CD1 . PHE   D 1 76 ? 13.238  -30.291 35.261 1   30.83 ? 91  PHE   D CD1 1 
ATOM   2969 C CD2 . PHE   D 1 76 ? 14.112  -28.216 34.511 1   30.43 ? 91  PHE   D CD2 1 
ATOM   2970 C CE1 . PHE   D 1 76 ? 12.146  -29.632 35.803 1   31.84 ? 91  PHE   D CE1 1 
ATOM   2971 C CE2 . PHE   D 1 76 ? 13.037  -27.558 35.078 1   31.35 ? 91  PHE   D CE2 1 
ATOM   2972 C CZ  . PHE   D 1 76 ? 12.06   -28.267 35.719 1   31.51 ? 91  PHE   D CZ  1 
ATOM   2973 N N   . SER   D 1 77 ? 17.671  -28.274 34.622 1   29.68 ? 92  SER   D N   1 
ATOM   2974 C CA  . SER   D 1 77 ? 18.165  -26.957 35.032 1   30.44 ? 92  SER   D CA  1 
ATOM   2975 C C   . SER   D 1 77 ? 17.316  -25.855 34.452 1   30.5  ? 92  SER   D C   1 
ATOM   2976 O O   . SER   D 1 77 ? 17.057  -25.826 33.249 1   30.6  ? 92  SER   D O   1 
ATOM   2977 C CB  . SER   D 1 77 ? 19.629  -26.741 34.634 1   31.92 ? 92  SER   D CB  1 
ATOM   2978 O OG  . SER   D 1 77 ? 20.092  -25.472 35.087 1   33.76 ? 92  SER   D OG  1 
ATOM   2979 N N   . VAL   D 1 78 ? 16.949  -24.899 35.311 1   30.54 ? 93  VAL   D N   1 
ATOM   2980 C CA  . VAL   D 1 78 ? 16.183  -23.714 34.93  1   31.28 ? 93  VAL   D CA  1 
ATOM   2981 C C   . VAL   D 1 78 ? 16.977  -22.804 33.981 1   32.08 ? 93  VAL   D C   1 
ATOM   2982 O O   . VAL   D 1 78 ? 16.376  -22.029 33.244 1   32.38 ? 93  VAL   D O   1 
ATOM   2983 C CB  . VAL   D 1 78 ? 15.681  -22.976 36.204 1   31.38 ? 93  VAL   D CB  1 
ATOM   2984 C CG1 . VAL   D 1 78 ? 14.968  -21.679 35.849 1   31.9  ? 93  VAL   D CG1 1 
ATOM   2985 C CG2 . VAL   D 1 78 ? 14.764  -23.886 37.025 1   31.36 ? 93  VAL   D CG2 1 
ATOM   2986 N N   . LYS   D 1 79 ? 18.318  -22.924 33.94  1   32.34 ? 94  LYS   D N   1 
ATOM   2987 C CA  . LYS   D 1 79 ? 19.137  -22.128 33.024 1   33.13 ? 94  LYS   D CA  1 
ATOM   2988 C C   . LYS   D 1 79 ? 18.918  -22.52  31.545 1   34.64 ? 94  LYS   D C   1 
ATOM   2989 O O   . LYS   D 1 79 ? 19.165  -21.702 30.662 1   34.92 ? 94  LYS   D O   1 
ATOM   2990 C CB  . LYS   D 1 79 ? 20.631  -22.28  33.355 1   34.9  ? 94  LYS   D CB  1 
ATOM   2991 C CG  . LYS   D 1 79 ? 21.023  -21.828 34.749 1   38.67 ? 94  LYS   D CG  1 
ATOM   2992 C CD  . LYS   D 1 79 ? 22.518  -22.086 35.007 1   41.92 ? 94  LYS   D CD  1 
ATOM   2993 C CE  . LYS   D 1 79 ? 22.95   -21.492 36.32  1   45.61 ? 94  LYS   D CE  1 
ATOM   2994 N NZ  . LYS   D 1 79 ? 24.398  -21.71  36.584 1   48.12 ? 94  LYS   D NZ  1 
ATOM   2995 N N   . GLU   D 1 80 ? 18.469  -23.758 31.278 1   35.42 ? 95  GLU   D N   1 
ATOM   2996 C CA  . GLU   D 1 80 ? 18.273  -24.245 29.902 1   36.68 ? 95  GLU   D CA  1 
ATOM   2997 C C   . GLU   D 1 80 ? 16.908  -23.79  29.386 1   36.52 ? 95  GLU   D C   1 
ATOM   2998 O O   . GLU   D 1 80 ? 15.982  -24.595 29.311 1   36.72 ? 95  GLU   D O   1 
ATOM   2999 C CB  . GLU   D 1 80 ? 18.388  -25.78  29.866 1   39.47 ? 95  GLU   D CB  1 
ATOM   3000 C CG  . GLU   D 1 80 ? 19.576  -26.323 30.645 1   47.19 ? 95  GLU   D CG  1 
ATOM   3001 C CD  . GLU   D 1 80 ? 19.722  -27.832 30.643 1   56.44 ? 95  GLU   D CD  1 
ATOM   3002 O OE1 . GLU   D 1 80 ? 20.466  -28.345 29.776 1   59.35 ? 95  GLU   D OE1 1 
ATOM   3003 O OE2 . GLU   D 1 80 ? 19.109  -28.5   31.51  1   58.45 ? 95  GLU   D OE2 1 
ATOM   3004 N N   . HIS   D 1 81 ? 16.794  -22.496 29.056 1   36.3  ? 96  HIS   D N   1 
ATOM   3005 C CA  . HIS   D 1 81 ? 15.557  -21.839 28.663 1   36.68 ? 96  HIS   D CA  1 
ATOM   3006 C C   . HIS   D 1 81 ? 14.78   -22.508 27.528 1   37.82 ? 96  HIS   D C   1 
ATOM   3007 O O   . HIS   D 1 81 ? 13.655  -22.937 27.765 1   37.71 ? 96  HIS   D O   1 
ATOM   3008 C CB  . HIS   D 1 81 ? 15.772  -20.353 28.339 1   36.93 ? 96  HIS   D CB  1 
ATOM   3009 C CG  . HIS   D 1 81 ? 16.335  -19.546 29.46  1   37.88 ? 96  HIS   D CG  1 
ATOM   3010 N ND1 . HIS   D 1 81 ? 17.466  -18.785 29.293 1   39.42 ? 96  HIS   D ND1 1 
ATOM   3011 C CD2 . HIS   D 1 81 ? 15.897  -19.4   30.731 1   39.53 ? 96  HIS   D CD2 1 
ATOM   3012 C CE1 . HIS   D 1 81 ? 17.684  -18.2   30.457 1   39.9  ? 96  HIS   D CE1 1 
ATOM   3013 N NE2 . HIS   D 1 81 ? 16.766  -18.536 31.351 1   40.11 ? 96  HIS   D NE2 1 
ATOM   3014 N N   . ARG   D 1 82 ? 15.357  -22.625 26.318 1   38.14 ? 97  ARG   D N   1 
ATOM   3015 C CA  . ARG   D 1 82 ? 14.609  -23.188 25.188 1   38.22 ? 97  ARG   D CA  1 
ATOM   3016 C C   . ARG   D 1 82 ? 14.362  -24.72  25.339 1   38.43 ? 97  ARG   D C   1 
ATOM   3017 O O   . ARG   D 1 82 ? 13.385  -25.207 24.787 1   39.51 ? 97  ARG   D O   1 
ATOM   3018 C CB  . ARG   D 1 82 ? 15.265  -22.787 23.857 1   38.24 ? 97  ARG   D CB  1 
ATOM   3019 C CG  . ARG   D 1 82 ? 14.388  -22.858 22.584 1   37.5  ? 97  ARG   D CG  1 
ATOM   3020 C CD  . ARG   D 1 82 ? 12.965  -22.275 22.613 1   36.19 ? 97  ARG   D CD  1 
ATOM   3021 N NE  . ARG   D 1 82 ? 12.816  -20.843 22.938 1   31.39 ? 97  ARG   D NE  1 
ATOM   3022 C CZ  . ARG   D 1 82 ? 11.661  -20.182 22.825 1   30.64 ? 97  ARG   D CZ  1 
ATOM   3023 N NH1 . ARG   D 1 82 ? 10.597  -20.773 22.285 1   28.33 ? 97  ARG   D NH1 1 
ATOM   3024 N NH2 . ARG   D 1 82 ? 11.575  -18.903 23.199 1   28.38 ? 97  ARG   D NH2 1 
ATOM   3025 N N   . LYS   D 1 83 ? 15.133  -25.444 26.172 1   37.25 ? 98  LYS   D N   1 
ATOM   3026 C CA  . LYS   D 1 83 ? 14.846  -26.86  26.458 1   36.55 ? 98  LYS   D CA  1 
ATOM   3027 C C   . LYS   D 1 83 ? 13.54   -26.984 27.294 1   35.42 ? 98  LYS   D C   1 
ATOM   3028 O O   . LYS   D 1 83 ? 12.751  -27.919 27.116 1   35.23 ? 98  LYS   D O   1 
ATOM   3029 C CB  . LYS   D 1 83 ? 15.987  -27.495 27.243 1   39.42 ? 98  LYS   D CB  1 
ATOM   3030 C CG  . LYS   D 1 83 ? 17.265  -27.658 26.427 1   45.67 ? 98  LYS   D CG  1 
ATOM   3031 C CD  . LYS   D 1 83 ? 18.283  -28.479 27.188 1   50.83 ? 98  LYS   D CD  1 
ATOM   3032 C CE  . LYS   D 1 83 ? 19.373  -29.005 26.288 1   55.36 ? 98  LYS   D CE  1 
ATOM   3033 N NZ  . LYS   D 1 83 ? 20.036  -30.199 26.882 1   57.84 ? 98  LYS   D NZ  1 
ATOM   3034 N N   . ILE   D 1 84 ? 13.316  -26.026 28.195 1   33.51 ? 99  ILE   D N   1 
ATOM   3035 C CA  . ILE   D 1 84 ? 12.099  -25.988 28.99  1   31.83 ? 99  ILE   D CA  1 
ATOM   3036 C C   . ILE   D 1 84 ? 10.919  -25.635 28.083 1   30.95 ? 99  ILE   D C   1 
ATOM   3037 O O   . ILE   D 1 84 ? 9.847   -26.213 28.229 1   30.47 ? 99  ILE   D O   1 
ATOM   3038 C CB  . ILE   D 1 84 ? 12.27   -24.995 30.162 1   31.66 ? 99  ILE   D CB  1 
ATOM   3039 C CG1 . ILE   D 1 84 ? 13.25   -25.582 31.198 1   32.41 ? 99  ILE   D CG1 1 
ATOM   3040 C CG2 . ILE   D 1 84 ? 10.911  -24.652 30.805 1   31.72 ? 99  ILE   D CG2 1 
ATOM   3041 C CD1 . ILE   D 1 84 ? 13.607  -24.628 32.313 1   33.1  ? 99  ILE   D CD1 1 
ATOM   3042 N N   . TYR   D 1 85 ? 11.099  -24.681 27.151 1   30.79 ? 100 TYR   D N   1 
ATOM   3043 C CA  . TYR   D 1 85 ? 10.034  -24.326 26.201 1   31.08 ? 100 TYR   D CA  1 
ATOM   3044 C C   . TYR   D 1 85 ? 9.696   -25.526 25.327 1   31.13 ? 100 TYR   D C   1 
ATOM   3045 O O   . TYR   D 1 85 ? 8.528   -25.746 25.036 1   30.97 ? 100 TYR   D O   1 
ATOM   3046 C CB  . TYR   D 1 85 ? 10.455  -23.176 25.29  1   31.34 ? 100 TYR   D CB  1 
ATOM   3047 C CG  . TYR   D 1 85 ? 10.308  -21.812 25.913 1   32.39 ? 100 TYR   D CG  1 
ATOM   3048 C CD1 . TYR   D 1 85 ? 9.07    -21.2   26.009 1   33.56 ? 100 TYR   D CD1 1 
ATOM   3049 C CD2 . TYR   D 1 85 ? 11.418  -21.102 26.345 1   33.48 ? 100 TYR   D CD2 1 
ATOM   3050 C CE1 . TYR   D 1 85 ? 8.937   -19.922 26.54  1   34.48 ? 100 TYR   D CE1 1 
ATOM   3051 C CE2 . TYR   D 1 85 ? 11.295  -19.835 26.89  1   34.09 ? 100 TYR   D CE2 1 
ATOM   3052 C CZ  . TYR   D 1 85 ? 10.051  -19.253 27.001 1   35.27 ? 100 TYR   D CZ  1 
ATOM   3053 O OH  . TYR   D 1 85 ? 9.926   -18.002 27.55  1   37.52 ? 100 TYR   D OH  1 
ATOM   3054 N N   . THR   D 1 86 ? 10.702  -26.311 24.926 1   31.31 ? 101 THR   D N   1 
ATOM   3055 C CA  . THR   D 1 86 ? 10.523  -27.506 24.107 1   32.73 ? 101 THR   D CA  1 
ATOM   3056 C C   . THR   D 1 86 ? 9.621   -28.5   24.823 1   32.44 ? 101 THR   D C   1 
ATOM   3057 O O   . THR   D 1 86 ? 8.677   -29.003 24.228 1   33.08 ? 101 THR   D O   1 
ATOM   3058 C CB  . THR   D 1 86 ? 11.898  -28.117 23.775 1   35.81 ? 101 THR   D CB  1 
ATOM   3059 O OG1 . THR   D 1 86 ? 12.532  -27.271 22.819 1   38.07 ? 101 THR   D OG1 1 
ATOM   3060 C CG2 . THR   D 1 86 ? 11.798  -29.55  23.235 1   36.71 ? 101 THR   D CG2 1 
ATOM   3061 N N   . MET   D 1 87 ? 9.896   -28.75  26.102 1   31.51 ? 102 MET   D N   1 
ATOM   3062 C CA  . MET   D 1 87 ? 9.105   -29.663 26.885 1   31.23 ? 102 MET   D CA  1 
ATOM   3063 C C   . MET   D 1 87 ? 7.693   -29.139 27.104 1   29.21 ? 102 MET   D C   1 
ATOM   3064 O O   . MET   D 1 87 ? 6.734   -29.914 27.04  1   28.41 ? 102 MET   D O   1 
ATOM   3065 C CB  . MET   D 1 87 ? 9.822   -30.036 28.195 1   33.26 ? 102 MET   D CB  1 
ATOM   3066 C CG  . MET   D 1 87 ? 11.079  -30.93  27.982 1   37.93 ? 102 MET   D CG  1 
ATOM   3067 S SD  . MET   D 1 87 ? 11.043  -32.229 26.683 1   48.74 ? 102 MET   D SD  1 
ATOM   3068 C CE  . MET   D 1 87 ? 9.602   -33.203 27.166 1   47.3  ? 102 MET   D CE  1 
ATOM   3069 N N   . ILE   D 1 88 ? 7.542   -27.818 27.293 1   27.98 ? 103 ILE   D N   1 
ATOM   3070 C CA  . ILE   D 1 88 ? 6.207   -27.237 27.487 1   27.54 ? 103 ILE   D CA  1 
ATOM   3071 C C   . ILE   D 1 88 ? 5.391   -27.375 26.208 1   26.66 ? 103 ILE   D C   1 
ATOM   3072 O O   . ILE   D 1 88 ? 4.253   -27.859 26.254 1   26.32 ? 103 ILE   D O   1 
ATOM   3073 C CB  . ILE   D 1 88 ? 6.303   -25.766 27.985 1   27.87 ? 103 ILE   D CB  1 
ATOM   3074 C CG1 . ILE   D 1 88 ? 6.747   -25.711 29.463 1   28.5  ? 103 ILE   D CG1 1 
ATOM   3075 C CG2 . ILE   D 1 88 ? 4.996   -25.01  27.762 1   28.73 ? 103 ILE   D CG2 1 
ATOM   3076 C CD1 . ILE   D 1 88 ? 7.152   -24.261 29.924 1   29.63 ? 103 ILE   D CD1 1 
ATOM   3077 N N   . TYR   D 1 89 ? 5.977   -27.019 25.061 1   26.44 ? 104 TYR   D N   1 
ATOM   3078 C CA  . TYR   D 1 89 ? 5.291   -27.135 23.777 1   27.17 ? 104 TYR   D CA  1 
ATOM   3079 C C   . TYR   D 1 89 ? 4.879   -28.577 23.455 1   27.93 ? 104 TYR   D C   1 
ATOM   3080 O O   . TYR   D 1 89 ? 3.81    -28.784 22.876 1   28.04 ? 104 TYR   D O   1 
ATOM   3081 C CB  . TYR   D 1 89 ? 6.1     -26.513 22.635 1   27.47 ? 104 TYR   D CB  1 
ATOM   3082 C CG  . TYR   D 1 89 ? 5.92    -25.013 22.548 1   28.87 ? 104 TYR   D CG  1 
ATOM   3083 C CD1 . TYR   D 1 89 ? 4.72    -24.461 22.127 1   29.54 ? 104 TYR   D CD1 1 
ATOM   3084 C CD2 . TYR   D 1 89 ? 6.961   -24.148 22.855 1   30.06 ? 104 TYR   D CD2 1 
ATOM   3085 C CE1 . TYR   D 1 89 ? 4.551   -23.083 22.044 1   30.56 ? 104 TYR   D CE1 1 
ATOM   3086 C CE2 . TYR   D 1 89 ? 6.808   -22.77  22.761 1   30.61 ? 104 TYR   D CE2 1 
ATOM   3087 C CZ  . TYR   D 1 89 ? 5.602   -22.244 22.349 1   31.5  ? 104 TYR   D CZ  1 
ATOM   3088 O OH  . TYR   D 1 89 ? 5.432   -20.887 22.269 1   33.6  ? 104 TYR   D OH  1 
ATOM   3089 N N   . ARG   D 1 90 ? 5.672   -29.556 23.871 1   27.93 ? 105 ARG   D N   1 
ATOM   3090 C CA  . ARG   D 1 90 ? 5.308   -30.969 23.661 1   28.68 ? 105 ARG   D CA  1 
ATOM   3091 C C   . ARG   D 1 90 ? 4.125   -31.416 24.547 1   28.39 ? 105 ARG   D C   1 
ATOM   3092 O O   . ARG   D 1 90 ? 3.593   -32.511 24.35  1   29.01 ? 105 ARG   D O   1 
ATOM   3093 C CB  . ARG   D 1 90 ? 6.508   -31.872 23.952 1   30.84 ? 105 ARG   D CB  1 
ATOM   3094 C CG  . ARG   D 1 90 ? 7.593   -31.777 22.911 1   36.08 ? 105 ARG   D CG  1 
ATOM   3095 C CD  . ARG   D 1 90 ? 8.81    -32.576 23.332 1   40.8  ? 105 ARG   D CD  1 
ATOM   3096 N NE  . ARG   D 1 90 ? 9.898   -32.434 22.367 1   45.92 ? 105 ARG   D NE  1 
ATOM   3097 C CZ  . ARG   D 1 90 ? 11.031  -33.129 22.401 1   49.01 ? 105 ARG   D CZ  1 
ATOM   3098 N NH1 . ARG   D 1 90 ? 11.238  -34.032 23.353 1   48.42 ? 105 ARG   D NH1 1 
ATOM   3099 N NH2 . ARG   D 1 90 ? 11.959  -32.939 21.474 1   50.01 ? 105 ARG   D NH2 1 
ATOM   3100 N N   . ASN   D 1 91 ? 3.771   -30.627 25.57  1   26.87 ? 106 ASN   D N   1 
ATOM   3101 C CA  . ASN   D 1 91 ? 2.699   -30.973 26.496 1   26.97 ? 106 ASN   D CA  1 
ATOM   3102 C C   . ASN   D 1 91 ? 1.439   -30.124 26.321 1   26.89 ? 106 ASN   D C   1 
ATOM   3103 O O   . ASN   D 1 91 ? 0.635   -29.996 27.243 1   26.87 ? 106 ASN   D O   1 
ATOM   3104 C CB  . ASN   D 1 91 ? 3.228   -30.931 27.935 1   28.05 ? 106 ASN   D CB  1 
ATOM   3105 C CG  . ASN   D 1 91 ? 3.996   -32.193 28.25  1   32.05 ? 106 ASN   D CG  1 
ATOM   3106 O OD1 . ASN   D 1 91 ? 3.423   -33.183 28.712 1   32.49 ? 106 ASN   D OD1 1 
ATOM   3107 N ND2 . ASN   D 1 91 ? 5.3     -32.213 27.957 1   32.72 ? 106 ASN   D ND2 1 
ATOM   3108 N N   . LEU   D 1 92 ? 1.274   -29.531 25.142 1   27.42 ? 107 LEU   D N   1 
ATOM   3109 C CA  . LEU   D 1 92 ? 0.117   -28.695 24.853 1   28.15 ? 107 LEU   D CA  1 
ATOM   3110 C C   . LEU   D 1 92 ? -0.194  -28.654 23.359 1   28.9  ? 107 LEU   D C   1 
ATOM   3111 O O   . LEU   D 1 92 ? 0.619   -29.071 22.52  1   29.47 ? 107 LEU   D O   1 
ATOM   3112 C CB  . LEU   D 1 92 ? 0.318   -27.257 25.429 1   28.05 ? 107 LEU   D CB  1 
ATOM   3113 C CG  . LEU   D 1 92 ? 1.585   -26.5   24.992 1   29.24 ? 107 LEU   D CG  1 
ATOM   3114 C CD1 . LEU   D 1 92 ? 1.44    -25.903 23.585 1   29.84 ? 107 LEU   D CD1 1 
ATOM   3115 C CD2 . LEU   D 1 92 ? 1.909   -25.392 25.965 1   30.38 ? 107 LEU   D CD2 1 
ATOM   3116 N N   . VAL   D 1 93 ? -1.376  -28.142 23.024 1   28.67 ? 108 VAL   D N   1 
ATOM   3117 C CA  . VAL   D 1 93 ? -1.745  -27.918 21.638 1   28.68 ? 108 VAL   D CA  1 
ATOM   3118 C C   . VAL   D 1 93 ? -1.903  -26.4   21.481 1   28.4  ? 108 VAL   D C   1 
ATOM   3119 O O   . VAL   D 1 93 ? -2.615  -25.762 22.279 1   27.59 ? 108 VAL   D O   1 
ATOM   3120 C CB  . VAL   D 1 93 ? -3.047  -28.634 21.255 1   29.96 ? 108 VAL   D CB  1 
ATOM   3121 C CG1 . VAL   D 1 93 ? -3.436  -28.272 19.825 1   30.66 ? 108 VAL   D CG1 1 
ATOM   3122 C CG2 . VAL   D 1 93 ? -2.899  -30.158 21.408 1   30.62 ? 108 VAL   D CG2 1 
ATOM   3123 N N   . VAL   D 1 94 ? -1.201  -25.808 20.509 1   28.05 ? 109 VAL   D N   1 
ATOM   3124 C CA  . VAL   D 1 94 ? -1.327  -24.378 20.269 1   28.81 ? 109 VAL   D CA  1 
ATOM   3125 C C   . VAL   D 1 94 ? -2.676  -24.19  19.569 1   30.42 ? 109 VAL   D C   1 
ATOM   3126 O O   . VAL   D 1 94 ? -2.922  -24.842 18.555 1   30.06 ? 109 VAL   D O   1 
ATOM   3127 C CB  . VAL   D 1 94 ? -0.145  -23.858 19.432 1   28.87 ? 109 VAL   D CB  1 
ATOM   3128 C CG1 . VAL   D 1 94 ? -0.386  -22.415 18.989 1   29    ? 109 VAL   D CG1 1 
ATOM   3129 C CG2 . VAL   D 1 94 ? 1.148   -23.971 20.247 1   29.53 ? 109 VAL   D CG2 1 
ATOM   3130 N N   . VAL   D 1 95 ? -3.577  -23.401 20.158 1   32.03 ? 110 VAL   D N   1 
ATOM   3131 C CA  . VAL   D 1 95 ? -4.927  -23.278 19.605 1   34.63 ? 110 VAL   D CA  1 
ATOM   3132 C C   . VAL   D 1 95 ? -4.93   -22.515 18.293 1   37.01 ? 110 VAL   D C   1 
ATOM   3133 O O   . VAL   D 1 95 ? -4.191  -21.544 18.121 1   36.5  ? 110 VAL   D O   1 
ATOM   3134 C CB  . VAL   D 1 95 ? -5.995  -22.741 20.602 1   35.63 ? 110 VAL   D CB  1 
ATOM   3135 C CG1 . VAL   D 1 95 ? -5.82   -23.341 21.991 1   35.52 ? 110 VAL   D CG1 1 
ATOM   3136 C CG2 . VAL   D 1 95 ? -6.005  -21.228 20.66  1   36.85 ? 110 VAL   D CG2 1 
ATOM   3137 N N   . ASN   D 1 96 ? -5.757  -22.979 17.348 1   39.66 ? 111 ASN   D N   1 
ATOM   3138 C CA  . ASN   D 1 96 ? -5.891  -22.33  16.053 1   42.66 ? 111 ASN   D CA  1 
ATOM   3139 C C   . ASN   D 1 96 ? -6.526  -20.947 16.261 1   44.2  ? 111 ASN   D C   1 
ATOM   3140 O O   . ASN   D 1 96 ? -5.925  -19.945 15.871 1   45.19 ? 111 ASN   D O   1 
ATOM   3141 C CB  . ASN   D 1 96 ? -6.757  -23.179 15.125 1   45.72 ? 111 ASN   D CB  1 
ATOM   3142 C CG  . ASN   D 1 96 ? -7.039  -22.531 13.798 1   51.64 ? 111 ASN   D CG  1 
ATOM   3143 O OD1 . ASN   D 1 96 ? -6.151  -22.392 12.937 1   53.78 ? 111 ASN   D OD1 1 
ATOM   3144 N ND2 . ASN   D 1 96 ? -8.283  -22.103 13.618 1   52.77 ? 111 ASN   D ND2 1 
ATOM   3145 N N   . THR   E 2 1  ? -0.841  -4.866  9.214  1   32.08 ? 1   THR   J N   1 
ATOM   3146 C CA  . THR   E 2 1  ? 0.285   -4.833  10.157 1   31.49 ? 1   THR   J CA  1 
ATOM   3147 C C   . THR   E 2 1  ? 1.571   -5.163  9.398  1   30.13 ? 1   THR   J C   1 
ATOM   3148 O O   . THR   E 2 1  ? 1.573   -5.985  8.482  1   30.13 ? 1   THR   J O   1 
ATOM   3149 C CB  . THR   E 2 1  ? 0.085   -5.599  11.485 1   32.96 ? 1   THR   J CB  1 
ATOM   3150 O OG1 . THR   E 2 1  ? 1.301   -6.164  11.996 1   33.59 ? 1   THR   J OG1 1 
ATOM   3151 C CG2 . THR   E 2 1  ? -0.998  -6.659  11.424 1   32.75 ? 1   THR   J CG2 1 
ATOM   3152 N N   . SER   E 2 2  ? 2.649   -4.435  9.722  1   28.59 ? 2   SER   J N   1 
ATOM   3153 C CA  . SER   E 2 2  ? 3.876   -4.482  8.938  1   26.82 ? 2   SER   J CA  1 
ATOM   3154 C C   . SER   E 2 2  ? 4.78    -5.636  9.376  1   25.4  ? 2   SER   J C   1 
ATOM   3155 O O   . SER   E 2 2  ? 4.606   -6.172  10.468 1   24.66 ? 2   SER   J O   1 
ATOM   3156 C CB  . SER   E 2 2  ? 4.63    -3.159  9.047  1   26.73 ? 2   SER   J CB  1 
ATOM   3157 O OG  . SER   E 2 2  ? 5.217   -3.012  10.339 1   26.26 ? 2   SER   J OG  1 
ATOM   3158 N N   . PHE   E 2 3  ? 5.772   -5.999  8.538  1   24.39 ? 3   PHE   J N   1 
ATOM   3159 C CA  . PHE   E 2 3  ? 6.77    -6.991  8.924  1   23.31 ? 3   PHE   J CA  1 
ATOM   3160 C C   . PHE   E 2 3  ? 7.455   -6.597  10.236 1   22.76 ? 3   PHE   J C   1 
ATOM   3161 O O   . PHE   E 2 3  ? 7.612   -7.43   11.117 1   21.61 ? 3   PHE   J O   1 
ATOM   3162 C CB  . PHE   E 2 3  ? 7.842   -7.212  7.836  1   22.66 ? 3   PHE   J CB  1 
ATOM   3163 C CG  . PHE   E 2 3  ? 9.007   -8.035  8.332  1   22.36 ? 3   PHE   J CG  1 
ATOM   3164 C CD1 . PHE   E 2 3  ? 10.176  -7.419  8.76   1   22.51 ? 3   PHE   J CD1 1 
ATOM   3165 C CD2 . PHE   E 2 3  ? 8.875   -9.41   8.518  1   22.15 ? 3   PHE   J CD2 1 
ATOM   3166 C CE1 . PHE   E 2 3  ? 11.169  -8.149  9.398  1   22.95 ? 3   PHE   J CE1 1 
ATOM   3167 C CE2 . PHE   E 2 3  ? 9.863   -10.135 9.166  1   22.53 ? 3   PHE   J CE2 1 
ATOM   3168 C CZ  . PHE   E 2 3  ? 11.006  -9.506  9.613  1   22.58 ? 3   PHE   J CZ  1 
ATOM   3169 N N   . CYS   E 2 4  ? 7.851   -5.319  10.337 1   23.38 ? 4   CYS   J N   1 
ATOM   3170 C CA  . CYS   E 2 4  ? 8.49    -4.759  11.517 1   25.22 ? 4   CYS   J CA  1 
ATOM   3171 C C   . CYS   E 2 4  ? 7.678   -5.004  12.793 1   22.31 ? 4   CYS   J C   1 
ATOM   3172 O O   . CYS   E 2 4  ? 8.221   -5.384  13.824 1   19.89 ? 4   CYS   J O   1 
ATOM   3173 C CB  . CYS   E 2 4  ? 8.646   -3.243  11.323 1   30.55 ? 4   CYS   J CB  1 
ATOM   3174 S SG  . CYS   E 2 4  ? 9.608   -2.521  12.672 1   36.5  ? 4   CYS   J SG  1 
ATOM   3175 N N   . GLU   E 2 5  ? 6.371   -4.751  12.716 1   22.31 ? 5   GLU   J N   1 
ATOM   3176 C CA  . GLU   E 2 5  ? 5.468   -4.994  13.83  1   22.03 ? 5   GLU   J CA  1 
ATOM   3177 C C   . GLU   E 2 5  ? 5.333   -6.474  14.195 1   21.23 ? 5   GLU   J C   1 
ATOM   3178 O O   . GLU   E 2 5  ? 5.388   -6.827  15.372 1   21.36 ? 5   GLU   J O   1 
ATOM   3179 C CB  . GLU   E 2 5  ? 4.109   -4.341  13.555 1   23.08 ? 5   GLU   J CB  1 
ATOM   3180 C CG  . GLU   E 2 5  ? 4.211   -2.818  13.488 1   25.15 ? 5   GLU   J CG  1 
ATOM   3181 C CD  . GLU   E 2 5  ? 3.094   -2.154  12.732 1   27.61 ? 5   GLU   J CD  1 
ATOM   3182 O OE1 . GLU   E 2 5  ? 2.287   -2.752  12.077 1   27.68 ? 5   GLU   J OE1 1 
ATOM   3183 O OE2 . GLU   E 2 5  ? 3.066   -0.859  12.875 1   29.38 ? 5   GLU   J OE2 1 
ATOM   3184 N N   . TYR   E 2 6  ? 5.192   -7.339  13.183 1   20.73 ? 6   TYR   J N   1 
ATOM   3185 C CA  . TYR   E 2 6  ? 5.219   -8.779  13.407 1   20.93 ? 6   TYR   J CA  1 
ATOM   3186 C C   . TYR   E 2 6  ? 6.519   -9.265  14.057 1   20.32 ? 6   TYR   J C   1 
ATOM   3187 O O   . TYR   E 2 6  ? 6.491   -10.184 14.876 1   19.7  ? 6   TYR   J O   1 
ATOM   3188 C CB  . TYR   E 2 6  ? 5.013   -9.545  12.087 1   22.37 ? 6   TYR   J CB  1 
ATOM   3189 C CG  . TYR   E 2 6  ? 3.574   -9.608  11.635 1   23.15 ? 6   TYR   J CG  1 
ATOM   3190 C CD1 . TYR   E 2 6  ? 2.6     -10.183 12.444 1   24.04 ? 6   TYR   J CD1 1 
ATOM   3191 C CD2 . TYR   E 2 6  ? 3.192   -9.084  10.405 1   24.49 ? 6   TYR   J CD2 1 
ATOM   3192 C CE1 . TYR   E 2 6  ? 1.277   -10.243 12.035 1   25.42 ? 6   TYR   J CE1 1 
ATOM   3193 C CE2 . TYR   E 2 6  ? 1.875   -9.155  9.974  1   25.45 ? 6   TYR   J CE2 1 
ATOM   3194 C CZ  . TYR   E 2 6  ? 0.916   -9.75   10.786 1   26.13 ? 6   TYR   J CZ  1 
ATOM   3195 O OH  . TYR   E 2 6  ? -0.357  -9.909  10.336 1   27.36 ? 6   TYR   J OH  1 
ATOM   3196 N N   . TRP   E 2 7  ? 7.659   -8.707  13.616 1   19.57 ? 7   TRP   J N   1 
ATOM   3197 C CA  . TRP   E 2 7  ? 8.968   -9.091  14.125 1   19.88 ? 7   TRP   J CA  1 
ATOM   3198 C C   . TRP   E 2 7  ? 9.193   -8.64   15.569 1   19.82 ? 7   TRP   J C   1 
ATOM   3199 O O   . TRP   E 2 7  ? 9.709   -9.398  16.39  1   19.44 ? 7   TRP   J O   1 
ATOM   3200 C CB  . TRP   E 2 7  ? 10.1    -8.561  13.22  1   20.03 ? 7   TRP   J CB  1 
ATOM   3201 C CG  . TRP   E 2 7  ? 11.416  -9.236  13.469 1   20.38 ? 7   TRP   J CG  1 
ATOM   3202 C CD1 . TRP   E 2 7  ? 12.515  -8.703  14.079 1   20.14 ? 7   TRP   J CD1 1 
ATOM   3203 C CD2 . TRP   E 2 7  ? 11.747  -10.604 13.177 1   21.17 ? 7   TRP   J CD2 1 
ATOM   3204 N NE1 . TRP   E 2 7  ? 13.499  -9.647  14.193 1   20.2  ? 7   TRP   J NE1 1 
ATOM   3205 C CE2 . TRP   E 2 7  ? 13.051  -10.826 13.658 1   20.42 ? 7   TRP   J CE2 1 
ATOM   3206 C CE3 . TRP   E 2 7  ? 11.081  -11.651 12.545 1   21.55 ? 7   TRP   J CE3 1 
ATOM   3207 C CZ2 . TRP   E 2 7  ? 13.683  -12.057 13.526 1   21.81 ? 7   TRP   J CZ2 1 
ATOM   3208 C CZ3 . TRP   E 2 7  ? 11.711  -12.879 12.4   1   22.18 ? 7   TRP   J CZ3 1 
ATOM   3209 C CH2 . TRP   E 2 7  ? 12.998  -13.08  12.886 1   22.11 ? 7   TRP   J CH2 1 
ATOM   3210 N N   . ALA   E 2 8  ? 8.842   -7.379  15.859 1   20.11 ? 8   ALA   J N   1 
ATOM   3211 C CA  . ALA   E 2 8  ? 8.949   -6.858  17.211 1   20.8  ? 8   ALA   J CA  1 
ATOM   3212 C C   . ALA   E 2 8  ? 8.023   -7.576  18.192 1   20.54 ? 8   ALA   J C   1 
ATOM   3213 O O   . ALA   E 2 8  ? 8.444   -7.928  19.293 1   20.55 ? 8   ALA   J O   1 
ATOM   3214 C CB  . ALA   E 2 8  ? 8.67    -5.356  17.224 1   20.68 ? 8   ALA   J CB  1 
HETATM 3215 C CA  . URL   E 2 9  ? 5.77    -8.497  18.609 1   22.38 ? 9   URL   J CA  1 
HETATM 3216 C C   . URL   E 2 9  ? 7.33    -11.246 18.486 1   23.84 ? 9   URL   J C   1 
HETATM 3217 O O   . URL   E 2 9  ? 6.902   -11.586 19.589 1   22.55 ? 9   URL   J O   1 
HETATM 3218 C CB  . URL   E 2 9  ? 4.518   -7.64   18.766 1   23.24 ? 9   URL   J CB  1 
HETATM 3219 C C2  . URL   E 2 9  ? 5.36    -9.857  17.97  1   22.88 ? 9   URL   J C2  1 
HETATM 3220 N N   . URL   E 2 9  ? 6.764   -7.799  17.787 1   20.85 ? 9   URL   J N   1 
HETATM 3221 N N2  . URL   E 2 9  ? 6.603   -10.522 17.613 1   23.39 ? 9   URL   J N2  1 
HETATM 3222 C C1  . URL   E 2 9  ? 4.7     -6.425  19.66  1   25.08 ? 9   URL   J C1  1 
HETATM 3223 C C3  . URL   E 2 9  ? 3.508   -5.512  19.489 1   25.72 ? 9   URL   J C3  1 
HETATM 3224 C C4  . URL   E 2 9  ? 4.826   -6.876  21.123 1   25.71 ? 9   URL   J C4  1 
HETATM 3225 C CA  . URL   E 2 10 ? 9.476   -12.433 18.79  1   25.14 ? 10  URL   J CA  1 
HETATM 3226 C C   . URL   E 2 10 ? 12.01   -10.084 20.118 1   26.24 ? 10  URL   J C   1 
HETATM 3227 O O   . URL   E 2 10 ? 12.29   -10.602 21.189 1   26.55 ? 10  URL   J O   1 
HETATM 3228 C CB  . URL   E 2 10 ? 10.576  -12.999 17.894 1   25.72 ? 10  URL   J CB  1 
HETATM 3229 C C2  . URL   E 2 10 ? 10.08   -11.552 19.895 1   24.91 ? 10  URL   J C2  1 
HETATM 3230 N N   . URL   E 2 10 ? 8.521   -11.656 18.004 1   24.44 ? 10  URL   J N   1 
HETATM 3231 N N2  . URL   E 2 10 ? 10.925  -10.452 19.416 1   25.17 ? 10  URL   J N2  1 
HETATM 3232 C C1  . URL   E 2 10 ? 10.124  -14.198 17.066 1   26.39 ? 10  URL   J C1  1 
HETATM 3233 C C3  . URL   E 2 10 ? 9.575   -13.762 15.73  1   27.33 ? 10  URL   J C3  1 
HETATM 3234 C C4  . URL   E 2 10 ? 11.241  -15.183 16.886 1   27.04 ? 10  URL   J C4  1 
HETATM 3235 C C17 . A1IL6 E 2 11 ? 11.295  -2.971  12.197 1   36.54 ? 11  A1IL6 J C17 1 
HETATM 3236 C C18 . A1IL6 E 2 11 ? 11.836  -4.049  13.103 1   35.82 ? 11  A1IL6 J C18 1 
HETATM 3237 C C19 . A1IL6 E 2 11 ? 12.196  -3.529  14.465 1   34.64 ? 11  A1IL6 J C19 1 
HETATM 3238 C C20 . A1IL6 E 2 11 ? 12.436  -4.64   15.442 1   32.92 ? 11  A1IL6 J C20 1 
HETATM 3239 C C21 . A1IL6 E 2 11 ? 13.518  -4.333  16.442 1   30.75 ? 11  A1IL6 J C21 1 
HETATM 3240 C C22 . A1IL6 E 2 11 ? 13.588  -5.437  17.469 1   28.4  ? 11  A1IL6 J C22 1 
HETATM 3241 C CD  . A1IL6 E 2 11 ? 12.82   -8.623  18.206 1   26.57 ? 11  A1IL6 J CD  1 
HETATM 3242 C CA  . A1IL6 E 2 11 ? 13.942  -8.595  20.37  1   28.31 ? 11  A1IL6 J CA  1 
HETATM 3243 O O   . A1IL6 E 2 11 ? 12.641  -7.125  21.744 1   30.83 ? 11  A1IL6 J O   1 
HETATM 3244 N N   . A1IL6 E 2 11 ? 12.79   -9.083  19.597 1   27.44 ? 11  A1IL6 J N   1 
HETATM 3245 C C   . A1IL6 E 2 11 ? 13.543  -7.966  21.704 1   29.81 ? 11  A1IL6 J C   1 
HETATM 3246 C CB  . A1IL6 E 2 11 ? 14.578  -7.553  19.439 1   27.02 ? 11  A1IL6 J CB  1 
HETATM 3247 C CG  . A1IL6 E 2 11 ? 14.25   -8.116  18.06  1   26.45 ? 11  A1IL6 J CG  1 
HETATM 3248 S S1  . A1IL6 E 2 11 ? 14.365  -6.899  16.738 1   25.49 ? 11  A1IL6 J S1  1 
HETATM 3249 N N   . NH2   E 2 12 ? 14.21   -8.369  22.775 1   30.19 ? 12  NH2   J N   1 
ATOM   3250 N N   . THR   F 2 1  ? 21.705  -17.403 44.399 1   36.07 ? 1   THR   F N   1 
ATOM   3251 C CA  . THR   F 2 1  ? 20.499  -16.9   43.73  1   35.85 ? 1   THR   F CA  1 
ATOM   3252 C C   . THR   F 2 1  ? 19.368  -17.915 43.906 1   33.98 ? 1   THR   F C   1 
ATOM   3253 O O   . THR   F 2 1  ? 19.609  -19.116 44.032 1   33.82 ? 1   THR   F O   1 
ATOM   3254 C CB  . THR   F 2 1  ? 20.702  -16.394 42.285 1   37.28 ? 1   THR   F CB  1 
ATOM   3255 O OG1 . THR   F 2 1  ? 19.795  -16.993 41.351 1   38.35 ? 1   THR   F OG1 1 
ATOM   3256 C CG2 . THR   F 2 1  ? 22.128  -16.531 41.789 1   37.2  ? 1   THR   F CG2 1 
ATOM   3257 N N   . SER   F 2 2  ? 18.131  -17.415 44.001 1   32.24 ? 2   SER   F N   1 
ATOM   3258 C CA  . SER   F 2 2  ? 17.01   -18.255 44.401 1   30.89 ? 2   SER   F CA  1 
ATOM   3259 C C   . SER   F 2 2  ? 16.315  -18.876 43.186 1   29    ? 2   SER   F C   1 
ATOM   3260 O O   . SER   F 2 2  ? 16.477  -18.401 42.058 1   27.69 ? 2   SER   F O   1 
ATOM   3261 C CB  . SER   F 2 2  ? 16      -17.455 45.223 1   31.36 ? 2   SER   F CB  1 
ATOM   3262 O OG  . SER   F 2 2  ? 15.246  -16.582 44.39  1   31.58 ? 2   SER   F OG  1 
ATOM   3263 N N   . PHE   F 2 3  ? 15.488  -19.905 43.429 1   27.92 ? 3   PHE   F N   1 
ATOM   3264 C CA  . PHE   F 2 3  ? 14.682  -20.51  42.379 1   27.15 ? 3   PHE   F CA  1 
ATOM   3265 C C   . PHE   F 2 3  ? 13.85   -19.476 41.621 1   26.79 ? 3   PHE   F C   1 
ATOM   3266 O O   . PHE   F 2 3  ? 13.864  -19.463 40.396 1   25.76 ? 3   PHE   F O   1 
ATOM   3267 C CB  . PHE   F 2 3  ? 13.761  -21.626 42.905 1   26.4  ? 3   PHE   F CB  1 
ATOM   3268 C CG  . PHE   F 2 3  ? 12.797  -22.108 41.844 1   25.6  ? 3   PHE   F CG  1 
ATOM   3269 C CD1 . PHE   F 2 3  ? 11.474  -21.675 41.841 1   25.41 ? 3   PHE   F CD1 1 
ATOM   3270 C CD2 . PHE   F 2 3  ? 13.249  -22.869 40.769 1   25.78 ? 3   PHE   F CD2 1 
ATOM   3271 C CE1 . PHE   F 2 3  ? 10.643  -21.944 40.764 1   25.43 ? 3   PHE   F CE1 1 
ATOM   3272 C CE2 . PHE   F 2 3  ? 12.413  -23.146 39.697 1   25.88 ? 3   PHE   F CE2 1 
ATOM   3273 C CZ  . PHE   F 2 3  ? 11.113  -22.674 39.689 1   25.33 ? 3   PHE   F CZ  1 
ATOM   3274 N N   . CYS   F 2 4  ? 13.126  -18.632 42.373 1   27.8  ? 4   CYS   F N   1 
ATOM   3275 C CA  . CYS   F 2 4  ? 12.265  -17.608 41.807 1   28.99 ? 4   CYS   F CA  1 
ATOM   3276 C C   . CYS   F 2 4  ? 13.049  -16.643 40.92  1   26.79 ? 4   CYS   F C   1 
ATOM   3277 O O   . CYS   F 2 4  ? 12.562  -16.247 39.87  1   25.3  ? 4   CYS   F O   1 
ATOM   3278 C CB  . CYS   F 2 4  ? 11.502  -16.832 42.889 1   32.28 ? 4   CYS   F CB  1 
ATOM   3279 S SG  . CYS   F 2 4  ? 10.022  -17.803 43.337 1   35.44 ? 4   CYS   F SG  1 
ATOM   3280 N N   . GLU   F 2 5  ? 14.275  -16.298 41.334 1   26.64 ? 5   GLU   F N   1 
ATOM   3281 C CA  . GLU   F 2 5  ? 15.144  -15.469 40.509 1   25.74 ? 5   GLU   F CA  1 
ATOM   3282 C C   . GLU   F 2 5  ? 15.581  -16.145 39.208 1   24.59 ? 5   GLU   F C   1 
ATOM   3283 O O   . GLU   F 2 5  ? 15.619  -15.507 38.161 1   24.16 ? 5   GLU   F O   1 
ATOM   3284 C CB  . GLU   F 2 5  ? 16.349  -14.969 41.306 1   26.9  ? 5   GLU   F CB  1 
ATOM   3285 C CG  . GLU   F 2 5  ? 15.971  -13.908 42.347 1   27.84 ? 5   GLU   F CG  1 
ATOM   3286 C CD  . GLU   F 2 5  ? 16.974  -13.79  43.459 1   29.34 ? 5   GLU   F CD  1 
ATOM   3287 O OE1 . GLU   F 2 5  ? 17.915  -14.532 43.597 1   29.32 ? 5   GLU   F OE1 1 
ATOM   3288 O OE2 . GLU   F 2 5  ? 16.728  -12.808 44.273 1   30.77 ? 5   GLU   F OE2 1 
ATOM   3289 N N   . TYR   F 2 6  ? 15.877  -17.449 39.274 1   23.9  ? 6   TYR   F N   1 
ATOM   3290 C CA  . TYR   F 2 6  ? 16.181  -18.213 38.073 1   22.99 ? 6   TYR   F CA  1 
ATOM   3291 C C   . TYR   F 2 6  ? 14.973  -18.331 37.145 1   21.86 ? 6   TYR   F C   1 
ATOM   3292 O O   . TYR   F 2 6  ? 15.119  -18.312 35.93  1   21.66 ? 6   TYR   F O   1 
ATOM   3293 C CB  . TYR   F 2 6  ? 16.664  -19.629 38.429 1   23.49 ? 6   TYR   F CB  1 
ATOM   3294 C CG  . TYR   F 2 6  ? 18.107  -19.668 38.866 1   24.84 ? 6   TYR   F CG  1 
ATOM   3295 C CD1 . TYR   F 2 6  ? 19.124  -19.355 37.976 1   26.15 ? 6   TYR   F CD1 1 
ATOM   3296 C CD2 . TYR   F 2 6  ? 18.449  -20.035 40.16  1   25.23 ? 6   TYR   F CD2 1 
ATOM   3297 C CE1 . TYR   F 2 6  ? 20.454  -19.409 38.361 1   27.61 ? 6   TYR   F CE1 1 
ATOM   3298 C CE2 . TYR   F 2 6  ? 19.774  -20.107 40.556 1   26.99 ? 6   TYR   F CE2 1 
ATOM   3299 C CZ  . TYR   F 2 6  ? 20.781  -19.788 39.656 1   28.22 ? 6   TYR   F CZ  1 
ATOM   3300 O OH  . TYR   F 2 6  ? 22.087  -19.806 40.055 1   30.24 ? 6   TYR   F OH  1 
ATOM   3301 N N   . TRP   F 2 7  ? 13.795  -18.552 37.729 1   22.07 ? 7   TRP   F N   1 
ATOM   3302 C CA  . TRP   F 2 7  ? 12.595  -18.754 36.934 1   22.62 ? 7   TRP   F CA  1 
ATOM   3303 C C   . TRP   F 2 7  ? 12.164  -17.456 36.242 1   22.45 ? 7   TRP   F C   1 
ATOM   3304 O O   . TRP   F 2 7  ? 11.804  -17.466 35.066 1   22.1  ? 7   TRP   F O   1 
ATOM   3305 C CB  . TRP   F 2 7  ? 11.467  -19.342 37.794 1   22.2  ? 7   TRP   F CB  1 
ATOM   3306 C CG  . TRP   F 2 7  ? 10.335  -19.856 36.957 1   22.94 ? 7   TRP   F CG  1 
ATOM   3307 C CD1 . TRP   F 2 7  ? 9.162   -19.218 36.666 1   23.84 ? 7   TRP   F CD1 1 
ATOM   3308 C CD2 . TRP   F 2 7  ? 10.29   -21.113 36.265 1   23.78 ? 7   TRP   F CD2 1 
ATOM   3309 N NE1 . TRP   F 2 7  ? 8.397   -19.989 35.834 1   24.19 ? 7   TRP   F NE1 1 
ATOM   3310 C CE2 . TRP   F 2 7  ? 9.065   -21.159 35.569 1   24.27 ? 7   TRP   F CE2 1 
ATOM   3311 C CE3 . TRP   F 2 7  ? 11.174  -22.183 36.137 1   24.88 ? 7   TRP   F CE3 1 
ATOM   3312 C CZ2 . TRP   F 2 7  ? 8.72    -22.236 34.76  1   24.99 ? 7   TRP   F CZ2 1 
ATOM   3313 C CZ3 . TRP   F 2 7  ? 10.836  -23.261 35.332 1   25.38 ? 7   TRP   F CZ3 1 
ATOM   3314 C CH2 . TRP   F 2 7  ? 9.622   -23.285 34.644 1   25.65 ? 7   TRP   F CH2 1 
ATOM   3315 N N   . ALA   F 2 8  ? 12.201  -16.343 36.983 1   22.86 ? 8   ALA   F N   1 
ATOM   3316 C CA  . ALA   F 2 8  ? 11.865  -15.049 36.403 1   23.44 ? 8   ALA   F CA  1 
ATOM   3317 C C   . ALA   F 2 8  ? 12.833  -14.6   35.31  1   24.5  ? 8   ALA   F C   1 
ATOM   3318 O O   . ALA   F 2 8  ? 12.39   -14.183 34.244 1   24.97 ? 8   ALA   F O   1 
ATOM   3319 C CB  . ALA   F 2 8  ? 11.743  -13.977 37.479 1   22.86 ? 8   ALA   F CB  1 
HETATM 3320 C CA  . URL   F 2 9  ? 15.206  -14.334 34.628 1   27.06 ? 9   URL   F CA  1 
HETATM 3321 C C   . URL   F 2 9  ? 14.309  -16.615 32.527 1   27.83 ? 9   URL   F C   1 
HETATM 3322 O O   . URL   F 2 9  ? 14.713  -15.967 31.552 1   26.7  ? 9   URL   F O   1 
HETATM 3323 C CB  . URL   F 2 9  ? 16.234  -13.476 35.368 1   28.96 ? 9   URL   F CB  1 
HETATM 3324 C C2  . URL   F 2 9  ? 15.94   -15.607 34.078 1   27.25 ? 9   URL   F C2  1 
HETATM 3325 N N   . URL   F 2 9  ? 14.143  -14.716 35.567 1   25.64 ? 9   URL   F N   1 
HETATM 3326 N N2  . URL   F 2 9  ? 14.939  -16.598 33.722 1   27.29 ? 9   URL   F N2  1 
HETATM 3327 C C1  . URL   F 2 9  ? 16.173  -11.943 35.235 1   30.66 ? 9   URL   F C1  1 
HETATM 3328 C C3  . URL   F 2 9  ? 16.374  -11.202 36.557 1   30.34 ? 9   URL   F C3  1 
HETATM 3329 C C4  . URL   F 2 9  ? 15.016  -11.376 34.427 1   31.59 ? 9   URL   F C4  1 
HETATM 3330 C CA  . URL   F 2 10 ? 12.404  -17.642 31.299 1   30.57 ? 10  URL   F CA  1 
HETATM 3331 C C   . URL   F 2 10 ? 9.422   -15.551 31.88  1   32.45 ? 10  URL   F C   1 
HETATM 3332 O O   . URL   F 2 10 ? 9.149   -15.192 30.742 1   32.37 ? 10  URL   F O   1 
HETATM 3333 C CB  . URL   F 2 10 ? 11.394  -18.772 31.496 1   31.79 ? 10  URL   F CB  1 
HETATM 3334 C C2  . URL   F 2 10 ? 11.628  -16.306 31.155 1   30.65 ? 10  URL   F C2  1 
HETATM 3335 N N   . URL   F 2 10 ? 13.3    -17.515 32.448 1   29.13 ? 10  URL   F N   1 
HETATM 3336 N N2  . URL   F 2 10 ? 10.619  -16.092 32.192 1   31.53 ? 10  URL   F N2  1 
HETATM 3337 C C1  . URL   F 2 10 ? 11.93   -20.202 31.578 1   33.23 ? 10  URL   F C1  1 
HETATM 3338 C C3  . URL   F 2 10 ? 12.331  -20.724 30.224 1   33.91 ? 10  URL   F C3  1 
HETATM 3339 C C4  . URL   F 2 10 ? 13.053  -20.384 32.59  1   33.68 ? 10  URL   F C4  1 
HETATM 3340 C C17 . A1IL6 F 2 11 ? 9.104   -17.826 41.765 1   37.02 ? 11  A1IL6 F C17 1 
HETATM 3341 C C18 . A1IL6 F 2 11 ? 8.292   -16.559 41.524 1   37.91 ? 11  A1IL6 F C18 1 
HETATM 3342 C C19 . A1IL6 F 2 11 ? 8.766   -15.734 40.336 1   38.37 ? 11  A1IL6 F C19 1 
HETATM 3343 C C20 . A1IL6 F 2 11 ? 7.817   -15.749 39.136 1   37.92 ? 11  A1IL6 F C20 1 
HETATM 3344 C C21 . A1IL6 F 2 11 ? 8.435   -15.16  37.873 1   37.05 ? 11  A1IL6 F C21 1 
HETATM 3345 C C22 . A1IL6 F 2 11 ? 7.455   -14.88  36.74  1   35.64 ? 11  A1IL6 F C22 1 
HETATM 3346 C CD  . A1IL6 F 2 11 ? 8.493   -16.173 34.156 1   33.39 ? 11  A1IL6 F CD  1 
HETATM 3347 C CA  . A1IL6 F 2 11 ? 7.199   -14.834 32.59  1   34.01 ? 11  A1IL6 F CA  1 
HETATM 3348 O O   . A1IL6 F 2 11 ? 6.682   -12.906 31.27  1   36.04 ? 11  A1IL6 F O   1 
HETATM 3349 N N   . A1IL6 F 2 11 ? 8.511   -15.415 32.905 1   33.35 ? 11  A1IL6 F N   1 
HETATM 3350 C C   . A1IL6 F 2 11 ? 7.286   -13.349 32.253 1   34.64 ? 11  A1IL6 F C   1 
HETATM 3351 C CB  . A1IL6 F 2 11 ? 6.372   -15.094 33.857 1   33.55 ? 11  A1IL6 F CB  1 
HETATM 3352 C CG  . A1IL6 F 2 11 ? 7.001   -16.368 34.407 1   33.95 ? 11  A1IL6 F CG  1 
HETATM 3353 S S1  . A1IL6 F 2 11 ? 6.716   -16.43  36.168 1   35.17 ? 11  A1IL6 F S1  1 
HETATM 3354 N N   . NH2   F 2 12 ? 8.056   -12.602 33.03  1   33.64 ? 12  NH2   F N   1 
ATOM   3355 N N   . THR   G 2 1  ? -1.116  -14.531 45.424 1   33.36 ? 1   THR   G N   1 
ATOM   3356 C CA  . THR   G 2 1  ? 0.101   -14.322 44.634 1   32.71 ? 1   THR   G CA  1 
ATOM   3357 C C   . THR   G 2 1  ? 1.146   -13.63  45.511 1   31.06 ? 1   THR   G C   1 
ATOM   3358 O O   . THR   G 2 1  ? 0.82    -12.749 46.307 1   31.44 ? 1   THR   G O   1 
ATOM   3359 C CB  . THR   G 2 1  ? -0.09   -13.702 43.231 1   33.99 ? 1   THR   G CB  1 
ATOM   3360 O OG1 . THR   G 2 1  ? 0.777   -12.591 42.966 1   34.92 ? 1   THR   G OG1 1 
ATOM   3361 C CG2 . THR   G 2 1  ? -1.524  -13.31  42.94  1   33.48 ? 1   THR   G CG2 1 
ATOM   3362 N N   . SER   G 2 2  ? 2.408   -14.053 45.368 1   28.97 ? 2   SER   G N   1 
ATOM   3363 C CA  . SER   G 2 2  ? 3.463   -13.636 46.276 1   27.26 ? 2   SER   G CA  1 
ATOM   3364 C C   . SER   G 2 2  ? 4.068   -12.28  45.88  1   25.46 ? 2   SER   G C   1 
ATOM   3365 O O   . SER   G 2 2  ? 3.88    -11.807 44.754 1   23.4  ? 2   SER   G O   1 
ATOM   3366 C CB  . SER   G 2 2  ? 4.56    -14.695 46.326 1   27.99 ? 2   SER   G CB  1 
ATOM   3367 O OG  . SER   G 2 2  ? 5.31    -14.682 45.112 1   28.44 ? 2   SER   G OG  1 
ATOM   3368 N N   . PHE   G 2 3  ? 4.853   -11.684 46.791 1   24.78 ? 3   PHE   G N   1 
ATOM   3369 C CA  . PHE   G 2 3  ? 5.577   -10.46  46.479 1   23.85 ? 3   PHE   G CA  1 
ATOM   3370 C C   . PHE   G 2 3  ? 6.487   -10.656 45.262 1   23.77 ? 3   PHE   G C   1 
ATOM   3371 O O   . PHE   G 2 3  ? 6.532   -9.803  44.386 1   22.84 ? 3   PHE   G O   1 
ATOM   3372 C CB  . PHE   G 2 3  ? 6.42    -9.968  47.667 1   24.02 ? 3   PHE   G CB  1 
ATOM   3373 C CG  . PHE   G 2 3  ? 7.363   -8.858  47.27  1   23.46 ? 3   PHE   G CG  1 
ATOM   3374 C CD1 . PHE   G 2 3  ? 8.705   -9.132  47.008 1   23.36 ? 3   PHE   G CD1 1 
ATOM   3375 C CD2 . PHE   G 2 3  ? 6.881   -7.576  47.017 1   23.47 ? 3   PHE   G CD2 1 
ATOM   3376 C CE1 . PHE   G 2 3  ? 9.533   -8.161  46.468 1   23.69 ? 3   PHE   G CE1 1 
ATOM   3377 C CE2 . PHE   G 2 3  ? 7.711   -6.602  46.484 1   23.49 ? 3   PHE   G CE2 1 
ATOM   3378 C CZ  . PHE   G 2 3  ? 9.04    -6.894  46.204 1   23.68 ? 3   PHE   G CZ  1 
ATOM   3379 N N   . CYS   G 2 4  ? 7.18    -11.796 45.214 1   24.95 ? 4   CYS   G N   1 
ATOM   3380 C CA  . CYS   G 2 4  ? 8.113   -12.061 44.132 1   27.24 ? 4   CYS   G CA  1 
ATOM   3381 C C   . CYS   G 2 4  ? 7.38    -12.151 42.793 1   25.54 ? 4   CYS   G C   1 
ATOM   3382 O O   . CYS   G 2 4  ? 7.869   -11.653 41.791 1   24.95 ? 4   CYS   G O   1 
ATOM   3383 C CB  . CYS   G 2 4  ? 8.904   -13.349 44.378 1   31.67 ? 4   CYS   G CB  1 
ATOM   3384 S SG  . CYS   G 2 4  ? 10.36   -12.947 45.39  1   36.38 ? 4   CYS   G SG  1 
ATOM   3385 N N   . GLU   G 2 5  ? 6.186   -12.755 42.796 1   25.13 ? 5   GLU   G N   1 
ATOM   3386 C CA  . GLU   G 2 5  ? 5.347   -12.778 41.607 1   24.89 ? 5   GLU   G CA  1 
ATOM   3387 C C   . GLU   G 2 5  ? 4.89    -11.383 41.158 1   23.96 ? 5   GLU   G C   1 
ATOM   3388 O O   . GLU   G 2 5  ? 4.88    -11.085 39.967 1   23.57 ? 5   GLU   G O   1 
ATOM   3389 C CB  . GLU   G 2 5  ? 4.179   -13.749 41.785 1   25.28 ? 5   GLU   G CB  1 
ATOM   3390 C CG  . GLU   G 2 5  ? 4.652   -15.214 41.903 1   25.9  ? 5   GLU   G CG  1 
ATOM   3391 C CD  . GLU   G 2 5  ? 3.623   -16.159 42.457 1   27.51 ? 5   GLU   G CD  1 
ATOM   3392 O OE1 . GLU   G 2 5  ? 3.857   -17.427 42.183 1   28.24 ? 5   GLU   G OE1 1 
ATOM   3393 O OE2 . GLU   G 2 5  ? 2.662   -15.79  43.105 1   28.16 ? 5   GLU   G OE2 1 
ATOM   3394 N N   . TYR   G 2 6  ? 4.531   -10.527 42.12  1   22.59 ? 6   TYR   G N   1 
ATOM   3395 C CA  . TYR   G 2 6  ? 4.17    -9.151  41.822 1   22.8  ? 6   TYR   G CA  1 
ATOM   3396 C C   . TYR   G 2 6  ? 5.362   -8.34   41.319 1   21.94 ? 6   TYR   G C   1 
ATOM   3397 O O   . TYR   G 2 6  ? 5.21    -7.491  40.451 1   22.89 ? 6   TYR   G O   1 
ATOM   3398 C CB  . TYR   G 2 6  ? 3.562   -8.461  43.056 1   23.18 ? 6   TYR   G CB  1 
ATOM   3399 C CG  . TYR   G 2 6  ? 2.108   -8.804  43.27  1   24.14 ? 6   TYR   G CG  1 
ATOM   3400 C CD1 . TYR   G 2 6  ? 1.146   -8.435  42.336 1   24.39 ? 6   TYR   G CD1 1 
ATOM   3401 C CD2 . TYR   G 2 6  ? 1.69    -9.45   44.429 1   25.2  ? 6   TYR   G CD2 1 
ATOM   3402 C CE1 . TYR   G 2 6  ? -0.202  -8.681  42.558 1   25.7  ? 6   TYR   G CE1 1 
ATOM   3403 C CE2 . TYR   G 2 6  ? 0.347   -9.705  44.663 1   25.89 ? 6   TYR   G CE2 1 
ATOM   3404 C CZ  . TYR   G 2 6  ? -0.604  -9.312  43.728 1   26.44 ? 6   TYR   G CZ  1 
ATOM   3405 O OH  . TYR   G 2 6  ? -1.926  -9.522  43.966 1   27.65 ? 6   TYR   G OH  1 
ATOM   3406 N N   . TRP   G 2 7  ? 6.539   -8.587  41.895 1   21.4  ? 7   TRP   G N   1 
ATOM   3407 C CA  . TRP   G 2 7  ? 7.745   -7.877  41.51  1   21.85 ? 7   TRP   G CA  1 
ATOM   3408 C C   . TRP   G 2 7  ? 8.171   -8.276  40.095 1   21.95 ? 7   TRP   G C   1 
ATOM   3409 O O   . TRP   G 2 7  ? 8.572   -7.425  39.311 1   21.99 ? 7   TRP   G O   1 
ATOM   3410 C CB  . TRP   G 2 7  ? 8.862   -8.084  42.536 1   21.51 ? 7   TRP   G CB  1 
ATOM   3411 C CG  . TRP   G 2 7  ? 9.985   -7.101  42.39  1   22.11 ? 7   TRP   G CG  1 
ATOM   3412 C CD1 . TRP   G 2 7  ? 11.244  -7.353  41.924 1   21.97 ? 7   TRP   G CD1 1 
ATOM   3413 C CD2 . TRP   G 2 7  ? 9.946   -5.7    42.703 1   22.82 ? 7   TRP   G CD2 1 
ATOM   3414 N NE1 . TRP   G 2 7  ? 11.985  -6.207  41.921 1   22.42 ? 7   TRP   G NE1 1 
ATOM   3415 C CE2 . TRP   G 2 7  ? 11.216  -5.175  42.397 1   23.15 ? 7   TRP   G CE2 1 
ATOM   3416 C CE3 . TRP   G 2 7  ? 8.975   -4.843  43.217 1   23.5  ? 7   TRP   G CE3 1 
ATOM   3417 C CZ2 . TRP   G 2 7  ? 11.522  -3.829  42.592 1   23.25 ? 7   TRP   G CZ2 1 
ATOM   3418 C CZ3 . TRP   G 2 7  ? 9.275   -3.502  43.419 1   23.94 ? 7   TRP   G CZ3 1 
ATOM   3419 C CH2 . TRP   G 2 7  ? 10.54   -3.003  43.119 1   23.8  ? 7   TRP   G CH2 1 
ATOM   3420 N N   . ALA   G 2 8  ? 8.076   -9.576  39.783 1   22.01 ? 8   ALA   G N   1 
ATOM   3421 C CA  . ALA   G 2 8  ? 8.522   -10.085 38.497 1   23.19 ? 8   ALA   G CA  1 
ATOM   3422 C C   . ALA   G 2 8  ? 7.589   -9.653  37.367 1   24.41 ? 8   ALA   G C   1 
ATOM   3423 O O   . ALA   G 2 8  ? 8.045   -9.199  36.311 1   24.66 ? 8   ALA   G O   1 
ATOM   3424 C CB  . ALA   G 2 8  ? 8.642   -11.608 38.532 1   23.08 ? 8   ALA   G CB  1 
HETATM 3425 C CA  . URL   G 2 9  ? 5.235   -9.316  36.688 1   25.9  ? 9   URL   G CA  1 
HETATM 3426 C C   . URL   G 2 9  ? 6.114   -6.297  36.92  1   26.48 ? 9   URL   G C   1 
HETATM 3427 O O   . URL   G 2 9  ? 5.812   -6.17   35.737 1   26.86 ? 9   URL   G O   1 
HETATM 3428 C CB  . URL   G 2 9  ? 4.247   -10.461 36.474 1   27.07 ? 9   URL   G CB  1 
HETATM 3429 C C2  . URL   G 2 9  ? 4.475   -8.094  37.25  1   25.61 ? 9   URL   G C2  1 
HETATM 3430 N N   . URL   G 2 9  ? 6.275   -9.744  37.624 1   24.57 ? 9   URL   G N   1 
HETATM 3431 N N2  . URL   G 2 9  ? 5.449   -7.134  37.737 1   25.96 ? 9   URL   G N2  1 
HETATM 3432 C C1  . URL   G 2 9  ? 4.737   -11.567 35.551 1   28.39 ? 9   URL   G C1  1 
HETATM 3433 C C3  . URL   G 2 9  ? 3.705   -12.679 35.499 1   28.56 ? 9   URL   G C3  1 
HETATM 3434 C C4  . URL   G 2 9  ? 5.017   -11.032 34.137 1   29.33 ? 9   URL   G C4  1 
HETATM 3435 C CA  . URL   G 2 10 ? 7.924   -4.582  36.832 1   26.92 ? 10  URL   G CA  1 
HETATM 3436 C C   . URL   G 2 10 ? 11.067  -6.317  35.925 1   28.86 ? 10  URL   G C   1 
HETATM 3437 O O   . URL   G 2 10 ? 11.362  -5.786  34.861 1   28.6  ? 10  URL   G O   1 
HETATM 3438 C CB  . URL   G 2 10 ? 8.879   -3.873  37.799 1   27.61 ? 10  URL   G CB  1 
HETATM 3439 C C2  . URL   G 2 10 ? 8.813   -5.353  35.818 1   27.15 ? 10  URL   G C2  1 
HETATM 3440 N N   . URL   G 2 10 ? 7.069   -5.551  37.525 1   26.42 ? 10  URL   G N   1 
HETATM 3441 N N2  . URL   G 2 10 ? 9.83    -6.179  36.468 1   27.55 ? 10  URL   G N2  1 
HETATM 3442 C C1  . URL   G 2 10 ? 8.365   -2.96   38.925 1   28.74 ? 10  URL   G C1  1 
HETATM 3443 C C3  . URL   G 2 10 ? 8.384   -1.49   38.596 1   28.91 ? 10  URL   G C3  1 
HETATM 3444 C C4  . URL   G 2 10 ? 7.095   -3.383  39.672 1   28.83 ? 10  URL   G C4  1 
HETATM 3445 C C17 . A1IL6 G 2 11 ? 11.676  -12.952 44.132 1   37.65 ? 11  A1IL6 G C17 1 
HETATM 3446 C C18 . A1IL6 G 2 11 ? 11.539  -11.919 43.023 1   37.76 ? 11  A1IL6 G C18 1 
HETATM 3447 C C19 . A1IL6 G 2 11 ? 12.714  -11.921 42.056 1   37.35 ? 11  A1IL6 G C19 1 
HETATM 3448 C C20 . A1IL6 G 2 11 ? 12.323  -11.968 40.582 1   36.53 ? 11  A1IL6 G C20 1 
HETATM 3449 C C21 . A1IL6 G 2 11 ? 13.442  -11.517 39.639 1   35.23 ? 11  A1IL6 G C21 1 
HETATM 3450 C C22 . A1IL6 G 2 11 ? 13.058  -10.283 38.832 1   33.37 ? 11  A1IL6 G C22 1 
HETATM 3451 C CD  . A1IL6 G 2 11 ? 11.925  -7.494  38.024 1   30.05 ? 11  A1IL6 G CD  1 
HETATM 3452 C CA  . A1IL6 G 2 11 ? 13.34   -7.194  36.059 1   31.41 ? 11  A1IL6 G CA  1 
HETATM 3453 O O   . A1IL6 G 2 11 ? 12.652  -8.962  34.595 1   33.58 ? 11  A1IL6 G O   1 
HETATM 3454 N N   . A1IL6 G 2 11 ? 11.988  -7.071  36.62  1   30.03 ? 11  A1IL6 G N   1 
HETATM 3455 C C   . A1IL6 G 2 11 ? 13.34   -7.945  34.73  1   32.74 ? 11  A1IL6 G C   1 
HETATM 3456 C CB  . A1IL6 G 2 11 ? 14.118  -7.939  37.15  1   31.21 ? 11  A1IL6 G CB  1 
HETATM 3457 C CG  . A1IL6 G 2 11 ? 13.395  -7.528  38.431 1   31.24 ? 11  A1IL6 G CG  1 
HETATM 3458 S S1  . A1IL6 G 2 11 ? 13.672  -8.798  39.664 1   32.25 ? 11  A1IL6 G S1  1 
HETATM 3459 N N   . NH2   G 2 12 ? 14.02   -7.394  33.737 1   33.38 ? 12  NH2   G N   1 
ATOM   3460 N N   . THR   H 2 1  ? 20.445  2.854   12.167 1   26.23 ? 1   THR   H N   1 
ATOM   3461 C CA  . THR   H 2 1  ? 19.356  2.323   12.977 1   27.08 ? 1   THR   H CA  1 
ATOM   3462 C C   . THR   H 2 1  ? 18.085  3.116   12.673 1   25.7  ? 1   THR   H C   1 
ATOM   3463 O O   . THR   H 2 1  ? 18.11   4.344   12.581 1   25.42 ? 1   THR   H O   1 
ATOM   3464 C CB  . THR   H 2 1  ? 19.722  2.356   14.474 1   27.95 ? 1   THR   H CB  1 
ATOM   3465 O OG1 . THR   H 2 1  ? 20.968  1.674   14.656 1   29.04 ? 1   THR   H OG1 1 
ATOM   3466 C CG2 . THR   H 2 1  ? 18.669  1.716   15.354 1   27.5  ? 1   THR   H CG2 1 
ATOM   3467 N N   . SER   H 2 2  ? 16.976  2.398   12.499 1   25.03 ? 2   SER   H N   1 
ATOM   3468 C CA  . SER   H 2 2  ? 15.745  3.001   12.011 1   24.54 ? 2   SER   H CA  1 
ATOM   3469 C C   . SER   H 2 2  ? 14.896  3.522   13.175 1   23.68 ? 2   SER   H C   1 
ATOM   3470 O O   . SER   H 2 2  ? 15.073  3.081   14.31  1   22.92 ? 2   SER   H O   1 
ATOM   3471 C CB  . SER   H 2 2  ? 14.951  1.993   11.18  1   24.33 ? 2   SER   H CB  1 
ATOM   3472 O OG  . SER   H 2 2  ? 14.317  1.007   12.008 1   24.78 ? 2   SER   H OG  1 
ATOM   3473 N N   . PHE   H 2 3  ? 13.914  4.394   12.885 1   23.86 ? 3   PHE   H N   1 
ATOM   3474 C CA  . PHE   H 2 3  ? 12.978  4.831   13.92  1   23.41 ? 3   PHE   H CA  1 
ATOM   3475 C C   . PHE   H 2 3  ? 12.277  3.638   14.584 1   23.21 ? 3   PHE   H C   1 
ATOM   3476 O O   . PHE   H 2 3  ? 12.189  3.576   15.806 1   22.48 ? 3   PHE   H O   1 
ATOM   3477 C CB  . PHE   H 2 3  ? 11.933  5.832   13.405 1   23.13 ? 3   PHE   H CB  1 
ATOM   3478 C CG  . PHE   H 2 3  ? 10.804  6.043   14.388 1   22.48 ? 3   PHE   H CG  1 
ATOM   3479 C CD1 . PHE   H 2 3  ? 9.593   5.371   14.23  1   22.07 ? 3   PHE   H CD1 1 
ATOM   3480 C CD2 . PHE   H 2 3  ? 11.006  6.782   15.55  1   22.2  ? 3   PHE   H CD2 1 
ATOM   3481 C CE1 . PHE   H 2 3  ? 8.629   5.402   15.227 1   22.58 ? 3   PHE   H CE1 1 
ATOM   3482 C CE2 . PHE   H 2 3  ? 10.038  6.814   16.545 1   21.98 ? 3   PHE   H CE2 1 
ATOM   3483 C CZ  . PHE   H 2 3  ? 8.853   6.119   16.387 1   22.39 ? 3   PHE   H CZ  1 
ATOM   3484 N N   . CYS   H 2 4  ? 11.816  2.687   13.762 1   23.89 ? 4   CYS   H N   1 
ATOM   3485 C CA  . CYS   H 2 4  ? 11.128  1.515   14.285 1   25.56 ? 4   CYS   H CA  1 
ATOM   3486 C C   . CYS   H 2 4  ? 11.993  0.677   15.233 1   23.97 ? 4   CYS   H C   1 
ATOM   3487 O O   . CYS   H 2 4  ? 11.503  0.188   16.244 1   22.97 ? 4   CYS   H O   1 
ATOM   3488 C CB  . CYS   H 2 4  ? 10.543  0.647   13.168 1   28.18 ? 4   CYS   H CB  1 
ATOM   3489 S SG  . CYS   H 2 4  ? 8.982   1.402   12.62  1   31.4  ? 4   CYS   H SG  1 
ATOM   3490 N N   . GLU   H 2 5  ? 13.279  0.536   14.9   1   23.1  ? 5   GLU   H N   1 
ATOM   3491 C CA  . GLU   H 2 5  ? 14.237  -0.146  15.757 1   22.69 ? 5   GLU   H CA  1 
ATOM   3492 C C   . GLU   H 2 5  ? 14.433  0.555   17.101 1   21.19 ? 5   GLU   H C   1 
ATOM   3493 O O   . GLU   H 2 5  ? 14.38   -0.088  18.148 1   20.87 ? 5   GLU   H O   1 
ATOM   3494 C CB  . GLU   H 2 5  ? 15.569  -0.351  15.024 1   23.35 ? 5   GLU   H CB  1 
ATOM   3495 C CG  . GLU   H 2 5  ? 15.47   -1.43   13.944 1   24.52 ? 5   GLU   H CG  1 
ATOM   3496 C CD  . GLU   H 2 5  ? 16.597  -1.395  12.948 1   25.97 ? 5   GLU   H CD  1 
ATOM   3497 O OE1 . GLU   H 2 5  ? 16.744  -2.53   12.312 1   26.11 ? 5   GLU   H OE1 1 
ATOM   3498 O OE2 . GLU   H 2 5  ? 17.292  -0.41   12.735 1   25.83 ? 5   GLU   H OE2 1 
ATOM   3499 N N   . TYR   H 2 6  ? 14.617  1.882   17.067 1   19.81 ? 6   TYR   H N   1 
ATOM   3500 C CA  . TYR   H 2 6  ? 14.603  2.668   18.292 1   19.69 ? 6   TYR   H CA  1 
ATOM   3501 C C   . TYR   H 2 6  ? 13.318  2.542   19.12  1   18.78 ? 6   TYR   H C   1 
ATOM   3502 O O   . TYR   H 2 6  ? 13.363  2.547   20.343 1   18.95 ? 6   TYR   H O   1 
ATOM   3503 C CB  . TYR   H 2 6  ? 14.902  4.149   18.006 1   20.24 ? 6   TYR   H CB  1 
ATOM   3504 C CG  . TYR   H 2 6  ? 16.348  4.438   17.687 1   21.31 ? 6   TYR   H CG  1 
ATOM   3505 C CD1 . TYR   H 2 6  ? 17.333  4.312   18.662 1   21.45 ? 6   TYR   H CD1 1 
ATOM   3506 C CD2 . TYR   H 2 6  ? 16.72   4.895   16.427 1   22.13 ? 6   TYR   H CD2 1 
ATOM   3507 C CE1 . TYR   H 2 6  ? 18.655  4.627   18.389 1   22.6  ? 6   TYR   H CE1 1 
ATOM   3508 C CE2 . TYR   H 2 6  ? 18.039  5.213   16.138 1   23.13 ? 6   TYR   H CE2 1 
ATOM   3509 C CZ  . TYR   H 2 6  ? 19.01   5.085   17.124 1   23.84 ? 6   TYR   H CZ  1 
ATOM   3510 O OH  . TYR   H 2 6  ? 20.303  5.43    16.851 1   25.61 ? 6   TYR   H OH  1 
ATOM   3511 N N   . TRP   H 2 7  ? 12.167  2.498   18.449 1   19.22 ? 7   TRP   H N   1 
ATOM   3512 C CA  . TRP   H 2 7  ? 10.889  2.476   19.143 1   20.09 ? 7   TRP   H CA  1 
ATOM   3513 C C   . TRP   H 2 7  ? 10.652  1.109   19.797 1   20.56 ? 7   TRP   H C   1 
ATOM   3514 O O   . TRP   H 2 7  ? 10.202  1.037   20.935 1   20.42 ? 7   TRP   H O   1 
ATOM   3515 C CB  . TRP   H 2 7  ? 9.741   2.821   18.179 1   20.17 ? 7   TRP   H CB  1 
ATOM   3516 C CG  . TRP   H 2 7  ? 8.457   3.085   18.904 1   21.58 ? 7   TRP   H CG  1 
ATOM   3517 C CD1 . TRP   H 2 7  ? 7.388   2.243   19.025 1   21.89 ? 7   TRP   H CD1 1 
ATOM   3518 C CD2 . TRP   H 2 7  ? 8.12    4.271   19.64  1   22    ? 7   TRP   H CD2 1 
ATOM   3519 N NE1 . TRP   H 2 7  ? 6.418   2.82    19.801 1   22.05 ? 7   TRP   H NE1 1 
ATOM   3520 C CE2 . TRP   H 2 7  ? 6.839   4.068   20.189 1   22.25 ? 7   TRP   H CE2 1 
ATOM   3521 C CE3 . TRP   H 2 7  ? 8.765   5.486   19.877 1   23.12 ? 7   TRP   H CE3 1 
ATOM   3522 C CZ2 . TRP   H 2 7  ? 6.211   5.035   20.965 1   22.52 ? 7   TRP   H CZ2 1 
ATOM   3523 C CZ3 . TRP   H 2 7  ? 8.136   6.463   20.639 1   22.84 ? 7   TRP   H CZ3 1 
ATOM   3524 C CH2 . TRP   H 2 7  ? 6.871   6.238   21.179 1   22.9  ? 7   TRP   H CH2 1 
ATOM   3525 N N   . ALA   H 2 8  ? 11.008  0.039   19.085 1   21.01 ? 8   ALA   H N   1 
ATOM   3526 C CA  . ALA   H 2 8  ? 10.81   -1.306  19.605 1   21.41 ? 8   ALA   H CA  1 
ATOM   3527 C C   . ALA   H 2 8  ? 11.74   -1.592  20.783 1   21.57 ? 8   ALA   H C   1 
ATOM   3528 O O   . ALA   H 2 8  ? 11.315  -2.162  21.786 1   21.03 ? 8   ALA   H O   1 
ATOM   3529 C CB  . ALA   H 2 8  ? 11.014  -2.338  18.503 1   21.65 ? 8   ALA   H CB  1 
HETATM 3530 C CA  . URL   H 2 9  ? 14.026  -1.355  21.699 1   22.15 ? 9   URL   H CA  1 
HETATM 3531 C C   . URL   H 2 9  ? 12.52   0.619   23.66  1   24.2  ? 9   URL   H C   1 
HETATM 3532 O O   . URL   H 2 9  ? 12.985  0.044   24.652 1   23.72 ? 9   URL   H O   1 
HETATM 3533 C CB  . URL   H 2 9  ? 15.271  -2.025  21.126 1   22.03 ? 9   URL   H CB  1 
HETATM 3534 C C2  . URL   H 2 9  ? 14.444  0.04    22.253 1   22.9  ? 9   URL   H C2  1 
HETATM 3535 N N   . URL   H 2 9  ? 13.015  -1.192  20.651 1   21.42 ? 9   URL   H N   1 
HETATM 3536 N N2  . URL   H 2 9  ? 13.218  0.774   22.526 1   23.41 ? 9   URL   H N2  1 
HETATM 3537 C C1  . URL   H 2 9  ? 15.093  -3.49   20.73  1   22.87 ? 9   URL   H C1  1 
HETATM 3538 C C3  . URL   H 2 9  ? 14.797  -4.339  21.951 1   23.49 ? 9   URL   H C3  1 
HETATM 3539 C C4  . URL   H 2 9  ? 16.315  -4.013  19.981 1   22.71 ? 9   URL   H C4  1 
HETATM 3540 C CA  . URL   H 2 10 ? 10.387  1.221   24.774 1   26.73 ? 10  URL   H CA  1 
HETATM 3541 C C   . URL   H 2 10 ? 7.978   -1.435  23.841 1   30.08 ? 10  URL   H C   1 
HETATM 3542 O O   . URL   H 2 10 ? 7.664   -1.883  24.934 1   30.48 ? 10  URL   H O   1 
HETATM 3543 C CB  . URL   H 2 10 ? 9.197   2.148   24.507 1   27.34 ? 10  URL   H CB  1 
HETATM 3544 C C2  . URL   H 2 10 ? 9.86    -0.239  24.873 1   27.1  ? 10  URL   H C2  1 
HETATM 3545 N N   . URL   H 2 10 ? 11.333  1.263   23.663 1   25.43 ? 10  URL   H N   1 
HETATM 3546 N N2  . URL   H 2 10 ? 9.076   -0.646  23.704 1   28.59 ? 10  URL   H N2  1 
HETATM 3547 C C1  . URL   H 2 10 ? 9.37    3.673   24.543 1   28.51 ? 10  URL   H C1  1 
HETATM 3548 C C3  . URL   H 2 10 ? 8.967   4.313   25.853 1   28.04 ? 10  URL   H C3  1 
HETATM 3549 C C4  . URL   H 2 10 ? 10.684  4.223   24.033 1   29.18 ? 10  URL   H C4  1 
HETATM 3550 C C17 . A1IL6 H 2 11 ? 8.165   1.823   14.189 1   33.16 ? 11  A1IL6 H C17 1 
HETATM 3551 C C18 . A1IL6 H 2 11 ? 7.117   0.836   14.668 1   34.46 ? 11  A1IL6 H C18 1 
HETATM 3552 C C19 . A1IL6 H 2 11 ? 7.618   -0.48   15.254 1   35.02 ? 11  A1IL6 H C19 1 
HETATM 3553 C C20 . A1IL6 H 2 11 ? 6.63    -1.039  16.282 1   35.11 ? 11  A1IL6 H C20 1 
HETATM 3554 C C21 . A1IL6 H 2 11 ? 7.112   -2.203  17.139 1   34.29 ? 11  A1IL6 H C21 1 
HETATM 3555 C C22 . A1IL6 H 2 11 ? 6.898   -2.128  18.66  1   32.8  ? 11  A1IL6 H C22 1 
HETATM 3556 C CD  . A1IL6 H 2 11 ? 7.222   -0.947  21.465 1   31.1  ? 11  A1IL6 H CD  1 
HETATM 3557 C CA  . A1IL6 H 2 11 ? 5.987   -2.487  22.886 1   33.29 ? 11  A1IL6 H CA  1 
HETATM 3558 O O   . A1IL6 H 2 11 ? 5.496   -4.44   24.18  1   37    ? 11  A1IL6 H O   1 
HETATM 3559 N N   . A1IL6 H 2 11 ? 7.222   -1.709  22.72  1   31.52 ? 11  A1IL6 H N   1 
HETATM 3560 C C   . A1IL6 H 2 11 ? 6.221   -3.937  23.318 1   35.44 ? 11  A1IL6 H C   1 
HETATM 3561 C CB  . A1IL6 H 2 11 ? 5.321   -2.393  21.507 1   32.33 ? 11  A1IL6 H CB  1 
HETATM 3562 C CG  . A1IL6 H 2 11 ? 5.77    -1.042  21.006 1   31.62 ? 11  A1IL6 H CG  1 
HETATM 3563 S S1  . A1IL6 H 2 11 ? 5.583   -1.01   19.212 1   32.54 ? 11  A1IL6 H S1  1 
HETATM 3564 N N   . NH2   H 2 12 ? 7.234   -4.581  22.763 1   35.86 ? 12  NH2   H N   1 
HETATM 3565 S S   . SO4   I 3 .  ? 19.802  11.406  48.891 1   55.55 ? 201 SO4   B S   1 
HETATM 3566 O O1  . SO4   I 3 .  ? 20.399  12.413  48.002 1   55.57 ? 201 SO4   B O1  1 
HETATM 3567 O O2  . SO4   I 3 .  ? 20.104  10.053  48.412 1   54.95 ? 201 SO4   B O2  1 
HETATM 3568 O O3  . SO4   I 3 .  ? 20.347  11.562  50.258 1   55.78 ? 201 SO4   B O3  1 
HETATM 3569 O O4  . SO4   I 3 .  ? 18.335  11.581  48.945 1   55.9  ? 201 SO4   B O4  1 
HETATM 3570 S S   . SO4   J 3 .  ? 26.498  -24.641 8.618  1   57.37 ? 201 SO4   C S   1 
HETATM 3571 O O1  . SO4   J 3 .  ? 27.145  -24.709 7.298  1   57.66 ? 201 SO4   C O1  1 
HETATM 3572 O O2  . SO4   J 3 .  ? 25.226  -25.371 8.571  1   57.62 ? 201 SO4   C O2  1 
HETATM 3573 O O3  . SO4   J 3 .  ? 27.396  -25.248 9.625  1   57.32 ? 201 SO4   C O3  1 
HETATM 3574 O O4  . SO4   J 3 .  ? 26.228  -23.237 8.988  1   56.8  ? 201 SO4   C O4  1 
HETATM 3575 S S   . SO4   K 3 .  ? -0.258  -36.793 28.687 1   56.65 ? 201 SO4   D S   1 
HETATM 3576 O O1  . SO4   K 3 .  ? 1.059   -36.873 28.029 1   57.28 ? 201 SO4   D O1  1 
HETATM 3577 O O2  . SO4   K 3 .  ? -1.299  -37.236 27.744 1   56.97 ? 201 SO4   D O2  1 
HETATM 3578 O O3  . SO4   K 3 .  ? -0.064  -37.666 29.862 1   56.77 ? 201 SO4   D O3  1 
HETATM 3579 O O4  . SO4   K 3 .  ? -0.571  -35.424 29.156 1   55.36 ? 201 SO4   D O4  1 
HETATM 3580 O O   . HOH   L 4 .  ? -3.972  -14.273 33.803 1   41.94 ? 201 HOH   A O   1 
HETATM 3581 O O   . HOH   L 4 .  ? -2.708  -11.308 40.614 1   43.15 ? 202 HOH   A O   1 
HETATM 3582 O O   . HOH   L 4 .  ? 12.176  11.957  8.283  1   55.2  ? 203 HOH   A O   1 
HETATM 3583 O O   . HOH   L 4 .  ? -8.334  11.278  15.447 1   32.97 ? 204 HOH   A O   1 
HETATM 3584 O O   . HOH   L 4 .  ? 14.616  14.082  24.569 1   41.46 ? 205 HOH   A O   1 
HETATM 3585 O O   . HOH   L 4 .  ? 1.052   -10.61  33.26  1   45.29 ? 206 HOH   A O   1 
HETATM 3586 O O   . HOH   L 4 .  ? 6.261   18.755  13.219 1   49.69 ? 207 HOH   A O   1 
HETATM 3587 O O   . HOH   L 4 .  ? -0.227  23.108  23.052 1   34.37 ? 208 HOH   A O   1 
HETATM 3588 O O   . HOH   L 4 .  ? 3.799   14.697  8.663  1   39.04 ? 209 HOH   A O   1 
HETATM 3589 O O   . HOH   L 4 .  ? 17.687  18.011  15.443 1   50.99 ? 210 HOH   A O   1 
HETATM 3590 O O   . HOH   L 4 .  ? 16.147  18.102  17.695 1   29.61 ? 211 HOH   A O   1 
HETATM 3591 O O   . HOH   L 4 .  ? -2.429  -5.295  24.47  1   36.86 ? 212 HOH   A O   1 
HETATM 3592 O O   . HOH   L 4 .  ? 14.584  5.968   6.395  1   55.16 ? 213 HOH   A O   1 
HETATM 3593 O O   . HOH   L 4 .  ? 0.73    -6.294  38.734 1   33.25 ? 214 HOH   A O   1 
HETATM 3594 O O   . HOH   L 4 .  ? 20.371  14.994  12.499 1   38.24 ? 215 HOH   A O   1 
HETATM 3595 O O   . HOH   L 4 .  ? 16.509  5.135   29.156 1   24.02 ? 216 HOH   A O   1 
HETATM 3596 O O   . HOH   L 4 .  ? 3.061   17.066  11.127 1   48.56 ? 217 HOH   A O   1 
HETATM 3597 O O   . HOH   L 4 .  ? 0.566   -0.257  35.904 1   24.47 ? 218 HOH   A O   1 
HETATM 3598 O O   . HOH   L 4 .  ? 12.797  4.324   8.99   1   30.25 ? 219 HOH   A O   1 
HETATM 3599 O O   . HOH   L 4 .  ? 18.568  4.58    25.713 1   32.33 ? 220 HOH   A O   1 
HETATM 3600 O O   . HOH   L 4 .  ? -10.315 7.468   26.538 1   41.05 ? 221 HOH   A O   1 
HETATM 3601 O O   . HOH   L 4 .  ? -4.154  13.777  26.022 1   33.52 ? 222 HOH   A O   1 
HETATM 3602 O O   . HOH   L 4 .  ? 3.73    0.156   15.749 1   41.89 ? 223 HOH   A O   1 
HETATM 3603 O O   . HOH   L 4 .  ? -10.192 13.168  21.267 1   27.13 ? 224 HOH   A O   1 
HETATM 3604 O O   . HOH   L 4 .  ? 2.04    1.999   35.63  1   24.01 ? 225 HOH   A O   1 
HETATM 3605 O O   . HOH   L 4 .  ? 3.082   -7.721  28.746 1   55.1  ? 226 HOH   A O   1 
HETATM 3606 O O   . HOH   L 4 .  ? -1.035  17.507  14.031 1   31.19 ? 227 HOH   A O   1 
HETATM 3607 O O   . HOH   L 4 .  ? -1.509  8.498   34.736 1   33.39 ? 228 HOH   A O   1 
HETATM 3608 O O   . HOH   L 4 .  ? -3.854  7.949   35.914 1   30.67 ? 229 HOH   A O   1 
HETATM 3609 O O   . HOH   L 4 .  ? 15.036  14.643  8.436  1   52.73 ? 230 HOH   A O   1 
HETATM 3610 O O   . HOH   L 4 .  ? 6.871   -1.29   30.495 1   63.84 ? 231 HOH   A O   1 
HETATM 3611 O O   . HOH   L 4 .  ? 3.507   11.206  34.22  1   38.65 ? 232 HOH   A O   1 
HETATM 3612 O O   . HOH   L 4 .  ? -5.024  -1.594  34.615 1   40.79 ? 233 HOH   A O   1 
HETATM 3613 O O   . HOH   L 4 .  ? -13.161 10.083  19.991 1   34.76 ? 234 HOH   A O   1 
HETATM 3614 O O   . HOH   L 4 .  ? -2.258  10.476  11.639 1   44.32 ? 235 HOH   A O   1 
HETATM 3615 O O   . HOH   L 4 .  ? -5.127  -5.754  20.517 1   54.13 ? 236 HOH   A O   1 
HETATM 3616 O O   . HOH   L 4 .  ? -7.889  -2.786  25.058 1   45.87 ? 237 HOH   A O   1 
HETATM 3617 O O   . HOH   L 4 .  ? -0.951  -3.361  34.921 1   35.83 ? 238 HOH   A O   1 
HETATM 3618 O O   . HOH   L 4 .  ? -1.837  -7.132  38.84  1   37.54 ? 239 HOH   A O   1 
HETATM 3619 O O   . HOH   L 4 .  ? 18.143  7.335   28.825 1   34.4  ? 240 HOH   A O   1 
HETATM 3620 O O   . HOH   L 4 .  ? 10.404  0.309   28.641 1   36.63 ? 241 HOH   A O   1 
HETATM 3621 O O   . HOH   L 4 .  ? -0.501  21.4    16.606 1   43.76 ? 242 HOH   A O   1 
HETATM 3622 O O   . HOH   L 4 .  ? -3.911  16.057  28.278 1   51.02 ? 243 HOH   A O   1 
HETATM 3623 O O   . HOH   L 4 .  ? 5.574   -4.52   30.805 1   37.4  ? 244 HOH   A O   1 
HETATM 3624 O O   . HOH   L 4 .  ? -1.677  -11.562 31.828 1   41.24 ? 245 HOH   A O   1 
HETATM 3625 O O   . HOH   L 4 .  ? 2.688   21.627  18.812 1   53.8  ? 246 HOH   A O   1 
HETATM 3626 O O   . HOH   L 4 .  ? 11.394  15.077  10.048 1   47.97 ? 247 HOH   A O   1 
HETATM 3627 O O   . HOH   L 4 .  ? -3.027  11.728  34.645 1   61.55 ? 248 HOH   A O   1 
HETATM 3628 O O   . HOH   L 4 .  ? 6.928   15.11   8.339  1   48.95 ? 249 HOH   A O   1 
HETATM 3629 O O   . HOH   L 4 .  ? 5.44    -7.289  29.527 1   63.23 ? 250 HOH   A O   1 
HETATM 3630 O O   . HOH   L 4 .  ? -0.314  17.282  9.823  1   52.59 ? 251 HOH   A O   1 
HETATM 3631 O O   . HOH   L 4 .  ? 4.604   3.282   7.91   1   57.37 ? 252 HOH   A O   1 
HETATM 3632 O O   . HOH   L 4 .  ? 3.826   15.834  29.077 1   48.85 ? 253 HOH   A O   1 
HETATM 3633 O O   . HOH   L 4 .  ? -2.939  14.773  13.824 1   62.73 ? 254 HOH   A O   1 
HETATM 3634 O O   . HOH   L 4 .  ? -9.572  9.852   13.407 1   45.78 ? 255 HOH   A O   1 
HETATM 3635 O O   . HOH   L 4 .  ? 18.731  15.287  8.911  1   54.28 ? 256 HOH   A O   1 
HETATM 3636 O O   . HOH   L 4 .  ? 18.406  12.994  33.516 1   62.72 ? 257 HOH   A O   1 
HETATM 3637 O O   . HOH   L 4 .  ? -2.613  13.405  11.781 1   41.3  ? 258 HOH   A O   1 
HETATM 3638 O O   . HOH   L 4 .  ? 10.545  12.609  33.292 1   44.19 ? 259 HOH   A O   1 
HETATM 3639 O O   . HOH   L 4 .  ? -17.56  2.789   27.542 1   42.95 ? 260 HOH   A O   1 
HETATM 3640 O O   . HOH   L 4 .  ? 1.04    17.082  29.019 1   55.11 ? 261 HOH   A O   1 
HETATM 3641 O O   . HOH   L 4 .  ? 15.861  13.107  33.678 1   56.98 ? 262 HOH   A O   1 
HETATM 3642 O O   . HOH   L 4 .  ? -0.235  19.171  11.554 1   53.48 ? 263 HOH   A O   1 
HETATM 3643 O O   . HOH   L 4 .  ? -15.213 0.456   27.666 1   56.82 ? 264 HOH   A O   1 
HETATM 3644 O O   . HOH   L 4 .  ? -6.497  13.453  35.512 1   51.6  ? 265 HOH   A O   1 
HETATM 3645 O O   . HOH   L 4 .  ? -10.58  11.182  19.572 1   29.14 ? 266 HOH   A O   1 
HETATM 3646 O O   . HOH   L 4 .  ? -11.399 15.327  17.538 1   37.49 ? 267 HOH   A O   1 
HETATM 3647 O O   . HOH   L 4 .  ? 3.641   2.748   10.561 1   42.57 ? 268 HOH   A O   1 
HETATM 3648 O O   . HOH   L 4 .  ? 21.809  3.607   20.066 1   40.02 ? 269 HOH   A O   1 
HETATM 3649 O O   . HOH   L 4 .  ? -18.155 4.556   24.634 1   42.27 ? 270 HOH   A O   1 
HETATM 3650 O O   . HOH   L 4 .  ? 5.19    22.544  20.457 1   56.32 ? 271 HOH   A O   1 
HETATM 3651 O O   . HOH   L 4 .  ? 9.385   24.176  24.276 1   62.06 ? 272 HOH   A O   1 
HETATM 3652 O O   . HOH   L 4 .  ? 20.414  17.528  11.997 1   49.85 ? 273 HOH   A O   1 
HETATM 3653 O O   . HOH   L 4 .  ? 15.782  20.666  11.501 1   58.62 ? 274 HOH   A O   1 
HETATM 3654 O O   . HOH   L 4 .  ? -0.667  13.233  35.479 1   49.85 ? 275 HOH   A O   1 
HETATM 3655 O O   . HOH   L 4 .  ? 0.429   8.806   36.392 1   45.22 ? 276 HOH   A O   1 
HETATM 3656 O O   . HOH   L 4 .  ? -17.04  8.007   25.345 1   56.96 ? 277 HOH   A O   1 
HETATM 3657 O O   . HOH   L 4 .  ? -10.656 11.731  16.856 1   35.25 ? 278 HOH   A O   1 
HETATM 3658 O O   . HOH   L 4 .  ? -3.008  -4.895  38.203 1   38.83 ? 279 HOH   A O   1 
HETATM 3659 O O   . HOH   L 4 .  ? 1.105   13.19   7.204  1   52.4  ? 280 HOH   A O   1 
HETATM 3660 O O   . HOH   L 4 .  ? 17.151  14.903  5.818  1   62.74 ? 281 HOH   A O   1 
HETATM 3661 O O   . HOH   L 4 .  ? 8.228   0.381   6.423  1   52.22 ? 282 HOH   A O   1 
HETATM 3662 O O   . HOH   M 4 .  ? 21.617  1.64    17.427 1   45.34 ? 301 HOH   B O   1 
HETATM 3663 O O   . HOH   M 4 .  ? 12.069  -5.456  58.149 1   30.84 ? 302 HOH   B O   1 
HETATM 3664 O O   . HOH   M 4 .  ? 1.654   2.778   44.779 1   39.33 ? 303 HOH   B O   1 
HETATM 3665 O O   . HOH   M 4 .  ? 26.197  5.695   42.835 1   40.17 ? 304 HOH   B O   1 
HETATM 3666 O O   . HOH   M 4 .  ? 16.321  12.097  47.386 1   56.29 ? 305 HOH   B O   1 
HETATM 3667 O O   . HOH   M 4 .  ? 34.420  -8.066  47.050 1   68.34 ? 306 HOH   B O   1 
HETATM 3668 O O   . HOH   M 4 .  ? 10.698  -0.596  31.194 1   51.9  ? 307 HOH   B O   1 
HETATM 3669 O O   . HOH   M 4 .  ? 5.339   -8.931  56.129 1   27.7  ? 308 HOH   B O   1 
HETATM 3670 O O   . HOH   M 4 .  ? 6.245   -14.162 49.649 1   28.35 ? 309 HOH   B O   1 
HETATM 3671 O O   . HOH   M 4 .  ? 23.686  -1.285  29.601 1   43.28 ? 310 HOH   B O   1 
HETATM 3672 O O   . HOH   M 4 .  ? 18.662  8.073   46.959 1   35.8  ? 311 HOH   B O   1 
HETATM 3673 O O   . HOH   M 4 .  ? 18.587  -3.608  23.67  1   36.03 ? 312 HOH   B O   1 
HETATM 3674 O O   . HOH   M 4 .  ? 22.702  5.828   30.695 1   40.07 ? 313 HOH   B O   1 
HETATM 3675 O O   . HOH   M 4 .  ? 25.362  5.829   50.271 1   41.02 ? 314 HOH   B O   1 
HETATM 3676 O O   . HOH   M 4 .  ? 24.457  -0.449  52.946 1   42.49 ? 315 HOH   B O   1 
HETATM 3677 O O   . HOH   M 4 .  ? 31.926  6.33    41.872 1   67.69 ? 316 HOH   B O   1 
HETATM 3678 O O   . HOH   M 4 .  ? 21.942  -5.676  33.645 1   36.26 ? 317 HOH   B O   1 
HETATM 3679 O O   . HOH   M 4 .  ? 10.501  -12.682 52.658 1   32.14 ? 318 HOH   B O   1 
HETATM 3680 O O   . HOH   M 4 .  ? 28.920  11.370  26.134 1   35.62 ? 319 HOH   B O   1 
HETATM 3681 O O   . HOH   M 4 .  ? 14.976  -9.765  43.251 1   47.53 ? 320 HOH   B O   1 
HETATM 3682 O O   . HOH   M 4 .  ? 12.187  -2.377  58.298 1   42.52 ? 321 HOH   B O   1 
HETATM 3683 O O   . HOH   M 4 .  ? 18.969  2.918   27.887 1   33.49 ? 322 HOH   B O   1 
HETATM 3684 O O   . HOH   M 4 .  ? 17.636  3.156   22.762 1   29.8  ? 323 HOH   B O   1 
HETATM 3685 O O   . HOH   M 4 .  ? 17.233  12.34   39.757 1   51.74 ? 324 HOH   B O   1 
HETATM 3686 O O   . HOH   M 4 .  ? 3.305   5.563   47.641 1   48.46 ? 325 HOH   B O   1 
HETATM 3687 O O   . HOH   M 4 .  ? 23.617  -5.681  55.13  1   50.52 ? 326 HOH   B O   1 
HETATM 3688 O O   . HOH   M 4 .  ? -0.917  -3.518  37.72  1   34.95 ? 327 HOH   B O   1 
HETATM 3689 O O   . HOH   M 4 .  ? 24.261  9.973   41.701 1   36.03 ? 328 HOH   B O   1 
HETATM 3690 O O   . HOH   M 4 .  ? 11.236  10.413  38.547 1   41.82 ? 329 HOH   B O   1 
HETATM 3691 O O   . HOH   M 4 .  ? 27.829  -1.725  36.427 1   51.09 ? 330 HOH   B O   1 
HETATM 3692 O O   . HOH   M 4 .  ? 30.447  10.096  30.315 1   40.78 ? 331 HOH   B O   1 
HETATM 3693 O O   . HOH   M 4 .  ? -3.961  -6.971  54.353 1   37.51 ? 332 HOH   B O   1 
HETATM 3694 O O   . HOH   M 4 .  ? 21.861  -0.928  12.534 1   48.39 ? 333 HOH   B O   1 
HETATM 3695 O O   . HOH   M 4 .  ? -2.697  -1.006  43.754 1   39.98 ? 334 HOH   B O   1 
HETATM 3696 O O   . HOH   M 4 .  ? 2.097   -15.381 54.571 1   41.11 ? 335 HOH   B O   1 
HETATM 3697 O O   . HOH   M 4 .  ? 25.651  8.333   45.547 1   42.95 ? 336 HOH   B O   1 
HETATM 3698 O O   . HOH   M 4 .  ? 10.108  13.696  38.359 1   55.47 ? 337 HOH   B O   1 
HETATM 3699 O O   . HOH   M 4 .  ? 16.65   10.404  36.805 1   36.77 ? 338 HOH   B O   1 
HETATM 3700 O O   . HOH   M 4 .  ? 32.994  6.694   37.989 1   58.92 ? 339 HOH   B O   1 
HETATM 3701 O O   . HOH   M 4 .  ? 22.922  3.596   29.535 1   42.2  ? 340 HOH   B O   1 
HETATM 3702 O O   . HOH   M 4 .  ? 24.295  -7.977  35.926 1   52.14 ? 341 HOH   B O   1 
HETATM 3703 O O   . HOH   M 4 .  ? 18.989  11.544  35.737 1   32.43 ? 342 HOH   B O   1 
HETATM 3704 O O   . HOH   M 4 .  ? -0.232  1.764   49.554 1   54.34 ? 343 HOH   B O   1 
HETATM 3705 O O   . HOH   M 4 .  ? 15.85   0.873   57.256 1   39.85 ? 344 HOH   B O   1 
HETATM 3706 O O   . HOH   M 4 .  ? 7.769   -2.374  33.691 1   39.47 ? 345 HOH   B O   1 
HETATM 3707 O O   . HOH   M 4 .  ? -3.327  6.626   40.861 1   66.71 ? 346 HOH   B O   1 
HETATM 3708 O O   . HOH   M 4 .  ? 15.122  13.906  42.266 1   55.26 ? 347 HOH   B O   1 
HETATM 3709 O O   . HOH   M 4 .  ? 19.186  -5.057  54.123 1   41.02 ? 348 HOH   B O   1 
HETATM 3710 O O   . HOH   M 4 .  ? -5.453  -3.917  47.489 1   59.96 ? 349 HOH   B O   1 
HETATM 3711 O O   . HOH   M 4 .  ? 14.869  6.126   30.865 1   25.35 ? 350 HOH   B O   1 
HETATM 3712 O O   . HOH   M 4 .  ? 11.095  10.33   45.812 1   52.78 ? 351 HOH   B O   1 
HETATM 3713 O O   . HOH   M 4 .  ? 4.996   -14.546 52.93  1   50.39 ? 352 HOH   B O   1 
HETATM 3714 O O   . HOH   M 4 .  ? 13.372  -2.522  29.115 1   34.77 ? 353 HOH   B O   1 
HETATM 3715 O O   . HOH   M 4 .  ? 13.215  -12.451 55.329 1   45.59 ? 354 HOH   B O   1 
HETATM 3716 O O   . HOH   M 4 .  ? 22.786  13.278  50.715 1   53.83 ? 355 HOH   B O   1 
HETATM 3717 O O   . HOH   M 4 .  ? 4.325   7.83    37.808 1   46.95 ? 356 HOH   B O   1 
HETATM 3718 O O   . HOH   M 4 .  ? 20.189  3.336   22.295 1   32.74 ? 357 HOH   B O   1 
HETATM 3719 O O   . HOH   M 4 .  ? 5.768   5.311   61.926 1   65.32 ? 358 HOH   B O   1 
HETATM 3720 O O   . HOH   M 4 .  ? 14.457  -5.165  28.213 1   61.42 ? 359 HOH   B O   1 
HETATM 3721 O O   . HOH   M 4 .  ? -0.759  -13.939 50.326 1   47.68 ? 360 HOH   B O   1 
HETATM 3722 O O   . HOH   M 4 .  ? 8.218   -15.618 51.873 1   52.32 ? 361 HOH   B O   1 
HETATM 3723 O O   . HOH   M 4 .  ? 8.538   9.594   44.076 1   59.1  ? 362 HOH   B O   1 
HETATM 3724 O O   . HOH   M 4 .  ? 22.667  -1.698  23.863 1   49.37 ? 363 HOH   B O   1 
HETATM 3725 O O   . HOH   M 4 .  ? -5.375  -3.561  44.77  1   45.63 ? 364 HOH   B O   1 
HETATM 3726 O O   . HOH   M 4 .  ? 26.293  -2.816  53.382 1   49.76 ? 365 HOH   B O   1 
HETATM 3727 O O   . HOH   M 4 .  ? 26.91   8.6     26.162 1   37.58 ? 366 HOH   B O   1 
HETATM 3728 O O   . HOH   M 4 .  ? 26.958  -6.277  42.295 1   44.78 ? 367 HOH   B O   1 
HETATM 3729 O O   . HOH   M 4 .  ? 1.708   3.764   37.818 1   37.16 ? 368 HOH   B O   1 
HETATM 3730 O O   . HOH   M 4 .  ? 22.54   13.655  45.717 1   59.87 ? 369 HOH   B O   1 
HETATM 3731 O O   . HOH   M 4 .  ? -1.148  0.864   37.588 1   31.24 ? 370 HOH   B O   1 
HETATM 3732 O O   . HOH   M 4 .  ? 20.245  -4.96   31.604 1   49.46 ? 371 HOH   B O   1 
HETATM 3733 O O   . HOH   M 4 .  ? 13.471  11.296  47.864 1   54.9  ? 372 HOH   B O   1 
HETATM 3734 O O   . HOH   M 4 .  ? 15.647  -11.981 48.764 1   43.88 ? 373 HOH   B O   1 
HETATM 3735 O O   . HOH   M 4 .  ? 16.927  -5.777  29.071 1   67.06 ? 374 HOH   B O   1 
HETATM 3736 O O   . HOH   M 4 .  ? 18.887  -1.828  55.952 1   56.04 ? 375 HOH   B O   1 
HETATM 3737 O O   . HOH   M 4 .  ? 25.809  -6.929  52.989 1   71.14 ? 376 HOH   B O   1 
HETATM 3738 O O   . HOH   M 4 .  ? 28.457  7.46    43.006 1   68.69 ? 377 HOH   B O   1 
HETATM 3739 O O   . HOH   M 4 .  ? -0.025  9.202   44.239 1   61.22 ? 378 HOH   B O   1 
HETATM 3740 O O   . HOH   M 4 .  ? 14.629  4.253   58.799 1   50.7  ? 379 HOH   B O   1 
HETATM 3741 O O   . HOH   M 4 .  ? 4.919   9.351   35.58  1   51.68 ? 380 HOH   B O   1 
HETATM 3742 O O   . HOH   M 4 .  ? 1.851   2.363   56.845 1   58.71 ? 381 HOH   B O   1 
HETATM 3743 O O   . HOH   M 4 .  ? -0.958  3.551   38.228 1   41.14 ? 382 HOH   B O   1 
HETATM 3744 O O   . HOH   M 4 .  ? 4.455   9.178   39.998 1   48.31 ? 383 HOH   B O   1 
HETATM 3745 O O   . HOH   M 4 .  ? 18.524  -12.487 48.831 1   49.55 ? 384 HOH   B O   1 
HETATM 3746 O O   . HOH   M 4 .  ? 2.272   6.32    37.004 1   51.17 ? 385 HOH   B O   1 
HETATM 3747 O O   . HOH   M 4 .  ? -3.4    -8.805  40.375 1   52.07 ? 386 HOH   B O   1 
HETATM 3748 O O   . HOH   M 4 .  ? -0.841  -16.638 54.217 1   66.48 ? 387 HOH   B O   1 
HETATM 3749 O O   . HOH   M 4 .  ? 20.898  6.821   28.776 1   38.17 ? 388 HOH   B O   1 
HETATM 3750 O O   . HOH   M 4 .  ? 4.963   -16.488 49.578 1   48.26 ? 389 HOH   B O   1 
HETATM 3751 O O   . HOH   M 4 .  ? -0.244  3.611   47.622 1   64.24 ? 390 HOH   B O   1 
HETATM 3752 O O   . HOH   M 4 .  ? 13.148  12.083  37.456 1   49.22 ? 391 HOH   B O   1 
HETATM 3753 O O   . HOH   M 4 .  ? 14.686  -13.638 50.74  1   48.03 ? 392 HOH   B O   1 
HETATM 3754 O O   . HOH   M 4 .  ? 4.490   1.551   64.563 1   50    ? 393 HOH   B O   1 
HETATM 3755 O O   . HOH   M 4 .  ? 27.293  -2.922  33.767 1   54.4  ? 394 HOH   B O   1 
HETATM 3756 O O   . HOH   M 4 .  ? 14.236  -6.726  59.327 1   43.52 ? 395 HOH   B O   1 
HETATM 3757 O O   . HOH   M 4 .  ? 14.852  13.854  39.654 1   59.1  ? 396 HOH   B O   1 
HETATM 3758 O O   . HOH   M 4 .  ? 24.482  -5.644  32.878 1   58.25 ? 397 HOH   B O   1 
HETATM 3759 O O   . HOH   M 4 .  ? 1.044   9.599   40.53  1   48.06 ? 398 HOH   B O   1 
HETATM 3760 O O   . HOH   M 4 .  ? 12.545  14.967  38.007 1   57.92 ? 399 HOH   B O   1 
HETATM 3761 O O   . HOH   M 4 .  ? 25.904  11.168  39.927 1   51.94 ? 400 HOH   B O   1 
HETATM 3762 O O   . HOH   M 4 .  ? 17.345  2.685   59.067 1   61.49 ? 401 HOH   B O   1 
HETATM 3763 O O   . HOH   M 4 .  ? 26.607  -10.819 49.966 1   59.39 ? 402 HOH   B O   1 
HETATM 3764 O O   . HOH   M 4 .  ? 0.796   9.453   52.25  1   59.63 ? 403 HOH   B O   1 
HETATM 3765 O O   . HOH   N 4 .  ? 23.307  -26.011 9.539  1   52.92 ? 301 HOH   C O   1 
HETATM 3766 O O   . HOH   N 4 .  ? 30.224  -7.526  9.145  1   53.52 ? 302 HOH   C O   1 
HETATM 3767 O O   . HOH   N 4 .  ? 19.074  -11.113 33.461 1   42.65 ? 303 HOH   C O   1 
HETATM 3768 O O   . HOH   N 4 .  ? -0.728  -12.681 0.116  1   56.02 ? 304 HOH   C O   1 
HETATM 3769 O O   . HOH   N 4 .  ? 6.196   -20.799 9.959  1   43.51 ? 305 HOH   C O   1 
HETATM 3770 O O   . HOH   N 4 .  ? 18.891  -26.375 4.085  1   55.18 ? 306 HOH   C O   1 
HETATM 3771 O O   . HOH   N 4 .  ? 1.498   -15.653 16.845 1   34.02 ? 307 HOH   C O   1 
HETATM 3772 O O   . HOH   N 4 .  ? 15.134  -5.125  -0.719 1   32.33 ? 308 HOH   C O   1 
HETATM 3773 O O   . HOH   N 4 .  ? 7.339   -2.122  3.38   1   58.56 ? 309 HOH   C O   1 
HETATM 3774 O O   . HOH   N 4 .  ? -2.051  -16.272 9.63   1   48.57 ? 310 HOH   C O   1 
HETATM 3775 O O   . HOH   N 4 .  ? 4.726   -0.593  -0.545 1   60.55 ? 311 HOH   C O   1 
HETATM 3776 O O   . HOH   N 4 .  ? 22.004  -7.663  23.625 1   34.42 ? 312 HOH   C O   1 
HETATM 3777 O O   . HOH   N 4 .  ? 6.668   -2.944  5.89   1   30.05 ? 313 HOH   C O   1 
HETATM 3778 O O   . HOH   N 4 .  ? 26.678  -25.266 24.179 1   56.8  ? 314 HOH   C O   1 
HETATM 3779 O O   . HOH   N 4 .  ? 24.438  -21.689 10.284 1   28.99 ? 315 HOH   C O   1 
HETATM 3780 O O   . HOH   N 4 .  ? 30.541  -17.705 7.894  1   37.71 ? 316 HOH   C O   1 
HETATM 3781 O O   . HOH   N 4 .  ? 11.507  -2.833  3.87   1   55.13 ? 317 HOH   C O   1 
HETATM 3782 O O   . HOH   N 4 .  ? 30.201  -17.391 15.42  1   31.05 ? 318 HOH   C O   1 
HETATM 3783 O O   . HOH   N 4 .  ? 35.515  -5.291  10.111 1   61.3  ? 319 HOH   C O   1 
HETATM 3784 O O   . HOH   N 4 .  ? 19.618  -17.959 33.793 1   32.51 ? 320 HOH   C O   1 
HETATM 3785 O O   . HOH   N 4 .  ? 19.098  -25.652 9.66   1   52.02 ? 321 HOH   C O   1 
HETATM 3786 O O   . HOH   N 4 .  ? 27.267  -9.168  22.268 1   52.31 ? 322 HOH   C O   1 
HETATM 3787 O O   . HOH   N 4 .  ? 18.631  -14.307 -2.516 1   33.32 ? 323 HOH   C O   1 
HETATM 3788 O O   . HOH   N 4 .  ? 14.161  -2.13   3.451  1   55.54 ? 324 HOH   C O   1 
HETATM 3789 O O   . HOH   N 4 .  ? 19.36   -19.607 27.442 1   30.75 ? 325 HOH   C O   1 
HETATM 3790 O O   . HOH   N 4 .  ? 29.042  -22.322 16.166 1   42.71 ? 326 HOH   C O   1 
HETATM 3791 O O   . HOH   N 4 .  ? 35.073  -10.494 10.688 1   55.22 ? 327 HOH   C O   1 
HETATM 3792 O O   . HOH   N 4 .  ? 23.768  -3.162  11.2   1   48.92 ? 328 HOH   C O   1 
HETATM 3793 O O   . HOH   N 4 .  ? 9.727   -14.721 21.868 1   33.3  ? 329 HOH   C O   1 
HETATM 3794 O O   . HOH   N 4 .  ? 8.784   -8.197  -1.247 1   30.47 ? 330 HOH   C O   1 
HETATM 3795 O O   . HOH   N 4 .  ? 36.743  -14.852 19.649 1   61.2  ? 331 HOH   C O   1 
HETATM 3796 O O   . HOH   N 4 .  ? 8.928   -23.151 7.265  1   40.98 ? 332 HOH   C O   1 
HETATM 3797 O O   . HOH   N 4 .  ? 5.818   -9.113  -1.717 1   28.95 ? 333 HOH   C O   1 
HETATM 3798 O O   . HOH   N 4 .  ? 21.686  -13.02  44.322 1   52.9  ? 334 HOH   C O   1 
HETATM 3799 O O   . HOH   N 4 .  ? 36.625  -17.293 20.232 1   51.12 ? 335 HOH   C O   1 
HETATM 3800 O O   . HOH   N 4 .  ? 36.79   -14.503 16.979 1   60.76 ? 336 HOH   C O   1 
HETATM 3801 O O   . HOH   N 4 .  ? 1.111   -26.478 16.306 1   64.34 ? 337 HOH   C O   1 
HETATM 3802 O O   . HOH   N 4 .  ? 2.567   -22.092 16.436 1   44.27 ? 338 HOH   C O   1 
HETATM 3803 O O   . HOH   N 4 .  ? 13.073  -15.025 24.184 1   52.71 ? 339 HOH   C O   1 
HETATM 3804 O O   . HOH   N 4 .  ? 1.014   -18.231 10.63  1   46.92 ? 340 HOH   C O   1 
HETATM 3805 O O   . HOH   N 4 .  ? 22.416  -8.75   3.319  1   39.14 ? 341 HOH   C O   1 
HETATM 3806 O O   . HOH   N 4 .  ? 13.454  -17.127 -5.223 1   46.05 ? 342 HOH   C O   1 
HETATM 3807 O O   . HOH   N 4 .  ? 25.54   -10.157 38.299 1   49    ? 343 HOH   C O   1 
HETATM 3808 O O   . HOH   N 4 .  ? 25.376  -17.087 27.793 1   45.87 ? 344 HOH   C O   1 
HETATM 3809 O O   . HOH   N 4 .  ? 16.513  -2.148  0.914  1   53.93 ? 345 HOH   C O   1 
HETATM 3810 O O   . HOH   N 4 .  ? 23.422  -26.616 17.926 1   49.59 ? 346 HOH   C O   1 
HETATM 3811 O O   . HOH   N 4 .  ? 16.713  -26.222 17.747 1   39.66 ? 347 HOH   C O   1 
HETATM 3812 O O   . HOH   N 4 .  ? 4.843   -2.025  3.116  1   44.89 ? 348 HOH   C O   1 
HETATM 3813 O O   . HOH   N 4 .  ? 28.738  -11.859 5.056  1   39.85 ? 349 HOH   C O   1 
HETATM 3814 O O   . HOH   N 4 .  ? 7.215   0.443   0.069  1   66.62 ? 350 HOH   C O   1 
HETATM 3815 O O   . HOH   N 4 .  ? 14.365  -5.449  25.549 1   50.86 ? 351 HOH   C O   1 
HETATM 3816 O O   . HOH   N 4 .  ? 7.435   -23.599 3.96   1   55.8  ? 352 HOH   C O   1 
HETATM 3817 O O   . HOH   N 4 .  ? 21.792  -15.587 -0.444 1   34.21 ? 353 HOH   C O   1 
HETATM 3818 O O   . HOH   N 4 .  ? 23.143  -11.348 1.179  1   45.53 ? 354 HOH   C O   1 
HETATM 3819 O O   . HOH   N 4 .  ? 18.892  -25.632 1.501  1   61.25 ? 355 HOH   C O   1 
HETATM 3820 O O   . HOH   N 4 .  ? 24.074  -25.199 21.722 1   38.34 ? 356 HOH   C O   1 
HETATM 3821 O O   . HOH   N 4 .  ? 14.821  -25.577 10.819 1   53.04 ? 357 HOH   C O   1 
HETATM 3822 O O   . HOH   N 4 .  ? 14.007  -5.12   11.125 1   40.89 ? 358 HOH   C O   1 
HETATM 3823 O O   . HOH   N 4 .  ? 28.476  -15.161 -1.456 1   60.38 ? 359 HOH   C O   1 
HETATM 3824 O O   . HOH   N 4 .  ? 2.508   -26.658 14.056 1   60.82 ? 360 HOH   C O   1 
HETATM 3825 O O   . HOH   N 4 .  ? 14.276  -12.938 27.61  1   48.9  ? 361 HOH   C O   1 
HETATM 3826 O O   . HOH   N 4 .  ? 22.494  -17.469 34.435 1   44.58 ? 362 HOH   C O   1 
HETATM 3827 O O   . HOH   N 4 .  ? 1.885   -19.514 17.027 1   42.44 ? 363 HOH   C O   1 
HETATM 3828 O O   . HOH   N 4 .  ? 27.838  -5.629  15.712 1   59.62 ? 364 HOH   C O   1 
HETATM 3829 O O   . HOH   N 4 .  ? 4.61    -19.614 5.14   1   60.16 ? 365 HOH   C O   1 
HETATM 3830 O O   . HOH   N 4 .  ? 14.503  -10.329 28.367 1   71.9  ? 366 HOH   C O   1 
HETATM 3831 O O   . HOH   N 4 .  ? 29.11   -4.368  19.457 1   65.57 ? 367 HOH   C O   1 
HETATM 3832 O O   . HOH   N 4 .  ? 32.983  -11.405 19.392 1   43.36 ? 368 HOH   C O   1 
HETATM 3833 O O   . HOH   N 4 .  ? 15.987  -22.65  -1.065 1   56.98 ? 369 HOH   C O   1 
HETATM 3834 O O   . HOH   N 4 .  ? 16.457  -2.806  7.936  1   43.9  ? 370 HOH   C O   1 
HETATM 3835 O O   . HOH   N 4 .  ? 20.65   -8.806  25.631 1   52.85 ? 371 HOH   C O   1 
HETATM 3836 O O   . HOH   N 4 .  ? 30.455  -24.354 6.144  1   56.04 ? 372 HOH   C O   1 
HETATM 3837 O O   . HOH   N 4 .  ? 23.929  -20.163 28.909 1   57.38 ? 373 HOH   C O   1 
HETATM 3838 O O   . HOH   N 4 .  ? 3.26    -19.697 1.763  1   48.92 ? 374 HOH   C O   1 
HETATM 3839 O O   . HOH   N 4 .  ? 5.859   -22.341 7.077  1   51.7  ? 375 HOH   C O   1 
HETATM 3840 O O   . HOH   N 4 .  ? 15.614  -17.481 -9.082 1   41.07 ? 376 HOH   C O   1 
HETATM 3841 O O   . HOH   N 4 .  ? 15.454  -1.62   5.811  1   46.64 ? 377 HOH   C O   1 
HETATM 3842 O O   . HOH   N 4 .  ? 37.466  -10.816 13.904 1   43.47 ? 378 HOH   C O   1 
HETATM 3843 O O   . HOH   N 4 .  ? 30.773  -18.483 5.149  1   64.4  ? 379 HOH   C O   1 
HETATM 3844 O O   . HOH   N 4 .  ? 10.917  -13.669 25.13  1   67.7  ? 380 HOH   C O   1 
HETATM 3845 O O   . HOH   N 4 .  ? 8.304   -23.01  9.955  1   64.02 ? 381 HOH   C O   1 
HETATM 3846 O O   . HOH   N 4 .  ? 32.356  -18.784 9.667  1   39.44 ? 382 HOH   C O   1 
HETATM 3847 O O   . HOH   N 4 .  ? 12.087  -32.853 5.281  1   67.76 ? 383 HOH   C O   1 
HETATM 3848 O O   . HOH   N 4 .  ? 30.198  -33.642 7.221  1   65.92 ? 384 HOH   C O   1 
HETATM 3849 O O   . HOH   O 4 .  ? -0.995  -38     25.572 1   64.39 ? 301 HOH   D O   1 
HETATM 3850 O O   . HOH   O 4 .  ? 24.324  -29.035 43.607 1   44.59 ? 302 HOH   D O   1 
HETATM 3851 O O   . HOH   O 4 .  ? -1.201  -38.728 31.824 1   26.6  ? 303 HOH   D O   1 
HETATM 3852 O O   . HOH   O 4 .  ? -6.669  -18.247 14.178 1   50.35 ? 304 HOH   D O   1 
HETATM 3853 O O   . HOH   O 4 .  ? -6.449  -27.984 28.351 1   29.4  ? 305 HOH   D O   1 
HETATM 3854 O O   . HOH   O 4 .  ? 3.025   -27.667 20.732 1   41.68 ? 306 HOH   D O   1 
HETATM 3855 O O   . HOH   O 4 .  ? 14.132  -19.917 47.308 1   32.25 ? 307 HOH   D O   1 
HETATM 3856 O O   . HOH   O 4 .  ? 12.777  -32.612 44.856 1   29.83 ? 308 HOH   D O   1 
HETATM 3857 O O   . HOH   O 4 .  ? -2.917  -19.818 19.633 1   37.07 ? 309 HOH   D O   1 
HETATM 3858 O O   . HOH   O 4 .  ? 7.092   -31.831 47.121 1   53.46 ? 310 HOH   D O   1 
HETATM 3859 O O   . HOH   O 4 .  ? 3.475   -18.302 19.093 1   26.78 ? 311 HOH   D O   1 
HETATM 3860 O O   . HOH   O 4 .  ? 4.677   -42.133 34.942 1   41.27 ? 312 HOH   D O   1 
HETATM 3861 O O   . HOH   O 4 .  ? 6.514   -34.045 44.902 1   35.68 ? 313 HOH   D O   1 
HETATM 3862 O O   . HOH   O 4 .  ? 1.211   -33.191 40.915 1   41.84 ? 314 HOH   D O   1 
HETATM 3863 O O   . HOH   O 4 .  ? 6.702   -40.418 31.783 1   54.88 ? 315 HOH   D O   1 
HETATM 3864 O O   . HOH   O 4 .  ? 0.812   -32.93  29.387 1   27.66 ? 316 HOH   D O   1 
HETATM 3865 O O   . HOH   O 4 .  ? -5.856  -33.143 33.553 1   35.12 ? 317 HOH   D O   1 
HETATM 3866 O O   . HOH   O 4 .  ? -9.449  -23.56  23.683 1   54.41 ? 318 HOH   D O   1 
HETATM 3867 O O   . HOH   O 4 .  ? 4.777   -20.823 45.238 1   48.94 ? 319 HOH   D O   1 
HETATM 3868 O O   . HOH   O 4 .  ? -5.151  -17.323 35.296 1   57.99 ? 320 HOH   D O   1 
HETATM 3869 O O   . HOH   O 4 .  ? -2.403  -19.464 41.82  1   60.93 ? 321 HOH   D O   1 
HETATM 3870 O O   . HOH   O 4 .  ? 8.458   -28.848 21.493 1   43.1  ? 322 HOH   D O   1 
HETATM 3871 O O   . HOH   O 4 .  ? -1.306  -13.748 29.845 1   37.46 ? 323 HOH   D O   1 
HETATM 3872 O O   . HOH   O 4 .  ? -7.876  -25.785 40.373 1   46.23 ? 324 HOH   D O   1 
HETATM 3873 O O   . HOH   O 4 .  ? -8.718  -19.638 12.461 1   49.69 ? 325 HOH   D O   1 
HETATM 3874 O O   . HOH   O 4 .  ? -9.605  -31.133 34.447 1   48.63 ? 326 HOH   D O   1 
HETATM 3875 O O   . HOH   O 4 .  ? 17.358  -31.108 47.019 1   47.51 ? 327 HOH   D O   1 
HETATM 3876 O O   . HOH   O 4 .  ? -2.422  -9.045  20.286 1   56.21 ? 328 HOH   D O   1 
HETATM 3877 O O   . HOH   O 4 .  ? 0.977   -15.932 19.435 1   38.18 ? 329 HOH   D O   1 
HETATM 3878 O O   . HOH   O 4 .  ? -7.837  -26.119 18.222 1   38.43 ? 330 HOH   D O   1 
HETATM 3879 O O   . HOH   O 4 .  ? 22.636  -34.538 43.133 1   37.02 ? 331 HOH   D O   1 
HETATM 3880 O O   . HOH   O 4 .  ? 2.302   -12.626 16.082 1   31.89 ? 332 HOH   D O   1 
HETATM 3881 O O   . HOH   O 4 .  ? 5.266   -20.34  19.487 1   26.5  ? 333 HOH   D O   1 
HETATM 3882 O O   . HOH   O 4 .  ? -3.266  -29.18  44.804 1   54.1  ? 334 HOH   D O   1 
HETATM 3883 O O   . HOH   O 4 .  ? 12.552  -16.879 27.446 1   35.81 ? 335 HOH   D O   1 
HETATM 3884 O O   . HOH   O 4 .  ? 9.126   -16.092 25.018 1   55.17 ? 336 HOH   D O   1 
HETATM 3885 O O   . HOH   O 4 .  ? 8.527   -38.637 37.62  1   43.05 ? 337 HOH   D O   1 
HETATM 3886 O O   . HOH   O 4 .  ? -7.816  -19.71  36.826 1   42.89 ? 338 HOH   D O   1 
HETATM 3887 O O   . HOH   O 4 .  ? 6.759   -13.238 24.411 1   34.41 ? 339 HOH   D O   1 
HETATM 3888 O O   . HOH   O 4 .  ? -3.346  -10.23  16.586 1   38.02 ? 340 HOH   D O   1 
HETATM 3889 O O   . HOH   O 4 .  ? 3.361   -35.532 41.636 1   33.74 ? 341 HOH   D O   1 
HETATM 3890 O O   . HOH   O 4 .  ? 6.36    -20.597 48.664 1   55.71 ? 342 HOH   D O   1 
HETATM 3891 O O   . HOH   O 4 .  ? 0.647   -27.486 19.001 1   34.45 ? 343 HOH   D O   1 
HETATM 3892 O O   . HOH   O 4 .  ? -1.303  -16.863 41.793 1   46.74 ? 344 HOH   D O   1 
HETATM 3893 O O   . HOH   O 4 .  ? -8.63   -16.466 34.18  1   65.36 ? 345 HOH   D O   1 
HETATM 3894 O O   . HOH   O 4 .  ? 9.925   -31.079 19.734 1   53.95 ? 346 HOH   D O   1 
HETATM 3895 O O   . HOH   O 4 .  ? 10.524  -35.457 43.298 1   31.57 ? 347 HOH   D O   1 
HETATM 3896 O O   . HOH   O 4 .  ? -6.165  -31.817 28.471 1   34.88 ? 348 HOH   D O   1 
HETATM 3897 O O   . HOH   O 4 .  ? 25.226  -27.338 53.992 1   58.91 ? 349 HOH   D O   1 
HETATM 3898 O O   . HOH   O 4 .  ? -5.089  -30.625 39.808 1   43.78 ? 350 HOH   D O   1 
HETATM 3899 O O   . HOH   O 4 .  ? 22.913  -30.475 46.25  1   54.83 ? 351 HOH   D O   1 
HETATM 3900 O O   . HOH   O 4 .  ? -2.613  -20.51  15.799 1   52.49 ? 352 HOH   D O   1 
HETATM 3901 O O   . HOH   O 4 .  ? -4.983  -30.326 24.433 1   37.09 ? 353 HOH   D O   1 
HETATM 3902 O O   . HOH   O 4 .  ? 20.821  -19.262 31.265 1   41.48 ? 354 HOH   D O   1 
HETATM 3903 O O   . HOH   O 4 .  ? 9.929   -31.232 48.352 1   41.32 ? 355 HOH   D O   1 
HETATM 3904 O O   . HOH   O 4 .  ? 0.524   -28.408 43.704 1   41.12 ? 356 HOH   D O   1 
HETATM 3905 O O   . HOH   O 4 .  ? 16.433  -29.256 48.836 1   48.06 ? 357 HOH   D O   1 
HETATM 3906 O O   . HOH   O 4 .  ? -7.599  -17.952 29.093 1   52.79 ? 358 HOH   D O   1 
HETATM 3907 O O   . HOH   O 4 .  ? 0.578   -31.284 43.667 1   40.31 ? 359 HOH   D O   1 
HETATM 3908 O O   . HOH   O 4 .  ? 6.429   -35.316 27.903 1   46.52 ? 360 HOH   D O   1 
HETATM 3909 O O   . HOH   O 4 .  ? 18.354  -23.601 26.277 1   44.56 ? 361 HOH   D O   1 
HETATM 3910 O O   . HOH   O 4 .  ? 5.951   -39.884 39.036 1   56.31 ? 362 HOH   D O   1 
HETATM 3911 O O   . HOH   O 4 .  ? -0.365  -12.253 15.492 1   41.1  ? 363 HOH   D O   1 
HETATM 3912 O O   . HOH   O 4 .  ? 8.976   -36.719 47.335 1   49.64 ? 364 HOH   D O   1 
HETATM 3913 O O   . HOH   O 4 .  ? 20.199  -29.362 49.814 1   70.96 ? 365 HOH   D O   1 
HETATM 3914 O O   . HOH   O 4 .  ? 22.49   -27.43  55.748 1   58.82 ? 366 HOH   D O   1 
HETATM 3915 O O   . HOH   O 4 .  ? 19.975  -31.455 33.003 1   46.86 ? 367 HOH   D O   1 
HETATM 3916 O O   . HOH   O 4 .  ? 3.741   -35.682 26.179 1   54.63 ? 368 HOH   D O   1 
HETATM 3917 O O   . HOH   O 4 .  ? -2.855  -36.09  43.201 1   39.36 ? 369 HOH   D O   1 
HETATM 3918 O O   . HOH   O 4 .  ? 12.951  -35.362 44.751 1   47.71 ? 370 HOH   D O   1 
HETATM 3919 O O   . HOH   O 4 .  ? 0.684   -34.971 19.487 1   51.35 ? 371 HOH   D O   1 
HETATM 3920 O O   . HOH   O 4 .  ? -1.563  -23.24  15.378 1   51.68 ? 372 HOH   D O   1 
HETATM 3921 O O   . HOH   O 4 .  ? -11.161 -28.671 19.544 1   52.23 ? 373 HOH   D O   1 
HETATM 3922 O O   . HOH   O 4 .  ? 20.934  -33.764 46.141 1   52.4  ? 374 HOH   D O   1 
HETATM 3923 O O   . HOH   O 4 .  ? -1.067  -19.017 17.742 1   47.45 ? 375 HOH   D O   1 
HETATM 3924 O O   . HOH   O 4 .  ? 8.993   -34.743 45.192 1   40.44 ? 376 HOH   D O   1 
HETATM 3925 O O   . HOH   O 4 .  ? -5.52   -19.584 43.505 1   79.49 ? 377 HOH   D O   1 
HETATM 3926 O O   . HOH   O 4 .  ? -10.124 -25.290 15.492 1   44.9  ? 378 HOH   D O   1 
HETATM 3927 O O   . HOH   O 4 .  ? -8.539  -29.595 27.532 1   45.29 ? 379 HOH   D O   1 
HETATM 3928 O O   . HOH   O 4 .  ? 10.555  -33.2   46.693 1   39.19 ? 380 HOH   D O   1 
HETATM 3929 O O   . HOH   O 4 .  ? -6.356  -24.215 8.868  1   53.3  ? 381 HOH   D O   1 
HETATM 3930 O O   . HOH   O 4 .  ? 5.693   -44.733 42.582 1   49.91 ? 382 HOH   D O   1 
HETATM 3931 O O   . HOH   O 4 .  ? 20.459  -30.048 55.973 1   51.48 ? 383 HOH   D O   1 
HETATM 3932 O O   . HOH   O 4 .  ? 20.833  -24.021 26.417 1   53.02 ? 384 HOH   D O   1 
HETATM 3933 O O   . HOH   O 4 .  ? 5.916   -32.597 50.68  1   60.58 ? 385 HOH   D O   1 
HETATM 3934 O O   . HOH   P 4 .  ? 10.696  -6.219  20.3   1   29.21 ? 101 HOH   J O   1 
HETATM 3935 O O   . HOH   P 4 .  ? -0.917  -9.784  7.813  1   36.39 ? 102 HOH   J O   1 
HETATM 3936 O O   . HOH   P 4 .  ? 11.009  -10.909 23.483 1   37.79 ? 103 HOH   J O   1 
HETATM 3937 O O   . HOH   P 4 .  ? 4.739   1.039   12.069 1   37.76 ? 104 HOH   J O   1 
HETATM 3938 O O   . HOH   P 4 .  ? 0.512   -7.476  6.521  1   31.14 ? 105 HOH   J O   1 
HETATM 3939 O O   . HOH   P 4 .  ? 4.901   -12.375 15.101 1   25.08 ? 106 HOH   J O   1 
HETATM 3940 O O   . HOH   P 4 .  ? 7.626   -13.009 21.824 1   25.65 ? 107 HOH   J O   1 
HETATM 3941 O O   . HOH   P 4 .  ? 6.324   -0.481  10.418 1   29.97 ? 108 HOH   J O   1 
HETATM 3942 O O   . HOH   P 4 .  ? 7.995   -8.368  22.081 1   42.75 ? 109 HOH   J O   1 
HETATM 3943 O O   . HOH   P 4 .  ? 8.263   -3.398  8.024  1   25.23 ? 110 HOH   J O   1 
HETATM 3944 O O   . HOH   P 4 .  ? 13.818  -8.125  25.931 1   65.6  ? 111 HOH   J O   1 
HETATM 3945 O O   . HOH   P 4 .  ? 1.266   -3.25   6.279  1   58.97 ? 112 HOH   J O   1 
HETATM 3946 O O   . HOH   P 4 .  ? 8.284   -11.105 23.736 1   51.72 ? 113 HOH   J O   1 
HETATM 3947 O O   . HOH   P 4 .  ? 8.663   -0.536  8.996  1   29.38 ? 114 HOH   J O   1 
HETATM 3948 O O   . HOH   Q 4 .  ? 14.042  -15.463 29.206 1   26    ? 101 HOH   F O   1 
HETATM 3949 O O   . HOH   Q 4 .  ? 10.051  -12.582 34.648 1   29.56 ? 102 HOH   F O   1 
HETATM 3950 O O   . HOH   Q 4 .  ? 13.792  -14.889 45.794 1   33.31 ? 103 HOH   F O   1 
HETATM 3951 O O   . HOH   Q 4 .  ? 21.157  -21.312 44.269 1   40.05 ? 104 HOH   F O   1 
HETATM 3952 O O   . HOH   Q 4 .  ? 14.535  -12.182 45.849 1   42.6  ? 105 HOH   F O   1 
HETATM 3953 O O   . HOH   Q 4 .  ? 22.437  -21.692 42.109 1   56.2  ? 106 HOH   F O   1 
HETATM 3954 O O   . HOH   Q 4 .  ? 17.268  -19.144 34.302 1   28.92 ? 107 HOH   F O   1 
HETATM 3955 O O   . HOH   Q 4 .  ? 12.909  -12.736 31.778 1   40.59 ? 108 HOH   F O   1 
HETATM 3956 O O   . HOH   Q 4 .  ? 12.616  -18.961 45.4   1   26.29 ? 109 HOH   F O   1 
HETATM 3957 O O   . HOH   Q 4 .  ? 17.883  -14.284 46.764 1   48.09 ? 110 HOH   F O   1 
HETATM 3958 O O   . HOH   Q 4 .  ? 9.897   -9.884  31.867 1   56.02 ? 111 HOH   F O   1 
HETATM 3959 O O   . HOH   Q 4 .  ? 23.374  -19.979 46.431 1   63.52 ? 112 HOH   F O   1 
HETATM 3960 O O   . HOH   Q 4 .  ? 11.566  -16.647 46.454 1   33.14 ? 113 HOH   F O   1 
HETATM 3961 O O   . HOH   Q 4 .  ? 23.589  -17.507 36.782 1   47.93 ? 114 HOH   F O   1 
HETATM 3962 O O   . HOH   R 4 .  ? 10.675  -10.213 35.597 1   32.12 ? 101 HOH   G O   1 
HETATM 3963 O O   . HOH   R 4 .  ? 6.822   -16.882 45.238 1   31.8  ? 102 HOH   G O   1 
HETATM 3964 O O   . HOH   R 4 .  ? -2.727  -9.549  46.521 1   42.54 ? 103 HOH   G O   1 
HETATM 3965 O O   . HOH   R 4 .  ? 3.055   -5.913  39.973 1   27.38 ? 104 HOH   G O   1 
HETATM 3966 O O   . HOH   R 4 .  ? 5.801   -18.765 43.549 1   35.28 ? 105 HOH   G O   1 
HETATM 3967 O O   . HOH   R 4 .  ? -0.912  -11.7   48.155 1   27.99 ? 106 HOH   G O   1 
HETATM 3968 O O   . HOH   R 4 .  ? 6.226   -4.419  33.659 1   24.48 ? 107 HOH   G O   1 
HETATM 3969 O O   . HOH   R 4 .  ? 2.384   -17.892 45.163 1   41.58 ? 108 HOH   G O   1 
HETATM 3970 O O   . HOH   R 4 .  ? 7.835   -13.519 47.537 1   23.4  ? 109 HOH   G O   1 
HETATM 3971 O O   . HOH   R 4 .  ? 7.222   -8.261  33.58  1   57.25 ? 110 HOH   G O   1 
HETATM 3972 O O   . HOH   R 4 .  ? -3.142  -12.171 45.834 1   46.56 ? 111 HOH   G O   1 
HETATM 3973 O O   . HOH   R 4 .  ? -1.94   -17.567 44.381 1   62.24 ? 112 HOH   G O   1 
HETATM 3974 O O   . HOH   R 4 .  ? 5.663   -17.967 47.444 1   52.84 ? 113 HOH   G O   1 
HETATM 3975 O O   . HOH   R 4 .  ? 8.895   -16.045 46.804 1   31.76 ? 114 HOH   G O   1 
HETATM 3976 O O   . HOH   R 4 .  ? 7.622   -5.927  31.905 1   49.2  ? 115 HOH   G O   1 
HETATM 3977 O O   . HOH   S 4 .  ? 19.29   6.65    12.553 1   24.16 ? 101 HOH   H O   1 
HETATM 3978 O O   . HOH   S 4 .  ? 12.447  -0.541  27.144 1   23.1  ? 102 HOH   H O   1 
HETATM 3979 O O   . HOH   S 4 .  ? 9.273   -4.07   21.147 1   28.75 ? 103 HOH   H O   1 
HETATM 3980 O O   . HOH   S 4 .  ? 11.817  -3.419  24.104 1   47.71 ? 104 HOH   H O   1 
HETATM 3981 O O   . HOH   S 4 .  ? 20.779  7.363   15.038 1   39.27 ? 105 HOH   H O   1 
HETATM 3982 O O   . HOH   S 4 .  ? 13.443  -0.859  10.245 1   29.74 ? 106 HOH   H O   1 
HETATM 3983 O O   . HOH   S 4 .  ? 15.076  -3.082  10.218 1   35.55 ? 107 HOH   H O   1 
HETATM 3984 O O   . HOH   S 4 .  ? 15.001  3.826   22.18  1   25.72 ? 108 HOH   H O   1 
HETATM 3985 O O   . HOH   S 4 .  ? 17.979  -0.137  10.056 1   37.28 ? 109 HOH   H O   1 
HETATM 3986 O O   . HOH   S 4 .  ? 21.864  5.043   13.406 1   46.52 ? 110 HOH   H O   1 
HETATM 3987 O O   . HOH   S 4 .  ? 11.382  2.93    10.893 1   21.49 ? 111 HOH   H O   1 
HETATM 3988 O O   . HOH   S 4 .  ? 15.741  -5.107  13.283 1   25.03 ? 112 HOH   H O   1 
HETATM 3989 O O   . HOH   S 4 .  ? 23.479  2.445   11.006 1   68.79 ? 113 HOH   H O   1 
HETATM 3990 O O   . HOH   S 4 .  ? 11.202  0.42    9.64   1   32.78 ? 114 HOH   H O   1 
HETATM 3991 O O   . HOH   S 4 .  ? 14.605  0.298   7.584  1   43.92 ? 115 HOH   H O   1 
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