data_9EPE
# 
_entry.id   9EPE 
# 
_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   9EPE         pdb_00009epe 10.2210/pdb9epe/pdb 
WWPDB D_1292137358 ?            ?                   
# 
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 2025-04-23 ? 
3 'Structure model' 1 2 2025-05-14 ? 
# 
_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             ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Database references' 
2 3 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
3 3 'Structure model' citation        
4 3 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1  2 'Structure model' '_citation.country'                 
2  2 'Structure model' '_citation.journal_abbrev'          
3  2 'Structure model' '_citation.journal_id_CSD'          
4  2 'Structure model' '_citation.journal_id_ISSN'         
5  2 'Structure model' '_citation.pdbx_database_id_DOI'    
6  2 'Structure model' '_citation.pdbx_database_id_PubMed' 
7  2 'Structure model' '_citation.title'                   
8  2 'Structure model' '_citation.year'                    
9  2 'Structure model' '_citation_author.identifier_ORCID' 
10 2 'Structure model' '_citation_author.name'             
11 3 'Structure model' '_citation.journal_volume'          
12 3 'Structure model' '_citation.page_first'              
13 3 'Structure model' '_citation.page_last'               
14 3 'Structure model' '_citation_author.identifier_ORCID' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9EPE 
_pdbx_database_status.recvd_initial_deposition_date   2024-03-18 
_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           Y 
# 
loop_
_pdbx_contact_author.id 
_pdbx_contact_author.email 
_pdbx_contact_author.name_first 
_pdbx_contact_author.name_last 
_pdbx_contact_author.name_mi 
_pdbx_contact_author.role 
_pdbx_contact_author.identifier_ORCID 
5 robin.owen@diamond.ac.uk    Robin   Owen  ? 'principal investigator/group leader' 0000-0002-2104-7057 
6 Michael.Hough@diamond.ac.uk Michael Hough ? 'principal investigator/group leader' 0000-0001-7377-6713 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Owen, R.L.'   1 ? 
'Hough, M.A.'  2 ? 
'Worrall, J.'  3 ? 
'Williams, L.' 4 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Iucrj 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2052-2525 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            12 
_citation.language                  ? 
_citation.page_first                358 
_citation.page_last                 371 
_citation.title                     
'Damage before destruction? X-ray-induced changes in single-pulse serial femtosecond crystallography.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1107/S2052252525002660 
_citation.pdbx_database_id_PubMed   40227256 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Williams, L.J.'     1  ? 
primary 'Thompson, A.J.'     2  ? 
primary 'Dijkstal, P.'       3  ? 
primary 'Appleby, M.'        4  ? 
primary 'Assmann, G.'        5  ? 
primary 'Dworkowski, F.S.N.' 6  ? 
primary 'Hiller, N.'         7  ? 
primary 'Huang, C.Y.'        8  ? 
primary 'Mason, T.'          9  ? 
primary 'Perrett, S.'        10 ? 
primary 'Prat, E.'           11 ? 
primary 'Voulot, D.'         12 ? 
primary 'Pedrini, B.'        13 ? 
primary 'Beale, J.H.'        14 ? 
primary 'Hough, M.A.'        15 ? 
primary 'Worrall, J.A.R.'    16 ? 
primary 'Owen, R.L.'         17 ? 
# 
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     nat Thaumatin-1          22227.059 1   ? ? ? ? 
2 non-polymer syn 'L(+)-TARTARIC ACID' 150.087   1   ? ? ? ? 
3 water       nat water                18.015    184 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;ATFEIVNRCSYTVWAAASKGDAALDAGGRQLNSGESWTINVEPGTNGGKIWARTDCYFDDSGSGICKTGDCGGLLRCKRF
GRPPTTLAEFSLNQYGKDYIDISNIKGFNVPMNFSPTTRGCRGVRCAADIVGQCPAKLKAPGGGCNDACTVFQTSEYCCT
TGKCGPTEYSRFFKRLCPDAFSYVLDKPTTVTCPGSSNYRVTFCPTA
;
_entity_poly.pdbx_seq_one_letter_code_can   
;ATFEIVNRCSYTVWAAASKGDAALDAGGRQLNSGESWTINVEPGTNGGKIWARTDCYFDDSGSGICKTGDCGGLLRCKRF
GRPPTTLAEFSLNQYGKDYIDISNIKGFNVPMNFSPTTRGCRGVRCAADIVGQCPAKLKAPGGGCNDACTVFQTSEYCCT
TGKCGPTEYSRFFKRLCPDAFSYVLDKPTTVTCPGSSNYRVTFCPTA
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'L(+)-TARTARIC ACID' TLA 
3 water                HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ALA n 
1 2   THR n 
1 3   PHE n 
1 4   GLU n 
1 5   ILE n 
1 6   VAL n 
1 7   ASN n 
1 8   ARG n 
1 9   CYS n 
1 10  SER n 
1 11  TYR n 
1 12  THR n 
1 13  VAL n 
1 14  TRP n 
1 15  ALA n 
1 16  ALA n 
1 17  ALA n 
1 18  SER n 
1 19  LYS n 
1 20  GLY n 
1 21  ASP n 
1 22  ALA n 
1 23  ALA n 
1 24  LEU n 
1 25  ASP n 
1 26  ALA n 
1 27  GLY n 
1 28  GLY n 
1 29  ARG n 
1 30  GLN n 
1 31  LEU n 
1 32  ASN n 
1 33  SER n 
1 34  GLY n 
1 35  GLU n 
1 36  SER n 
1 37  TRP n 
1 38  THR n 
1 39  ILE n 
1 40  ASN n 
1 41  VAL n 
1 42  GLU n 
1 43  PRO n 
1 44  GLY n 
1 45  THR n 
1 46  ASN n 
1 47  GLY n 
1 48  GLY n 
1 49  LYS n 
1 50  ILE n 
1 51  TRP n 
1 52  ALA n 
1 53  ARG n 
1 54  THR n 
1 55  ASP n 
1 56  CYS n 
1 57  TYR n 
1 58  PHE n 
1 59  ASP n 
1 60  ASP n 
1 61  SER n 
1 62  GLY n 
1 63  SER n 
1 64  GLY n 
1 65  ILE n 
1 66  CYS n 
1 67  LYS n 
1 68  THR n 
1 69  GLY n 
1 70  ASP n 
1 71  CYS n 
1 72  GLY n 
1 73  GLY n 
1 74  LEU n 
1 75  LEU n 
1 76  ARG n 
1 77  CYS n 
1 78  LYS n 
1 79  ARG n 
1 80  PHE n 
1 81  GLY n 
1 82  ARG n 
1 83  PRO n 
1 84  PRO n 
1 85  THR n 
1 86  THR n 
1 87  LEU n 
1 88  ALA n 
1 89  GLU n 
1 90  PHE n 
1 91  SER n 
1 92  LEU n 
1 93  ASN n 
1 94  GLN n 
1 95  TYR n 
1 96  GLY n 
1 97  LYS n 
1 98  ASP n 
1 99  TYR n 
1 100 ILE n 
1 101 ASP n 
1 102 ILE n 
1 103 SER n 
1 104 ASN n 
1 105 ILE n 
1 106 LYS n 
1 107 GLY n 
1 108 PHE n 
1 109 ASN n 
1 110 VAL n 
1 111 PRO n 
1 112 MET n 
1 113 ASN n 
1 114 PHE n 
1 115 SER n 
1 116 PRO n 
1 117 THR n 
1 118 THR n 
1 119 ARG n 
1 120 GLY n 
1 121 CYS n 
1 122 ARG n 
1 123 GLY n 
1 124 VAL n 
1 125 ARG n 
1 126 CYS n 
1 127 ALA n 
1 128 ALA n 
1 129 ASP n 
1 130 ILE n 
1 131 VAL n 
1 132 GLY n 
1 133 GLN n 
1 134 CYS n 
1 135 PRO n 
1 136 ALA n 
1 137 LYS n 
1 138 LEU n 
1 139 LYS n 
1 140 ALA n 
1 141 PRO n 
1 142 GLY n 
1 143 GLY n 
1 144 GLY n 
1 145 CYS n 
1 146 ASN n 
1 147 ASP n 
1 148 ALA n 
1 149 CYS n 
1 150 THR n 
1 151 VAL n 
1 152 PHE n 
1 153 GLN n 
1 154 THR n 
1 155 SER n 
1 156 GLU n 
1 157 TYR n 
1 158 CYS n 
1 159 CYS n 
1 160 THR n 
1 161 THR n 
1 162 GLY n 
1 163 LYS n 
1 164 CYS n 
1 165 GLY n 
1 166 PRO n 
1 167 THR n 
1 168 GLU n 
1 169 TYR n 
1 170 SER n 
1 171 ARG n 
1 172 PHE n 
1 173 PHE n 
1 174 LYS n 
1 175 ARG n 
1 176 LEU n 
1 177 CYS n 
1 178 PRO n 
1 179 ASP n 
1 180 ALA n 
1 181 PHE n 
1 182 SER n 
1 183 TYR n 
1 184 VAL n 
1 185 LEU n 
1 186 ASP n 
1 187 LYS n 
1 188 PRO n 
1 189 THR n 
1 190 THR n 
1 191 VAL n 
1 192 THR n 
1 193 CYS n 
1 194 PRO n 
1 195 GLY n 
1 196 SER n 
1 197 SER n 
1 198 ASN n 
1 199 TYR n 
1 200 ARG n 
1 201 VAL n 
1 202 THR n 
1 203 PHE n 
1 204 CYS n 
1 205 PRO n 
1 206 THR n 
1 207 ALA n 
# 
_entity_src_nat.entity_id                  1 
_entity_src_nat.pdbx_src_id                1 
_entity_src_nat.pdbx_alt_source_flag       sample 
_entity_src_nat.pdbx_beg_seq_num           1 
_entity_src_nat.pdbx_end_seq_num           207 
_entity_src_nat.common_name                ? 
_entity_src_nat.pdbx_organism_scientific   'Thaumatococcus daniellii' 
_entity_src_nat.pdbx_ncbi_taxonomy_id      4621 
_entity_src_nat.genus                      ? 
_entity_src_nat.species                    ? 
_entity_src_nat.strain                     ? 
_entity_src_nat.tissue                     ? 
_entity_src_nat.tissue_fraction            ? 
_entity_src_nat.pdbx_secretion             ? 
_entity_src_nat.pdbx_fragment              ? 
_entity_src_nat.pdbx_variant               ? 
_entity_src_nat.pdbx_cell_line             ? 
_entity_src_nat.pdbx_atcc                  ? 
_entity_src_nat.pdbx_cellular_location     ? 
_entity_src_nat.pdbx_organ                 ? 
_entity_src_nat.pdbx_organelle             ? 
_entity_src_nat.pdbx_cell                  ? 
_entity_src_nat.pdbx_plasmid_name          ? 
_entity_src_nat.pdbx_plasmid_details       ? 
_entity_src_nat.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 
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  
HOH non-polymer         . WATER                ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE           ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE              ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE               ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE           ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE        ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE              ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE               ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE            ? 'C4 H9 N O3'     119.119 
TLA non-polymer         . 'L(+)-TARTARIC ACID' ? 'C4 H6 O6'       150.087 
TRP 'L-peptide linking' y TRYPTOPHAN           ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE             ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE               ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   ALA 1   1   1   ALA ALA A . n 
A 1 2   THR 2   2   2   THR THR A . n 
A 1 3   PHE 3   3   3   PHE PHE A . n 
A 1 4   GLU 4   4   4   GLU GLU A . n 
A 1 5   ILE 5   5   5   ILE ILE A . n 
A 1 6   VAL 6   6   6   VAL VAL A . n 
A 1 7   ASN 7   7   7   ASN ASN A . n 
A 1 8   ARG 8   8   8   ARG ARG A . n 
A 1 9   CYS 9   9   9   CYS CYS A . n 
A 1 10  SER 10  10  10  SER SER A . n 
A 1 11  TYR 11  11  11  TYR TYR A . n 
A 1 12  THR 12  12  12  THR THR A . n 
A 1 13  VAL 13  13  13  VAL VAL A . n 
A 1 14  TRP 14  14  14  TRP TRP A . n 
A 1 15  ALA 15  15  15  ALA ALA A . n 
A 1 16  ALA 16  16  16  ALA ALA A . n 
A 1 17  ALA 17  17  17  ALA ALA A . n 
A 1 18  SER 18  18  18  SER SER A . n 
A 1 19  LYS 19  19  19  LYS LYS A . n 
A 1 20  GLY 20  20  20  GLY GLY A . n 
A 1 21  ASP 21  21  21  ASP ASP A . n 
A 1 22  ALA 22  22  22  ALA ALA A . n 
A 1 23  ALA 23  23  23  ALA ALA A . n 
A 1 24  LEU 24  24  24  LEU LEU A . n 
A 1 25  ASP 25  25  25  ASP ASP A . n 
A 1 26  ALA 26  26  26  ALA ALA A . n 
A 1 27  GLY 27  27  27  GLY GLY A . n 
A 1 28  GLY 28  28  28  GLY GLY A . n 
A 1 29  ARG 29  29  29  ARG ARG A . n 
A 1 30  GLN 30  30  30  GLN GLN A . n 
A 1 31  LEU 31  31  31  LEU LEU A . n 
A 1 32  ASN 32  32  32  ASN ASN A . n 
A 1 33  SER 33  33  33  SER SER A . n 
A 1 34  GLY 34  34  34  GLY GLY A . n 
A 1 35  GLU 35  35  35  GLU GLU A . n 
A 1 36  SER 36  36  36  SER SER A . n 
A 1 37  TRP 37  37  37  TRP TRP A . n 
A 1 38  THR 38  38  38  THR THR A . n 
A 1 39  ILE 39  39  39  ILE ILE A . n 
A 1 40  ASN 40  40  40  ASN ASN A . n 
A 1 41  VAL 41  41  41  VAL VAL A . n 
A 1 42  GLU 42  42  42  GLU GLU A . n 
A 1 43  PRO 43  43  43  PRO PRO A . n 
A 1 44  GLY 44  44  44  GLY GLY A . n 
A 1 45  THR 45  45  45  THR THR A . n 
A 1 46  ASN 46  46  46  ASN ASN A . n 
A 1 47  GLY 47  47  47  GLY GLY A . n 
A 1 48  GLY 48  48  48  GLY GLY A . n 
A 1 49  LYS 49  49  49  LYS LYS A . n 
A 1 50  ILE 50  50  50  ILE ILE A . n 
A 1 51  TRP 51  51  51  TRP TRP A . n 
A 1 52  ALA 52  52  52  ALA ALA A . n 
A 1 53  ARG 53  53  53  ARG ARG A . n 
A 1 54  THR 54  54  54  THR THR A . n 
A 1 55  ASP 55  55  55  ASP ASP A . n 
A 1 56  CYS 56  56  56  CYS CYS A . n 
A 1 57  TYR 57  57  57  TYR TYR A . n 
A 1 58  PHE 58  58  58  PHE PHE A . n 
A 1 59  ASP 59  59  59  ASP ASP A . n 
A 1 60  ASP 60  60  60  ASP ASP A . n 
A 1 61  SER 61  61  61  SER SER A . n 
A 1 62  GLY 62  62  62  GLY GLY A . n 
A 1 63  SER 63  63  63  SER SER A . n 
A 1 64  GLY 64  64  64  GLY GLY A . n 
A 1 65  ILE 65  65  65  ILE ILE A . n 
A 1 66  CYS 66  66  66  CYS CYS A . n 
A 1 67  LYS 67  67  67  LYS LYS A . n 
A 1 68  THR 68  68  68  THR THR A . n 
A 1 69  GLY 69  69  69  GLY GLY A . n 
A 1 70  ASP 70  70  70  ASP ASP A . n 
A 1 71  CYS 71  71  71  CYS CYS A . n 
A 1 72  GLY 72  72  72  GLY GLY A . n 
A 1 73  GLY 73  73  73  GLY GLY A . n 
A 1 74  LEU 74  74  74  LEU LEU A . n 
A 1 75  LEU 75  75  75  LEU LEU A . n 
A 1 76  ARG 76  76  76  ARG ARG A . n 
A 1 77  CYS 77  77  77  CYS CYS A . n 
A 1 78  LYS 78  78  78  LYS LYS A . n 
A 1 79  ARG 79  79  79  ARG ARG A . n 
A 1 80  PHE 80  80  80  PHE PHE A . n 
A 1 81  GLY 81  81  81  GLY GLY A . n 
A 1 82  ARG 82  82  82  ARG ARG A . n 
A 1 83  PRO 83  83  83  PRO PRO A . n 
A 1 84  PRO 84  84  84  PRO PRO A . n 
A 1 85  THR 85  85  85  THR THR A . n 
A 1 86  THR 86  86  86  THR THR A . n 
A 1 87  LEU 87  87  87  LEU LEU A . n 
A 1 88  ALA 88  88  88  ALA ALA A . n 
A 1 89  GLU 89  89  89  GLU GLU A . n 
A 1 90  PHE 90  90  90  PHE PHE A . n 
A 1 91  SER 91  91  91  SER SER A . n 
A 1 92  LEU 92  92  92  LEU LEU A . n 
A 1 93  ASN 93  93  93  ASN ASN A . n 
A 1 94  GLN 94  94  94  GLN GLN A . n 
A 1 95  TYR 95  95  95  TYR TYR A . n 
A 1 96  GLY 96  96  96  GLY GLY A . n 
A 1 97  LYS 97  97  97  LYS LYS A . n 
A 1 98  ASP 98  98  98  ASP ASP A . n 
A 1 99  TYR 99  99  99  TYR TYR A . n 
A 1 100 ILE 100 100 100 ILE ILE A . n 
A 1 101 ASP 101 101 101 ASP ASP A . n 
A 1 102 ILE 102 102 102 ILE ILE A . n 
A 1 103 SER 103 103 103 SER SER A . n 
A 1 104 ASN 104 104 104 ASN ASN A . n 
A 1 105 ILE 105 105 105 ILE ILE A . n 
A 1 106 LYS 106 106 106 LYS LYS A . n 
A 1 107 GLY 107 107 107 GLY GLY A . n 
A 1 108 PHE 108 108 108 PHE PHE A . n 
A 1 109 ASN 109 109 109 ASN ASN A . n 
A 1 110 VAL 110 110 110 VAL VAL A . n 
A 1 111 PRO 111 111 111 PRO PRO A . n 
A 1 112 MET 112 112 112 MET MET A . n 
A 1 113 ASN 113 113 113 ASN ASN A . n 
A 1 114 PHE 114 114 114 PHE PHE A . n 
A 1 115 SER 115 115 115 SER SER A . n 
A 1 116 PRO 116 116 116 PRO PRO A . n 
A 1 117 THR 117 117 117 THR THR A . n 
A 1 118 THR 118 118 118 THR THR A . n 
A 1 119 ARG 119 119 119 ARG ARG A . n 
A 1 120 GLY 120 120 120 GLY GLY A . n 
A 1 121 CYS 121 121 121 CYS CYS A . n 
A 1 122 ARG 122 122 122 ARG ARG A . n 
A 1 123 GLY 123 123 123 GLY GLY A . n 
A 1 124 VAL 124 124 124 VAL VAL A . n 
A 1 125 ARG 125 125 125 ARG ARG A . n 
A 1 126 CYS 126 126 126 CYS CYS A . n 
A 1 127 ALA 127 127 127 ALA ALA A . n 
A 1 128 ALA 128 128 128 ALA ALA A . n 
A 1 129 ASP 129 129 129 ASP ASP A . n 
A 1 130 ILE 130 130 130 ILE ILE A . n 
A 1 131 VAL 131 131 131 VAL VAL A . n 
A 1 132 GLY 132 132 132 GLY GLY A . n 
A 1 133 GLN 133 133 133 GLN GLN A . n 
A 1 134 CYS 134 134 134 CYS CYS A . n 
A 1 135 PRO 135 135 135 PRO PRO A . n 
A 1 136 ALA 136 136 136 ALA ALA A . n 
A 1 137 LYS 137 137 137 LYS LYS A . n 
A 1 138 LEU 138 138 138 LEU LEU A . n 
A 1 139 LYS 139 139 139 LYS LYS A . n 
A 1 140 ALA 140 140 140 ALA ALA A . n 
A 1 141 PRO 141 141 141 PRO PRO A . n 
A 1 142 GLY 142 142 142 GLY GLY A . n 
A 1 143 GLY 143 143 143 GLY GLY A . n 
A 1 144 GLY 144 144 144 GLY GLY A . n 
A 1 145 CYS 145 145 145 CYS CYS A . n 
A 1 146 ASN 146 146 146 ASN ASN A . n 
A 1 147 ASP 147 147 147 ASP ASP A . n 
A 1 148 ALA 148 148 148 ALA ALA A . n 
A 1 149 CYS 149 149 149 CYS CYS A . n 
A 1 150 THR 150 150 150 THR THR A . n 
A 1 151 VAL 151 151 151 VAL VAL A . n 
A 1 152 PHE 152 152 152 PHE PHE A . n 
A 1 153 GLN 153 153 153 GLN GLN A . n 
A 1 154 THR 154 154 154 THR THR A . n 
A 1 155 SER 155 155 155 SER SER A . n 
A 1 156 GLU 156 156 156 GLU GLU A . n 
A 1 157 TYR 157 157 157 TYR TYR A . n 
A 1 158 CYS 158 158 158 CYS CYS A . n 
A 1 159 CYS 159 159 159 CYS CYS A . n 
A 1 160 THR 160 160 160 THR THR A . n 
A 1 161 THR 161 161 161 THR THR A . n 
A 1 162 GLY 162 162 162 GLY GLY A . n 
A 1 163 LYS 163 163 163 LYS LYS A . n 
A 1 164 CYS 164 164 164 CYS CYS A . n 
A 1 165 GLY 165 165 165 GLY GLY A . n 
A 1 166 PRO 166 166 166 PRO PRO A . n 
A 1 167 THR 167 167 167 THR THR A . n 
A 1 168 GLU 168 168 168 GLU GLU A . n 
A 1 169 TYR 169 169 169 TYR TYR A . n 
A 1 170 SER 170 170 170 SER SER A . n 
A 1 171 ARG 171 171 171 ARG ARG A . n 
A 1 172 PHE 172 172 172 PHE PHE A . n 
A 1 173 PHE 173 173 173 PHE PHE A . n 
A 1 174 LYS 174 174 174 LYS LYS A . n 
A 1 175 ARG 175 175 175 ARG ARG A . n 
A 1 176 LEU 176 176 176 LEU LEU A . n 
A 1 177 CYS 177 177 177 CYS CYS A . n 
A 1 178 PRO 178 178 178 PRO PRO A . n 
A 1 179 ASP 179 179 179 ASP ASP A . n 
A 1 180 ALA 180 180 180 ALA ALA A . n 
A 1 181 PHE 181 181 181 PHE PHE A . n 
A 1 182 SER 182 182 182 SER SER A . n 
A 1 183 TYR 183 183 183 TYR TYR A . n 
A 1 184 VAL 184 184 184 VAL VAL A . n 
A 1 185 LEU 185 185 185 LEU LEU A . n 
A 1 186 ASP 186 186 186 ASP ASP A . n 
A 1 187 LYS 187 187 187 LYS LYS A . n 
A 1 188 PRO 188 188 188 PRO PRO A . n 
A 1 189 THR 189 189 189 THR THR A . n 
A 1 190 THR 190 190 190 THR THR A . n 
A 1 191 VAL 191 191 191 VAL VAL A . n 
A 1 192 THR 192 192 192 THR THR A . n 
A 1 193 CYS 193 193 193 CYS CYS A . n 
A 1 194 PRO 194 194 194 PRO PRO A . n 
A 1 195 GLY 195 195 195 GLY GLY A . n 
A 1 196 SER 196 196 196 SER SER A . n 
A 1 197 SER 197 197 197 SER SER A . n 
A 1 198 ASN 198 198 198 ASN ASN A . n 
A 1 199 TYR 199 199 199 TYR TYR A . n 
A 1 200 ARG 200 200 200 ARG ARG A . n 
A 1 201 VAL 201 201 201 VAL VAL A . n 
A 1 202 THR 202 202 202 THR THR A . n 
A 1 203 PHE 203 203 203 PHE PHE A . n 
A 1 204 CYS 204 204 204 CYS CYS A . n 
A 1 205 PRO 205 205 205 PRO PRO A . n 
A 1 206 THR 206 206 206 THR THR A . n 
A 1 207 ALA 207 207 ?   ?   ?   A . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 TLA 1   301 1207 TLA TLA A . 
C 3 HOH 1   401 120  HOH HOH A . 
C 3 HOH 2   402 170  HOH HOH A . 
C 3 HOH 3   403 3    HOH HOH A . 
C 3 HOH 4   404 89   HOH HOH A . 
C 3 HOH 5   405 95   HOH HOH A . 
C 3 HOH 6   406 128  HOH HOH A . 
C 3 HOH 7   407 119  HOH HOH A . 
C 3 HOH 8   408 98   HOH HOH A . 
C 3 HOH 9   409 88   HOH HOH A . 
C 3 HOH 10  410 79   HOH HOH A . 
C 3 HOH 11  411 164  HOH HOH A . 
C 3 HOH 12  412 114  HOH HOH A . 
C 3 HOH 13  413 45   HOH HOH A . 
C 3 HOH 14  414 103  HOH HOH A . 
C 3 HOH 15  415 174  HOH HOH A . 
C 3 HOH 16  416 115  HOH HOH A . 
C 3 HOH 17  417 102  HOH HOH A . 
C 3 HOH 18  418 91   HOH HOH A . 
C 3 HOH 19  419 9    HOH HOH A . 
C 3 HOH 20  420 53   HOH HOH A . 
C 3 HOH 21  421 172  HOH HOH A . 
C 3 HOH 22  422 62   HOH HOH A . 
C 3 HOH 23  423 80   HOH HOH A . 
C 3 HOH 24  424 44   HOH HOH A . 
C 3 HOH 25  425 135  HOH HOH A . 
C 3 HOH 26  426 166  HOH HOH A . 
C 3 HOH 27  427 48   HOH HOH A . 
C 3 HOH 28  428 169  HOH HOH A . 
C 3 HOH 29  429 155  HOH HOH A . 
C 3 HOH 30  430 107  HOH HOH A . 
C 3 HOH 31  431 167  HOH HOH A . 
C 3 HOH 32  432 36   HOH HOH A . 
C 3 HOH 33  433 67   HOH HOH A . 
C 3 HOH 34  434 151  HOH HOH A . 
C 3 HOH 35  435 42   HOH HOH A . 
C 3 HOH 36  436 8    HOH HOH A . 
C 3 HOH 37  437 71   HOH HOH A . 
C 3 HOH 38  438 160  HOH HOH A . 
C 3 HOH 39  439 66   HOH HOH A . 
C 3 HOH 40  440 15   HOH HOH A . 
C 3 HOH 41  441 12   HOH HOH A . 
C 3 HOH 42  442 154  HOH HOH A . 
C 3 HOH 43  443 60   HOH HOH A . 
C 3 HOH 44  444 5    HOH HOH A . 
C 3 HOH 45  445 20   HOH HOH A . 
C 3 HOH 46  446 72   HOH HOH A . 
C 3 HOH 47  447 76   HOH HOH A . 
C 3 HOH 48  448 47   HOH HOH A . 
C 3 HOH 49  449 99   HOH HOH A . 
C 3 HOH 50  450 4    HOH HOH A . 
C 3 HOH 51  451 82   HOH HOH A . 
C 3 HOH 52  452 81   HOH HOH A . 
C 3 HOH 53  453 27   HOH HOH A . 
C 3 HOH 54  454 41   HOH HOH A . 
C 3 HOH 55  455 144  HOH HOH A . 
C 3 HOH 56  456 40   HOH HOH A . 
C 3 HOH 57  457 175  HOH HOH A . 
C 3 HOH 58  458 157  HOH HOH A . 
C 3 HOH 59  459 19   HOH HOH A . 
C 3 HOH 60  460 11   HOH HOH A . 
C 3 HOH 61  461 149  HOH HOH A . 
C 3 HOH 62  462 39   HOH HOH A . 
C 3 HOH 63  463 22   HOH HOH A . 
C 3 HOH 64  464 32   HOH HOH A . 
C 3 HOH 65  465 86   HOH HOH A . 
C 3 HOH 66  466 110  HOH HOH A . 
C 3 HOH 67  467 68   HOH HOH A . 
C 3 HOH 68  468 43   HOH HOH A . 
C 3 HOH 69  469 146  HOH HOH A . 
C 3 HOH 70  470 123  HOH HOH A . 
C 3 HOH 71  471 35   HOH HOH A . 
C 3 HOH 72  472 87   HOH HOH A . 
C 3 HOH 73  473 156  HOH HOH A . 
C 3 HOH 74  474 74   HOH HOH A . 
C 3 HOH 75  475 55   HOH HOH A . 
C 3 HOH 76  476 136  HOH HOH A . 
C 3 HOH 77  477 129  HOH HOH A . 
C 3 HOH 78  478 112  HOH HOH A . 
C 3 HOH 79  479 83   HOH HOH A . 
C 3 HOH 80  480 122  HOH HOH A . 
C 3 HOH 81  481 125  HOH HOH A . 
C 3 HOH 82  482 54   HOH HOH A . 
C 3 HOH 83  483 73   HOH HOH A . 
C 3 HOH 84  484 92   HOH HOH A . 
C 3 HOH 85  485 37   HOH HOH A . 
C 3 HOH 86  486 137  HOH HOH A . 
C 3 HOH 87  487 24   HOH HOH A . 
C 3 HOH 88  488 58   HOH HOH A . 
C 3 HOH 89  489 51   HOH HOH A . 
C 3 HOH 90  490 117  HOH HOH A . 
C 3 HOH 91  491 10   HOH HOH A . 
C 3 HOH 92  492 75   HOH HOH A . 
C 3 HOH 93  493 50   HOH HOH A . 
C 3 HOH 94  494 2    HOH HOH A . 
C 3 HOH 95  495 121  HOH HOH A . 
C 3 HOH 96  496 104  HOH HOH A . 
C 3 HOH 97  497 130  HOH HOH A . 
C 3 HOH 98  498 46   HOH HOH A . 
C 3 HOH 99  499 159  HOH HOH A . 
C 3 HOH 100 500 38   HOH HOH A . 
C 3 HOH 101 501 69   HOH HOH A . 
C 3 HOH 102 502 70   HOH HOH A . 
C 3 HOH 103 503 97   HOH HOH A . 
C 3 HOH 104 504 183  HOH HOH A . 
C 3 HOH 105 505 1    HOH HOH A . 
C 3 HOH 106 506 161  HOH HOH A . 
C 3 HOH 107 507 56   HOH HOH A . 
C 3 HOH 108 508 93   HOH HOH A . 
C 3 HOH 109 509 57   HOH HOH A . 
C 3 HOH 110 510 29   HOH HOH A . 
C 3 HOH 111 511 34   HOH HOH A . 
C 3 HOH 112 512 33   HOH HOH A . 
C 3 HOH 113 513 63   HOH HOH A . 
C 3 HOH 114 514 118  HOH HOH A . 
C 3 HOH 115 515 52   HOH HOH A . 
C 3 HOH 116 516 162  HOH HOH A . 
C 3 HOH 117 517 163  HOH HOH A . 
C 3 HOH 118 518 158  HOH HOH A . 
C 3 HOH 119 519 105  HOH HOH A . 
C 3 HOH 120 520 90   HOH HOH A . 
C 3 HOH 121 521 25   HOH HOH A . 
C 3 HOH 122 522 77   HOH HOH A . 
C 3 HOH 123 523 78   HOH HOH A . 
C 3 HOH 124 524 18   HOH HOH A . 
C 3 HOH 125 525 94   HOH HOH A . 
C 3 HOH 126 526 106  HOH HOH A . 
C 3 HOH 127 527 178  HOH HOH A . 
C 3 HOH 128 528 179  HOH HOH A . 
C 3 HOH 129 529 13   HOH HOH A . 
C 3 HOH 130 530 84   HOH HOH A . 
C 3 HOH 131 531 49   HOH HOH A . 
C 3 HOH 132 532 64   HOH HOH A . 
C 3 HOH 133 533 61   HOH HOH A . 
C 3 HOH 134 534 182  HOH HOH A . 
C 3 HOH 135 535 145  HOH HOH A . 
C 3 HOH 136 536 65   HOH HOH A . 
C 3 HOH 137 537 131  HOH HOH A . 
C 3 HOH 138 538 14   HOH HOH A . 
C 3 HOH 139 539 113  HOH HOH A . 
C 3 HOH 140 540 7    HOH HOH A . 
C 3 HOH 141 541 23   HOH HOH A . 
C 3 HOH 142 542 138  HOH HOH A . 
C 3 HOH 143 543 31   HOH HOH A . 
C 3 HOH 144 544 21   HOH HOH A . 
C 3 HOH 145 545 111  HOH HOH A . 
C 3 HOH 146 546 180  HOH HOH A . 
C 3 HOH 147 547 143  HOH HOH A . 
C 3 HOH 148 548 101  HOH HOH A . 
C 3 HOH 149 549 132  HOH HOH A . 
C 3 HOH 150 550 142  HOH HOH A . 
C 3 HOH 151 551 59   HOH HOH A . 
C 3 HOH 152 552 165  HOH HOH A . 
C 3 HOH 153 553 109  HOH HOH A . 
C 3 HOH 154 554 85   HOH HOH A . 
C 3 HOH 155 555 181  HOH HOH A . 
C 3 HOH 156 556 133  HOH HOH A . 
C 3 HOH 157 557 108  HOH HOH A . 
C 3 HOH 158 558 28   HOH HOH A . 
C 3 HOH 159 559 168  HOH HOH A . 
C 3 HOH 160 560 100  HOH HOH A . 
C 3 HOH 161 561 134  HOH HOH A . 
C 3 HOH 162 562 127  HOH HOH A . 
C 3 HOH 163 563 171  HOH HOH A . 
C 3 HOH 164 564 6    HOH HOH A . 
C 3 HOH 165 565 184  HOH HOH A . 
C 3 HOH 166 566 139  HOH HOH A . 
C 3 HOH 167 567 96   HOH HOH A . 
C 3 HOH 168 568 147  HOH HOH A . 
C 3 HOH 169 569 126  HOH HOH A . 
C 3 HOH 170 570 150  HOH HOH A . 
C 3 HOH 171 571 152  HOH HOH A . 
C 3 HOH 172 572 148  HOH HOH A . 
C 3 HOH 173 573 176  HOH HOH A . 
C 3 HOH 174 574 141  HOH HOH A . 
C 3 HOH 175 575 16   HOH HOH A . 
C 3 HOH 176 576 26   HOH HOH A . 
C 3 HOH 177 577 153  HOH HOH A . 
C 3 HOH 178 578 17   HOH HOH A . 
C 3 HOH 179 579 173  HOH HOH A . 
C 3 HOH 180 580 124  HOH HOH A . 
C 3 HOH 181 581 140  HOH HOH A . 
C 3 HOH 182 582 30   HOH HOH A . 
C 3 HOH 183 583 116  HOH HOH A . 
C 3 HOH 184 584 177  HOH HOH A . 
# 
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 0 A VAL 124 ? CA  B A VAL 124 CA  
2 1 Y 0 A VAL 124 ? CB  B A VAL 124 CB  
3 1 Y 0 A VAL 124 ? CG1 B A VAL 124 CG1 
4 1 Y 0 A VAL 124 ? CG2 B A VAL 124 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       ? ? ? ? ? ? ? ? ? ? ? REFMAC   ? ? ? 5.8.0419 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? CrystFEL ? ? ? 10.2     2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? CrystFEL ? ? ? 10.2     3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER   ? ? ? .        4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9EPE 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     58.500 
_cell.length_a_esd                 ? 
_cell.length_b                     58.500 
_cell.length_b_esd                 ? 
_cell.length_c                     151.250 
_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                         9EPE 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                92 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 41 21 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9EPE 
_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             2.91 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          57.75 
_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          'BATCH MODE' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;100 mg of thaumatin (Sigma-T7638) was dissolved in 1 ml of MiniQ water, reaching a concentration of 100 mg/ml with solutions vortexed to ensure complete dissolution. Subsequently, 200 uL of the thaumatin solution was mixed with 200 ul of 1.6 M (Na, K, tartrate) crystallization solution
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     293 
_diffrn.ambient_temp_details             'room temperature' 
_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   Y 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'PSI JUNGFRAU 8M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-09-05 
_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   1.0306 
_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                      'FREE ELECTRON LASER' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SwissFEL ARAMIS BEAMLINE ESC' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.0306 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ESC 
_diffrn_source.pdbx_synchrotron_site       'SwissFEL ARAMIS' 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9EPE 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.52 
_reflns.d_resolution_low                               32 
_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                                     41507 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                70.8 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          3.41 
_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                                   0.909 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   0.25 
_reflns.pdbx_Rmerge_I_obs                              ? 
_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                                    1.52 
_reflns_shell.d_res_low                                     1.56 
_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                             2043 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_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                                  0.362 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  1.129 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_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]                            0.354 
_refine.aniso_B[1][2]                            -0.000 
_refine.aniso_B[1][3]                            -0.000 
_refine.aniso_B[2][2]                            0.354 
_refine.aniso_B[2][3]                            -0.000 
_refine.aniso_B[3][3]                            -0.708 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               21.268 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.962 
_refine.correlation_coeff_Fo_to_Fc_free          0.936 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_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                                 9EPE 
_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                            1.520 
_refine.ls_d_res_low                             32.000 
_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                     41408 
_refine.ls_number_reflns_R_free                  2089 
_refine.ls_number_reflns_R_work                  39319 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.964 
_refine.ls_percent_reflns_R_free                 5.045 
_refine.ls_R_factor_all                          0.178 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2046 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1771 
_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                    'MASK BULK SOLVENT' 
_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               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.065 
_refine.pdbx_overall_ESU_R_Free                  0.068 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_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   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             1.607 
_refine.overall_SU_ML                            0.055 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.520 
_refine_hist.d_res_low                        32.000 
_refine_hist.number_atoms_solvent             184 
_refine_hist.number_atoms_total               1739 
_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        1545 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         10 
_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' ? 0.009  0.012  1656 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  1488 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.656  1.809  2263 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.610  1.757  3456 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 6.890  5.000  227  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 10.096 5.000  13   ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 12.268 10.000 255  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 15.371 10.000 71   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.092  0.200  244  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  2042 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  408  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.239  0.200  274  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.194  0.200  1319 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.187  0.200  805  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.086  0.200  904  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.406  0.200  119  ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.164  0.200  4    ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.172  0.200  46   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.343  0.200  11   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 2.139  2.046  845  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.071  2.043  845  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.092  3.668  1060 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.112  3.670  1061 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 3.238  2.410  811  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 3.240  2.411  810  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 4.995  4.233  1192 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 4.995  4.233  1192 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 6.489  22.605 1850 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 6.316  22.129 1817 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.520 1.559  2998 . 149 2849 100.0000 . 0.344 . . 0.345 . . . . . 0.343 . 20 . 0.910 0.915 0.322 
'X-RAY DIFFRACTION' 1.559 1.602  2927 . 144 2783 100.0000 . 0.315 . . 0.314 . . . . . 0.310 . 20 . 0.929 0.931 0.338 
'X-RAY DIFFRACTION' 1.602 1.648  2841 . 136 2705 100.0000 . 0.287 . . 0.287 . . . . . 0.279 . 20 . 0.944 0.939 0.286 
'X-RAY DIFFRACTION' 1.648 1.699  2761 . 161 2600 100.0000 . 0.252 . . 0.250 . . . . . 0.238 . 20 . 0.958 0.948 0.285 
'X-RAY DIFFRACTION' 1.699 1.754  2692 . 149 2543 100.0000 . 0.219 . . 0.217 . . . . . 0.206 . 20 . 0.968 0.958 0.244 
'X-RAY DIFFRACTION' 1.754 1.816  2601 . 135 2466 100.0000 . 0.191 . . 0.191 . . . . . 0.180 . 20 . 0.975 0.973 0.204 
'X-RAY DIFFRACTION' 1.816 1.884  2534 . 123 2411 100.0000 . 0.186 . . 0.184 . . . . . 0.174 . 20 . 0.976 0.971 0.212 
'X-RAY DIFFRACTION' 1.884 1.961  2411 . 114 2297 100.0000 . 0.174 . . 0.172 . . . . . 0.164 . 20 . 0.980 0.971 0.215 
'X-RAY DIFFRACTION' 1.961 2.048  2328 . 107 2221 100.0000 . 0.158 . . 0.157 . . . . . 0.153 . 20 . 0.984 0.979 0.181 
'X-RAY DIFFRACTION' 2.048 2.147  2230 . 126 2104 100.0000 . 0.158 . . 0.158 . . . . . 0.156 . 20 . 0.984 0.982 0.165 
'X-RAY DIFFRACTION' 2.147 2.263  2137 . 95  2042 100.0000 . 0.154 . . 0.153 . . . . . 0.153 . 20 . 0.986 0.979 0.179 
'X-RAY DIFFRACTION' 2.263 2.399  2014 . 89  1925 100.0000 . 0.148 . . 0.148 . . . . . 0.152 . 20 . 0.986 0.984 0.156 
'X-RAY DIFFRACTION' 2.399 2.564  1934 . 95  1839 100.0000 . 0.148 . . 0.146 . . . . . 0.152 . 20 . 0.986 0.980 0.177 
'X-RAY DIFFRACTION' 2.564 2.768  1788 . 97  1691 100.0000 . 0.162 . . 0.159 . . . . . 0.169 . 20 . 0.983 0.965 0.202 
'X-RAY DIFFRACTION' 2.768 3.030  1659 . 80  1579 100.0000 . 0.159 . . 0.158 . . . . . 0.173 . 20 . 0.983 0.982 0.163 
'X-RAY DIFFRACTION' 3.030 3.384  1502 . 77  1425 100.0000 . 0.158 . . 0.156 . . . . . 0.183 . 20 . 0.984 0.976 0.209 
'X-RAY DIFFRACTION' 3.384 3.900  1368 . 83  1285 100.0000 . 0.154 . . 0.153 . . . . . 0.176 . 20 . 0.983 0.980 0.176 
'X-RAY DIFFRACTION' 3.900 4.759  1161 . 45  1116 100.0000 . 0.138 . . 0.138 . . . . . 0.160 . 20 . 0.986 0.991 0.143 
'X-RAY DIFFRACTION' 4.759 6.656  938  . 48  890  100.0000 . 0.186 . . 0.183 . . . . . 0.220 . 20 . 0.978 0.906 0.240 
'X-RAY DIFFRACTION' 6.656 32.000 592  . 36  548  98.6487  . 0.343 . . 0.343 . . . . . 0.688 . 20 . 0.935 0.959 0.354 
# 
_struct.entry_id                     9EPE 
_struct.title                        '8fs pulse duration 10uJ pulse energy thaumatin' 
_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        9EPE 
_struct_keywords.text            'radiation damage, XFEL, pulse duration and intensity, disulphides, PLANT PROTEIN' 
_struct_keywords.pdbx_keywords   'PLANT PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    THM1_THADA 
_struct_ref.pdbx_db_accession          P02883 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;ATFEIVNRCSYTVWAAASKGDAALDAGGRQLNSGESWTINVEPGTNGGKIWARTDCYFDDSGSGICKTGDCGGLLRCKRF
GRPPTTLAEFSLNQYGKDYIDISNIKGFNVPMDFSPTTRGCRGVRCAADIVGQCPAKLKAPGGGCNDACTVFQTSEYCCT
TGKCGPTEYSRFFKRLCPDAFSYVLDKPTTVTCPGSSNYRVTFCPTA
;
_struct_ref.pdbx_align_begin           23 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9EPE 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 207 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P02883 
_struct_ref_seq.db_align_beg                  23 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  229 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       207 
# 
_struct_ref_seq_dif.align_id                     1 
_struct_ref_seq_dif.pdbx_pdb_id_code             9EPE 
_struct_ref_seq_dif.mon_id                       ASN 
_struct_ref_seq_dif.pdbx_pdb_strand_id           A 
_struct_ref_seq_dif.seq_num                      113 
_struct_ref_seq_dif.pdbx_pdb_ins_code            ? 
_struct_ref_seq_dif.pdbx_seq_db_name             UNP 
_struct_ref_seq_dif.pdbx_seq_db_accession_code   P02883 
_struct_ref_seq_dif.db_mon_id                    ASP 
_struct_ref_seq_dif.pdbx_seq_db_seq_num          135 
_struct_ref_seq_dif.details                      conflict 
_struct_ref_seq_dif.pdbx_auth_seq_num            113 
_struct_ref_seq_dif.pdbx_ordinal                 1 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 190  ? 
1 MORE         0    ? 
1 'SSA (A^2)'  9650 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_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 ASP A 129 ? CYS A 134 ? ASP A 129 CYS A 134 1 ? 6  
HELX_P HELX_P2 AA2 PRO A 135 ? LYS A 139 ? PRO A 135 LYS A 139 5 ? 5  
HELX_P HELX_P3 AA3 ASP A 147 ? GLN A 153 ? ASP A 147 GLN A 153 1 ? 7  
HELX_P HELX_P4 AA4 THR A 154 ? CYS A 159 ? THR A 154 CYS A 159 1 ? 6  
HELX_P HELX_P5 AA5 THR A 167 ? CYS A 177 ? THR A 167 CYS A 177 1 ? 11 
# 
_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 
disulf1 disulf ? ? A CYS 9   SG ? ? ? 1_555 A CYS 204 SG ? ? A CYS 9   A CYS 204 1_555 ? ? ? ? ? ? ? 1.995 ? ? 
disulf2 disulf ? ? A CYS 56  SG ? ? ? 1_555 A CYS 66  SG ? ? A CYS 56  A CYS 66  1_555 ? ? ? ? ? ? ? 2.021 ? ? 
disulf3 disulf ? ? A CYS 71  SG ? ? ? 1_555 A CYS 77  SG ? ? A CYS 71  A CYS 77  1_555 ? ? ? ? ? ? ? 2.037 ? ? 
disulf4 disulf ? ? A CYS 121 SG ? ? ? 1_555 A CYS 193 SG ? ? A CYS 121 A CYS 193 1_555 ? ? ? ? ? ? ? 2.006 ? ? 
disulf5 disulf ? ? A CYS 126 SG ? ? ? 1_555 A CYS 177 SG ? ? A CYS 126 A CYS 177 1_555 ? ? ? ? ? ? ? 1.994 ? ? 
disulf6 disulf ? ? A CYS 134 SG ? ? ? 1_555 A CYS 145 SG ? ? A CYS 134 A CYS 145 1_555 ? ? ? ? ? ? ? 2.027 ? ? 
disulf7 disulf ? ? A CYS 149 SG ? ? ? 1_555 A CYS 158 SG ? ? A CYS 149 A CYS 158 1_555 ? ? ? ? ? ? ? 2.052 ? ? 
disulf8 disulf ? ? A CYS 159 SG A ? ? 1_555 A CYS 164 SG ? ? A CYS 159 A CYS 164 1_555 ? ? ? ? ? ? ? 1.980 ? ? 
disulf9 disulf ? ? A CYS 159 SG B ? ? 1_555 A CYS 164 SG ? ? A CYS 159 A CYS 164 1_555 ? ? ? ? ? ? ? 1.900 ? ? 
# 
_struct_conn_type.id          disulf 
_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 CYS A 9   ? CYS A 204 ? CYS A 9   ? 1_555 CYS A 204 ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS A 56  ? CYS A 66  ? CYS A 56  ? 1_555 CYS A 66  ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS A 71  ? CYS A 77  ? CYS A 71  ? 1_555 CYS A 77  ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS A 121 ? CYS A 193 ? CYS A 121 ? 1_555 CYS A 193 ? 1_555 SG SG . . . None 'Disulfide bridge' 
5 CYS A 126 ? CYS A 177 ? CYS A 126 ? 1_555 CYS A 177 ? 1_555 SG SG . . . None 'Disulfide bridge' 
6 CYS A 134 ? CYS A 145 ? CYS A 134 ? 1_555 CYS A 145 ? 1_555 SG SG . . . None 'Disulfide bridge' 
7 CYS A 149 ? CYS A 158 ? CYS A 149 ? 1_555 CYS A 158 ? 1_555 SG SG . . . None 'Disulfide bridge' 
8 CYS A 159 A CYS A 164 ? CYS A 159 ? 1_555 CYS A 164 ? 1_555 SG SG . . . None 'Disulfide bridge' 
9 CYS A 159 B CYS A 164 ? CYS A 159 ? 1_555 CYS A 164 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          PRO 
_struct_mon_prot_cis.label_seq_id           83 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      ? 
_struct_mon_prot_cis.auth_comp_id           PRO 
_struct_mon_prot_cis.auth_seq_id            83 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    84 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    ? 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     84 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       7.92 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 4 ? 
AA3 ? 6 ? 
# 
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 ? parallel      
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA3 4 5 ? anti-parallel 
AA3 5 6 ? 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 SER A 36  ? ASN A 40  ? SER A 36  ASN A 40  
AA1 2 THR A 2   ? ASN A 7   ? THR A 2   ASN A 7   
AA1 3 TYR A 199 ? PHE A 203 ? TYR A 199 PHE A 203 
AA1 4 MET A 112 ? PRO A 116 ? MET A 112 PRO A 116 
AA1 5 VAL A 124 ? CYS A 126 ? VAL A 124 CYS A 126 
AA2 1 ALA A 23  ? LEU A 31  ? ALA A 23  LEU A 31  
AA2 2 VAL A 13  ? SER A 18  ? VAL A 13  SER A 18  
AA2 3 GLY A 48  ? PHE A 58  ? GLY A 48  PHE A 58  
AA2 4 GLY A 64  ? THR A 68  ? GLY A 64  THR A 68  
AA3 1 ALA A 23  ? LEU A 31  ? ALA A 23  LEU A 31  
AA3 2 VAL A 13  ? SER A 18  ? VAL A 13  SER A 18  
AA3 3 GLY A 48  ? PHE A 58  ? GLY A 48  PHE A 58  
AA3 4 LEU A 87  ? GLN A 94  ? LEU A 87  GLN A 94  
AA3 5 LYS A 97  ? SER A 103 ? LYS A 97  SER A 103 
AA3 6 VAL A 191 ? PRO A 194 ? VAL A 191 PRO A 194 
# 
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 TRP A 37  ? O TRP A 37  N ILE A 5   ? N ILE A 5   
AA1 2 3 N VAL A 6   ? N VAL A 6   O VAL A 201 ? O VAL A 201 
AA1 3 4 O ARG A 200 ? O ARG A 200 N SER A 115 ? N SER A 115 
AA1 4 5 N PHE A 114 ? N PHE A 114 O VAL A 124 ? O VAL A 124 
AA2 1 2 O LEU A 31  ? O LEU A 31  N VAL A 13  ? N VAL A 13  
AA2 2 3 N SER A 18  ? N SER A 18  O LYS A 49  ? O LYS A 49  
AA2 3 4 N TYR A 57  ? N TYR A 57  O ILE A 65  ? O ILE A 65  
AA3 1 2 O LEU A 31  ? O LEU A 31  N VAL A 13  ? N VAL A 13  
AA3 2 3 N SER A 18  ? N SER A 18  O LYS A 49  ? O LYS A 49  
AA3 3 4 N ILE A 50  ? N ILE A 50  O ALA A 88  ? O ALA A 88  
AA3 4 5 N GLN A 94  ? N GLN A 94  O LYS A 97  ? O LYS A 97  
AA3 5 6 N ILE A 100 ? N ILE A 100 O VAL A 191 ? O VAL A 191 
# 
_pdbx_entry_details.entry_id                   9EPE 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 OE2 A GLU 168 ? A O A HOH 401 ? ? 2.01 
2 1 O   A HOH 516 ? ? O A HOH 518 ? ? 2.06 
3 1 O   A HOH 461 ? ? O A HOH 573 ? ? 2.06 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    O 
_pdbx_validate_symm_contact.auth_asym_id_1    A 
_pdbx_validate_symm_contact.auth_comp_id_1    HOH 
_pdbx_validate_symm_contact.auth_seq_id_1     438 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    ? 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    O 
_pdbx_validate_symm_contact.auth_asym_id_2    A 
_pdbx_validate_symm_contact.auth_comp_id_2    HOH 
_pdbx_validate_symm_contact.auth_seq_id_2     458 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   6_444 
_pdbx_validate_symm_contact.dist              2.01 
# 
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 ASP A 25  ? ? 53.97   -138.02 
2 1 CYS A 71  ? ? -113.74 68.97   
3 1 SER A 196 ? ? 72.96   30.42   
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     76 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.131 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
_pdbx_unobs_or_zero_occ_residues.id               1 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num    1 
_pdbx_unobs_or_zero_occ_residues.polymer_flag     Y 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag   1 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id     A 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id     ALA 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id      207 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code     ? 
_pdbx_unobs_or_zero_occ_residues.label_asym_id    A 
_pdbx_unobs_or_zero_occ_residues.label_comp_id    ALA 
_pdbx_unobs_or_zero_occ_residues.label_seq_id     207 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
HOH O    O N N 137 
HOH H1   H N N 138 
HOH H2   H N N 139 
ILE N    N N N 140 
ILE CA   C N S 141 
ILE C    C N N 142 
ILE O    O N N 143 
ILE CB   C N S 144 
ILE CG1  C N N 145 
ILE CG2  C N N 146 
ILE CD1  C N N 147 
ILE OXT  O N N 148 
ILE H    H N N 149 
ILE H2   H N N 150 
ILE HA   H N N 151 
ILE HB   H N N 152 
ILE HG12 H N N 153 
ILE HG13 H N N 154 
ILE HG21 H N N 155 
ILE HG22 H N N 156 
ILE HG23 H N N 157 
ILE HD11 H N N 158 
ILE HD12 H N N 159 
ILE HD13 H N N 160 
ILE HXT  H N N 161 
LEU N    N N N 162 
LEU CA   C N S 163 
LEU C    C N N 164 
LEU O    O N N 165 
LEU CB   C N N 166 
LEU CG   C N N 167 
LEU CD1  C N N 168 
LEU CD2  C N N 169 
LEU OXT  O N N 170 
LEU H    H N N 171 
LEU H2   H N N 172 
LEU HA   H N N 173 
LEU HB2  H N N 174 
LEU HB3  H N N 175 
LEU HG   H N N 176 
LEU HD11 H N N 177 
LEU HD12 H N N 178 
LEU HD13 H N N 179 
LEU HD21 H N N 180 
LEU HD22 H N N 181 
LEU HD23 H N N 182 
LEU HXT  H N N 183 
LYS N    N N N 184 
LYS CA   C N S 185 
LYS C    C N N 186 
LYS O    O N N 187 
LYS CB   C N N 188 
LYS CG   C N N 189 
LYS CD   C N N 190 
LYS CE   C N N 191 
LYS NZ   N N N 192 
LYS OXT  O N N 193 
LYS H    H N N 194 
LYS H2   H N N 195 
LYS HA   H N N 196 
LYS HB2  H N N 197 
LYS HB3  H N N 198 
LYS HG2  H N N 199 
LYS HG3  H N N 200 
LYS HD2  H N N 201 
LYS HD3  H N N 202 
LYS HE2  H N N 203 
LYS HE3  H N N 204 
LYS HZ1  H N N 205 
LYS HZ2  H N N 206 
LYS HZ3  H N N 207 
LYS HXT  H N N 208 
MET N    N N N 209 
MET CA   C N S 210 
MET C    C N N 211 
MET O    O N N 212 
MET CB   C N N 213 
MET CG   C N N 214 
MET SD   S N N 215 
MET CE   C N N 216 
MET OXT  O N N 217 
MET H    H N N 218 
MET H2   H N N 219 
MET HA   H N N 220 
MET HB2  H N N 221 
MET HB3  H N N 222 
MET HG2  H N N 223 
MET HG3  H N N 224 
MET HE1  H N N 225 
MET HE2  H N N 226 
MET HE3  H N N 227 
MET HXT  H N N 228 
PHE N    N N N 229 
PHE CA   C N S 230 
PHE C    C N N 231 
PHE O    O N N 232 
PHE CB   C N N 233 
PHE CG   C Y N 234 
PHE CD1  C Y N 235 
PHE CD2  C Y N 236 
PHE CE1  C Y N 237 
PHE CE2  C Y N 238 
PHE CZ   C Y N 239 
PHE OXT  O N N 240 
PHE H    H N N 241 
PHE H2   H N N 242 
PHE HA   H N N 243 
PHE HB2  H N N 244 
PHE HB3  H N N 245 
PHE HD1  H N N 246 
PHE HD2  H N N 247 
PHE HE1  H N N 248 
PHE HE2  H N N 249 
PHE HZ   H N N 250 
PHE HXT  H N N 251 
PRO N    N N N 252 
PRO CA   C N S 253 
PRO C    C N N 254 
PRO O    O N N 255 
PRO CB   C N N 256 
PRO CG   C N N 257 
PRO CD   C N N 258 
PRO OXT  O N N 259 
PRO H    H N N 260 
PRO HA   H N N 261 
PRO HB2  H N N 262 
PRO HB3  H N N 263 
PRO HG2  H N N 264 
PRO HG3  H N N 265 
PRO HD2  H N N 266 
PRO HD3  H N N 267 
PRO HXT  H N N 268 
SER N    N N N 269 
SER CA   C N S 270 
SER C    C N N 271 
SER O    O N N 272 
SER CB   C N N 273 
SER OG   O N N 274 
SER OXT  O N N 275 
SER H    H N N 276 
SER H2   H N N 277 
SER HA   H N N 278 
SER HB2  H N N 279 
SER HB3  H N N 280 
SER HG   H N N 281 
SER HXT  H N N 282 
THR N    N N N 283 
THR CA   C N S 284 
THR C    C N N 285 
THR O    O N N 286 
THR CB   C N R 287 
THR OG1  O N N 288 
THR CG2  C N N 289 
THR OXT  O N N 290 
THR H    H N N 291 
THR H2   H N N 292 
THR HA   H N N 293 
THR HB   H N N 294 
THR HG1  H N N 295 
THR HG21 H N N 296 
THR HG22 H N N 297 
THR HG23 H N N 298 
THR HXT  H N N 299 
TLA O1   O N N 300 
TLA O11  O N N 301 
TLA C1   C N N 302 
TLA C2   C N R 303 
TLA O2   O N N 304 
TLA C3   C N R 305 
TLA O3   O N N 306 
TLA C4   C N N 307 
TLA O4   O N N 308 
TLA O41  O N N 309 
TLA H11  H N N 310 
TLA H2   H N N 311 
TLA HA   H N N 312 
TLA H3   H N N 313 
TLA HB   H N N 314 
TLA H41  H N N 315 
TRP N    N N N 316 
TRP CA   C N S 317 
TRP C    C N N 318 
TRP O    O N N 319 
TRP CB   C N N 320 
TRP CG   C Y N 321 
TRP CD1  C Y N 322 
TRP CD2  C Y N 323 
TRP NE1  N Y N 324 
TRP CE2  C Y N 325 
TRP CE3  C Y N 326 
TRP CZ2  C Y N 327 
TRP CZ3  C Y N 328 
TRP CH2  C Y N 329 
TRP OXT  O N N 330 
TRP H    H N N 331 
TRP H2   H N N 332 
TRP HA   H N N 333 
TRP HB2  H N N 334 
TRP HB3  H N N 335 
TRP HD1  H N N 336 
TRP HE1  H N N 337 
TRP HE3  H N N 338 
TRP HZ2  H N N 339 
TRP HZ3  H N N 340 
TRP HH2  H N N 341 
TRP HXT  H N N 342 
TYR N    N N N 343 
TYR CA   C N S 344 
TYR C    C N N 345 
TYR O    O N N 346 
TYR CB   C N N 347 
TYR CG   C Y N 348 
TYR CD1  C Y N 349 
TYR CD2  C Y N 350 
TYR CE1  C Y N 351 
TYR CE2  C Y N 352 
TYR CZ   C Y N 353 
TYR OH   O N N 354 
TYR OXT  O N N 355 
TYR H    H N N 356 
TYR H2   H N N 357 
TYR HA   H N N 358 
TYR HB2  H N N 359 
TYR HB3  H N N 360 
TYR HD1  H N N 361 
TYR HD2  H N N 362 
TYR HE1  H N N 363 
TYR HE2  H N N 364 
TYR HH   H N N 365 
TYR HXT  H N N 366 
VAL N    N N N 367 
VAL CA   C N S 368 
VAL C    C N N 369 
VAL O    O N N 370 
VAL CB   C N N 371 
VAL CG1  C N N 372 
VAL CG2  C N N 373 
VAL OXT  O N N 374 
VAL H    H N N 375 
VAL H2   H N N 376 
VAL HA   H N N 377 
VAL HB   H N N 378 
VAL HG11 H N N 379 
VAL HG12 H N N 380 
VAL HG13 H N N 381 
VAL HG21 H N N 382 
VAL HG22 H N N 383 
VAL HG23 H N N 384 
VAL HXT  H N N 385 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HOH O   H1   sing N N 129 
HOH O   H2   sing N N 130 
ILE N   CA   sing N N 131 
ILE N   H    sing N N 132 
ILE N   H2   sing N N 133 
ILE CA  C    sing N N 134 
ILE CA  CB   sing N N 135 
ILE CA  HA   sing N N 136 
ILE C   O    doub N N 137 
ILE C   OXT  sing N N 138 
ILE CB  CG1  sing N N 139 
ILE CB  CG2  sing N N 140 
ILE CB  HB   sing N N 141 
ILE CG1 CD1  sing N N 142 
ILE CG1 HG12 sing N N 143 
ILE CG1 HG13 sing N N 144 
ILE CG2 HG21 sing N N 145 
ILE CG2 HG22 sing N N 146 
ILE CG2 HG23 sing N N 147 
ILE CD1 HD11 sing N N 148 
ILE CD1 HD12 sing N N 149 
ILE CD1 HD13 sing N N 150 
ILE OXT HXT  sing N N 151 
LEU N   CA   sing N N 152 
LEU N   H    sing N N 153 
LEU N   H2   sing N N 154 
LEU CA  C    sing N N 155 
LEU CA  CB   sing N N 156 
LEU CA  HA   sing N N 157 
LEU C   O    doub N N 158 
LEU C   OXT  sing N N 159 
LEU CB  CG   sing N N 160 
LEU CB  HB2  sing N N 161 
LEU CB  HB3  sing N N 162 
LEU CG  CD1  sing N N 163 
LEU CG  CD2  sing N N 164 
LEU CG  HG   sing N N 165 
LEU CD1 HD11 sing N N 166 
LEU CD1 HD12 sing N N 167 
LEU CD1 HD13 sing N N 168 
LEU CD2 HD21 sing N N 169 
LEU CD2 HD22 sing N N 170 
LEU CD2 HD23 sing N N 171 
LEU OXT HXT  sing N N 172 
LYS N   CA   sing N N 173 
LYS N   H    sing N N 174 
LYS N   H2   sing N N 175 
LYS CA  C    sing N N 176 
LYS CA  CB   sing N N 177 
LYS CA  HA   sing N N 178 
LYS C   O    doub N N 179 
LYS C   OXT  sing N N 180 
LYS CB  CG   sing N N 181 
LYS CB  HB2  sing N N 182 
LYS CB  HB3  sing N N 183 
LYS CG  CD   sing N N 184 
LYS CG  HG2  sing N N 185 
LYS CG  HG3  sing N N 186 
LYS CD  CE   sing N N 187 
LYS CD  HD2  sing N N 188 
LYS CD  HD3  sing N N 189 
LYS CE  NZ   sing N N 190 
LYS CE  HE2  sing N N 191 
LYS CE  HE3  sing N N 192 
LYS NZ  HZ1  sing N N 193 
LYS NZ  HZ2  sing N N 194 
LYS NZ  HZ3  sing N N 195 
LYS OXT HXT  sing N N 196 
MET N   CA   sing N N 197 
MET N   H    sing N N 198 
MET N   H2   sing N N 199 
MET CA  C    sing N N 200 
MET CA  CB   sing N N 201 
MET CA  HA   sing N N 202 
MET C   O    doub N N 203 
MET C   OXT  sing N N 204 
MET CB  CG   sing N N 205 
MET CB  HB2  sing N N 206 
MET CB  HB3  sing N N 207 
MET CG  SD   sing N N 208 
MET CG  HG2  sing N N 209 
MET CG  HG3  sing N N 210 
MET SD  CE   sing N N 211 
MET CE  HE1  sing N N 212 
MET CE  HE2  sing N N 213 
MET CE  HE3  sing N N 214 
MET OXT HXT  sing N N 215 
PHE N   CA   sing N N 216 
PHE N   H    sing N N 217 
PHE N   H2   sing N N 218 
PHE CA  C    sing N N 219 
PHE CA  CB   sing N N 220 
PHE CA  HA   sing N N 221 
PHE C   O    doub N N 222 
PHE C   OXT  sing N N 223 
PHE CB  CG   sing N N 224 
PHE CB  HB2  sing N N 225 
PHE CB  HB3  sing N N 226 
PHE CG  CD1  doub Y N 227 
PHE CG  CD2  sing Y N 228 
PHE CD1 CE1  sing Y N 229 
PHE CD1 HD1  sing N N 230 
PHE CD2 CE2  doub Y N 231 
PHE CD2 HD2  sing N N 232 
PHE CE1 CZ   doub Y N 233 
PHE CE1 HE1  sing N N 234 
PHE CE2 CZ   sing Y N 235 
PHE CE2 HE2  sing N N 236 
PHE CZ  HZ   sing N N 237 
PHE OXT HXT  sing N N 238 
PRO N   CA   sing N N 239 
PRO N   CD   sing N N 240 
PRO N   H    sing N N 241 
PRO CA  C    sing N N 242 
PRO CA  CB   sing N N 243 
PRO CA  HA   sing N N 244 
PRO C   O    doub N N 245 
PRO C   OXT  sing N N 246 
PRO CB  CG   sing N N 247 
PRO CB  HB2  sing N N 248 
PRO CB  HB3  sing N N 249 
PRO CG  CD   sing N N 250 
PRO CG  HG2  sing N N 251 
PRO CG  HG3  sing N N 252 
PRO CD  HD2  sing N N 253 
PRO CD  HD3  sing N N 254 
PRO OXT HXT  sing N N 255 
SER N   CA   sing N N 256 
SER N   H    sing N N 257 
SER N   H2   sing N N 258 
SER CA  C    sing N N 259 
SER CA  CB   sing N N 260 
SER CA  HA   sing N N 261 
SER C   O    doub N N 262 
SER C   OXT  sing N N 263 
SER CB  OG   sing N N 264 
SER CB  HB2  sing N N 265 
SER CB  HB3  sing N N 266 
SER OG  HG   sing N N 267 
SER OXT HXT  sing N N 268 
THR N   CA   sing N N 269 
THR N   H    sing N N 270 
THR N   H2   sing N N 271 
THR CA  C    sing N N 272 
THR CA  CB   sing N N 273 
THR CA  HA   sing N N 274 
THR C   O    doub N N 275 
THR C   OXT  sing N N 276 
THR CB  OG1  sing N N 277 
THR CB  CG2  sing N N 278 
THR CB  HB   sing N N 279 
THR OG1 HG1  sing N N 280 
THR CG2 HG21 sing N N 281 
THR CG2 HG22 sing N N 282 
THR CG2 HG23 sing N N 283 
THR OXT HXT  sing N N 284 
TLA O1  C1   doub N N 285 
TLA O11 C1   sing N N 286 
TLA O11 H11  sing N N 287 
TLA C1  C2   sing N N 288 
TLA C2  O2   sing N N 289 
TLA C2  C3   sing N N 290 
TLA C2  H2   sing N N 291 
TLA O2  HA   sing N N 292 
TLA C3  O3   sing N N 293 
TLA C3  C4   sing N N 294 
TLA C3  H3   sing N N 295 
TLA O3  HB   sing N N 296 
TLA C4  O4   doub N N 297 
TLA C4  O41  sing N N 298 
TLA O41 H41  sing N N 299 
TRP N   CA   sing N N 300 
TRP N   H    sing N N 301 
TRP N   H2   sing N N 302 
TRP CA  C    sing N N 303 
TRP CA  CB   sing N N 304 
TRP CA  HA   sing N N 305 
TRP C   O    doub N N 306 
TRP C   OXT  sing N N 307 
TRP CB  CG   sing N N 308 
TRP CB  HB2  sing N N 309 
TRP CB  HB3  sing N N 310 
TRP CG  CD1  doub Y N 311 
TRP CG  CD2  sing Y N 312 
TRP CD1 NE1  sing Y N 313 
TRP CD1 HD1  sing N N 314 
TRP CD2 CE2  doub Y N 315 
TRP CD2 CE3  sing Y N 316 
TRP NE1 CE2  sing Y N 317 
TRP NE1 HE1  sing N N 318 
TRP CE2 CZ2  sing Y N 319 
TRP CE3 CZ3  doub Y N 320 
TRP CE3 HE3  sing N N 321 
TRP CZ2 CH2  doub Y N 322 
TRP CZ2 HZ2  sing N N 323 
TRP CZ3 CH2  sing Y N 324 
TRP CZ3 HZ3  sing N N 325 
TRP CH2 HH2  sing N N 326 
TRP OXT HXT  sing N N 327 
TYR N   CA   sing N N 328 
TYR N   H    sing N N 329 
TYR N   H2   sing N N 330 
TYR CA  C    sing N N 331 
TYR CA  CB   sing N N 332 
TYR CA  HA   sing N N 333 
TYR C   O    doub N N 334 
TYR C   OXT  sing N N 335 
TYR CB  CG   sing N N 336 
TYR CB  HB2  sing N N 337 
TYR CB  HB3  sing N N 338 
TYR CG  CD1  doub Y N 339 
TYR CG  CD2  sing Y N 340 
TYR CD1 CE1  sing Y N 341 
TYR CD1 HD1  sing N N 342 
TYR CD2 CE2  doub Y N 343 
TYR CD2 HD2  sing N N 344 
TYR CE1 CZ   doub Y N 345 
TYR CE1 HE1  sing N N 346 
TYR CE2 CZ   sing Y N 347 
TYR CE2 HE2  sing N N 348 
TYR CZ  OH   sing N N 349 
TYR OH  HH   sing N N 350 
TYR OXT HXT  sing N N 351 
VAL N   CA   sing N N 352 
VAL N   H    sing N N 353 
VAL N   H2   sing N N 354 
VAL CA  C    sing N N 355 
VAL CA  CB   sing N N 356 
VAL CA  HA   sing N N 357 
VAL C   O    doub N N 358 
VAL C   OXT  sing N N 359 
VAL CB  CG1  sing N N 360 
VAL CB  CG2  sing N N 361 
VAL CB  HB   sing N N 362 
VAL CG1 HG11 sing N N 363 
VAL CG1 HG12 sing N N 364 
VAL CG1 HG13 sing N N 365 
VAL CG2 HG21 sing N N 366 
VAL CG2 HG22 sing N N 367 
VAL CG2 HG23 sing N N 368 
VAL OXT HXT  sing N N 369 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   4AXR 
_pdbx_initial_refinement_model.details          ? 
# 
_pdbx_serial_crystallography_data_reduction.diffrn_id             1 
_pdbx_serial_crystallography_data_reduction.frames_total          ? 
_pdbx_serial_crystallography_data_reduction.xfel_pulse_events     ? 
_pdbx_serial_crystallography_data_reduction.frame_hits            ? 
_pdbx_serial_crystallography_data_reduction.crystal_hits          ? 
_pdbx_serial_crystallography_data_reduction.droplet_hits          ? 
_pdbx_serial_crystallography_data_reduction.frames_failed_index   ? 
_pdbx_serial_crystallography_data_reduction.frames_indexed        8240 
_pdbx_serial_crystallography_data_reduction.lattices_indexed      ? 
_pdbx_serial_crystallography_data_reduction.xfel_run_numbers      ? 
_pdbx_serial_crystallography_data_reduction.lattices_merged       ? 
# 
_pdbx_serial_crystallography_measurement.diffrn_id                    1 
_pdbx_serial_crystallography_measurement.pulse_energy                 10 
_pdbx_serial_crystallography_measurement.pulse_duration               7.9 
_pdbx_serial_crystallography_measurement.xfel_pulse_repetition_rate   100 
_pdbx_serial_crystallography_measurement.pulse_photon_energy          12.03 
_pdbx_serial_crystallography_measurement.photons_per_pulse            ? 
_pdbx_serial_crystallography_measurement.source_size                  ? 
_pdbx_serial_crystallography_measurement.source_distance              ? 
_pdbx_serial_crystallography_measurement.focal_spot_size              7.98 
_pdbx_serial_crystallography_measurement.collimation                  ? 
_pdbx_serial_crystallography_measurement.collection_time_total        ? 
# 
_pdbx_serial_crystallography_sample_delivery.diffrn_id     1 
_pdbx_serial_crystallography_sample_delivery.description   'polymer fixed target' 
_pdbx_serial_crystallography_sample_delivery.method        'fixed target' 
# 
_pdbx_serial_crystallography_sample_delivery_fixed_target.diffrn_id                       1 
_pdbx_serial_crystallography_sample_delivery_fixed_target.description                     ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.sample_holding                  'polymer fixed target' 
_pdbx_serial_crystallography_sample_delivery_fixed_target.support_base                    ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.sample_unit_size                ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.crystals_per_unit               ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.sample_solvent                  ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.sample_dehydration_prevention   'thin film' 
_pdbx_serial_crystallography_sample_delivery_fixed_target.motion_control                  ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.velocity_horizontal             ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.velocity_vertical               ? 
_pdbx_serial_crystallography_sample_delivery_fixed_target.details                         ? 
# 
_atom_sites.entry_id                    9EPE 
_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]   0.017094 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.017094 
_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]   0.006612 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C 6  6  2.3103  20.8439 1.0201 10.2075 1.5888 0.5687  0.8651 51.6512 0.2156   
H 1  1  0.4930  10.5109 0.3229 26.1257 0.1402 3.1424  0.0408 57.7997 0.0030   
N 7  7  12.2220 0.0057  3.1346 9.8933  2.0141 28.9975 1.1672 0.5826  -11.5379 
O 8  8  3.0487  13.2771 2.2870 5.7011  1.5464 0.3239  0.8671 32.9089 0.2508   
S 16 16 6.9054  1.4679  5.2035 22.2151 1.4379 0.2536  1.5863 56.1720 0.8669   
# 
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_site.calc_flag 
ATOM   1    N N   . ALA A 1 1   ? 21.841  -10.913 -9.910  1.000 31.113 0 1   ALA A N   1 ? 
ATOM   2    C CA  . ALA A 1 1   ? 21.490  -12.353 -10.054 1.000 27.886 0 1   ALA A CA  1 ? 
ATOM   3    C C   . ALA A 1 1   ? 20.479  -12.426 -11.176 1.000 23.934 0 1   ALA A C   1 ? 
ATOM   4    O O   . ALA A 1 1   ? 19.704  -11.495 -11.331 1.000 26.589 0 1   ALA A O   1 ? 
ATOM   5    C CB  . ALA A 1 1   ? 20.884  -12.890 -8.791  1.000 32.202 0 1   ALA A CB  1 ? 
ATOM   6    N N   . THR A 1 2   ? 20.490  -13.547 -11.895 1.000 22.150 0 2   THR A N   1 ? 
ATOM   7    C CA  A THR A 1 2   ? 19.568  -13.733 -12.997 0.340 21.125 0 2   THR A CA  1 ? 
ATOM   8    C CA  B THR A 1 2   ? 19.598  -13.771 -13.009 0.660 22.962 0 2   THR A CA  1 ? 
ATOM   9    C C   . THR A 1 2   ? 18.502  -14.737 -12.560 1.000 19.558 0 2   THR A C   1 ? 
ATOM   10   O O   . THR A 1 2   ? 18.807  -15.740 -11.949 1.000 22.200 0 2   THR A O   1 ? 
ATOM   11   C CB  A THR A 1 2   ? 20.295  -14.171 -14.267 0.340 21.375 0 2   THR A CB  1 ? 
ATOM   12   C CB  B THR A 1 2   ? 20.397  -14.340 -14.175 0.660 26.374 0 2   THR A CB  1 ? 
ATOM   13   O OG1 A THR A 1 2   ? 20.708  -15.514 -14.083 0.340 20.654 0 2   THR A OG1 1 ? 
ATOM   14   O OG1 B THR A 1 2   ? 21.323  -13.324 -14.552 0.660 30.374 0 2   THR A OG1 1 ? 
ATOM   15   C CG2 A THR A 1 2   ? 21.569  -13.387 -14.523 0.340 21.506 0 2   THR A CG2 1 ? 
ATOM   16   C CG2 B THR A 1 2   ? 19.510  -14.671 -15.355 0.660 28.365 0 2   THR A CG2 1 ? 
ATOM   17   N N   . PHE A 1 3   ? 17.260  -14.392 -12.882 1.000 19.467 0 3   PHE A N   1 ? 
ATOM   18   C CA  . PHE A 1 3   ? 16.116  -15.272 -12.707 1.000 17.970 0 3   PHE A CA  1 ? 
ATOM   19   C C   . PHE A 1 3   ? 15.465  -15.482 -14.067 1.000 16.530 0 3   PHE A C   1 ? 
ATOM   20   O O   . PHE A 1 3   ? 15.125  -14.504 -14.721 1.000 20.504 0 3   PHE A O   1 ? 
ATOM   21   C CB  . PHE A 1 3   ? 15.083  -14.636 -11.805 1.000 18.677 0 3   PHE A CB  1 ? 
ATOM   22   C CG  . PHE A 1 3   ? 15.422  -14.658 -10.328 1.000 20.544 0 3   PHE A CG  1 ? 
ATOM   23   C CD1 . PHE A 1 3   ? 16.381  -13.789 -9.810  1.000 21.824 0 3   PHE A CD1 1 ? 
ATOM   24   C CD2 . PHE A 1 3   ? 14.727  -15.465 -9.449  1.000 20.645 0 3   PHE A CD2 1 ? 
ATOM   25   C CE1 . PHE A 1 3   ? 16.669  -13.770 -8.465  1.000 25.102 0 3   PHE A CE1 1 ? 
ATOM   26   C CE2 . PHE A 1 3   ? 15.024  -15.428 -8.099  1.000 21.921 0 3   PHE A CE2 1 ? 
ATOM   27   C CZ  . PHE A 1 3   ? 15.964  -14.566 -7.620  1.000 21.380 0 3   PHE A CZ  1 ? 
ATOM   28   N N   . GLU A 1 4   ? 15.317  -16.749 -14.456 1.000 15.456 0 4   GLU A N   1 ? 
ATOM   29   C CA  . GLU A 1 4   ? 14.537  -17.033 -15.647 1.000 16.665 0 4   GLU A CA  1 ? 
ATOM   30   C C   . GLU A 1 4   ? 13.172  -17.500 -15.186 1.000 16.113 0 4   GLU A C   1 ? 
ATOM   31   O O   . GLU A 1 4   ? 13.125  -18.413 -14.349 1.000 17.941 0 4   GLU A O   1 ? 
ATOM   32   C CB  . GLU A 1 4   ? 15.193  -18.112 -16.499 1.000 20.313 0 4   GLU A CB  1 ? 
ATOM   33   C CG  . GLU A 1 4   ? 14.461  -18.309 -17.820 1.000 23.070 0 4   GLU A CG  1 ? 
ATOM   34   C CD  . GLU A 1 4   ? 15.071  -19.342 -18.742 1.000 26.710 0 4   GLU A CD  1 ? 
ATOM   35   O OE1 . GLU A 1 4   ? 15.304  -20.427 -18.296 1.000 25.180 0 4   GLU A OE1 1 ? 
ATOM   36   O OE2 . GLU A 1 4   ? 15.327  -18.998 -19.899 1.000 28.609 0 4   GLU A OE2 1 ? 
ATOM   37   N N   . ILE A 1 5   ? 12.138  -16.821 -15.681 1.000 14.765 0 5   ILE A N   1 ? 
ATOM   38   C CA  . ILE A 1 5   ? 10.791  -17.130 -15.276 1.000 16.009 0 5   ILE A CA  1 ? 
ATOM   39   C C   . ILE A 1 5   ? 10.106  -17.757 -16.483 1.000 15.244 0 5   ILE A C   1 ? 
ATOM   40   O O   . ILE A 1 5   ? 10.039  -17.140 -17.538 1.000 16.324 0 5   ILE A O   1 ? 
ATOM   41   C CB  . ILE A 1 5   ? 10.071  -15.864 -14.805 1.000 17.219 0 5   ILE A CB  1 ? 
ATOM   42   C CG1 . ILE A 1 5   ? 10.856  -15.218 -13.610 1.000 19.071 0 5   ILE A CG1 1 ? 
ATOM   43   C CG2 . ILE A 1 5   ? 8.648   -16.248 -14.412 1.000 19.562 0 5   ILE A CG2 1 ? 
ATOM   44   C CD1 . ILE A 1 5   ? 10.434  -13.783 -13.329 1.000 22.715 0 5   ILE A CD1 1 ? 
ATOM   45   N N   . VAL A 1 6   ? 9.665   -18.992 -16.331 1.000 14.714 0 6   VAL A N   1 ? 
ATOM   46   C CA  . VAL A 1 6   ? 9.146   -19.802 -17.421 1.000 16.673 0 6   VAL A CA  1 ? 
ATOM   47   C C   . VAL A 1 6   ? 7.687   -20.163 -17.175 1.000 14.524 0 6   VAL A C   1 ? 
ATOM   48   O O   . VAL A 1 6   ? 7.365   -20.645 -16.097 1.000 15.756 0 6   VAL A O   1 ? 
ATOM   49   C CB  . VAL A 1 6   ? 9.964   -21.072 -17.534 1.000 17.757 0 6   VAL A CB  1 ? 
ATOM   50   C CG1 . VAL A 1 6   ? 9.452   -21.957 -18.685 1.000 17.794 0 6   VAL A CG1 1 ? 
ATOM   51   C CG2 . VAL A 1 6   ? 11.416  -20.707 -17.751 1.000 17.759 0 6   VAL A CG2 1 ? 
ATOM   52   N N   . ASN A 1 7   ? 6.820   -19.909 -18.145 1.000 14.431 0 7   ASN A N   1 ? 
ATOM   53   C CA  . ASN A 1 7   ? 5.430   -20.325 -18.028 1.000 14.615 0 7   ASN A CA  1 ? 
ATOM   54   C C   . ASN A 1 7   ? 5.235   -21.656 -18.775 1.000 14.125 0 7   ASN A C   1 ? 
ATOM   55   O O   . ASN A 1 7   ? 5.169   -21.636 -20.009 1.000 16.454 0 7   ASN A O   1 ? 
ATOM   56   C CB  . ASN A 1 7   ? 4.483   -19.271 -18.576 1.000 15.444 0 7   ASN A CB  1 ? 
ATOM   57   C CG  . ASN A 1 7   ? 3.065   -19.740 -18.434 1.000 14.835 0 7   ASN A CG  1 ? 
ATOM   58   O OD1 . ASN A 1 7   ? 2.799   -20.598 -17.601 1.000 15.639 0 7   ASN A OD1 1 ? 
ATOM   59   N ND2 . ASN A 1 7   ? 2.181   -19.141 -19.203 1.000 16.269 0 7   ASN A ND2 1 ? 
ATOM   60   N N   . ARG A 1 8   ? 5.178   -22.765 -18.057 1.000 13.623 0 8   ARG A N   1 ? 
ATOM   61   C CA  . ARG A 1 8   ? 4.873   -24.058 -18.651 1.000 14.276 0 8   ARG A CA  1 ? 
ATOM   62   C C   . ARG A 1 8   ? 3.378   -24.376 -18.580 1.000 16.000 0 8   ARG A C   1 ? 
ATOM   63   O O   . ARG A 1 8   ? 2.934   -25.433 -19.034 1.000 17.139 0 8   ARG A O   1 ? 
ATOM   64   C CB  . ARG A 1 8   ? 5.741   -25.141 -18.003 1.000 15.390 0 8   ARG A CB  1 ? 
ATOM   65   C CG  . ARG A 1 8   ? 5.722   -26.466 -18.733 1.000 17.552 0 8   ARG A CG  1 ? 
ATOM   66   C CD  . ARG A 1 8   ? 6.674   -27.437 -18.109 1.000 18.695 0 8   ARG A CD  1 ? 
ATOM   67   N NE  . ARG A 1 8   ? 8.059   -27.037 -18.343 1.000 17.332 0 8   ARG A NE  1 ? 
ATOM   68   C CZ  . ARG A 1 8   ? 9.085   -27.343 -17.561 1.000 21.261 0 8   ARG A CZ  1 ? 
ATOM   69   N NH1 . ARG A 1 8   ? 8.919   -28.084 -16.443 1.000 21.501 0 8   ARG A NH1 1 ? 
ATOM   70   N NH2 . ARG A 1 8   ? 10.259  -26.864 -17.866 1.000 21.002 0 8   ARG A NH2 1 ? 
ATOM   71   N N   . CYS A 1 9   ? 2.571   -23.436 -18.061 1.000 15.293 0 9   CYS A N   1 ? 
ATOM   72   C CA  . CYS A 1 9   ? 1.130   -23.656 -18.013 1.000 14.828 0 9   CYS A CA  1 ? 
ATOM   73   C C   . CYS A 1 9   ? 0.574   -23.590 -19.435 1.000 16.814 0 9   CYS A C   1 ? 
ATOM   74   O O   . CYS A 1 9   ? 1.148   -22.894 -20.282 1.000 16.862 0 9   CYS A O   1 ? 
ATOM   75   C CB  . CYS A 1 9   ? 0.430   -22.607 -17.155 1.000 15.390 0 9   CYS A CB  1 ? 
ATOM   76   S SG  . CYS A 1 9   ? 1.102   -22.427 -15.475 1.000 15.928 0 9   CYS A SG  1 ? 
ATOM   77   N N   . SER A 1 10  ? -0.620  -24.167 -19.607 1.000 17.061 0 10  SER A N   1 ? 
ATOM   78   C CA  A SER A 1 10  ? -1.312  -24.134 -20.886 0.770 19.910 0 10  SER A CA  1 ? 
ATOM   79   C CA  B SER A 1 10  ? -1.335  -24.141 -20.876 0.230 19.875 0 10  SER A CA  1 ? 
ATOM   80   C C   . SER A 1 10  ? -2.030  -22.805 -21.099 1.000 21.579 0 10  SER A C   1 ? 
ATOM   81   O O   . SER A 1 10  ? -2.526  -22.549 -22.197 1.000 25.922 0 10  SER A O   1 ? 
ATOM   82   C CB  A SER A 1 10  ? -2.280  -25.317 -21.008 0.770 21.196 0 10  SER A CB  1 ? 
ATOM   83   C CB  B SER A 1 10  ? -2.355  -25.250 -20.960 0.230 20.937 0 10  SER A CB  1 ? 
ATOM   84   O OG  A SER A 1 10  ? -3.277  -25.183 -20.009 0.770 21.413 0 10  SER A OG  1 ? 
ATOM   85   O OG  B SER A 1 10  ? -1.806  -26.457 -20.470 0.230 22.111 0 10  SER A OG  1 ? 
ATOM   86   N N   . TYR A 1 11  ? -2.088  -21.953 -20.068 1.000 17.590 0 11  TYR A N   1 ? 
ATOM   87   C CA  . TYR A 1 11  ? -2.744  -20.675 -20.124 1.000 18.438 0 11  TYR A CA  1 ? 
ATOM   88   C C   . TYR A 1 11  ? -1.704  -19.575 -19.913 1.000 16.649 0 11  TYR A C   1 ? 
ATOM   89   O O   . TYR A 1 11  ? -0.639  -19.818 -19.339 1.000 18.000 0 11  TYR A O   1 ? 
ATOM   90   C CB  . TYR A 1 11  ? -3.821  -20.650 -19.030 1.000 21.142 0 11  TYR A CB  1 ? 
ATOM   91   C CG  . TYR A 1 11  ? -3.426  -21.099 -17.644 1.000 19.728 0 11  TYR A CG  1 ? 
ATOM   92   C CD1 . TYR A 1 11  ? -2.842  -20.218 -16.726 1.000 20.516 0 11  TYR A CD1 1 ? 
ATOM   93   C CD2 . TYR A 1 11  ? -3.611  -22.416 -17.240 1.000 19.994 0 11  TYR A CD2 1 ? 
ATOM   94   C CE1 . TYR A 1 11  ? -2.441  -20.643 -15.476 1.000 22.155 0 11  TYR A CE1 1 ? 
ATOM   95   C CE2 . TYR A 1 11  ? -3.230  -22.836 -15.985 1.000 19.382 0 11  TYR A CE2 1 ? 
ATOM   96   C CZ  . TYR A 1 11  ? -2.695  -21.934 -15.077 1.000 19.805 0 11  TYR A CZ  1 ? 
ATOM   97   O OH  . TYR A 1 11  ? -2.319  -22.415 -13.849 1.000 22.231 0 11  TYR A OH  1 ? 
ATOM   98   N N   . THR A 1 12  ? -2.060  -18.378 -20.348 1.000 16.322 0 12  THR A N   1 ? 
ATOM   99   C CA  . THR A 1 12  ? -1.266  -17.176 -20.173 1.000 16.958 0 12  THR A CA  1 ? 
ATOM   100  C C   . THR A 1 12  ? -1.233  -16.813 -18.702 1.000 16.713 0 12  THR A C   1 ? 
ATOM   101  O O   . THR A 1 12  ? -2.243  -16.890 -18.004 1.000 18.524 0 12  THR A O   1 ? 
ATOM   102  C CB  . THR A 1 12  ? -1.803  -16.012 -21.002 1.000 18.982 0 12  THR A CB  1 ? 
ATOM   103  O OG1 . THR A 1 12  ? -1.823  -16.463 -22.356 1.000 19.417 0 12  THR A OG1 1 ? 
ATOM   104  C CG2 . THR A 1 12  ? -0.956  -14.762 -20.902 1.000 18.658 0 12  THR A CG2 1 ? 
ATOM   105  N N   . VAL A 1 13  ? -0.056  -16.388 -18.251 1.000 15.775 0 13  VAL A N   1 ? 
ATOM   106  C CA  . VAL A 1 13  ? 0.085   -15.806 -16.932 1.000 15.991 0 13  VAL A CA  1 ? 
ATOM   107  C C   . VAL A 1 13  ? 0.778   -14.474 -17.093 1.000 16.902 0 13  VAL A C   1 ? 
ATOM   108  O O   . VAL A 1 13  ? 1.489   -14.253 -18.073 1.000 19.069 0 13  VAL A O   1 ? 
ATOM   109  C CB  . VAL A 1 13  ? 0.820   -16.659 -15.898 1.000 17.725 0 13  VAL A CB  1 ? 
ATOM   110  C CG1 . VAL A 1 13  ? 0.135   -18.023 -15.688 1.000 18.224 0 13  VAL A CG1 1 ? 
ATOM   111  C CG2 . VAL A 1 13  ? 2.287   -16.766 -16.229 1.000 19.073 0 13  VAL A CG2 1 ? 
ATOM   112  N N   . TRP A 1 14  ? 0.561   -13.598 -16.112 1.000 14.681 0 14  TRP A N   1 ? 
ATOM   113  C CA  . TRP A 1 14  ? 1.274   -12.349 -16.037 1.000 14.134 0 14  TRP A CA  1 ? 
ATOM   114  C C   . TRP A 1 14  ? 2.194   -12.386 -14.831 1.000 15.395 0 14  TRP A C   1 ? 
ATOM   115  O O   . TRP A 1 14  ? 1.778   -12.292 -13.671 1.000 15.655 0 14  TRP A O   1 ? 
ATOM   116  C CB  . TRP A 1 14  ? 0.303   -11.170 -16.003 1.000 15.026 0 14  TRP A CB  1 ? 
ATOM   117  C CG  . TRP A 1 14  ? -0.432  -10.937 -17.286 1.000 14.568 0 14  TRP A CG  1 ? 
ATOM   118  C CD1 . TRP A 1 14  ? -0.122  -9.978  -18.206 1.000 17.899 0 14  TRP A CD1 1 ? 
ATOM   119  C CD2 . TRP A 1 14  ? -1.536  -11.670 -17.830 1.000 16.691 0 14  TRP A CD2 1 ? 
ATOM   120  N NE1 . TRP A 1 14  ? -0.979  -10.034 -19.270 1.000 18.971 0 14  TRP A NE1 1 ? 
ATOM   121  C CE2 . TRP A 1 14  ? -1.840  -11.072 -19.094 1.000 17.319 0 14  TRP A CE2 1 ? 
ATOM   122  C CE3 . TRP A 1 14  ? -2.305  -12.732 -17.374 1.000 17.906 0 14  TRP A CE3 1 ? 
ATOM   123  C CZ2 . TRP A 1 14  ? -2.928  -11.476 -19.870 1.000 19.428 0 14  TRP A CZ2 1 ? 
ATOM   124  C CZ3 . TRP A 1 14  ? -3.318  -13.194 -18.200 1.000 19.305 0 14  TRP A CZ3 1 ? 
ATOM   125  C CH2 . TRP A 1 14  ? -3.611  -12.576 -19.421 1.000 19.770 0 14  TRP A CH2 1 ? 
ATOM   126  N N   . ALA A 1 15  ? 3.473   -12.664 -15.115 1.000 14.013 0 15  ALA A N   1 ? 
ATOM   127  C CA  . ALA A 1 15  ? 4.467   -12.751 -14.057 1.000 14.022 0 15  ALA A CA  1 ? 
ATOM   128  C C   . ALA A 1 15  ? 4.649   -11.377 -13.419 1.000 14.561 0 15  ALA A C   1 ? 
ATOM   129  O O   . ALA A 1 15  ? 4.440   -10.337 -14.055 1.000 14.953 0 15  ALA A O   1 ? 
ATOM   130  C CB  . ALA A 1 15  ? 5.774   -13.284 -14.581 1.000 16.603 0 15  ALA A CB  1 ? 
ATOM   131  N N   . ALA A 1 16  ? 5.012   -11.396 -12.142 1.000 15.270 0 16  ALA A N   1 ? 
ATOM   132  C CA  . ALA A 1 16  ? 5.266   -10.199 -11.351 1.000 16.294 0 16  ALA A CA  1 ? 
ATOM   133  C C   . ALA A 1 16  ? 6.478   -10.442 -10.481 1.000 16.069 0 16  ALA A C   1 ? 
ATOM   134  O O   . ALA A 1 16  ? 6.716   -11.565 -10.023 1.000 16.525 0 16  ALA A O   1 ? 
ATOM   135  C CB  . ALA A 1 16  ? 4.079   -9.893  -10.474 1.000 16.658 0 16  ALA A CB  1 ? 
ATOM   136  N N   . ALA A 1 17  ? 7.259   -9.365  -10.250 1.000 16.022 0 17  ALA A N   1 ? 
ATOM   137  C CA  . ALA A 1 17  ? 8.419   -9.454  -9.401  1.000 16.594 0 17  ALA A CA  1 ? 
ATOM   138  C C   . ALA A 1 17  ? 8.609   -8.120  -8.687  1.000 18.018 0 17  ALA A C   1 ? 
ATOM   139  O O   . ALA A 1 17  ? 8.658   -7.086  -9.351  1.000 18.807 0 17  ALA A O   1 ? 
ATOM   140  C CB  . ALA A 1 17  ? 9.644   -9.771  -10.220 1.000 19.938 0 17  ALA A CB  1 ? 
ATOM   141  N N   . SER A 1 18  ? 8.646   -8.177  -7.361  1.000 16.582 0 18  SER A N   1 ? 
ATOM   142  C CA  . SER A 1 18  ? 8.646   -6.980  -6.523  1.000 19.050 0 18  SER A CA  1 ? 
ATOM   143  C C   . SER A 1 18  ? 9.405   -7.262  -5.232  1.000 20.533 0 18  SER A C   1 ? 
ATOM   144  O O   . SER A 1 18  ? 9.467   -8.397  -4.800  1.000 18.614 0 18  SER A O   1 ? 
ATOM   145  C CB  . SER A 1 18  ? 7.211   -6.547  -6.246  1.000 21.109 0 18  SER A CB  1 ? 
ATOM   146  O OG  . SER A 1 18  ? 7.102   -5.433  -5.359  1.000 26.001 0 18  SER A OG  1 ? 
ATOM   147  N N   . LYS A 1 19  ? 9.902   -6.195  -4.573  1.000 21.796 0 19  LYS A N   1 ? 
ATOM   148  C CA  . LYS A 1 19  ? 10.346  -6.328  -3.183  1.000 23.609 0 19  LYS A CA  1 ? 
ATOM   149  C C   . LYS A 1 19  ? 9.440   -5.535  -2.236  1.000 26.973 0 19  LYS A C   1 ? 
ATOM   150  O O   . LYS A 1 19  ? 9.829   -5.308  -1.093  1.000 28.310 0 19  LYS A O   1 ? 
ATOM   151  C CB  . LYS A 1 19  ? 11.848  -6.017  -3.038  1.000 25.783 0 19  LYS A CB  1 ? 
ATOM   152  C CG  . LYS A 1 19  ? 12.236  -4.589  -3.473  1.000 29.264 0 19  LYS A CG  1 ? 
ATOM   153  C CD  . LYS A 1 19  ? 13.698  -4.283  -3.159  1.000 34.132 0 19  LYS A CD  1 ? 
ATOM   154  C CE  . LYS A 1 19  ? 14.013  -2.827  -3.244  1.000 43.164 0 19  LYS A CE  1 ? 
ATOM   155  N NZ  . LYS A 1 19  ? 13.658  -2.180  -1.976  1.000 42.060 0 19  LYS A NZ  1 ? 
ATOM   156  N N   . GLY A 1 20  ? 8.218   -5.194  -2.658  1.000 23.411 0 20  GLY A N   1 ? 
ATOM   157  C CA  . GLY A 1 20  ? 7.194   -4.674  -1.747  1.000 27.565 0 20  GLY A CA  1 ? 
ATOM   158  C C   . GLY A 1 20  ? 7.076   -3.153  -1.843  1.000 28.610 0 20  GLY A C   1 ? 
ATOM   159  O O   . GLY A 1 20  ? 5.973   -2.633  -1.848  1.000 29.458 0 20  GLY A O   1 ? 
ATOM   160  N N   . ASP A 1 21  ? 8.224   -2.482  -2.015  1.000 31.427 0 21  ASP A N   1 ? 
ATOM   161  C CA  . ASP A 1 21  ? 8.264   -1.033  -2.153  1.000 35.367 0 21  ASP A CA  1 ? 
ATOM   162  C C   . ASP A 1 21  ? 8.826   -0.616  -3.504  1.000 34.049 0 21  ASP A C   1 ? 
ATOM   163  O O   . ASP A 1 21  ? 8.992   0.566   -3.737  1.000 34.300 0 21  ASP A O   1 ? 
ATOM   164  C CB  . ASP A 1 21  ? 9.067   -0.429  -1.006  1.000 38.593 0 21  ASP A CB  1 ? 
ATOM   165  C CG  . ASP A 1 21  ? 10.551  -0.773  -0.978  1.000 46.540 0 21  ASP A CG  1 ? 
ATOM   166  O OD1 . ASP A 1 21  ? 10.966  -1.742  -1.659  1.000 36.236 0 21  ASP A OD1 1 ? 
ATOM   167  O OD2 . ASP A 1 21  ? 11.303  -0.022  -0.317  1.000 52.668 0 21  ASP A OD2 1 ? 
ATOM   168  N N   . ALA A 1 22  ? 9.108   -1.572  -4.404  1.000 28.385 0 22  ALA A N   1 ? 
ATOM   169  C CA  . ALA A 1 22  ? 9.648   -1.284  -5.720  1.000 24.633 0 22  ALA A CA  1 ? 
ATOM   170  C C   . ALA A 1 22  ? 9.533   -2.535  -6.602  1.000 22.495 0 22  ALA A C   1 ? 
ATOM   171  O O   . ALA A 1 22  ? 9.647   -3.652  -6.101  1.000 22.670 0 22  ALA A O   1 ? 
ATOM   172  C CB  . ALA A 1 22  ? 11.104  -0.903  -5.644  1.000 25.646 0 22  ALA A CB  1 ? 
ATOM   173  N N   . ALA A 1 23  ? 9.472   -2.306  -7.909  1.000 22.686 0 23  ALA A N   1 ? 
ATOM   174  C CA  . ALA A 1 23  ? 9.597   -3.375  -8.878  1.000 22.792 0 23  ALA A CA  1 ? 
ATOM   175  C C   . ALA A 1 23  ? 10.988  -3.987  -8.815  1.000 26.309 0 23  ALA A C   1 ? 
ATOM   176  O O   . ALA A 1 23  ? 11.962  -3.303  -8.508  1.000 25.098 0 23  ALA A O   1 ? 
ATOM   177  C CB  . ALA A 1 23  ? 9.319   -2.850  -10.251 1.000 24.946 0 23  ALA A CB  1 ? 
ATOM   178  N N   . LEU A 1 24  ? 11.069  -5.281  -9.142  1.000 20.379 0 24  LEU A N   1 ? 
ATOM   179  C CA  . LEU A 1 24  ? 12.309  -5.888  -9.558  1.000 20.613 0 24  LEU A CA  1 ? 
ATOM   180  C C   . LEU A 1 24  ? 12.321  -5.954  -11.082 1.000 22.543 0 24  LEU A C   1 ? 
ATOM   181  O O   . LEU A 1 24  ? 11.397  -6.456  -11.710 1.000 21.660 0 24  LEU A O   1 ? 
ATOM   182  C CB  . LEU A 1 24  ? 12.499  -7.272  -8.951  1.000 22.072 0 24  LEU A CB  1 ? 
ATOM   183  C CG  . LEU A 1 24  ? 12.473  -7.332  -7.423  1.000 24.060 0 24  LEU A CG  1 ? 
ATOM   184  C CD1 . LEU A 1 24  ? 12.519  -8.779  -7.008  1.000 24.797 0 24  LEU A CD1 1 ? 
ATOM   185  C CD2 . LEU A 1 24  ? 13.597  -6.525  -6.830  1.000 25.386 0 24  LEU A CD2 1 ? 
ATOM   186  N N   . ASP A 1 25  ? 13.413  -5.464  -11.688 1.000 22.099 0 25  ASP A N   1 ? 
ATOM   187  C CA  . ASP A 1 25  ? 13.483  -5.365  -13.137 1.000 22.212 0 25  ASP A CA  1 ? 
ATOM   188  C C   . ASP A 1 25  ? 12.253  -4.577  -13.591 1.000 21.691 0 25  ASP A C   1 ? 
ATOM   189  O O   . ASP A 1 25  ? 11.882  -3.591  -12.989 1.000 23.970 0 25  ASP A O   1 ? 
ATOM   190  C CB  . ASP A 1 25  ? 13.683  -6.737  -13.750 1.000 23.055 0 25  ASP A CB  1 ? 
ATOM   191  C CG  . ASP A 1 25  ? 14.214  -6.798  -15.184 1.000 26.487 0 25  ASP A CG  1 ? 
ATOM   192  O OD1 . ASP A 1 25  ? 13.434  -6.490  -16.114 1.000 27.132 0 25  ASP A OD1 1 ? 
ATOM   193  O OD2 . ASP A 1 25  ? 15.346  -7.279  -15.351 1.000 26.273 0 25  ASP A OD2 1 ? 
ATOM   194  N N   . ALA A 1 26  ? 11.610  -5.002  -14.668 1.000 21.467 0 26  ALA A N   1 ? 
ATOM   195  C CA  . ALA A 1 26  ? 10.435  -4.325  -15.185 1.000 22.121 0 26  ALA A CA  1 ? 
ATOM   196  C C   . ALA A 1 26  ? 9.231   -4.537  -14.270 1.000 22.999 0 26  ALA A C   1 ? 
ATOM   197  O O   . ALA A 1 26  ? 8.247   -3.833  -14.382 1.000 26.986 0 26  ALA A O   1 ? 
ATOM   198  C CB  . ALA A 1 26  ? 10.169  -4.788  -16.613 1.000 25.492 0 26  ALA A CB  1 ? 
ATOM   199  N N   . GLY A 1 27  ? 9.275   -5.500  -13.355 1.000 21.658 0 27  GLY A N   1 ? 
ATOM   200  C CA  . GLY A 1 27  ? 8.168   -5.634  -12.413 1.000 19.255 0 27  GLY A CA  1 ? 
ATOM   201  C C   . GLY A 1 27  ? 7.055   -6.580  -12.868 1.000 20.798 0 27  GLY A C   1 ? 
ATOM   202  O O   . GLY A 1 27  ? 6.306   -7.096  -12.026 1.000 19.100 0 27  GLY A O   1 ? 
ATOM   203  N N   . GLY A 1 28  ? 6.835   -6.717  -14.168 1.000 18.069 0 28  GLY A N   1 ? 
ATOM   204  C CA  . GLY A 1 28  ? 5.801   -7.624  -14.642 1.000 17.383 0 28  GLY A CA  1 ? 
ATOM   205  C C   . GLY A 1 28  ? 5.809   -7.744  -16.148 1.000 18.438 0 28  GLY A C   1 ? 
ATOM   206  O O   . GLY A 1 28  ? 6.343   -6.873  -16.832 1.000 19.848 0 28  GLY A O   1 ? 
ATOM   207  N N   . ARG A 1 29  ? 5.231   -8.856  -16.645 1.000 16.275 0 29  ARG A N   1 ? 
ATOM   208  C CA  . ARG A 1 29  ? 5.188   -9.097  -18.060 1.000 18.963 0 29  ARG A CA  1 ? 
ATOM   209  C C   . ARG A 1 29  ? 4.217   -10.235 -18.316 1.000 17.771 0 29  ARG A C   1 ? 
ATOM   210  O O   . ARG A 1 29  ? 4.079   -11.164 -17.527 1.000 17.952 0 29  ARG A O   1 ? 
ATOM   211  C CB  . ARG A 1 29  ? 6.572   -9.480  -18.583 1.000 21.950 0 29  ARG A CB  1 ? 
ATOM   212  C CG  . ARG A 1 29  ? 6.758   -8.950  -19.990 1.000 24.687 0 29  ARG A CG  1 ? 
ATOM   213  C CD  . ARG A 1 29  ? 7.845   -9.737  -20.686 1.000 24.697 0 29  ARG A CD  1 ? 
ATOM   214  N NE  . ARG A 1 29  ? 7.358   -11.024 -21.164 1.000 22.162 0 29  ARG A NE  1 ? 
ATOM   215  C CZ  . ARG A 1 29  ? 8.030   -11.797 -22.000 1.000 23.532 0 29  ARG A CZ  1 ? 
ATOM   216  N NH1 . ARG A 1 29  ? 9.325   -11.568 -22.174 1.000 23.434 0 29  ARG A NH1 1 ? 
ATOM   217  N NH2 . ARG A 1 29  ? 7.422   -12.857 -22.554 1.000 22.455 0 29  ARG A NH2 1 ? 
ATOM   218  N N   . GLN A 1 30  ? 3.600   -10.164 -19.480 1.000 17.085 0 30  GLN A N   1 ? 
ATOM   219  C CA  . GLN A 1 30  ? 2.802   -11.264 -19.977 1.000 15.970 0 30  GLN A CA  1 ? 
ATOM   220  C C   . GLN A 1 30  ? 3.700   -12.409 -20.449 1.000 16.739 0 30  GLN A C   1 ? 
ATOM   221  O O   . GLN A 1 30  ? 4.712   -12.204 -21.119 1.000 17.636 0 30  GLN A O   1 ? 
ATOM   222  C CB  . GLN A 1 30  ? 1.932   -10.791 -21.149 1.000 17.376 0 30  GLN A CB  1 ? 
ATOM   223  C CG  . GLN A 1 30  ? 0.985   -11.857 -21.674 1.000 18.733 0 30  GLN A CG  1 ? 
ATOM   224  C CD  . GLN A 1 30  ? 0.030   -11.350 -22.739 1.000 22.039 0 30  GLN A CD  1 ? 
ATOM   225  O OE1 . GLN A 1 30  ? -0.512  -10.248 -22.632 1.000 26.423 0 30  GLN A OE1 1 ? 
ATOM   226  N NE2 . GLN A 1 30  ? -0.176  -12.153 -23.765 1.000 23.955 0 30  GLN A NE2 1 ? 
ATOM   227  N N   . LEU A 1 31  ? 3.330   -13.638 -20.050 1.000 15.253 0 31  LEU A N   1 ? 
ATOM   228  C CA  . LEU A 1 31  ? 4.011   -14.848 -20.491 1.000 15.053 0 31  LEU A CA  1 ? 
ATOM   229  C C   . LEU A 1 31  ? 2.941   -15.758 -21.081 1.000 15.682 0 31  LEU A C   1 ? 
ATOM   230  O O   . LEU A 1 31  ? 2.164   -16.415 -20.368 1.000 15.652 0 31  LEU A O   1 ? 
ATOM   231  C CB  . LEU A 1 31  ? 4.753   -15.616 -19.396 1.000 16.401 0 31  LEU A CB  1 ? 
ATOM   232  C CG  . LEU A 1 31  ? 5.967   -14.946 -18.773 1.000 22.950 0 31  LEU A CG  1 ? 
ATOM   233  C CD1 . LEU A 1 31  ? 6.435   -15.789 -17.618 1.000 26.526 0 31  LEU A CD1 1 ? 
ATOM   234  C CD2 . LEU A 1 31  ? 7.067   -14.829 -19.764 1.000 26.154 0 31  LEU A CD2 1 ? 
ATOM   235  N N   . ASN A 1 32  ? 2.936   -15.907 -22.404 1.000 16.358 0 32  ASN A N   1 ? 
ATOM   236  C CA  . ASN A 1 32  ? 2.144   -16.949 -23.017 1.000 15.994 0 32  ASN A CA  1 ? 
ATOM   237  C C   . ASN A 1 32  ? 2.747   -18.305 -22.689 1.000 15.497 0 32  ASN A C   1 ? 
ATOM   238  O O   . ASN A 1 32  ? 3.869   -18.411 -22.184 1.000 16.139 0 32  ASN A O   1 ? 
ATOM   239  C CB  . ASN A 1 32  ? 2.061   -16.714 -24.513 1.000 18.337 0 32  ASN A CB  1 ? 
ATOM   240  C CG  . ASN A 1 32  ? 1.320   -15.431 -24.835 1.000 22.163 0 32  ASN A CG  1 ? 
ATOM   241  O OD1 . ASN A 1 32  ? 0.395   -15.054 -24.122 1.000 27.315 0 32  ASN A OD1 1 ? 
ATOM   242  N ND2 . ASN A 1 32  ? 1.710   -14.718 -25.872 1.000 31.087 0 32  ASN A ND2 1 ? 
ATOM   243  N N   . SER A 1 33  ? 1.956   -19.361 -22.921 1.000 15.596 0 33  SER A N   1 ? 
ATOM   244  C CA  . SER A 1 33  ? 2.359   -20.732 -22.694 1.000 15.673 0 33  SER A CA  1 ? 
ATOM   245  C C   . SER A 1 33  ? 3.662   -21.027 -23.426 1.000 15.690 0 33  SER A C   1 ? 
ATOM   246  O O   . SER A 1 33  ? 3.725   -20.907 -24.664 1.000 15.260 0 33  SER A O   1 ? 
ATOM   247  C CB  . SER A 1 33  ? 1.283   -21.697 -23.167 1.000 17.108 0 33  SER A CB  1 ? 
ATOM   248  O OG  . SER A 1 33  ? 1.744   -23.013 -22.963 1.000 18.178 0 33  SER A OG  1 ? 
ATOM   249  N N   . GLY A 1 34  ? 4.674   -21.387 -22.640 1.000 14.932 0 34  GLY A N   1 ? 
ATOM   250  C CA  . GLY A 1 34  ? 5.998   -21.689 -23.119 1.000 15.905 0 34  GLY A CA  1 ? 
ATOM   251  C C   . GLY A 1 34  ? 7.006   -20.557 -23.067 1.000 16.103 0 34  GLY A C   1 ? 
ATOM   252  O O   . GLY A 1 34  ? 8.202   -20.827 -23.256 1.000 16.294 0 34  GLY A O   1 ? 
ATOM   253  N N   . GLU A 1 35  ? 6.557   -19.321 -22.867 1.000 15.198 0 35  GLU A N   1 ? 
ATOM   254  C CA  . GLU A 1 35  ? 7.473   -18.191 -22.885 1.000 15.265 0 35  GLU A CA  1 ? 
ATOM   255  C C   . GLU A 1 35  ? 8.332   -18.131 -21.626 1.000 15.271 0 35  GLU A C   1 ? 
ATOM   256  O O   . GLU A 1 35  ? 7.945   -18.573 -20.524 1.000 15.894 0 35  GLU A O   1 ? 
ATOM   257  C CB  . GLU A 1 35  ? 6.727   -16.866 -23.063 1.000 15.627 0 35  GLU A CB  1 ? 
ATOM   258  C CG  . GLU A 1 35  ? 6.176   -16.702 -24.489 1.000 15.904 0 35  GLU A CG  1 ? 
ATOM   259  C CD  . GLU A 1 35  ? 5.558   -15.356 -24.781 1.000 18.602 0 35  GLU A CD  1 ? 
ATOM   260  O OE1 . GLU A 1 35  ? 5.091   -14.668 -23.852 1.000 17.257 0 35  GLU A OE1 1 ? 
ATOM   261  O OE2 . GLU A 1 35  ? 5.610   -14.976 -25.980 1.000 22.018 0 35  GLU A OE2 1 ? 
ATOM   262  N N   . SER A 1 36  ? 9.504   -17.531 -21.796 1.000 15.441 0 36  SER A N   1 ? 
ATOM   263  C CA  . SER A 1 36  ? 10.508  -17.368 -20.759 1.000 17.370 0 36  SER A CA  1 ? 
ATOM   264  C C   . SER A 1 36  ? 10.880  -15.896 -20.684 1.000 19.313 0 36  SER A C   1 ? 
ATOM   265  O O   . SER A 1 36  ? 11.017  -15.228 -21.697 1.000 19.045 0 36  SER A O   1 ? 
ATOM   266  C CB  . SER A 1 36  ? 11.758  -18.169 -21.057 1.000 18.878 0 36  SER A CB  1 ? 
ATOM   267  O OG  . SER A 1 36  ? 11.475  -19.549 -21.175 1.000 17.526 0 36  SER A OG  1 ? 
ATOM   268  N N   . TRP A 1 37  ? 11.040  -15.398 -19.467 1.000 17.515 0 37  TRP A N   1 ? 
ATOM   269  C CA  . TRP A 1 37  ? 11.367  -14.004 -19.230 1.000 18.026 0 37  TRP A CA  1 ? 
ATOM   270  C C   . TRP A 1 37  ? 12.560  -13.996 -18.277 1.000 19.491 0 37  TRP A C   1 ? 
ATOM   271  O O   . TRP A 1 37  ? 12.508  -14.612 -17.222 1.000 18.585 0 37  TRP A O   1 ? 
ATOM   272  C CB  . TRP A 1 37  ? 10.166  -13.269 -18.642 1.000 19.471 0 37  TRP A CB  1 ? 
ATOM   273  C CG  . TRP A 1 37  ? 10.379  -11.842 -18.227 1.000 20.166 0 37  TRP A CG  1 ? 
ATOM   274  C CD1 . TRP A 1 37  ? 11.123  -10.889 -18.850 1.000 23.346 0 37  TRP A CD1 1 ? 
ATOM   275  C CD2 . TRP A 1 37  ? 9.784   -11.202 -17.077 1.000 20.812 0 37  TRP A CD2 1 ? 
ATOM   276  N NE1 . TRP A 1 37  ? 10.960  -9.683  -18.199 1.000 24.120 0 37  TRP A NE1 1 ? 
ATOM   277  C CE2 . TRP A 1 37  ? 10.172  -9.837  -17.112 1.000 21.920 0 37  TRP A CE2 1 ? 
ATOM   278  C CE3 . TRP A 1 37  ? 8.965   -11.635 -16.041 1.000 21.483 0 37  TRP A CE3 1 ? 
ATOM   279  C CZ2 . TRP A 1 37  ? 9.776   -8.927  -16.130 1.000 21.873 0 37  TRP A CZ2 1 ? 
ATOM   280  C CZ3 . TRP A 1 37  ? 8.604   -10.743 -15.049 1.000 24.908 0 37  TRP A CZ3 1 ? 
ATOM   281  C CH2 . TRP A 1 37  ? 8.990   -9.406  -15.108 1.000 23.708 0 37  TRP A CH2 1 ? 
ATOM   282  N N   . THR A 1 38  ? 13.660  -13.357 -18.704 1.000 19.800 0 38  THR A N   1 ? 
ATOM   283  C CA  . THR A 1 38  ? 14.851  -13.298 -17.878 1.000 21.531 0 38  THR A CA  1 ? 
ATOM   284  C C   . THR A 1 38  ? 14.930  -11.903 -17.255 1.000 19.754 0 38  THR A C   1 ? 
ATOM   285  O O   . THR A 1 38  ? 14.822  -10.888 -17.953 1.000 22.080 0 38  THR A O   1 ? 
ATOM   286  C CB  . THR A 1 38  ? 16.069  -13.619 -18.753 1.000 27.617 0 38  THR A CB  1 ? 
ATOM   287  O OG1 . THR A 1 38  ? 15.964  -14.964 -19.224 1.000 27.957 0 38  THR A OG1 1 ? 
ATOM   288  C CG2 . THR A 1 38  ? 17.358  -13.502 -17.969 1.000 30.389 0 38  THR A CG2 1 ? 
ATOM   289  N N   . ILE A 1 39  ? 15.054  -11.874 -15.930 1.000 19.707 0 39  ILE A N   1 ? 
ATOM   290  C CA  . ILE A 1 39  ? 15.179  -10.647 -15.166 1.000 19.580 0 39  ILE A CA  1 ? 
ATOM   291  C C   . ILE A 1 39  ? 16.490  -10.667 -14.403 1.000 20.470 0 39  ILE A C   1 ? 
ATOM   292  O O   . ILE A 1 39  ? 17.030  -11.711 -14.077 1.000 21.160 0 39  ILE A O   1 ? 
ATOM   293  C CB  . ILE A 1 39  ? 13.991  -10.411 -14.226 1.000 20.511 0 39  ILE A CB  1 ? 
ATOM   294  C CG1 . ILE A 1 39  ? 13.910  -11.418 -13.141 1.000 20.525 0 39  ILE A CG1 1 ? 
ATOM   295  C CG2 . ILE A 1 39  ? 12.698  -10.319 -15.039 1.000 24.064 0 39  ILE A CG2 1 ? 
ATOM   296  C CD1 . ILE A 1 39  ? 12.932  -11.050 -12.031 1.000 21.689 0 39  ILE A CD1 1 ? 
ATOM   297  N N   . ASN A 1 40  ? 16.986  -9.454  -14.123 1.000 23.030 0 40  ASN A N   1 ? 
ATOM   298  C CA  . ASN A 1 40  ? 18.155  -9.283  -13.290 1.000 21.838 0 40  ASN A CA  1 ? 
ATOM   299  C C   . ASN A 1 40  ? 17.699  -8.630  -12.002 1.000 21.014 0 40  ASN A C   1 ? 
ATOM   300  O O   . ASN A 1 40  ? 17.008  -7.614  -12.048 1.000 25.174 0 40  ASN A O   1 ? 
ATOM   301  C CB  . ASN A 1 40  ? 19.166  -8.369  -13.992 1.000 27.927 0 40  ASN A CB  1 ? 
ATOM   302  C CG  . ASN A 1 40  ? 19.786  -9.094  -15.163 1.000 40.676 0 40  ASN A CG  1 ? 
ATOM   303  O OD1 . ASN A 1 40  ? 20.532  -10.068 -14.978 1.000 46.741 0 40  ASN A OD1 1 ? 
ATOM   304  N ND2 . ASN A 1 40  ? 19.383  -8.729  -16.373 1.000 49.681 0 40  ASN A ND2 1 ? 
ATOM   305  N N   . VAL A 1 41  ? 18.109  -9.227  -10.894 1.000 22.065 0 41  VAL A N   1 ? 
ATOM   306  C CA  . VAL A 1 41  ? 17.793  -8.763  -9.561  1.000 23.380 0 41  VAL A CA  1 ? 
ATOM   307  C C   . VAL A 1 41  ? 19.106  -8.323  -8.928  1.000 23.678 0 41  VAL A C   1 ? 
ATOM   308  O O   . VAL A 1 41  ? 20.061  -9.081  -8.943  1.000 24.419 0 41  VAL A O   1 ? 
ATOM   309  C CB  . VAL A 1 41  ? 17.127  -9.896  -8.779  1.000 22.746 0 41  VAL A CB  1 ? 
ATOM   310  C CG1 . VAL A 1 41  ? 16.855  -9.468  -7.349  1.000 24.961 0 41  VAL A CG1 1 ? 
ATOM   311  C CG2 . VAL A 1 41  ? 15.833  -10.354 -9.445  1.000 23.935 0 41  VAL A CG2 1 ? 
ATOM   312  N N   . GLU A 1 42  ? 19.108  -7.112  -8.367  1.000 23.463 0 42  GLU A N   1 ? 
ATOM   313  C CA  . GLU A 1 42  ? 20.324  -6.563  -7.772  1.000 24.292 0 42  GLU A CA  1 ? 
ATOM   314  C C   . GLU A 1 42  ? 20.790  -7.438  -6.618  1.000 24.203 0 42  GLU A C   1 ? 
ATOM   315  O O   . GLU A 1 42  ? 20.004  -7.892  -5.771  1.000 22.805 0 42  GLU A O   1 ? 
ATOM   316  C CB  . GLU A 1 42  ? 20.101  -5.133  -7.288  1.000 29.570 0 42  GLU A CB  1 ? 
ATOM   317  C CG  . GLU A 1 42  ? 21.440  -4.409  -7.121  1.000 39.778 0 42  GLU A CG  1 ? 
ATOM   318  C CD  . GLU A 1 42  ? 21.456  -3.027  -6.503  0.230 39.769 0 42  GLU A CD  1 ? 
ATOM   319  O OE1 . GLU A 1 42  ? 22.512  -2.380  -6.668  0.690 43.591 0 42  GLU A OE1 1 ? 
ATOM   320  O OE2 . GLU A 1 42  ? 20.483  -2.618  -5.841  0.620 41.070 0 42  GLU A OE2 1 ? 
ATOM   321  N N   . PRO A 1 43  ? 22.105  -7.704  -6.507  1.000 24.559 0 43  PRO A N   1 ? 
ATOM   322  C CA  . PRO A 1 43  ? 22.639  -8.373  -5.331  1.000 22.962 0 43  PRO A CA  1 ? 
ATOM   323  C C   . PRO A 1 43  ? 22.235  -7.600  -4.080  1.000 22.294 0 43  PRO A C   1 ? 
ATOM   324  O O   . PRO A 1 43  ? 22.058  -6.383  -4.114  1.000 24.158 0 43  PRO A O   1 ? 
ATOM   325  C CB  . PRO A 1 43  ? 24.171  -8.363  -5.507  1.000 28.188 0 43  PRO A CB  1 ? 
ATOM   326  C CG  . PRO A 1 43  ? 24.382  -8.061  -6.973  1.000 27.697 0 43  PRO A CG  1 ? 
ATOM   327  C CD  . PRO A 1 43  ? 23.142  -7.357  -7.502  1.000 25.499 0 43  PRO A CD  1 ? 
ATOM   328  N N   . GLY A 1 44  ? 22.059  -8.345  -2.994  1.000 24.534 0 44  GLY A N   1 ? 
ATOM   329  C CA  . GLY A 1 44  ? 21.672  -7.765  -1.725  1.000 25.624 0 44  GLY A CA  1 ? 
ATOM   330  C C   . GLY A 1 44  ? 20.167  -7.558  -1.580  1.000 28.079 0 44  GLY A C   1 ? 
ATOM   331  O O   . GLY A 1 44  ? 19.746  -7.082  -0.536  1.000 26.758 0 44  GLY A O   1 ? 
ATOM   332  N N   . THR A 1 45  ? 19.366  -7.895  -2.609  1.000 22.382 0 45  THR A N   1 ? 
ATOM   333  C CA  . THR A 1 45  ? 17.920  -7.757  -2.500  1.000 23.545 0 45  THR A CA  1 ? 
ATOM   334  C C   . THR A 1 45  ? 17.402  -8.639  -1.360  1.000 21.899 0 45  THR A C   1 ? 
ATOM   335  O O   . THR A 1 45  ? 17.650  -9.840  -1.314  1.000 22.899 0 45  THR A O   1 ? 
ATOM   336  C CB  . THR A 1 45  ? 17.277  -8.116  -3.830  1.000 24.694 0 45  THR A CB  1 ? 
ATOM   337  O OG1 . THR A 1 45  ? 17.694  -7.149  -4.790  1.000 24.449 0 45  THR A OG1 1 ? 
ATOM   338  C CG2 . THR A 1 45  ? 15.762  -8.103  -3.768  1.000 26.009 0 45  THR A CG2 1 ? 
ATOM   339  N N   . ASN A 1 46  ? 16.662  -8.008  -0.439  1.000 21.237 0 46  ASN A N   1 ? 
ATOM   340  C CA  . ASN A 1 46  ? 16.068  -8.662  0.710   1.000 25.414 0 46  ASN A CA  1 ? 
ATOM   341  C C   . ASN A 1 46  ? 14.550  -8.615  0.541   1.000 21.872 0 46  ASN A C   1 ? 
ATOM   342  O O   . ASN A 1 46  ? 13.998  -7.568  0.227   1.000 24.157 0 46  ASN A O   1 ? 
ATOM   343  C CB  . ASN A 1 46  ? 16.452  -7.893  1.977   1.000 33.856 0 46  ASN A CB  1 ? 
ATOM   344  C CG  . ASN A 1 46  ? 16.521  -8.754  3.211   1.000 49.125 0 46  ASN A CG  1 ? 
ATOM   345  O OD1 . ASN A 1 46  ? 15.564  -9.457  3.554   1.000 61.193 0 46  ASN A OD1 1 ? 
ATOM   346  N ND2 . ASN A 1 46  ? 17.640  -8.679  3.913   1.000 62.953 0 46  ASN A ND2 1 ? 
ATOM   347  N N   . GLY A 1 47  ? 13.883  -9.763  0.620   1.000 22.379 0 47  GLY A N   1 ? 
ATOM   348  C CA  . GLY A 1 47  ? 12.423  -9.744  0.652   1.000 22.912 0 47  GLY A CA  1 ? 
ATOM   349  C C   . GLY A 1 47  ? 11.799  -9.635  -0.741  1.000 21.946 0 47  GLY A C   1 ? 
ATOM   350  O O   . GLY A 1 47  ? 10.727  -9.042  -0.952  1.000 22.690 0 47  GLY A O   1 ? 
ATOM   351  N N   . GLY A 1 48  ? 12.485  -10.176 -1.739  1.000 17.912 0 48  GLY A N   1 ? 
ATOM   352  C CA  . GLY A 1 48  ? 11.910  -10.226 -3.061  1.000 15.622 0 48  GLY A CA  1 ? 
ATOM   353  C C   . GLY A 1 48  ? 10.903  -11.374 -3.187  1.000 15.283 0 48  GLY A C   1 ? 
ATOM   354  O O   . GLY A 1 48  ? 11.046  -12.405 -2.550  1.000 17.981 0 48  GLY A O   1 ? 
ATOM   355  N N   . LYS A 1 49  ? 9.932   -11.165 -4.077  1.000 16.210 0 49  LYS A N   1 ? 
ATOM   356  C CA  . LYS A 1 49  ? 8.959   -12.208 -4.389  1.000 16.498 0 49  LYS A CA  1 ? 
ATOM   357  C C   . LYS A 1 49  ? 8.650   -12.188 -5.886  1.000 15.876 0 49  LYS A C   1 ? 
ATOM   358  O O   . LYS A 1 49  ? 8.629   -11.134 -6.525  1.000 16.669 0 49  LYS A O   1 ? 
ATOM   359  C CB  . LYS A 1 49  ? 7.677   -11.920 -3.615  1.000 15.644 0 49  LYS A CB  1 ? 
ATOM   360  C CG  . LYS A 1 49  ? 7.845   -11.908 -2.112  1.000 18.145 0 49  LYS A CG  1 ? 
ATOM   361  C CD  . LYS A 1 49  ? 6.544   -11.841 -1.338  1.000 21.158 0 49  LYS A CD  1 ? 
ATOM   362  C CE  . LYS A 1 49  ? 6.699   -11.365 0.092   1.000 21.899 0 49  LYS A CE  1 ? 
ATOM   363  N NZ  . LYS A 1 49  ? 7.492   -12.224 0.952   1.000 23.614 0 49  LYS A NZ  1 ? 
ATOM   364  N N   . ILE A 1 50  ? 8.389   -13.377 -6.419  1.000 13.951 0 50  ILE A N   1 ? 
ATOM   365  C CA  . ILE A 1 50  ? 7.898   -13.544 -7.777  1.000 14.570 0 50  ILE A CA  1 ? 
ATOM   366  C C   . ILE A 1 50  ? 6.620   -14.358 -7.661  1.000 14.430 0 50  ILE A C   1 ? 
ATOM   367  O O   . ILE A 1 50  ? 6.534   -15.301 -6.894  1.000 15.371 0 50  ILE A O   1 ? 
ATOM   368  C CB  . ILE A 1 50  ? 8.958   -14.279 -8.626  1.000 16.279 0 50  ILE A CB  1 ? 
ATOM   369  C CG1 . ILE A 1 50  ? 10.158  -13.356 -8.864  1.000 18.045 0 50  ILE A CG1 1 ? 
ATOM   370  C CG2 . ILE A 1 50  ? 8.334   -14.807 -9.920  1.000 17.118 0 50  ILE A CG2 1 ? 
ATOM   371  C CD1 . ILE A 1 50  ? 11.415  -14.057 -9.341  1.000 19.490 0 50  ILE A CD1 1 ? 
ATOM   372  N N   . TRP A 1 51  ? 5.644   -14.003 -8.463  1.000 15.025 0 51  TRP A N   1 ? 
ATOM   373  C CA  . TRP A 1 51  ? 4.374   -14.710 -8.505  1.000 14.923 0 51  TRP A CA  1 ? 
ATOM   374  C C   . TRP A 1 51  ? 3.777   -14.568 -9.886  1.000 15.808 0 51  TRP A C   1 ? 
ATOM   375  O O   . TRP A 1 51  ? 4.245   -13.761 -10.707 1.000 15.045 0 51  TRP A O   1 ? 
ATOM   376  C CB  . TRP A 1 51  ? 3.416   -14.194 -7.408  1.000 15.024 0 51  TRP A CB  1 ? 
ATOM   377  C CG  . TRP A 1 51  ? 2.874   -12.793 -7.553  1.000 14.450 0 51  TRP A CG  1 ? 
ATOM   378  C CD1 . TRP A 1 51  ? 1.651   -12.409 -8.013  1.000 14.983 0 51  TRP A CD1 1 ? 
ATOM   379  C CD2 . TRP A 1 51  ? 3.567   -11.560 -7.258  1.000 15.942 0 51  TRP A CD2 1 ? 
ATOM   380  N NE1 . TRP A 1 51  ? 1.505   -11.042 -7.946  1.000 16.221 0 51  TRP A NE1 1 ? 
ATOM   381  C CE2 . TRP A 1 51  ? 2.670   -10.505 -7.480  1.000 16.209 0 51  TRP A CE2 1 ? 
ATOM   382  C CE3 . TRP A 1 51  ? 4.840   -11.274 -6.763  1.000 16.734 0 51  TRP A CE3 1 ? 
ATOM   383  C CZ2 . TRP A 1 51  ? 3.019   -9.172  -7.297  1.000 17.168 0 51  TRP A CZ2 1 ? 
ATOM   384  C CZ3 . TRP A 1 51  ? 5.201   -9.949  -6.631  1.000 17.183 0 51  TRP A CZ3 1 ? 
ATOM   385  C CH2 . TRP A 1 51  ? 4.272   -8.932  -6.800  1.000 18.571 0 51  TRP A CH2 1 ? 
ATOM   386  N N   . ALA A 1 52  ? 2.753   -15.404 -10.118 1.000 14.170 0 52  ALA A N   1 ? 
ATOM   387  C CA  . ALA A 1 52  ? 1.941   -15.348 -11.320 1.000 13.698 0 52  ALA A CA  1 ? 
ATOM   388  C C   . ALA A 1 52  ? 0.616   -14.676 -11.008 1.000 12.994 0 52  ALA A C   1 ? 
ATOM   389  O O   . ALA A 1 52  ? 0.058   -14.797 -9.917  1.000 16.184 0 52  ALA A O   1 ? 
ATOM   390  C CB  . ALA A 1 52  ? 1.711   -16.723 -11.885 1.000 16.402 0 52  ALA A CB  1 ? 
ATOM   391  N N   . ARG A 1 53  ? 0.109   -13.955 -11.994 1.000 13.950 0 53  ARG A N   1 ? 
ATOM   392  C CA  . ARG A 1 53  ? -1.250  -13.441 -11.971 1.000 14.091 0 53  ARG A CA  1 ? 
ATOM   393  C C   . ARG A 1 53  ? -2.045  -14.077 -13.094 1.000 15.614 0 53  ARG A C   1 ? 
ATOM   394  O O   . ARG A 1 53  ? -1.508  -14.343 -14.173 1.000 15.781 0 53  ARG A O   1 ? 
ATOM   395  C CB  . ARG A 1 53  ? -1.211  -11.930 -12.200 1.000 14.492 0 53  ARG A CB  1 ? 
ATOM   396  C CG  . ARG A 1 53  ? -0.378  -11.273 -11.117 1.000 14.669 0 53  ARG A CG  1 ? 
ATOM   397  C CD  . ARG A 1 53  ? -0.141  -9.799  -11.439 1.000 16.483 0 53  ARG A CD  1 ? 
ATOM   398  N NE  . ARG A 1 53  ? 0.822   -9.659  -12.531 1.000 15.033 0 53  ARG A NE  1 ? 
ATOM   399  C CZ  . ARG A 1 53  ? 1.176   -8.508  -13.101 1.000 17.624 0 53  ARG A CZ  1 ? 
ATOM   400  N NH1 . ARG A 1 53  ? 0.491   -7.409  -12.829 1.000 18.104 0 53  ARG A NH1 1 ? 
ATOM   401  N NH2 . ARG A 1 53  ? 2.194   -8.476  -13.955 1.000 19.911 0 53  ARG A NH2 1 ? 
ATOM   402  N N   . THR A 1 54  ? -3.336  -14.323 -12.851 1.000 14.399 0 54  THR A N   1 ? 
ATOM   403  C CA  . THR A 1 54  ? -4.200  -14.968 -13.823 1.000 14.977 0 54  THR A CA  1 ? 
ATOM   404  C C   . THR A 1 54  ? -5.342  -14.036 -14.211 1.000 16.705 0 54  THR A C   1 ? 
ATOM   405  O O   . THR A 1 54  ? -5.768  -13.155 -13.454 1.000 16.217 0 54  THR A O   1 ? 
ATOM   406  C CB  . THR A 1 54  ? -4.719  -16.314 -13.341 1.000 16.965 0 54  THR A CB  1 ? 
ATOM   407  O OG1 . THR A 1 54  ? -5.483  -16.099 -12.151 1.000 18.704 0 54  THR A OG1 1 ? 
ATOM   408  C CG2 . THR A 1 54  ? -3.596  -17.305 -13.097 1.000 20.649 0 54  THR A CG2 1 ? 
ATOM   409  N N   . ASP A 1 55  ? -5.817  -14.259 -15.440 1.000 16.375 0 55  ASP A N   1 ? 
ATOM   410  C CA  . ASP A 1 55  ? -7.009  -13.626 -15.995 1.000 18.967 0 55  ASP A CA  1 ? 
ATOM   411  C C   . ASP A 1 55  ? -6.936  -12.113 -15.885 1.000 18.993 0 55  ASP A C   1 ? 
ATOM   412  O O   . ASP A 1 55  ? -7.761  -11.480 -15.220 1.000 21.120 0 55  ASP A O   1 ? 
ATOM   413  C CB  . ASP A 1 55  ? -8.250  -14.170 -15.322 1.000 21.914 0 55  ASP A CB  1 ? 
ATOM   414  C CG  . ASP A 1 55  ? -8.558  -15.607 -15.684 1.000 26.603 0 55  ASP A CG  1 ? 
ATOM   415  O OD1 . ASP A 1 55  ? -8.717  -15.851 -16.890 0.520 28.474 0 55  ASP A OD1 1 ? 
ATOM   416  O OD2 . ASP A 1 55  ? -8.549  -16.450 -14.774 0.640 29.246 0 55  ASP A OD2 1 ? 
ATOM   417  N N   . CYS A 1 56  ? -5.909  -11.531 -16.503 1.000 17.632 0 56  CYS A N   1 ? 
ATOM   418  C CA  . CYS A 1 56  ? -5.647  -10.110 -16.444 1.000 18.772 0 56  CYS A CA  1 ? 
ATOM   419  C C   . CYS A 1 56  ? -6.116  -9.443  -17.737 1.000 21.835 0 56  CYS A C   1 ? 
ATOM   420  O O   . CYS A 1 56  ? -6.037  -10.012 -18.826 1.000 22.188 0 56  CYS A O   1 ? 
ATOM   421  C CB  . CYS A 1 56  ? -4.155  -9.791  -16.393 1.000 17.825 0 56  CYS A CB  1 ? 
ATOM   422  S SG  . CYS A 1 56  ? -3.295  -10.494 -14.947 1.000 17.958 0 56  CYS A SG  1 ? 
ATOM   423  N N   . TYR A 1 57  ? -6.562  -8.201  -17.602 1.000 22.345 0 57  TYR A N   1 ? 
ATOM   424  C CA  A TYR A 1 57  ? -6.824  -7.311  -18.725 0.590 23.560 0 57  TYR A CA  1 ? 
ATOM   425  C CA  B TYR A 1 57  ? -6.787  -7.337  -18.741 0.410 25.354 0 57  TYR A CA  1 ? 
ATOM   426  C C   . TYR A 1 57  ? -6.031  -6.040  -18.478 1.000 25.602 0 57  TYR A C   1 ? 
ATOM   427  O O   . TYR A 1 57  ? -6.187  -5.420  -17.434 1.000 27.412 0 57  TYR A O   1 ? 
ATOM   428  C CB  A TYR A 1 57  ? -8.324  -7.003  -18.841 0.590 25.016 0 57  TYR A CB  1 ? 
ATOM   429  C CB  B TYR A 1 57  ? -8.288  -7.132  -18.960 0.410 29.040 0 57  TYR A CB  1 ? 
ATOM   430  C CG  A TYR A 1 57  ? -9.086  -8.258  -19.212 0.590 26.498 0 57  TYR A CG  1 ? 
ATOM   431  C CG  B TYR A 1 57  ? -8.548  -5.787  -19.615 0.410 33.057 0 57  TYR A CG  1 ? 
ATOM   432  C CD1 A TYR A 1 57  ? -9.489  -9.163  -18.238 0.590 25.351 0 57  TYR A CD1 1 ? 
ATOM   433  C CD1 B TYR A 1 57  ? -8.360  -5.612  -20.981 0.410 37.284 0 57  TYR A CD1 1 ? 
ATOM   434  C CD2 A TYR A 1 57  ? -9.260  -8.622  -20.546 0.590 30.258 0 57  TYR A CD2 1 ? 
ATOM   435  C CD2 B TYR A 1 57  ? -8.942  -4.690  -18.859 0.410 38.323 0 57  TYR A CD2 1 ? 
ATOM   436  C CE1 A TYR A 1 57  ? -10.104 -10.357 -18.573 0.590 27.593 0 57  TYR A CE1 1 ? 
ATOM   437  C CE1 B TYR A 1 57  ? -8.570  -4.384  -21.582 0.410 39.153 0 57  TYR A CE1 1 ? 
ATOM   438  C CE2 A TYR A 1 57  ? -9.898  -9.803  -20.887 0.590 26.276 0 57  TYR A CE2 1 ? 
ATOM   439  C CE2 B TYR A 1 57  ? -9.126  -3.451  -19.444 0.410 40.539 0 57  TYR A CE2 1 ? 
ATOM   440  C CZ  A TYR A 1 57  ? -10.309 -10.671 -19.903 0.590 28.051 0 57  TYR A CZ  1 ? 
ATOM   441  C CZ  B TYR A 1 57  ? -8.953  -3.304  -20.809 0.410 40.649 0 57  TYR A CZ  1 ? 
ATOM   442  O OH  A TYR A 1 57  ? -10.897 -11.843 -20.243 0.590 32.836 0 57  TYR A OH  1 ? 
ATOM   443  O OH  B TYR A 1 57  ? -9.161  -2.088  -21.391 0.410 45.326 0 57  TYR A OH  1 ? 
ATOM   444  N N   . PHE A 1 58  ? -5.235  -5.614  -19.457 1.000 25.590 0 58  PHE A N   1 ? 
ATOM   445  C CA  . PHE A 1 58  ? -4.521  -4.368  -19.358 1.000 26.616 0 58  PHE A CA  1 ? 
ATOM   446  C C   . PHE A 1 58  ? -4.765  -3.562  -20.629 1.000 30.478 0 58  PHE A C   1 ? 
ATOM   447  O O   . PHE A 1 58  ? -4.853  -4.138  -21.709 1.000 33.866 0 58  PHE A O   1 ? 
ATOM   448  C CB  . PHE A 1 58  ? -3.015  -4.579  -19.172 1.000 25.439 0 58  PHE A CB  1 ? 
ATOM   449  C CG  . PHE A 1 58  ? -2.667  -5.279  -17.871 1.000 23.044 0 58  PHE A CG  1 ? 
ATOM   450  C CD1 . PHE A 1 58  ? -2.768  -4.597  -16.665 1.000 24.606 0 58  PHE A CD1 1 ? 
ATOM   451  C CD2 . PHE A 1 58  ? -2.235  -6.599  -17.839 1.000 22.404 0 58  PHE A CD2 1 ? 
ATOM   452  C CE1 . PHE A 1 58  ? -2.482  -5.226  -15.469 1.000 23.773 0 58  PHE A CE1 1 ? 
ATOM   453  C CE2 . PHE A 1 58  ? -1.910  -7.201  -16.643 1.000 22.107 0 58  PHE A CE2 1 ? 
ATOM   454  C CZ  . PHE A 1 58  ? -2.049  -6.522  -15.460 1.000 21.771 0 58  PHE A CZ  1 ? 
ATOM   455  N N   . ASP A 1 59  ? -4.836  -2.243  -20.460 1.000 35.446 0 59  ASP A N   1 ? 
ATOM   456  C CA  . ASP A 1 59  ? -4.894  -1.325  -21.592 1.000 37.526 0 59  ASP A CA  1 ? 
ATOM   457  C C   . ASP A 1 59  ? -3.481  -0.974  -22.059 1.000 42.537 0 59  ASP A C   1 ? 
ATOM   458  O O   . ASP A 1 59  ? -2.491  -1.532  -21.600 1.000 38.458 0 59  ASP A O   1 ? 
ATOM   459  C CB  . ASP A 1 59  ? -5.709  -0.108  -21.214 1.000 35.607 0 59  ASP A CB  1 ? 
ATOM   460  C CG  . ASP A 1 59  ? -5.068  0.813   -20.206 1.000 37.044 0 59  ASP A CG  1 ? 
ATOM   461  O OD1 . ASP A 1 59  ? -3.835  0.732   -20.020 1.000 39.613 0 59  ASP A OD1 1 ? 
ATOM   462  O OD2 . ASP A 1 59  ? -5.821  1.600   -19.618 1.000 47.452 0 59  ASP A OD2 1 ? 
ATOM   463  N N   . ASP A 1 60  ? -3.382  -0.005  -22.980 1.000 51.313 0 60  ASP A N   1 ? 
ATOM   464  C CA  . ASP A 1 60  ? -2.103  0.333   -23.584 1.000 54.518 0 60  ASP A CA  1 ? 
ATOM   465  C C   . ASP A 1 60  ? -1.181  1.037   -22.594 1.000 47.146 0 60  ASP A C   1 ? 
ATOM   466  O O   . ASP A 1 60  ? 0.031   1.013   -22.800 1.000 57.985 0 60  ASP A O   1 ? 
ATOM   467  C CB  . ASP A 1 60  ? -2.257  1.094   -24.898 1.000 58.436 0 60  ASP A CB  1 ? 
ATOM   468  C CG  . ASP A 1 60  ? -2.067  0.231   -26.134 0.650 54.975 0 60  ASP A CG  1 ? 
ATOM   469  O OD1 . ASP A 1 60  ? -2.931  -0.630  -26.376 1.000 56.577 0 60  ASP A OD1 1 ? 
ATOM   470  O OD2 . ASP A 1 60  ? -1.021  0.384   -26.803 0.550 54.680 0 60  ASP A OD2 1 ? 
ATOM   471  N N   . SER A 1 61  ? -1.731  1.641   -21.527 1.000 44.193 0 61  SER A N   1 ? 
ATOM   472  C CA  . SER A 1 61  ? -0.906  2.267   -20.495 1.000 42.662 0 61  SER A CA  1 ? 
ATOM   473  C C   . SER A 1 61  ? -0.391  1.264   -19.440 1.000 42.257 0 61  SER A C   1 ? 
ATOM   474  O O   . SER A 1 61  ? 0.340   1.651   -18.538 1.000 40.992 0 61  SER A O   1 ? 
ATOM   475  C CB  . SER A 1 61  ? -1.645  3.419   -19.844 1.000 47.062 0 61  SER A CB  1 ? 
ATOM   476  O OG  . SER A 1 61  ? -2.714  2.976   -19.009 1.000 53.361 0 61  SER A OG  1 ? 
ATOM   477  N N   . GLY A 1 62  ? -0.764  -0.021  -19.522 1.000 35.780 0 62  GLY A N   1 ? 
ATOM   478  C CA  . GLY A 1 62  ? -0.334  -1.004  -18.528 1.000 34.405 0 62  GLY A CA  1 ? 
ATOM   479  C C   . GLY A 1 62  ? -1.173  -0.960  -17.254 1.000 30.042 0 62  GLY A C   1 ? 
ATOM   480  O O   . GLY A 1 62  ? -0.706  -1.340  -16.185 1.000 25.676 0 62  GLY A O   1 ? 
ATOM   481  N N   . SER A 1 63  ? -2.390  -0.422  -17.375 1.000 30.340 0 63  SER A N   1 ? 
ATOM   482  C CA  A SER A 1 63  ? -3.337  -0.358  -16.276 0.590 28.774 0 63  SER A CA  1 ? 
ATOM   483  C CA  B SER A 1 63  ? -3.337  -0.353  -16.277 0.410 28.744 0 63  SER A CA  1 ? 
ATOM   484  C C   . SER A 1 63  ? -4.505  -1.301  -16.537 1.000 28.401 0 63  SER A C   1 ? 
ATOM   485  O O   . SER A 1 63  ? -4.986  -1.436  -17.657 1.000 28.280 0 63  SER A O   1 ? 
ATOM   486  C CB  A SER A 1 63  ? -3.814  1.062   -16.068 0.590 31.994 0 63  SER A CB  1 ? 
ATOM   487  C CB  B SER A 1 63  ? -3.818  1.066   -16.078 0.410 30.756 0 63  SER A CB  1 ? 
ATOM   488  O OG  A SER A 1 63  ? -2.827  1.818   -15.383 0.590 34.961 0 63  SER A OG  1 ? 
ATOM   489  O OG  B SER A 1 63  ? -4.711  1.139   -14.976 0.410 32.383 0 63  SER A OG  1 ? 
ATOM   490  N N   . GLY A 1 64  ? -4.963  -1.985  -15.475 1.000 26.251 0 64  GLY A N   1 ? 
ATOM   491  C CA  . GLY A 1 64  ? -6.056  -2.906  -15.637 1.000 23.549 0 64  GLY A CA  1 ? 
ATOM   492  C C   . GLY A 1 64  ? -6.377  -3.675  -14.350 1.000 20.635 0 64  GLY A C   1 ? 
ATOM   493  O O   . GLY A 1 64  ? -6.339  -3.132  -13.253 1.000 22.253 0 64  GLY A O   1 ? 
ATOM   494  N N   . ILE A 1 65  ? -6.596  -4.972  -14.488 1.000 19.574 0 65  ILE A N   1 ? 
ATOM   495  C CA  . ILE A 1 65  ? -7.057  -5.796  -13.383 1.000 20.129 0 65  ILE A CA  1 ? 
ATOM   496  C C   . ILE A 1 65  ? -6.712  -7.256  -13.668 1.000 19.282 0 65  ILE A C   1 ? 
ATOM   497  O O   . ILE A 1 65  ? -6.769  -7.684  -14.814 1.000 20.461 0 65  ILE A O   1 ? 
ATOM   498  C CB  . ILE A 1 65  ? -8.566  -5.632  -13.161 1.000 20.391 0 65  ILE A CB  1 ? 
ATOM   499  C CG1 . ILE A 1 65  ? -9.073  -6.396  -11.939 1.000 23.876 0 65  ILE A CG1 1 ? 
ATOM   500  C CG2 . ILE A 1 65  ? -9.377  -6.043  -14.392 1.000 24.237 0 65  ILE A CG2 1 ? 
ATOM   501  C CD1 . ILE A 1 65  ? -8.793  -5.771  -10.598 1.000 33.684 0 65  ILE A CD1 1 ? 
ATOM   502  N N   . CYS A 1 66  ? -6.398  -8.016  -12.613 1.000 17.701 0 66  CYS A N   1 ? 
ATOM   503  C CA  . CYS A 1 66  ? -6.221  -9.466  -12.683 1.000 15.840 0 66  CYS A CA  1 ? 
ATOM   504  C C   . CYS A 1 66  ? -7.093  -10.128 -11.624 1.000 16.944 0 66  CYS A C   1 ? 
ATOM   505  O O   . CYS A 1 66  ? -7.314  -9.564  -10.562 1.000 18.133 0 66  CYS A O   1 ? 
ATOM   506  C CB  . CYS A 1 66  ? -4.789  -9.899  -12.401 1.000 16.408 0 66  CYS A CB  1 ? 
ATOM   507  S SG  . CYS A 1 66  ? -3.575  -9.123  -13.489 0.920 16.324 0 66  CYS A SG  1 ? 
ATOM   508  N N   . LYS A 1 67  ? -7.502  -11.365 -11.874 1.000 18.111 0 67  LYS A N   1 ? 
ATOM   509  C CA  . LYS A 1 67  ? -8.327  -12.093 -10.908 1.000 18.870 0 67  LYS A CA  1 ? 
ATOM   510  C C   . LYS A 1 67  ? -7.547  -12.696 -9.751  1.000 20.207 0 67  LYS A C   1 ? 
ATOM   511  O O   . LYS A 1 67  ? -8.091  -12.894 -8.664  1.000 19.803 0 67  LYS A O   1 ? 
ATOM   512  C CB  . LYS A 1 67  ? -9.170  -13.151 -11.606 1.000 19.778 0 67  LYS A CB  1 ? 
ATOM   513  C CG  . LYS A 1 67  ? -10.170 -12.517 -12.520 1.000 23.876 0 67  LYS A CG  1 ? 
ATOM   514  C CD  . LYS A 1 67  ? -11.263 -13.503 -12.801 1.000 26.826 0 67  LYS A CD  1 ? 
ATOM   515  C CE  . LYS A 1 67  ? -12.231 -12.862 -13.729 1.000 30.685 0 67  LYS A CE  1 ? 
ATOM   516  N NZ  . LYS A 1 67  ? -13.153 -13.919 -14.112 1.000 34.473 0 67  LYS A NZ  1 ? 
ATOM   517  N N   . THR A 1 68  ? -6.248  -12.996 -9.936  1.000 16.425 0 68  THR A N   1 ? 
ATOM   518  C CA  . THR A 1 68  ? -5.396  -13.377 -8.832  1.000 16.728 0 68  THR A CA  1 ? 
ATOM   519  C C   . THR A 1 68  ? -4.132  -12.546 -8.919  1.000 16.504 0 68  THR A C   1 ? 
ATOM   520  O O   . THR A 1 68  ? -3.670  -12.236 -10.009 1.000 16.930 0 68  THR A O   1 ? 
ATOM   521  C CB  . THR A 1 68  ? -5.061  -14.869 -8.786  1.000 16.247 0 68  THR A CB  1 ? 
ATOM   522  O OG1 . THR A 1 68  ? -4.277  -15.268 -9.891  1.000 16.199 0 68  THR A OG1 1 ? 
ATOM   523  C CG2 . THR A 1 68  ? -6.289  -15.770 -8.677  1.000 16.920 0 68  THR A CG2 1 ? 
ATOM   524  N N   . GLY A 1 69  ? -3.613  -12.138 -7.775  1.000 16.046 0 69  GLY A N   1 ? 
ATOM   525  C CA  . GLY A 1 69  ? -2.307  -11.529 -7.680  1.000 15.779 0 69  GLY A CA  1 ? 
ATOM   526  C C   . GLY A 1 69  ? -2.213  -10.080 -8.154  1.000 15.556 0 69  GLY A C   1 ? 
ATOM   527  O O   . GLY A 1 69  ? -1.110  -9.613  -8.337  1.000 17.102 0 69  GLY A O   1 ? 
ATOM   528  N N   . ASP A 1 70  ? -3.342  -9.371  -8.313  1.000 16.672 0 70  ASP A N   1 ? 
ATOM   529  C CA  . ASP A 1 70  ? -3.336  -8.011  -8.829  1.000 16.995 0 70  ASP A CA  1 ? 
ATOM   530  C C   . ASP A 1 70  ? -2.519  -7.129  -7.908  1.000 18.869 0 70  ASP A C   1 ? 
ATOM   531  O O   . ASP A 1 70  ? -2.684  -7.200  -6.687  1.000 19.185 0 70  ASP A O   1 ? 
ATOM   532  C CB  . ASP A 1 70  ? -4.764  -7.511  -8.905  1.000 17.441 0 70  ASP A CB  1 ? 
ATOM   533  C CG  . ASP A 1 70  ? -4.895  -6.163  -9.589  1.000 21.367 0 70  ASP A CG  1 ? 
ATOM   534  O OD1 . ASP A 1 70  ? -4.682  -6.130  -10.803 1.000 24.550 0 70  ASP A OD1 1 ? 
ATOM   535  O OD2 . ASP A 1 70  ? -5.110  -5.166  -8.862  1.000 26.685 0 70  ASP A OD2 1 ? 
ATOM   536  N N   . CYS A 1 71  ? -1.642  -6.294  -8.494  1.000 18.282 0 71  CYS A N   1 ? 
ATOM   537  C CA  . CYS A 1 71  ? -0.774  -5.415  -7.715  1.000 21.294 0 71  CYS A CA  1 ? 
ATOM   538  C C   . CYS A 1 71  ? -1.166  -3.953  -7.973  1.000 22.236 0 71  CYS A C   1 ? 
ATOM   539  O O   . CYS A 1 71  ? -0.501  -3.251  -8.734  1.000 25.245 0 71  CYS A O   1 ? 
ATOM   540  C CB  . CYS A 1 71  ? 0.697   -5.642  -8.041  1.000 18.604 0 71  CYS A CB  1 ? 
ATOM   541  S SG  . CYS A 1 71  ? 1.067   -5.299  -9.773  1.000 20.421 0 71  CYS A SG  1 ? 
ATOM   542  N N   . GLY A 1 72  ? -2.348  -3.576  -7.484  1.000 22.045 0 72  GLY A N   1 ? 
ATOM   543  C CA  . GLY A 1 72  ? -2.918  -2.250  -7.658  1.000 23.722 0 72  GLY A CA  1 ? 
ATOM   544  C C   . GLY A 1 72  ? -3.191  -1.890  -9.111  1.000 24.822 0 72  GLY A C   1 ? 
ATOM   545  O O   . GLY A 1 72  ? -2.995  -0.759  -9.522  1.000 26.972 0 72  GLY A O   1 ? 
ATOM   546  N N   . GLY A 1 73  ? -3.577  -2.869  -9.911  1.000 23.047 0 73  GLY A N   1 ? 
ATOM   547  C CA  . GLY A 1 73  ? -4.031  -2.621  -11.252 1.000 23.345 0 73  GLY A CA  1 ? 
ATOM   548  C C   . GLY A 1 73  ? -2.904  -2.335  -12.237 1.000 24.673 0 73  GLY A C   1 ? 
ATOM   549  O O   . GLY A 1 73  ? -3.187  -1.854  -13.325 1.000 28.830 0 73  GLY A O   1 ? 
ATOM   550  N N   . LEU A 1 74  ? -1.648  -2.624  -11.887 1.000 23.722 0 74  LEU A N   1 ? 
ATOM   551  C CA  . LEU A 1 74  ? -0.530  -2.333  -12.791 1.000 23.240 0 74  LEU A CA  1 ? 
ATOM   552  C C   . LEU A 1 74  ? 0.007   -3.606  -13.449 1.000 22.258 0 74  LEU A C   1 ? 
ATOM   553  O O   . LEU A 1 74  ? 0.024   -4.646  -12.800 1.000 23.332 0 74  LEU A O   1 ? 
ATOM   554  C CB  . LEU A 1 74  ? 0.606   -1.675  -12.011 1.000 24.434 0 74  LEU A CB  1 ? 
ATOM   555  C CG  . LEU A 1 74  ? 0.280   -0.291  -11.432 1.000 30.059 0 74  LEU A CG  1 ? 
ATOM   556  C CD1 . LEU A 1 74  ? 1.505   0.305   -10.779 1.000 31.168 0 74  LEU A CD1 1 ? 
ATOM   557  C CD2 . LEU A 1 74  ? -0.295  0.613   -12.519 1.000 33.301 0 74  LEU A CD2 1 ? 
ATOM   558  N N   . LEU A 1 75  ? 0.383   -3.522  -14.719 1.000 20.699 0 75  LEU A N   1 ? 
ATOM   559  C CA  . LEU A 1 75  ? 1.119   -4.588  -15.404 1.000 21.730 0 75  LEU A CA  1 ? 
ATOM   560  C C   . LEU A 1 75  ? 2.471   -4.749  -14.727 1.000 21.111 0 75  LEU A C   1 ? 
ATOM   561  O O   . LEU A 1 75  ? 2.881   -5.852  -14.381 1.000 23.219 0 75  LEU A O   1 ? 
ATOM   562  C CB  . LEU A 1 75  ? 1.269   -4.283  -16.896 1.000 24.361 0 75  LEU A CB  1 ? 
ATOM   563  C CG  . LEU A 1 75  ? 2.172   -5.230  -17.704 1.000 27.228 0 75  LEU A CG  1 ? 
ATOM   564  C CD1 . LEU A 1 75  ? 1.777   -6.691  -17.589 1.000 28.623 0 75  LEU A CD1 1 ? 
ATOM   565  C CD2 . LEU A 1 75  ? 2.150   -4.760  -19.153 1.000 30.760 0 75  LEU A CD2 1 ? 
ATOM   566  N N   . ARG A 1 76  ? 3.161   -3.627  -14.518 1.000 24.513 0 76  ARG A N   1 ? 
ATOM   567  C CA  . ARG A 1 76  ? 4.487   -3.599  -13.947 1.000 24.223 0 76  ARG A CA  1 ? 
ATOM   568  C C   . ARG A 1 76  ? 4.338   -3.330  -12.455 1.000 25.823 0 76  ARG A C   1 ? 
ATOM   569  O O   . ARG A 1 76  ? 4.239   -2.192  -11.993 1.000 27.909 0 76  ARG A O   1 ? 
ATOM   570  C CB  . ARG A 1 76  ? 5.340   -2.540  -14.685 1.000 25.802 0 76  ARG A CB  1 ? 
ATOM   571  C CG  . ARG A 1 76  ? 5.656   -2.884  -16.133 1.000 29.832 0 76  ARG A CG  1 ? 
ATOM   572  C CD  . ARG A 1 76  ? 6.165   -1.640  -16.899 1.000 34.556 0 76  ARG A CD  1 ? 
ATOM   573  N NE  . ARG A 1 76  ? 7.050   -1.883  -18.042 0.410 40.373 0 76  ARG A NE  1 ? 
ATOM   574  C CZ  . ARG A 1 76  ? 6.689   -1.888  -19.322 0.480 45.554 0 76  ARG A CZ  1 ? 
ATOM   575  N NH1 . ARG A 1 76  ? 5.476   -2.282  -19.684 0.630 48.181 0 76  ARG A NH1 1 ? 
ATOM   576  N NH2 . ARG A 1 76  ? 7.584   -1.587  -20.248 0.800 46.176 0 76  ARG A NH2 1 ? 
ATOM   577  N N   . CYS A 1 77  ? 4.355   -4.400  -11.665 1.000 23.123 0 77  CYS A N   1 ? 
ATOM   578  C CA  . CYS A 1 77  ? 4.137   -4.306  -10.239 1.000 21.746 0 77  CYS A CA  1 ? 
ATOM   579  C C   . CYS A 1 77  ? 5.265   -3.624  -9.468  1.000 26.731 0 77  CYS A C   1 ? 
ATOM   580  O O   . CYS A 1 77  ? 6.443   -3.974  -9.633  1.000 28.253 0 77  CYS A O   1 ? 
ATOM   581  C CB  . CYS A 1 77  ? 4.015   -5.688  -9.602  1.000 22.823 0 77  CYS A CB  1 ? 
ATOM   582  S SG  . CYS A 1 77  ? 2.578   -6.586  -10.231 1.000 21.282 0 77  CYS A SG  1 ? 
ATOM   583  N N   . LYS A 1 78  ? 4.859   -2.672  -8.622  1.000 22.940 0 78  LYS A N   1 ? 
ATOM   584  C CA  . LYS A 1 78  ? 5.737   -1.998  -7.675  1.000 28.742 0 78  LYS A CA  1 ? 
ATOM   585  C C   . LYS A 1 78  ? 5.492   -2.546  -6.278  1.000 28.477 0 78  LYS A C   1 ? 
ATOM   586  O O   . LYS A 1 78  ? 6.353   -2.455  -5.416  1.000 37.803 0 78  LYS A O   1 ? 
ATOM   587  C CB  . LYS A 1 78  ? 5.493   -0.483  -7.542  1.000 35.205 0 78  LYS A CB  1 ? 
ATOM   588  C CG  . LYS A 1 78  ? 5.406   0.347   -8.815  0.470 38.149 0 78  LYS A CG  1 ? 
ATOM   589  C CD  . LYS A 1 78  ? 5.129   1.812   -8.487  0.430 43.931 0 78  LYS A CD  1 ? 
ATOM   590  C CE  . LYS A 1 78  ? 5.301   2.752   -9.638  0.730 54.047 0 78  LYS A CE  1 ? 
ATOM   591  N NZ  . LYS A 1 78  ? 4.055   2.981   -10.376 0.960 61.611 0 78  LYS A NZ  1 ? 
ATOM   592  N N   . ARG A 1 79  ? 4.296   -3.101  -6.018  1.000 25.269 0 79  ARG A N   1 ? 
ATOM   593  C CA  . ARG A 1 79  ? 3.989   -3.626  -4.703  1.000 25.230 0 79  ARG A CA  1 ? 
ATOM   594  C C   . ARG A 1 79  ? 3.567   -5.090  -4.830  1.000 21.644 0 79  ARG A C   1 ? 
ATOM   595  O O   . ARG A 1 79  ? 3.475   -5.597  -5.923  1.000 21.973 0 79  ARG A O   1 ? 
ATOM   596  C CB  . ARG A 1 79  ? 2.885   -2.812  -4.026  1.000 29.730 0 79  ARG A CB  1 ? 
ATOM   597  C CG  . ARG A 1 79  ? 1.546   -2.837  -4.731  1.000 36.806 0 79  ARG A CG  1 ? 
ATOM   598  C CD  . ARG A 1 79  ? 0.397   -2.419  -3.810  0.390 40.600 0 79  ARG A CD  1 ? 
ATOM   599  N NE  . ARG A 1 79  ? -0.725  -3.317  -4.099  0.470 44.123 0 79  ARG A NE  1 ? 
ATOM   600  C CZ  . ARG A 1 79  ? -1.073  -4.350  -3.346  0.250 47.508 0 79  ARG A CZ  1 ? 
ATOM   601  N NH1 . ARG A 1 79  ? -0.544  -4.501  -2.141  0.440 49.178 0 79  ARG A NH1 1 ? 
ATOM   602  N NH2 . ARG A 1 79  ? -1.955  -5.221  -3.808  1.000 51.971 0 79  ARG A NH2 1 ? 
ATOM   603  N N   . PHE A 1 80  ? 3.349   -5.758  -3.700  1.000 20.630 0 80  PHE A N   1 ? 
ATOM   604  C CA  . PHE A 1 80  ? 2.953   -7.160  -3.704  1.000 19.525 0 80  PHE A CA  1 ? 
ATOM   605  C C   . PHE A 1 80  ? 1.497   -7.318  -4.137  1.000 21.338 0 80  PHE A C   1 ? 
ATOM   606  O O   . PHE A 1 80  ? 0.700   -6.384  -4.125  1.000 22.865 0 80  PHE A O   1 ? 
ATOM   607  C CB  . PHE A 1 80  ? 3.177   -7.779  -2.333  1.000 19.820 0 80  PHE A CB  1 ? 
ATOM   608  C CG  . PHE A 1 80  ? 4.619   -7.886  -1.888  1.000 19.455 0 80  PHE A CG  1 ? 
ATOM   609  C CD1 . PHE A 1 80  ? 5.628   -8.248  -2.774  1.000 21.256 0 80  PHE A CD1 1 ? 
ATOM   610  C CD2 . PHE A 1 80  ? 4.952   -7.619  -0.574  1.000 24.538 0 80  PHE A CD2 1 ? 
ATOM   611  C CE1 . PHE A 1 80  ? 6.935   -8.358  -2.358  1.000 21.559 0 80  PHE A CE1 1 ? 
ATOM   612  C CE2 . PHE A 1 80  ? 6.270   -7.736  -0.152  1.000 24.747 0 80  PHE A CE2 1 ? 
ATOM   613  C CZ  . PHE A 1 80  ? 7.256   -8.070  -1.059  1.000 24.716 0 80  PHE A CZ  1 ? 
ATOM   614  N N   . GLY A 1 81  ? 1.177   -8.535  -4.533  1.000 19.678 0 81  GLY A N   1 ? 
ATOM   615  C CA  . GLY A 1 81  ? -0.095  -8.854  -5.164  1.000 18.015 0 81  GLY A CA  1 ? 
ATOM   616  C C   . GLY A 1 81  ? -1.154  -9.282  -4.153  1.000 16.890 0 81  GLY A C   1 ? 
ATOM   617  O O   . GLY A 1 81  ? -0.871  -9.745  -3.041  1.000 19.008 0 81  GLY A O   1 ? 
ATOM   618  N N   . ARG A 1 82  ? -2.404  -9.130  -4.595  1.000 16.628 0 82  ARG A N   1 ? 
ATOM   619  C CA  . ARG A 1 82  ? -3.561  -9.543  -3.816  1.000 18.141 0 82  ARG A CA  1 ? 
ATOM   620  C C   . ARG A 1 82  ? -3.688  -11.068 -3.805  1.000 16.246 0 82  ARG A C   1 ? 
ATOM   621  O O   . ARG A 1 82  ? -3.655  -11.733 -4.843  1.000 16.473 0 82  ARG A O   1 ? 
ATOM   622  C CB  . ARG A 1 82  ? -4.798  -8.934  -4.460  1.000 19.853 0 82  ARG A CB  1 ? 
ATOM   623  C CG  . ARG A 1 82  ? -6.102  -9.187  -3.726  1.000 29.042 0 82  ARG A CG  1 ? 
ATOM   624  C CD  . ARG A 1 82  ? -7.216  -8.300  -4.316  1.000 30.119 0 82  ARG A CD  1 ? 
ATOM   625  N NE  . ARG A 1 82  ? -8.415  -8.325  -3.475  0.700 37.028 0 82  ARG A NE  1 ? 
ATOM   626  C CZ  . ARG A 1 82  ? -9.398  -9.222  -3.506  1.000 31.407 0 82  ARG A CZ  1 ? 
ATOM   627  N NH1 . ARG A 1 82  ? -9.431  -10.154 -4.443  0.720 32.463 0 82  ARG A NH1 1 ? 
ATOM   628  N NH2 . ARG A 1 82  ? -10.302 -9.225  -2.551  0.430 30.575 0 82  ARG A NH2 1 ? 
ATOM   629  N N   . PRO A 1 83  ? -3.826  -11.716 -2.632  1.000 16.363 0 83  PRO A N   1 ? 
ATOM   630  C CA  . PRO A 1 83  ? -4.051  -13.155 -2.562  1.000 16.598 0 83  PRO A CA  1 ? 
ATOM   631  C C   . PRO A 1 83  ? -5.284  -13.548 -3.344  1.000 16.530 0 83  PRO A C   1 ? 
ATOM   632  O O   . PRO A 1 83  ? -6.235  -12.776 -3.465  1.000 18.371 0 83  PRO A O   1 ? 
ATOM   633  C CB  . PRO A 1 83  ? -4.270  -13.480 -1.092  1.000 18.408 0 83  PRO A CB  1 ? 
ATOM   634  C CG  . PRO A 1 83  ? -3.583  -12.330 -0.395  1.000 21.637 0 83  PRO A CG  1 ? 
ATOM   635  C CD  . PRO A 1 83  ? -3.695  -11.105 -1.293  1.000 20.195 0 83  PRO A CD  1 ? 
ATOM   636  N N   . PRO A 1 84  ? -5.352  -14.781 -3.843  1.000 15.818 0 84  PRO A N   1 ? 
ATOM   637  C CA  . PRO A 1 84  ? -4.379  -15.819 -3.534  1.000 15.148 0 84  PRO A CA  1 ? 
ATOM   638  C C   . PRO A 1 84  ? -3.196  -15.820 -4.501  1.000 14.780 0 84  PRO A C   1 ? 
ATOM   639  O O   . PRO A 1 84  ? -3.395  -15.700 -5.707  1.000 16.619 0 84  PRO A O   1 ? 
ATOM   640  C CB  . PRO A 1 84  ? -5.238  -17.085 -3.656  1.000 17.104 0 84  PRO A CB  1 ? 
ATOM   641  C CG  . PRO A 1 84  ? -6.305  -16.759 -4.679  1.000 19.187 0 84  PRO A CG  1 ? 
ATOM   642  C CD  . PRO A 1 84  ? -6.523  -15.279 -4.585  1.000 18.685 0 84  PRO A CD  1 ? 
ATOM   643  N N   . THR A 1 85  ? -1.998  -16.055 -3.992  1.000 14.416 0 85  THR A N   1 ? 
ATOM   644  C CA  . THR A 1 85  ? -0.783  -16.044 -4.788  1.000 13.721 0 85  THR A CA  1 ? 
ATOM   645  C C   . THR A 1 85  ? 0.224   -17.030 -4.237  1.000 14.419 0 85  THR A C   1 ? 
ATOM   646  O O   . THR A 1 85  ? 0.737   -16.839 -3.151  1.000 14.511 0 85  THR A O   1 ? 
ATOM   647  C CB  . THR A 1 85  ? -0.106  -14.683 -4.785  1.000 15.923 0 85  THR A CB  1 ? 
ATOM   648  O OG1 . THR A 1 85  ? 0.143   -14.261 -3.431  1.000 18.059 0 85  THR A OG1 1 ? 
ATOM   649  C CG2 . THR A 1 85  ? -0.842  -13.616 -5.571  1.000 16.291 0 85  THR A CG2 1 ? 
ATOM   650  N N   . THR A 1 86  ? 0.577   -18.051 -5.006  1.000 13.906 0 86  THR A N   1 ? 
ATOM   651  C CA  . THR A 1 86  ? 1.710   -18.886 -4.667  1.000 13.392 0 86  THR A CA  1 ? 
ATOM   652  C C   . THR A 1 86  ? 2.949   -17.988 -4.761  1.000 13.903 0 86  THR A C   1 ? 
ATOM   653  O O   . THR A 1 86  ? 3.072   -17.260 -5.735  1.000 14.625 0 86  THR A O   1 ? 
ATOM   654  C CB  . THR A 1 86  ? 1.840   -20.065 -5.645  1.000 14.261 0 86  THR A CB  1 ? 
ATOM   655  O OG1 . THR A 1 86  ? 0.555   -20.590 -5.963  1.000 14.686 0 86  THR A OG1 1 ? 
ATOM   656  C CG2 . THR A 1 86  ? 2.777   -21.127 -5.127  1.000 15.442 0 86  THR A CG2 1 ? 
ATOM   657  N N   . LEU A 1 87  ? 3.833   -18.011 -3.759  1.000 13.906 0 87  LEU A N   1 ? 
ATOM   658  C CA  . LEU A 1 87  ? 4.955   -17.074 -3.762  1.000 14.213 0 87  LEU A CA  1 ? 
ATOM   659  C C   . LEU A 1 87  ? 6.301   -17.783 -3.806  1.000 14.502 0 87  LEU A C   1 ? 
ATOM   660  O O   . LEU A 1 87  ? 6.587   -18.660 -2.998  1.000 15.635 0 87  LEU A O   1 ? 
ATOM   661  C CB  . LEU A 1 87  ? 4.884   -16.221 -2.495  1.000 14.287 0 87  LEU A CB  1 ? 
ATOM   662  C CG  . LEU A 1 87  ? 3.705   -15.260 -2.412  1.000 15.724 0 87  LEU A CG  1 ? 
ATOM   663  C CD1 . LEU A 1 87  ? 3.653   -14.694 -1.026  1.000 18.586 0 87  LEU A CD1 1 ? 
ATOM   664  C CD2 . LEU A 1 87  ? 3.794   -14.206 -3.459  1.000 17.701 0 87  LEU A CD2 1 ? 
ATOM   665  N N   . ALA A 1 88  ? 7.184   -17.297 -4.698  1.000 13.347 0 88  ALA A N   1 ? 
ATOM   666  C CA  . ALA A 1 88  ? 8.599   -17.591 -4.697  1.000 14.696 0 88  ALA A CA  1 ? 
ATOM   667  C C   . ALA A 1 88  ? 9.260   -16.415 -3.977  1.000 14.832 0 88  ALA A C   1 ? 
ATOM   668  O O   . ALA A 1 88  ? 9.062   -15.293 -4.362  1.000 17.810 0 88  ALA A O   1 ? 
ATOM   669  C CB  . ALA A 1 88  ? 9.104   -17.692 -6.095  1.000 14.844 0 88  ALA A CB  1 ? 
ATOM   670  N N   . GLU A 1 89  ? 9.942   -16.702 -2.871  1.000 14.540 0 89  GLU A N   1 ? 
ATOM   671  C CA  . GLU A 1 89  ? 10.480  -15.687 -2.004  1.000 14.207 0 89  GLU A CA  1 ? 
ATOM   672  C C   . GLU A 1 89  ? 11.993  -15.868 -1.889  1.000 15.323 0 89  GLU A C   1 ? 
ATOM   673  O O   . GLU A 1 89  ? 12.511  -16.994 -1.823  1.000 15.819 0 89  GLU A O   1 ? 
ATOM   674  C CB  . GLU A 1 89  ? 9.869   -15.783 -0.603  1.000 16.568 0 89  GLU A CB  1 ? 
ATOM   675  C CG  . GLU A 1 89  ? 8.348   -15.794 -0.564  1.000 18.172 0 89  GLU A CG  1 ? 
ATOM   676  C CD  . GLU A 1 89  ? 7.762   -15.864 0.844   1.000 18.080 0 89  GLU A CD  1 ? 
ATOM   677  O OE1 . GLU A 1 89  ? 8.129   -16.747 1.648   1.000 18.958 0 89  GLU A OE1 1 ? 
ATOM   678  O OE2 . GLU A 1 89  ? 6.906   -15.003 1.064   1.000 19.842 0 89  GLU A OE2 1 ? 
ATOM   679  N N   . PHE A 1 90  ? 12.690  -14.730 -1.830  1.000 16.714 0 90  PHE A N   1 ? 
ATOM   680  C CA  . PHE A 1 90  ? 14.136  -14.825 -1.796  1.000 17.769 0 90  PHE A CA  1 ? 
ATOM   681  C C   . PHE A 1 90  ? 14.741  -13.595 -1.142  1.000 16.763 0 90  PHE A C   1 ? 
ATOM   682  O O   . PHE A 1 90  ? 14.252  -12.464 -1.285  1.000 18.454 0 90  PHE A O   1 ? 
ATOM   683  C CB  . PHE A 1 90  ? 14.730  -14.995 -3.211  1.000 17.661 0 90  PHE A CB  1 ? 
ATOM   684  C CG  . PHE A 1 90  ? 14.144  -14.057 -4.252  1.000 15.811 0 90  PHE A CG  1 ? 
ATOM   685  C CD1 . PHE A 1 90  ? 12.975  -14.403 -4.910  1.000 18.869 0 90  PHE A CD1 1 ? 
ATOM   686  C CD2 . PHE A 1 90  ? 14.672  -12.810 -4.533  1.000 19.468 0 90  PHE A CD2 1 ? 
ATOM   687  C CE1 . PHE A 1 90  ? 12.372  -13.532 -5.808  1.000 21.144 0 90  PHE A CE1 1 ? 
ATOM   688  C CE2 . PHE A 1 90  ? 14.097  -11.992 -5.479  1.000 19.878 0 90  PHE A CE2 1 ? 
ATOM   689  C CZ  . PHE A 1 90  ? 12.931  -12.344 -6.093  1.000 20.595 0 90  PHE A CZ  1 ? 
ATOM   690  N N   . SER A 1 91  ? 15.871  -13.881 -0.485  1.000 17.836 0 91  SER A N   1 ? 
ATOM   691  C CA  . SER A 1 91  ? 16.757  -12.847 0.018   1.000 19.908 0 91  SER A CA  1 ? 
ATOM   692  C C   . SER A 1 91  ? 18.178  -13.179 -0.442  1.000 17.259 0 91  SER A C   1 ? 
ATOM   693  O O   . SER A 1 91  ? 18.625  -14.288 -0.195  1.000 20.600 0 91  SER A O   1 ? 
ATOM   694  C CB  . SER A 1 91  ? 16.622  -12.753 1.528   1.000 21.612 0 91  SER A CB  1 ? 
ATOM   695  O OG  . SER A 1 91  ? 15.374  -12.167 1.904   1.000 22.691 0 91  SER A OG  1 ? 
ATOM   696  N N   . LEU A 1 92  ? 18.876  -12.226 -1.092  1.000 19.211 0 92  LEU A N   1 ? 
ATOM   697  C CA  . LEU A 1 92  ? 20.116  -12.555 -1.793  1.000 18.696 0 92  LEU A CA  1 ? 
ATOM   698  C C   . LEU A 1 92  ? 21.299  -11.908 -1.048  1.000 18.714 0 92  LEU A C   1 ? 
ATOM   699  O O   . LEU A 1 92  ? 21.184  -10.786 -0.570  1.000 22.245 0 92  LEU A O   1 ? 
ATOM   700  C CB  . LEU A 1 92  ? 20.072  -12.074 -3.241  1.000 19.866 0 92  LEU A CB  1 ? 
ATOM   701  C CG  . LEU A 1 92  ? 18.850  -12.508 -4.066  1.000 21.780 0 92  LEU A CG  1 ? 
ATOM   702  C CD1 . LEU A 1 92  ? 18.973  -11.847 -5.443  1.000 24.315 0 92  LEU A CD1 1 ? 
ATOM   703  C CD2 . LEU A 1 92  ? 18.769  -13.984 -4.099  1.000 22.098 0 92  LEU A CD2 1 ? 
ATOM   704  N N   . ASN A 1 93  ? 22.410  -12.638 -0.985  1.000 21.408 0 93  ASN A N   1 ? 
ATOM   705  C CA  . ASN A 1 93  ? 23.686  -12.081 -0.494  1.000 21.204 0 93  ASN A CA  1 ? 
ATOM   706  C C   . ASN A 1 93  ? 23.533  -11.578 0.935   1.000 23.607 0 93  ASN A C   1 ? 
ATOM   707  O O   . ASN A 1 93  ? 23.886  -10.428 1.244   1.000 24.359 0 93  ASN A O   1 ? 
ATOM   708  C CB  . ASN A 1 93  ? 24.215  -10.949 -1.371  1.000 22.633 0 93  ASN A CB  1 ? 
ATOM   709  C CG  . ASN A 1 93  ? 24.275  -11.316 -2.834  1.000 23.733 0 93  ASN A CG  1 ? 
ATOM   710  O OD1 . ASN A 1 93  ? 23.368  -10.940 -3.595  1.000 24.163 0 93  ASN A OD1 1 ? 
ATOM   711  N ND2 . ASN A 1 93  ? 25.306  -12.036 -3.237  1.000 24.759 0 93  ASN A ND2 1 ? 
ATOM   712  N N   . GLN A 1 94  ? 22.950  -12.444 1.767   1.000 22.348 0 94  GLN A N   1 ? 
ATOM   713  C CA  . GLN A 1 94  ? 22.765  -12.162 3.187   1.000 25.361 0 94  GLN A CA  1 ? 
ATOM   714  C C   . GLN A 1 94  ? 23.885  -12.857 3.942   1.000 22.751 0 94  GLN A C   1 ? 
ATOM   715  O O   . GLN A 1 94  ? 23.882  -14.073 4.154   1.000 22.737 0 94  GLN A O   1 ? 
ATOM   716  C CB  . GLN A 1 94  ? 21.406  -12.664 3.670   1.000 25.519 0 94  GLN A CB  1 ? 
ATOM   717  C CG  . GLN A 1 94  ? 20.258  -12.014 2.911   1.000 29.358 0 94  GLN A CG  1 ? 
ATOM   718  C CD  . GLN A 1 94  ? 20.170  -10.526 3.108   1.000 33.131 0 94  GLN A CD  1 ? 
ATOM   719  O OE1 . GLN A 1 94  ? 20.035  -10.052 4.243   1.000 38.898 0 94  GLN A OE1 1 ? 
ATOM   720  N NE2 . GLN A 1 94  ? 20.222  -9.770  2.018   1.000 32.386 0 94  GLN A NE2 1 ? 
ATOM   721  N N   . TYR A 1 95  ? 24.921  -12.057 4.268   1.000 27.453 0 95  TYR A N   1 ? 
ATOM   722  C CA  . TYR A 1 95  ? 26.111  -12.602 4.909   1.000 27.365 0 95  TYR A CA  1 ? 
ATOM   723  C C   . TYR A 1 95  ? 26.635  -13.820 4.168   1.000 26.383 0 95  TYR A C   1 ? 
ATOM   724  O O   . TYR A 1 95  ? 26.905  -14.856 4.780   1.000 30.562 0 95  TYR A O   1 ? 
ATOM   725  C CB  . TYR A 1 95  ? 25.845  -12.901 6.389   1.000 27.529 0 95  TYR A CB  1 ? 
ATOM   726  C CG  . TYR A 1 95  ? 25.403  -11.670 7.151   1.000 32.983 0 95  TYR A CG  1 ? 
ATOM   727  C CD1 . TYR A 1 95  ? 26.321  -10.753 7.668   1.000 39.809 0 95  TYR A CD1 1 ? 
ATOM   728  C CD2 . TYR A 1 95  ? 24.052  -11.424 7.358   1.000 40.089 0 95  TYR A CD2 1 ? 
ATOM   729  C CE1 . TYR A 1 95  ? 25.907  -9.632  8.375   1.000 41.311 0 95  TYR A CE1 1 ? 
ATOM   730  C CE2 . TYR A 1 95  ? 23.623  -10.311 8.059   1.000 43.994 0 95  TYR A CE2 1 ? 
ATOM   731  C CZ  . TYR A 1 95  ? 24.553  -9.418  8.574   1.000 51.741 0 95  TYR A CZ  1 ? 
ATOM   732  O OH  . TYR A 1 95  ? 24.105  -8.329  9.256   1.000 53.673 0 95  TYR A OH  1 ? 
ATOM   733  N N   . GLY A 1 96  ? 26.767  -13.696 2.822   1.000 25.747 0 96  GLY A N   1 ? 
ATOM   734  C CA  . GLY A 1 96  ? 27.418  -14.708 2.001   1.000 27.294 0 96  GLY A CA  1 ? 
ATOM   735  C C   . GLY A 1 96  ? 26.473  -15.797 1.474   1.000 30.235 0 96  GLY A C   1 ? 
ATOM   736  O O   . GLY A 1 96  ? 26.899  -16.677 0.728   1.000 27.300 0 96  GLY A O   1 ? 
ATOM   737  N N   . LYS A 1 97  ? 25.180  -15.734 1.840   1.000 22.847 0 97  LYS A N   1 ? 
ATOM   738  C CA  . LYS A 1 97  ? 24.256  -16.807 1.501   1.000 24.996 0 97  LYS A CA  1 ? 
ATOM   739  C C   . LYS A 1 97  ? 22.999  -16.217 0.855   1.000 21.537 0 97  LYS A C   1 ? 
ATOM   740  O O   . LYS A 1 97  ? 22.606  -15.086 1.115   1.000 21.424 0 97  LYS A O   1 ? 
ATOM   741  C CB  . LYS A 1 97  ? 23.888  -17.616 2.755   1.000 29.695 0 97  LYS A CB  1 ? 
ATOM   742  C CG  . LYS A 1 97  ? 24.978  -18.504 3.373   1.000 37.529 0 97  LYS A CG  1 ? 
ATOM   743  C CD  . LYS A 1 97  ? 25.620  -19.401 2.330   1.000 43.983 0 97  LYS A CD  1 ? 
ATOM   744  C CE  . LYS A 1 97  ? 26.429  -20.516 2.901   1.000 53.515 0 97  LYS A CE  1 ? 
ATOM   745  N NZ  . LYS A 1 97  ? 26.850  -21.405 1.804   1.000 57.234 0 97  LYS A NZ  1 ? 
ATOM   746  N N   . ASP A 1 98  ? 22.383  -16.999 -0.042  1.000 21.188 0 98  ASP A N   1 ? 
ATOM   747  C CA  . ASP A 1 98  ? 21.052  -16.695 -0.553  1.000 19.843 0 98  ASP A CA  1 ? 
ATOM   748  C C   . ASP A 1 98  ? 20.047  -17.612 0.142   1.000 18.807 0 98  ASP A C   1 ? 
ATOM   749  O O   . ASP A 1 98  ? 20.328  -18.754 0.494   1.000 20.220 0 98  ASP A O   1 ? 
ATOM   750  C CB  . ASP A 1 98  ? 20.977  -16.982 -2.048  1.000 19.671 0 98  ASP A CB  1 ? 
ATOM   751  C CG  . ASP A 1 98  ? 21.742  -16.093 -3.009  1.000 22.665 0 98  ASP A CG  1 ? 
ATOM   752  O OD1 . ASP A 1 98  ? 22.361  -15.085 -2.559  1.000 20.062 0 98  ASP A OD1 1 ? 
ATOM   753  O OD2 . ASP A 1 98  ? 21.646  -16.377 -4.235  1.000 21.712 0 98  ASP A OD2 1 ? 
ATOM   754  N N   . TYR A 1 99  ? 18.825  -17.102 0.349   1.000 18.455 0 99  TYR A N   1 ? 
ATOM   755  C CA  . TYR A 1 99  ? 17.794  -17.888 0.998   1.000 21.051 0 99  TYR A CA  1 ? 
ATOM   756  C C   . TYR A 1 99  ? 16.541  -17.889 0.095   1.000 18.436 0 99  TYR A C   1 ? 
ATOM   757  O O   . TYR A 1 99  ? 16.071  -16.820 -0.256  1.000 20.922 0 99  TYR A O   1 ? 
ATOM   758  C CB  . TYR A 1 99  ? 17.438  -17.263 2.341   1.000 21.178 0 99  TYR A CB  1 ? 
ATOM   759  C CG  . TYR A 1 99  ? 18.582  -17.354 3.321   1.000 23.659 0 99  TYR A CG  1 ? 
ATOM   760  C CD1 . TYR A 1 99  ? 18.825  -18.538 3.980   1.000 24.533 0 99  TYR A CD1 1 ? 
ATOM   761  C CD2 . TYR A 1 99  ? 19.467  -16.293 3.484   1.000 27.987 0 99  TYR A CD2 1 ? 
ATOM   762  C CE1 . TYR A 1 99  ? 19.891  -18.657 4.855   1.000 28.635 0 99  TYR A CE1 1 ? 
ATOM   763  C CE2 . TYR A 1 99  ? 20.550  -16.413 4.341   1.000 29.800 0 99  TYR A CE2 1 ? 
ATOM   764  C CZ  . TYR A 1 99  ? 20.739  -17.590 5.040   1.000 28.450 0 99  TYR A CZ  1 ? 
ATOM   765  O OH  . TYR A 1 99  ? 21.760  -17.742 5.932   1.000 33.552 0 99  TYR A OH  1 ? 
ATOM   766  N N   . ILE A 1 100 ? 16.038  -19.074 -0.228  1.000 18.364 0 100 ILE A N   1 ? 
ATOM   767  C CA  . ILE A 1 100 ? 14.865  -19.220 -1.109  1.000 18.543 0 100 ILE A CA  1 ? 
ATOM   768  C C   . ILE A 1 100 ? 13.823  -20.105 -0.446  1.000 18.305 0 100 ILE A C   1 ? 
ATOM   769  O O   . ILE A 1 100 ? 14.102  -21.034 0.306   1.000 18.639 0 100 ILE A O   1 ? 
ATOM   770  C CB  . ILE A 1 100 ? 15.229  -19.742 -2.504  1.000 18.939 0 100 ILE A CB  1 ? 
ATOM   771  C CG1 . ILE A 1 100 ? 15.668  -21.217 -2.483  1.000 22.222 0 100 ILE A CG1 1 ? 
ATOM   772  C CG2 . ILE A 1 100 ? 16.294  -18.844 -3.111  1.000 20.221 0 100 ILE A CG2 1 ? 
ATOM   773  C CD1 . ILE A 1 100 ? 15.773  -21.872 -3.844  1.000 25.826 0 100 ILE A CD1 1 ? 
ATOM   774  N N   . ASP A 1 101 ? 12.571  -19.827 -0.787  1.000 16.397 0 101 ASP A N   1 ? 
ATOM   775  C CA  . ASP A 1 101 ? 11.474  -20.658 -0.333  1.000 17.104 0 101 ASP A CA  1 ? 
ATOM   776  C C   . ASP A 1 101 ? 10.279  -20.419 -1.249  1.000 15.796 0 101 ASP A C   1 ? 
ATOM   777  O O   . ASP A 1 101 ? 10.233  -19.483 -2.039  1.000 15.899 0 101 ASP A O   1 ? 
ATOM   778  C CB  . ASP A 1 101 ? 11.098  -20.325 1.112   1.000 17.024 0 101 ASP A CB  1 ? 
ATOM   779  C CG  . ASP A 1 101 ? 10.469  -18.972 1.363   1.000 18.639 0 101 ASP A CG  1 ? 
ATOM   780  O OD1 . ASP A 1 101 ? 9.263   -18.798 1.078   1.000 18.163 0 101 ASP A OD1 1 ? 
ATOM   781  O OD2 . ASP A 1 101 ? 11.184  -18.050 1.772   1.000 20.408 0 101 ASP A OD2 1 ? 
ATOM   782  N N   . ILE A 1 102 ? 9.338   -21.361 -1.143  1.000 16.157 0 102 ILE A N   1 ? 
ATOM   783  C CA  . ILE A 1 102 ? 8.002   -21.164 -1.644  1.000 14.425 0 102 ILE A CA  1 ? 
ATOM   784  C C   . ILE A 1 102 ? 7.076   -21.076 -0.446  1.000 15.001 0 102 ILE A C   1 ? 
ATOM   785  O O   . ILE A 1 102 ? 7.216   -21.793 0.549   1.000 15.722 0 102 ILE A O   1 ? 
ATOM   786  C CB  . ILE A 1 102 ? 7.616   -22.272 -2.627  1.000 16.438 0 102 ILE A CB  1 ? 
ATOM   787  C CG1 . ILE A 1 102 ? 8.434   -22.181 -3.909  1.000 17.488 0 102 ILE A CG1 1 ? 
ATOM   788  C CG2 . ILE A 1 102 ? 6.122   -22.212 -2.969  1.000 20.554 0 102 ILE A CG2 1 ? 
ATOM   789  C CD1 . ILE A 1 102 ? 8.204   -23.352 -4.833  1.000 21.605 0 102 ILE A CD1 1 ? 
ATOM   790  N N   . SER A 1 103 ? 6.093   -20.201 -0.578  1.000 13.343 0 103 SER A N   1 ? 
ATOM   791  C CA  . SER A 1 103 ? 5.137   -19.950 0.497   1.000 13.863 0 103 SER A CA  1 ? 
ATOM   792  C C   . SER A 1 103 ? 3.708   -20.024 -0.021  1.000 14.541 0 103 SER A C   1 ? 
ATOM   793  O O   . SER A 1 103 ? 3.410   -19.485 -1.080  1.000 14.427 0 103 SER A O   1 ? 
ATOM   794  C CB  . SER A 1 103 ? 5.396   -18.608 1.126   1.000 15.448 0 103 SER A CB  1 ? 
ATOM   795  O OG  . SER A 1 103 ? 4.373   -18.268 2.066   1.000 17.832 0 103 SER A OG  1 ? 
ATOM   796  N N   . ASN A 1 104 ? 2.835   -20.698 0.756   1.000 14.671 0 104 ASN A N   1 ? 
ATOM   797  C CA  . ASN A 1 104 ? 1.382   -20.680 0.647   1.000 14.319 0 104 ASN A CA  1 ? 
ATOM   798  C C   . ASN A 1 104 ? 0.701   -19.846 1.737   1.000 14.661 0 104 ASN A C   1 ? 
ATOM   799  O O   . ASN A 1 104 ? -0.529  -19.908 1.905   1.000 15.300 0 104 ASN A O   1 ? 
ATOM   800  C CB  . ASN A 1 104 ? 0.809   -22.091 0.708   1.000 14.319 0 104 ASN A CB  1 ? 
ATOM   801  C CG  . ASN A 1 104 ? 1.135   -22.904 -0.520  1.000 17.877 0 104 ASN A CG  1 ? 
ATOM   802  O OD1 . ASN A 1 104 ? 1.117   -22.376 -1.628  1.000 18.882 0 104 ASN A OD1 1 ? 
ATOM   803  N ND2 . ASN A 1 104 ? 1.440   -24.166 -0.351  1.000 17.138 0 104 ASN A ND2 1 ? 
ATOM   804  N N   . ILE A 1 105 ? 1.467   -18.949 2.383   1.000 14.684 0 105 ILE A N   1 ? 
ATOM   805  C CA  . ILE A 1 105 ? 0.907   -18.154 3.464   1.000 15.937 0 105 ILE A CA  1 ? 
ATOM   806  C C   . ILE A 1 105 ? -0.132  -17.181 2.933   1.000 16.092 0 105 ILE A C   1 ? 
ATOM   807  O O   . ILE A 1 105 ? -1.020  -16.767 3.703   1.000 16.536 0 105 ILE A O   1 ? 
ATOM   808  C CB  . ILE A 1 105 ? 2.046   -17.482 4.252   1.000 17.981 0 105 ILE A CB  1 ? 
ATOM   809  C CG1 . ILE A 1 105 ? 2.837   -18.531 5.037   1.000 21.433 0 105 ILE A CG1 1 ? 
ATOM   810  C CG2 . ILE A 1 105 ? 1.571   -16.348 5.160   1.000 21.240 0 105 ILE A CG2 1 ? 
ATOM   811  C CD1 . ILE A 1 105 ? 4.138   -17.996 5.616   1.000 22.479 0 105 ILE A CD1 1 ? 
ATOM   812  N N   . LYS A 1 106 ? -0.002  -16.765 1.668   1.000 14.221 0 106 LYS A N   1 ? 
ATOM   813  C CA  . LYS A 1 106 ? -0.951  -15.865 1.003   1.000 16.232 0 106 LYS A CA  1 ? 
ATOM   814  C C   . LYS A 1 106 ? -1.723  -16.659 -0.031  1.000 14.714 0 106 LYS A C   1 ? 
ATOM   815  O O   . LYS A 1 106 ? -2.186  -16.060 -0.994  1.000 16.027 0 106 LYS A O   1 ? 
ATOM   816  C CB  . LYS A 1 106 ? -0.228  -14.657 0.366   1.000 17.521 0 106 LYS A CB  1 ? 
ATOM   817  C CG  . LYS A 1 106 ? 0.572   -13.777 1.332   1.000 22.378 0 106 LYS A CG  1 ? 
ATOM   818  C CD  . LYS A 1 106 ? -0.413  -12.915 2.093   1.000 30.787 0 106 LYS A CD  1 ? 
ATOM   819  C CE  . LYS A 1 106 ? 0.220   -11.911 3.021   1.000 37.874 0 106 LYS A CE  1 ? 
ATOM   820  N NZ  . LYS A 1 106 ? -0.857  -11.275 3.794   1.000 40.283 0 106 LYS A NZ  1 ? 
ATOM   821  N N   . GLY A 1 107 ? -1.903  -17.963 0.211   1.000 14.369 0 107 GLY A N   1 ? 
ATOM   822  C CA  . GLY A 1 107 ? -2.733  -18.783 -0.649  1.000 15.974 0 107 GLY A CA  1 ? 
ATOM   823  C C   . GLY A 1 107 ? -1.963  -19.327 -1.857  1.000 15.680 0 107 GLY A C   1 ? 
ATOM   824  O O   . GLY A 1 107 ? -0.734  -19.238 -1.911  1.000 17.619 0 107 GLY A O   1 ? 
ATOM   825  N N   . PHE A 1 108 ? -2.731  -19.915 -2.754  1.000 14.763 0 108 PHE A N   1 ? 
ATOM   826  C CA  . PHE A 1 108 ? -2.187  -20.633 -3.890  1.000 15.775 0 108 PHE A CA  1 ? 
ATOM   827  C C   . PHE A 1 108 ? -3.034  -20.293 -5.100  1.000 15.499 0 108 PHE A C   1 ? 
ATOM   828  O O   . PHE A 1 108 ? -4.241  -20.322 -5.038  1.000 15.567 0 108 PHE A O   1 ? 
ATOM   829  C CB  . PHE A 1 108 ? -2.184  -22.136 -3.589  1.000 16.733 0 108 PHE A CB  1 ? 
ATOM   830  C CG  . PHE A 1 108 ? -1.735  -23.006 -4.748  1.000 14.406 0 108 PHE A CG  1 ? 
ATOM   831  C CD1 . PHE A 1 108 ? -2.607  -23.275 -5.790  1.000 14.401 0 108 PHE A CD1 1 ? 
ATOM   832  C CD2 . PHE A 1 108 ? -0.471  -23.575 -4.735  1.000 15.743 0 108 PHE A CD2 1 ? 
ATOM   833  C CE1 . PHE A 1 108 ? -2.171  -24.077 -6.843  1.000 18.347 0 108 PHE A CE1 1 ? 
ATOM   834  C CE2 . PHE A 1 108 ? -0.047  -24.391 -5.775  1.000 16.351 0 108 PHE A CE2 1 ? 
ATOM   835  C CZ  . PHE A 1 108 ? -0.900  -24.630 -6.810  1.000 16.801 0 108 PHE A CZ  1 ? 
ATOM   836  N N   . ASN A 1 109 ? -2.392  -19.942 -6.208  1.000 15.431 0 109 ASN A N   1 ? 
ATOM   837  C CA  . ASN A 1 109 ? -3.101  -19.772 -7.474  1.000 13.516 0 109 ASN A CA  1 ? 
ATOM   838  C C   . ASN A 1 109 ? -2.555  -20.698 -8.561  1.000 15.727 0 109 ASN A C   1 ? 
ATOM   839  O O   . ASN A 1 109 ? -3.350  -21.316 -9.280  1.000 17.081 0 109 ASN A O   1 ? 
ATOM   840  C CB  . ASN A 1 109 ? -3.159  -18.323 -7.904  1.000 15.341 0 109 ASN A CB  1 ? 
ATOM   841  C CG  . ASN A 1 109 ? -1.829  -17.654 -8.155  1.000 14.102 0 109 ASN A CG  1 ? 
ATOM   842  O OD1 . ASN A 1 109 ? -0.778  -18.113 -7.682  1.000 13.543 0 109 ASN A OD1 1 ? 
ATOM   843  N ND2 . ASN A 1 109 ? -1.904  -16.563 -8.884  1.000 15.398 0 109 ASN A ND2 1 ? 
ATOM   844  N N   . VAL A 1 110 ? -1.236  -20.750 -8.718  1.000 14.696 0 110 VAL A N   1 ? 
ATOM   845  C CA  A VAL A 1 110 ? -0.590  -21.468 -9.801  0.800 16.020 0 110 VAL A CA  1 ? 
ATOM   846  C CA  B VAL A 1 110 ? -0.602  -21.481 -9.801  0.200 14.984 0 110 VAL A CA  1 ? 
ATOM   847  C C   . VAL A 1 110 ? 0.491   -22.347 -9.189  1.000 15.351 0 110 VAL A C   1 ? 
ATOM   848  O O   . VAL A 1 110 ? 1.250   -21.880 -8.305  1.000 16.365 0 110 VAL A O   1 ? 
ATOM   849  C CB  A VAL A 1 110 ? 0.007   -20.442 -10.790 0.800 18.361 0 110 VAL A CB  1 ? 
ATOM   850  C CB  B VAL A 1 110 ? -0.026  -20.543 -10.884 0.200 14.890 0 110 VAL A CB  1 ? 
ATOM   851  C CG1 A VAL A 1 110 ? 0.976   -21.031 -11.802 0.800 20.371 0 110 VAL A CG1 1 ? 
ATOM   852  C CG1 B VAL A 1 110 ? 1.129   -19.700 -10.363 0.200 14.565 0 110 VAL A CG1 1 ? 
ATOM   853  C CG2 A VAL A 1 110 ? -1.073  -19.620 -11.487 0.800 18.952 0 110 VAL A CG2 1 ? 
ATOM   854  C CG2 B VAL A 1 110 ? 0.425   -21.271 -12.145 0.200 15.281 0 110 VAL A CG2 1 ? 
ATOM   855  N N   . PRO A 1 111 ? 0.671   -23.582 -9.670  1.000 14.219 0 111 PRO A N   1 ? 
ATOM   856  C CA  . PRO A 1 111 ? 1.758   -24.441 -9.209  1.000 14.807 0 111 PRO A CA  1 ? 
ATOM   857  C C   . PRO A 1 111 ? 3.105   -23.894 -9.662  1.000 15.219 0 111 PRO A C   1 ? 
ATOM   858  O O   . PRO A 1 111 ? 3.162   -23.235 -10.676 1.000 15.210 0 111 PRO A O   1 ? 
ATOM   859  C CB  . PRO A 1 111 ? 1.445   -25.801 -9.836  1.000 16.335 0 111 PRO A CB  1 ? 
ATOM   860  C CG  . PRO A 1 111 ? 0.556   -25.492 -10.979 1.000 17.762 0 111 PRO A CG  1 ? 
ATOM   861  C CD  . PRO A 1 111 ? -0.217  -24.259 -10.655 1.000 15.642 0 111 PRO A CD  1 ? 
ATOM   862  N N   . MET A 1 112 ? 4.162   -24.166 -8.895  1.000 15.781 0 112 MET A N   1 ? 
ATOM   863  C CA  . MET A 1 112 ? 5.457   -23.531 -9.099  1.000 16.132 0 112 MET A CA  1 ? 
ATOM   864  C C   . MET A 1 112 ? 6.590   -24.445 -8.646  1.000 16.360 0 112 MET A C   1 ? 
ATOM   865  O O   . MET A 1 112 ? 6.484   -25.131 -7.649  1.000 17.817 0 112 MET A O   1 ? 
ATOM   866  C CB  . MET A 1 112 ? 5.470   -22.247 -8.244  1.000 20.790 0 112 MET A CB  1 ? 
ATOM   867  C CG  . MET A 1 112 ? 6.756   -21.497 -8.180  1.000 25.948 0 112 MET A CG  1 ? 
ATOM   868  S SD  . MET A 1 112 ? 6.522   -20.252 -6.894  1.000 23.966 0 112 MET A SD  1 ? 
ATOM   869  C CE  . MET A 1 112 ? 5.398   -19.152 -7.741  1.000 26.233 0 112 MET A CE  1 ? 
ATOM   870  N N   . ASN A 1 113 ? 7.708   -24.366 -9.376  1.000 15.566 0 113 ASN A N   1 ? 
ATOM   871  C CA  . ASN A 1 113 ? 9.007   -24.897 -9.017  1.000 15.964 0 113 ASN A CA  1 ? 
ATOM   872  C C   . ASN A 1 113 ? 9.964   -23.703 -8.949  1.000 14.564 0 113 ASN A C   1 ? 
ATOM   873  O O   . ASN A 1 113 ? 9.948   -22.815 -9.798  1.000 16.370 0 113 ASN A O   1 ? 
ATOM   874  C CB  . ASN A 1 113 ? 9.471   -25.889 -10.063 1.000 16.619 0 113 ASN A CB  1 ? 
ATOM   875  C CG  . ASN A 1 113 ? 10.808  -26.513 -9.732  1.000 20.612 0 113 ASN A CG  1 ? 
ATOM   876  O OD1 . ASN A 1 113 ? 10.886  -27.579 -9.119  1.000 21.298 0 113 ASN A OD1 1 ? 
ATOM   877  N ND2 . ASN A 1 113 ? 11.854  -25.790 -10.041 1.000 19.506 0 113 ASN A ND2 1 ? 
ATOM   878  N N   . PHE A 1 114 ? 10.774  -23.668 -7.894  1.000 16.032 0 114 PHE A N   1 ? 
ATOM   879  C CA  . PHE A 1 114 ? 11.764  -22.612 -7.746  1.000 14.935 0 114 PHE A CA  1 ? 
ATOM   880  C C   . PHE A 1 114 ? 13.113  -23.273 -7.492  1.000 16.706 0 114 PHE A C   1 ? 
ATOM   881  O O   . PHE A 1 114 ? 13.318  -23.850 -6.433  1.000 18.373 0 114 PHE A O   1 ? 
ATOM   882  C CB  . PHE A 1 114 ? 11.352  -21.754 -6.553  1.000 14.980 0 114 PHE A CB  1 ? 
ATOM   883  C CG  . PHE A 1 114 ? 12.166  -20.518 -6.264  1.000 15.781 0 114 PHE A CG  1 ? 
ATOM   884  C CD1 . PHE A 1 114 ? 13.171  -20.035 -7.125  1.000 17.452 0 114 PHE A CD1 1 ? 
ATOM   885  C CD2 . PHE A 1 114 ? 11.942  -19.824 -5.081  1.000 15.568 0 114 PHE A CD2 1 ? 
ATOM   886  C CE1 . PHE A 1 114 ? 13.882  -18.888 -6.802  1.000 18.485 0 114 PHE A CE1 1 ? 
ATOM   887  C CE2 . PHE A 1 114 ? 12.640  -18.684 -4.768  1.000 18.033 0 114 PHE A CE2 1 ? 
ATOM   888  C CZ  . PHE A 1 114 ? 13.600  -18.189 -5.634  1.000 18.440 0 114 PHE A CZ  1 ? 
ATOM   889  N N   . SER A 1 115 ? 13.992  -23.198 -8.485  1.000 15.837 0 115 SER A N   1 ? 
ATOM   890  C CA  . SER A 1 115 ? 15.211  -24.015 -8.455  1.000 17.945 0 115 SER A CA  1 ? 
ATOM   891  C C   . SER A 1 115 ? 16.409  -23.154 -8.841  1.000 19.642 0 115 SER A C   1 ? 
ATOM   892  O O   . SER A 1 115 ? 16.305  -22.237 -9.648  1.000 20.449 0 115 SER A O   1 ? 
ATOM   893  C CB  . SER A 1 115 ? 15.138  -25.220 -9.377  1.000 20.087 0 115 SER A CB  1 ? 
ATOM   894  O OG  . SER A 1 115 ? 14.232  -26.206 -8.918  1.000 22.301 0 115 SER A OG  1 ? 
ATOM   895  N N   . PRO A 1 116 ? 17.581  -23.404 -8.233  1.000 19.263 0 116 PRO A N   1 ? 
ATOM   896  C CA  . PRO A 1 116 ? 18.809  -22.775 -8.726  1.000 20.493 0 116 PRO A CA  1 ? 
ATOM   897  C C   . PRO A 1 116 ? 19.162  -23.342 -10.103 1.000 22.031 0 116 PRO A C   1 ? 
ATOM   898  O O   . PRO A 1 116 ? 18.858  -24.509 -10.421 1.000 22.490 0 116 PRO A O   1 ? 
ATOM   899  C CB  . PRO A 1 116 ? 19.829  -23.189 -7.634  1.000 21.100 0 116 PRO A CB  1 ? 
ATOM   900  C CG  . PRO A 1 116 ? 19.337  -24.530 -7.155  1.000 22.483 0 116 PRO A CG  1 ? 
ATOM   901  C CD  . PRO A 1 116 ? 17.817  -24.413 -7.184  1.000 21.818 0 116 PRO A CD  1 ? 
ATOM   902  N N   . THR A 1 117 ? 19.816  -22.488 -10.890 1.000 21.857 0 117 THR A N   1 ? 
ATOM   903  C CA  . THR A 1 117 ? 20.425  -22.886 -12.163 1.000 23.908 0 117 THR A CA  1 ? 
ATOM   904  C C   . THR A 1 117 ? 21.930  -22.994 -12.024 1.000 27.862 0 117 THR A C   1 ? 
ATOM   905  O O   . THR A 1 117 ? 22.556  -23.386 -13.002 1.000 29.980 0 117 THR A O   1 ? 
ATOM   906  C CB  . THR A 1 117 ? 20.102  -21.910 -13.279 1.000 24.096 0 117 THR A CB  1 ? 
ATOM   907  O OG1 . THR A 1 117 ? 20.531  -20.592 -12.964 1.000 26.651 0 117 THR A OG1 1 ? 
ATOM   908  C CG2 . THR A 1 117 ? 18.616  -21.887 -13.582 1.000 25.931 0 117 THR A CG2 1 ? 
ATOM   909  N N   . THR A 1 118 ? 22.466  -22.644 -10.843 1.000 26.344 0 118 THR A N   1 ? 
ATOM   910  C CA  . THR A 1 118 ? 23.885  -22.801 -10.517 1.000 28.275 0 118 THR A CA  1 ? 
ATOM   911  C C   . THR A 1 118 ? 24.006  -23.876 -9.436  1.000 32.955 0 118 THR A C   1 ? 
ATOM   912  O O   . THR A 1 118 ? 23.006  -24.389 -8.930  1.000 32.830 0 118 THR A O   1 ? 
ATOM   913  C CB  . THR A 1 118 ? 24.469  -21.453 -10.084 1.000 30.967 0 118 THR A CB  1 ? 
ATOM   914  O OG1 . THR A 1 118 ? 23.632  -20.914 -9.055  1.000 28.881 0 118 THR A OG1 1 ? 
ATOM   915  C CG2 . THR A 1 118 ? 24.586  -20.453 -11.219 1.000 35.370 0 118 THR A CG2 1 ? 
ATOM   916  N N   . ARG A 1 119 ? 25.239  -24.184 -9.014  1.000 34.546 0 119 ARG A N   1 ? 
ATOM   917  C CA  . ARG A 1 119 ? 25.486  -25.360 -8.187  1.000 35.684 0 119 ARG A CA  1 ? 
ATOM   918  C C   . ARG A 1 119 ? 25.314  -25.056 -6.696  1.000 34.674 0 119 ARG A C   1 ? 
ATOM   919  O O   . ARG A 1 119 ? 25.451  -23.912 -6.263  1.000 37.901 0 119 ARG A O   1 ? 
ATOM   920  C CB  . ARG A 1 119 ? 26.918  -25.893 -8.416  1.000 40.681 0 119 ARG A CB  1 ? 
ATOM   921  C CG  . ARG A 1 119 ? 27.068  -27.378 -8.100  0.300 42.648 0 119 ARG A CG  1 ? 
ATOM   922  C CD  . ARG A 1 119 ? 28.441  -27.950 -8.461  0.600 46.184 0 119 ARG A CD  1 ? 
ATOM   923  N NE  . ARG A 1 119 ? 29.532  -27.303 -7.723  0.580 49.538 0 119 ARG A NE  1 ? 
ATOM   924  C CZ  . ARG A 1 119 ? 30.382  -26.427 -8.242  0.260 47.824 0 119 ARG A CZ  1 ? 
ATOM   925  N NH1 . ARG A 1 119 ? 30.223  -26.009 -9.485  0.700 50.099 0 119 ARG A NH1 1 ? 
ATOM   926  N NH2 . ARG A 1 119 ? 31.375  -25.958 -7.510  0.370 44.787 0 119 ARG A NH2 1 ? 
ATOM   927  N N   . GLY A 1 120 ? 25.004  -26.088 -5.905  1.000 31.902 0 120 GLY A N   1 ? 
ATOM   928  C CA  . GLY A 1 120 ? 25.277  -26.028 -4.480  1.000 36.101 0 120 GLY A CA  1 ? 
ATOM   929  C C   . GLY A 1 120 ? 24.042  -25.994 -3.574  1.000 35.069 0 120 GLY A C   1 ? 
ATOM   930  O O   . GLY A 1 120 ? 24.196  -25.787 -2.377  1.000 32.362 0 120 GLY A O   1 ? 
ATOM   931  N N   . CYS A 1 121 ? 22.832  -26.152 -4.128  1.000 30.006 0 121 CYS A N   1 ? 
ATOM   932  C CA  . CYS A 1 121 ? 21.649  -26.285 -3.296  1.000 30.123 0 121 CYS A CA  1 ? 
ATOM   933  C C   . CYS A 1 121 ? 20.556  -26.957 -4.126  1.000 33.154 0 121 CYS A C   1 ? 
ATOM   934  O O   . CYS A 1 121 ? 20.720  -27.143 -5.322  1.000 35.895 0 121 CYS A O   1 ? 
ATOM   935  C CB  . CYS A 1 121 ? 21.187  -24.935 -2.743  1.000 27.142 0 121 CYS A CB  1 ? 
ATOM   936  S SG  . CYS A 1 121 ? 21.036  -23.656 -4.010  1.000 27.172 0 121 CYS A SG  1 ? 
ATOM   937  N N   . ARG A 1 122 ? 19.439  -27.243 -3.474  1.000 28.949 0 122 ARG A N   1 ? 
ATOM   938  C CA  A ARG A 1 122 ? 18.304  -27.928 -4.070  0.450 31.622 0 122 ARG A CA  1 ? 
ATOM   939  C CA  B ARG A 1 122 ? 18.306  -27.927 -4.073  0.550 31.782 0 122 ARG A CA  1 ? 
ATOM   940  C C   . ARG A 1 122 ? 17.221  -26.895 -4.380  1.000 27.289 0 122 ARG A C   1 ? 
ATOM   941  O O   . ARG A 1 122 ? 17.280  -25.778 -3.881  1.000 26.442 0 122 ARG A O   1 ? 
ATOM   942  C CB  A ARG A 1 122 ? 17.750  -28.966 -3.085  0.450 34.597 0 122 ARG A CB  1 ? 
ATOM   943  C CB  B ARG A 1 122 ? 17.713  -28.946 -3.094  0.550 34.470 0 122 ARG A CB  1 ? 
ATOM   944  C CG  A ARG A 1 122 ? 17.020  -28.389 -1.878  0.450 38.861 0 122 ARG A CG  1 ? 
ATOM   945  C CG  B ARG A 1 122 ? 16.832  -28.348 -2.001  0.550 38.676 0 122 ARG A CG  1 ? 
ATOM   946  C CD  A ARG A 1 122 ? 16.837  -29.386 -0.736  0.450 42.009 0 122 ARG A CD  1 ? 
ATOM   947  C CD  B ARG A 1 122 ? 16.155  -29.344 -1.058  0.550 40.639 0 122 ARG A CD  1 ? 
ATOM   948  N NE  A ARG A 1 122 ? 16.274  -28.767 0.471   0.450 45.704 0 122 ARG A NE  1 ? 
ATOM   949  N NE  B ARG A 1 122 ? 15.949  -30.688 -1.616  0.550 44.167 0 122 ARG A NE  1 ? 
ATOM   950  C CZ  A ARG A 1 122 ? 16.971  -28.475 1.567   0.450 46.830 0 122 ARG A CZ  1 ? 
ATOM   951  C CZ  B ARG A 1 122 ? 15.152  -31.627 -1.113  0.550 44.833 0 122 ARG A CZ  1 ? 
ATOM   952  N NH1 A ARG A 1 122 ? 18.263  -28.716 1.608   0.450 45.663 0 122 ARG A NH1 1 ? 
ATOM   953  N NH1 B ARG A 1 122 ? 15.212  -32.859 -1.586  0.550 45.160 0 122 ARG A NH1 1 ? 
ATOM   954  N NH2 A ARG A 1 122 ? 16.384  -27.925 2.617   0.450 46.021 0 122 ARG A NH2 1 ? 
ATOM   955  N NH2 B ARG A 1 122 ? 14.329  -31.347 -0.114  0.550 45.176 0 122 ARG A NH2 1 ? 
ATOM   956  N N   . GLY A 1 123 ? 16.260  -27.289 -5.201  1.000 24.952 0 123 GLY A N   1 ? 
ATOM   957  C CA  . GLY A 1 123 ? 15.087  -26.481 -5.492  1.000 22.299 0 123 GLY A CA  1 ? 
ATOM   958  C C   . GLY A 1 123 ? 13.940  -26.877 -4.567  1.000 25.076 0 123 GLY A C   1 ? 
ATOM   959  O O   . GLY A 1 123 ? 14.025  -27.871 -3.846  1.000 25.320 0 123 GLY A O   1 ? 
ATOM   960  N N   . VAL A 1 124 ? 12.840  -26.126 -4.654  1.000 21.401 0 124 VAL A N   1 ? 
ATOM   961  C CA  A VAL A 1 124 ? 11.614  -26.469 -3.947  1.000 21.933 0 124 VAL A CA  1 ? 
ATOM   962  C CA  B VAL A 1 124 ? 11.622  -26.354 -3.957  0.000 23.080 0 124 VAL A CA  1 ? 
ATOM   963  C C   . VAL A 1 124 ? 10.455  -26.353 -4.930  1.000 21.317 0 124 VAL A C   1 ? 
ATOM   964  O O   . VAL A 1 124 ? 10.513  -25.615 -5.925  1.000 20.445 0 124 VAL A O   1 ? 
ATOM   965  C CB  A VAL A 1 124 ? 11.375  -25.570 -2.720  1.000 26.650 0 124 VAL A CB  1 ? 
ATOM   966  C CB  B VAL A 1 124 ? 11.384  -25.386 -2.782  0.000 25.710 0 124 VAL A CB  1 ? 
ATOM   967  C CG1 A VAL A 1 124 ? 12.253  -26.020 -1.547  1.000 34.824 0 124 VAL A CG1 1 ? 
ATOM   968  C CG1 B VAL A 1 124 ? 11.980  -25.912 -1.482  0.000 30.770 0 124 VAL A CG1 1 ? 
ATOM   969  C CG2 A VAL A 1 124 ? 11.607  -24.115 -3.036  1.000 27.144 0 124 VAL A CG2 1 ? 
ATOM   970  C CG2 B VAL A 1 124 ? 11.899  -23.984 -3.086  0.000 25.360 0 124 VAL A CG2 1 ? 
ATOM   971  N N   . ARG A 1 125 ? 9.402   -27.113 -4.654  1.000 18.026 0 125 ARG A N   1 ? 
ATOM   972  C CA  . ARG A 1 125 ? 8.275   -27.180 -5.572  1.000 20.490 0 125 ARG A CA  1 ? 
ATOM   973  C C   . ARG A 1 125 ? 6.977   -27.288 -4.777  1.000 20.039 0 125 ARG A C   1 ? 
ATOM   974  O O   . ARG A 1 125 ? 6.953   -27.915 -3.724  1.000 21.485 0 125 ARG A O   1 ? 
ATOM   975  C CB  . ARG A 1 125 ? 8.487   -28.403 -6.468  1.000 26.454 0 125 ARG A CB  1 ? 
ATOM   976  C CG  . ARG A 1 125 ? 7.345   -28.711 -7.414  1.000 31.360 0 125 ARG A CG  1 ? 
ATOM   977  C CD  . ARG A 1 125 ? 7.687   -29.919 -8.314  1.000 34.323 0 125 ARG A CD  1 ? 
ATOM   978  N NE  . ARG A 1 125 ? 8.843   -29.607 -9.167  1.000 37.425 0 125 ARG A NE  1 ? 
ATOM   979  C CZ  . ARG A 1 125 ? 9.241   -30.346 -10.204 1.000 47.138 0 125 ARG A CZ  1 ? 
ATOM   980  N NH1 . ARG A 1 125 ? 8.596   -31.459 -10.518 1.000 54.220 0 125 ARG A NH1 1 ? 
ATOM   981  N NH2 . ARG A 1 125 ? 10.261  -29.958 -10.942 1.000 40.826 0 125 ARG A NH2 1 ? 
ATOM   982  N N   . CYS A 1 126 ? 5.926   -26.658 -5.287  1.000 17.405 0 126 CYS A N   1 ? 
ATOM   983  C CA  . CYS A 1 126 ? 4.555   -26.927 -4.879  1.000 17.777 0 126 CYS A CA  1 ? 
ATOM   984  C C   . CYS A 1 126 ? 3.731   -27.052 -6.154  1.000 18.221 0 126 CYS A C   1 ? 
ATOM   985  O O   . CYS A 1 126 ? 3.340   -26.038 -6.755  1.000 17.834 0 126 CYS A O   1 ? 
ATOM   986  C CB  . CYS A 1 126 ? 4.027   -25.827 -3.971  1.000 17.755 0 126 CYS A CB  1 ? 
ATOM   987  S SG  . CYS A 1 126 ? 2.291   -26.083 -3.490  1.000 18.759 0 126 CYS A SG  1 ? 
ATOM   988  N N   . ALA A 1 127 ? 3.440   -28.305 -6.521  1.000 19.617 0 127 ALA A N   1 ? 
ATOM   989  C CA  . ALA A 1 127 ? 2.822   -28.594 -7.806  1.000 23.026 0 127 ALA A CA  1 ? 
ATOM   990  C C   . ALA A 1 127 ? 1.565   -29.447 -7.662  1.000 27.110 0 127 ALA A C   1 ? 
ATOM   991  O O   . ALA A 1 127 ? 1.009   -29.892 -8.653  1.000 27.610 0 127 ALA A O   1 ? 
ATOM   992  C CB  . ALA A 1 127 ? 3.834   -29.267 -8.697  1.000 24.814 0 127 ALA A CB  1 ? 
ATOM   993  N N   . ALA A 1 128 ? 1.044   -29.585 -6.452  1.000 23.571 0 128 ALA A N   1 ? 
ATOM   994  C CA  . ALA A 1 128 ? -0.222  -30.304 -6.257  1.000 23.255 0 128 ALA A CA  1 ? 
ATOM   995  C C   . ALA A 1 128 ? -1.410  -29.483 -6.732  1.000 22.292 0 128 ALA A C   1 ? 
ATOM   996  O O   . ALA A 1 128 ? -1.329  -28.265 -6.838  1.000 21.379 0 128 ALA A O   1 ? 
ATOM   997  C CB  . ALA A 1 128 ? -0.384  -30.664 -4.806  1.000 25.298 0 128 ALA A CB  1 ? 
ATOM   998  N N   . ASP A 1 129 ? -2.556  -30.163 -6.921  1.000 23.843 0 129 ASP A N   1 ? 
ATOM   999  C CA  . ASP A 1 129 ? -3.792  -29.535 -7.345  1.000 26.200 0 129 ASP A CA  1 ? 
ATOM   1000 C C   . ASP A 1 129 ? -4.518  -28.928 -6.148  1.000 22.198 0 129 ASP A C   1 ? 
ATOM   1001 O O   . ASP A 1 129 ? -5.583  -29.358 -5.727  1.000 22.297 0 129 ASP A O   1 ? 
ATOM   1002 C CB  . ASP A 1 129 ? -4.715  -30.507 -8.062  1.000 30.380 0 129 ASP A CB  1 ? 
ATOM   1003 C CG  . ASP A 1 129 ? -5.918  -29.843 -8.711  1.000 28.880 0 129 ASP A CG  1 ? 
ATOM   1004 O OD1 . ASP A 1 129 ? -5.944  -28.594 -8.800  1.000 28.151 0 129 ASP A OD1 1 ? 
ATOM   1005 O OD2 . ASP A 1 129 ? -6.843  -30.590 -9.062  1.000 35.699 0 129 ASP A OD2 1 ? 
ATOM   1006 N N   . ILE A 1 130 ? -3.891  -27.901 -5.596  1.000 18.116 0 130 ILE A N   1 ? 
ATOM   1007 C CA  . ILE A 1 130 ? -4.468  -27.236 -4.443  1.000 18.105 0 130 ILE A CA  1 ? 
ATOM   1008 C C   . ILE A 1 130 ? -5.792  -26.588 -4.811  1.000 18.201 0 130 ILE A C   1 ? 
ATOM   1009 O O   . ILE A 1 130 ? -6.680  -26.544 -3.985  1.000 21.817 0 130 ILE A O   1 ? 
ATOM   1010 C CB  . ILE A 1 130 ? -3.450  -26.277 -3.817  1.000 18.188 0 130 ILE A CB  1 ? 
ATOM   1011 C CG1 . ILE A 1 130 ? -2.386  -27.112 -3.082  1.000 21.090 0 130 ILE A CG1 1 ? 
ATOM   1012 C CG2 . ILE A 1 130 ? -4.174  -25.252 -2.920  1.000 19.665 0 130 ILE A CG2 1 ? 
ATOM   1013 C CD1 . ILE A 1 130 ? -1.295  -26.341 -2.393  1.000 22.561 0 130 ILE A CD1 1 ? 
ATOM   1014 N N   . VAL A 1 131 ? -5.938  -26.006 -6.004  1.000 17.082 0 131 VAL A N   1 ? 
ATOM   1015 C CA  . VAL A 1 131 ? -7.182  -25.352 -6.331  1.000 18.245 0 131 VAL A CA  1 ? 
ATOM   1016 C C   . VAL A 1 131 ? -8.327  -26.357 -6.396  1.000 20.209 0 131 VAL A C   1 ? 
ATOM   1017 O O   . VAL A 1 131 ? -9.401  -26.106 -5.840  1.000 22.303 0 131 VAL A O   1 ? 
ATOM   1018 C CB  . VAL A 1 131 ? -7.059  -24.520 -7.614  1.000 23.583 0 131 VAL A CB  1 ? 
ATOM   1019 C CG1 . VAL A 1 131 ? -8.377  -23.873 -7.984  1.000 26.437 0 131 VAL A CG1 1 ? 
ATOM   1020 C CG2 . VAL A 1 131 ? -5.989  -23.449 -7.428  1.000 23.340 0 131 VAL A CG2 1 ? 
ATOM   1021 N N   . GLY A 1 132 ? -8.078  -27.465 -7.076  1.000 19.320 0 132 GLY A N   1 ? 
ATOM   1022 C CA  . GLY A 1 132 ? -9.086  -28.510 -7.203  1.000 20.951 0 132 GLY A CA  1 ? 
ATOM   1023 C C   . GLY A 1 132 ? -9.552  -29.050 -5.850  1.000 21.961 0 132 GLY A C   1 ? 
ATOM   1024 O O   . GLY A 1 132 ? -10.736 -29.383 -5.677  1.000 24.013 0 132 GLY A O   1 ? 
ATOM   1025 N N   . GLN A 1 133 ? -8.631  -29.144 -4.897  1.000 18.657 0 133 GLN A N   1 ? 
ATOM   1026 C CA  . GLN A 1 133 ? -8.917  -29.809 -3.632  1.000 20.127 0 133 GLN A CA  1 ? 
ATOM   1027 C C   . GLN A 1 133 ? -9.278  -28.795 -2.525  1.000 19.874 0 133 GLN A C   1 ? 
ATOM   1028 O O   . GLN A 1 133 ? -9.656  -29.180 -1.431  1.000 19.420 0 133 GLN A O   1 ? 
ATOM   1029 C CB  . GLN A 1 133 ? -7.707  -30.619 -3.163  1.000 20.783 0 133 GLN A CB  1 ? 
ATOM   1030 C CG  . GLN A 1 133 ? -7.249  -31.788 -4.025  1.000 23.722 0 133 GLN A CG  1 ? 
ATOM   1031 C CD  . GLN A 1 133 ? -8.300  -32.861 -4.207  1.000 30.459 0 133 GLN A CD  1 ? 
ATOM   1032 O OE1 . GLN A 1 133 ? -9.422  -32.784 -3.698  1.000 28.162 0 133 GLN A OE1 1 ? 
ATOM   1033 N NE2 . GLN A 1 133 ? -7.977  -33.843 -5.028  1.000 36.982 0 133 GLN A NE2 1 ? 
ATOM   1034 N N   . CYS A 1 134 ? -9.218  -27.498 -2.846  1.000 18.265 0 134 CYS A N   1 ? 
ATOM   1035 C CA  . CYS A 1 134 ? -9.370  -26.395 -1.898  1.000 17.723 0 134 CYS A CA  1 ? 
ATOM   1036 C C   . CYS A 1 134 ? -10.650 -26.543 -1.060  1.000 21.568 0 134 CYS A C   1 ? 
ATOM   1037 O O   . CYS A 1 134 ? -11.745 -26.683 -1.610  1.000 20.914 0 134 CYS A O   1 ? 
ATOM   1038 C CB  . CYS A 1 134 ? -9.399  -25.080 -2.668  1.000 18.899 0 134 CYS A CB  1 ? 
ATOM   1039 S SG  . CYS A 1 134 ? -9.368  -23.611 -1.617  1.000 16.806 0 134 CYS A SG  1 ? 
ATOM   1040 N N   . PRO A 1 135 ? -10.557 -26.433 0.285   1.000 20.112 0 135 PRO A N   1 ? 
ATOM   1041 C CA  . PRO A 1 135 ? -11.743 -26.406 1.146   1.000 24.802 0 135 PRO A CA  1 ? 
ATOM   1042 C C   . PRO A 1 135 ? -12.735 -25.377 0.659   1.000 22.113 0 135 PRO A C   1 ? 
ATOM   1043 O O   . PRO A 1 135 ? -12.372 -24.263 0.292   1.000 20.492 0 135 PRO A O   1 ? 
ATOM   1044 C CB  . PRO A 1 135 ? -11.174 -26.047 2.528   1.000 23.827 0 135 PRO A CB  1 ? 
ATOM   1045 C CG  . PRO A 1 135 ? -9.772  -26.539 2.512   1.000 24.615 0 135 PRO A CG  1 ? 
ATOM   1046 C CD  . PRO A 1 135 ? -9.315  -26.337 1.064   1.000 22.000 0 135 PRO A CD  1 ? 
ATOM   1047 N N   . ALA A 1 136 ? -14.038 -25.690 0.743   1.000 22.857 0 136 ALA A N   1 ? 
ATOM   1048 C CA  . ALA A 1 136 ? -15.058 -24.786 0.242   1.000 24.535 0 136 ALA A CA  1 ? 
ATOM   1049 C C   . ALA A 1 136 ? -14.923 -23.366 0.802   1.000 21.552 0 136 ALA A C   1 ? 
ATOM   1050 O O   . ALA A 1 136 ? -15.085 -22.391 0.088   1.000 22.790 0 136 ALA A O   1 ? 
ATOM   1051 C CB  . ALA A 1 136 ? -16.426 -25.390 0.590   1.000 29.800 0 136 ALA A CB  1 ? 
ATOM   1052 N N   . LYS A 1 137 ? -14.623 -23.218 2.097   1.000 19.819 0 137 LYS A N   1 ? 
ATOM   1053 C CA  . LYS A 1 137 ? -14.569 -21.883 2.669   1.000 19.501 0 137 LYS A CA  1 ? 
ATOM   1054 C C   . LYS A 1 137 ? -13.382 -21.058 2.172   1.000 19.419 0 137 LYS A C   1 ? 
ATOM   1055 O O   . LYS A 1 137 ? -13.394 -19.833 2.316   1.000 21.816 0 137 LYS A O   1 ? 
ATOM   1056 C CB  . LYS A 1 137 ? -14.602 -21.913 4.198   1.000 24.658 0 137 LYS A CB  1 ? 
ATOM   1057 C CG  . LYS A 1 137 ? -16.007 -22.221 4.706   1.000 30.290 0 137 LYS A CG  1 ? 
ATOM   1058 C CD  . LYS A 1 137 ? -16.115 -22.228 6.213   1.000 35.928 0 137 LYS A CD  1 ? 
ATOM   1059 C CE  . LYS A 1 137 ? -17.558 -22.482 6.570   1.000 42.400 0 137 LYS A CE  1 ? 
ATOM   1060 N NZ  . LYS A 1 137 ? -17.631 -22.810 7.994   1.000 48.421 0 137 LYS A NZ  1 ? 
ATOM   1061 N N   . LEU A 1 138 ? -12.359 -21.706 1.607   1.000 17.439 0 138 LEU A N   1 ? 
ATOM   1062 C CA  . LEU A 1 138 ? -11.165 -20.982 1.154   1.000 17.651 0 138 LEU A CA  1 ? 
ATOM   1063 C C   . LEU A 1 138 ? -11.166 -20.706 -0.360  1.000 16.623 0 138 LEU A C   1 ? 
ATOM   1064 O O   . LEU A 1 138 ? -10.262 -20.043 -0.864  1.000 18.456 0 138 LEU A O   1 ? 
ATOM   1065 C CB  . LEU A 1 138 ? -9.925  -21.795 1.505   1.000 15.980 0 138 LEU A CB  1 ? 
ATOM   1066 C CG  . LEU A 1 138 ? -9.659  -22.035 2.992   1.000 17.476 0 138 LEU A CG  1 ? 
ATOM   1067 C CD1 . LEU A 1 138 ? -8.358  -22.770 3.149   1.000 19.143 0 138 LEU A CD1 1 ? 
ATOM   1068 C CD2 . LEU A 1 138 ? -9.642  -20.747 3.754   1.000 20.014 0 138 LEU A CD2 1 ? 
ATOM   1069 N N   . LYS A 1 139 ? -12.088 -21.307 -1.116  1.000 17.247 0 139 LYS A N   1 ? 
ATOM   1070 C CA  . LYS A 1 139 ? -12.079 -21.110 -2.539  1.000 20.420 0 139 LYS A CA  1 ? 
ATOM   1071 C C   . LYS A 1 139 ? -12.363 -19.659 -2.885  1.000 22.135 0 139 LYS A C   1 ? 
ATOM   1072 O O   . LYS A 1 139 ? -13.323 -19.061 -2.406  1.000 25.306 0 139 LYS A O   1 ? 
ATOM   1073 C CB  . LYS A 1 139 ? -13.155 -21.951 -3.234  1.000 26.705 0 139 LYS A CB  1 ? 
ATOM   1074 C CG  . LYS A 1 139 ? -12.999 -23.415 -3.013  1.000 34.489 0 139 LYS A CG  1 ? 
ATOM   1075 C CD  . LYS A 1 139 ? -14.144 -24.281 -3.554  1.000 43.619 0 139 LYS A CD  1 ? 
ATOM   1076 C CE  . LYS A 1 139 ? -14.006 -24.642 -5.002  1.000 52.136 0 139 LYS A CE  1 ? 
ATOM   1077 N NZ  . LYS A 1 139 ? -12.656 -25.109 -5.364  1.000 56.524 0 139 LYS A NZ  1 ? 
ATOM   1078 N N   . ALA A 1 140 ? -11.511 -19.108 -3.735  1.000 21.485 0 140 ALA A N   1 ? 
ATOM   1079 C CA  . ALA A 1 140 ? -11.697 -17.761 -4.256  1.000 23.776 0 140 ALA A CA  1 ? 
ATOM   1080 C C   . ALA A 1 140 ? -12.512 -17.798 -5.548  1.000 25.315 0 140 ALA A C   1 ? 
ATOM   1081 O O   . ALA A 1 140 ? -12.178 -18.544 -6.453  1.000 24.585 0 140 ALA A O   1 ? 
ATOM   1082 C CB  . ALA A 1 140 ? -10.349 -17.132 -4.513  1.000 25.361 0 140 ALA A CB  1 ? 
ATOM   1083 N N   . PRO A 1 141 ? -13.591 -16.996 -5.671  1.000 30.790 0 141 PRO A N   1 ? 
ATOM   1084 C CA  . PRO A 1 141 ? -14.441 -17.018 -6.872  1.000 33.710 0 141 PRO A CA  1 ? 
ATOM   1085 C C   . PRO A 1 141 ? -13.674 -16.729 -8.156  1.000 38.357 0 141 PRO A C   1 ? 
ATOM   1086 O O   . PRO A 1 141 ? -13.898 -17.377 -9.188  1.000 40.008 0 141 PRO A O   1 ? 
ATOM   1087 C CB  . PRO A 1 141 ? -15.466 -15.923 -6.556  1.000 34.617 0 141 PRO A CB  1 ? 
ATOM   1088 C CG  . PRO A 1 141 ? -15.547 -15.900 -5.054  1.000 36.335 0 141 PRO A CG  1 ? 
ATOM   1089 C CD  . PRO A 1 141 ? -14.100 -16.091 -4.635  1.000 35.898 0 141 PRO A CD  1 ? 
ATOM   1090 N N   . GLY A 1 142 ? -12.728 -15.785 -8.055  1.000 38.145 0 142 GLY A N   1 ? 
ATOM   1091 C CA  . GLY A 1 142 ? -11.898 -15.396 -9.181  1.000 37.079 0 142 GLY A CA  1 ? 
ATOM   1092 C C   . GLY A 1 142 ? -10.930 -16.491 -9.615  1.000 35.046 0 142 GLY A C   1 ? 
ATOM   1093 O O   . GLY A 1 142 ? -10.334 -16.428 -10.683 1.000 35.399 0 142 GLY A O   1 ? 
ATOM   1094 N N   . GLY A 1 143 ? -10.763 -17.512 -8.781  1.000 32.239 0 143 GLY A N   1 ? 
ATOM   1095 C CA  . GLY A 1 143 ? -9.789  -18.543 -9.043  1.000 29.802 0 143 GLY A CA  1 ? 
ATOM   1096 C C   . GLY A 1 143 ? -8.837  -18.582 -7.850  1.000 26.849 0 143 GLY A C   1 ? 
ATOM   1097 O O   . GLY A 1 143 ? -8.664  -17.590 -7.131  1.000 28.284 0 143 GLY A O   1 ? 
ATOM   1098 N N   . GLY A 1 144 ? -8.304  -19.756 -7.575  1.000 23.345 0 144 GLY A N   1 ? 
ATOM   1099 C CA  . GLY A 1 144 ? -7.330  -19.882 -6.516  1.000 20.284 0 144 GLY A CA  1 ? 
ATOM   1100 C C   . GLY A 1 144 ? -7.919  -20.398 -5.213  1.000 16.971 0 144 GLY A C   1 ? 
ATOM   1101 O O   . GLY A 1 144 ? -9.141  -20.586 -5.071  1.000 18.242 0 144 GLY A O   1 ? 
ATOM   1102 N N   . CYS A 1 145 ? -7.011  -20.603 -4.271  1.000 15.276 0 145 CYS A N   1 ? 
ATOM   1103 C CA  . CYS A 1 145 ? -7.358  -21.098 -2.933  1.000 15.425 0 145 CYS A CA  1 ? 
ATOM   1104 C C   . CYS A 1 145 ? -6.727  -20.149 -1.917  1.000 14.879 0 145 CYS A C   1 ? 
ATOM   1105 O O   . CYS A 1 145 ? -5.497  -20.071 -1.800  1.000 14.922 0 145 CYS A O   1 ? 
ATOM   1106 C CB  . CYS A 1 145 ? -6.809  -22.501 -2.744  1.000 15.132 0 145 CYS A CB  1 ? 
ATOM   1107 S SG  . CYS A 1 145 ? -7.395  -23.326 -1.249  1.000 16.322 0 145 CYS A SG  1 ? 
ATOM   1108 N N   . ASN A 1 146 ? -7.573  -19.382 -1.197  1.000 14.156 0 146 ASN A N   1 ? 
ATOM   1109 C CA  . ASN A 1 146 ? -7.098  -18.407 -0.235  1.000 15.351 0 146 ASN A CA  1 ? 
ATOM   1110 C C   . ASN A 1 146 ? -6.550  -19.082 1.008   1.000 15.114 0 146 ASN A C   1 ? 
ATOM   1111 O O   . ASN A 1 146 ? -6.982  -20.166 1.384   1.000 15.895 0 146 ASN A O   1 ? 
ATOM   1112 C CB  . ASN A 1 146 ? -8.205  -17.498 0.270   1.000 15.672 0 146 ASN A CB  1 ? 
ATOM   1113 C CG  . ASN A 1 146 ? -8.663  -16.468 -0.734  1.000 19.707 0 146 ASN A CG  1 ? 
ATOM   1114 O OD1 . ASN A 1 146 ? -7.822  -15.764 -1.283  1.000 24.808 0 146 ASN A OD1 1 ? 
ATOM   1115 N ND2 . ASN A 1 146 ? -9.971  -16.363 -0.949  1.000 24.199 0 146 ASN A ND2 1 ? 
ATOM   1116 N N   . ASP A 1 147 ? -5.596  -18.405 1.639   1.000 14.307 0 147 ASP A N   1 ? 
ATOM   1117 C CA  . ASP A 1 147 ? -5.199  -18.746 3.000   1.000 14.269 0 147 ASP A CA  1 ? 
ATOM   1118 C C   . ASP A 1 147 ? -6.282  -18.302 3.988   1.000 13.681 0 147 ASP A C   1 ? 
ATOM   1119 O O   . ASP A 1 147 ? -7.114  -17.402 3.726   1.000 14.273 0 147 ASP A O   1 ? 
ATOM   1120 C CB  . ASP A 1 147 ? -3.890  -18.104 3.375   1.000 14.955 0 147 ASP A CB  1 ? 
ATOM   1121 C CG  . ASP A 1 147 ? -3.997  -16.602 3.426   1.000 16.608 0 147 ASP A CG  1 ? 
ATOM   1122 O OD1 . ASP A 1 147 ? -4.092  -15.984 2.346   1.000 15.772 0 147 ASP A OD1 1 ? 
ATOM   1123 O OD2 . ASP A 1 147 ? -4.099  -16.049 4.574   1.000 16.766 0 147 ASP A OD2 1 ? 
ATOM   1124 N N   . ALA A 1 148 ? -6.271  -18.915 5.172   1.000 14.429 0 148 ALA A N   1 ? 
ATOM   1125 C CA  . ALA A 1 148 ? -7.305  -18.643 6.161   1.000 14.871 0 148 ALA A CA  1 ? 
ATOM   1126 C C   . ALA A 1 148 ? -7.194  -17.251 6.786   1.000 14.794 0 148 ALA A C   1 ? 
ATOM   1127 O O   . ALA A 1 148 ? -8.167  -16.727 7.322   1.000 15.131 0 148 ALA A O   1 ? 
ATOM   1128 C CB  . ALA A 1 148 ? -7.175  -19.716 7.238   1.000 14.795 0 148 ALA A CB  1 ? 
ATOM   1129 N N   . CYS A 1 149 ? -5.997  -16.663 6.849   1.000 14.676 0 149 CYS A N   1 ? 
ATOM   1130 C CA  . CYS A 1 149 ? -5.839  -15.318 7.374   1.000 14.081 0 149 CYS A CA  1 ? 
ATOM   1131 C C   . CYS A 1 149 ? -6.591  -14.334 6.492   1.000 14.807 0 149 CYS A C   1 ? 
ATOM   1132 O O   . CYS A 1 149 ? -7.370  -13.499 6.955   1.000 15.938 0 149 CYS A O   1 ? 
ATOM   1133 C CB  . CYS A 1 149 ? -4.369  -14.984 7.533   1.000 16.766 0 149 CYS A CB  1 ? 
ATOM   1134 S SG  . CYS A 1 149 ? -4.038  -13.241 7.875   1.000 17.572 0 149 CYS A SG  1 ? 
ATOM   1135 N N   . THR A 1 150 ? -6.327  -14.410 5.184   1.000 14.097 0 150 THR A N   1 ? 
ATOM   1136 C CA  . THR A 1 150 ? -7.035  -13.597 4.214   1.000 14.697 0 150 THR A CA  1 ? 
ATOM   1137 C C   . THR A 1 150 ? -8.539  -13.718 4.392   1.000 14.687 0 150 THR A C   1 ? 
ATOM   1138 O O   . THR A 1 150 ? -9.225  -12.707 4.384   1.000 18.324 0 150 THR A O   1 ? 
ATOM   1139 C CB  . THR A 1 150 ? -6.620  -14.010 2.803   1.000 17.343 0 150 THR A CB  1 ? 
ATOM   1140 O OG1 . THR A 1 150 ? -5.237  -13.683 2.692   1.000 16.626 0 150 THR A OG1 1 ? 
ATOM   1141 C CG2 . THR A 1 150 ? -7.458  -13.274 1.773   1.000 19.280 0 150 THR A CG2 1 ? 
ATOM   1142 N N   . VAL A 1 151 ? -9.074  -14.924 4.522   1.000 14.714 0 151 VAL A N   1 ? 
ATOM   1143 C CA  . VAL A 1 151 ? -10.523 -15.092 4.581   1.000 15.197 0 151 VAL A CA  1 ? 
ATOM   1144 C C   . VAL A 1 151 ? -11.112 -14.667 5.930   1.000 16.867 0 151 VAL A C   1 ? 
ATOM   1145 O O   . VAL A 1 151 ? -12.077 -13.906 5.942   1.000 18.178 0 151 VAL A O   1 ? 
ATOM   1146 C CB  . VAL A 1 151 ? -10.866 -16.555 4.294   1.000 16.983 0 151 VAL A CB  1 ? 
ATOM   1147 C CG1 . VAL A 1 151 ? -12.330 -16.845 4.517   1.000 18.387 0 151 VAL A CG1 1 ? 
ATOM   1148 C CG2 . VAL A 1 151 ? -10.450 -16.934 2.870   1.000 17.960 0 151 VAL A CG2 1 ? 
ATOM   1149 N N   . PHE A 1 152 ? -10.525 -15.076 7.051   1.000 15.054 0 152 PHE A N   1 ? 
ATOM   1150 C CA  . PHE A 1 152 ? -11.209 -14.935 8.341   1.000 15.666 0 152 PHE A CA  1 ? 
ATOM   1151 C C   . PHE A 1 152 ? -10.650 -13.817 9.218   1.000 16.713 0 152 PHE A C   1 ? 
ATOM   1152 O O   . PHE A 1 152 ? -11.312 -13.417 10.178  1.000 16.601 0 152 PHE A O   1 ? 
ATOM   1153 C CB  . PHE A 1 152 ? -11.136 -16.257 9.109   1.000 15.030 0 152 PHE A CB  1 ? 
ATOM   1154 C CG  . PHE A 1 152 ? -11.922 -17.369 8.451   1.000 15.446 0 152 PHE A CG  1 ? 
ATOM   1155 C CD1 . PHE A 1 152 ? -13.307 -17.387 8.472   1.000 17.154 0 152 PHE A CD1 1 ? 
ATOM   1156 C CD2 . PHE A 1 152 ? -11.279 -18.367 7.737   1.000 17.071 0 152 PHE A CD2 1 ? 
ATOM   1157 C CE1 . PHE A 1 152 ? -14.020 -18.415 7.890   1.000 18.477 0 152 PHE A CE1 1 ? 
ATOM   1158 C CE2 . PHE A 1 152 ? -12.008 -19.385 7.134   1.000 18.604 0 152 PHE A CE2 1 ? 
ATOM   1159 C CZ  . PHE A 1 152 ? -13.374 -19.391 7.192   1.000 18.185 0 152 PHE A CZ  1 ? 
ATOM   1160 N N   . GLN A 1 153 ? -9.404  -13.371 8.994   1.000 15.748 0 153 GLN A N   1 ? 
ATOM   1161 C CA  A GLN A 1 153 ? -8.846  -12.222 9.686   0.740 15.653 0 153 GLN A CA  1 ? 
ATOM   1162 C CA  B GLN A 1 153 ? -8.835  -12.220 9.682   0.260 15.805 0 153 GLN A CA  1 ? 
ATOM   1163 C C   . GLN A 1 153 ? -8.867  -12.420 11.198  1.000 15.610 0 153 GLN A C   1 ? 
ATOM   1164 O O   . GLN A 1 153 ? -9.276  -11.518 11.927  1.000 18.179 0 153 GLN A O   1 ? 
ATOM   1165 C CB  A GLN A 1 153 ? -9.600  -10.944 9.311   0.740 17.749 0 153 GLN A CB  1 ? 
ATOM   1166 C CB  B GLN A 1 153 ? -9.547  -10.917 9.300   0.260 16.503 0 153 GLN A CB  1 ? 
ATOM   1167 C CG  A GLN A 1 153 ? -9.581  -10.612 7.818   0.740 22.376 0 153 GLN A CG  1 ? 
ATOM   1168 C CG  B GLN A 1 153 ? -9.368  -10.486 7.845   0.260 17.663 0 153 GLN A CG  1 ? 
ATOM   1169 C CD  A GLN A 1 153 ? -8.369  -9.816  7.431   0.740 29.397 0 153 GLN A CD  1 ? 
ATOM   1170 C CD  B GLN A 1 153 ? -8.022  -9.852  7.567   0.260 19.765 0 153 GLN A CD  1 ? 
ATOM   1171 O OE1 A GLN A 1 153 ? -8.437  -8.588  7.396   0.740 29.186 0 153 GLN A OE1 1 ? 
ATOM   1172 O OE1 B GLN A 1 153 ? -7.743  -8.702  7.939   0.260 18.309 0 153 GLN A OE1 1 ? 
ATOM   1173 N NE2 A GLN A 1 153 ? -7.242  -10.485 7.205   0.740 32.283 0 153 GLN A NE2 1 ? 
ATOM   1174 N NE2 B GLN A 1 153 ? -7.170  -10.593 6.874   0.260 20.516 0 153 GLN A NE2 1 ? 
ATOM   1175 N N   . THR A 1 154 ? -8.416  -13.592 11.679  1.000 14.365 0 154 THR A N   1 ? 
ATOM   1176 C CA  . THR A 1 154 ? -8.279  -13.825 13.111  1.000 14.709 0 154 THR A CA  1 ? 
ATOM   1177 C C   . THR A 1 154 ? -6.804  -13.756 13.531  1.000 16.011 0 154 THR A C   1 ? 
ATOM   1178 O O   . THR A 1 154 ? -5.873  -14.001 12.755  1.000 15.857 0 154 THR A O   1 ? 
ATOM   1179 C CB  . THR A 1 154 ? -8.878  -15.167 13.546  1.000 15.084 0 154 THR A CB  1 ? 
ATOM   1180 O OG1 . THR A 1 154 ? -8.028  -16.201 13.054  1.000 16.988 0 154 THR A OG1 1 ? 
ATOM   1181 C CG2 . THR A 1 154 ? -10.330 -15.358 13.153  1.000 17.427 0 154 THR A CG2 1 ? 
ATOM   1182 N N   . SER A 1 155 ? -6.597  -13.531 14.829  1.000 15.769 0 155 SER A N   1 ? 
ATOM   1183 C CA  A SER A 1 155 ? -5.264  -13.534 15.397  0.710 15.985 0 155 SER A CA  1 ? 
ATOM   1184 C CA  B SER A 1 155 ? -5.283  -13.550 15.443  0.290 15.728 0 155 SER A CA  1 ? 
ATOM   1185 C C   . SER A 1 155 ? -4.591  -14.882 15.177  1.000 15.559 0 155 SER A C   1 ? 
ATOM   1186 O O   . SER A 1 155 ? -3.408  -14.922 14.895  1.000 17.189 0 155 SER A O   1 ? 
ATOM   1187 C CB  A SER A 1 155 ? -5.239  -13.126 16.848  0.710 18.669 0 155 SER A CB  1 ? 
ATOM   1188 C CB  B SER A 1 155 ? -5.373  -13.276 16.925  0.290 16.677 0 155 SER A CB  1 ? 
ATOM   1189 O OG  A SER A 1 155 ? -5.781  -11.823 17.005  0.710 21.669 0 155 SER A OG  1 ? 
ATOM   1190 O OG  B SER A 1 155 ? -6.189  -14.241 17.586  0.290 17.452 0 155 SER A OG  1 ? 
ATOM   1191 N N   . GLU A 1 156 ? -5.349  -15.985 15.263  1.000 14.909 0 156 GLU A N   1 ? 
ATOM   1192 C CA  . GLU A 1 156 ? -4.759  -17.300 15.173  1.000 15.238 0 156 GLU A CA  1 ? 
ATOM   1193 C C   . GLU A 1 156 ? -4.290  -17.593 13.753  1.000 15.515 0 156 GLU A C   1 ? 
ATOM   1194 O O   . GLU A 1 156 ? -3.184  -18.037 13.564  1.000 16.773 0 156 GLU A O   1 ? 
ATOM   1195 C CB  . GLU A 1 156 ? -5.759  -18.358 15.623  1.000 15.988 0 156 GLU A CB  1 ? 
ATOM   1196 C CG  . GLU A 1 156 ? -5.135  -19.732 15.813  1.000 16.303 0 156 GLU A CG  1 ? 
ATOM   1197 C CD  . GLU A 1 156 ? -4.076  -19.804 16.901  1.000 17.274 0 156 GLU A CD  1 ? 
ATOM   1198 O OE1 . GLU A 1 156 ? -4.009  -18.887 17.742  1.000 17.091 0 156 GLU A OE1 1 ? 
ATOM   1199 O OE2 . GLU A 1 156 ? -3.296  -20.793 16.918  1.000 18.768 0 156 GLU A OE2 1 ? 
ATOM   1200 N N   . TYR A 1 157 ? -5.102  -17.266 12.750  1.000 14.967 0 157 TYR A N   1 ? 
ATOM   1201 C CA  . TYR A 1 157 ? -4.703  -17.547 11.385  1.000 14.043 0 157 TYR A CA  1 ? 
ATOM   1202 C C   . TYR A 1 157 ? -3.589  -16.623 10.907  1.000 15.958 0 157 TYR A C   1 ? 
ATOM   1203 O O   . TYR A 1 157 ? -2.767  -17.053 10.072  1.000 16.437 0 157 TYR A O   1 ? 
ATOM   1204 C CB  . TYR A 1 157 ? -5.866  -17.469 10.402  1.000 14.344 0 157 TYR A CB  1 ? 
ATOM   1205 C CG  . TYR A 1 157 ? -6.963  -18.501 10.626  1.000 14.831 0 157 TYR A CG  1 ? 
ATOM   1206 C CD1 . TYR A 1 157 ? -6.677  -19.816 10.929  1.000 15.818 0 157 TYR A CD1 1 ? 
ATOM   1207 C CD2 . TYR A 1 157 ? -8.289  -18.145 10.613  1.000 13.717 0 157 TYR A CD2 1 ? 
ATOM   1208 C CE1 . TYR A 1 157 ? -7.678  -20.754 11.128  1.000 16.104 0 157 TYR A CE1 1 ? 
ATOM   1209 C CE2 . TYR A 1 157 ? -9.293  -19.075 10.788  1.000 14.112 0 157 TYR A CE2 1 ? 
ATOM   1210 C CZ  . TYR A 1 157 ? -8.990  -20.388 11.098  1.000 14.541 0 157 TYR A CZ  1 ? 
ATOM   1211 O OH  . TYR A 1 157 ? -9.983  -21.286 11.360  1.000 16.010 0 157 TYR A OH  1 ? 
ATOM   1212 N N   . CYS A 1 158 ? -3.662  -15.360 11.316  1.000 15.384 0 158 CYS A N   1 ? 
ATOM   1213 C CA  . CYS A 1 158 ? -2.714  -14.333 10.888  1.000 16.023 0 158 CYS A CA  1 ? 
ATOM   1214 C C   . CYS A 1 158 ? -1.463  -14.276 11.756  1.000 17.761 0 158 CYS A C   1 ? 
ATOM   1215 O O   . CYS A 1 158 ? -0.535  -13.565 11.388  1.000 17.893 0 158 CYS A O   1 ? 
ATOM   1216 C CB  . CYS A 1 158 ? -3.428  -12.993 10.826  1.000 15.280 0 158 CYS A CB  1 ? 
ATOM   1217 S SG  . CYS A 1 158 ? -4.871  -12.976 9.732   1.000 16.205 0 158 CYS A SG  1 ? 
ATOM   1218 N N   . CYS A 1 159 ? -1.472  -15.011 12.882  1.000 18.383 0 159 CYS A N   1 ? 
ATOM   1219 C CA  A CYS A 1 159 ? -0.370  -15.089 13.815  0.590 18.630 0 159 CYS A CA  1 ? 
ATOM   1220 C CA  B CYS A 1 159 ? -0.346  -15.096 13.798  0.410 18.696 0 159 CYS A CA  1 ? 
ATOM   1221 C C   . CYS A 1 159 ? 0.020   -13.702 14.295  1.000 19.756 0 159 CYS A C   1 ? 
ATOM   1222 O O   . CYS A 1 159 ? 1.196   -13.392 14.500  1.000 21.009 0 159 CYS A O   1 ? 
ATOM   1223 C CB  A CYS A 1 159 ? 0.799   -15.821 13.190  0.590 18.829 0 159 CYS A CB  1 ? 
ATOM   1224 C CB  B CYS A 1 159 ? 0.854   -15.785 13.154  0.410 18.743 0 159 CYS A CB  1 ? 
ATOM   1225 S SG  A CYS A 1 159 ? 1.725   -16.745 14.433  0.590 20.168 0 159 CYS A SG  1 ? 
ATOM   1226 S SG  B CYS A 1 159 ? 0.600   -17.538 12.756  0.410 19.193 0 159 CYS A SG  1 ? 
ATOM   1227 N N   . THR A 1 160 ? -1.007  -12.896 14.580  1.000 20.404 0 160 THR A N   1 ? 
ATOM   1228 C CA  . THR A 1 160 ? -0.844  -11.500 14.911  1.000 20.739 0 160 THR A CA  1 ? 
ATOM   1229 C C   . THR A 1 160 ? -0.020  -11.330 16.181  1.000 26.516 0 160 THR A C   1 ? 
ATOM   1230 O O   . THR A 1 160 ? 0.697   -10.331 16.261  1.000 32.667 0 160 THR A O   1 ? 
ATOM   1231 C CB  . THR A 1 160 ? -2.244  -10.921 15.149  1.000 23.706 0 160 THR A CB  1 ? 
ATOM   1232 O OG1 . THR A 1 160 ? -2.888  -11.192 13.918  1.000 27.311 0 160 THR A OG1 1 ? 
ATOM   1233 C CG2 . THR A 1 160 ? -2.240  -9.423  15.333  1.000 29.506 0 160 THR A CG2 1 ? 
ATOM   1234 N N   . THR A 1 161 ? -0.219  -12.215 17.176  1.000 24.405 0 161 THR A N   1 ? 
ATOM   1235 C CA  . THR A 1 161 ? 0.459   -12.062 18.468  1.000 31.466 0 161 THR A CA  1 ? 
ATOM   1236 C C   . THR A 1 161 ? 1.871   -12.646 18.407  1.000 33.543 0 161 THR A C   1 ? 
ATOM   1237 O O   . THR A 1 161 ? 2.611   -12.507 19.364  1.000 37.957 0 161 THR A O   1 ? 
ATOM   1238 C CB  . THR A 1 161 ? -0.327  -12.699 19.615  1.000 31.976 0 161 THR A CB  1 ? 
ATOM   1239 O OG1 . THR A 1 161 ? -0.244  -14.108 19.439  1.000 32.963 0 161 THR A OG1 1 ? 
ATOM   1240 C CG2 . THR A 1 161 ? -1.809  -12.352 19.651  1.000 37.246 0 161 THR A CG2 1 ? 
ATOM   1241 N N   . GLY A 1 162 ? 2.257   -13.289 17.303  1.000 29.495 0 162 GLY A N   1 ? 
ATOM   1242 C CA  . GLY A 1 162 ? 3.518   -14.009 17.237  1.000 31.949 0 162 GLY A CA  1 ? 
ATOM   1243 C C   . GLY A 1 162 ? 3.435   -15.365 17.935  1.000 31.212 0 162 GLY A C   1 ? 
ATOM   1244 O O   . GLY A 1 162 ? 4.407   -16.099 17.988  1.000 35.952 0 162 GLY A O   1 ? 
ATOM   1245 N N   . LYS A 1 163 ? 2.259   -15.712 18.445  1.000 30.118 0 163 LYS A N   1 ? 
ATOM   1246 C CA  . LYS A 1 163 ? 1.987   -17.043 18.929  1.000 31.210 0 163 LYS A CA  1 ? 
ATOM   1247 C C   . LYS A 1 163 ? 0.781   -17.537 18.146  1.000 31.509 0 163 LYS A C   1 ? 
ATOM   1248 O O   . LYS A 1 163 ? -0.255  -16.882 18.065  1.000 33.536 0 163 LYS A O   1 ? 
ATOM   1249 C CB  . LYS A 1 163 ? 1.628   -17.044 20.417  1.000 38.172 0 163 LYS A CB  1 ? 
ATOM   1250 C CG  . LYS A 1 163 ? 2.551   -16.267 21.366  0.750 42.804 0 163 LYS A CG  1 ? 
ATOM   1251 C CD  . LYS A 1 163 ? 3.597   -17.088 22.113  0.600 49.532 0 163 LYS A CD  1 ? 
ATOM   1252 C CE  . LYS A 1 163 ? 4.709   -17.584 21.234  0.830 57.043 0 163 LYS A CE  1 ? 
ATOM   1253 N NZ  . LYS A 1 163 ? 5.457   -18.660 21.897  0.680 60.197 0 163 LYS A NZ  1 ? 
ATOM   1254 N N   . CYS A 1 164 ? 0.949   -18.682 17.528  1.000 25.391 0 164 CYS A N   1 ? 
ATOM   1255 C CA  . CYS A 1 164 ? -0.135  -19.305 16.778  1.000 19.651 0 164 CYS A CA  1 ? 
ATOM   1256 C C   . CYS A 1 164 ? 0.304   -20.743 16.533  1.000 21.945 0 164 CYS A C   1 ? 
ATOM   1257 O O   . CYS A 1 164 ? 1.512   -21.036 16.572  1.000 22.308 0 164 CYS A O   1 ? 
ATOM   1258 C CB  . CYS A 1 164 ? -0.455  -18.590 15.468  1.000 20.714 0 164 CYS A CB  1 ? 
ATOM   1259 S SG  . CYS A 1 164 ? 0.941   -18.560 14.321  1.000 21.596 0 164 CYS A SG  1 ? 
ATOM   1260 N N   . GLY A 1 165 ? -0.667  -21.609 16.232  1.000 18.647 0 165 GLY A N   1 ? 
ATOM   1261 C CA  . GLY A 1 165 ? -0.382  -22.995 15.927  1.000 18.079 0 165 GLY A CA  1 ? 
ATOM   1262 C C   . GLY A 1 165 ? -0.857  -23.299 14.526  1.000 17.618 0 165 GLY A C   1 ? 
ATOM   1263 O O   . GLY A 1 165 ? -1.497  -22.469 13.879  1.000 19.039 0 165 GLY A O   1 ? 
ATOM   1264 N N   . PRO A 1 166 ? -0.550  -24.505 14.040  1.000 16.888 0 166 PRO A N   1 ? 
ATOM   1265 C CA  . PRO A 1 166 ? -1.145  -24.999 12.809  1.000 15.910 0 166 PRO A CA  1 ? 
ATOM   1266 C C   . PRO A 1 166 ? -2.652  -25.108 12.997  1.000 17.469 0 166 PRO A C   1 ? 
ATOM   1267 O O   . PRO A 1 166 ? -3.131  -25.285 14.129  1.000 17.340 0 166 PRO A O   1 ? 
ATOM   1268 C CB  . PRO A 1 166 ? -0.477  -26.343 12.583  1.000 18.033 0 166 PRO A CB  1 ? 
ATOM   1269 C CG  . PRO A 1 166 ? 0.079   -26.752 13.930  1.000 20.813 0 166 PRO A CG  1 ? 
ATOM   1270 C CD  . PRO A 1 166 ? 0.179   -25.532 14.810  1.000 19.107 0 166 PRO A CD  1 ? 
ATOM   1271 N N   . THR A 1 167 ? -3.394  -25.066 11.887  1.000 16.243 0 167 THR A N   1 ? 
ATOM   1272 C CA  . THR A 1 167 ? -4.845  -25.127 11.925  1.000 15.129 0 167 THR A CA  1 ? 
ATOM   1273 C C   . THR A 1 167 ? -5.327  -26.161 10.920  1.000 15.791 0 167 THR A C   1 ? 
ATOM   1274 O O   . THR A 1 167 ? -4.548  -26.596 10.073  1.000 16.965 0 167 THR A O   1 ? 
ATOM   1275 C CB  . THR A 1 167 ? -5.395  -23.731 11.592  1.000 15.240 0 167 THR A CB  1 ? 
ATOM   1276 O OG1 . THR A 1 167 ? -5.049  -23.428 10.229  1.000 15.517 0 167 THR A OG1 1 ? 
ATOM   1277 C CG2 . THR A 1 167 ? -4.813  -22.645 12.483  1.000 15.490 0 167 THR A CG2 1 ? 
ATOM   1278 N N   . GLU A 1 168 ? -6.631  -26.416 10.872  1.000 16.007 0 168 GLU A N   1 ? 
ATOM   1279 C CA  A GLU A 1 168 ? -7.203  -27.315 9.879   0.420 16.873 0 168 GLU A CA  1 ? 
ATOM   1280 C CA  B GLU A 1 168 ? -7.174  -27.325 9.881   0.580 16.659 0 168 GLU A CA  1 ? 
ATOM   1281 C C   . GLU A 1 168 ? -6.841  -26.798 8.485   1.000 15.973 0 168 GLU A C   1 ? 
ATOM   1282 O O   . GLU A 1 168 ? -6.500  -27.560 7.577   1.000 17.078 0 168 GLU A O   1 ? 
ATOM   1283 C CB  A GLU A 1 168 ? -8.720  -27.439 10.021  0.420 19.577 0 168 GLU A CB  1 ? 
ATOM   1284 C CB  B GLU A 1 168 ? -8.666  -27.558 10.070  0.580 19.181 0 168 GLU A CB  1 ? 
ATOM   1285 C CG  A GLU A 1 168 ? -9.385  -28.407 9.037   0.420 23.422 0 168 GLU A CG  1 ? 
ATOM   1286 C CG  B GLU A 1 168 ? -8.982  -28.597 11.142  0.580 23.909 0 168 GLU A CG  1 ? 
ATOM   1287 C CD  A GLU A 1 168 ? -10.882 -28.171 8.848   0.420 27.130 0 168 GLU A CD  1 ? 
ATOM   1288 C CD  B GLU A 1 168 ? -8.215  -29.903 10.969  0.580 24.519 0 168 GLU A CD  1 ? 
ATOM   1289 O OE1 A GLU A 1 168 ? -11.660 -28.515 9.739   0.420 32.287 0 168 GLU A OE1 1 ? 
ATOM   1290 O OE1 B GLU A 1 168 ? -8.640  -30.585 10.017  0.580 32.644 0 168 GLU A OE1 1 ? 
ATOM   1291 O OE2 A GLU A 1 168 ? -11.298 -27.585 7.831   0.420 34.658 0 168 GLU A OE2 1 ? 
ATOM   1292 O OE2 B GLU A 1 168 ? -7.146  -30.181 11.612  0.580 25.718 0 168 GLU A OE2 1 ? 
ATOM   1293 N N   . TYR A 1 169 ? -6.875  -25.481 8.331   1.000 15.358 0 169 TYR A N   1 ? 
ATOM   1294 C CA  . TYR A 1 169 ? -6.612  -24.922 7.025   1.000 14.882 0 169 TYR A CA  1 ? 
ATOM   1295 C C   . TYR A 1 169 ? -5.142  -24.943 6.657   1.000 15.530 0 169 TYR A C   1 ? 
ATOM   1296 O O   . TYR A 1 169 ? -4.852  -25.255 5.493   1.000 16.834 0 169 TYR A O   1 ? 
ATOM   1297 C CB  . TYR A 1 169 ? -7.129  -23.500 6.956   1.000 15.091 0 169 TYR A CB  1 ? 
ATOM   1298 C CG  . TYR A 1 169 ? -8.630  -23.371 7.099   1.000 15.149 0 169 TYR A CG  1 ? 
ATOM   1299 C CD1 . TYR A 1 169 ? -9.502  -24.065 6.269   1.000 16.804 0 169 TYR A CD1 1 ? 
ATOM   1300 C CD2 . TYR A 1 169 ? -9.189  -22.619 8.125   1.000 15.642 0 169 TYR A CD2 1 ? 
ATOM   1301 C CE1 . TYR A 1 169 ? -10.872 -23.932 6.403   1.000 17.480 0 169 TYR A CE1 1 ? 
ATOM   1302 C CE2 . TYR A 1 169 ? -10.563 -22.499 8.293   1.000 16.248 0 169 TYR A CE2 1 ? 
ATOM   1303 C CZ  . TYR A 1 169 ? -11.400 -23.167 7.423   1.000 19.264 0 169 TYR A CZ  1 ? 
ATOM   1304 O OH  . TYR A 1 169 ? -12.755 -23.039 7.556   1.000 19.349 0 169 TYR A OH  1 ? 
ATOM   1305 N N   . SER A 1 170 ? -4.224  -24.571 7.566   1.000 14.927 0 170 SER A N   1 ? 
ATOM   1306 C CA  . SER A 1 170 ? -2.797  -24.646 7.274   1.000 15.997 0 170 SER A CA  1 ? 
ATOM   1307 C C   . SER A 1 170 ? -2.400  -26.085 6.950   1.000 15.587 0 170 SER A C   1 ? 
ATOM   1308 O O   . SER A 1 170 ? -1.593  -26.344 6.034   1.000 15.533 0 170 SER A O   1 ? 
ATOM   1309 C CB  . SER A 1 170 ? -1.932  -24.084 8.358   1.000 16.256 0 170 SER A CB  1 ? 
ATOM   1310 O OG  . SER A 1 170 ? -1.824  -24.926 9.489   1.000 16.137 0 170 SER A OG  1 ? 
ATOM   1311 N N   . ARG A 1 171 ? -3.021  -27.054 7.632   1.000 14.904 0 171 ARG A N   1 ? 
ATOM   1312 C CA  . ARG A 1 171 ? -2.633  -28.451 7.445   1.000 16.818 0 171 ARG A CA  1 ? 
ATOM   1313 C C   . ARG A 1 171 ? -3.032  -28.947 6.050   1.000 15.879 0 171 ARG A C   1 ? 
ATOM   1314 O O   . ARG A 1 171 ? -2.416  -29.882 5.551   1.000 18.090 0 171 ARG A O   1 ? 
ATOM   1315 C CB  . ARG A 1 171 ? -3.264  -29.360 8.515   1.000 16.931 0 171 ARG A CB  1 ? 
ATOM   1316 C CG  . ARG A 1 171 ? -2.563  -29.209 9.850   1.000 18.904 0 171 ARG A CG  1 ? 
ATOM   1317 C CD  . ARG A 1 171 ? -3.294  -30.181 10.816  1.000 20.859 0 171 ARG A CD  1 ? 
ATOM   1318 N NE  . ARG A 1 171 ? -2.763  -29.949 12.154  1.000 23.318 0 171 ARG A NE  1 ? 
ATOM   1319 C CZ  . ARG A 1 171 ? -3.358  -29.244 13.120  1.000 22.913 0 171 ARG A CZ  1 ? 
ATOM   1320 N NH1 . ARG A 1 171 ? -4.542  -28.709 12.935  1.000 25.374 0 171 ARG A NH1 1 ? 
ATOM   1321 N NH2 . ARG A 1 171 ? -2.751  -29.137 14.284  1.000 29.069 0 171 ARG A NH2 1 ? 
ATOM   1322 N N   . PHE A 1 172 ? -4.083  -28.401 5.467   1.000 15.092 0 172 PHE A N   1 ? 
ATOM   1323 C CA  . PHE A 1 172 ? -4.492  -28.702 4.104   1.000 15.731 0 172 PHE A CA  1 ? 
ATOM   1324 C C   . PHE A 1 172 ? -3.339  -28.347 3.161   1.000 17.355 0 172 PHE A C   1 ? 
ATOM   1325 O O   . PHE A 1 172 ? -2.917  -29.163 2.347   1.000 16.093 0 172 PHE A O   1 ? 
ATOM   1326 C CB  . PHE A 1 172 ? -5.776  -27.960 3.760   1.000 18.361 0 172 PHE A CB  1 ? 
ATOM   1327 C CG  . PHE A 1 172 ? -5.979  -27.881 2.259   1.000 19.044 0 172 PHE A CG  1 ? 
ATOM   1328 C CD1 . PHE A 1 172 ? -6.330  -29.004 1.531   1.000 19.923 0 172 PHE A CD1 1 ? 
ATOM   1329 C CD2 . PHE A 1 172 ? -5.766  -26.700 1.587   1.000 18.577 0 172 PHE A CD2 1 ? 
ATOM   1330 C CE1 . PHE A 1 172 ? -6.442  -28.939 0.135   1.000 22.796 0 172 PHE A CE1 1 ? 
ATOM   1331 C CE2 . PHE A 1 172 ? -5.941  -26.625 0.221   1.000 19.520 0 172 PHE A CE2 1 ? 
ATOM   1332 C CZ  . PHE A 1 172 ? -6.284  -27.735 -0.509  1.000 20.483 0 172 PHE A CZ  1 ? 
ATOM   1333 N N   . PHE A 1 173 ? -2.841  -27.105 3.265   1.000 15.897 0 173 PHE A N   1 ? 
ATOM   1334 C CA  . PHE A 1 173 ? -1.769  -26.671 2.377   1.000 15.384 0 173 PHE A CA  1 ? 
ATOM   1335 C C   . PHE A 1 173 ? -0.546  -27.549 2.588   1.000 15.428 0 173 PHE A C   1 ? 
ATOM   1336 O O   . PHE A 1 173 ? 0.138   -27.904 1.647   1.000 17.474 0 173 PHE A O   1 ? 
ATOM   1337 C CB  . PHE A 1 173 ? -1.479  -25.188 2.569   1.000 15.519 0 173 PHE A CB  1 ? 
ATOM   1338 C CG  . PHE A 1 173 ? -2.513  -24.235 2.029   1.000 14.596 0 173 PHE A CG  1 ? 
ATOM   1339 C CD1 . PHE A 1 173 ? -2.499  -23.872 0.695   1.000 15.458 0 173 PHE A CD1 1 ? 
ATOM   1340 C CD2 . PHE A 1 173 ? -3.528  -23.750 2.843   1.000 15.842 0 173 PHE A CD2 1 ? 
ATOM   1341 C CE1 . PHE A 1 173 ? -3.474  -23.024 0.197   1.000 18.310 0 173 PHE A CE1 1 ? 
ATOM   1342 C CE2 . PHE A 1 173 ? -4.497  -22.939 2.346   1.000 16.160 0 173 PHE A CE2 1 ? 
ATOM   1343 C CZ  . PHE A 1 173 ? -4.464  -22.567 1.002   1.000 18.643 0 173 PHE A CZ  1 ? 
ATOM   1344 N N   . LYS A 1 174 ? -0.246  -27.882 3.833   1.000 15.118 0 174 LYS A N   1 ? 
ATOM   1345 C CA  . LYS A 1 174 ? 0.958   -28.579 4.214   1.000 15.923 0 174 LYS A CA  1 ? 
ATOM   1346 C C   . LYS A 1 174 ? 0.901   -30.020 3.734   1.000 17.966 0 174 LYS A C   1 ? 
ATOM   1347 O O   . LYS A 1 174 ? 1.934   -30.572 3.331   1.000 19.216 0 174 LYS A O   1 ? 
ATOM   1348 C CB  . LYS A 1 174 ? 1.177   -28.494 5.725   1.000 16.372 0 174 LYS A CB  1 ? 
ATOM   1349 C CG  . LYS A 1 174 ? 2.600   -28.851 6.145   1.000 18.603 0 174 LYS A CG  1 ? 
ATOM   1350 C CD  . LYS A 1 174 ? 3.662   -27.911 5.581   1.000 21.855 0 174 LYS A CD  1 ? 
ATOM   1351 C CE  . LYS A 1 174 ? 4.957   -28.027 6.259   1.000 22.589 0 174 LYS A CE  1 ? 
ATOM   1352 N NZ  . LYS A 1 174 ? 5.840   -26.995 5.718   1.000 22.488 0 174 LYS A NZ  1 ? 
ATOM   1353 N N   . ARG A 1 175 ? -0.291  -30.617 3.733   1.000 17.824 0 175 ARG A N   1 ? 
ATOM   1354 C CA  . ARG A 1 175 ? -0.432  -31.999 3.295   1.000 19.753 0 175 ARG A CA  1 ? 
ATOM   1355 C C   . ARG A 1 175 ? -0.141  -32.116 1.793   1.000 22.539 0 175 ARG A C   1 ? 
ATOM   1356 O O   . ARG A 1 175 ? 0.524   -33.060 1.374   1.000 22.323 0 175 ARG A O   1 ? 
ATOM   1357 C CB  . ARG A 1 175 ? -1.853  -32.434 3.627   1.000 24.218 0 175 ARG A CB  1 ? 
ATOM   1358 C CG  . ARG A 1 175 ? -2.197  -33.799 3.065   1.000 28.852 0 175 ARG A CG  1 ? 
ATOM   1359 C CD  . ARG A 1 175 ? -3.534  -34.264 3.643   1.000 30.892 0 175 ARG A CD  1 ? 
ATOM   1360 N NE  . ARG A 1 175 ? -4.723  -33.518 3.220   1.000 36.988 0 175 ARG A NE  1 ? 
ATOM   1361 C CZ  . ARG A 1 175 ? -5.378  -33.694 2.062   1.000 38.888 0 175 ARG A CZ  1 ? 
ATOM   1362 N NH1 . ARG A 1 175 ? -4.912  -34.524 1.140   1.000 38.723 0 175 ARG A NH1 1 ? 
ATOM   1363 N NH2 . ARG A 1 175 ? -6.502  -33.037 1.838   1.000 36.183 0 175 ARG A NH2 1 ? 
ATOM   1364 N N   . LEU A 1 176 ? -0.615  -31.142 1.015   1.000 19.135 0 176 LEU A N   1 ? 
ATOM   1365 C CA  . LEU A 1 176 ? -0.448  -31.165 -0.441  1.000 18.304 0 176 LEU A CA  1 ? 
ATOM   1366 C C   . LEU A 1 176 ? 0.935   -30.658 -0.860  1.000 20.626 0 176 LEU A C   1 ? 
ATOM   1367 O O   . LEU A 1 176 ? 1.499   -31.119 -1.883  1.000 19.500 0 176 LEU A O   1 ? 
ATOM   1368 C CB  . LEU A 1 176 ? -1.553  -30.351 -1.104  1.000 20.982 0 176 LEU A CB  1 ? 
ATOM   1369 C CG  . LEU A 1 176 ? -2.935  -31.007 -1.035  1.000 27.414 0 176 LEU A CG  1 ? 
ATOM   1370 C CD1 . LEU A 1 176 ? -3.867  -30.399 -2.019  1.000 29.769 0 176 LEU A CD1 1 ? 
ATOM   1371 C CD2 . LEU A 1 176 ? -2.836  -32.509 -1.214  1.000 32.490 0 176 LEU A CD2 1 ? 
ATOM   1372 N N   . CYS A 1 177 ? 1.507   -29.728 -0.089  1.000 17.764 0 177 CYS A N   1 ? 
ATOM   1373 C CA  . CYS A 1 177 ? 2.803   -29.148 -0.415  1.000 18.659 0 177 CYS A CA  1 ? 
ATOM   1374 C C   . CYS A 1 177 ? 3.654   -29.023 0.842   1.000 18.240 0 177 CYS A C   1 ? 
ATOM   1375 O O   . CYS A 1 177 ? 3.799   -27.965 1.437   1.000 17.504 0 177 CYS A O   1 ? 
ATOM   1376 C CB  . CYS A 1 177 ? 2.652   -27.786 -1.076  1.000 18.488 0 177 CYS A CB  1 ? 
ATOM   1377 S SG  . CYS A 1 177 ? 2.185   -27.955 -2.810  1.000 18.088 0 177 CYS A SG  1 ? 
ATOM   1378 N N   . PRO A 1 178 ? 4.268   -30.120 1.284   1.000 19.128 0 178 PRO A N   1 ? 
ATOM   1379 C CA  . PRO A 1 178 ? 5.117   -30.092 2.468   1.000 20.275 0 178 PRO A CA  1 ? 
ATOM   1380 C C   . PRO A 1 178 ? 6.295   -29.142 2.428   1.000 19.853 0 178 PRO A C   1 ? 
ATOM   1381 O O   . PRO A 1 178 ? 6.774   -28.701 3.474   1.000 21.401 0 178 PRO A O   1 ? 
ATOM   1382 C CB  . PRO A 1 178 ? 5.640   -31.556 2.555   1.000 24.196 0 178 PRO A CB  1 ? 
ATOM   1383 C CG  . PRO A 1 178 ? 4.782   -32.356 1.635   1.000 24.727 0 178 PRO A CG  1 ? 
ATOM   1384 C CD  . PRO A 1 178 ? 4.113   -31.452 0.674   1.000 20.966 0 178 PRO A CD  1 ? 
ATOM   1385 N N   . ASP A 1 179 ? 6.779   -28.828 1.231   1.000 20.573 0 179 ASP A N   1 ? 
ATOM   1386 C CA  A ASP A 1 179 ? 8.005   -28.059 1.129   0.880 23.946 0 179 ASP A CA  1 ? 
ATOM   1387 C CA  B ASP A 1 179 ? 8.011   -28.070 1.125   0.120 20.992 0 179 ASP A CA  1 ? 
ATOM   1388 C C   . ASP A 1 179 ? 7.720   -26.573 1.002   1.000 24.041 0 179 ASP A C   1 ? 
ATOM   1389 O O   . ASP A 1 179 ? 8.624   -25.809 0.739   1.000 25.599 0 179 ASP A O   1 ? 
ATOM   1390 C CB  A ASP A 1 179 ? 8.864   -28.466 -0.050  0.880 29.241 0 179 ASP A CB  1 ? 
ATOM   1391 C CB  B ASP A 1 179 ? 8.884   -28.680 0.041   0.120 20.199 0 179 ASP A CB  1 ? 
ATOM   1392 C CG  A ASP A 1 179 ? 9.648   -29.743 0.172   0.880 36.409 0 179 ASP A CG  1 ? 
ATOM   1393 C CG  B ASP A 1 179 ? 9.010   -30.195 0.137   0.120 19.369 0 179 ASP A CG  1 ? 
ATOM   1394 O OD1 A ASP A 1 179 ? 10.070  -29.991 1.350   0.880 42.075 0 179 ASP A OD1 1 ? 
ATOM   1395 O OD1 B ASP A 1 179 ? 9.291   -30.698 1.255   0.120 18.638 0 179 ASP A OD1 1 ? 
ATOM   1396 O OD2 A ASP A 1 179 ? 9.834   -30.454 -0.832  0.880 35.739 0 179 ASP A OD2 1 ? 
ATOM   1397 O OD2 B ASP A 1 179 ? 8.808   -30.863 -0.894  0.120 18.347 0 179 ASP A OD2 1 ? 
ATOM   1398 N N   . ALA A 1 180 ? 6.469   -26.154 1.213   1.000 18.336 0 180 ALA A N   1 ? 
ATOM   1399 C CA  . ALA A 1 180 ? 6.129   -24.746 1.214   1.000 17.055 0 180 ALA A CA  1 ? 
ATOM   1400 C C   . ALA A 1 180 ? 5.633   -24.328 2.599   1.000 17.640 0 180 ALA A C   1 ? 
ATOM   1401 O O   . ALA A 1 180 ? 4.992   -25.100 3.284   1.000 17.643 0 180 ALA A O   1 ? 
ATOM   1402 C CB  . ALA A 1 180 ? 5.060   -24.489 0.180   1.000 19.289 0 180 ALA A CB  1 ? 
ATOM   1403 N N   . PHE A 1 181 ? 5.865   -23.070 2.968   1.000 15.593 0 181 PHE A N   1 ? 
ATOM   1404 C CA  . PHE A 1 181 ? 5.317   -22.540 4.215   1.000 16.142 0 181 PHE A CA  1 ? 
ATOM   1405 C C   . PHE A 1 181 ? 3.801   -22.572 4.165   1.000 17.136 0 181 PHE A C   1 ? 
ATOM   1406 O O   . PHE A 1 181 ? 3.183   -22.098 3.208   1.000 15.664 0 181 PHE A O   1 ? 
ATOM   1407 C CB  . PHE A 1 181 ? 5.735   -21.101 4.408   1.000 15.661 0 181 PHE A CB  1 ? 
ATOM   1408 C CG  . PHE A 1 181 ? 7.133   -20.918 4.933   1.000 19.714 0 181 PHE A CG  1 ? 
ATOM   1409 C CD1 . PHE A 1 181 ? 8.220   -20.828 4.072   1.000 22.390 0 181 PHE A CD1 1 ? 
ATOM   1410 C CD2 . PHE A 1 181 ? 7.344   -20.769 6.282   1.000 21.289 0 181 PHE A CD2 1 ? 
ATOM   1411 C CE1 . PHE A 1 181 ? 9.488   -20.630 4.579   1.000 25.915 0 181 PHE A CE1 1 ? 
ATOM   1412 C CE2 . PHE A 1 181 ? 8.606   -20.561 6.776   1.000 22.930 0 181 PHE A CE2 1 ? 
ATOM   1413 C CZ  . PHE A 1 181 ? 9.671   -20.491 5.933   1.000 24.559 0 181 PHE A CZ  1 ? 
ATOM   1414 N N   . SER A 1 182 ? 3.185   -23.073 5.236   1.000 16.274 0 182 SER A N   1 ? 
ATOM   1415 C CA  . SER A 1 182 ? 1.734   -23.185 5.273   1.000 16.194 0 182 SER A CA  1 ? 
ATOM   1416 C C   . SER A 1 182 ? 1.081   -22.167 6.228   1.000 17.590 0 182 SER A C   1 ? 
ATOM   1417 O O   . SER A 1 182 ? -0.118  -21.909 6.110   1.000 17.714 0 182 SER A O   1 ? 
ATOM   1418 C CB  . SER A 1 182 ? 1.316   -24.591 5.582   1.000 17.146 0 182 SER A CB  1 ? 
ATOM   1419 O OG  . SER A 1 182 ? 1.612   -24.953 6.932   1.000 17.834 0 182 SER A OG  1 ? 
ATOM   1420 N N   . TYR A 1 183 ? 1.859   -21.613 7.164   1.000 15.543 0 183 TYR A N   1 ? 
ATOM   1421 C CA  . TYR A 1 183 ? 1.425   -20.594 8.109   1.000 16.534 0 183 TYR A CA  1 ? 
ATOM   1422 C C   . TYR A 1 183 ? 2.666   -19.868 8.621   1.000 20.059 0 183 TYR A C   1 ? 
ATOM   1423 O O   . TYR A 1 183 ? 3.777   -20.339 8.381   1.000 19.503 0 183 TYR A O   1 ? 
ATOM   1424 C CB  . TYR A 1 183 ? 0.530   -21.172 9.204   1.000 17.909 0 183 TYR A CB  1 ? 
ATOM   1425 C CG  . TYR A 1 183 ? 1.252   -21.939 10.295  1.000 17.491 0 183 TYR A CG  1 ? 
ATOM   1426 C CD1 . TYR A 1 183 ? 1.664   -23.239 10.081  1.000 18.333 0 183 TYR A CD1 1 ? 
ATOM   1427 C CD2 . TYR A 1 183 ? 1.429   -21.398 11.583  1.000 17.988 0 183 TYR A CD2 1 ? 
ATOM   1428 C CE1 . TYR A 1 183 ? 2.283   -23.982 11.074  1.000 19.713 0 183 TYR A CE1 1 ? 
ATOM   1429 C CE2 . TYR A 1 183 ? 2.021   -22.146 12.602  1.000 20.270 0 183 TYR A CE2 1 ? 
ATOM   1430 C CZ  . TYR A 1 183 ? 2.466   -23.428 12.332  1.000 22.565 0 183 TYR A CZ  1 ? 
ATOM   1431 O OH  . TYR A 1 183 ? 3.057   -24.185 13.320  1.000 24.411 0 183 TYR A OH  1 ? 
ATOM   1432 N N   . VAL A 1 184 ? 2.486   -18.721 9.294   1.000 21.907 0 184 VAL A N   1 ? 
ATOM   1433 C CA  . VAL A 1 184 ? 3.611   -17.837 9.618   1.000 22.621 0 184 VAL A CA  1 ? 
ATOM   1434 C C   . VAL A 1 184 ? 4.688   -18.561 10.427  1.000 23.528 0 184 VAL A C   1 ? 
ATOM   1435 O O   . VAL A 1 184 ? 5.874   -18.379 10.133  1.000 26.616 0 184 VAL A O   1 ? 
ATOM   1436 C CB  . VAL A 1 184 ? 3.099   -16.564 10.327  1.000 26.996 0 184 VAL A CB  1 ? 
ATOM   1437 C CG1 . VAL A 1 184 ? 4.230   -15.721 10.928  1.000 29.719 0 184 VAL A CG1 1 ? 
ATOM   1438 C CG2 . VAL A 1 184 ? 2.244   -15.741 9.397   1.000 28.349 0 184 VAL A CG2 1 ? 
ATOM   1439 N N   . LEU A 1 185 ? 4.343   -19.406 11.398  1.000 21.667 0 185 LEU A N   1 ? 
ATOM   1440 C CA  . LEU A 1 185 ? 5.329   -20.058 12.258  1.000 24.794 0 185 LEU A CA  1 ? 
ATOM   1441 C C   . LEU A 1 185 ? 5.589   -21.507 11.872  1.000 24.145 0 185 LEU A C   1 ? 
ATOM   1442 O O   . LEU A 1 185 ? 6.026   -22.321 12.666  1.000 24.156 0 185 LEU A O   1 ? 
ATOM   1443 C CB  . LEU A 1 185 ? 4.884   -20.007 13.724  1.000 27.994 0 185 LEU A CB  1 ? 
ATOM   1444 C CG  . LEU A 1 185 ? 4.924   -18.640 14.401  1.000 32.656 0 185 LEU A CG  1 ? 
ATOM   1445 C CD1 . LEU A 1 185 ? 4.515   -18.852 15.854  1.000 30.342 0 185 LEU A CD1 1 ? 
ATOM   1446 C CD2 . LEU A 1 185 ? 6.251   -17.915 14.267  1.000 37.953 0 185 LEU A CD2 1 ? 
ATOM   1447 N N   . ASP A 1 186 ? 5.264   -21.889 10.643  1.000 21.019 0 186 ASP A N   1 ? 
ATOM   1448 C CA  . ASP A 1 186 ? 5.576   -23.210 10.184  1.000 20.489 0 186 ASP A CA  1 ? 
ATOM   1449 C C   . ASP A 1 186 ? 7.074   -23.479 10.353  1.000 23.745 0 186 ASP A C   1 ? 
ATOM   1450 O O   . ASP A 1 186 ? 7.874   -22.569 10.239  1.000 25.658 0 186 ASP A O   1 ? 
ATOM   1451 C CB  . ASP A 1 186 ? 5.125   -23.296 8.736   1.000 19.866 0 186 ASP A CB  1 ? 
ATOM   1452 C CG  . ASP A 1 186 ? 4.842   -24.696 8.230   1.000 19.744 0 186 ASP A CG  1 ? 
ATOM   1453 O OD1 . ASP A 1 186 ? 5.078   -25.666 8.980   1.000 21.129 0 186 ASP A OD1 1 ? 
ATOM   1454 O OD2 . ASP A 1 186 ? 4.361   -24.810 7.116   1.000 20.721 0 186 ASP A OD2 1 ? 
ATOM   1455 N N   . LYS A 1 187 ? 7.428   -24.738 10.564  1.000 25.422 0 187 LYS A N   1 ? 
ATOM   1456 C CA  . LYS A 1 187 ? 8.844   -25.072 10.584  1.000 28.966 0 187 LYS A CA  1 ? 
ATOM   1457 C C   . LYS A 1 187 ? 9.451   -24.700 9.220   1.000 25.195 0 187 LYS A C   1 ? 
ATOM   1458 O O   . LYS A 1 187 ? 8.919   -25.075 8.178   1.000 25.429 0 187 LYS A O   1 ? 
ATOM   1459 C CB  . LYS A 1 187 ? 8.989   -26.569 10.869  1.000 36.039 0 187 LYS A CB  1 ? 
ATOM   1460 C CG  . LYS A 1 187 ? 10.422  -27.056 11.093  1.000 45.958 0 187 LYS A CG  1 ? 
ATOM   1461 C CD  . LYS A 1 187 ? 10.446  -28.569 11.311  1.000 55.973 0 187 LYS A CD  1 ? 
ATOM   1462 C CE  . LYS A 1 187 ? 10.470  -29.377 10.039  1.000 63.243 0 187 LYS A CE  1 ? 
ATOM   1463 N NZ  . LYS A 1 187 ? 11.849  -29.721 9.670   0.900 66.314 0 187 LYS A NZ  1 ? 
ATOM   1464 N N   . PRO A 1 188 ? 10.544  -23.917 9.170   1.000 27.402 0 188 PRO A N   1 ? 
ATOM   1465 C CA  . PRO A 1 188 ? 10.981  -23.339 7.900   1.000 29.920 0 188 PRO A CA  1 ? 
ATOM   1466 C C   . PRO A 1 188 ? 11.370  -24.367 6.858   1.000 27.971 0 188 PRO A C   1 ? 
ATOM   1467 O O   . PRO A 1 188 ? 11.990  -25.377 7.161   1.000 26.615 0 188 PRO A O   1 ? 
ATOM   1468 C CB  . PRO A 1 188 ? 12.147  -22.410 8.292   1.000 30.909 0 188 PRO A CB  1 ? 
ATOM   1469 C CG  . PRO A 1 188 ? 11.829  -22.081 9.724   1.000 34.921 0 188 PRO A CG  1 ? 
ATOM   1470 C CD  . PRO A 1 188 ? 11.308  -23.397 10.314  1.000 32.852 0 188 PRO A CD  1 ? 
ATOM   1471 N N   . THR A 1 189 ? 10.965  -24.081 5.612   1.000 24.536 0 189 THR A N   1 ? 
ATOM   1472 C CA  . THR A 1 189 ? 11.361  -24.890 4.467   1.000 24.945 0 189 THR A CA  1 ? 
ATOM   1473 C C   . THR A 1 189 ? 12.327  -24.103 3.591   1.000 24.647 0 189 THR A C   1 ? 
ATOM   1474 O O   . THR A 1 189 ? 12.475  -24.415 2.421   1.000 26.370 0 189 THR A O   1 ? 
ATOM   1475 C CB  . THR A 1 189 ? 10.114  -25.328 3.708   1.000 26.329 0 189 THR A CB  1 ? 
ATOM   1476 O OG1 . THR A 1 189 ? 9.337   -24.163 3.517   1.000 27.749 0 189 THR A OG1 1 ? 
ATOM   1477 C CG2 . THR A 1 189 ? 9.360   -26.372 4.509   1.000 31.368 0 189 THR A CG2 1 ? 
ATOM   1478 N N   . THR A 1 190 ? 12.953  -23.082 4.181   1.000 24.705 0 190 THR A N   1 ? 
ATOM   1479 C CA  . THR A 1 190 ? 13.915  -22.255 3.486   1.000 23.768 0 190 THR A CA  1 ? 
ATOM   1480 C C   . THR A 1 190 ? 15.107  -23.125 3.073   1.000 24.187 0 190 THR A C   1 ? 
ATOM   1481 O O   . THR A 1 190 ? 15.562  -23.985 3.831   1.000 25.203 0 190 THR A O   1 ? 
ATOM   1482 C CB  . THR A 1 190 ? 14.310  -21.085 4.390   1.000 26.468 0 190 THR A CB  1 ? 
ATOM   1483 O OG1 . THR A 1 190 ? 13.084  -20.442 4.734   1.000 28.273 0 190 THR A OG1 1 ? 
ATOM   1484 C CG2 . THR A 1 190 ? 15.150  -20.055 3.656   1.000 26.802 0 190 THR A CG2 1 ? 
ATOM   1485 N N   . VAL A 1 191 ? 15.608  -22.848 1.874   1.000 21.494 0 191 VAL A N   1 ? 
ATOM   1486 C CA  . VAL A 1 191 ? 16.812  -23.460 1.339   1.000 23.275 0 191 VAL A CA  1 ? 
ATOM   1487 C C   . VAL A 1 191 ? 17.904  -22.405 1.328   1.000 22.100 0 191 VAL A C   1 ? 
ATOM   1488 O O   . VAL A 1 191 ? 17.704  -21.261 0.912   1.000 22.398 0 191 VAL A O   1 ? 
ATOM   1489 C CB  . VAL A 1 191 ? 16.589  -24.001 -0.087  1.000 23.568 0 191 VAL A CB  1 ? 
ATOM   1490 C CG1 . VAL A 1 191 ? 17.893  -24.446 -0.744  1.000 27.792 0 191 VAL A CG1 1 ? 
ATOM   1491 C CG2 . VAL A 1 191 ? 15.585  -25.130 -0.051  1.000 25.791 0 191 VAL A CG2 1 ? 
ATOM   1492 N N   . THR A 1 192 ? 19.096  -22.824 1.768   1.000 22.895 0 192 THR A N   1 ? 
ATOM   1493 C CA  . THR A 1 192 ? 20.242  -21.942 1.786   1.000 21.784 0 192 THR A CA  1 ? 
ATOM   1494 C C   . THR A 1 192 ? 21.070  -22.304 0.557   1.000 21.441 0 192 THR A C   1 ? 
ATOM   1495 O O   . THR A 1 192 ? 21.431  -23.471 0.406   1.000 25.268 0 192 THR A O   1 ? 
ATOM   1496 C CB  . THR A 1 192 ? 21.055  -22.151 3.066   1.000 26.490 0 192 THR A CB  1 ? 
ATOM   1497 O OG1 . THR A 1 192 ? 20.253  -21.870 4.208   1.000 28.579 0 192 THR A OG1 1 ? 
ATOM   1498 C CG2 . THR A 1 192 ? 22.283  -21.261 3.091   1.000 30.273 0 192 THR A CG2 1 ? 
ATOM   1499 N N   . CYS A 1 193 ? 21.327  -21.310 -0.291  1.000 21.311 0 193 CYS A N   1 ? 
ATOM   1500 C CA  . CYS A 1 193 ? 22.146  -21.465 -1.476  1.000 23.167 0 193 CYS A CA  1 ? 
ATOM   1501 C C   . CYS A 1 193 ? 23.390  -20.590 -1.348  1.000 23.144 0 193 CYS A C   1 ? 
ATOM   1502 O O   . CYS A 1 193 ? 23.418  -19.607 -0.607  1.000 22.951 0 193 CYS A O   1 ? 
ATOM   1503 C CB  . CYS A 1 193 ? 21.384  -21.005 -2.708  1.000 24.324 0 193 CYS A CB  1 ? 
ATOM   1504 S SG  . CYS A 1 193 ? 20.045  -22.146 -3.137  1.000 24.849 0 193 CYS A SG  1 ? 
ATOM   1505 N N   . PRO A 1 194 ? 24.453  -20.894 -2.117  1.000 26.426 0 194 PRO A N   1 ? 
ATOM   1506 C CA  . PRO A 1 194 ? 25.597  -19.990 -2.186  1.000 26.272 0 194 PRO A CA  1 ? 
ATOM   1507 C C   . PRO A 1 194 ? 25.148  -18.590 -2.544  1.000 24.950 0 194 PRO A C   1 ? 
ATOM   1508 O O   . PRO A 1 194 ? 24.282  -18.441 -3.390  1.000 24.395 0 194 PRO A O   1 ? 
ATOM   1509 C CB  . PRO A 1 194 ? 26.392  -20.664 -3.318  1.000 29.265 0 194 PRO A CB  1 ? 
ATOM   1510 C CG  . PRO A 1 194 ? 26.162  -22.124 -3.093  1.000 29.128 0 194 PRO A CG  1 ? 
ATOM   1511 C CD  . PRO A 1 194 ? 24.653  -22.159 -2.845  1.000 28.995 0 194 PRO A CD  1 ? 
ATOM   1512 N N   . GLY A 1 195 ? 25.777  -17.575 -1.948  1.000 23.094 0 195 GLY A N   1 ? 
ATOM   1513 C CA  . GLY A 1 195 ? 25.587  -16.197 -2.355  1.000 21.589 0 195 GLY A CA  1 ? 
ATOM   1514 C C   . GLY A 1 195 ? 25.807  -16.045 -3.854  1.000 25.221 0 195 GLY A C   1 ? 
ATOM   1515 O O   . GLY A 1 195 ? 26.710  -16.681 -4.413  1.000 26.794 0 195 GLY A O   1 ? 
ATOM   1516 N N   . SER A 1 196 ? 24.928  -15.273 -4.487  1.000 22.029 0 196 SER A N   1 ? 
ATOM   1517 C CA  . SER A 1 196 ? 25.068  -14.926 -5.881  1.000 23.215 0 196 SER A CA  1 ? 
ATOM   1518 C C   . SER A 1 196 ? 24.757  -16.112 -6.787  1.000 25.117 0 196 SER A C   1 ? 
ATOM   1519 O O   . SER A 1 196 ? 25.259  -16.168 -7.909  1.000 24.304 0 196 SER A O   1 ? 
ATOM   1520 C CB  . SER A 1 196 ? 26.467  -14.376 -6.142  1.000 24.990 0 196 SER A CB  1 ? 
ATOM   1521 O OG  . SER A 1 196 ? 26.542  -13.066 -5.613  1.000 28.127 0 196 SER A OG  1 ? 
ATOM   1522 N N   . SER A 1 197 ? 23.861  -17.009 -6.346  1.000 23.069 0 197 SER A N   1 ? 
ATOM   1523 C CA  . SER A 1 197 ? 23.313  -18.054 -7.204  1.000 20.796 0 197 SER A CA  1 ? 
ATOM   1524 C C   . SER A 1 197 ? 22.373  -17.435 -8.232  1.000 18.924 0 197 SER A C   1 ? 
ATOM   1525 O O   . SER A 1 197 ? 21.926  -16.312 -8.049  1.000 21.936 0 197 SER A O   1 ? 
ATOM   1526 C CB  . SER A 1 197 ? 22.612  -19.087 -6.390  1.000 23.253 0 197 SER A CB  1 ? 
ATOM   1527 O OG  . SER A 1 197 ? 23.535  -19.840 -5.593  1.000 25.358 0 197 SER A OG  1 ? 
ATOM   1528 N N   . ASN A 1 198 ? 22.032  -18.205 -9.287  1.000 19.761 0 198 ASN A N   1 ? 
ATOM   1529 C CA  . ASN A 1 198 ? 21.015  -17.815 -10.258 1.000 17.919 0 198 ASN A CA  1 ? 
ATOM   1530 C C   . ASN A 1 198 ? 19.887  -18.835 -10.195 1.000 15.983 0 198 ASN A C   1 ? 
ATOM   1531 O O   . ASN A 1 198 ? 20.068  -19.952 -9.714  1.000 18.886 0 198 ASN A O   1 ? 
ATOM   1532 C CB  . ASN A 1 198 ? 21.572  -17.726 -11.679 1.000 20.841 0 198 ASN A CB  1 ? 
ATOM   1533 C CG  . ASN A 1 198 ? 22.605  -16.644 -11.842 1.000 23.901 0 198 ASN A CG  1 ? 
ATOM   1534 O OD1 . ASN A 1 198 ? 22.445  -15.529 -11.342 1.000 22.598 0 198 ASN A OD1 1 ? 
ATOM   1535 N ND2 . ASN A 1 198 ? 23.680  -16.956 -12.560 1.000 29.437 0 198 ASN A ND2 1 ? 
ATOM   1536 N N   . TYR A 1 199 ? 18.724  -18.452 -10.741 1.000 18.142 0 199 TYR A N   1 ? 
ATOM   1537 C CA  . TYR A 1 199 ? 17.541  -19.241 -10.446 1.000 17.781 0 199 TYR A CA  1 ? 
ATOM   1538 C C   . TYR A 1 199 ? 16.585  -19.309 -11.630 1.000 17.083 0 199 TYR A C   1 ? 
ATOM   1539 O O   . TYR A 1 199 ? 16.640  -18.493 -12.517 1.000 16.663 0 199 TYR A O   1 ? 
ATOM   1540 C CB  . TYR A 1 199 ? 16.763  -18.609 -9.273  1.000 17.508 0 199 TYR A CB  1 ? 
ATOM   1541 C CG  . TYR A 1 199 ? 17.571  -18.548 -7.990  1.000 17.859 0 199 TYR A CG  1 ? 
ATOM   1542 C CD1 . TYR A 1 199 ? 17.695  -19.650 -7.155  1.000 17.152 0 199 TYR A CD1 1 ? 
ATOM   1543 C CD2 . TYR A 1 199 ? 18.244  -17.372 -7.655  1.000 18.385 0 199 TYR A CD2 1 ? 
ATOM   1544 C CE1 . TYR A 1 199 ? 18.481  -19.586 -6.012  1.000 18.728 0 199 TYR A CE1 1 ? 
ATOM   1545 C CE2 . TYR A 1 199 ? 19.031  -17.317 -6.522  1.000 19.283 0 199 TYR A CE2 1 ? 
ATOM   1546 C CZ  . TYR A 1 199 ? 19.159  -18.420 -5.706  1.000 18.904 0 199 TYR A CZ  1 ? 
ATOM   1547 O OH  . TYR A 1 199 ? 19.908  -18.419 -4.534  1.000 22.498 0 199 TYR A OH  1 ? 
ATOM   1548 N N   . ARG A 1 200 ? 15.683  -20.294 -11.575 1.000 17.543 0 200 ARG A N   1 ? 
ATOM   1549 C CA  . ARG A 1 200 ? 14.580  -20.396 -12.519 1.000 17.153 0 200 ARG A CA  1 ? 
ATOM   1550 C C   . ARG A 1 200 ? 13.303  -20.651 -11.712 1.000 16.889 0 200 ARG A C   1 ? 
ATOM   1551 O O   . ARG A 1 200 ? 13.317  -21.509 -10.825 1.000 18.089 0 200 ARG A O   1 ? 
ATOM   1552 C CB  . ARG A 1 200 ? 14.802  -21.577 -13.461 1.000 16.933 0 200 ARG A CB  1 ? 
ATOM   1553 C CG  . ARG A 1 200 ? 13.678  -21.771 -14.464 1.000 18.503 0 200 ARG A CG  1 ? 
ATOM   1554 C CD  . ARG A 1 200 ? 13.917  -22.910 -15.458 1.000 21.929 0 200 ARG A CD  1 ? 
ATOM   1555 N NE  . ARG A 1 200 ? 15.009  -22.503 -16.345 1.000 24.851 0 200 ARG A NE  1 ? 
ATOM   1556 C CZ  . ARG A 1 200 ? 16.165  -23.137 -16.495 1.000 28.797 0 200 ARG A CZ  1 ? 
ATOM   1557 N NH1 . ARG A 1 200 ? 16.485  -24.163 -15.747 1.000 33.204 0 200 ARG A NH1 1 ? 
ATOM   1558 N NH2 . ARG A 1 200 ? 17.012  -22.713 -17.423 1.000 28.807 0 200 ARG A NH2 1 ? 
ATOM   1559 N N   . VAL A 1 201 ? 12.273  -19.873 -12.039 1.000 15.977 0 201 VAL A N   1 ? 
ATOM   1560 C CA  . VAL A 1 201 ? 10.939  -20.101 -11.511 1.000 15.228 0 201 VAL A CA  1 ? 
ATOM   1561 C C   . VAL A 1 201 ? 10.088  -20.614 -12.653 1.000 14.492 0 201 VAL A C   1 ? 
ATOM   1562 O O   . VAL A 1 201 ? 10.004  -19.964 -13.688 1.000 17.015 0 201 VAL A O   1 ? 
ATOM   1563 C CB  . VAL A 1 201 ? 10.319  -18.826 -10.936 1.000 15.890 0 201 VAL A CB  1 ? 
ATOM   1564 C CG1 . VAL A 1 201 ? 8.909   -19.073 -10.443 1.000 17.915 0 201 VAL A CG1 1 ? 
ATOM   1565 C CG2 . VAL A 1 201 ? 11.184  -18.262 -9.825  1.000 18.157 0 201 VAL A CG2 1 ? 
ATOM   1566 N N   . THR A 1 202 ? 9.577   -21.825 -12.497 1.000 15.686 0 202 THR A N   1 ? 
ATOM   1567 C CA  . THR A 1 202 ? 8.731   -22.404 -13.522 1.000 15.520 0 202 THR A CA  1 ? 
ATOM   1568 C C   . THR A 1 202 ? 7.296   -22.532 -13.006 1.000 15.292 0 202 THR A C   1 ? 
ATOM   1569 O O   . THR A 1 202 ? 7.052   -23.214 -11.997 1.000 17.770 0 202 THR A O   1 ? 
ATOM   1570 C CB  . THR A 1 202 ? 9.264   -23.776 -13.900 1.000 17.807 0 202 THR A CB  1 ? 
ATOM   1571 O OG1 . THR A 1 202 ? 10.656  -23.747 -14.218 1.000 17.585 0 202 THR A OG1 1 ? 
ATOM   1572 C CG2 . THR A 1 202 ? 8.441   -24.399 -15.008 1.000 18.743 0 202 THR A CG2 1 ? 
ATOM   1573 N N   . PHE A 1 203 ? 6.362   -21.894 -13.706 1.000 14.796 0 203 PHE A N   1 ? 
ATOM   1574 C CA  . PHE A 1 203 ? 4.953   -22.071 -13.418 1.000 13.972 0 203 PHE A CA  1 ? 
ATOM   1575 C C   . PHE A 1 203 ? 4.477   -23.341 -14.114 1.000 15.645 0 203 PHE A C   1 ? 
ATOM   1576 O O   . PHE A 1 203 ? 4.862   -23.612 -15.247 1.000 15.913 0 203 PHE A O   1 ? 
ATOM   1577 C CB  . PHE A 1 203 ? 4.169   -20.863 -13.877 1.000 15.235 0 203 PHE A CB  1 ? 
ATOM   1578 C CG  . PHE A 1 203 ? 4.629   -19.550 -13.301 1.000 16.327 0 203 PHE A CG  1 ? 
ATOM   1579 C CD1 . PHE A 1 203 ? 4.624   -19.333 -11.933 1.000 18.849 0 203 PHE A CD1 1 ? 
ATOM   1580 C CD2 . PHE A 1 203 ? 5.029   -18.533 -14.140 1.000 18.324 0 203 PHE A CD2 1 ? 
ATOM   1581 C CE1 . PHE A 1 203 ? 5.075   -18.111 -11.440 1.000 18.081 0 203 PHE A CE1 1 ? 
ATOM   1582 C CE2 . PHE A 1 203 ? 5.442   -17.320 -13.629 1.000 17.875 0 203 PHE A CE2 1 ? 
ATOM   1583 C CZ  . PHE A 1 203 ? 5.490   -17.132 -12.283 1.000 16.957 0 203 PHE A CZ  1 ? 
ATOM   1584 N N   . CYS A 1 204 ? 3.597   -24.088 -13.446 1.000 14.739 0 204 CYS A N   1 ? 
ATOM   1585 C CA  . CYS A 1 204 ? 3.095   -25.375 -13.922 1.000 15.571 0 204 CYS A CA  1 ? 
ATOM   1586 C C   . CYS A 1 204 ? 4.201   -26.341 -14.307 1.000 16.435 0 204 CYS A C   1 ? 
ATOM   1587 O O   . CYS A 1 204 ? 4.279   -26.799 -15.450 1.000 16.944 0 204 CYS A O   1 ? 
ATOM   1588 C CB  . CYS A 1 204 ? 2.101   -25.225 -15.068 1.000 16.994 0 204 CYS A CB  1 ? 
ATOM   1589 S SG  . CYS A 1 204 ? 0.673   -24.196 -14.658 1.000 17.187 0 204 CYS A SG  1 ? 
ATOM   1590 N N   . PRO A 1 205 ? 5.096   -26.692 -13.369 1.000 17.137 0 205 PRO A N   1 ? 
ATOM   1591 C CA  . PRO A 1 205 ? 6.276   -27.467 -13.709 1.000 18.161 0 205 PRO A CA  1 ? 
ATOM   1592 C C   . PRO A 1 205 ? 5.979   -28.858 -14.222 1.000 22.474 0 205 PRO A C   1 ? 
ATOM   1593 O O   . PRO A 1 205 ? 6.803   -29.400 -14.957 1.000 23.760 0 205 PRO A O   1 ? 
ATOM   1594 C CB  . PRO A 1 205 ? 7.105   -27.535 -12.452 1.000 19.689 0 205 PRO A CB  1 ? 
ATOM   1595 C CG  . PRO A 1 205 ? 6.135   -27.266 -11.361 1.000 18.334 0 205 PRO A CG  1 ? 
ATOM   1596 C CD  . PRO A 1 205 ? 5.051   -26.335 -11.936 1.000 16.846 0 205 PRO A CD  1 ? 
ATOM   1597 N N   . THR A 1 206 ? 4.862   -29.445 -13.796 1.000 21.942 0 206 THR A N   1 ? 
ATOM   1598 C CA  . THR A 1 206 ? 4.525   -30.800 -14.217 1.000 33.944 0 206 THR A CA  1 ? 
ATOM   1599 C C   . THR A 1 206 ? 3.367   -30.713 -15.190 1.000 45.023 0 206 THR A C   1 ? 
ATOM   1600 O O   . THR A 1 206 ? 3.625   -31.070 -16.350 1.000 60.626 0 206 THR A O   1 ? 
ATOM   1601 C CB  . THR A 1 206 ? 4.207   -31.679 -13.008 1.000 36.226 0 206 THR A CB  1 ? 
ATOM   1602 O OG1 . THR A 1 206 ? 3.139   -31.061 -12.310 1.000 41.937 0 206 THR A OG1 1 ? 
ATOM   1603 C CG2 . THR A 1 206 ? 5.348   -31.745 -12.014 1.000 40.735 0 206 THR A CG2 1 ? 
HETATM 1604 O O1  . TLA B 2 .   ? 10.573  -12.516 -26.594 1.000 27.238 0 301 TLA A O1  1 ? 
HETATM 1605 O O11 . TLA B 2 .   ? 10.825  -12.282 -24.434 1.000 25.887 0 301 TLA A O11 1 ? 
HETATM 1606 C C1  . TLA B 2 .   ? 10.455  -12.886 -25.427 1.000 25.611 0 301 TLA A C1  1 ? 
HETATM 1607 C C2  . TLA B 2 .   ? 9.793   -14.253 -25.222 1.000 20.405 0 301 TLA A C2  1 ? 
HETATM 1608 O O2  . TLA B 2 .   ? 9.437   -14.517 -23.871 1.000 20.527 0 301 TLA A O2  1 ? 
HETATM 1609 C C3  . TLA B 2 .   ? 10.731  -15.352 -25.728 1.000 20.408 0 301 TLA A C3  1 ? 
HETATM 1610 O O3  . TLA B 2 .   ? 11.927  -15.377 -24.983 1.000 20.671 0 301 TLA A O3  1 ? 
HETATM 1611 C C4  . TLA B 2 .   ? 10.027  -16.706 -25.596 1.000 18.447 0 301 TLA A C4  1 ? 
HETATM 1612 O O4  . TLA B 2 .   ? 10.467  -17.471 -24.710 1.000 17.388 0 301 TLA A O4  1 ? 
HETATM 1613 O O41 . TLA B 2 .   ? 9.055   -16.914 -26.353 1.000 18.440 0 301 TLA A O41 1 ? 
HETATM 1614 O O   . HOH C 3 .   ? -11.548 -27.826 5.855   1.000 40.150 0 401 HOH A O   1 ? 
HETATM 1615 O O   . HOH C 3 .   ? -2.547  -1.923  -3.992  1.000 53.611 0 402 HOH A O   1 ? 
HETATM 1616 O O   . HOH C 3 .   ? -7.779  -15.882 17.131  1.000 21.266 0 403 HOH A O   1 ? 
HETATM 1617 O O   . HOH C 3 .   ? 10.032  -29.509 -2.997  1.000 33.314 0 404 HOH A O   1 ? 
HETATM 1618 O O   . HOH C 3 .   ? -7.997  -16.643 -12.414 1.000 29.776 0 405 HOH A O   1 ? 
HETATM 1619 O O   . HOH C 3 .   ? 11.976  -10.096 -24.486 1.000 47.860 0 406 HOH A O   1 ? 
HETATM 1620 O O   . HOH C 3 .   ? 20.670  -4.495  -3.212  1.000 42.714 0 407 HOH A O   1 ? 
HETATM 1621 O O   . HOH C 3 .   ? 25.077  -21.412 -7.032  1.000 38.897 0 408 HOH A O   1 ? 
HETATM 1622 O O   . HOH C 3 .   ? -1.566  -14.954 17.061  1.000 29.063 0 409 HOH A O   1 ? 
HETATM 1623 O O   . HOH C 3 .   ? 8.080   -27.393 7.526   1.000 30.074 0 410 HOH A O   1 ? 
HETATM 1624 O O   . HOH C 3 .   ? 2.141   -34.818 2.280   1.000 55.066 0 411 HOH A O   1 ? 
HETATM 1625 O O   . HOH C 3 .   ? 12.455  -28.598 -7.377  1.000 40.383 0 412 HOH A O   1 ? 
HETATM 1626 O O   . HOH C 3 .   ? 21.754  -14.497 -5.978  1.000 25.052 0 413 HOH A O   1 ? 
HETATM 1627 O O   . HOH C 3 .   ? 18.052  -22.898 5.036   1.000 48.022 0 414 HOH A O   1 ? 
HETATM 1628 O O   . HOH C 3 .   ? -5.488  -9.710  -21.327 1.000 48.620 0 415 HOH A O   1 ? 
HETATM 1629 O O   . HOH C 3 .   ? 22.568  -26.634 -7.735  1.000 52.777 0 416 HOH A O   1 ? 
HETATM 1630 O O   . HOH C 3 .   ? 20.742  -6.543  1.789   1.000 40.417 0 417 HOH A O   1 ? 
HETATM 1631 O O   . HOH C 3 .   ? 13.165  -1.783  -11.641 1.000 42.396 0 418 HOH A O   1 ? 
HETATM 1632 O O   . HOH C 3 .   ? -2.890  -24.816 -13.015 1.000 32.006 0 419 HOH A O   1 ? 
HETATM 1633 O O   . HOH C 3 .   ? 12.274  -24.032 -11.925 1.000 19.502 0 420 HOH A O   1 ? 
HETATM 1634 O O   . HOH C 3 .   ? -1.717  -9.870  11.989  1.000 41.428 0 421 HOH A O   1 ? 
HETATM 1635 O O   . HOH C 3 .   ? -16.269 -20.965 9.262   1.000 29.404 0 422 HOH A O   1 ? 
HETATM 1636 O O   . HOH C 3 .   ? 4.204   -26.523 13.025  1.000 44.214 0 423 HOH A O   1 ? 
HETATM 1637 O O   . HOH C 3 .   ? 23.448  -15.601 6.239   1.000 39.268 0 424 HOH A O   1 ? 
HETATM 1638 O O   . HOH C 3 .   ? -7.943  -28.287 -10.472 1.000 51.756 0 425 HOH A O   1 ? 
HETATM 1639 O O   . HOH C 3 .   ? 17.466  -25.619 -12.351 1.000 44.074 0 426 HOH A O   1 ? 
HETATM 1640 O O   . HOH C 3 .   ? -1.810  -20.972 4.324   1.000 24.049 0 427 HOH A O   1 ? 
HETATM 1641 O O   . HOH C 3 .   ? 3.617   -0.780  -18.579 1.000 50.674 0 428 HOH A O   1 ? 
HETATM 1642 O O   . HOH C 3 .   ? 12.942  -7.654  -18.428 1.000 43.882 0 429 HOH A O   1 ? 
HETATM 1643 O O   . HOH C 3 .   ? -0.075  -12.346 9.094   1.000 39.050 0 430 HOH A O   1 ? 
HETATM 1644 O O   . HOH C 3 .   ? 6.877   -16.813 8.259   1.000 46.201 0 431 HOH A O   1 ? 
HETATM 1645 O O   . HOH C 3 .   ? -3.922  -4.969  -5.555  1.000 44.359 0 432 HOH A O   1 ? 
HETATM 1646 O O   . HOH C 3 .   ? 16.852  -20.543 -21.413 1.000 21.384 0 433 HOH A O   1 ? 
HETATM 1647 O O   . HOH C 3 .   ? -6.237  -31.468 9.315   1.000 48.534 0 434 HOH A O   1 ? 
HETATM 1648 O O   . HOH C 3 .   ? 4.892   -15.746 2.722   1.000 27.107 0 435 HOH A O   1 ? 
HETATM 1649 O O   . HOH C 3 .   ? -3.008  -23.619 -24.585 1.000 40.394 0 436 HOH A O   1 ? 
HETATM 1650 O O   . HOH C 3 .   ? 5.139   -19.908 -26.685 1.000 20.520 0 437 HOH A O   1 ? 
HETATM 1651 O O   . HOH C 3 .   ? -15.218 -14.342 -15.740 1.000 51.083 0 438 HOH A O   1 ? 
HETATM 1652 O O   . HOH C 3 .   ? 10.685  -20.018 -23.782 1.000 15.660 0 439 HOH A O   1 ? 
HETATM 1653 O O   . HOH C 3 .   ? 17.139  -7.375  -17.322 1.000 48.835 0 440 HOH A O   1 ? 
HETATM 1654 O O   . HOH C 3 .   ? -0.873  -7.989  -21.249 1.000 32.336 0 441 HOH A O   1 ? 
HETATM 1655 O O   . HOH C 3 .   ? 17.042  -4.558  -4.695  1.000 50.247 0 442 HOH A O   1 ? 
HETATM 1656 O O   . HOH C 3 .   ? -15.498 -18.376 3.094   1.000 36.291 0 443 HOH A O   1 ? 
HETATM 1657 O O   . HOH C 3 .   ? 11.778  -25.862 -15.411 1.000 35.955 0 444 HOH A O   1 ? 
HETATM 1658 O O   . HOH C 3 .   ? 7.307   -15.524 -27.984 1.000 20.254 0 445 HOH A O   1 ? 
HETATM 1659 O O   . HOH C 3 .   ? 3.458   -22.946 15.669  1.000 34.947 0 446 HOH A O   1 ? 
HETATM 1660 O O   . HOH C 3 .   ? 0.227   -26.551 8.857   1.000 19.127 0 447 HOH A O   1 ? 
HETATM 1661 O O   . HOH C 3 .   ? 10.253  -23.646 0.616   1.000 21.021 0 448 HOH A O   1 ? 
HETATM 1662 O O   . HOH C 3 .   ? 6.944   -5.412  -19.035 1.000 31.919 0 449 HOH A O   1 ? 
HETATM 1663 O O   . HOH C 3 .   ? -3.307  -27.093 16.149  1.000 21.884 0 450 HOH A O   1 ? 
HETATM 1664 O O   . HOH C 3 .   ? 21.684  -21.736 6.517   1.000 51.521 0 451 HOH A O   1 ? 
HETATM 1665 O O   . HOH C 3 .   ? 8.310   -19.883 10.320  1.000 34.852 0 452 HOH A O   1 ? 
HETATM 1666 O O   . HOH C 3 .   ? 1.892   -17.268 -8.195  1.000 15.953 0 453 HOH A O   1 ? 
HETATM 1667 O O   . HOH C 3 .   ? 1.515   -17.580 -0.578  1.000 14.579 0 454 HOH A O   1 ? 
HETATM 1668 O O   . HOH C 3 .   ? 7.478   -24.522 5.921   1.000 38.887 0 455 HOH A O   1 ? 
HETATM 1669 O O   . HOH C 3 .   ? -0.618  -8.405  -0.671  1.000 39.099 0 456 HOH A O   1 ? 
HETATM 1670 O O   . HOH C 3 .   ? 10.452  -1.309  -13.485 1.000 51.567 0 457 HOH A O   1 ? 
HETATM 1671 O O   . HOH C 3 .   ? 14.825  -16.515 -21.173 1.000 37.380 0 458 HOH A O   1 ? 
HETATM 1672 O O   . HOH C 3 .   ? 3.912   -12.208 -24.105 1.000 30.204 0 459 HOH A O   1 ? 
HETATM 1673 O O   . HOH C 3 .   ? -4.778  -16.444 -17.056 1.000 21.338 0 460 HOH A O   1 ? 
HETATM 1674 O O   . HOH C 3 .   ? 7.462   -12.056 3.693   1.000 51.481 0 461 HOH A O   1 ? 
HETATM 1675 O O   . HOH C 3 .   ? 0.934   -11.798 -2.506  1.000 25.111 0 462 HOH A O   1 ? 
HETATM 1676 O O   . HOH C 3 .   ? 16.918  -5.448  -8.347  1.000 39.837 0 463 HOH A O   1 ? 
HETATM 1677 O O   . HOH C 3 .   ? -6.765  -0.449  -12.816 1.000 38.168 0 464 HOH A O   1 ? 
HETATM 1678 O O   . HOH C 3 .   ? -7.250  -11.868 -5.856  1.000 24.123 0 465 HOH A O   1 ? 
HETATM 1679 O O   . HOH C 3 .   ? -1.635  1.334   -8.355  1.000 46.470 0 466 HOH A O   1 ? 
HETATM 1680 O O   . HOH C 3 .   ? -5.204  -16.541 18.747  1.000 25.394 0 467 HOH A O   1 ? 
HETATM 1681 O O   . HOH C 3 .   ? 22.937  -11.865 -6.164  1.000 24.126 0 468 HOH A O   1 ? 
HETATM 1682 O O   . HOH C 3 .   ? -11.934 -15.980 -15.511 1.000 43.907 0 469 HOH A O   1 ? 
HETATM 1683 O O   . HOH C 3 .   ? 7.648   -30.373 5.508   1.000 50.444 0 470 HOH A O   1 ? 
HETATM 1684 O O   . HOH C 3 .   ? -9.463  -14.685 -7.044  1.000 32.089 0 471 HOH A O   1 ? 
HETATM 1685 O O   . HOH C 3 .   ? -1.825  -6.246  -11.481 1.000 20.327 0 472 HOH A O   1 ? 
HETATM 1686 O O   . HOH C 3 .   ? -8.581  -13.168 -1.940  1.000 35.629 0 473 HOH A O   1 ? 
HETATM 1687 O O   . HOH C 3 .   ? -6.819  -30.292 7.138   1.000 26.291 0 474 HOH A O   1 ? 
HETATM 1688 O O   . HOH C 3 .   ? 5.845   -29.377 -1.620  1.000 23.757 0 475 HOH A O   1 ? 
HETATM 1689 O O   . HOH C 3 .   ? -8.557  -31.732 13.461  1.000 46.706 0 476 HOH A O   1 ? 
HETATM 1690 O O   . HOH C 3 .   ? 24.702  -7.815  0.674   1.000 40.061 0 477 HOH A O   1 ? 
HETATM 1691 O O   . HOH C 3 .   ? 12.033  -5.616  0.627   1.000 43.450 0 478 HOH A O   1 ? 
HETATM 1692 O O   . HOH C 3 .   ? 24.629  -14.363 -9.955  1.000 36.150 0 479 HOH A O   1 ? 
HETATM 1693 O O   . HOH C 3 .   ? 2.998   -32.688 4.849   1.000 39.155 0 480 HOH A O   1 ? 
HETATM 1694 O O   . HOH C 3 .   ? 14.068  -2.658  -6.755  1.000 51.074 0 481 HOH A O   1 ? 
HETATM 1695 O O   . HOH C 3 .   ? 19.894  -27.671 -0.437  1.000 38.611 0 482 HOH A O   1 ? 
HETATM 1696 O O   . HOH C 3 .   ? -3.459  -21.128 9.879   1.000 18.190 0 483 HOH A O   1 ? 
HETATM 1697 O O   . HOH C 3 .   ? 29.082  -12.787 -4.418  1.000 41.429 0 484 HOH A O   1 ? 
HETATM 1698 O O   . HOH C 3 .   ? 2.127   -2.152  -8.130  1.000 26.698 0 485 HOH A O   1 ? 
HETATM 1699 O O   . HOH C 3 .   ? 29.172  -17.198 -3.129  1.000 43.490 0 486 HOH A O   1 ? 
HETATM 1700 O O   . HOH C 3 .   ? 10.502  -12.456 0.222   1.000 22.354 0 487 HOH A O   1 ? 
HETATM 1701 O O   . HOH C 3 .   ? -4.332  -26.276 -8.654  1.000 26.663 0 488 HOH A O   1 ? 
HETATM 1702 O O   . HOH C 3 .   ? -1.611  -18.128 6.110   1.000 29.869 0 489 HOH A O   1 ? 
HETATM 1703 O O   . HOH C 3 .   ? -1.829  -27.292 -9.451  1.000 39.063 0 490 HOH A O   1 ? 
HETATM 1704 O O   . HOH C 3 .   ? -0.757  -18.700 -23.732 1.000 28.267 0 491 HOH A O   1 ? 
HETATM 1705 O O   . HOH C 3 .   ? -14.102 -25.410 6.768   1.000 39.869 0 492 HOH A O   1 ? 
HETATM 1706 O O   . HOH C 3 .   ? -1.873  -14.344 5.029   1.000 29.000 0 493 HOH A O   1 ? 
HETATM 1707 O O   . HOH C 3 .   ? 18.957  -18.199 -14.152 1.000 29.838 0 494 HOH A O   1 ? 
HETATM 1708 O O   . HOH C 3 .   ? -6.906  -5.584  -6.685  1.000 48.528 0 495 HOH A O   1 ? 
HETATM 1709 O O   . HOH C 3 .   ? -9.867  -30.229 1.215   1.000 37.707 0 496 HOH A O   1 ? 
HETATM 1710 O O   . HOH C 3 .   ? -9.454  -19.140 -15.092 1.000 49.084 0 497 HOH A O   1 ? 
HETATM 1711 O O   . HOH C 3 .   ? 13.651  -16.607 1.565   1.000 30.006 0 498 HOH A O   1 ? 
HETATM 1712 O O   . HOH C 3 .   ? -0.378  -17.301 8.504   1.000 39.225 0 499 HOH A O   1 ? 
HETATM 1713 O O   . HOH C 3 .   ? 2.963   -10.709 -3.964  1.000 24.322 0 500 HOH A O   1 ? 
HETATM 1714 O O   . HOH C 3 .   ? -1.927  -20.268 12.085  1.000 18.458 0 501 HOH A O   1 ? 
HETATM 1715 O O   . HOH C 3 .   ? -4.327  -23.308 15.978  1.000 20.006 0 502 HOH A O   1 ? 
HETATM 1716 O O   . HOH C 3 .   ? 19.462  -25.475 2.836   1.000 43.096 0 503 HOH A O   1 ? 
HETATM 1717 O O   . HOH C 3 .   ? 7.672   -32.012 -15.826 1.000 56.529 0 504 HOH A O   1 ? 
HETATM 1718 O O   . HOH C 3 .   ? 24.219  -11.631 -8.438  1.000 32.863 0 505 HOH A O   1 ? 
HETATM 1719 O O   . HOH C 3 .   ? -0.201  -18.276 10.596  1.000 35.234 0 506 HOH A O   1 ? 
HETATM 1720 O O   . HOH C 3 .   ? 4.930   -30.455 -5.290  1.000 32.958 0 507 HOH A O   1 ? 
HETATM 1721 O O   . HOH C 3 .   ? 26.793  -11.163 1.422   1.000 27.223 0 508 HOH A O   1 ? 
HETATM 1722 O O   . HOH C 3 .   ? -2.546  -33.010 -6.396  1.000 35.230 0 509 HOH A O   1 ? 
HETATM 1723 O O   . HOH C 3 .   ? -7.276  -12.538 -19.511 1.000 31.287 0 510 HOH A O   1 ? 
HETATM 1724 O O   . HOH C 3 .   ? -7.155  -3.070  -10.473 1.000 39.184 0 511 HOH A O   1 ? 
HETATM 1725 O O   . HOH C 3 .   ? 0.980   -7.628  15.226  1.000 41.301 0 512 HOH A O   1 ? 
HETATM 1726 O O   . HOH C 3 .   ? -11.172 -21.378 -7.000  1.000 39.147 0 513 HOH A O   1 ? 
HETATM 1727 O O   . HOH C 3 .   ? 11.037  -9.217  -21.986 1.000 36.958 0 514 HOH A O   1 ? 
HETATM 1728 O O   . HOH C 3 .   ? -3.986  -23.897 -10.488 1.000 32.891 0 515 HOH A O   1 ? 
HETATM 1729 O O   . HOH C 3 .   ? -2.357  -20.516 7.367   1.000 36.014 0 516 HOH A O   1 ? 
HETATM 1730 O O   . HOH C 3 .   ? -7.791  -11.143 -1.607  1.000 46.834 0 517 HOH A O   1 ? 
HETATM 1731 O O   . HOH C 3 .   ? -3.514  -18.918 7.944   1.000 32.422 0 518 HOH A O   1 ? 
HETATM 1732 O O   . HOH C 3 .   ? -3.341  -10.494 -23.342 1.000 50.837 0 519 HOH A O   1 ? 
HETATM 1733 O O   . HOH C 3 .   ? -12.705 -28.663 -3.630  1.000 36.168 0 520 HOH A O   1 ? 
HETATM 1734 O O   . HOH C 3 .   ? 9.391   -8.994  1.657   1.000 39.082 0 521 HOH A O   1 ? 
HETATM 1735 O O   . HOH C 3 .   ? -0.699  -31.636 7.156   1.000 32.316 0 522 HOH A O   1 ? 
HETATM 1736 O O   . HOH C 3 .   ? -4.998  -32.010 5.723   1.000 31.928 0 523 HOH A O   1 ? 
HETATM 1737 O O   . HOH C 3 .   ? 3.773   -7.796  -21.210 1.000 24.206 0 524 HOH A O   1 ? 
HETATM 1738 O O   . HOH C 3 .   ? -9.779  -10.322 14.575  1.000 27.073 0 525 HOH A O   1 ? 
HETATM 1739 O O   . HOH C 3 .   ? -14.530 -25.397 4.083   1.000 32.703 0 526 HOH A O   1 ? 
HETATM 1740 O O   . HOH C 3 .   ? -13.691 -14.632 11.435  1.000 32.590 0 527 HOH A O   1 ? 
HETATM 1741 O O   . HOH C 3 .   ? 12.799  -13.602 1.700   1.000 34.270 0 528 HOH A O   1 ? 
HETATM 1742 O O   . HOH C 3 .   ? 3.539   -4.150  -1.136  1.000 33.272 0 529 HOH A O   1 ? 
HETATM 1743 O O   . HOH C 3 .   ? 2.285   -28.255 -12.675 1.000 28.761 0 530 HOH A O   1 ? 
HETATM 1744 O O   . HOH C 3 .   ? 2.233   -25.584 2.227   1.000 17.423 0 531 HOH A O   1 ? 
HETATM 1745 O O   . HOH C 3 .   ? -11.040 -14.158 -2.628  1.000 41.412 0 532 HOH A O   1 ? 
HETATM 1746 O O   . HOH C 3 .   ? -12.740 -17.739 0.311   1.000 30.908 0 533 HOH A O   1 ? 
HETATM 1747 O O   . HOH C 3 .   ? -4.400  -10.228 5.843   1.000 49.250 0 534 HOH A O   1 ? 
HETATM 1748 O O   . HOH C 3 .   ? 0.833   -33.812 -2.967  1.000 40.024 0 535 HOH A O   1 ? 
HETATM 1749 O O   . HOH C 3 .   ? -4.345  -21.154 5.630   1.000 19.169 0 536 HOH A O   1 ? 
HETATM 1750 O O   . HOH C 3 .   ? -10.205 -6.221  7.851   1.000 19.645 0 537 HOH A O   1 ? 
HETATM 1751 O O   . HOH C 3 .   ? 9.611   0.525   -8.879  1.000 33.107 0 538 HOH A O   1 ? 
HETATM 1752 O O   . HOH C 3 .   ? 2.532   -28.133 -17.506 1.000 39.510 0 539 HOH A O   1 ? 
HETATM 1753 O O   . HOH C 3 .   ? -1.562  -25.885 -17.320 1.000 26.394 0 540 HOH A O   1 ? 
HETATM 1754 O O   . HOH C 3 .   ? 16.699  -4.989  -0.537  1.000 37.922 0 541 HOH A O   1 ? 
HETATM 1755 O O   . HOH C 3 .   ? 26.771  -10.634 -7.408  1.000 44.725 0 542 HOH A O   1 ? 
HETATM 1756 O O   . HOH C 3 .   ? 2.320   -0.863  -15.441 1.000 30.087 0 543 HOH A O   1 ? 
HETATM 1757 O O   . HOH C 3 .   ? 13.839  -11.888 -21.352 1.000 33.827 0 544 HOH A O   1 ? 
HETATM 1758 O O   . HOH C 3 .   ? -4.851  -18.066 -21.551 1.000 31.996 0 545 HOH A O   1 ? 
HETATM 1759 O O   . HOH C 3 .   ? 6.216   -31.862 -2.270  1.000 53.297 0 546 HOH A O   1 ? 
HETATM 1760 O O   . HOH C 3 .   ? -5.668  -35.085 -1.815  1.000 47.901 0 547 HOH A O   1 ? 
HETATM 1761 O O   . HOH C 3 .   ? 27.235  -13.137 -1.068  1.000 39.519 0 548 HOH A O   1 ? 
HETATM 1762 O O   . HOH C 3 .   ? -9.076  -27.593 5.637   1.000 37.070 0 549 HOH A O   1 ? 
HETATM 1763 O O   . HOH C 3 .   ? 3.699   -29.838 -19.239 1.000 53.069 0 550 HOH A O   1 ? 
HETATM 1764 O O   . HOH C 3 .   ? -14.617 -28.710 1.445   1.000 43.806 0 551 HOH A O   1 ? 
HETATM 1765 O O   . HOH C 3 .   ? 7.711   -31.078 -3.854  1.000 55.102 0 552 HOH A O   1 ? 
HETATM 1766 O O   . HOH C 3 .   ? -3.050  -15.479 20.237  1.000 44.222 0 553 HOH A O   1 ? 
HETATM 1767 O O   . HOH C 3 .   ? -11.862 -25.333 10.264  1.000 22.997 0 554 HOH A O   1 ? 
HETATM 1768 O O   . HOH C 3 .   ? -4.120  -3.141  -24.695 1.000 54.289 0 555 HOH A O   1 ? 
HETATM 1769 O O   . HOH C 3 .   ? 25.358  -3.852  -7.345  1.000 47.129 0 556 HOH A O   1 ? 
HETATM 1770 O O   . HOH C 3 .   ? 0.546   -29.959 12.342  1.000 47.789 0 557 HOH A O   1 ? 
HETATM 1771 O O   . HOH C 3 .   ? -6.415  -18.484 -16.345 1.000 36.120 0 558 HOH A O   1 ? 
HETATM 1772 O O   . HOH C 3 .   ? -5.815  -22.454 -21.604 1.000 59.093 0 559 HOH A O   1 ? 
HETATM 1773 O O   . HOH C 3 .   ? 14.566  -25.344 -13.201 1.000 34.308 0 560 HOH A O   1 ? 
HETATM 1774 O O   . HOH C 3 .   ? -17.661 -22.507 11.501  1.000 45.251 0 561 HOH A O   1 ? 
HETATM 1775 O O   . HOH C 3 .   ? 4.850   -9.583  -23.556 1.000 41.888 0 562 HOH A O   1 ? 
HETATM 1776 O O   . HOH C 3 .   ? -5.638  -23.350 -23.820 1.000 63.310 0 563 HOH A O   1 ? 
HETATM 1777 O O   . HOH C 3 .   ? 5.464   -5.535  -21.227 1.000 44.444 0 564 HOH A O   1 ? 
HETATM 1778 O O   . HOH C 3 .   ? 7.310   -9.059  -24.217 1.000 53.721 0 565 HOH A O   1 ? 
HETATM 1779 O O   . HOH C 3 .   ? 9.815   -6.524  -19.786 1.000 49.410 0 566 HOH A O   1 ? 
HETATM 1780 O O   . HOH C 3 .   ? -6.043  -15.753 -19.537 1.000 40.727 0 567 HOH A O   1 ? 
HETATM 1781 O O   . HOH C 3 .   ? -0.606  -14.927 7.741   1.000 43.823 0 568 HOH A O   1 ? 
HETATM 1782 O O   . HOH C 3 .   ? 5.778   -22.803 16.460  1.000 48.792 0 569 HOH A O   1 ? 
HETATM 1783 O O   . HOH C 3 .   ? -16.054 -16.342 -1.519  1.000 61.165 0 570 HOH A O   1 ? 
HETATM 1784 O O   . HOH C 3 .   ? 3.259   -3.699  -22.680 1.000 59.188 0 571 HOH A O   1 ? 
HETATM 1785 O O   . HOH C 3 .   ? 17.782  -3.846  -2.238  1.000 51.455 0 572 HOH A O   1 ? 
HETATM 1786 O O   . HOH C 3 .   ? 8.361   -13.481 4.886   1.000 56.060 0 573 HOH A O   1 ? 
HETATM 1787 O O   . HOH C 3 .   ? 3.665   -13.339 3.214   1.000 45.197 0 574 HOH A O   1 ? 
HETATM 1788 O O   . HOH C 3 .   ? 1.280   0.269   -7.128  1.000 40.936 0 575 HOH A O   1 ? 
HETATM 1789 O O   . HOH C 3 .   ? 3.398   -11.009 1.649   1.000 48.751 0 576 HOH A O   1 ? 
HETATM 1790 O O   . HOH C 3 .   ? -3.488  -35.929 -2.718  1.000 51.949 0 577 HOH A O   1 ? 
HETATM 1791 O O   . HOH C 3 .   ? 2.541   -10.877 -0.568  1.000 44.012 0 578 HOH A O   1 ? 
HETATM 1792 O O   . HOH C 3 .   ? -7.416  -0.682  -9.273  1.000 59.458 0 579 HOH A O   1 ? 
HETATM 1793 O O   . HOH C 3 .   ? -6.741  -23.633 -11.466 1.000 41.885 0 580 HOH A O   1 ? 
HETATM 1794 O O   . HOH C 3 .   ? -17.303 -26.268 4.474   1.000 52.304 0 581 HOH A O   1 ? 
HETATM 1795 O O   . HOH C 3 .   ? 1.301   -28.641 10.107  1.000 34.957 0 582 HOH A O   1 ? 
HETATM 1796 O O   . HOH C 3 .   ? 1.030   -31.068 8.883   1.000 46.385 0 583 HOH A O   1 ? 
HETATM 1797 O O   . HOH C 3 .   ? 2.970   -5.550  1.750   1.000 60.166 0 584 HOH A O   1 ? 
# 
