data_9FEM
# 
_entry.id   9FEM 
# 
_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   9FEM         pdb_00009fem 10.2210/pdb9fem/pdb 
WWPDB D_1292129760 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-06-04 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9FEM 
_pdbx_database_status.recvd_initial_deposition_date   2024-05-21 
_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 
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.details        . 
_pdbx_database_related.db_id          6YLO 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_contact_author.id                 1 
_pdbx_contact_author.email              brynda@uochb.cas.cz 
_pdbx_contact_author.name_first         Jiri 
_pdbx_contact_author.name_last          Brynda 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-3675-6769 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Myskova, J.' 1 ? 
'Brynda, J.'  2 ? 
'Lazar, J.'   3 ? 
# 
loop_
_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 
_citation.database_id_Medline 
_citation.details 
_citation.id 
_citation.journal_abbrev 
_citation.journal_id_ASTM 
_citation.journal_id_CSD 
_citation.journal_id_ISSN 
_citation.journal_full 
_citation.journal_issue 
_citation.journal_volume 
_citation.language 
_citation.page_first 
_citation.page_last 
_citation.title 
_citation.year 
_citation.database_id_CSD 
_citation.pdbx_database_id_DOI 
_citation.pdbx_database_id_PubMed 
_citation.pdbx_database_id_patent 
_citation.unpublished_flag 
? ? ? ? ? ? ? ? ? ? primary 'To Be Published' ? 0353 ? ? ? ? ? ? ? 'Directionality of Optical Properties of Fluorescent Proteins' 
? ? ? ? ? ? 
? ? ? ? ? ? ? ? ? ? 1       'To Be Published' ? 0353 ? ? ? ? ? ? ? 'Directional optical properties of fluorescent proteins'       
? ? ? ? ? ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Myskova, J.'   1 ? 
primary 'Brynda, J.'    2 ? 
primary 'Khoroshyy, P.' 3 ? 
primary 'Lazar, J.'     4 ? 
1       'Myskova, J.'   5 ? 
1       'Lazar, J.'     6 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man mNeonGreen    27490.789 1  ? ? ? ? 
2 non-polymer syn 'SULFATE ION' 96.063    1  ? ? ? ? 
3 water       nat water         18.015    21 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       
;MVSKGEEDNMASLPATHELHIFGSINGVDFDMVGQGTGNPNDGYEELNLKSTKGDLQFSPWILVPHI(CR2)FHQYLPYP
DGMSPFQAAMVDGSGYQVHRTMQFEDGASLTVNYRYTYEGSHIKGEAQVKGTGFPADGPVMTNSLTAADWCRSKKTYPND
KTIISTFKWSYTTGNGKRYRSTARTTYTFAKPMAANYLKNQPMYVFRKTELKHSKTELNFKEWQKAFTDVMGMDELYKHH
HHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MVSKGEEDNMASLPATHELHIFGSINGVDFDMVGQGTGNPNDGYEELNLKSTKGDLQFSPWILVPHIGYGFHQYLPYPDG
MSPFQAAMVDGSGYQVHRTMQFEDGASLTVNYRYTYEGSHIKGEAQVKGTGFPADGPVMTNSLTAADWCRSKKTYPNDKT
IISTFKWSYTTGNGKRYRSTARTTYTFAKPMAANYLKNQPMYVFRKTELKHSKTELNFKEWQKAFTDVMGMDELYKHHHH
HH
;
_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 'SULFATE ION' SO4 
3 water         HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   VAL n 
1 3   SER n 
1 4   LYS n 
1 5   GLY n 
1 6   GLU n 
1 7   GLU n 
1 8   ASP n 
1 9   ASN n 
1 10  MET n 
1 11  ALA n 
1 12  SER n 
1 13  LEU n 
1 14  PRO n 
1 15  ALA n 
1 16  THR n 
1 17  HIS n 
1 18  GLU n 
1 19  LEU n 
1 20  HIS n 
1 21  ILE n 
1 22  PHE n 
1 23  GLY n 
1 24  SER n 
1 25  ILE n 
1 26  ASN n 
1 27  GLY n 
1 28  VAL n 
1 29  ASP n 
1 30  PHE n 
1 31  ASP n 
1 32  MET n 
1 33  VAL n 
1 34  GLY n 
1 35  GLN n 
1 36  GLY n 
1 37  THR n 
1 38  GLY n 
1 39  ASN n 
1 40  PRO n 
1 41  ASN n 
1 42  ASP n 
1 43  GLY n 
1 44  TYR n 
1 45  GLU n 
1 46  GLU n 
1 47  LEU n 
1 48  ASN n 
1 49  LEU n 
1 50  LYS n 
1 51  SER n 
1 52  THR n 
1 53  LYS n 
1 54  GLY n 
1 55  ASP n 
1 56  LEU n 
1 57  GLN n 
1 58  PHE n 
1 59  SER n 
1 60  PRO n 
1 61  TRP n 
1 62  ILE n 
1 63  LEU n 
1 64  VAL n 
1 65  PRO n 
1 66  HIS n 
1 67  ILE n 
1 68  CR2 n 
1 69  PHE n 
1 70  HIS n 
1 71  GLN n 
1 72  TYR n 
1 73  LEU n 
1 74  PRO n 
1 75  TYR n 
1 76  PRO n 
1 77  ASP n 
1 78  GLY n 
1 79  MET n 
1 80  SER n 
1 81  PRO n 
1 82  PHE n 
1 83  GLN n 
1 84  ALA n 
1 85  ALA n 
1 86  MET n 
1 87  VAL n 
1 88  ASP n 
1 89  GLY n 
1 90  SER n 
1 91  GLY n 
1 92  TYR n 
1 93  GLN n 
1 94  VAL n 
1 95  HIS n 
1 96  ARG n 
1 97  THR n 
1 98  MET n 
1 99  GLN n 
1 100 PHE n 
1 101 GLU n 
1 102 ASP n 
1 103 GLY n 
1 104 ALA n 
1 105 SER n 
1 106 LEU n 
1 107 THR n 
1 108 VAL n 
1 109 ASN n 
1 110 TYR n 
1 111 ARG n 
1 112 TYR n 
1 113 THR n 
1 114 TYR n 
1 115 GLU n 
1 116 GLY n 
1 117 SER n 
1 118 HIS n 
1 119 ILE n 
1 120 LYS n 
1 121 GLY n 
1 122 GLU n 
1 123 ALA n 
1 124 GLN n 
1 125 VAL n 
1 126 LYS n 
1 127 GLY n 
1 128 THR n 
1 129 GLY n 
1 130 PHE n 
1 131 PRO n 
1 132 ALA n 
1 133 ASP n 
1 134 GLY n 
1 135 PRO n 
1 136 VAL n 
1 137 MET n 
1 138 THR n 
1 139 ASN n 
1 140 SER n 
1 141 LEU n 
1 142 THR n 
1 143 ALA n 
1 144 ALA n 
1 145 ASP n 
1 146 TRP n 
1 147 CYS n 
1 148 ARG n 
1 149 SER n 
1 150 LYS n 
1 151 LYS n 
1 152 THR n 
1 153 TYR n 
1 154 PRO n 
1 155 ASN n 
1 156 ASP n 
1 157 LYS n 
1 158 THR n 
1 159 ILE n 
1 160 ILE n 
1 161 SER n 
1 162 THR n 
1 163 PHE n 
1 164 LYS n 
1 165 TRP n 
1 166 SER n 
1 167 TYR n 
1 168 THR n 
1 169 THR n 
1 170 GLY n 
1 171 ASN n 
1 172 GLY n 
1 173 LYS n 
1 174 ARG n 
1 175 TYR n 
1 176 ARG n 
1 177 SER n 
1 178 THR n 
1 179 ALA n 
1 180 ARG n 
1 181 THR n 
1 182 THR n 
1 183 TYR n 
1 184 THR n 
1 185 PHE n 
1 186 ALA n 
1 187 LYS n 
1 188 PRO n 
1 189 MET n 
1 190 ALA n 
1 191 ALA n 
1 192 ASN n 
1 193 TYR n 
1 194 LEU n 
1 195 LYS n 
1 196 ASN n 
1 197 GLN n 
1 198 PRO n 
1 199 MET n 
1 200 TYR n 
1 201 VAL n 
1 202 PHE n 
1 203 ARG n 
1 204 LYS n 
1 205 THR n 
1 206 GLU n 
1 207 LEU n 
1 208 LYS n 
1 209 HIS n 
1 210 SER n 
1 211 LYS n 
1 212 THR n 
1 213 GLU n 
1 214 LEU n 
1 215 ASN n 
1 216 PHE n 
1 217 LYS n 
1 218 GLU n 
1 219 TRP n 
1 220 GLN n 
1 221 LYS n 
1 222 ALA n 
1 223 PHE n 
1 224 THR n 
1 225 ASP n 
1 226 VAL n 
1 227 MET n 
1 228 GLY n 
1 229 MET n 
1 230 ASP n 
1 231 GLU n 
1 232 LEU n 
1 233 TYR n 
1 234 LYS n 
1 235 HIS n 
1 236 HIS n 
1 237 HIS n 
1 238 HIS n 
1 239 HIS n 
1 240 HIS n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   240 
_entity_src_gen.gene_src_common_name               amphioxus 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 blFP-Y3 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Branchiostoma lanceolatum' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     7740 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE                                                                                                 
?                           'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                                                                                                
?                           'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE                                                                                              
?                           'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'                                                                                         
?                           'C4 H7 N O4'     133.103 
CR2 'L-peptide linking' n '{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid' 
'CHROMOPHORE (GLY-TYR-GLY)' 'C13 H13 N3 O4'  275.260 
CYS 'L-peptide linking' y CYSTEINE                                                                                                
?                           'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE                                                                                               
?                           'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'                                                                                         
?                           'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                                                                                                 
?                           'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE                                                                                               
?                           'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER                                                                                                   
?                           'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE                                                                                              
?                           'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE                                                                                                 
?                           'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE                                                                                                  
?                           'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE                                                                                              
?                           'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE                                                                                           
?                           'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                                                                                                 
?                           'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE                                                                                                  
?                           'C3 H7 N O3'     105.093 
SO4 non-polymer         . 'SULFATE ION'                                                                                           
?                           'O4 S -2'        96.063  
THR 'L-peptide linking' y THREONINE                                                                                               
?                           'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN                                                                                              
?                           'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE                                                                                                
?                           'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE                                                                                                  
?                           'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   -9  ?   ?   ?   A . n 
A 1 2   VAL 2   -8  ?   ?   ?   A . n 
A 1 3   SER 3   -7  ?   ?   ?   A . n 
A 1 4   LYS 4   -6  ?   ?   ?   A . n 
A 1 5   GLY 5   -5  ?   ?   ?   A . n 
A 1 6   GLU 6   -4  ?   ?   ?   A . n 
A 1 7   GLU 7   -3  ?   ?   ?   A . n 
A 1 8   ASP 8   -2  ?   ?   ?   A . n 
A 1 9   ASN 9   -1  ?   ?   ?   A . n 
A 1 10  MET 10  0   ?   ?   ?   A . n 
A 1 11  ALA 11  1   ?   ?   ?   A . n 
A 1 12  SER 12  2   2   SER SER A . n 
A 1 13  LEU 13  3   3   LEU LEU A . n 
A 1 14  PRO 14  4   4   PRO PRO A . n 
A 1 15  ALA 15  5   5   ALA ALA A . n 
A 1 16  THR 16  6   6   THR THR A . n 
A 1 17  HIS 17  7   7   HIS HIS A . n 
A 1 18  GLU 18  8   8   GLU GLU A . n 
A 1 19  LEU 19  9   9   LEU LEU A . n 
A 1 20  HIS 20  10  10  HIS HIS A . n 
A 1 21  ILE 21  11  11  ILE ILE A . n 
A 1 22  PHE 22  12  12  PHE PHE A . n 
A 1 23  GLY 23  13  13  GLY GLY A . n 
A 1 24  SER 24  14  14  SER SER A . n 
A 1 25  ILE 25  15  15  ILE ILE A . n 
A 1 26  ASN 26  16  16  ASN ASN A . n 
A 1 27  GLY 27  17  17  GLY GLY A . n 
A 1 28  VAL 28  18  18  VAL VAL A . n 
A 1 29  ASP 29  19  19  ASP ASP A . n 
A 1 30  PHE 30  20  20  PHE PHE A . n 
A 1 31  ASP 31  21  21  ASP ASP A . n 
A 1 32  MET 32  22  22  MET MET A . n 
A 1 33  VAL 33  23  23  VAL VAL A . n 
A 1 34  GLY 34  24  24  GLY GLY A . n 
A 1 35  GLN 35  25  25  GLN GLN A . n 
A 1 36  GLY 36  26  26  GLY GLY A . n 
A 1 37  THR 37  27  27  THR THR A . n 
A 1 38  GLY 38  28  28  GLY GLY A . n 
A 1 39  ASN 39  29  29  ASN ASN A . n 
A 1 40  PRO 40  30  30  PRO PRO A . n 
A 1 41  ASN 41  31  31  ASN ASN A . n 
A 1 42  ASP 42  32  32  ASP ASP A . n 
A 1 43  GLY 43  33  33  GLY GLY A . n 
A 1 44  TYR 44  34  34  TYR TYR A . n 
A 1 45  GLU 45  35  35  GLU GLU A . n 
A 1 46  GLU 46  36  36  GLU GLU A . n 
A 1 47  LEU 47  37  37  LEU LEU A . n 
A 1 48  ASN 48  38  38  ASN ASN A . n 
A 1 49  LEU 49  39  39  LEU LEU A . n 
A 1 50  LYS 50  40  40  LYS LYS A . n 
A 1 51  SER 51  41  41  SER SER A . n 
A 1 52  THR 52  42  42  THR THR A . n 
A 1 53  LYS 53  43  43  LYS LYS A . n 
A 1 54  GLY 54  44  44  GLY GLY A . n 
A 1 55  ASP 55  45  45  ASP ASP A . n 
A 1 56  LEU 56  46  46  LEU LEU A . n 
A 1 57  GLN 57  47  47  GLN GLN A . n 
A 1 58  PHE 58  48  48  PHE PHE A . n 
A 1 59  SER 59  49  49  SER SER A . n 
A 1 60  PRO 60  50  50  PRO PRO A . n 
A 1 61  TRP 61  51  51  TRP TRP A . n 
A 1 62  ILE 62  52  52  ILE ILE A . n 
A 1 63  LEU 63  53  53  LEU LEU A . n 
A 1 64  VAL 64  54  54  VAL VAL A . n 
A 1 65  PRO 65  55  55  PRO PRO A . n 
A 1 66  HIS 66  56  56  HIS HIS A . n 
A 1 67  ILE 67  57  57  ILE ILE A . n 
A 1 68  CR2 68  58  58  CR2 CR2 A . n 
A 1 69  PHE 69  61  61  PHE PHE A . n 
A 1 70  HIS 70  62  62  HIS HIS A . n 
A 1 71  GLN 71  63  63  GLN GLN A . n 
A 1 72  TYR 72  64  64  TYR TYR A . n 
A 1 73  LEU 73  65  65  LEU LEU A . n 
A 1 74  PRO 74  66  66  PRO PRO A . n 
A 1 75  TYR 75  67  67  TYR TYR A . n 
A 1 76  PRO 76  68  68  PRO PRO A . n 
A 1 77  ASP 77  69  69  ASP ASP A . n 
A 1 78  GLY 78  70  70  GLY GLY A . n 
A 1 79  MET 79  71  71  MET MET A . n 
A 1 80  SER 80  72  72  SER SER A . n 
A 1 81  PRO 81  73  73  PRO PRO A . n 
A 1 82  PHE 82  74  74  PHE PHE A . n 
A 1 83  GLN 83  75  75  GLN GLN A . n 
A 1 84  ALA 84  76  76  ALA ALA A . n 
A 1 85  ALA 85  77  77  ALA ALA A . n 
A 1 86  MET 86  78  78  MET MET A . n 
A 1 87  VAL 87  79  79  VAL VAL A . n 
A 1 88  ASP 88  80  80  ASP ASP A . n 
A 1 89  GLY 89  81  81  GLY GLY A . n 
A 1 90  SER 90  82  82  SER SER A . n 
A 1 91  GLY 91  83  83  GLY GLY A . n 
A 1 92  TYR 92  84  84  TYR TYR A . n 
A 1 93  GLN 93  85  85  GLN GLN A . n 
A 1 94  VAL 94  86  86  VAL VAL A . n 
A 1 95  HIS 95  87  87  HIS HIS A . n 
A 1 96  ARG 96  88  88  ARG ARG A . n 
A 1 97  THR 97  89  89  THR THR A . n 
A 1 98  MET 98  90  90  MET MET A . n 
A 1 99  GLN 99  91  91  GLN GLN A . n 
A 1 100 PHE 100 92  92  PHE PHE A . n 
A 1 101 GLU 101 93  93  GLU GLU A . n 
A 1 102 ASP 102 94  94  ASP ASP A . n 
A 1 103 GLY 103 95  95  GLY GLY A . n 
A 1 104 ALA 104 96  96  ALA ALA A . n 
A 1 105 SER 105 97  97  SER SER A . n 
A 1 106 LEU 106 98  98  LEU LEU A . n 
A 1 107 THR 107 99  99  THR THR A . n 
A 1 108 VAL 108 100 100 VAL VAL A . n 
A 1 109 ASN 109 101 101 ASN ASN A . n 
A 1 110 TYR 110 102 102 TYR TYR A . n 
A 1 111 ARG 111 103 103 ARG ARG A . n 
A 1 112 TYR 112 104 104 TYR TYR A . n 
A 1 113 THR 113 105 105 THR THR A . n 
A 1 114 TYR 114 106 106 TYR TYR A . n 
A 1 115 GLU 115 107 107 GLU GLU A . n 
A 1 116 GLY 116 108 108 GLY GLY A . n 
A 1 117 SER 117 109 109 SER SER A . n 
A 1 118 HIS 118 110 110 HIS HIS A . n 
A 1 119 ILE 119 111 111 ILE ILE A . n 
A 1 120 LYS 120 112 112 LYS LYS A . n 
A 1 121 GLY 121 113 113 GLY GLY A . n 
A 1 122 GLU 122 114 114 GLU GLU A . n 
A 1 123 ALA 123 115 115 ALA ALA A . n 
A 1 124 GLN 124 116 116 GLN GLN A . n 
A 1 125 VAL 125 117 117 VAL VAL A . n 
A 1 126 LYS 126 118 118 LYS LYS A . n 
A 1 127 GLY 127 119 119 GLY GLY A . n 
A 1 128 THR 128 120 120 THR THR A . n 
A 1 129 GLY 129 121 121 GLY GLY A . n 
A 1 130 PHE 130 122 122 PHE PHE A . n 
A 1 131 PRO 131 123 123 PRO PRO A . n 
A 1 132 ALA 132 124 124 ALA ALA A . n 
A 1 133 ASP 133 125 125 ASP ASP A . n 
A 1 134 GLY 134 126 126 GLY GLY A . n 
A 1 135 PRO 135 127 127 PRO PRO A . n 
A 1 136 VAL 136 128 128 VAL VAL A . n 
A 1 137 MET 137 129 129 MET MET A . n 
A 1 138 THR 138 130 130 THR THR A . n 
A 1 139 ASN 139 131 131 ASN ASN A . n 
A 1 140 SER 140 132 132 SER SER A . n 
A 1 141 LEU 141 133 133 LEU LEU A . n 
A 1 142 THR 142 134 134 THR THR A . n 
A 1 143 ALA 143 135 135 ALA ALA A . n 
A 1 144 ALA 144 136 136 ALA ALA A . n 
A 1 145 ASP 145 137 137 ASP ASP A . n 
A 1 146 TRP 146 138 138 TRP TRP A . n 
A 1 147 CYS 147 139 139 CYS CYS A . n 
A 1 148 ARG 148 140 140 ARG ARG A . n 
A 1 149 SER 149 141 141 SER SER A . n 
A 1 150 LYS 150 142 142 LYS LYS A . n 
A 1 151 LYS 151 143 143 LYS LYS A . n 
A 1 152 THR 152 144 144 THR THR A . n 
A 1 153 TYR 153 145 145 TYR TYR A . n 
A 1 154 PRO 154 146 146 PRO PRO A . n 
A 1 155 ASN 155 147 147 ASN ASN A . n 
A 1 156 ASP 156 148 148 ASP ASP A . n 
A 1 157 LYS 157 149 149 LYS LYS A . n 
A 1 158 THR 158 150 150 THR THR A . n 
A 1 159 ILE 159 151 151 ILE ILE A . n 
A 1 160 ILE 160 152 152 ILE ILE A . n 
A 1 161 SER 161 153 153 SER SER A . n 
A 1 162 THR 162 154 154 THR THR A . n 
A 1 163 PHE 163 155 155 PHE PHE A . n 
A 1 164 LYS 164 156 156 LYS LYS A . n 
A 1 165 TRP 165 157 157 TRP TRP A . n 
A 1 166 SER 166 158 158 SER SER A . n 
A 1 167 TYR 167 159 159 TYR TYR A . n 
A 1 168 THR 168 160 160 THR THR A . n 
A 1 169 THR 169 161 161 THR THR A . n 
A 1 170 GLY 170 162 162 GLY GLY A . n 
A 1 171 ASN 171 163 163 ASN ASN A . n 
A 1 172 GLY 172 164 164 GLY GLY A . n 
A 1 173 LYS 173 165 165 LYS LYS A . n 
A 1 174 ARG 174 166 166 ARG ARG A . n 
A 1 175 TYR 175 167 167 TYR TYR A . n 
A 1 176 ARG 176 168 168 ARG ARG A . n 
A 1 177 SER 177 169 169 SER SER A . n 
A 1 178 THR 178 170 170 THR THR A . n 
A 1 179 ALA 179 171 171 ALA ALA A . n 
A 1 180 ARG 180 172 172 ARG ARG A . n 
A 1 181 THR 181 173 173 THR THR A . n 
A 1 182 THR 182 174 174 THR THR A . n 
A 1 183 TYR 183 175 175 TYR TYR A . n 
A 1 184 THR 184 176 176 THR THR A . n 
A 1 185 PHE 185 177 177 PHE PHE A . n 
A 1 186 ALA 186 178 178 ALA ALA A . n 
A 1 187 LYS 187 179 179 LYS LYS A . n 
A 1 188 PRO 188 180 180 PRO PRO A . n 
A 1 189 MET 189 181 181 MET MET A . n 
A 1 190 ALA 190 182 182 ALA ALA A . n 
A 1 191 ALA 191 183 183 ALA ALA A . n 
A 1 192 ASN 192 184 184 ASN ASN A . n 
A 1 193 TYR 193 185 185 TYR TYR A . n 
A 1 194 LEU 194 186 186 LEU LEU A . n 
A 1 195 LYS 195 187 187 LYS LYS A . n 
A 1 196 ASN 196 188 188 ASN ASN A . n 
A 1 197 GLN 197 189 189 GLN GLN A . n 
A 1 198 PRO 198 190 190 PRO PRO A . n 
A 1 199 MET 199 191 191 MET MET A . n 
A 1 200 TYR 200 192 192 TYR TYR A . n 
A 1 201 VAL 201 193 193 VAL VAL A . n 
A 1 202 PHE 202 194 194 PHE PHE A . n 
A 1 203 ARG 203 195 195 ARG ARG A . n 
A 1 204 LYS 204 196 196 LYS LYS A . n 
A 1 205 THR 205 197 197 THR THR A . n 
A 1 206 GLU 206 198 198 GLU GLU A . n 
A 1 207 LEU 207 199 199 LEU LEU A . n 
A 1 208 LYS 208 200 200 LYS LYS A . n 
A 1 209 HIS 209 201 201 HIS HIS A . n 
A 1 210 SER 210 202 202 SER SER A . n 
A 1 211 LYS 211 203 203 LYS LYS A . n 
A 1 212 THR 212 204 204 THR THR A . n 
A 1 213 GLU 213 205 205 GLU GLU A . n 
A 1 214 LEU 214 206 206 LEU LEU A . n 
A 1 215 ASN 215 207 207 ASN ASN A . n 
A 1 216 PHE 216 208 208 PHE PHE A . n 
A 1 217 LYS 217 209 209 LYS LYS A . n 
A 1 218 GLU 218 210 210 GLU GLU A . n 
A 1 219 TRP 219 211 211 TRP TRP A . n 
A 1 220 GLN 220 212 212 GLN GLN A . n 
A 1 221 LYS 221 213 213 LYS LYS A . n 
A 1 222 ALA 222 214 214 ALA ALA A . n 
A 1 223 PHE 223 215 215 PHE PHE A . n 
A 1 224 THR 224 216 216 THR THR A . n 
A 1 225 ASP 225 217 217 ASP ASP A . n 
A 1 226 VAL 226 218 218 VAL ALA A . n 
A 1 227 MET 227 219 ?   ?   ?   A . n 
A 1 228 GLY 228 220 ?   ?   ?   A . n 
A 1 229 MET 229 221 ?   ?   ?   A . n 
A 1 230 ASP 230 222 ?   ?   ?   A . n 
A 1 231 GLU 231 223 ?   ?   ?   A . n 
A 1 232 LEU 232 224 ?   ?   ?   A . n 
A 1 233 TYR 233 225 ?   ?   ?   A . n 
A 1 234 LYS 234 226 ?   ?   ?   A . n 
A 1 235 HIS 235 227 ?   ?   ?   A . n 
A 1 236 HIS 236 228 ?   ?   ?   A . n 
A 1 237 HIS 237 229 ?   ?   ?   A . n 
A 1 238 HIS 238 230 ?   ?   ?   A . n 
A 1 239 HIS 239 231 ?   ?   ?   A . n 
A 1 240 HIS 240 232 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        CR2 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   CR2 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
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 SO4 1  301 1  SO4 SO4 A . 
C 3 HOH 1  401 5  HOH HOH A . 
C 3 HOH 2  402 16 HOH HOH A . 
C 3 HOH 3  403 20 HOH HOH A . 
C 3 HOH 4  404 13 HOH HOH A . 
C 3 HOH 5  405 19 HOH HOH A . 
C 3 HOH 6  406 14 HOH HOH A . 
C 3 HOH 7  407 2  HOH HOH A . 
C 3 HOH 8  408 4  HOH HOH A . 
C 3 HOH 9  409 8  HOH HOH A . 
C 3 HOH 10 410 7  HOH HOH A . 
C 3 HOH 11 411 6  HOH HOH A . 
C 3 HOH 12 412 12 HOH HOH A . 
C 3 HOH 13 413 3  HOH HOH A . 
C 3 HOH 14 414 10 HOH HOH A . 
C 3 HOH 15 415 15 HOH HOH A . 
C 3 HOH 16 416 11 HOH HOH A . 
C 3 HOH 17 417 1  HOH HOH A . 
C 3 HOH 18 418 18 HOH HOH A . 
C 3 HOH 19 419 21 HOH HOH A . 
C 3 HOH 20 420 17 HOH HOH A . 
C 3 HOH 21 421 9  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 1 A LYS 156 ? NZ  ? A LYS 164 NZ  
2  1 Y 1 A LYS 165 ? CG  ? A LYS 173 CG  
3  1 Y 1 A LYS 165 ? CD  ? A LYS 173 CD  
4  1 Y 1 A LYS 165 ? CE  ? A LYS 173 CE  
5  1 Y 1 A LYS 165 ? NZ  ? A LYS 173 NZ  
6  1 Y 1 A ASP 217 ? CG  ? A ASP 225 CG  
7  1 Y 1 A ASP 217 ? OD1 ? A ASP 225 OD1 
8  1 Y 1 A ASP 217 ? OD2 ? A ASP 225 OD2 
9  1 Y 1 A VAL 218 ? CG1 ? A VAL 226 CG1 
10 1 Y 1 A VAL 218 ? CG2 ? A VAL 226 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 ? ? ? 5.8.0267 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? MOLREP ? ? ? .        4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9FEM 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     59.501 
_cell.length_a_esd                 ? 
_cell.length_b                     59.501 
_cell.length_b_esd                 ? 
_cell.length_c                     132.679 
_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                         9FEM 
_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                   9FEM 
_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             2.14 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          42.41 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              7.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;100 mM sodium HEPES
20% PEG 8000
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            291 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      'VariMax Cu-VHF' 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 R 300K' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-12-10 
_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                    'Mirror system' 
_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   1.541870 
_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                      'ROTATING ANODE' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'RIGAKU MICROMAX-007 HF' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.541870 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_synchrotron_site       ? 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9FEM 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.3 
_reflns.d_resolution_low                               50.0 
_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                                     11039 
_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                           98.4 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                7.1 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          15.37 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.08900000000000001 
_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                                   0.998 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.083 
_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                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_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 
_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 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_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 
2.30 2.44 ? ? ? ? ? ? 1645 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.546                ? ? 1 1 0.9159999999999999 ? ? ? ? 
0.48700000000000004 ? ? ? ? ? ? ? ? ? 
2.44 2.61 ? ? ? ? ? ? 1673 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.35600000000000004  ? ? 2 1 0.958              ? ? ? ? 0.331 ? ? ? ? ? ? 
? ? ? 
2.61 2.82 ? ? ? ? ? ? 1543 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.22699999999999998  ? ? 3 1 0.982              ? ? ? ? 0.212 ? ? ? ? ? ? 
? ? ? 
2.82 3.08 ? ? ? ? ? ? 1429 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.154                ? ? 4 1 0.993              ? ? ? ? 
0.14400000000000002 ? ? ? ? ? ? ? ? ? 
3.08 3.44 ? ? ? ? ? ? 1310 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.10099999999999999  ? ? 5 1 0.996              ? ? ? ? 0.094 ? ? ? ? ? ? 
? ? ? 
3.44 3.97 ? ? ? ? ? ? 1158 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.08                 ? ? 6 1 0.997              ? ? ? ? 
0.07400000000000001 ? ? ? ? ? ? ? ? ? 
3.97 4.86 ? ? ? ? ? ? 983  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.055999999999999994 ? ? 7 1 0.998              ? ? ? ? 0.051 ? ? ? ? ? ? 
? ? ? 
4.86 6.83 ? ? ? ? ? ? 800  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.054000000000000006 ? ? 8 1 0.997              ? ? ? ? 0.049 ? ? ? ? ? ? 
? ? ? 
6.83 50.0 ? ? ? ? ? ? 498  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.042                ? ? 9 1 0.9990000000000001 ? ? ? ? 0.038 ? ? ? ? ? ? 
? ? ? 
# 
_refine.aniso_B[1][1]                            0.06 
_refine.aniso_B[1][2]                            -0.00 
_refine.aniso_B[1][3]                            -0.00 
_refine.aniso_B[2][2]                            0.06 
_refine.aniso_B[2][3]                            -0.00 
_refine.aniso_B[3][3]                            -0.12 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               50.495 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.935 
_refine.correlation_coeff_Fo_to_Fc_free          0.893 
_refine.details                                  'HYDROGENS HAVE BEEN ADDED IN THE 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                                 9FEM 
_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                            2.32 
_refine.ls_d_res_low                             30.48 
_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                     10286 
_refine.ls_number_reflns_R_free                  542 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    98.85 
_refine.ls_percent_reflns_R_free                 5.0 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.23325 
_refine.ls_R_factor_R_free                       0.29365 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.23001 
_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                    'BABINET MODEL WITH MASK' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'MAXIMUM LIKELIHOOD' 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.395 
_refine.pdbx_overall_ESU_R_Free                  0.286 
_refine.pdbx_solvent_vdw_probe_radii             1.20 
_refine.pdbx_solvent_ion_probe_radii             0.80 
_refine.pdbx_solvent_shrinkage_radii             0.80 
_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                             9.380 
_refine.overall_SU_ML                            0.217 
_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                         1 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.32 
_refine_hist.d_res_low                        30.48 
_refine_hist.number_atoms_solvent             21 
_refine_hist.number_atoms_total               1744 
_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        1718 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         5 
_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' ? 0.014  0.013  1775 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.002  0.017  1576 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 2.367  1.674  2404 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 1.378  1.591  3636 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 9.606  5.000  212  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 33.772 22.809 89   ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 17.881 15.000 277  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? 16.403 15.000 7    ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.082  0.200  224  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.011  0.020  2017 ? r_gen_planes_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  433  ? r_gen_planes_other           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_refined                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_other                  ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_refined              ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_other                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_refined        ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_other          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_refined          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_other            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_refined       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_refined     ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_other       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_refined ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_other   ? ? 
'X-RAY DIFFRACTION' ? 5.640  5.195  854  ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 5.616  5.193  853  ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 6.987  7.798  1064 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 6.988  7.803  1065 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 6.368  5.486  921  ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 6.305  5.487  918  ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 8.457  8.058  1335 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 10.419 57.160 1880 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 10.436 57.181 1879 ? r_long_range_B_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_rigid_bond_restr           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_free            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_bonded          ? ? 
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       2.32 
_refine_ls_shell.d_res_low                        2.379 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             37 
_refine_ls_shell.number_reflns_R_work             703 
_refine_ls_shell.percent_reflns_obs               91.81 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     ? 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.361 
_refine_ls_shell.redundancy_reflns_all            ? 
_refine_ls_shell.redundancy_reflns_obs            ? 
_refine_ls_shell.wR_factor_all                    ? 
_refine_ls_shell.wR_factor_obs                    ? 
_refine_ls_shell.wR_factor_R_free                 ? 
_refine_ls_shell.wR_factor_R_work                 ? 
_refine_ls_shell.pdbx_R_complete                  ? 
_refine_ls_shell.pdbx_total_number_of_bins_used   ? 
_refine_ls_shell.pdbx_phase_error                 ? 
_refine_ls_shell.pdbx_fsc_work                    ? 
_refine_ls_shell.pdbx_fsc_free                    ? 
_refine_ls_shell.R_factor_R_free                  0.506 
# 
_struct.entry_id                     9FEM 
_struct.title                        'mNeonGreen - Directionality of Optical Properties of Fluorescent Proteins' 
_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        9FEM 
_struct_keywords.text            'FLUORESCENT PROTEIN' 
_struct_keywords.pdbx_keywords   'FLUORESCENT 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                    A0A1S4NYF2_BRALA 
_struct_ref.pdbx_db_accession          A0A1S4NYF2 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MVSKGEEDNMASLPATHELHIFGSINGVDFDMVGQGTGNPNDGYEELNLKSTKGDLQFSPWILVPHIGYGFHQYLPYPDG
MSPFQAAMVDGSGYQVHRTMQFEDGASLTVNYRYTYEGSHIKGEAQVKGTGFPADGPVMTNSLTAADWCRSKKTYPNDKT
IISTFKWSYTTGNGKRYRSTARTTYTFAKPMAANYLKNQPMYVFRKTELKHSKTELNFKEWQKAFTDVMGMDELYK
;
_struct_ref.pdbx_align_begin           25 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9FEM 
_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                 234 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             A0A1S4NYF2 
_struct_ref_seq.db_align_beg                  25 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  260 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       -9 
_struct_ref_seq.pdbx_auth_seq_align_end       226 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9FEM CR2 A 68  ? UNP A0A1S4NYF2 GLY 92 conflict         58  1 
1 9FEM ?   A ?   ? UNP A0A1S4NYF2 TYR 93 deletion         ?   2 
1 9FEM ?   A ?   ? UNP A0A1S4NYF2 GLY 94 deletion         ?   3 
1 9FEM HIS A 235 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 227 4 
1 9FEM HIS A 236 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 228 5 
1 9FEM HIS A 237 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 229 6 
1 9FEM HIS A 238 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 230 7 
1 9FEM HIS A 239 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 231 8 
1 9FEM HIS A 240 ? UNP A0A1S4NYF2 ?   ?  'expression tag' 232 9 
# 
_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)' 150  ? 
1 MORE         -11  ? 
1 'SSA (A^2)'  9410 ? 
# 
_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   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 SER A 59  ? VAL A 64  ? SER A 49  VAL A 54  5 ? 6 
HELX_P HELX_P2 AA2 PHE A 69  ? LEU A 73  ? PHE A 61  LEU A 65  5 ? 5 
HELX_P HELX_P3 AA3 SER A 80  ? ASP A 88  ? SER A 72  ASP A 80  1 ? 9 
HELX_P HELX_P4 AA4 GLY A 134 ? ASN A 139 ? GLY A 126 ASN A 131 1 ? 6 
HELX_P HELX_P5 AA5 ALA A 190 ? ASN A 196 ? ALA A 182 ASN A 188 1 ? 7 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1 covale both ? A ILE 67 C  ? ? ? 1_555 A CR2 68 N1 ? ? A ILE 57 A CR2 58 1_555 ? ? ? ? ? ? ? 1.288 ? ? 
covale2 covale both ? A CR2 68 C3 ? ? ? 1_555 A PHE 69 N  ? ? A CR2 58 A PHE 61 1_555 ? ? ? ? ? ? ? 1.314 ? ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      CR2 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       68 
_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                       CR2 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        58 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_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                'GLY, TYR, GLY' 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        CR2 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           Chromophore/chromophore-like 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 VAL 64  A . ? VAL 54  A PRO 65  A ? PRO 55  A 1 4.48   
2 GLN 197 A . ? GLN 189 A PRO 198 A ? PRO 190 A 1 -21.05 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   13 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1  2  ? anti-parallel 
AA1 2  3  ? anti-parallel 
AA1 3  4  ? anti-parallel 
AA1 4  5  ? anti-parallel 
AA1 5  6  ? anti-parallel 
AA1 6  7  ? parallel      
AA1 7  8  ? anti-parallel 
AA1 8  9  ? anti-parallel 
AA1 9  10 ? anti-parallel 
AA1 10 11 ? anti-parallel 
AA1 11 12 ? anti-parallel 
AA1 12 13 ? 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  LEU A 141 ? ALA A 144 ? LEU A 133 ALA A 136 
AA1 2  THR A 158 ? THR A 169 ? THR A 150 THR A 161 
AA1 3  ARG A 174 ? PHE A 185 ? ARG A 166 PHE A 177 
AA1 4  TYR A 92  ? PHE A 100 ? TYR A 84  PHE A 92  
AA1 5  SER A 105 ? GLU A 115 ? SER A 97  GLU A 107 
AA1 6  HIS A 118 ? THR A 128 ? HIS A 110 THR A 120 
AA1 7  THR A 16  ? ILE A 25  ? THR A 6   ILE A 15  
AA1 8  VAL A 28  ? GLY A 38  ? VAL A 18  GLY A 28  
AA1 9  GLU A 45  ? SER A 51  ? GLU A 35  SER A 41  
AA1 10 GLU A 213 ? PHE A 223 ? GLU A 205 PHE A 215 
AA1 11 MET A 199 ? HIS A 209 ? MET A 191 HIS A 201 
AA1 12 CYS A 147 ? ASN A 155 ? CYS A 139 ASN A 147 
AA1 13 THR A 158 ? THR A 169 ? THR A 150 THR A 161 
# 
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  N ALA A 143 ? N ALA A 135 O THR A 168 ? O THR A 160 
AA1 2  3  N TRP A 165 ? N TRP A 157 O SER A 177 ? O SER A 169 
AA1 3  4  O THR A 182 ? O THR A 174 N HIS A 95  ? N HIS A 87  
AA1 4  5  N VAL A 94  ? N VAL A 86  O TYR A 110 ? O TYR A 102 
AA1 5  6  N GLU A 115 ? N GLU A 107 O HIS A 118 ? O HIS A 110 
AA1 6  7  O GLY A 121 ? O GLY A 113 N GLU A 18  ? N GLU A 8   
AA1 7  8  N HIS A 17  ? N HIS A 7   O GLY A 36  ? O GLY A 26  
AA1 8  9  N GLN A 35  ? N GLN A 25  O ASN A 48  ? O ASN A 38  
AA1 9  10 N LEU A 47  ? N LEU A 37  O PHE A 216 ? O PHE A 208 
AA1 10 11 O LYS A 217 ? O LYS A 209 N GLU A 206 ? N GLU A 198 
AA1 11 12 O MET A 199 ? O MET A 191 N LYS A 151 ? N LYS A 143 
AA1 12 13 N THR A 152 ? N THR A 144 O ILE A 160 ? O ILE A 152 
# 
_pdbx_entry_details.entry_id                   9FEM 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 NE A ARG 103 ? ? CZ A ARG 103 ? ? NH1 A ARG 103 ? ? 124.30 120.30 4.00  0.50 N 
2 1 NE A ARG 103 ? ? CZ A ARG 103 ? ? NH2 A ARG 103 ? ? 116.47 120.30 -3.83 0.50 N 
# 
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 ALA A 5   ? ? -145.02 -40.62 
2 1 TRP A 138 ? ? -38.12  147.59 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     421 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   C 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET -9  ? A MET 1   
2  1 Y 1 A VAL -8  ? A VAL 2   
3  1 Y 1 A SER -7  ? A SER 3   
4  1 Y 1 A LYS -6  ? A LYS 4   
5  1 Y 1 A GLY -5  ? A GLY 5   
6  1 Y 1 A GLU -4  ? A GLU 6   
7  1 Y 1 A GLU -3  ? A GLU 7   
8  1 Y 1 A ASP -2  ? A ASP 8   
9  1 Y 1 A ASN -1  ? A ASN 9   
10 1 Y 1 A MET 0   ? A MET 10  
11 1 Y 1 A ALA 1   ? A ALA 11  
12 1 Y 1 A MET 219 ? A MET 227 
13 1 Y 1 A GLY 220 ? A GLY 228 
14 1 Y 1 A MET 221 ? A MET 229 
15 1 Y 1 A ASP 222 ? A ASP 230 
16 1 Y 1 A GLU 223 ? A GLU 231 
17 1 Y 1 A LEU 224 ? A LEU 232 
18 1 Y 1 A TYR 225 ? A TYR 233 
19 1 Y 1 A LYS 226 ? A LYS 234 
20 1 Y 1 A HIS 227 ? A HIS 235 
21 1 Y 1 A HIS 228 ? A HIS 236 
22 1 Y 1 A HIS 229 ? A HIS 237 
23 1 Y 1 A HIS 230 ? A HIS 238 
24 1 Y 1 A HIS 231 ? A HIS 239 
25 1 Y 1 A HIS 232 ? A HIS 240 
# 
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  
CR2 N1   N N N 74  
CR2 CA1  C N N 75  
CR2 C1   C N N 76  
CR2 N2   N N N 77  
CR2 N3   N N N 78  
CR2 C2   C N N 79  
CR2 O2   O N N 80  
CR2 CA2  C N N 81  
CR2 CA3  C N N 82  
CR2 C3   C N N 83  
CR2 O3   O N N 84  
CR2 CB2  C N N 85  
CR2 CG2  C Y N 86  
CR2 CD1  C Y N 87  
CR2 CD2  C Y N 88  
CR2 CE1  C Y N 89  
CR2 CE2  C Y N 90  
CR2 CZ   C Y N 91  
CR2 OH   O N N 92  
CR2 OXT  O N N 93  
CR2 H    H N N 94  
CR2 H2   H N N 95  
CR2 HA1  H N N 96  
CR2 HA12 H N N 97  
CR2 HA31 H N N 98  
CR2 HA32 H N N 99  
CR2 HB2  H N N 100 
CR2 HD1  H N N 101 
CR2 HD2  H N N 102 
CR2 HE1  H N N 103 
CR2 HE2  H N N 104 
CR2 HOH  H N N 105 
CR2 HXT  H N N 106 
CYS N    N N N 107 
CYS CA   C N R 108 
CYS C    C N N 109 
CYS O    O N N 110 
CYS CB   C N N 111 
CYS SG   S N N 112 
CYS OXT  O N N 113 
CYS H    H N N 114 
CYS H2   H N N 115 
CYS HA   H N N 116 
CYS HB2  H N N 117 
CYS HB3  H N N 118 
CYS HG   H N N 119 
CYS HXT  H N N 120 
GLN N    N N N 121 
GLN CA   C N S 122 
GLN C    C N N 123 
GLN O    O N N 124 
GLN CB   C N N 125 
GLN CG   C N N 126 
GLN CD   C N N 127 
GLN OE1  O N N 128 
GLN NE2  N N N 129 
GLN OXT  O N N 130 
GLN H    H N N 131 
GLN H2   H N N 132 
GLN HA   H N N 133 
GLN HB2  H N N 134 
GLN HB3  H N N 135 
GLN HG2  H N N 136 
GLN HG3  H N N 137 
GLN HE21 H N N 138 
GLN HE22 H N N 139 
GLN HXT  H N N 140 
GLU N    N N N 141 
GLU CA   C N S 142 
GLU C    C N N 143 
GLU O    O N N 144 
GLU CB   C N N 145 
GLU CG   C N N 146 
GLU CD   C N N 147 
GLU OE1  O N N 148 
GLU OE2  O N N 149 
GLU OXT  O N N 150 
GLU H    H N N 151 
GLU H2   H N N 152 
GLU HA   H N N 153 
GLU HB2  H N N 154 
GLU HB3  H N N 155 
GLU HG2  H N N 156 
GLU HG3  H N N 157 
GLU HE2  H N N 158 
GLU HXT  H N N 159 
GLY N    N N N 160 
GLY CA   C N N 161 
GLY C    C N N 162 
GLY O    O N N 163 
GLY OXT  O N N 164 
GLY H    H N N 165 
GLY H2   H N N 166 
GLY HA2  H N N 167 
GLY HA3  H N N 168 
GLY HXT  H N N 169 
HIS N    N N N 170 
HIS CA   C N S 171 
HIS C    C N N 172 
HIS O    O N N 173 
HIS CB   C N N 174 
HIS CG   C Y N 175 
HIS ND1  N Y N 176 
HIS CD2  C Y N 177 
HIS CE1  C Y N 178 
HIS NE2  N Y N 179 
HIS OXT  O N N 180 
HIS H    H N N 181 
HIS H2   H N N 182 
HIS HA   H N N 183 
HIS HB2  H N N 184 
HIS HB3  H N N 185 
HIS HD1  H N N 186 
HIS HD2  H N N 187 
HIS HE1  H N N 188 
HIS HE2  H N N 189 
HIS HXT  H N N 190 
HOH O    O N N 191 
HOH H1   H N N 192 
HOH H2   H N N 193 
ILE N    N N N 194 
ILE CA   C N S 195 
ILE C    C N N 196 
ILE O    O N N 197 
ILE CB   C N S 198 
ILE CG1  C N N 199 
ILE CG2  C N N 200 
ILE CD1  C N N 201 
ILE OXT  O N N 202 
ILE H    H N N 203 
ILE H2   H N N 204 
ILE HA   H N N 205 
ILE HB   H N N 206 
ILE HG12 H N N 207 
ILE HG13 H N N 208 
ILE HG21 H N N 209 
ILE HG22 H N N 210 
ILE HG23 H N N 211 
ILE HD11 H N N 212 
ILE HD12 H N N 213 
ILE HD13 H N N 214 
ILE HXT  H N N 215 
LEU N    N N N 216 
LEU CA   C N S 217 
LEU C    C N N 218 
LEU O    O N N 219 
LEU CB   C N N 220 
LEU CG   C N N 221 
LEU CD1  C N N 222 
LEU CD2  C N N 223 
LEU OXT  O N N 224 
LEU H    H N N 225 
LEU H2   H N N 226 
LEU HA   H N N 227 
LEU HB2  H N N 228 
LEU HB3  H N N 229 
LEU HG   H N N 230 
LEU HD11 H N N 231 
LEU HD12 H N N 232 
LEU HD13 H N N 233 
LEU HD21 H N N 234 
LEU HD22 H N N 235 
LEU HD23 H N N 236 
LEU HXT  H N N 237 
LYS N    N N N 238 
LYS CA   C N S 239 
LYS C    C N N 240 
LYS O    O N N 241 
LYS CB   C N N 242 
LYS CG   C N N 243 
LYS CD   C N N 244 
LYS CE   C N N 245 
LYS NZ   N N N 246 
LYS OXT  O N N 247 
LYS H    H N N 248 
LYS H2   H N N 249 
LYS HA   H N N 250 
LYS HB2  H N N 251 
LYS HB3  H N N 252 
LYS HG2  H N N 253 
LYS HG3  H N N 254 
LYS HD2  H N N 255 
LYS HD3  H N N 256 
LYS HE2  H N N 257 
LYS HE3  H N N 258 
LYS HZ1  H N N 259 
LYS HZ2  H N N 260 
LYS HZ3  H N N 261 
LYS HXT  H N N 262 
MET N    N N N 263 
MET CA   C N S 264 
MET C    C N N 265 
MET O    O N N 266 
MET CB   C N N 267 
MET CG   C N N 268 
MET SD   S N N 269 
MET CE   C N N 270 
MET OXT  O N N 271 
MET H    H N N 272 
MET H2   H N N 273 
MET HA   H N N 274 
MET HB2  H N N 275 
MET HB3  H N N 276 
MET HG2  H N N 277 
MET HG3  H N N 278 
MET HE1  H N N 279 
MET HE2  H N N 280 
MET HE3  H N N 281 
MET HXT  H N N 282 
PHE N    N N N 283 
PHE CA   C N S 284 
PHE C    C N N 285 
PHE O    O N N 286 
PHE CB   C N N 287 
PHE CG   C Y N 288 
PHE CD1  C Y N 289 
PHE CD2  C Y N 290 
PHE CE1  C Y N 291 
PHE CE2  C Y N 292 
PHE CZ   C Y N 293 
PHE OXT  O N N 294 
PHE H    H N N 295 
PHE H2   H N N 296 
PHE HA   H N N 297 
PHE HB2  H N N 298 
PHE HB3  H N N 299 
PHE HD1  H N N 300 
PHE HD2  H N N 301 
PHE HE1  H N N 302 
PHE HE2  H N N 303 
PHE HZ   H N N 304 
PHE HXT  H N N 305 
PRO N    N N N 306 
PRO CA   C N S 307 
PRO C    C N N 308 
PRO O    O N N 309 
PRO CB   C N N 310 
PRO CG   C N N 311 
PRO CD   C N N 312 
PRO OXT  O N N 313 
PRO H    H N N 314 
PRO HA   H N N 315 
PRO HB2  H N N 316 
PRO HB3  H N N 317 
PRO HG2  H N N 318 
PRO HG3  H N N 319 
PRO HD2  H N N 320 
PRO HD3  H N N 321 
PRO HXT  H N N 322 
SER N    N N N 323 
SER CA   C N S 324 
SER C    C N N 325 
SER O    O N N 326 
SER CB   C N N 327 
SER OG   O N N 328 
SER OXT  O N N 329 
SER H    H N N 330 
SER H2   H N N 331 
SER HA   H N N 332 
SER HB2  H N N 333 
SER HB3  H N N 334 
SER HG   H N N 335 
SER HXT  H N N 336 
SO4 S    S N N 337 
SO4 O1   O N N 338 
SO4 O2   O N N 339 
SO4 O3   O N N 340 
SO4 O4   O N N 341 
THR N    N N N 342 
THR CA   C N S 343 
THR C    C N N 344 
THR O    O N N 345 
THR CB   C N R 346 
THR OG1  O N N 347 
THR CG2  C N N 348 
THR OXT  O N N 349 
THR H    H N N 350 
THR H2   H N N 351 
THR HA   H N N 352 
THR HB   H N N 353 
THR HG1  H N N 354 
THR HG21 H N N 355 
THR HG22 H N N 356 
THR HG23 H N N 357 
THR HXT  H N N 358 
TRP N    N N N 359 
TRP CA   C N S 360 
TRP C    C N N 361 
TRP O    O N N 362 
TRP CB   C N N 363 
TRP CG   C Y N 364 
TRP CD1  C Y N 365 
TRP CD2  C Y N 366 
TRP NE1  N Y N 367 
TRP CE2  C Y N 368 
TRP CE3  C Y N 369 
TRP CZ2  C Y N 370 
TRP CZ3  C Y N 371 
TRP CH2  C Y N 372 
TRP OXT  O N N 373 
TRP H    H N N 374 
TRP H2   H N N 375 
TRP HA   H N N 376 
TRP HB2  H N N 377 
TRP HB3  H N N 378 
TRP HD1  H N N 379 
TRP HE1  H N N 380 
TRP HE3  H N N 381 
TRP HZ2  H N N 382 
TRP HZ3  H N N 383 
TRP HH2  H N N 384 
TRP HXT  H N N 385 
TYR N    N N N 386 
TYR CA   C N S 387 
TYR C    C N N 388 
TYR O    O N N 389 
TYR CB   C N N 390 
TYR CG   C Y N 391 
TYR CD1  C Y N 392 
TYR CD2  C Y N 393 
TYR CE1  C Y N 394 
TYR CE2  C Y N 395 
TYR CZ   C Y N 396 
TYR OH   O N N 397 
TYR OXT  O N N 398 
TYR H    H N N 399 
TYR H2   H N N 400 
TYR HA   H N N 401 
TYR HB2  H N N 402 
TYR HB3  H N N 403 
TYR HD1  H N N 404 
TYR HD2  H N N 405 
TYR HE1  H N N 406 
TYR HE2  H N N 407 
TYR HH   H N N 408 
TYR HXT  H N N 409 
VAL N    N N N 410 
VAL CA   C N S 411 
VAL C    C N N 412 
VAL O    O N N 413 
VAL CB   C N N 414 
VAL CG1  C N N 415 
VAL CG2  C N N 416 
VAL OXT  O N N 417 
VAL H    H N N 418 
VAL H2   H N N 419 
VAL HA   H N N 420 
VAL HB   H N N 421 
VAL HG11 H N N 422 
VAL HG12 H N N 423 
VAL HG13 H N N 424 
VAL HG21 H N N 425 
VAL HG22 H N N 426 
VAL HG23 H N N 427 
VAL HXT  H N N 428 
# 
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  
CR2 O3  C3   doub N N 70  
CR2 CA3 C3   sing N N 71  
CR2 CA3 N3   sing N N 72  
CR2 C3  OXT  sing N N 73  
CR2 N1  CA1  sing N N 74  
CR2 O2  C2   doub N N 75  
CR2 N3  C2   sing N N 76  
CR2 N3  C1   sing N N 77  
CR2 C2  CA2  sing N N 78  
CR2 CA1 C1   sing N N 79  
CR2 C1  N2   doub N N 80  
CR2 CA2 N2   sing N N 81  
CR2 CA2 CB2  doub N Z 82  
CR2 CB2 CG2  sing N N 83  
CR2 CG2 CD2  doub Y N 84  
CR2 CG2 CD1  sing Y N 85  
CR2 CD2 CE2  sing Y N 86  
CR2 CD1 CE1  doub Y N 87  
CR2 CE2 CZ   doub Y N 88  
CR2 CE1 CZ   sing Y N 89  
CR2 CZ  OH   sing N N 90  
CR2 N1  H    sing N N 91  
CR2 N1  H2   sing N N 92  
CR2 CA1 HA1  sing N N 93  
CR2 CA1 HA12 sing N N 94  
CR2 CA3 HA31 sing N N 95  
CR2 CA3 HA32 sing N N 96  
CR2 CB2 HB2  sing N N 97  
CR2 CD1 HD1  sing N N 98  
CR2 CD2 HD2  sing N N 99  
CR2 CE1 HE1  sing N N 100 
CR2 CE2 HE2  sing N N 101 
CR2 OH  HOH  sing N N 102 
CR2 OXT HXT  sing N N 103 
CYS N   CA   sing N N 104 
CYS N   H    sing N N 105 
CYS N   H2   sing N N 106 
CYS CA  C    sing N N 107 
CYS CA  CB   sing N N 108 
CYS CA  HA   sing N N 109 
CYS C   O    doub N N 110 
CYS C   OXT  sing N N 111 
CYS CB  SG   sing N N 112 
CYS CB  HB2  sing N N 113 
CYS CB  HB3  sing N N 114 
CYS SG  HG   sing N N 115 
CYS OXT HXT  sing N N 116 
GLN N   CA   sing N N 117 
GLN N   H    sing N N 118 
GLN N   H2   sing N N 119 
GLN CA  C    sing N N 120 
GLN CA  CB   sing N N 121 
GLN CA  HA   sing N N 122 
GLN C   O    doub N N 123 
GLN C   OXT  sing N N 124 
GLN CB  CG   sing N N 125 
GLN CB  HB2  sing N N 126 
GLN CB  HB3  sing N N 127 
GLN CG  CD   sing N N 128 
GLN CG  HG2  sing N N 129 
GLN CG  HG3  sing N N 130 
GLN CD  OE1  doub N N 131 
GLN CD  NE2  sing N N 132 
GLN NE2 HE21 sing N N 133 
GLN NE2 HE22 sing N N 134 
GLN OXT HXT  sing N N 135 
GLU N   CA   sing N N 136 
GLU N   H    sing N N 137 
GLU N   H2   sing N N 138 
GLU CA  C    sing N N 139 
GLU CA  CB   sing N N 140 
GLU CA  HA   sing N N 141 
GLU C   O    doub N N 142 
GLU C   OXT  sing N N 143 
GLU CB  CG   sing N N 144 
GLU CB  HB2  sing N N 145 
GLU CB  HB3  sing N N 146 
GLU CG  CD   sing N N 147 
GLU CG  HG2  sing N N 148 
GLU CG  HG3  sing N N 149 
GLU CD  OE1  doub N N 150 
GLU CD  OE2  sing N N 151 
GLU OE2 HE2  sing N N 152 
GLU OXT HXT  sing N N 153 
GLY N   CA   sing N N 154 
GLY N   H    sing N N 155 
GLY N   H2   sing N N 156 
GLY CA  C    sing N N 157 
GLY CA  HA2  sing N N 158 
GLY CA  HA3  sing N N 159 
GLY C   O    doub N N 160 
GLY C   OXT  sing N N 161 
GLY OXT HXT  sing N N 162 
HIS N   CA   sing N N 163 
HIS N   H    sing N N 164 
HIS N   H2   sing N N 165 
HIS CA  C    sing N N 166 
HIS CA  CB   sing N N 167 
HIS CA  HA   sing N N 168 
HIS C   O    doub N N 169 
HIS C   OXT  sing N N 170 
HIS CB  CG   sing N N 171 
HIS CB  HB2  sing N N 172 
HIS CB  HB3  sing N N 173 
HIS CG  ND1  sing Y N 174 
HIS CG  CD2  doub Y N 175 
HIS ND1 CE1  doub Y N 176 
HIS ND1 HD1  sing N N 177 
HIS CD2 NE2  sing Y N 178 
HIS CD2 HD2  sing N N 179 
HIS CE1 NE2  sing Y N 180 
HIS CE1 HE1  sing N N 181 
HIS NE2 HE2  sing N N 182 
HIS OXT HXT  sing N N 183 
HOH O   H1   sing N N 184 
HOH O   H2   sing N N 185 
ILE N   CA   sing N N 186 
ILE N   H    sing N N 187 
ILE N   H2   sing N N 188 
ILE CA  C    sing N N 189 
ILE CA  CB   sing N N 190 
ILE CA  HA   sing N N 191 
ILE C   O    doub N N 192 
ILE C   OXT  sing N N 193 
ILE CB  CG1  sing N N 194 
ILE CB  CG2  sing N N 195 
ILE CB  HB   sing N N 196 
ILE CG1 CD1  sing N N 197 
ILE CG1 HG12 sing N N 198 
ILE CG1 HG13 sing N N 199 
ILE CG2 HG21 sing N N 200 
ILE CG2 HG22 sing N N 201 
ILE CG2 HG23 sing N N 202 
ILE CD1 HD11 sing N N 203 
ILE CD1 HD12 sing N N 204 
ILE CD1 HD13 sing N N 205 
ILE OXT HXT  sing N N 206 
LEU N   CA   sing N N 207 
LEU N   H    sing N N 208 
LEU N   H2   sing N N 209 
LEU CA  C    sing N N 210 
LEU CA  CB   sing N N 211 
LEU CA  HA   sing N N 212 
LEU C   O    doub N N 213 
LEU C   OXT  sing N N 214 
LEU CB  CG   sing N N 215 
LEU CB  HB2  sing N N 216 
LEU CB  HB3  sing N N 217 
LEU CG  CD1  sing N N 218 
LEU CG  CD2  sing N N 219 
LEU CG  HG   sing N N 220 
LEU CD1 HD11 sing N N 221 
LEU CD1 HD12 sing N N 222 
LEU CD1 HD13 sing N N 223 
LEU CD2 HD21 sing N N 224 
LEU CD2 HD22 sing N N 225 
LEU CD2 HD23 sing N N 226 
LEU OXT HXT  sing N N 227 
LYS N   CA   sing N N 228 
LYS N   H    sing N N 229 
LYS N   H2   sing N N 230 
LYS CA  C    sing N N 231 
LYS CA  CB   sing N N 232 
LYS CA  HA   sing N N 233 
LYS C   O    doub N N 234 
LYS C   OXT  sing N N 235 
LYS CB  CG   sing N N 236 
LYS CB  HB2  sing N N 237 
LYS CB  HB3  sing N N 238 
LYS CG  CD   sing N N 239 
LYS CG  HG2  sing N N 240 
LYS CG  HG3  sing N N 241 
LYS CD  CE   sing N N 242 
LYS CD  HD2  sing N N 243 
LYS CD  HD3  sing N N 244 
LYS CE  NZ   sing N N 245 
LYS CE  HE2  sing N N 246 
LYS CE  HE3  sing N N 247 
LYS NZ  HZ1  sing N N 248 
LYS NZ  HZ2  sing N N 249 
LYS NZ  HZ3  sing N N 250 
LYS OXT HXT  sing N N 251 
MET N   CA   sing N N 252 
MET N   H    sing N N 253 
MET N   H2   sing N N 254 
MET CA  C    sing N N 255 
MET CA  CB   sing N N 256 
MET CA  HA   sing N N 257 
MET C   O    doub N N 258 
MET C   OXT  sing N N 259 
MET CB  CG   sing N N 260 
MET CB  HB2  sing N N 261 
MET CB  HB3  sing N N 262 
MET CG  SD   sing N N 263 
MET CG  HG2  sing N N 264 
MET CG  HG3  sing N N 265 
MET SD  CE   sing N N 266 
MET CE  HE1  sing N N 267 
MET CE  HE2  sing N N 268 
MET CE  HE3  sing N N 269 
MET OXT HXT  sing N N 270 
PHE N   CA   sing N N 271 
PHE N   H    sing N N 272 
PHE N   H2   sing N N 273 
PHE CA  C    sing N N 274 
PHE CA  CB   sing N N 275 
PHE CA  HA   sing N N 276 
PHE C   O    doub N N 277 
PHE C   OXT  sing N N 278 
PHE CB  CG   sing N N 279 
PHE CB  HB2  sing N N 280 
PHE CB  HB3  sing N N 281 
PHE CG  CD1  doub Y N 282 
PHE CG  CD2  sing Y N 283 
PHE CD1 CE1  sing Y N 284 
PHE CD1 HD1  sing N N 285 
PHE CD2 CE2  doub Y N 286 
PHE CD2 HD2  sing N N 287 
PHE CE1 CZ   doub Y N 288 
PHE CE1 HE1  sing N N 289 
PHE CE2 CZ   sing Y N 290 
PHE CE2 HE2  sing N N 291 
PHE CZ  HZ   sing N N 292 
PHE OXT HXT  sing N N 293 
PRO N   CA   sing N N 294 
PRO N   CD   sing N N 295 
PRO N   H    sing N N 296 
PRO CA  C    sing N N 297 
PRO CA  CB   sing N N 298 
PRO CA  HA   sing N N 299 
PRO C   O    doub N N 300 
PRO C   OXT  sing N N 301 
PRO CB  CG   sing N N 302 
PRO CB  HB2  sing N N 303 
PRO CB  HB3  sing N N 304 
PRO CG  CD   sing N N 305 
PRO CG  HG2  sing N N 306 
PRO CG  HG3  sing N N 307 
PRO CD  HD2  sing N N 308 
PRO CD  HD3  sing N N 309 
PRO OXT HXT  sing N N 310 
SER N   CA   sing N N 311 
SER N   H    sing N N 312 
SER N   H2   sing N N 313 
SER CA  C    sing N N 314 
SER CA  CB   sing N N 315 
SER CA  HA   sing N N 316 
SER C   O    doub N N 317 
SER C   OXT  sing N N 318 
SER CB  OG   sing N N 319 
SER CB  HB2  sing N N 320 
SER CB  HB3  sing N N 321 
SER OG  HG   sing N N 322 
SER OXT HXT  sing N N 323 
SO4 S   O1   doub N N 324 
SO4 S   O2   doub N N 325 
SO4 S   O3   sing N N 326 
SO4 S   O4   sing N N 327 
THR N   CA   sing N N 328 
THR N   H    sing N N 329 
THR N   H2   sing N N 330 
THR CA  C    sing N N 331 
THR CA  CB   sing N N 332 
THR CA  HA   sing N N 333 
THR C   O    doub N N 334 
THR C   OXT  sing N N 335 
THR CB  OG1  sing N N 336 
THR CB  CG2  sing N N 337 
THR CB  HB   sing N N 338 
THR OG1 HG1  sing N N 339 
THR CG2 HG21 sing N N 340 
THR CG2 HG22 sing N N 341 
THR CG2 HG23 sing N N 342 
THR OXT HXT  sing N N 343 
TRP N   CA   sing N N 344 
TRP N   H    sing N N 345 
TRP N   H2   sing N N 346 
TRP CA  C    sing N N 347 
TRP CA  CB   sing N N 348 
TRP CA  HA   sing N N 349 
TRP C   O    doub N N 350 
TRP C   OXT  sing N N 351 
TRP CB  CG   sing N N 352 
TRP CB  HB2  sing N N 353 
TRP CB  HB3  sing N N 354 
TRP CG  CD1  doub Y N 355 
TRP CG  CD2  sing Y N 356 
TRP CD1 NE1  sing Y N 357 
TRP CD1 HD1  sing N N 358 
TRP CD2 CE2  doub Y N 359 
TRP CD2 CE3  sing Y N 360 
TRP NE1 CE2  sing Y N 361 
TRP NE1 HE1  sing N N 362 
TRP CE2 CZ2  sing Y N 363 
TRP CE3 CZ3  doub Y N 364 
TRP CE3 HE3  sing N N 365 
TRP CZ2 CH2  doub Y N 366 
TRP CZ2 HZ2  sing N N 367 
TRP CZ3 CH2  sing Y N 368 
TRP CZ3 HZ3  sing N N 369 
TRP CH2 HH2  sing N N 370 
TRP OXT HXT  sing N N 371 
TYR N   CA   sing N N 372 
TYR N   H    sing N N 373 
TYR N   H2   sing N N 374 
TYR CA  C    sing N N 375 
TYR CA  CB   sing N N 376 
TYR CA  HA   sing N N 377 
TYR C   O    doub N N 378 
TYR C   OXT  sing N N 379 
TYR CB  CG   sing N N 380 
TYR CB  HB2  sing N N 381 
TYR CB  HB3  sing N N 382 
TYR CG  CD1  doub Y N 383 
TYR CG  CD2  sing Y N 384 
TYR CD1 CE1  sing Y N 385 
TYR CD1 HD1  sing N N 386 
TYR CD2 CE2  doub Y N 387 
TYR CD2 HD2  sing N N 388 
TYR CE1 CZ   doub Y N 389 
TYR CE1 HE1  sing N N 390 
TYR CE2 CZ   sing Y N 391 
TYR CE2 HE2  sing N N 392 
TYR CZ  OH   sing N N 393 
TYR OH  HH   sing N N 394 
TYR OXT HXT  sing N N 395 
VAL N   CA   sing N N 396 
VAL N   H    sing N N 397 
VAL N   H2   sing N N 398 
VAL CA  C    sing N N 399 
VAL CA  CB   sing N N 400 
VAL CA  HA   sing N N 401 
VAL C   O    doub N N 402 
VAL C   OXT  sing N N 403 
VAL CB  CG1  sing N N 404 
VAL CB  CG2  sing N N 405 
VAL CB  HB   sing N N 406 
VAL CG1 HG11 sing N N 407 
VAL CG1 HG12 sing N N 408 
VAL CG1 HG13 sing N N 409 
VAL CG2 HG21 sing N N 410 
VAL CG2 HG22 sing N N 411 
VAL CG2 HG23 sing N N 412 
VAL OXT HXT  sing N N 413 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Ministry of Education, Youth and Sports of the Czech Republic' 'Czech Republic' CZ.02.1.01/0.0/0.0/16_019/0000729 1 
'Czech Science Foundation'                                      'Czech Republic' 23-05983S                         2 
# 
_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   5LTP 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9FEM 
_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]   0.016806 
_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]   0.016806 
_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]   0.007537 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
N 
O 
S 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N   . SER A 1 12  ? 8.136   -7.927  7.524  1.00 67.09  ? 2   SER A N   1 
ATOM   2    C CA  . SER A 1 12  ? 7.198   -8.552  8.497  1.00 63.09  ? 2   SER A CA  1 
ATOM   3    C C   . SER A 1 12  ? 7.712   -8.266  9.903  1.00 63.83  ? 2   SER A C   1 
ATOM   4    O O   . SER A 1 12  ? 8.648   -7.417  10.064 1.00 63.49  ? 2   SER A O   1 
ATOM   5    C CB  . SER A 1 12  ? 7.033   -10.010 8.282  1.00 71.77  ? 2   SER A CB  1 
ATOM   6    O OG  . SER A 1 12  ? 6.995   -10.276 6.892  1.00 90.30  ? 2   SER A OG  1 
ATOM   7    N N   . LEU A 1 13  ? 7.075   -8.879  10.890 1.00 51.12  ? 3   LEU A N   1 
ATOM   8    C CA  . LEU A 1 13  ? 7.177   -8.401  12.296 1.00 49.45  ? 3   LEU A CA  1 
ATOM   9    C C   . LEU A 1 13  ? 8.485   -8.913  12.850 1.00 46.08  ? 3   LEU A C   1 
ATOM   10   O O   . LEU A 1 13  ? 8.951   -9.965  12.481 1.00 47.18  ? 3   LEU A O   1 
ATOM   11   C CB  . LEU A 1 13  ? 5.974   -8.868  13.129 1.00 52.98  ? 3   LEU A CB  1 
ATOM   12   C CG  . LEU A 1 13  ? 4.705   -8.023  12.950 1.00 47.47  ? 3   LEU A CG  1 
ATOM   13   C CD1 . LEU A 1 13  ? 3.474   -8.626  13.630 1.00 47.26  ? 3   LEU A CD1 1 
ATOM   14   C CD2 . LEU A 1 13  ? 4.917   -6.601  13.445 1.00 47.97  ? 3   LEU A CD2 1 
ATOM   15   N N   . PRO A 1 14  ? 9.198   -8.171  13.699 1.00 48.09  ? 4   PRO A N   1 
ATOM   16   C CA  . PRO A 1 14  ? 10.539  -8.607  14.051 1.00 45.45  ? 4   PRO A CA  1 
ATOM   17   C C   . PRO A 1 14  ? 10.543  -9.745  15.082 1.00 40.43  ? 4   PRO A C   1 
ATOM   18   O O   . PRO A 1 14  ? 9.570   -9.967  15.777 1.00 42.30  ? 4   PRO A O   1 
ATOM   19   C CB  . PRO A 1 14  ? 11.170  -7.307  14.579 1.00 39.68  ? 4   PRO A CB  1 
ATOM   20   C CG  . PRO A 1 14  ? 9.996   -6.606  15.226 1.00 43.19  ? 4   PRO A CG  1 
ATOM   21   C CD  . PRO A 1 14  ? 8.835   -6.878  14.293 1.00 47.44  ? 4   PRO A CD  1 
ATOM   22   N N   . ALA A 1 15  ? 11.705  -10.381 15.188 1.00 46.09  ? 5   ALA A N   1 
ATOM   23   C CA  . ALA A 1 15  ? 11.935  -11.613 15.983 1.00 40.77  ? 5   ALA A CA  1 
ATOM   24   C C   . ALA A 1 15  ? 13.340  -11.496 16.539 1.00 43.63  ? 5   ALA A C   1 
ATOM   25   O O   . ALA A 1 15  ? 13.448  -11.736 17.710 1.00 39.10  ? 5   ALA A O   1 
ATOM   26   C CB  . ALA A 1 15  ? 11.766  -12.831 15.121 1.00 39.31  ? 5   ALA A CB  1 
ATOM   27   N N   . THR A 1 16  ? 14.313  -11.005 15.751 1.00 37.54  ? 6   THR A N   1 
ATOM   28   C CA  . THR A 1 16  ? 15.716  -10.858 16.158 1.00 40.58  ? 6   THR A CA  1 
ATOM   29   C C   . THR A 1 16  ? 16.158  -9.435  15.850 1.00 47.26  ? 6   THR A C   1 
ATOM   30   O O   . THR A 1 16  ? 15.527  -8.792  15.008 1.00 48.51  ? 6   THR A O   1 
ATOM   31   C CB  . THR A 1 16  ? 16.680  -11.747 15.362 1.00 42.61  ? 6   THR A CB  1 
ATOM   32   O OG1 . THR A 1 16  ? 16.858  -11.216 14.057 1.00 54.10  ? 6   THR A OG1 1 
ATOM   33   C CG2 . THR A 1 16  ? 16.155  -13.141 15.126 1.00 52.35  ? 6   THR A CG2 1 
ATOM   34   N N   . HIS A 1 17  ? 17.283  -9.046  16.433 1.00 39.40  ? 7   HIS A N   1 
ATOM   35   C CA  . HIS A 1 17  ? 17.821  -7.668  16.359 1.00 42.95  ? 7   HIS A CA  1 
ATOM   36   C C   . HIS A 1 17  ? 19.270  -7.644  16.877 1.00 41.60  ? 7   HIS A C   1 
ATOM   37   O O   . HIS A 1 17  ? 19.680  -8.553  17.666 1.00 43.44  ? 7   HIS A O   1 
ATOM   38   C CB  . HIS A 1 17  ? 16.924  -6.615  17.065 1.00 41.09  ? 7   HIS A CB  1 
ATOM   39   C CG  . HIS A 1 17  ? 16.944  -6.611  18.562 1.00 53.26  ? 7   HIS A CG  1 
ATOM   40   N ND1 . HIS A 1 17  ? 16.381  -7.650  19.337 1.00 53.68  ? 7   HIS A ND1 1 
ATOM   41   C CD2 . HIS A 1 17  ? 17.356  -5.648  19.422 1.00 47.05  ? 7   HIS A CD2 1 
ATOM   42   C CE1 . HIS A 1 17  ? 16.453  -7.301  20.607 1.00 54.10  ? 7   HIS A CE1 1 
ATOM   43   N NE2 . HIS A 1 17  ? 17.047  -6.057  20.679 1.00 49.87  ? 7   HIS A NE2 1 
ATOM   44   N N   . GLU A 1 18  ? 20.006  -6.665  16.358 1.00 36.46  ? 8   GLU A N   1 
ATOM   45   C CA  . GLU A 1 18  ? 21.364  -6.237  16.779 1.00 42.95  ? 8   GLU A CA  1 
ATOM   46   C C   . GLU A 1 18  ? 21.413  -4.716  17.004 1.00 43.89  ? 8   GLU A C   1 
ATOM   47   O O   . GLU A 1 18  ? 20.699  -3.949  16.303 1.00 44.53  ? 8   GLU A O   1 
ATOM   48   C CB  . GLU A 1 18  ? 22.430  -6.586  15.737 1.00 43.13  ? 8   GLU A CB  1 
ATOM   49   C CG  . GLU A 1 18  ? 22.093  -6.263  14.288 1.00 48.46  ? 8   GLU A CG  1 
ATOM   50   C CD  . GLU A 1 18  ? 22.943  -7.143  13.381 1.00 53.68  ? 8   GLU A CD  1 
ATOM   51   O OE1 . GLU A 1 18  ? 22.411  -7.692  12.377 1.00 54.64  ? 8   GLU A OE1 1 
ATOM   52   O OE2 . GLU A 1 18  ? 24.122  -7.363  13.746 1.00 54.88  ? 8   GLU A OE2 1 
ATOM   53   N N   . LEU A 1 19  ? 22.316  -4.316  17.891 1.00 40.90  ? 9   LEU A N   1 
ATOM   54   C CA  . LEU A 1 19  ? 22.536  -2.902  18.264 1.00 46.44  ? 9   LEU A CA  1 
ATOM   55   C C   . LEU A 1 19  ? 24.029  -2.636  18.333 1.00 51.28  ? 9   LEU A C   1 
ATOM   56   O O   . LEU A 1 19  ? 24.749  -3.414  19.038 1.00 50.57  ? 9   LEU A O   1 
ATOM   57   C CB  . LEU A 1 19  ? 21.887  -2.644  19.619 1.00 42.47  ? 9   LEU A CB  1 
ATOM   58   C CG  . LEU A 1 19  ? 22.044  -1.251  20.191 1.00 36.20  ? 9   LEU A CG  1 
ATOM   59   C CD1 . LEU A 1 19  ? 21.667  -0.178  19.217 1.00 36.13  ? 9   LEU A CD1 1 
ATOM   60   C CD2 . LEU A 1 19  ? 21.227  -1.130  21.486 1.00 38.73  ? 9   LEU A CD2 1 
ATOM   61   N N   . HIS A 1 20  ? 24.436  -1.564  17.641 1.00 52.77  ? 10  HIS A N   1 
ATOM   62   C CA  . HIS A 1 20  ? 25.740  -0.880  17.791 1.00 55.85  ? 10  HIS A CA  1 
ATOM   63   C C   . HIS A 1 20  ? 25.412  0.416   18.523 1.00 52.37  ? 10  HIS A C   1 
ATOM   64   O O   . HIS A 1 20  ? 24.620  1.221   17.943 1.00 43.74  ? 10  HIS A O   1 
ATOM   65   C CB  . HIS A 1 20  ? 26.422  -0.709  16.417 1.00 49.06  ? 10  HIS A CB  1 
ATOM   66   C CG  . HIS A 1 20  ? 27.688  0.063   16.493 1.00 55.94  ? 10  HIS A CG  1 
ATOM   67   N ND1 . HIS A 1 20  ? 27.892  1.226   15.745 1.00 59.03  ? 10  HIS A ND1 1 
ATOM   68   C CD2 . HIS A 1 20  ? 28.808  -0.123  17.235 1.00 63.82  ? 10  HIS A CD2 1 
ATOM   69   C CE1 . HIS A 1 20  ? 29.104  1.704   15.998 1.00 63.81  ? 10  HIS A CE1 1 
ATOM   70   N NE2 . HIS A 1 20  ? 29.684  0.903   16.925 1.00 59.36  ? 10  HIS A NE2 1 
ATOM   71   N N   . ILE A 1 21  ? 25.863  0.536   19.779 1.00 46.95  ? 11  ILE A N   1 
ATOM   72   C CA  . ILE A 1 21  ? 25.597  1.749   20.617 1.00 38.47  ? 11  ILE A CA  1 
ATOM   73   C C   . ILE A 1 21  ? 26.961  2.328   21.018 1.00 47.07  ? 11  ILE A C   1 
ATOM   74   O O   . ILE A 1 21  ? 27.800  1.539   21.442 1.00 46.74  ? 11  ILE A O   1 
ATOM   75   C CB  . ILE A 1 21  ? 24.685  1.441   21.837 1.00 47.94  ? 11  ILE A CB  1 
ATOM   76   C CG1 . ILE A 1 21  ? 24.446  2.701   22.676 1.00 50.43  ? 11  ILE A CG1 1 
ATOM   77   C CG2 . ILE A 1 21  ? 25.205  0.324   22.743 1.00 47.08  ? 11  ILE A CG2 1 
ATOM   78   C CD1 . ILE A 1 21  ? 23.188  2.644   23.523 1.00 53.70  ? 11  ILE A CD1 1 
ATOM   79   N N   . PHE A 1 22  ? 27.218  3.631   20.848 1.00 42.49  ? 12  PHE A N   1 
ATOM   80   C CA  . PHE A 1 22  ? 28.584  4.188   21.021 1.00 49.75  ? 12  PHE A CA  1 
ATOM   81   C C   . PHE A 1 22  ? 28.465  5.676   21.247 1.00 45.35  ? 12  PHE A C   1 
ATOM   82   O O   . PHE A 1 22  ? 27.381  6.130   21.036 1.00 47.00  ? 12  PHE A O   1 
ATOM   83   C CB  . PHE A 1 22  ? 29.424  3.974   19.756 1.00 52.49  ? 12  PHE A CB  1 
ATOM   84   C CG  . PHE A 1 22  ? 28.792  4.552   18.516 1.00 44.22  ? 12  PHE A CG  1 
ATOM   85   C CD1 . PHE A 1 22  ? 27.835  3.846   17.839 1.00 40.33  ? 12  PHE A CD1 1 
ATOM   86   C CD2 . PHE A 1 22  ? 29.100  5.828   18.072 1.00 47.19  ? 12  PHE A CD2 1 
ATOM   87   C CE1 . PHE A 1 22  ? 27.242  4.358   16.687 1.00 49.77  ? 12  PHE A CE1 1 
ATOM   88   C CE2 . PHE A 1 22  ? 28.531  6.327   16.904 1.00 42.78  ? 12  PHE A CE2 1 
ATOM   89   C CZ  . PHE A 1 22  ? 27.568  5.614   16.233 1.00 43.19  ? 12  PHE A CZ  1 
ATOM   90   N N   . GLY A 1 23  ? 29.560  6.372   21.569 1.00 54.98  ? 13  GLY A N   1 
ATOM   91   C CA  . GLY A 1 23  ? 29.598  7.839   21.751 1.00 44.54  ? 13  GLY A CA  1 
ATOM   92   C C   . GLY A 1 23  ? 30.449  8.192   22.939 1.00 54.47  ? 13  GLY A C   1 
ATOM   93   O O   . GLY A 1 23  ? 31.475  7.538   23.119 1.00 60.83  ? 13  GLY A O   1 
ATOM   94   N N   . SER A 1 24  ? 30.029  9.148   23.754 1.00 48.67  ? 14  SER A N   1 
ATOM   95   C CA  . SER A 1 24  ? 30.885  9.599   24.856 1.00 47.33  ? 14  SER A CA  1 
ATOM   96   C C   . SER A 1 24  ? 30.000  9.762   26.075 1.00 48.95  ? 14  SER A C   1 
ATOM   97   O O   . SER A 1 24  ? 28.847  10.135  25.945 1.00 50.83  ? 14  SER A O   1 
ATOM   98   C CB  . SER A 1 24  ? 31.654  10.857  24.493 1.00 52.09  ? 14  SER A CB  1 
ATOM   99   O OG  . SER A 1 24  ? 30.803  11.877  23.940 1.00 49.82  ? 14  SER A OG  1 
ATOM   100  N N   . ILE A 1 25  ? 30.539  9.408   27.214 1.00 52.94  ? 15  ILE A N   1 
ATOM   101  C CA  . ILE A 1 25  ? 30.003  9.839   28.525 1.00 52.48  ? 15  ILE A CA  1 
ATOM   102  C C   . ILE A 1 25  ? 31.071  10.741  29.138 1.00 50.76  ? 15  ILE A C   1 
ATOM   103  O O   . ILE A 1 25  ? 32.176  10.200  29.393 1.00 45.14  ? 15  ILE A O   1 
ATOM   104  C CB  . ILE A 1 25  ? 29.734  8.586   29.375 1.00 48.75  ? 15  ILE A CB  1 
ATOM   105  C CG1 . ILE A 1 25  ? 28.641  7.733   28.710 1.00 53.04  ? 15  ILE A CG1 1 
ATOM   106  C CG2 . ILE A 1 25  ? 29.461  8.940   30.834 1.00 45.59  ? 15  ILE A CG2 1 
ATOM   107  C CD1 . ILE A 1 25  ? 27.256  8.360   28.603 1.00 49.71  ? 15  ILE A CD1 1 
ATOM   108  N N   . ASN A 1 26  ? 30.778  12.026  29.384 1.00 49.42  ? 16  ASN A N   1 
ATOM   109  C CA  . ASN A 1 26  ? 31.763  12.946  30.032 1.00 63.42  ? 16  ASN A CA  1 
ATOM   110  C C   . ASN A 1 26  ? 33.068  12.962  29.214 1.00 61.35  ? 16  ASN A C   1 
ATOM   111  O O   . ASN A 1 26  ? 34.160  12.924  29.838 1.00 83.40  ? 16  ASN A O   1 
ATOM   112  C CB  . ASN A 1 26  ? 31.983  12.566  31.514 1.00 62.20  ? 16  ASN A CB  1 
ATOM   113  C CG  . ASN A 1 26  ? 30.883  13.114  32.402 1.00 49.22  ? 16  ASN A CG  1 
ATOM   114  O OD1 . ASN A 1 26  ? 29.827  13.483  31.932 1.00 44.21  ? 16  ASN A OD1 1 
ATOM   115  N ND2 . ASN A 1 26  ? 31.141  13.269  33.680 1.00 57.47  ? 16  ASN A ND2 1 
ATOM   116  N N   . GLY A 1 27  ? 32.937  12.983  27.877 1.00 61.77  ? 17  GLY A N   1 
ATOM   117  C CA  . GLY A 1 27  ? 34.013  13.217  26.892 1.00 55.83  ? 17  GLY A CA  1 
ATOM   118  C C   . GLY A 1 27  ? 34.914  12.016  26.689 1.00 61.37  ? 17  GLY A C   1 
ATOM   119  O O   . GLY A 1 27  ? 35.968  12.217  26.131 1.00 64.38  ? 17  GLY A O   1 
ATOM   120  N N   . VAL A 1 28  ? 34.504  10.825  27.128 1.00 62.16  ? 18  VAL A N   1 
ATOM   121  C CA  . VAL A 1 28  ? 35.261  9.543   27.067 1.00 57.38  ? 18  VAL A CA  1 
ATOM   122  C C   . VAL A 1 28  ? 34.442  8.621   26.167 1.00 63.40  ? 18  VAL A C   1 
ATOM   123  O O   . VAL A 1 28  ? 33.257  8.406   26.476 1.00 70.25  ? 18  VAL A O   1 
ATOM   124  C CB  . VAL A 1 28  ? 35.433  8.902   28.464 1.00 70.02  ? 18  VAL A CB  1 
ATOM   125  C CG1 . VAL A 1 28  ? 36.157  7.559   28.386 1.00 61.36  ? 18  VAL A CG1 1 
ATOM   126  C CG2 . VAL A 1 28  ? 36.105  9.833   29.468 1.00 67.74  ? 18  VAL A CG2 1 
ATOM   127  N N   . ASP A 1 29  ? 35.044  8.106   25.099 1.00 60.69  ? 19  ASP A N   1 
ATOM   128  C CA  . ASP A 1 29  ? 34.336  7.313   24.067 1.00 61.11  ? 19  ASP A CA  1 
ATOM   129  C C   . ASP A 1 29  ? 33.960  5.958   24.682 1.00 61.62  ? 19  ASP A C   1 
ATOM   130  O O   . ASP A 1 29  ? 34.481  5.631   25.716 1.00 59.29  ? 19  ASP A O   1 
ATOM   131  C CB  . ASP A 1 29  ? 35.170  7.163   22.790 1.00 58.89  ? 19  ASP A CB  1 
ATOM   132  C CG  . ASP A 1 29  ? 35.173  8.370   21.862 1.00 62.40  ? 19  ASP A CG  1 
ATOM   133  O OD1 . ASP A 1 29  ? 34.418  9.342   22.093 1.00 60.95  ? 19  ASP A OD1 1 
ATOM   134  O OD2 . ASP A 1 29  ? 35.947  8.325   20.910 1.00 68.23  ? 19  ASP A OD2 1 
ATOM   135  N N   . PHE A 1 30  ? 33.065  5.202   24.052 1.00 52.63  ? 20  PHE A N   1 
ATOM   136  C CA  . PHE A 1 30  ? 32.682  3.830   24.467 1.00 52.70  ? 20  PHE A CA  1 
ATOM   137  C C   . PHE A 1 30  ? 32.036  3.248   23.215 1.00 46.69  ? 20  PHE A C   1 
ATOM   138  O O   . PHE A 1 30  ? 31.531  4.005   22.402 1.00 54.80  ? 20  PHE A O   1 
ATOM   139  C CB  . PHE A 1 30  ? 31.754  3.858   25.700 1.00 49.97  ? 20  PHE A CB  1 
ATOM   140  C CG  . PHE A 1 30  ? 30.313  4.199   25.384 1.00 44.06  ? 20  PHE A CG  1 
ATOM   141  C CD1 . PHE A 1 30  ? 29.418  3.192   25.042 1.00 47.51  ? 20  PHE A CD1 1 
ATOM   142  C CD2 . PHE A 1 30  ? 29.868  5.526   25.305 1.00 44.70  ? 20  PHE A CD2 1 
ATOM   143  C CE1 . PHE A 1 30  ? 28.092  3.476   24.722 1.00 37.17  ? 20  PHE A CE1 1 
ATOM   144  C CE2 . PHE A 1 30  ? 28.538  5.814   24.972 1.00 39.31  ? 20  PHE A CE2 1 
ATOM   145  C CZ  . PHE A 1 30  ? 27.660  4.787   24.694 1.00 38.79  ? 20  PHE A CZ  1 
ATOM   146  N N   . ASP A 1 31  ? 32.058  1.951   23.038 1.00 54.59  ? 21  ASP A N   1 
ATOM   147  C CA  . ASP A 1 31  ? 31.396  1.365   21.860 1.00 50.57  ? 21  ASP A CA  1 
ATOM   148  C C   . ASP A 1 31  ? 31.012  -0.023  22.330 1.00 48.12  ? 21  ASP A C   1 
ATOM   149  O O   . ASP A 1 31  ? 31.846  -0.620  22.962 1.00 46.93  ? 21  ASP A O   1 
ATOM   150  C CB  . ASP A 1 31  ? 32.314  1.495   20.629 1.00 56.94  ? 21  ASP A CB  1 
ATOM   151  C CG  . ASP A 1 31  ? 31.829  0.877   19.314 1.00 54.61  ? 21  ASP A CG  1 
ATOM   152  O OD1 . ASP A 1 31  ? 31.703  -0.371  19.236 1.00 40.18  ? 21  ASP A OD1 1 
ATOM   153  O OD2 . ASP A 1 31  ? 31.610  1.663   18.361 1.00 53.42  ? 21  ASP A OD2 1 
ATOM   154  N N   . MET A 1 32  ? 29.787  -0.464  22.034 1.00 50.71  ? 22  MET A N   1 
ATOM   155  C CA  . MET A 1 32  ? 29.246  -1.815  22.340 1.00 49.67  ? 22  MET A CA  1 
ATOM   156  C C   . MET A 1 32  ? 28.480  -2.361  21.125 1.00 41.18  ? 22  MET A C   1 
ATOM   157  O O   . MET A 1 32  ? 27.911  -1.519  20.411 1.00 39.00  ? 22  MET A O   1 
ATOM   158  C CB  . MET A 1 32  ? 28.334  -1.729  23.559 1.00 45.41  ? 22  MET A CB  1 
ATOM   159  C CG  . MET A 1 32  ? 29.113  -1.488  24.793 1.00 59.47  ? 22  MET A CG  1 
ATOM   160  S SD  . MET A 1 32  ? 28.016  -1.490  26.206 1.00 57.17  ? 22  MET A SD  1 
ATOM   161  C CE  . MET A 1 32  ? 28.097  -3.195  26.745 1.00 65.99  ? 22  MET A CE  1 
ATOM   162  N N   . VAL A 1 33  ? 28.515  -3.698  20.915 1.00 46.18  ? 23  VAL A N   1 
ATOM   163  C CA  . VAL A 1 33  ? 27.711  -4.469  19.902 1.00 52.81  ? 23  VAL A CA  1 
ATOM   164  C C   . VAL A 1 33  ? 27.038  -5.655  20.584 1.00 54.86  ? 23  VAL A C   1 
ATOM   165  O O   . VAL A 1 33  ? 27.684  -6.227  21.522 1.00 50.80  ? 23  VAL A O   1 
ATOM   166  C CB  . VAL A 1 33  ? 28.551  -5.034  18.726 1.00 57.46  ? 23  VAL A CB  1 
ATOM   167  C CG1 . VAL A 1 33  ? 29.107  -3.935  17.810 1.00 55.72  ? 23  VAL A CG1 1 
ATOM   168  C CG2 . VAL A 1 33  ? 29.657  -5.965  19.212 1.00 56.56  ? 23  VAL A CG2 1 
ATOM   169  N N   . GLY A 1 34  ? 25.878  -6.096  20.072 1.00 50.15  ? 24  GLY A N   1 
ATOM   170  C CA  . GLY A 1 34  ? 25.422  -7.464  20.389 1.00 48.69  ? 24  GLY A CA  1 
ATOM   171  C C   . GLY A 1 34  ? 24.091  -7.844  19.773 1.00 39.54  ? 24  GLY A C   1 
ATOM   172  O O   . GLY A 1 34  ? 23.533  -7.108  19.008 1.00 42.74  ? 24  GLY A O   1 
ATOM   173  N N   . GLN A 1 35  ? 23.583  -8.996  20.136 1.00 44.46  ? 25  GLN A N   1 
ATOM   174  C CA  . GLN A 1 35  ? 22.335  -9.540  19.555 1.00 51.73  ? 25  GLN A CA  1 
ATOM   175  C C   . GLN A 1 35  ? 21.244  -9.649  20.629 1.00 44.83  ? 25  GLN A C   1 
ATOM   176  O O   . GLN A 1 35  ? 21.559  -9.606  21.830 1.00 48.59  ? 25  GLN A O   1 
ATOM   177  C CB  . GLN A 1 35  ? 22.626  -10.894 18.908 1.00 56.22  ? 25  GLN A CB  1 
ATOM   178  C CG  . GLN A 1 35  ? 23.810  -10.896 17.947 1.00 61.34  ? 25  GLN A CG  1 
ATOM   179  C CD  . GLN A 1 35  ? 23.407  -10.445 16.568 1.00 62.69  ? 25  GLN A CD  1 
ATOM   180  O OE1 . GLN A 1 35  ? 22.474  -10.966 15.941 1.00 67.15  ? 25  GLN A OE1 1 
ATOM   181  N NE2 . GLN A 1 35  ? 24.136  -9.462  16.075 1.00 71.70  ? 25  GLN A NE2 1 
ATOM   182  N N   . GLY A 1 36  ? 20.012  -9.788  20.155 1.00 40.14  ? 26  GLY A N   1 
ATOM   183  C CA  . GLY A 1 36  ? 18.824  -10.038 20.959 1.00 45.71  ? 26  GLY A CA  1 
ATOM   184  C C   . GLY A 1 36  ? 17.658  -10.492 20.131 1.00 41.06  ? 26  GLY A C   1 
ATOM   185  O O   . GLY A 1 36  ? 17.750  -10.629 18.892 1.00 41.36  ? 26  GLY A O   1 
ATOM   186  N N   . THR A 1 37  ? 16.561  -10.654 20.837 1.00 44.59  ? 27  THR A N   1 
ATOM   187  C CA  . THR A 1 37  ? 15.335  -11.247 20.280 1.00 45.65  ? 27  THR A CA  1 
ATOM   188  C C   . THR A 1 37  ? 14.205  -10.576 21.031 1.00 45.03  ? 27  THR A C   1 
ATOM   189  O O   . THR A 1 37  ? 14.492  -9.963  22.114 1.00 37.57  ? 27  THR A O   1 
ATOM   190  C CB  . THR A 1 37  ? 15.358  -12.786 20.444 1.00 53.66  ? 27  THR A CB  1 
ATOM   191  O OG1 . THR A 1 37  ? 15.024  -13.080 21.795 1.00 47.36  ? 27  THR A OG1 1 
ATOM   192  C CG2 . THR A 1 37  ? 16.700  -13.447 20.176 1.00 50.67  ? 27  THR A CG2 1 
ATOM   193  N N   . GLY A 1 38  ? 12.986  -10.780 20.554 1.00 39.41  0 28  GLY A N   1 
ATOM   194  C CA  . GLY A 1 38  ? 11.822  -10.299 21.287 1.00 43.92  ? 28  GLY A CA  1 
ATOM   195  C C   . GLY A 1 38  ? 10.594  -10.821 20.630 1.00 39.42  ? 28  GLY A C   1 
ATOM   196  O O   . GLY A 1 38  ? 10.718  -11.561 19.672 1.00 43.65  ? 28  GLY A O   1 
ATOM   197  N N   . ASN A 1 39  ? 9.471   -10.359 21.128 1.00 46.01  ? 29  ASN A N   1 
ATOM   198  C CA  . ASN A 1 39  ? 8.143   -10.889 20.796 1.00 51.47  ? 29  ASN A CA  1 
ATOM   199  C C   . ASN A 1 39  ? 7.234   -9.698  20.529 1.00 43.58  ? 29  ASN A C   1 
ATOM   200  O O   . ASN A 1 39  ? 6.744   -9.062  21.477 1.00 44.36  ? 29  ASN A O   1 
ATOM   201  C CB  . ASN A 1 39  ? 7.675   -11.867 21.878 1.00 55.94  0 29  ASN A CB  1 
ATOM   202  C CG  . ASN A 1 39  ? 6.262   -12.359 21.650 1.00 52.91  ? 29  ASN A CG  1 
ATOM   203  O OD1 . ASN A 1 39  ? 5.514   -11.799 20.845 1.00 54.86  ? 29  ASN A OD1 1 
ATOM   204  N ND2 . ASN A 1 39  ? 5.873   -13.384 22.395 1.00 62.50  ? 29  ASN A ND2 1 
ATOM   205  N N   . PRO A 1 40  ? 6.980   -9.443  19.218 1.00 45.91  ? 30  PRO A N   1 
ATOM   206  C CA  . PRO A 1 40  ? 6.284   -8.239  18.775 1.00 48.81  ? 30  PRO A CA  1 
ATOM   207  C C   . PRO A 1 40  ? 4.804   -8.360  19.142 1.00 50.05  ? 30  PRO A C   1 
ATOM   208  O O   . PRO A 1 40  ? 4.085   -7.431  18.924 1.00 48.39  ? 30  PRO A O   1 
ATOM   209  C CB  . PRO A 1 40  ? 6.495   -8.228  17.248 1.00 51.68  ? 30  PRO A CB  1 
ATOM   210  C CG  . PRO A 1 40  ? 6.719   -9.666  16.857 1.00 43.52  ? 30  PRO A CG  1 
ATOM   211  C CD  . PRO A 1 40  ? 7.389   -10.292 18.074 1.00 44.01  ? 30  PRO A CD  1 
ATOM   212  N N   . ASN A 1 41  ? 4.397   -9.523  19.661 1.00 46.98  ? 31  ASN A N   1 
ATOM   213  C CA  . ASN A 1 41  ? 3.013   -9.808  20.100 1.00 42.86  ? 31  ASN A CA  1 
ATOM   214  C C   . ASN A 1 41  ? 2.783   -9.398  21.557 1.00 48.22  ? 31  ASN A C   1 
ATOM   215  O O   . ASN A 1 41  ? 1.595   -9.100  21.881 1.00 42.26  ? 31  ASN A O   1 
ATOM   216  C CB  . ASN A 1 41  ? 2.713   -11.280 19.839 1.00 50.49  ? 31  ASN A CB  1 
ATOM   217  C CG  . ASN A 1 41  ? 2.752   -11.557 18.351 1.00 60.25  ? 31  ASN A CG  1 
ATOM   218  O OD1 . ASN A 1 41  ? 3.543   -12.374 17.897 1.00 58.11  ? 31  ASN A OD1 1 
ATOM   219  N ND2 . ASN A 1 41  ? 1.978   -10.803 17.577 1.00 67.57  ? 31  ASN A ND2 1 
ATOM   220  N N   . ASP A 1 42  ? 3.807   -9.342  22.420 1.00 48.00  ? 32  ASP A N   1 
ATOM   221  C CA  . ASP A 1 42  ? 3.563   -8.956  23.842 1.00 53.29  ? 32  ASP A CA  1 
ATOM   222  C C   . ASP A 1 42  ? 4.605   -7.952  24.354 1.00 56.03  ? 32  ASP A C   1 
ATOM   223  O O   . ASP A 1 42  ? 4.431   -7.509  25.523 1.00 60.12  ? 32  ASP A O   1 
ATOM   224  C CB  . ASP A 1 42  ? 3.502   -10.186 24.741 1.00 47.58  ? 32  ASP A CB  1 
ATOM   225  C CG  . ASP A 1 42  ? 4.878   -10.735 24.975 1.00 49.42  ? 32  ASP A CG  1 
ATOM   226  O OD1 . ASP A 1 42  ? 5.811   -10.193 24.386 1.00 51.17  ? 32  ASP A OD1 1 
ATOM   227  O OD2 . ASP A 1 42  ? 4.995   -11.690 25.752 1.00 64.03  ? 32  ASP A OD2 1 
ATOM   228  N N   . GLY A 1 43  ? 5.589   -7.568  23.521 1.00 54.77  ? 33  GLY A N   1 
ATOM   229  C CA  . GLY A 1 43  ? 6.425   -6.359  23.721 1.00 54.69  ? 33  GLY A CA  1 
ATOM   230  C C   . GLY A 1 43  ? 7.750   -6.664  24.402 1.00 52.20  ? 33  GLY A C   1 
ATOM   231  O O   . GLY A 1 43  ? 8.659   -5.773  24.545 1.00 42.64  ? 33  GLY A O   1 
ATOM   232  N N   . TYR A 1 44  ? 7.948   -7.928  24.711 1.00 42.69  ? 34  TYR A N   1 
ATOM   233  C CA  . TYR A 1 44  ? 9.221   -8.406  25.291 1.00 41.57  ? 34  TYR A CA  1 
ATOM   234  C C   . TYR A 1 44  ? 10.396  -8.351  24.297 1.00 39.78  ? 34  TYR A C   1 
ATOM   235  O O   . TYR A 1 44  ? 10.260  -8.688  23.087 1.00 42.89  ? 34  TYR A O   1 
ATOM   236  C CB  . TYR A 1 44  ? 9.031   -9.816  25.831 1.00 44.41  ? 34  TYR A CB  1 
ATOM   237  C CG  . TYR A 1 44  ? 10.272  -10.373 26.452 1.00 44.21  ? 34  TYR A CG  1 
ATOM   238  C CD1 . TYR A 1 44  ? 10.641  -10.015 27.745 1.00 44.00  ? 34  TYR A CD1 1 
ATOM   239  C CD2 . TYR A 1 44  ? 11.043  -11.287 25.740 1.00 43.82  ? 34  TYR A CD2 1 
ATOM   240  C CE1 . TYR A 1 44  ? 11.767  -10.575 28.328 1.00 43.41  ? 34  TYR A CE1 1 
ATOM   241  C CE2 . TYR A 1 44  ? 12.187  -11.826 26.287 1.00 41.08  ? 34  TYR A CE2 1 
ATOM   242  C CZ  . TYR A 1 44  ? 12.519  -11.494 27.603 1.00 46.87  ? 34  TYR A CZ  1 
ATOM   243  O OH  . TYR A 1 44  ? 13.635  -12.035 28.158 1.00 50.91  ? 34  TYR A OH  1 
ATOM   244  N N   . GLU A 1 45  ? 11.536  -7.922  24.865 1.00 41.62  ? 35  GLU A N   1 
ATOM   245  C CA  . GLU A 1 45  ? 12.894  -7.741  24.269 1.00 41.03  ? 35  GLU A CA  1 
ATOM   246  C C   . GLU A 1 45  ? 13.930  -8.225  25.279 1.00 43.81  ? 35  GLU A C   1 
ATOM   247  O O   . GLU A 1 45  ? 13.808  -7.899  26.469 1.00 46.83  ? 35  GLU A O   1 
ATOM   248  C CB  . GLU A 1 45  ? 13.332  -6.285  24.049 1.00 36.26  ? 35  GLU A CB  1 
ATOM   249  C CG  . GLU A 1 45  ? 12.471  -5.520  23.059 1.00 45.40  ? 35  GLU A CG  1 
ATOM   250  C CD  . GLU A 1 45  ? 12.685  -4.010  22.995 1.00 47.95  ? 35  GLU A CD  1 
ATOM   251  O OE1 . GLU A 1 45  ? 13.912  -3.613  23.069 1.00 43.75  ? 35  GLU A OE1 1 
ATOM   252  O OE2 . GLU A 1 45  ? 11.645  -3.239  22.763 1.00 44.60  ? 35  GLU A OE2 1 
ATOM   253  N N   . GLU A 1 46  ? 14.854  -9.023  24.774 1.00 51.61  ? 36  GLU A N   1 
ATOM   254  C CA  . GLU A 1 46  ? 16.125  -9.397  25.379 1.00 50.13  ? 36  GLU A CA  1 
ATOM   255  C C   . GLU A 1 46  ? 17.217  -8.905  24.462 1.00 51.66  ? 36  GLU A C   1 
ATOM   256  O O   . GLU A 1 46  ? 17.102  -9.162  23.217 1.00 52.97  ? 36  GLU A O   1 
ATOM   257  C CB  . GLU A 1 46  ? 16.260  -10.905 25.410 1.00 52.93  ? 36  GLU A CB  1 
ATOM   258  C CG  . GLU A 1 46  ? 16.319  -11.406 26.796 1.00 63.72  ? 36  GLU A CG  1 
ATOM   259  C CD  . GLU A 1 46  ? 16.947  -12.770 26.866 1.00 65.22  ? 36  GLU A CD  1 
ATOM   260  O OE1 . GLU A 1 46  ? 17.092  -13.391 25.818 1.00 52.12  ? 36  GLU A OE1 1 
ATOM   261  O OE2 . GLU A 1 46  ? 17.338  -13.164 27.964 1.00 70.28  ? 36  GLU A OE2 1 
ATOM   262  N N   . LEU A 1 47  ? 18.261  -8.347  25.076 1.00 48.34  ? 37  LEU A N   1 
ATOM   263  C CA  . LEU A 1 47  ? 19.492  -7.915  24.388 1.00 50.06  ? 37  LEU A CA  1 
ATOM   264  C C   . LEU A 1 47  ? 20.709  -8.320  25.208 1.00 42.86  ? 37  LEU A C   1 
ATOM   265  O O   . LEU A 1 47  ? 20.730  -8.044  26.430 1.00 41.35  ? 37  LEU A O   1 
ATOM   266  C CB  . LEU A 1 47  ? 19.455  -6.391  24.198 1.00 50.81  ? 37  LEU A CB  1 
ATOM   267  C CG  . LEU A 1 47  ? 20.584  -5.824  23.322 1.00 47.04  ? 37  LEU A CG  1 
ATOM   268  C CD1 . LEU A 1 47  ? 20.709  -6.558  22.004 1.00 39.22  ? 37  LEU A CD1 1 
ATOM   269  C CD2 . LEU A 1 47  ? 20.348  -4.360  23.027 1.00 48.95  ? 37  LEU A CD2 1 
ATOM   270  N N   . ASN A 1 48  ? 21.703  -8.868  24.529 1.00 41.11  ? 38  ASN A N   1 
ATOM   271  C CA  . ASN A 1 48  ? 23.094  -8.994  25.057 1.00 51.39  ? 38  ASN A CA  1 
ATOM   272  C C   . ASN A 1 48  ? 24.051  -8.039  24.305 1.00 58.02  ? 38  ASN A C   1 
ATOM   273  O O   . ASN A 1 48  ? 24.017  -8.040  23.053 1.00 67.70  ? 38  ASN A O   1 
ATOM   274  C CB  . ASN A 1 48  ? 23.614  -10.439 24.985 1.00 49.20  ? 38  ASN A CB  1 
ATOM   275  C CG  . ASN A 1 48  ? 25.067  -10.539 25.421 1.00 59.70  ? 38  ASN A CG  1 
ATOM   276  O OD1 . ASN A 1 48  ? 25.389  -10.672 26.609 1.00 69.66  ? 38  ASN A OD1 1 
ATOM   277  N ND2 . ASN A 1 48  ? 25.982  -10.415 24.471 1.00 80.06  ? 38  ASN A ND2 1 
ATOM   278  N N   . LEU A 1 49  ? 24.906  -7.293  25.025 1.00 52.75  ? 39  LEU A N   1 
ATOM   279  C CA  . LEU A 1 49  ? 25.896  -6.346  24.457 1.00 53.01  ? 39  LEU A CA  1 
ATOM   280  C C   . LEU A 1 49  ? 27.263  -6.491  25.132 1.00 57.95  ? 39  LEU A C   1 
ATOM   281  O O   . LEU A 1 49  ? 27.313  -6.593  26.421 1.00 49.52  ? 39  LEU A O   1 
ATOM   282  C CB  . LEU A 1 49  ? 25.424  -4.923  24.731 1.00 59.74  ? 39  LEU A CB  1 
ATOM   283  C CG  . LEU A 1 49  ? 24.192  -4.456  23.972 1.00 63.68  ? 39  LEU A CG  1 
ATOM   284  C CD1 . LEU A 1 49  ? 23.807  -3.088  24.497 1.00 62.35  ? 39  LEU A CD1 1 
ATOM   285  C CD2 . LEU A 1 49  ? 24.423  -4.412  22.468 1.00 62.61  ? 39  LEU A CD2 1 
ATOM   286  N N   . LYS A 1 50  ? 28.314  -6.286  24.326 1.00 46.37  ? 40  LYS A N   1 
ATOM   287  C CA  . LYS A 1 50  ? 29.753  -6.362  24.766 1.00 61.62  ? 40  LYS A CA  1 
ATOM   288  C C   . LYS A 1 50  ? 30.543  -5.122  24.323 1.00 45.00  ? 40  LYS A C   1 
ATOM   289  O O   . LYS A 1 50  ? 30.449  -4.768  23.130 1.00 62.37  ? 40  LYS A O   1 
ATOM   290  C CB  . LYS A 1 50  ? 30.454  -7.629  24.240 1.00 55.23  ? 40  LYS A CB  1 
ATOM   291  C CG  . LYS A 1 50  ? 29.840  -8.924  24.753 1.00 75.67  ? 40  LYS A CG  1 
ATOM   292  C CD  . LYS A 1 50  ? 30.320  -10.254 24.145 1.00 79.08  ? 40  LYS A CD  1 
ATOM   293  C CE  . LYS A 1 50  ? 29.167  -11.214 23.876 1.00 78.53  ? 40  LYS A CE  1 
ATOM   294  N NZ  . LYS A 1 50  ? 29.524  -12.637 24.101 1.00 88.15  ? 40  LYS A NZ  1 
ATOM   295  N N   . SER A 1 51  ? 31.291  -4.481  25.240 1.00 51.31  ? 41  SER A N   1 
ATOM   296  C CA  . SER A 1 51  ? 32.303  -3.410  24.927 1.00 64.33  ? 41  SER A CA  1 
ATOM   297  C C   . SER A 1 51  ? 33.260  -3.882  23.824 1.00 62.23  ? 41  SER A C   1 
ATOM   298  O O   . SER A 1 51  ? 33.663  -5.036  23.926 1.00 55.06  ? 41  SER A O   1 
ATOM   299  C CB  . SER A 1 51  ? 33.121  -3.007  26.124 1.00 68.58  ? 41  SER A CB  1 
ATOM   300  O OG  . SER A 1 51  ? 34.119  -2.067  25.740 1.00 67.53  ? 41  SER A OG  1 
ATOM   301  N N   . THR A 1 52  ? 33.562  -3.066  22.802 1.00 65.20  ? 42  THR A N   1 
ATOM   302  C CA  . THR A 1 52  ? 34.593  -3.377  21.760 1.00 59.96  ? 42  THR A CA  1 
ATOM   303  C C   . THR A 1 52  ? 35.820  -2.521  22.020 1.00 67.15  0 42  THR A C   1 
ATOM   304  O O   . THR A 1 52  ? 36.765  -2.650  21.259 1.00 72.74  ? 42  THR A O   1 
ATOM   305  C CB  . THR A 1 52  ? 34.134  -3.143  20.316 1.00 56.67  ? 42  THR A CB  1 
ATOM   306  O OG1 . THR A 1 52  ? 33.815  -1.761  20.137 1.00 64.10  ? 42  THR A OG1 1 
ATOM   307  C CG2 . THR A 1 52  ? 32.942  -3.996  19.952 1.00 59.91  ? 42  THR A CG2 1 
ATOM   308  N N   . LYS A 1 53  ? 35.789  -1.684  23.059 1.00 76.59  ? 43  LYS A N   1 
ATOM   309  C CA  . LYS A 1 53  ? 36.989  -1.006  23.608 1.00 74.75  ? 43  LYS A CA  1 
ATOM   310  C C   . LYS A 1 53  ? 37.084  -1.201  25.123 1.00 66.34  ? 43  LYS A C   1 
ATOM   311  O O   . LYS A 1 53  ? 37.275  -0.187  25.799 1.00 74.70  ? 43  LYS A O   1 
ATOM   312  C CB  . LYS A 1 53  ? 36.926  0.512   23.417 1.00 86.61  ? 43  LYS A CB  1 
ATOM   313  C CG  . LYS A 1 53  ? 36.548  1.047   22.043 1.00 92.42  ? 43  LYS A CG  1 
ATOM   314  C CD  . LYS A 1 53  ? 36.355  2.572   22.093 1.00 98.80  ? 43  LYS A CD  1 
ATOM   315  C CE  . LYS A 1 53  ? 35.340  3.137   21.113 1.00 102.83 ? 43  LYS A CE  1 
ATOM   316  N NZ  . LYS A 1 53  ? 35.981  3.973   20.069 1.00 105.10 ? 43  LYS A NZ  1 
ATOM   317  N N   . GLY A 1 54  ? 36.992  -2.429  25.638 1.00 69.63  ? 44  GLY A N   1 
ATOM   318  C CA  . GLY A 1 54  ? 37.339  -2.747  27.042 1.00 69.67  ? 44  GLY A CA  1 
ATOM   319  C C   . GLY A 1 54  ? 36.392  -2.111  28.051 1.00 67.25  ? 44  GLY A C   1 
ATOM   320  O O   . GLY A 1 54  ? 35.235  -1.908  27.717 1.00 63.14  ? 44  GLY A O   1 
ATOM   321  N N   . ASP A 1 55  ? 36.878  -1.798  29.248 1.00 59.85  ? 45  ASP A N   1 
ATOM   322  C CA  . ASP A 1 55  ? 36.031  -1.513  30.433 1.00 68.90  ? 45  ASP A CA  1 
ATOM   323  C C   . ASP A 1 55  ? 35.268  -0.203  30.253 1.00 63.09  ? 45  ASP A C   1 
ATOM   324  O O   . ASP A 1 55  ? 35.830  0.738   29.722 1.00 75.75  ? 45  ASP A O   1 
ATOM   325  C CB  . ASP A 1 55  ? 36.858  -1.381  31.712 1.00 67.23  ? 45  ASP A CB  1 
ATOM   326  C CG  . ASP A 1 55  ? 37.353  -2.696  32.276 1.00 68.44  ? 45  ASP A CG  1 
ATOM   327  O OD1 . ASP A 1 55  ? 37.142  -3.760  31.643 1.00 72.38  ? 45  ASP A OD1 1 
ATOM   328  O OD2 . ASP A 1 55  ? 37.915  -2.642  33.366 1.00 80.33  ? 45  ASP A OD2 1 
ATOM   329  N N   . LEU A 1 56  ? 34.033  -0.169  30.741 1.00 64.22  ? 46  LEU A N   1 
ATOM   330  C CA  . LEU A 1 56  ? 33.188  1.037   30.838 1.00 58.46  ? 46  LEU A CA  1 
ATOM   331  C C   . LEU A 1 56  ? 33.510  1.710   32.185 1.00 57.88  ? 46  LEU A C   1 
ATOM   332  O O   . LEU A 1 56  ? 33.753  0.962   33.189 1.00 57.01  ? 46  LEU A O   1 
ATOM   333  C CB  . LEU A 1 56  ? 31.699  0.652   30.684 1.00 69.64  ? 46  LEU A CB  1 
ATOM   334  C CG  . LEU A 1 56  ? 31.264  -0.105  29.410 1.00 75.64  ? 46  LEU A CG  1 
ATOM   335  C CD1 . LEU A 1 56  ? 29.999  -0.935  29.645 1.00 65.27  ? 46  LEU A CD1 1 
ATOM   336  C CD2 . LEU A 1 56  ? 31.055  0.846   28.216 1.00 79.27  ? 46  LEU A CD2 1 
ATOM   337  N N   . GLN A 1 57  ? 33.501  3.054   32.140 1.00 60.98  ? 47  GLN A N   1 
ATOM   338  C CA  . GLN A 1 57  ? 33.963  4.089   33.113 1.00 74.28  ? 47  GLN A CA  1 
ATOM   339  C C   . GLN A 1 57  ? 32.748  4.829   33.692 1.00 71.30  ? 47  GLN A C   1 
ATOM   340  O O   . GLN A 1 57  ? 32.898  5.974   34.118 1.00 69.22  ? 47  GLN A O   1 
ATOM   341  C CB  . GLN A 1 57  ? 34.790  5.185   32.406 1.00 84.26  ? 47  GLN A CB  1 
ATOM   342  C CG  . GLN A 1 57  ? 35.798  4.687   31.373 1.00 91.52  ? 47  GLN A CG  1 
ATOM   343  C CD  . GLN A 1 57  ? 36.645  3.567   31.928 1.00 110.06 ? 47  GLN A CD  1 
ATOM   344  O OE1 . GLN A 1 57  ? 36.392  2.391   31.667 1.00 127.31 ? 47  GLN A OE1 1 
ATOM   345  N NE2 . GLN A 1 57  ? 37.627  3.922   32.747 1.00 111.36 ? 47  GLN A NE2 1 
ATOM   346  N N   . PHE A 1 58  ? 31.573  4.219   33.587 1.00 65.25  ? 48  PHE A N   1 
ATOM   347  C CA  . PHE A 1 58  ? 30.251  4.772   33.962 1.00 58.74  ? 48  PHE A CA  1 
ATOM   348  C C   . PHE A 1 58  ? 29.325  3.581   34.221 1.00 53.34  ? 48  PHE A C   1 
ATOM   349  O O   . PHE A 1 58  ? 29.601  2.502   33.620 1.00 52.58  ? 48  PHE A O   1 
ATOM   350  C CB  . PHE A 1 58  ? 29.769  5.726   32.860 1.00 58.24  ? 48  PHE A CB  1 
ATOM   351  C CG  . PHE A 1 58  ? 29.692  5.149   31.463 1.00 61.55  ? 48  PHE A CG  1 
ATOM   352  C CD1 . PHE A 1 58  ? 28.592  4.387   31.069 1.00 60.08  ? 48  PHE A CD1 1 
ATOM   353  C CD2 . PHE A 1 58  ? 30.697  5.401   30.532 1.00 52.49  ? 48  PHE A CD2 1 
ATOM   354  C CE1 . PHE A 1 58  ? 28.502  3.891   29.781 1.00 53.07  ? 48  PHE A CE1 1 
ATOM   355  C CE2 . PHE A 1 58  ? 30.600  4.902   29.243 1.00 52.32  ? 48  PHE A CE2 1 
ATOM   356  C CZ  . PHE A 1 58  ? 29.505  4.163   28.871 1.00 51.46  ? 48  PHE A CZ  1 
ATOM   357  N N   . SER A 1 59  ? 28.323  3.736   35.100 1.00 63.18  ? 49  SER A N   1 
ATOM   358  C CA  . SER A 1 59  ? 27.229  2.746   35.331 1.00 57.63  ? 49  SER A CA  1 
ATOM   359  C C   . SER A 1 59  ? 26.704  2.235   33.983 1.00 52.61  ? 49  SER A C   1 
ATOM   360  O O   . SER A 1 59  ? 26.180  3.010   33.170 1.00 46.38  ? 49  SER A O   1 
ATOM   361  C CB  . SER A 1 59  ? 26.099  3.354   36.161 1.00 50.44  ? 49  SER A CB  1 
ATOM   362  O OG  . SER A 1 59  ? 25.058  2.390   36.272 1.00 56.15  ? 49  SER A OG  1 
ATOM   363  N N   . PRO A 1 60  ? 26.777  0.924   33.672 1.00 52.65  ? 50  PRO A N   1 
ATOM   364  C CA  . PRO A 1 60  ? 26.081  0.445   32.474 1.00 59.20  ? 50  PRO A CA  1 
ATOM   365  C C   . PRO A 1 60  ? 24.565  0.832   32.492 1.00 54.86  ? 50  PRO A C   1 
ATOM   366  O O   . PRO A 1 60  ? 23.939  0.921   31.441 1.00 52.34  ? 50  PRO A O   1 
ATOM   367  C CB  . PRO A 1 60  ? 26.449  -1.069  32.465 1.00 51.60  ? 50  PRO A CB  1 
ATOM   368  C CG  . PRO A 1 60  ? 27.706  -1.169  33.269 1.00 60.16  ? 50  PRO A CG  1 
ATOM   369  C CD  . PRO A 1 60  ? 27.562  -0.123  34.358 1.00 59.89  ? 50  PRO A CD  1 
ATOM   370  N N   . TRP A 1 61  ? 23.968  1.073   33.670 1.00 54.75  ? 51  TRP A N   1 
ATOM   371  C CA  . TRP A 1 61  ? 22.523  1.402   33.807 1.00 49.58  ? 51  TRP A CA  1 
ATOM   372  C C   . TRP A 1 61  ? 22.245  2.678   33.046 1.00 48.46  ? 51  TRP A C   1 
ATOM   373  O O   . TRP A 1 61  ? 21.051  2.896   32.663 1.00 43.60  ? 51  TRP A O   1 
ATOM   374  C CB  . TRP A 1 61  ? 22.057  1.535   35.255 1.00 47.55  ? 51  TRP A CB  1 
ATOM   375  C CG  . TRP A 1 61  ? 21.687  0.234   35.929 1.00 47.30  ? 51  TRP A CG  1 
ATOM   376  C CD1 . TRP A 1 61  ? 22.465  -0.453  36.800 1.00 45.09  ? 51  TRP A CD1 1 
ATOM   377  C CD2 . TRP A 1 61  ? 20.463  -0.522  35.827 1.00 41.76  ? 51  TRP A CD2 1 
ATOM   378  N NE1 . TRP A 1 61  ? 21.832  -1.592  37.209 1.00 56.54  ? 51  TRP A NE1 1 
ATOM   379  C CE2 . TRP A 1 61  ? 20.585  -1.647  36.664 1.00 48.11  ? 51  TRP A CE2 1 
ATOM   380  C CE3 . TRP A 1 61  ? 19.263  -0.348  35.141 1.00 46.93  ? 51  TRP A CE3 1 
ATOM   381  C CZ2 . TRP A 1 61  ? 19.584  -2.604  36.817 1.00 47.04  ? 51  TRP A CZ2 1 
ATOM   382  C CZ3 . TRP A 1 61  ? 18.275  -1.296  35.274 1.00 44.52  ? 51  TRP A CZ3 1 
ATOM   383  C CH2 . TRP A 1 61  ? 18.425  -2.389  36.120 1.00 42.67  ? 51  TRP A CH2 1 
ATOM   384  N N   . ILE A 1 62  ? 23.295  3.468   32.806 1.00 46.83  ? 52  ILE A N   1 
ATOM   385  C CA  . ILE A 1 62  ? 23.110  4.783   32.129 1.00 52.95  ? 52  ILE A CA  1 
ATOM   386  C C   . ILE A 1 62  ? 22.597  4.561   30.694 1.00 48.08  ? 52  ILE A C   1 
ATOM   387  O O   . ILE A 1 62  ? 21.885  5.484   30.175 1.00 51.11  ? 52  ILE A O   1 
ATOM   388  C CB  . ILE A 1 62  ? 24.381  5.668   32.222 1.00 53.79  ? 52  ILE A CB  1 
ATOM   389  C CG1 . ILE A 1 62  ? 24.010  7.138   32.154 1.00 50.45  ? 52  ILE A CG1 1 
ATOM   390  C CG2 . ILE A 1 62  ? 25.445  5.342   31.203 1.00 57.28  ? 52  ILE A CG2 1 
ATOM   391  C CD1 . ILE A 1 62  ? 22.968  7.529   33.168 1.00 48.38  ? 52  ILE A CD1 1 
ATOM   392  N N   . LEU A 1 63  ? 22.841  3.367   30.124 1.00 43.61  ? 53  LEU A N   1 
ATOM   393  C CA  . LEU A 1 63  ? 22.455  2.970   28.729 1.00 50.69  ? 53  LEU A CA  1 
ATOM   394  C C   . LEU A 1 63  ? 21.009  2.463   28.707 1.00 49.45  ? 53  LEU A C   1 
ATOM   395  O O   . LEU A 1 63  ? 20.427  2.254   27.623 1.00 43.07  ? 53  LEU A O   1 
ATOM   396  C CB  . LEU A 1 63  ? 23.459  1.907   28.258 1.00 50.79  ? 53  LEU A CB  1 
ATOM   397  C CG  . LEU A 1 63  ? 24.913  2.420   28.199 1.00 49.32  ? 53  LEU A CG  1 
ATOM   398  C CD1 . LEU A 1 63  ? 25.850  1.396   27.590 1.00 48.88  ? 53  LEU A CD1 1 
ATOM   399  C CD2 . LEU A 1 63  ? 25.026  3.717   27.403 1.00 44.00  ? 53  LEU A CD2 1 
ATOM   400  N N   . VAL A 1 64  ? 20.437  2.305   29.892 1.00 45.17  ? 54  VAL A N   1 
ATOM   401  C CA  . VAL A 1 64  ? 19.003  1.985   30.053 1.00 46.93  ? 54  VAL A CA  1 
ATOM   402  C C   . VAL A 1 64  ? 18.292  3.281   30.324 1.00 41.75  ? 54  VAL A C   1 
ATOM   403  O O   . VAL A 1 64  ? 18.812  4.096   31.071 1.00 47.88  ? 54  VAL A O   1 
ATOM   404  C CB  . VAL A 1 64  ? 18.785  0.954   31.168 1.00 58.73  ? 54  VAL A CB  1 
ATOM   405  C CG1 . VAL A 1 64  ? 17.316  0.624   31.346 1.00 51.45  ? 54  VAL A CG1 1 
ATOM   406  C CG2 . VAL A 1 64  ? 19.607  -0.290  30.895 1.00 57.80  ? 54  VAL A CG2 1 
ATOM   407  N N   . PRO A 1 65  ? 17.140  3.510   29.661 1.00 43.44  ? 55  PRO A N   1 
ATOM   408  C CA  . PRO A 1 65  ? 16.513  2.519   28.773 1.00 48.19  ? 55  PRO A CA  1 
ATOM   409  C C   . PRO A 1 65  ? 16.899  2.516   27.284 1.00 47.46  ? 55  PRO A C   1 
ATOM   410  O O   . PRO A 1 65  ? 16.249  1.847   26.465 1.00 43.55  ? 55  PRO A O   1 
ATOM   411  C CB  . PRO A 1 65  ? 15.064  2.994   28.856 1.00 46.22  ? 55  PRO A CB  1 
ATOM   412  C CG  . PRO A 1 65  ? 15.222  4.472   28.781 1.00 40.95  ? 55  PRO A CG  1 
ATOM   413  C CD  . PRO A 1 65  ? 16.328  4.721   29.788 1.00 41.46  ? 55  PRO A CD  1 
ATOM   414  N N   . HIS A 1 66  ? 17.925  3.282   26.944 1.00 46.22  ? 56  HIS A N   1 
ATOM   415  C CA  . HIS A 1 66  ? 18.249  3.587   25.524 1.00 48.34  ? 56  HIS A CA  1 
ATOM   416  C C   . HIS A 1 66  ? 18.471  2.299   24.735 1.00 39.25  ? 56  HIS A C   1 
ATOM   417  O O   . HIS A 1 66  ? 18.042  2.251   23.572 1.00 43.93  ? 56  HIS A O   1 
ATOM   418  C CB  . HIS A 1 66  ? 19.404  4.578   25.431 1.00 47.77  ? 56  HIS A CB  1 
ATOM   419  C CG  . HIS A 1 66  ? 19.167  5.692   26.376 1.00 45.35  ? 56  HIS A CG  1 
ATOM   420  N ND1 . HIS A 1 66  ? 18.095  6.516   26.233 1.00 39.50  ? 56  HIS A ND1 1 
ATOM   421  C CD2 . HIS A 1 66  ? 19.745  5.991   27.555 1.00 49.64  ? 56  HIS A CD2 1 
ATOM   422  C CE1 . HIS A 1 66  ? 18.081  7.356   27.241 1.00 55.17  ? 56  HIS A CE1 1 
ATOM   423  N NE2 . HIS A 1 66  ? 19.055  7.033   28.082 1.00 50.51  ? 56  HIS A NE2 1 
ATOM   424  N N   . ILE A 1 67  ? 18.981  1.242   25.354 1.00 41.82  ? 57  ILE A N   1 
ATOM   425  C CA  . ILE A 1 67  ? 19.172  -0.072  24.662 1.00 38.44  ? 57  ILE A CA  1 
ATOM   426  C C   . ILE A 1 67  ? 17.855  -0.828  24.440 1.00 43.06  ? 57  ILE A C   1 
ATOM   427  O O   . ILE A 1 67  ? 17.846  -1.590  23.391 1.00 37.84  ? 57  ILE A O   1 
ATOM   428  C CB  . ILE A 1 67  ? 20.224  -0.929  25.377 1.00 43.35  ? 57  ILE A CB  1 
ATOM   429  C CG1 . ILE A 1 67  ? 19.818  -1.327  26.792 1.00 42.96  ? 57  ILE A CG1 1 
ATOM   430  C CG2 . ILE A 1 67  ? 21.584  -0.216  25.328 1.00 50.14  ? 57  ILE A CG2 1 
ATOM   431  C CD1 . ILE A 1 67  ? 20.864  -2.141  27.520 1.00 40.77  ? 57  ILE A CD1 1 
HETATM 432  N N1  . CR2 A 1 68  ? 16.663  -0.368  24.603 1.00 36.71  ? 58  CR2 A N1  1 
HETATM 433  C CA1 . CR2 A 1 68  ? 15.442  -0.990  24.159 1.00 35.44  ? 58  CR2 A CA1 1 
HETATM 434  C C1  . CR2 A 1 68  ? 14.684  0.270   24.113 1.00 41.55  ? 58  CR2 A C1  1 
HETATM 435  N N2  . CR2 A 1 68  ? 13.887  0.683   25.116 1.00 43.67  ? 58  CR2 A N2  1 
HETATM 436  N N3  . CR2 A 1 68  ? 14.796  1.150   23.079 1.00 44.09  ? 58  CR2 A N3  1 
HETATM 437  C C2  . CR2 A 1 68  ? 14.011  2.118   23.421 1.00 49.48  ? 58  CR2 A C2  1 
HETATM 438  O O2  . CR2 A 1 68  ? 13.799  3.200   22.794 1.00 53.92  ? 58  CR2 A O2  1 
HETATM 439  C CA2 . CR2 A 1 68  ? 13.448  1.876   24.712 1.00 48.09  ? 58  CR2 A CA2 1 
HETATM 440  C CA3 . CR2 A 1 68  ? 15.576  1.016   21.838 1.00 43.93  ? 58  CR2 A CA3 1 
HETATM 441  C C3  . CR2 A 1 68  ? 14.738  0.680   20.636 1.00 52.49  ? 58  CR2 A C3  1 
HETATM 442  O O3  . CR2 A 1 68  ? 15.403  0.890   19.594 1.00 50.38  ? 58  CR2 A O3  1 
HETATM 443  C CB2 . CR2 A 1 68  ? 12.526  2.814   25.331 1.00 46.67  ? 58  CR2 A CB2 1 
HETATM 444  C CG2 . CR2 A 1 68  ? 11.924  2.796   26.662 1.00 45.62  ? 58  CR2 A CG2 1 
HETATM 445  C CD1 . CR2 A 1 68  ? 12.025  1.727   27.539 1.00 45.78  ? 58  CR2 A CD1 1 
HETATM 446  C CD2 . CR2 A 1 68  ? 11.365  4.005   27.148 1.00 49.71  ? 58  CR2 A CD2 1 
HETATM 447  C CE1 . CR2 A 1 68  ? 11.522  1.785   28.830 1.00 49.25  ? 58  CR2 A CE1 1 
HETATM 448  C CE2 . CR2 A 1 68  ? 10.808  4.063   28.486 1.00 55.80  ? 58  CR2 A CE2 1 
HETATM 449  C CZ  . CR2 A 1 68  ? 10.910  2.941   29.326 1.00 53.96  ? 58  CR2 A CZ  1 
HETATM 450  O OH  . CR2 A 1 68  ? 10.432  2.907   30.579 1.00 53.04  ? 58  CR2 A OH  1 
ATOM   451  N N   . PHE A 1 69  ? 13.933  -0.350  20.766 1.00 49.93  ? 61  PHE A N   1 
ATOM   452  C CA  . PHE A 1 69  ? 13.373  -1.153  19.624 1.00 42.50  ? 61  PHE A CA  1 
ATOM   453  C C   . PHE A 1 69  ? 11.857  -1.297  19.808 1.00 41.09  ? 61  PHE A C   1 
ATOM   454  O O   . PHE A 1 69  ? 11.333  -2.401  20.129 1.00 37.80  ? 61  PHE A O   1 
ATOM   455  C CB  . PHE A 1 69  ? 14.063  -2.518  19.520 1.00 43.59  ? 61  PHE A CB  1 
ATOM   456  C CG  . PHE A 1 69  ? 15.533  -2.486  19.145 1.00 38.40  ? 61  PHE A CG  1 
ATOM   457  C CD1 . PHE A 1 69  ? 16.518  -2.275  20.087 1.00 42.74  ? 61  PHE A CD1 1 
ATOM   458  C CD2 . PHE A 1 69  ? 15.917  -2.658  17.832 1.00 38.76  ? 61  PHE A CD2 1 
ATOM   459  C CE1 . PHE A 1 69  ? 17.859  -2.226  19.724 1.00 49.03  ? 61  PHE A CE1 1 
ATOM   460  C CE2 . PHE A 1 69  ? 17.251  -2.614  17.468 1.00 44.12  ? 61  PHE A CE2 1 
ATOM   461  C CZ  . PHE A 1 69  ? 18.227  -2.398  18.409 1.00 46.93  ? 61  PHE A CZ  1 
ATOM   462  N N   . HIS A 1 70  ? 11.163  -0.197  19.573 1.00 36.42  ? 62  HIS A N   1 
ATOM   463  C CA  . HIS A 1 70  ? 9.692   -0.076  19.657 1.00 39.01  ? 62  HIS A CA  1 
ATOM   464  C C   . HIS A 1 70  ? 9.065   -0.852  18.512 1.00 40.62  ? 62  HIS A C   1 
ATOM   465  O O   . HIS A 1 70  ? 7.805   -0.993  18.506 1.00 40.17  ? 62  HIS A O   1 
ATOM   466  C CB  . HIS A 1 70  ? 9.334   1.415   19.762 1.00 38.37  ? 62  HIS A CB  1 
ATOM   467  C CG  . HIS A 1 70  ? 9.670   1.908   21.127 1.00 42.71  ? 62  HIS A CG  1 
ATOM   468  N ND1 . HIS A 1 70  ? 10.128  1.032   22.114 1.00 47.15  ? 62  HIS A ND1 1 
ATOM   469  C CD2 . HIS A 1 70  ? 9.580   3.132   21.701 1.00 42.88  ? 62  HIS A CD2 1 
ATOM   470  C CE1 . HIS A 1 70  ? 10.310  1.693   23.243 1.00 49.32  ? 62  HIS A CE1 1 
ATOM   471  N NE2 . HIS A 1 70  ? 9.977   3.008   23.018 1.00 49.22  ? 62  HIS A NE2 1 
ATOM   472  N N   . GLN A 1 71  ? 9.845   -1.306  17.530 1.00 37.71  ? 63  GLN A N   1 
ATOM   473  C CA  . GLN A 1 71  ? 9.259   -2.247  16.523 1.00 38.65  ? 63  GLN A CA  1 
ATOM   474  C C   . GLN A 1 71  ? 8.747   -3.542  17.240 1.00 39.74  ? 63  GLN A C   1 
ATOM   475  O O   . GLN A 1 71  ? 7.906   -4.264  16.691 1.00 38.62  ? 63  GLN A O   1 
ATOM   476  C CB  . GLN A 1 71  ? 10.241  -2.561  15.390 1.00 47.10  ? 63  GLN A CB  1 
ATOM   477  C CG  . GLN A 1 71  ? 10.912  -1.351  14.749 1.00 42.71  ? 63  GLN A CG  1 
ATOM   478  C CD  . GLN A 1 71  ? 12.174  -0.957  15.466 1.00 38.61  ? 63  GLN A CD  1 
ATOM   479  O OE1 . GLN A 1 71  ? 12.307  -1.010  16.704 1.00 36.46  ? 63  GLN A OE1 1 
ATOM   480  N NE2 . GLN A 1 71  ? 13.112  -0.522  14.667 1.00 43.23  ? 63  GLN A NE2 1 
ATOM   481  N N   . TYR A 1 72  ? 9.148   -3.809  18.489 1.00 40.23  ? 64  TYR A N   1 
ATOM   482  C CA  . TYR A 1 72  ? 8.692   -5.001  19.241 1.00 40.15  ? 64  TYR A CA  1 
ATOM   483  C C   . TYR A 1 72  ? 7.431   -4.701  20.048 1.00 45.09  ? 64  TYR A C   1 
ATOM   484  O O   . TYR A 1 72  ? 6.926   -5.701  20.616 1.00 43.68  ? 64  TYR A O   1 
ATOM   485  C CB  . TYR A 1 72  ? 9.764   -5.536  20.176 1.00 40.59  ? 64  TYR A CB  1 
ATOM   486  C CG  . TYR A 1 72  ? 10.842  -6.385  19.540 1.00 42.87  ? 64  TYR A CG  1 
ATOM   487  C CD1 . TYR A 1 72  ? 10.588  -7.669  19.083 1.00 45.02  ? 64  TYR A CD1 1 
ATOM   488  C CD2 . TYR A 1 72  ? 12.157  -5.930  19.500 1.00 46.71  ? 64  TYR A CD2 1 
ATOM   489  C CE1 . TYR A 1 72  ? 11.610  -8.445  18.550 1.00 51.43  ? 64  TYR A CE1 1 
ATOM   490  C CE2 . TYR A 1 72  ? 13.180  -6.684  18.964 1.00 47.93  ? 64  TYR A CE2 1 
ATOM   491  C CZ  . TYR A 1 72  ? 12.903  -7.953  18.503 1.00 46.05  ? 64  TYR A CZ  1 
ATOM   492  O OH  . TYR A 1 72  ? 13.940  -8.651  17.996 1.00 42.66  ? 64  TYR A OH  1 
ATOM   493  N N   . LEU A 1 73  ? 6.933   -3.450  20.031 1.00 44.74  ? 65  LEU A N   1 
ATOM   494  C CA  . LEU A 1 73  ? 5.764   -2.959  20.806 1.00 45.02  ? 65  LEU A CA  1 
ATOM   495  C C   . LEU A 1 73  ? 4.460   -3.056  20.001 1.00 55.12  ? 65  LEU A C   1 
ATOM   496  O O   . LEU A 1 73  ? 4.238   -2.264  19.094 1.00 48.54  ? 65  LEU A O   1 
ATOM   497  C CB  . LEU A 1 73  ? 5.979   -1.505  21.238 1.00 49.07  ? 65  LEU A CB  1 
ATOM   498  C CG  . LEU A 1 73  ? 4.755   -0.845  21.877 1.00 48.26  ? 65  LEU A CG  1 
ATOM   499  C CD1 . LEU A 1 73  ? 4.404   -1.526  23.193 1.00 49.00  ? 65  LEU A CD1 1 
ATOM   500  C CD2 . LEU A 1 73  ? 4.968   0.635   22.102 1.00 54.30  ? 65  LEU A CD2 1 
ATOM   501  N N   . PRO A 1 74  ? 3.497   -3.953  20.347 1.00 53.46  ? 66  PRO A N   1 
ATOM   502  C CA  . PRO A 1 74  ? 2.176   -3.932  19.712 1.00 50.55  ? 66  PRO A CA  1 
ATOM   503  C C   . PRO A 1 74  ? 1.246   -2.886  20.370 1.00 45.12  ? 66  PRO A C   1 
ATOM   504  O O   . PRO A 1 74  ? 1.551   -2.401  21.413 1.00 48.20  ? 66  PRO A O   1 
ATOM   505  C CB  . PRO A 1 74  ? 1.738   -5.403  19.893 1.00 55.52  ? 66  PRO A CB  1 
ATOM   506  C CG  . PRO A 1 74  ? 2.344   -5.837  21.257 1.00 57.92  ? 66  PRO A CG  1 
ATOM   507  C CD  . PRO A 1 74  ? 3.626   -5.022  21.368 1.00 60.96  ? 66  PRO A CD  1 
ATOM   508  N N   . TYR A 1 75  ? 0.145   -2.537  19.714 1.00 48.44  ? 67  TYR A N   1 
ATOM   509  C CA  . TYR A 1 75  ? -0.909  -1.621  20.207 1.00 49.80  ? 67  TYR A CA  1 
ATOM   510  C C   . TYR A 1 75  ? -2.147  -2.402  20.609 1.00 44.47  ? 67  TYR A C   1 
ATOM   511  O O   . TYR A 1 75  ? -2.357  -3.513  20.184 1.00 47.31  ? 67  TYR A O   1 
ATOM   512  C CB  . TYR A 1 75  ? -1.225  -0.616  19.101 1.00 48.23  ? 67  TYR A CB  1 
ATOM   513  C CG  . TYR A 1 75  ? -0.525  0.706   19.304 1.00 50.14  ? 67  TYR A CG  1 
ATOM   514  C CD1 . TYR A 1 75  ? 0.660   0.788   20.031 1.00 41.42  ? 67  TYR A CD1 1 
ATOM   515  C CD2 . TYR A 1 75  ? -1.027  1.881   18.735 1.00 51.46  ? 67  TYR A CD2 1 
ATOM   516  C CE1 . TYR A 1 75  ? 1.298   2.011   20.217 1.00 45.54  ? 67  TYR A CE1 1 
ATOM   517  C CE2 . TYR A 1 75  ? -0.387  3.108   18.894 1.00 52.27  ? 67  TYR A CE2 1 
ATOM   518  C CZ  . TYR A 1 75  ? 0.786   3.170   19.634 1.00 55.93  ? 67  TYR A CZ  1 
ATOM   519  O OH  . TYR A 1 75  ? 1.436   4.365   19.778 1.00 48.52  ? 67  TYR A OH  1 
ATOM   520  N N   . PRO A 1 76  ? -3.067  -1.849  21.397 1.00 47.16  ? 68  PRO A N   1 
ATOM   521  C CA  . PRO A 1 76  ? -4.273  -2.602  21.740 1.00 51.21  ? 68  PRO A CA  1 
ATOM   522  C C   . PRO A 1 76  ? -4.968  -3.313  20.547 1.00 47.49  ? 68  PRO A C   1 
ATOM   523  O O   . PRO A 1 76  ? -5.412  -4.454  20.722 1.00 57.65  ? 68  PRO A O   1 
ATOM   524  C CB  . PRO A 1 76  ? -5.175  -1.547  22.411 1.00 47.38  ? 68  PRO A CB  1 
ATOM   525  C CG  . PRO A 1 76  ? -4.219  -0.451  22.890 1.00 50.88  ? 68  PRO A CG  1 
ATOM   526  C CD  . PRO A 1 76  ? -3.023  -0.497  21.948 1.00 51.78  ? 68  PRO A CD  1 
ATOM   527  N N   . ASP A 1 77  ? -5.035  -2.707  19.356 1.00 58.43  ? 69  ASP A N   1 
ATOM   528  C CA  . ASP A 1 77  ? -5.922  -3.174  18.250 1.00 65.04  ? 69  ASP A CA  1 
ATOM   529  C C   . ASP A 1 77  ? -5.143  -3.456  16.985 1.00 67.42  ? 69  ASP A C   1 
ATOM   530  O O   . ASP A 1 77  ? -5.796  -3.525  15.943 1.00 68.88  ? 69  ASP A O   1 
ATOM   531  C CB  . ASP A 1 77  ? -6.952  -2.138  17.838 1.00 69.70  ? 69  ASP A CB  1 
ATOM   532  C CG  . ASP A 1 77  ? -7.846  -1.819  19.003 1.00 79.02  ? 69  ASP A CG  1 
ATOM   533  O OD1 . ASP A 1 77  ? -8.025  -2.710  19.873 1.00 98.85  ? 69  ASP A OD1 1 
ATOM   534  O OD2 . ASP A 1 77  ? -8.326  -0.695  19.040 1.00 76.99  ? 69  ASP A OD2 1 
ATOM   535  N N   . GLY A 1 78  ? -3.828  -3.607  17.115 1.00 56.39  ? 70  GLY A N   1 
ATOM   536  C CA  . GLY A 1 78  ? -2.932  -4.145  16.085 1.00 48.75  ? 70  GLY A CA  1 
ATOM   537  C C   . GLY A 1 78  ? -1.579  -3.500  16.214 1.00 55.37  ? 70  GLY A C   1 
ATOM   538  O O   . GLY A 1 78  ? -1.203  -3.051  17.345 1.00 57.54  ? 70  GLY A O   1 
ATOM   539  N N   . MET A 1 79  ? -0.902  -3.398  15.078 1.00 50.17  ? 71  MET A N   1 
ATOM   540  C CA  . MET A 1 79  ? 0.469   -2.889  14.977 1.00 52.29  ? 71  MET A CA  1 
ATOM   541  C C   . MET A 1 79  ? 0.524   -1.513  15.573 1.00 48.15  ? 71  MET A C   1 
ATOM   542  O O   . MET A 1 79  ? -0.463  -0.803  15.583 1.00 53.14  ? 71  MET A O   1 
ATOM   543  C CB  . MET A 1 79  ? 0.939   -2.821  13.538 1.00 52.81  ? 71  MET A CB  1 
ATOM   544  C CG  . MET A 1 79  ? 1.171   -4.205  13.030 1.00 53.96  ? 71  MET A CG  1 
ATOM   545  S SD  . MET A 1 79  ? 1.956   -4.086  11.442 1.00 62.21  ? 71  MET A SD  1 
ATOM   546  C CE  . MET A 1 79  ? 0.535   -3.724  10.391 1.00 59.12  ? 71  MET A CE  1 
ATOM   547  N N   . SER A 1 80  ? 1.640   -1.271  16.201 1.00 45.53  ? 72  SER A N   1 
ATOM   548  C CA  . SER A 1 80  ? 2.006   0.088   16.606 1.00 49.05  ? 72  SER A CA  1 
ATOM   549  C C   . SER A 1 80  ? 2.523   0.741   15.340 1.00 48.16  ? 72  SER A C   1 
ATOM   550  O O   . SER A 1 80  ? 2.821   0.091   14.346 1.00 47.65  ? 72  SER A O   1 
ATOM   551  C CB  . SER A 1 80  ? 3.014   0.082   17.714 1.00 46.09  ? 72  SER A CB  1 
ATOM   552  O OG  . SER A 1 80  ? 4.223   -0.480  17.232 1.00 41.50  ? 72  SER A OG  1 
ATOM   553  N N   . PRO A 1 81  ? 2.581   2.073   15.350 1.00 49.44  ? 73  PRO A N   1 
ATOM   554  C CA  . PRO A 1 81  ? 2.985   2.805   14.170 1.00 46.72  ? 73  PRO A CA  1 
ATOM   555  C C   . PRO A 1 81  ? 4.403   2.369   13.800 1.00 44.28  ? 73  PRO A C   1 
ATOM   556  O O   . PRO A 1 81  ? 4.700   2.300   12.623 1.00 45.48  ? 73  PRO A O   1 
ATOM   557  C CB  . PRO A 1 81  ? 2.975   4.262   14.624 1.00 55.65  ? 73  PRO A CB  1 
ATOM   558  C CG  . PRO A 1 81  ? 2.191   4.291   15.941 1.00 57.47  ? 73  PRO A CG  1 
ATOM   559  C CD  . PRO A 1 81  ? 2.255   2.907   16.518 1.00 52.62  ? 73  PRO A CD  1 
ATOM   560  N N   . PHE A 1 82  ? 5.219   2.081   14.822 1.00 47.60  ? 74  PHE A N   1 
ATOM   561  C CA  . PHE A 1 82  ? 6.632   1.633   14.685 1.00 49.34  ? 74  PHE A CA  1 
ATOM   562  C C   . PHE A 1 82  ? 6.696   0.276   13.960 1.00 50.68  ? 74  PHE A C   1 
ATOM   563  O O   . PHE A 1 82  ? 7.612   0.035   13.159 1.00 48.28  ? 74  PHE A O   1 
ATOM   564  C CB  . PHE A 1 82  ? 7.297   1.524   16.057 1.00 49.09  ? 74  PHE A CB  1 
ATOM   565  C CG  . PHE A 1 82  ? 6.920   2.599   17.041 1.00 51.26  ? 74  PHE A CG  1 
ATOM   566  C CD1 . PHE A 1 82  ? 7.496   3.861   16.972 1.00 49.40  ? 74  PHE A CD1 1 
ATOM   567  C CD2 . PHE A 1 82  ? 6.024   2.343   18.070 1.00 41.68  ? 74  PHE A CD2 1 
ATOM   568  C CE1 . PHE A 1 82  ? 7.185   4.837   17.910 1.00 45.38  ? 74  PHE A CE1 1 
ATOM   569  C CE2 . PHE A 1 82  ? 5.709   3.328   18.997 1.00 42.10  ? 74  PHE A CE2 1 
ATOM   570  C CZ  . PHE A 1 82  ? 6.281   4.575   18.914 1.00 42.21  ? 74  PHE A CZ  1 
ATOM   571  N N   . GLN A 1 83  ? 5.768   -0.622  14.256 1.00 47.84  ? 75  GLN A N   1 
ATOM   572  C CA  . GLN A 1 83  ? 5.754   -1.968  13.629 1.00 51.43  ? 75  GLN A CA  1 
ATOM   573  C C   . GLN A 1 83  ? 5.362   -1.813  12.164 1.00 51.10  ? 75  GLN A C   1 
ATOM   574  O O   . GLN A 1 83  ? 6.000   -2.460  11.309 1.00 54.64  ? 75  GLN A O   1 
ATOM   575  C CB  . GLN A 1 83  ? 4.760   -2.874  14.342 1.00 41.53  ? 75  GLN A CB  1 
ATOM   576  C CG  . GLN A 1 83  ? 5.265   -3.254  15.724 1.00 46.20  ? 75  GLN A CG  1 
ATOM   577  C CD  . GLN A 1 83  ? 4.309   -4.182  16.437 1.00 46.08  ? 75  GLN A CD  1 
ATOM   578  O OE1 . GLN A 1 83  ? 3.081   -4.053  16.353 1.00 55.08  ? 75  GLN A OE1 1 
ATOM   579  N NE2 . GLN A 1 83  ? 4.891   -5.136  17.137 1.00 51.18  ? 75  GLN A NE2 1 
ATOM   580  N N   . ALA A 1 84  ? 4.327   -1.002  11.944 1.00 48.11  ? 76  ALA A N   1 
ATOM   581  C CA  . ALA A 1 84  ? 3.742   -0.640  10.634 1.00 53.73  ? 76  ALA A CA  1 
ATOM   582  C C   . ALA A 1 84  ? 4.823   -0.048  9.726  1.00 49.90  ? 76  ALA A C   1 
ATOM   583  O O   . ALA A 1 84  ? 4.865   -0.468  8.572  1.00 50.55  ? 76  ALA A O   1 
ATOM   584  C CB  . ALA A 1 84  ? 2.596   0.329   10.831 1.00 46.68  ? 76  ALA A CB  1 
ATOM   585  N N   . ALA A 1 85  ? 5.666   0.853   10.255 1.00 45.48  ? 77  ALA A N   1 
ATOM   586  C CA  . ALA A 1 85  ? 6.689   1.600   9.489  1.00 48.53  ? 77  ALA A CA  1 
ATOM   587  C C   . ALA A 1 85  ? 7.877   0.677   9.156  1.00 50.61  ? 77  ALA A C   1 
ATOM   588  O O   . ALA A 1 85  ? 8.515   0.880   8.092  1.00 57.76  ? 77  ALA A O   1 
ATOM   589  C CB  . ALA A 1 85  ? 7.075   2.856   10.212 1.00 44.04  ? 77  ALA A CB  1 
ATOM   590  N N   . MET A 1 86  ? 8.119   -0.352  9.968  1.00 45.81  ? 78  MET A N   1 
ATOM   591  C CA  . MET A 1 86  ? 9.008   -1.493  9.621  1.00 50.85  ? 78  MET A CA  1 
ATOM   592  C C   . MET A 1 86  ? 8.358   -2.423  8.578  1.00 53.85  ? 78  MET A C   1 
ATOM   593  O O   . MET A 1 86  ? 9.063   -2.773  7.586  1.00 55.48  ? 78  MET A O   1 
ATOM   594  C CB  . MET A 1 86  ? 9.388   -2.317  10.846 1.00 49.65  ? 78  MET A CB  1 
ATOM   595  C CG  . MET A 1 86  ? 9.892   -3.682  10.489 1.00 50.00  ? 78  MET A CG  1 
ATOM   596  S SD  . MET A 1 86  ? 10.626  -4.394  11.958 1.00 57.64  ? 78  MET A SD  1 
ATOM   597  C CE  . MET A 1 86  ? 11.632  -5.717  11.277 1.00 60.23  ? 78  MET A CE  1 
ATOM   598  N N   . VAL A 1 87  ? 7.096   -2.833  8.760  1.00 52.47  ? 79  VAL A N   1 
ATOM   599  C CA  . VAL A 1 87  ? 6.462   -3.854  7.861  1.00 54.50  ? 79  VAL A CA  1 
ATOM   600  C C   . VAL A 1 87  ? 6.411   -3.314  6.421  1.00 56.90  ? 79  VAL A C   1 
ATOM   601  O O   . VAL A 1 87  ? 6.676   -4.100  5.490  1.00 45.95  ? 79  VAL A O   1 
ATOM   602  C CB  . VAL A 1 87  ? 5.048   -4.288  8.304  1.00 55.48  ? 79  VAL A CB  1 
ATOM   603  C CG1 . VAL A 1 87  ? 4.329   -5.155  7.248  1.00 53.71  ? 79  VAL A CG1 1 
ATOM   604  C CG2 . VAL A 1 87  ? 5.128   -5.032  9.614  1.00 63.71  ? 79  VAL A CG2 1 
ATOM   605  N N   . ASP A 1 88  ? 6.055   -2.044  6.222  1.00 45.89  ? 80  ASP A N   1 
ATOM   606  C CA  . ASP A 1 88  ? 5.909   -1.482  4.848  1.00 54.76  ? 80  ASP A CA  1 
ATOM   607  C C   . ASP A 1 88  ? 7.285   -0.980  4.345  1.00 51.17  ? 80  ASP A C   1 
ATOM   608  O O   . ASP A 1 88  ? 7.388   -0.661  3.145  1.00 57.61  ? 80  ASP A O   1 
ATOM   609  C CB  . ASP A 1 88  ? 4.764   -0.452  4.813  1.00 54.55  ? 80  ASP A CB  1 
ATOM   610  C CG  . ASP A 1 88  ? 5.178   0.908   5.356  1.00 63.58  ? 80  ASP A CG  1 
ATOM   611  O OD1 . ASP A 1 88  ? 6.390   1.023   5.867  1.00 62.08  ? 80  ASP A OD1 1 
ATOM   612  O OD2 . ASP A 1 88  ? 4.321   1.841   5.238  1.00 68.95  ? 80  ASP A OD2 1 
ATOM   613  N N   . GLY A 1 89  ? 8.305   -0.916  5.213  1.00 58.12  ? 81  GLY A N   1 
ATOM   614  C CA  . GLY A 1 89  ? 9.695   -0.583  4.836  1.00 57.55  ? 81  GLY A CA  1 
ATOM   615  C C   . GLY A 1 89  ? 9.952   0.921   4.801  1.00 63.13  ? 81  GLY A C   1 
ATOM   616  O O   . GLY A 1 89  ? 11.110  1.309   4.645  1.00 60.46  ? 81  GLY A O   1 
ATOM   617  N N   . SER A 1 90  ? 8.933   1.759   4.961  1.00 54.40  ? 82  SER A N   1 
ATOM   618  C CA  . SER A 1 90  ? 9.081   3.233   5.051  1.00 53.47  ? 82  SER A CA  1 
ATOM   619  C C   . SER A 1 90  ? 9.978   3.645   6.235  1.00 52.07  ? 82  SER A C   1 
ATOM   620  O O   . SER A 1 90  ? 10.833  4.505   6.035  1.00 61.45  ? 82  SER A O   1 
ATOM   621  C CB  . SER A 1 90  ? 7.729   3.844   5.195  1.00 53.35  ? 82  SER A CB  1 
ATOM   622  O OG  . SER A 1 90  ? 7.138   3.381   6.408  1.00 52.66  ? 82  SER A OG  1 
ATOM   623  N N   . GLY A 1 91  ? 9.693   3.165   7.455  1.00 53.55  ? 83  GLY A N   1 
ATOM   624  C CA  . GLY A 1 91  ? 10.516  3.368   8.671  1.00 43.24  ? 83  GLY A CA  1 
ATOM   625  C C   . GLY A 1 91  ? 10.452  4.761   9.332  1.00 42.88  ? 83  GLY A C   1 
ATOM   626  O O   . GLY A 1 91  ? 9.712   5.679   8.931  1.00 43.86  ? 83  GLY A O   1 
ATOM   627  N N   . TYR A 1 92  ? 11.352  4.948   10.279 1.00 41.20  ? 84  TYR A N   1 
ATOM   628  C CA  . TYR A 1 92  ? 11.369  6.102   11.163 1.00 40.84  ? 84  TYR A CA  1 
ATOM   629  C C   . TYR A 1 92  ? 12.726  6.092   11.811 1.00 51.91  ? 84  TYR A C   1 
ATOM   630  O O   . TYR A 1 92  ? 13.277  4.989   11.935 1.00 45.68  ? 84  TYR A O   1 
ATOM   631  C CB  . TYR A 1 92  ? 10.273  6.006   12.218 1.00 44.49  ? 84  TYR A CB  1 
ATOM   632  C CG  . TYR A 1 92  ? 10.429  4.879   13.197 1.00 38.24  ? 84  TYR A CG  1 
ATOM   633  C CD1 . TYR A 1 92  ? 10.007  3.594   12.879 1.00 51.45  ? 84  TYR A CD1 1 
ATOM   634  C CD2 . TYR A 1 92  ? 10.936  5.091   14.462 1.00 43.29  ? 84  TYR A CD2 1 
ATOM   635  C CE1 . TYR A 1 92  ? 10.112  2.549   13.792 1.00 42.63  ? 84  TYR A CE1 1 
ATOM   636  C CE2 . TYR A 1 92  ? 11.041  4.068   15.397 1.00 44.76  ? 84  TYR A CE2 1 
ATOM   637  C CZ  . TYR A 1 92  ? 10.626  2.782   15.064 1.00 41.50  ? 84  TYR A CZ  1 
ATOM   638  O OH  . TYR A 1 92  ? 10.821  1.755   15.955 1.00 36.78  ? 84  TYR A OH  1 
ATOM   639  N N   . GLN A 1 93  ? 13.115  7.306   12.206 1.00 45.33  ? 85  GLN A N   1 
ATOM   640  C CA  . GLN A 1 93  ? 14.302  7.766   12.931 1.00 50.99  ? 85  GLN A CA  1 
ATOM   641  C C   . GLN A 1 93  ? 13.850  8.165   14.327 1.00 41.44  ? 85  GLN A C   1 
ATOM   642  O O   . GLN A 1 93  ? 12.673  8.556   14.487 1.00 42.08  ? 85  GLN A O   1 
ATOM   643  C CB  . GLN A 1 93  ? 14.857  9.010   12.197 1.00 54.83  ? 85  GLN A CB  1 
ATOM   644  C CG  . GLN A 1 93  ? 15.376  8.647   10.814 1.00 55.56  ? 85  GLN A CG  1 
ATOM   645  C CD  . GLN A 1 93  ? 16.104  9.680   9.981  1.00 57.17  ? 85  GLN A CD  1 
ATOM   646  O OE1 . GLN A 1 93  ? 16.305  10.835  10.350 1.00 57.51  ? 85  GLN A OE1 1 
ATOM   647  N NE2 . GLN A 1 93  ? 16.583  9.213   8.842  1.00 57.39  ? 85  GLN A NE2 1 
ATOM   648  N N   . VAL A 1 94  ? 14.780  8.179   15.264 1.00 43.89  ? 86  VAL A N   1 
ATOM   649  C CA  . VAL A 1 94  ? 14.494  8.571   16.665 1.00 42.93  ? 86  VAL A CA  1 
ATOM   650  C C   . VAL A 1 94  ? 15.599  9.516   17.162 1.00 43.60  ? 86  VAL A C   1 
ATOM   651  O O   . VAL A 1 94  ? 16.770  9.201   16.956 1.00 39.14  ? 86  VAL A O   1 
ATOM   652  C CB  . VAL A 1 94  ? 14.406  7.348   17.588 1.00 47.43  ? 86  VAL A CB  1 
ATOM   653  C CG1 . VAL A 1 94  ? 13.820  7.735   18.940 1.00 49.15  ? 86  VAL A CG1 1 
ATOM   654  C CG2 . VAL A 1 94  ? 13.642  6.200   16.963 1.00 49.85  ? 86  VAL A CG2 1 
ATOM   655  N N   . HIS A 1 95  ? 15.172  10.569  17.868 1.00 43.30  ? 87  HIS A N   1 
ATOM   656  C CA  . HIS A 1 95  ? 15.961  11.388  18.806 1.00 45.86  ? 87  HIS A CA  1 
ATOM   657  C C   . HIS A 1 95  ? 15.342  11.365  20.209 1.00 39.84  ? 87  HIS A C   1 
ATOM   658  O O   . HIS A 1 95  ? 14.132  11.523  20.368 1.00 39.90  ? 87  HIS A O   1 
ATOM   659  C CB  . HIS A 1 95  ? 16.040  12.829  18.277 1.00 47.80  ? 87  HIS A CB  1 
ATOM   660  C CG  . HIS A 1 95  ? 16.768  13.678  19.250 1.00 46.15  ? 87  HIS A CG  1 
ATOM   661  N ND1 . HIS A 1 95  ? 18.148  13.665  19.346 1.00 47.90  ? 87  HIS A ND1 1 
ATOM   662  C CD2 . HIS A 1 95  ? 16.308  14.485  20.225 1.00 44.86  ? 87  HIS A CD2 1 
ATOM   663  C CE1 . HIS A 1 95  ? 18.518  14.487  20.314 1.00 49.38  ? 87  HIS A CE1 1 
ATOM   664  N NE2 . HIS A 1 95  ? 17.389  14.993  20.893 1.00 41.59  ? 87  HIS A NE2 1 
ATOM   665  N N   . ARG A 1 96  ? 16.178  11.254  21.209 1.00 46.31  ? 88  ARG A N   1 
ATOM   666  C CA  . ARG A 1 96  ? 15.761  11.346  22.631 1.00 47.62  ? 88  ARG A CA  1 
ATOM   667  C C   . ARG A 1 96  ? 16.697  12.296  23.404 1.00 43.83  ? 88  ARG A C   1 
ATOM   668  O O   . ARG A 1 96  ? 17.918  12.217  23.237 1.00 41.38  ? 88  ARG A O   1 
ATOM   669  C CB  . ARG A 1 96  ? 15.748  9.961   23.300 1.00 41.49  ? 88  ARG A CB  1 
ATOM   670  C CG  . ARG A 1 96  ? 15.258  9.978   24.752 1.00 44.06  ? 88  ARG A CG  1 
ATOM   671  C CD  . ARG A 1 96  ? 15.263  8.663   25.507 1.00 48.21  ? 88  ARG A CD  1 
ATOM   672  N NE  . ARG A 1 96  ? 14.378  7.731   24.819 1.00 52.70  ? 88  ARG A NE  1 
ATOM   673  C CZ  . ARG A 1 96  ? 14.744  6.614   24.161 1.00 41.96  ? 88  ARG A CZ  1 
ATOM   674  N NH1 . ARG A 1 96  ? 15.986  6.185   24.140 1.00 43.29  ? 88  ARG A NH1 1 
ATOM   675  N NH2 . ARG A 1 96  ? 13.826  5.898   23.547 1.00 52.81  ? 88  ARG A NH2 1 
ATOM   676  N N   . THR A 1 97  ? 16.112  13.143  24.242 1.00 39.40  ? 89  THR A N   1 
ATOM   677  C CA  . THR A 1 97  ? 16.810  14.059  25.183 1.00 45.61  ? 89  THR A CA  1 
ATOM   678  C C   . THR A 1 97  ? 16.329  13.689  26.571 1.00 39.53  ? 89  THR A C   1 
ATOM   679  O O   . THR A 1 97  ? 15.139  13.492  26.744 1.00 39.26  ? 89  THR A O   1 
ATOM   680  C CB  . THR A 1 97  ? 16.430  15.544  25.045 1.00 43.57  ? 89  THR A CB  1 
ATOM   681  O OG1 . THR A 1 97  ? 16.880  15.888  23.754 1.00 67.35  ? 89  THR A OG1 1 
ATOM   682  C CG2 . THR A 1 97  ? 17.141  16.456  26.015 1.00 51.63  ? 89  THR A CG2 1 
ATOM   683  N N   . MET A 1 98  ? 17.222  13.731  27.521 1.00 46.03  ? 90  MET A N   1 
ATOM   684  C CA  . MET A 1 98  ? 16.909  13.326  28.884 1.00 51.25  ? 90  MET A CA  1 
ATOM   685  C C   . MET A 1 98  ? 17.715  14.274  29.760 1.00 54.42  ? 90  MET A C   1 
ATOM   686  O O   . MET A 1 98  ? 18.955  14.380  29.513 1.00 53.55  ? 90  MET A O   1 
ATOM   687  C CB  . MET A 1 98  ? 17.330  11.857  29.075 1.00 52.11  ? 90  MET A CB  1 
ATOM   688  C CG  . MET A 1 98  ? 16.889  11.263  30.393 1.00 61.76  ? 90  MET A CG  1 
ATOM   689  S SD  . MET A 1 98  ? 17.270  9.500   30.584 1.00 59.98  ? 90  MET A SD  1 
ATOM   690  C CE  . MET A 1 98  ? 15.661  8.743   30.390 1.00 68.62  ? 90  MET A CE  1 
ATOM   691  N N   . GLN A 1 99  ? 17.055  14.891  30.735 1.00 55.55  ? 91  GLN A N   1 
ATOM   692  C CA  . GLN A 1 99  ? 17.677  15.811  31.720 1.00 64.69  ? 91  GLN A CA  1 
ATOM   693  C C   . GLN A 1 99  ? 17.693  15.155  33.110 1.00 55.85  ? 91  GLN A C   1 
ATOM   694  O O   . GLN A 1 99  ? 16.668  14.615  33.508 1.00 49.13  ? 91  GLN A O   1 
ATOM   695  C CB  . GLN A 1 99  ? 16.900  17.128  31.743 1.00 76.48  ? 91  GLN A CB  1 
ATOM   696  C CG  . GLN A 1 99  ? 17.673  18.255  32.410 1.00 90.79  ? 91  GLN A CG  1 
ATOM   697  C CD  . GLN A 1 99  ? 18.845  18.648  31.546 1.00 107.77 ? 91  GLN A CD  1 
ATOM   698  O OE1 . GLN A 1 99  ? 18.871  18.339  30.349 1.00 126.20 ? 91  GLN A OE1 1 
ATOM   699  N NE2 . GLN A 1 99  ? 19.824  19.313  32.150 1.00 100.66 ? 91  GLN A NE2 1 
ATOM   700  N N   . PHE A 1 100 ? 18.829  15.169  33.803 1.00 44.04  ? 92  PHE A N   1 
ATOM   701  C CA  . PHE A 1 100 ? 19.008  14.546  35.127 1.00 55.65  ? 92  PHE A CA  1 
ATOM   702  C C   . PHE A 1 100 ? 18.827  15.622  36.182 1.00 57.48  ? 92  PHE A C   1 
ATOM   703  O O   . PHE A 1 100 ? 18.993  16.813  35.852 1.00 57.19  ? 92  PHE A O   1 
ATOM   704  C CB  . PHE A 1 100 ? 20.367  13.859  35.211 1.00 56.70  ? 92  PHE A CB  1 
ATOM   705  C CG  . PHE A 1 100 ? 20.462  12.720  34.244 1.00 52.85  ? 92  PHE A CG  1 
ATOM   706  C CD1 . PHE A 1 100 ? 20.757  12.954  32.910 1.00 56.62  ? 92  PHE A CD1 1 
ATOM   707  C CD2 . PHE A 1 100 ? 20.178  11.428  34.659 1.00 51.46  ? 92  PHE A CD2 1 
ATOM   708  C CE1 . PHE A 1 100 ? 20.791  11.913  31.994 1.00 52.42  ? 92  PHE A CE1 1 
ATOM   709  C CE2 . PHE A 1 100 ? 20.269  10.384  33.761 1.00 52.81  ? 92  PHE A CE2 1 
ATOM   710  C CZ  . PHE A 1 100 ? 20.553  10.634  32.421 1.00 53.94  ? 92  PHE A CZ  1 
ATOM   711  N N   . GLU A 1 101 ? 18.433  15.204  37.378 1.00 64.30  ? 93  GLU A N   1 
ATOM   712  C CA  . GLU A 1 101 ? 18.157  16.136  38.501 1.00 70.12  ? 93  GLU A CA  1 
ATOM   713  C C   . GLU A 1 101 ? 19.483  16.751  38.979 1.00 63.49  ? 93  GLU A C   1 
ATOM   714  O O   . GLU A 1 101 ? 19.414  17.817  39.581 1.00 71.84  ? 93  GLU A O   1 
ATOM   715  C CB  . GLU A 1 101 ? 17.479  15.418  39.659 1.00 67.92  ? 93  GLU A CB  1 
ATOM   716  C CG  . GLU A 1 101 ? 18.449  14.476  40.348 1.00 73.38  ? 93  GLU A CG  1 
ATOM   717  C CD  . GLU A 1 101 ? 17.917  13.842  41.608 1.00 73.84  ? 93  GLU A CD  1 
ATOM   718  O OE1 . GLU A 1 101 ? 18.220  14.375  42.681 1.00 87.22  ? 93  GLU A OE1 1 
ATOM   719  O OE2 . GLU A 1 101 ? 17.216  12.823  41.503 1.00 70.56  ? 93  GLU A OE2 1 
ATOM   720  N N   . ASP A 1 102 ? 20.633  16.127  38.711 1.00 58.69  ? 94  ASP A N   1 
ATOM   721  C CA  . ASP A 1 102 ? 21.972  16.654  39.093 1.00 56.66  ? 94  ASP A CA  1 
ATOM   722  C C   . ASP A 1 102 ? 22.576  17.452  37.906 1.00 66.25  ? 94  ASP A C   1 
ATOM   723  O O   . ASP A 1 102 ? 23.803  17.622  37.880 1.00 57.43  ? 94  ASP A O   1 
ATOM   724  C CB  . ASP A 1 102 ? 22.836  15.512  39.649 1.00 61.03  ? 94  ASP A CB  1 
ATOM   725  C CG  . ASP A 1 102 ? 23.321  14.522  38.600 1.00 60.04  ? 94  ASP A CG  1 
ATOM   726  O OD1 . ASP A 1 102 ? 22.800  14.647  37.460 1.00 48.89  ? 94  ASP A OD1 1 
ATOM   727  O OD2 . ASP A 1 102 ? 24.213  13.618  38.936 1.00 59.43  ? 94  ASP A OD2 1 
ATOM   728  N N   . GLY A 1 103 ? 21.748  17.948  36.964 1.00 62.37  ? 95  GLY A N   1 
ATOM   729  C CA  . GLY A 1 103 ? 22.157  18.805  35.829 1.00 57.08  ? 95  GLY A CA  1 
ATOM   730  C C   . GLY A 1 103 ? 22.773  18.047  34.648 1.00 60.00  ? 95  GLY A C   1 
ATOM   731  O O   . GLY A 1 103 ? 23.010  18.686  33.579 1.00 50.91  ? 95  GLY A O   1 
ATOM   732  N N   . ALA A 1 104 ? 23.086  16.753  34.769 1.00 54.36  ? 96  ALA A N   1 
ATOM   733  C CA  . ALA A 1 104 ? 23.608  15.983  33.612 1.00 52.01  ? 96  ALA A CA  1 
ATOM   734  C C   . ALA A 1 104 ? 22.602  16.067  32.469 1.00 47.54  ? 96  ALA A C   1 
ATOM   735  O O   . ALA A 1 104 ? 21.452  16.399  32.732 1.00 55.19  ? 96  ALA A O   1 
ATOM   736  C CB  . ALA A 1 104 ? 23.861  14.554  33.960 1.00 53.74  ? 96  ALA A CB  1 
ATOM   737  N N   . SER A 1 105 ? 23.002  15.862  31.219 1.00 47.54  ? 97  SER A N   1 
ATOM   738  C CA  . SER A 1 105 ? 21.996  15.672  30.135 1.00 60.68  ? 97  SER A CA  1 
ATOM   739  C C   . SER A 1 105 ? 22.515  14.586  29.207 1.00 54.35  ? 97  SER A C   1 
ATOM   740  O O   . SER A 1 105 ? 23.704  14.255  29.337 1.00 61.21  ? 97  SER A O   1 
ATOM   741  C CB  . SER A 1 105 ? 21.604  16.953  29.419 1.00 54.29  ? 97  SER A CB  1 
ATOM   742  O OG  . SER A 1 105 ? 22.744  17.689  29.077 1.00 58.06  ? 97  SER A OG  1 
ATOM   743  N N   . LEU A 1 106 ? 21.641  13.957  28.430 1.00 53.31  ? 98  LEU A N   1 
ATOM   744  C CA  . LEU A 1 106 ? 22.061  12.865  27.513 1.00 48.51  ? 98  LEU A CA  1 
ATOM   745  C C   . LEU A 1 106 ? 21.225  12.958  26.236 1.00 43.47  ? 98  LEU A C   1 
ATOM   746  O O   . LEU A 1 106 ? 19.996  13.127  26.370 1.00 45.30  ? 98  LEU A O   1 
ATOM   747  C CB  . LEU A 1 106 ? 21.861  11.556  28.276 1.00 46.29  ? 98  LEU A CB  1 
ATOM   748  C CG  . LEU A 1 106 ? 22.337  10.302  27.538 1.00 61.31  ? 98  LEU A CG  1 
ATOM   749  C CD1 . LEU A 1 106 ? 22.920  9.249   28.471 1.00 54.48  ? 98  LEU A CD1 1 
ATOM   750  C CD2 . LEU A 1 106 ? 21.219  9.684   26.729 1.00 62.94  ? 98  LEU A CD2 1 
ATOM   751  N N   . THR A 1 107 ? 21.822  12.821  25.053 1.00 39.83  ? 99  THR A N   1 
ATOM   752  C CA  . THR A 1 107 ? 21.034  12.589  23.794 1.00 43.38  ? 99  THR A CA  1 
ATOM   753  C C   . THR A 1 107 ? 21.303  11.206  23.205 1.00 37.68  ? 99  THR A C   1 
ATOM   754  O O   . THR A 1 107 ? 22.351  10.684  23.454 1.00 46.55  ? 99  THR A O   1 
ATOM   755  C CB  . THR A 1 107 ? 21.373  13.547  22.645 1.00 41.10  ? 99  THR A CB  1 
ATOM   756  O OG1 . THR A 1 107 ? 22.788  13.584  22.529 1.00 47.08  ? 99  THR A OG1 1 
ATOM   757  C CG2 . THR A 1 107 ? 20.817  14.930  22.864 1.00 46.82  ? 99  THR A CG2 1 
ATOM   758  N N   . VAL A 1 108 ? 20.426  10.732  22.326 1.00 41.68  ? 100 VAL A N   1 
ATOM   759  C CA  . VAL A 1 108 ? 20.597  9.465   21.570 1.00 43.34  ? 100 VAL A CA  1 
ATOM   760  C C   . VAL A 1 108 ? 19.909  9.670   20.228 1.00 42.98  ? 100 VAL A C   1 
ATOM   761  O O   . VAL A 1 108 ? 18.704  10.078  20.210 1.00 38.09  ? 100 VAL A O   1 
ATOM   762  C CB  . VAL A 1 108 ? 19.983  8.236   22.289 1.00 52.18  ? 100 VAL A CB  1 
ATOM   763  C CG1 . VAL A 1 108 ? 20.555  6.927   21.771 1.00 51.97  ? 100 VAL A CG1 1 
ATOM   764  C CG2 . VAL A 1 108 ? 20.138  8.286   23.795 1.00 54.97  ? 100 VAL A CG2 1 
ATOM   765  N N   . ASN A 1 109 ? 20.622  9.333   19.163 1.00 42.99  ? 101 ASN A N   1 
ATOM   766  C CA  . ASN A 1 109 ? 20.065  9.248   17.775 1.00 44.27  ? 101 ASN A CA  1 
ATOM   767  C C   . ASN A 1 109 ? 20.148  7.800   17.328 1.00 37.60  ? 101 ASN A C   1 
ATOM   768  O O   . ASN A 1 109 ? 21.172  7.205   17.577 1.00 45.99  ? 101 ASN A O   1 
ATOM   769  C CB  . ASN A 1 109 ? 20.815  10.162  16.827 1.00 44.78  ? 101 ASN A CB  1 
ATOM   770  C CG  . ASN A 1 109 ? 20.565  11.583  17.285 1.00 40.02  ? 101 ASN A CG  1 
ATOM   771  O OD1 . ASN A 1 109 ? 19.431  12.058  17.278 1.00 41.77  ? 101 ASN A OD1 1 
ATOM   772  N ND2 . ASN A 1 109 ? 21.575  12.198  17.840 1.00 43.00  ? 101 ASN A ND2 1 
ATOM   773  N N   . TYR A 1 110 ? 19.043  7.266   16.811 1.00 39.81  ? 102 TYR A N   1 
ATOM   774  C CA  . TYR A 1 110 ? 18.877  5.885   16.326 1.00 39.51  ? 102 TYR A CA  1 
ATOM   775  C C   . TYR A 1 110 ? 18.681  5.921   14.800 1.00 44.14  ? 102 TYR A C   1 
ATOM   776  O O   . TYR A 1 110 ? 17.938  6.784   14.307 1.00 42.98  ? 102 TYR A O   1 
ATOM   777  C CB  . TYR A 1 110 ? 17.655  5.267   17.035 1.00 41.98  ? 102 TYR A CB  1 
ATOM   778  C CG  . TYR A 1 110 ? 17.725  5.120   18.552 1.00 39.60  ? 102 TYR A CG  1 
ATOM   779  C CD1 . TYR A 1 110 ? 17.337  6.131   19.427 1.00 34.34  ? 102 TYR A CD1 1 
ATOM   780  C CD2 . TYR A 1 110 ? 18.126  3.922   19.110 1.00 38.79  ? 102 TYR A CD2 1 
ATOM   781  C CE1 . TYR A 1 110 ? 17.364  5.943   20.806 1.00 36.21  ? 102 TYR A CE1 1 
ATOM   782  C CE2 . TYR A 1 110 ? 18.153  3.719   20.482 1.00 39.60  ? 102 TYR A CE2 1 
ATOM   783  C CZ  . TYR A 1 110 ? 17.772  4.727   21.340 1.00 37.28  ? 102 TYR A CZ  1 
ATOM   784  O OH  . TYR A 1 110 ? 17.894  4.516   22.692 1.00 42.39  ? 102 TYR A OH  1 
ATOM   785  N N   . ARG A 1 111 ? 19.261  4.949   14.089 1.00 44.11  ? 103 ARG A N   1 
ATOM   786  C CA  . ARG A 1 111 ? 18.877  4.588   12.702 1.00 42.75  ? 103 ARG A CA  1 
ATOM   787  C C   . ARG A 1 111 ? 18.738  3.069   12.645 1.00 37.75  ? 103 ARG A C   1 
ATOM   788  O O   . ARG A 1 111 ? 19.351  2.351   13.474 1.00 44.97  ? 103 ARG A O   1 
ATOM   789  C CB  . ARG A 1 111 ? 19.866  5.143   11.667 1.00 45.20  ? 103 ARG A CB  1 
ATOM   790  C CG  . ARG A 1 111 ? 20.000  6.663   11.664 1.00 46.34  ? 103 ARG A CG  1 
ATOM   791  C CD  . ARG A 1 111 ? 18.705  7.385   11.343 1.00 47.59  ? 103 ARG A CD  1 
ATOM   792  N NE  . ARG A 1 111 ? 18.942  8.828   11.359 1.00 58.48  ? 103 ARG A NE  1 
ATOM   793  C CZ  . ARG A 1 111 ? 18.904  9.644   12.421 1.00 64.32  ? 103 ARG A CZ  1 
ATOM   794  N NH1 . ARG A 1 111 ? 18.536  9.264   13.653 1.00 48.91  ? 103 ARG A NH1 1 
ATOM   795  N NH2 . ARG A 1 111 ? 19.213  10.907  12.203 1.00 75.67  ? 103 ARG A NH2 1 
ATOM   796  N N   . TYR A 1 112 ? 17.834  2.594   11.830 1.00 36.64  ? 104 TYR A N   1 
ATOM   797  C CA  . TYR A 1 112 ? 17.577  1.143   11.720 1.00 49.14  ? 104 TYR A CA  1 
ATOM   798  C C   . TYR A 1 112 ? 17.589  0.825   10.231 1.00 49.77  ? 104 TYR A C   1 
ATOM   799  O O   . TYR A 1 112 ? 17.284  1.767   9.379  1.00 54.65  ? 104 TYR A O   1 
ATOM   800  C CB  . TYR A 1 112 ? 16.305  0.681   12.445 1.00 43.25  ? 104 TYR A CB  1 
ATOM   801  C CG  . TYR A 1 112 ? 16.024  1.242   13.826 1.00 43.60  ? 104 TYR A CG  1 
ATOM   802  C CD1 . TYR A 1 112 ? 15.450  2.501   13.995 1.00 42.16  ? 104 TYR A CD1 1 
ATOM   803  C CD2 . TYR A 1 112 ? 16.271  0.500   14.973 1.00 38.16  ? 104 TYR A CD2 1 
ATOM   804  C CE1 . TYR A 1 112 ? 15.146  2.981   15.265 1.00 44.64  ? 104 TYR A CE1 1 
ATOM   805  C CE2 . TYR A 1 112 ? 16.026  0.990   16.260 1.00 38.24  ? 104 TYR A CE2 1 
ATOM   806  C CZ  . TYR A 1 112 ? 15.427  2.231   16.405 1.00 39.98  ? 104 TYR A CZ  1 
ATOM   807  O OH  . TYR A 1 112 ? 15.122  2.707   17.651 1.00 39.81  ? 104 TYR A OH  1 
ATOM   808  N N   . THR A 1 113 ? 17.949  -0.431  9.960  1.00 48.38  ? 105 THR A N   1 
ATOM   809  C CA  . THR A 1 113 ? 17.732  -1.163  8.672  1.00 50.23  ? 105 THR A CA  1 
ATOM   810  C C   . THR A 1 113 ? 17.060  -2.501  9.012  1.00 51.82  ? 105 THR A C   1 
ATOM   811  O O   . THR A 1 113 ? 17.095  -2.983  10.179 1.00 51.43  ? 105 THR A O   1 
ATOM   812  C CB  . THR A 1 113 ? 19.026  -1.242  7.837  1.00 47.96  ? 105 THR A CB  1 
ATOM   813  O OG1 . THR A 1 113 ? 20.059  -1.932  8.555  1.00 47.22  ? 105 THR A OG1 1 
ATOM   814  C CG2 . THR A 1 113 ? 19.543  0.149   7.517  1.00 41.07  ? 105 THR A CG2 1 
ATOM   815  N N   . TYR A 1 114 ? 16.361  -3.040  8.037  1.00 52.18  ? 106 TYR A N   1 
ATOM   816  C CA  . TYR A 1 114 ? 15.427  -4.153  8.226  1.00 51.06  ? 106 TYR A CA  1 
ATOM   817  C C   . TYR A 1 114 ? 15.734  -5.210  7.163  1.00 55.05  ? 106 TYR A C   1 
ATOM   818  O O   . TYR A 1 114 ? 15.774  -4.866  5.974  1.00 44.03  ? 106 TYR A O   1 
ATOM   819  C CB  . TYR A 1 114 ? 14.000  -3.607  8.103  1.00 50.23  ? 106 TYR A CB  1 
ATOM   820  C CG  . TYR A 1 114 ? 13.624  -2.518  9.071  1.00 49.45  ? 106 TYR A CG  1 
ATOM   821  C CD1 . TYR A 1 114 ? 13.725  -2.738  10.441 1.00 52.80  ? 106 TYR A CD1 1 
ATOM   822  C CD2 . TYR A 1 114 ? 13.094  -1.307  8.638  1.00 54.61  ? 106 TYR A CD2 1 
ATOM   823  C CE1 . TYR A 1 114 ? 13.349  -1.768  11.362 1.00 47.01  ? 106 TYR A CE1 1 
ATOM   824  C CE2 . TYR A 1 114 ? 12.695  -0.336  9.549  1.00 47.28  ? 106 TYR A CE2 1 
ATOM   825  C CZ  . TYR A 1 114 ? 12.802  -0.585  10.913 1.00 47.14  ? 106 TYR A CZ  1 
ATOM   826  O OH  . TYR A 1 114 ? 12.456  0.317   11.861 1.00 43.07  ? 106 TYR A OH  1 
ATOM   827  N N   . GLU A 1 115 ? 15.906  -6.454  7.592  1.00 53.54  ? 107 GLU A N   1 
ATOM   828  C CA  . GLU A 1 115 ? 16.048  -7.632  6.702  1.00 57.56  ? 107 GLU A CA  1 
ATOM   829  C C   . GLU A 1 115 ? 15.092  -8.706  7.179  1.00 46.78  ? 107 GLU A C   1 
ATOM   830  O O   . GLU A 1 115 ? 15.408  -9.322  8.200  1.00 48.19  ? 107 GLU A O   1 
ATOM   831  C CB  . GLU A 1 115 ? 17.470  -8.182  6.787  1.00 58.85  ? 107 GLU A CB  1 
ATOM   832  C CG  . GLU A 1 115 ? 18.487  -7.147  6.370  1.00 59.92  ? 107 GLU A CG  1 
ATOM   833  C CD  . GLU A 1 115 ? 19.906  -7.596  6.649  1.00 83.57  ? 107 GLU A CD  1 
ATOM   834  O OE1 . GLU A 1 115 ? 20.081  -8.780  7.089  1.00 81.04  ? 107 GLU A OE1 1 
ATOM   835  O OE2 . GLU A 1 115 ? 20.830  -6.748  6.435  1.00 88.11  ? 107 GLU A OE2 1 
ATOM   836  N N   . GLY A 1 116 ? 13.995  -8.901  6.467  1.00 42.73  ? 108 GLY A N   1 
ATOM   837  C CA  . GLY A 1 116 ? 12.879  -9.728  6.951  1.00 45.71  ? 108 GLY A CA  1 
ATOM   838  C C   . GLY A 1 116 ? 12.543  -9.386  8.404  1.00 51.92  ? 108 GLY A C   1 
ATOM   839  O O   . GLY A 1 116 ? 11.998  -8.351  8.635  1.00 58.19  ? 108 GLY A O   1 
ATOM   840  N N   . SER A 1 117 ? 12.902  -10.231 9.372  1.00 56.17  ? 109 SER A N   1 
ATOM   841  C CA  . SER A 1 117 ? 12.429  -10.154 10.781 1.00 43.03  ? 109 SER A CA  1 
ATOM   842  C C   . SER A 1 117 ? 13.582  -9.672  11.640 1.00 34.00  ? 109 SER A C   1 
ATOM   843  O O   . SER A 1 117 ? 13.523  -9.658  12.891 1.00 35.51  ? 109 SER A O   1 
ATOM   844  C CB  . SER A 1 117 ? 11.922  -11.514 11.177 1.00 44.05  ? 109 SER A CB  1 
ATOM   845  O OG  . SER A 1 117 ? 12.998  -12.371 11.426 1.00 39.09  ? 109 SER A OG  1 
ATOM   846  N N   . HIS A 1 118 ? 14.671  -9.360  10.958 1.00 29.32  ? 110 HIS A N   1 
ATOM   847  C CA  . HIS A 1 118 ? 15.882  -8.882  11.615 1.00 34.24  ? 110 HIS A CA  1 
ATOM   848  C C   . HIS A 1 118 ? 15.968  -7.362  11.435 1.00 42.60  ? 110 HIS A C   1 
ATOM   849  O O   . HIS A 1 118 ? 15.721  -6.893  10.305 1.00 44.70  ? 110 HIS A O   1 
ATOM   850  C CB  . HIS A 1 118 ? 17.116  -9.554  11.050 1.00 40.30  ? 110 HIS A CB  1 
ATOM   851  C CG  . HIS A 1 118 ? 18.321  -9.278  11.874 1.00 37.02  ? 110 HIS A CG  1 
ATOM   852  N ND1 . HIS A 1 118 ? 18.393  -9.669  13.210 1.00 42.59  ? 110 HIS A ND1 1 
ATOM   853  C CD2 . HIS A 1 118 ? 19.518  -8.723  11.568 1.00 37.60  ? 110 HIS A CD2 1 
ATOM   854  C CE1 . HIS A 1 118 ? 19.604  -9.382  13.693 1.00 29.89  ? 110 HIS A CE1 1 
ATOM   855  N NE2 . HIS A 1 118 ? 20.299  -8.760  12.714 1.00 37.70  ? 110 HIS A NE2 1 
ATOM   856  N N   . ILE A 1 119 ? 16.325  -6.685  12.542 1.00 46.56  ? 111 ILE A N   1 
ATOM   857  C CA  . ILE A 1 119 ? 16.557  -5.228  12.723 1.00 44.33  ? 111 ILE A CA  1 
ATOM   858  C C   . ILE A 1 119 ? 18.034  -5.033  13.056 1.00 42.95  ? 111 ILE A C   1 
ATOM   859  O O   . ILE A 1 119 ? 18.559  -5.709  13.981 1.00 44.72  ? 111 ILE A O   1 
ATOM   860  C CB  . ILE A 1 119 ? 15.732  -4.625  13.880 1.00 43.05  ? 111 ILE A CB  1 
ATOM   861  C CG1 . ILE A 1 119 ? 14.245  -5.001  13.883 1.00 49.35  ? 111 ILE A CG1 1 
ATOM   862  C CG2 . ILE A 1 119 ? 15.902  -3.118  13.921 1.00 42.87  ? 111 ILE A CG2 1 
ATOM   863  C CD1 . ILE A 1 119 ? 13.506  -4.646  15.179 1.00 48.76  ? 111 ILE A CD1 1 
ATOM   864  N N   . LYS A 1 120 ? 18.635  -4.032  12.437 1.00 46.82  ? 112 LYS A N   1 
ATOM   865  C CA  . LYS A 1 120 ? 19.976  -3.494  12.807 1.00 52.41  ? 112 LYS A CA  1 
ATOM   866  C C   . LYS A 1 120 ? 19.836  -2.076  13.347 1.00 46.40  ? 112 LYS A C   1 
ATOM   867  O O   . LYS A 1 120 ? 19.474  -1.218  12.551 1.00 51.17  ? 112 LYS A O   1 
ATOM   868  C CB  . LYS A 1 120 ? 20.861  -3.434  11.561 1.00 57.62  ? 112 LYS A CB  1 
ATOM   869  C CG  . LYS A 1 120 ? 21.577  -4.737  11.232 1.00 64.51  ? 112 LYS A CG  1 
ATOM   870  C CD  . LYS A 1 120 ? 22.051  -4.819  9.800  1.00 62.96  ? 112 LYS A CD  1 
ATOM   871  C CE  . LYS A 1 120 ? 23.331  -5.608  9.676  1.00 68.29  ? 112 LYS A CE  1 
ATOM   872  N NZ  . LYS A 1 120 ? 23.166  -6.701  8.702  1.00 71.14  ? 112 LYS A NZ  1 
ATOM   873  N N   . GLY A 1 121 ? 20.067  -1.866  14.648 1.00 47.19  ? 113 GLY A N   1 
ATOM   874  C CA  . GLY A 1 121 ? 20.113  -0.538  15.270 1.00 48.81  ? 113 GLY A CA  1 
ATOM   875  C C   . GLY A 1 121 ? 21.519  0.040   15.381 1.00 47.28  ? 113 GLY A C   1 
ATOM   876  O O   . GLY A 1 121 ? 22.416  -0.689  15.758 1.00 48.30  ? 113 GLY A O   1 
ATOM   877  N N   . GLU A 1 122 ? 21.657  1.330   15.051 1.00 45.46  ? 114 GLU A N   1 
ATOM   878  C CA  . GLU A 1 122 ? 22.780  2.229   15.383 1.00 45.85  ? 114 GLU A CA  1 
ATOM   879  C C   . GLU A 1 122 ? 22.212  3.319   16.297 1.00 44.49  ? 114 GLU A C   1 
ATOM   880  O O   . GLU A 1 122 ? 21.281  4.025   15.886 1.00 46.90  ? 114 GLU A O   1 
ATOM   881  C CB  . GLU A 1 122 ? 23.346  2.845   14.102 1.00 52.13  ? 114 GLU A CB  1 
ATOM   882  C CG  . GLU A 1 122 ? 23.746  1.806   13.045 1.00 53.45  ? 114 GLU A CG  1 
ATOM   883  C CD  . GLU A 1 122 ? 25.134  1.312   13.348 1.00 51.85  ? 114 GLU A CD  1 
ATOM   884  O OE1 . GLU A 1 122 ? 25.854  2.099   13.974 1.00 65.21  ? 114 GLU A OE1 1 
ATOM   885  O OE2 . GLU A 1 122 ? 25.455  0.148   13.067 1.00 57.43  ? 114 GLU A OE2 1 
ATOM   886  N N   . ALA A 1 123 ? 22.737  3.389   17.508 1.00 39.62  ? 115 ALA A N   1 
ATOM   887  C CA  . ALA A 1 123 ? 22.399  4.363   18.550 1.00 47.81  ? 115 ALA A CA  1 
ATOM   888  C C   . ALA A 1 123 ? 23.693  5.086   18.929 1.00 46.83  ? 115 ALA A C   1 
ATOM   889  O O   . ALA A 1 123 ? 24.620  4.419   19.377 1.00 50.13  ? 115 ALA A O   1 
ATOM   890  C CB  . ALA A 1 123 ? 21.769  3.655   19.734 1.00 40.69  ? 115 ALA A CB  1 
ATOM   891  N N   . GLN A 1 124 ? 23.732  6.401   18.707 1.00 52.55  ? 116 GLN A N   1 
ATOM   892  C CA  . GLN A 1 124 ? 24.849  7.310   19.068 1.00 51.71  ? 116 GLN A CA  1 
ATOM   893  C C   . GLN A 1 124 ? 24.409  8.196   20.235 1.00 47.10  ? 116 GLN A C   1 
ATOM   894  O O   . GLN A 1 124 ? 23.389  8.923   20.145 1.00 40.71  ? 116 GLN A O   1 
ATOM   895  C CB  . GLN A 1 124 ? 25.222  8.188   17.876 1.00 51.00  ? 116 GLN A CB  1 
ATOM   896  C CG  . GLN A 1 124 ? 25.630  9.590   18.269 1.00 57.14  ? 116 GLN A CG  1 
ATOM   897  C CD  . GLN A 1 124 ? 26.345  10.164  17.080 1.00 68.44  ? 116 GLN A CD  1 
ATOM   898  O OE1 . GLN A 1 124 ? 25.806  10.174  15.978 1.00 73.95  ? 116 GLN A OE1 1 
ATOM   899  N NE2 . GLN A 1 124 ? 27.599  10.530  17.274 1.00 68.01  ? 116 GLN A NE2 1 
ATOM   900  N N   . VAL A 1 125 ? 25.177  8.150   21.297 1.00 46.96  ? 117 VAL A N   1 
ATOM   901  C CA  . VAL A 1 125 ? 24.812  8.760   22.598 1.00 44.92  ? 117 VAL A CA  1 
ATOM   902  C C   . VAL A 1 125 ? 25.802  9.868   22.862 1.00 44.89  ? 117 VAL A C   1 
ATOM   903  O O   . VAL A 1 125 ? 26.981  9.561   22.826 1.00 51.02  ? 117 VAL A O   1 
ATOM   904  C CB  . VAL A 1 125 ? 24.954  7.712   23.707 1.00 46.16  ? 117 VAL A CB  1 
ATOM   905  C CG1 . VAL A 1 125 ? 24.782  8.325   25.093 1.00 41.37  ? 117 VAL A CG1 1 
ATOM   906  C CG2 . VAL A 1 125 ? 24.050  6.519   23.481 1.00 47.80  ? 117 VAL A CG2 1 
ATOM   907  N N   . LYS A 1 126 ? 25.360  11.016  23.338 1.00 51.75  ? 118 LYS A N   1 
ATOM   908  C CA  . LYS A 1 126 ? 26.332  11.934  23.968 1.00 63.24  ? 118 LYS A CA  1 
ATOM   909  C C   . LYS A 1 126 ? 25.856  12.272  25.398 1.00 54.97  ? 118 LYS A C   1 
ATOM   910  O O   . LYS A 1 126 ? 24.891  12.982  25.549 1.00 47.96  ? 118 LYS A O   1 
ATOM   911  C CB  . LYS A 1 126 ? 26.599  13.113  23.024 1.00 62.85  ? 118 LYS A CB  1 
ATOM   912  C CG  . LYS A 1 126 ? 27.499  14.183  23.633 1.00 75.25  ? 118 LYS A CG  1 
ATOM   913  C CD  . LYS A 1 126 ? 28.104  15.143  22.626 1.00 82.44  ? 118 LYS A CD  1 
ATOM   914  C CE  . LYS A 1 126 ? 29.421  15.716  23.111 1.00 83.73  ? 118 LYS A CE  1 
ATOM   915  N NZ  . LYS A 1 126 ? 29.680  17.031  22.484 1.00 85.88  ? 118 LYS A NZ  1 
ATOM   916  N N   . GLY A 1 127 ? 26.565  11.816  26.421 1.00 50.48  ? 119 GLY A N   1 
ATOM   917  C CA  . GLY A 1 127 ? 26.220  12.141  27.820 1.00 59.73  ? 119 GLY A CA  1 
ATOM   918  C C   . GLY A 1 127 ? 27.268  13.018  28.453 1.00 58.66  ? 119 GLY A C   1 
ATOM   919  O O   . GLY A 1 127 ? 28.436  12.587  28.463 1.00 56.98  ? 119 GLY A O   1 
ATOM   920  N N   . THR A 1 128 ? 26.871  14.184  28.972 1.00 56.22  ? 120 THR A N   1 
ATOM   921  C CA  . THR A 1 128 ? 27.781  15.126  29.696 1.00 60.72  ? 120 THR A CA  1 
ATOM   922  C C   . THR A 1 128 ? 27.146  15.707  30.975 1.00 53.97  ? 120 THR A C   1 
ATOM   923  O O   . THR A 1 128 ? 25.929  15.840  31.073 1.00 54.03  ? 120 THR A O   1 
ATOM   924  C CB  . THR A 1 128 ? 28.197  16.283  28.789 1.00 60.84  ? 120 THR A CB  1 
ATOM   925  O OG1 . THR A 1 128 ? 26.961  16.869  28.419 1.00 62.79  ? 120 THR A OG1 1 
ATOM   926  C CG2 . THR A 1 128 ? 28.966  15.849  27.559 1.00 70.97  ? 120 THR A CG2 1 
ATOM   927  N N   . GLY A 1 129 ? 27.967  16.110  31.926 1.00 55.40  ? 121 GLY A N   1 
ATOM   928  C CA  . GLY A 1 129 ? 27.500  16.931  33.050 1.00 52.89  ? 121 GLY A CA  1 
ATOM   929  C C   . GLY A 1 129 ? 27.343  16.082  34.284 1.00 59.57  ? 121 GLY A C   1 
ATOM   930  O O   . GLY A 1 129 ? 26.727  16.569  35.236 1.00 56.40  ? 121 GLY A O   1 
ATOM   931  N N   . PHE A 1 130 ? 27.880  14.856  34.275 1.00 59.96  ? 122 PHE A N   1 
ATOM   932  C CA  . PHE A 1 130 ? 27.628  13.879  35.363 1.00 63.27  ? 122 PHE A CA  1 
ATOM   933  C C   . PHE A 1 130 ? 28.651  14.161  36.441 1.00 62.60  ? 122 PHE A C   1 
ATOM   934  O O   . PHE A 1 130 ? 29.834  13.970  36.208 1.00 71.07  ? 122 PHE A O   1 
ATOM   935  C CB  . PHE A 1 130 ? 27.688  12.414  34.901 1.00 53.79  ? 122 PHE A CB  1 
ATOM   936  C CG  . PHE A 1 130 ? 26.586  12.023  33.939 1.00 50.22  ? 122 PHE A CG  1 
ATOM   937  C CD1 . PHE A 1 130 ? 25.318  11.704  34.404 1.00 51.37  ? 122 PHE A CD1 1 
ATOM   938  C CD2 . PHE A 1 130 ? 26.809  11.994  32.559 1.00 48.71  ? 122 PHE A CD2 1 
ATOM   939  C CE1 . PHE A 1 130 ? 24.298  11.370  33.514 1.00 55.42  ? 122 PHE A CE1 1 
ATOM   940  C CE2 . PHE A 1 130 ? 25.788  11.676  31.676 1.00 52.77  ? 122 PHE A CE2 1 
ATOM   941  C CZ  . PHE A 1 130 ? 24.533  11.365  32.150 1.00 52.93  ? 122 PHE A CZ  1 
ATOM   942  N N   . PRO A 1 131 ? 28.233  14.538  37.660 1.00 66.28  ? 123 PRO A N   1 
ATOM   943  C CA  . PRO A 1 131 ? 29.204  14.794  38.726 1.00 67.81  ? 123 PRO A CA  1 
ATOM   944  C C   . PRO A 1 131 ? 30.148  13.575  38.806 1.00 63.53  ? 123 PRO A C   1 
ATOM   945  O O   . PRO A 1 131 ? 29.625  12.458  38.624 1.00 68.19  ? 123 PRO A O   1 
ATOM   946  C CB  . PRO A 1 131 ? 28.359  14.941  40.012 1.00 63.44  ? 123 PRO A CB  1 
ATOM   947  C CG  . PRO A 1 131 ? 26.908  14.996  39.553 1.00 64.01  ? 123 PRO A CG  1 
ATOM   948  C CD  . PRO A 1 131 ? 26.839  14.519  38.114 1.00 57.77  ? 123 PRO A CD  1 
ATOM   949  N N   . ALA A 1 132 ? 31.456  13.768  39.072 1.00 64.17  ? 124 ALA A N   1 
ATOM   950  C CA  . ALA A 1 132 ? 32.459  12.682  39.276 1.00 59.64  ? 124 ALA A CA  1 
ATOM   951  C C   . ALA A 1 132 ? 32.206  11.907  40.571 1.00 58.04  ? 124 ALA A C   1 
ATOM   952  O O   . ALA A 1 132 ? 32.709  10.773  40.640 1.00 67.51  ? 124 ALA A O   1 
ATOM   953  C CB  . ALA A 1 132 ? 33.858  13.247  39.311 1.00 65.08  ? 124 ALA A CB  1 
ATOM   954  N N   . ASP A 1 133 ? 31.556  12.527  41.574 1.00 61.02  ? 125 ASP A N   1 
ATOM   955  C CA  . ASP A 1 133 ? 31.181  11.904  42.882 1.00 61.57  ? 125 ASP A CA  1 
ATOM   956  C C   . ASP A 1 133 ? 29.765  11.314  42.785 1.00 68.64  ? 125 ASP A C   1 
ATOM   957  O O   . ASP A 1 133 ? 29.316  10.684  43.778 1.00 69.06  ? 125 ASP A O   1 
ATOM   958  C CB  . ASP A 1 133 ? 31.312  12.865  44.078 1.00 59.17  ? 125 ASP A CB  1 
ATOM   959  C CG  . ASP A 1 133 ? 30.739  14.294  43.971 1.00 74.62  ? 125 ASP A CG  1 
ATOM   960  O OD1 . ASP A 1 133 ? 30.020  14.655  42.973 1.00 65.44  ? 125 ASP A OD1 1 
ATOM   961  O OD2 . ASP A 1 133 ? 31.003  15.070  44.925 1.00 75.71  ? 125 ASP A OD2 1 
ATOM   962  N N   . GLY A 1 134 ? 29.155  11.426  41.590 1.00 69.13  ? 126 GLY A N   1 
ATOM   963  C CA  . GLY A 1 134 ? 27.771  11.053  41.207 1.00 61.27  ? 126 GLY A CA  1 
ATOM   964  C C   . GLY A 1 134 ? 27.570  9.559   40.943 1.00 57.88  ? 126 GLY A C   1 
ATOM   965  O O   . GLY A 1 134 ? 28.502  8.769   40.826 1.00 58.03  ? 126 GLY A O   1 
ATOM   966  N N   . PRO A 1 135 ? 26.314  9.084   40.938 1.00 56.84  ? 127 PRO A N   1 
ATOM   967  C CA  . PRO A 1 135 ? 26.072  7.643   41.010 1.00 57.32  ? 127 PRO A CA  1 
ATOM   968  C C   . PRO A 1 135 ? 26.384  7.005   39.646 1.00 59.61  ? 127 PRO A C   1 
ATOM   969  O O   . PRO A 1 135 ? 26.607  5.790   39.550 1.00 56.72  ? 127 PRO A O   1 
ATOM   970  C CB  . PRO A 1 135 ? 24.573  7.524   41.359 1.00 60.15  ? 127 PRO A CB  1 
ATOM   971  C CG  . PRO A 1 135 ? 24.029  8.965   41.438 1.00 61.31  ? 127 PRO A CG  1 
ATOM   972  C CD  . PRO A 1 135 ? 25.088  9.894   40.876 1.00 63.61  ? 127 PRO A CD  1 
ATOM   973  N N   . VAL A 1 136 ? 26.372  7.827   38.597 1.00 50.12  ? 128 VAL A N   1 
ATOM   974  C CA  . VAL A 1 136 ? 26.710  7.288   37.262 1.00 51.50  ? 128 VAL A CA  1 
ATOM   975  C C   . VAL A 1 136 ? 28.191  6.928   37.279 1.00 55.30  ? 128 VAL A C   1 
ATOM   976  O O   . VAL A 1 136 ? 28.502  5.711   37.116 1.00 51.67  ? 128 VAL A O   1 
ATOM   977  C CB  . VAL A 1 136 ? 26.331  8.275   36.155 1.00 51.66  ? 128 VAL A CB  1 
ATOM   978  C CG1 . VAL A 1 136 ? 26.700  7.743   34.754 1.00 51.24  ? 128 VAL A CG1 1 
ATOM   979  C CG2 . VAL A 1 136 ? 24.839  8.582   36.278 1.00 45.49  ? 128 VAL A CG2 1 
ATOM   980  N N   . MET A 1 137 ? 29.046  7.920   37.556 1.00 60.48  ? 129 MET A N   1 
ATOM   981  C CA  . MET A 1 137 ? 30.522  7.748   37.425 1.00 64.94  ? 129 MET A CA  1 
ATOM   982  C C   . MET A 1 137 ? 31.085  6.924   38.611 1.00 64.38  ? 129 MET A C   1 
ATOM   983  O O   . MET A 1 137 ? 32.151  6.281   38.433 1.00 61.20  ? 129 MET A O   1 
ATOM   984  C CB  . MET A 1 137 ? 31.217  9.107   37.271 1.00 60.78  ? 129 MET A CB  1 
ATOM   985  C CG  . MET A 1 137 ? 30.580  10.041  36.204 1.00 60.59  ? 129 MET A CG  1 
ATOM   986  S SD  . MET A 1 137 ? 30.427  9.466   34.422 1.00 61.07  ? 129 MET A SD  1 
ATOM   987  C CE  . MET A 1 137 ? 32.098  9.002   33.990 1.00 55.90  ? 129 MET A CE  1 
ATOM   988  N N   . THR A 1 138 ? 30.382  6.858   39.752 1.00 68.49  ? 130 THR A N   1 
ATOM   989  C CA  . THR A 1 138 ? 30.736  5.976   40.914 1.00 69.58  ? 130 THR A CA  1 
ATOM   990  C C   . THR A 1 138 ? 30.200  4.554   40.654 1.00 66.94  ? 130 THR A C   1 
ATOM   991  O O   . THR A 1 138 ? 30.646  3.636   41.357 1.00 71.21  ? 130 THR A O   1 
ATOM   992  C CB  . THR A 1 138 ? 30.280  6.524   42.286 1.00 62.79  ? 130 THR A CB  1 
ATOM   993  O OG1 . THR A 1 138 ? 28.871  6.610   42.500 1.00 76.12  ? 130 THR A OG1 1 
ATOM   994  C CG2 . THR A 1 138 ? 30.783  7.924   42.563 1.00 67.77  ? 130 THR A CG2 1 
ATOM   995  N N   . ASN A 1 139 ? 29.316  4.376   39.662 1.00 61.36  ? 131 ASN A N   1 
ATOM   996  C CA  . ASN A 1 139 ? 28.709  3.069   39.316 1.00 58.67  ? 131 ASN A CA  1 
ATOM   997  C C   . ASN A 1 139 ? 27.786  2.591   40.452 1.00 58.55  ? 131 ASN A C   1 
ATOM   998  O O   . ASN A 1 139 ? 27.931  1.401   40.766 1.00 48.45  ? 131 ASN A O   1 
ATOM   999  C CB  . ASN A 1 139 ? 29.803  2.015   39.109 1.00 61.72  ? 131 ASN A CB  1 
ATOM   1000 C CG  . ASN A 1 139 ? 29.521  0.969   38.039 1.00 64.90  ? 131 ASN A CG  1 
ATOM   1001 O OD1 . ASN A 1 139 ? 28.383  0.720   37.623 1.00 63.68  ? 131 ASN A OD1 1 
ATOM   1002 N ND2 . ASN A 1 139 ? 30.589  0.355   37.566 1.00 68.04  ? 131 ASN A ND2 1 
ATOM   1003 N N   . SER A 1 140 ? 26.895  3.444   41.016 1.00 54.27  ? 132 SER A N   1 
ATOM   1004 C CA  . SER A 1 140 ? 26.071  3.208   42.246 1.00 53.05  ? 132 SER A CA  1 
ATOM   1005 C C   . SER A 1 140 ? 24.592  3.026   41.899 1.00 48.64  ? 132 SER A C   1 
ATOM   1006 O O   . SER A 1 140 ? 23.770  3.241   42.811 1.00 59.97  ? 132 SER A O   1 
ATOM   1007 C CB  . SER A 1 140 ? 26.164  4.342   43.265 1.00 59.02  ? 132 SER A CB  1 
ATOM   1008 O OG  . SER A 1 140 ? 27.501  4.677   43.575 1.00 66.30  ? 132 SER A OG  1 
ATOM   1009 N N   . LEU A 1 141 ? 24.289  2.655   40.656 1.00 48.92  ? 133 LEU A N   1 
ATOM   1010 C CA  . LEU A 1 141 ? 22.923  2.430   40.116 1.00 49.15  ? 133 LEU A CA  1 
ATOM   1011 C C   . LEU A 1 141 ? 22.608  0.917   40.110 1.00 48.30  ? 133 LEU A C   1 
ATOM   1012 O O   . LEU A 1 141 ? 23.442  0.117   39.696 1.00 41.04  ? 133 LEU A O   1 
ATOM   1013 C CB  . LEU A 1 141 ? 22.901  3.024   38.700 1.00 51.49  ? 133 LEU A CB  1 
ATOM   1014 C CG  . LEU A 1 141 ? 22.938  4.554   38.648 1.00 57.84  ? 133 LEU A CG  1 
ATOM   1015 C CD1 . LEU A 1 141 ? 22.451  5.071   37.295 1.00 54.57  ? 133 LEU A CD1 1 
ATOM   1016 C CD2 . LEU A 1 141 ? 22.117  5.172   39.789 1.00 60.94  ? 133 LEU A CD2 1 
ATOM   1017 N N   . THR A 1 142 ? 21.442  0.511   40.590 1.00 51.44  ? 134 THR A N   1 
ATOM   1018 C CA  . THR A 1 142 ? 21.145  -0.909  40.914 1.00 54.04  ? 134 THR A CA  1 
ATOM   1019 C C   . THR A 1 142 ? 19.890  -1.348  40.175 1.00 46.53  ? 134 THR A C   1 
ATOM   1020 O O   . THR A 1 142 ? 19.750  -2.559  39.923 1.00 49.39  ? 134 THR A O   1 
ATOM   1021 C CB  . THR A 1 142 ? 21.030  -1.118  42.437 1.00 48.30  ? 134 THR A CB  1 
ATOM   1022 O OG1 . THR A 1 142 ? 20.103  -0.180  42.969 1.00 55.11  ? 134 THR A OG1 1 
ATOM   1023 C CG2 . THR A 1 142 ? 22.355  -0.912  43.133 1.00 46.93  ? 134 THR A CG2 1 
ATOM   1024 N N   . ALA A 1 143 ? 18.985  -0.412  39.905 1.00 46.44  ? 135 ALA A N   1 
ATOM   1025 C CA  . ALA A 1 143 ? 17.658  -0.734  39.340 1.00 49.86  ? 135 ALA A CA  1 
ATOM   1026 C C   . ALA A 1 143 ? 16.987  0.490   38.734 1.00 48.97  ? 135 ALA A C   1 
ATOM   1027 O O   . ALA A 1 143 ? 17.405  1.626   39.008 1.00 46.29  ? 135 ALA A O   1 
ATOM   1028 C CB  . ALA A 1 143 ? 16.760  -1.314  40.418 1.00 52.47  ? 135 ALA A CB  1 
ATOM   1029 N N   . ALA A 1 144 ? 15.869  0.210   38.071 1.00 46.28  ? 136 ALA A N   1 
ATOM   1030 C CA  . ALA A 1 144 ? 15.107  1.149   37.268 1.00 45.20  ? 136 ALA A CA  1 
ATOM   1031 C C   . ALA A 1 144 ? 13.656  0.982   37.691 1.00 45.96  ? 136 ALA A C   1 
ATOM   1032 O O   . ALA A 1 144 ? 13.207  -0.128  37.618 1.00 43.06  ? 136 ALA A O   1 
ATOM   1033 C CB  . ALA A 1 144 ? 15.369  0.787   35.846 1.00 43.25  ? 136 ALA A CB  1 
ATOM   1034 N N   . ASP A 1 145 ? 12.989  2.055   38.149 1.00 40.32  ? 137 ASP A N   1 
ATOM   1035 C CA  . ASP A 1 145 ? 11.569  1.990   38.489 1.00 42.91  ? 137 ASP A CA  1 
ATOM   1036 C C   . ASP A 1 145 ? 10.829  1.624   37.211 1.00 44.02  ? 137 ASP A C   1 
ATOM   1037 O O   . ASP A 1 145 ? 11.278  1.956   36.107 1.00 42.69  ? 137 ASP A O   1 
ATOM   1038 C CB  . ASP A 1 145 ? 11.033  3.262   39.154 1.00 55.27  ? 137 ASP A CB  1 
ATOM   1039 C CG  . ASP A 1 145 ? 11.547  3.511   40.576 1.00 55.46  ? 137 ASP A CG  1 
ATOM   1040 O OD1 . ASP A 1 145 ? 12.374  2.698   41.044 1.00 42.08  ? 137 ASP A OD1 1 
ATOM   1041 O OD2 . ASP A 1 145 ? 11.158  4.557   41.160 1.00 49.19  ? 137 ASP A OD2 1 
ATOM   1042 N N   . TRP A 1 146 ? 9.708   0.953   37.387 1.00 46.91  ? 138 TRP A N   1 
ATOM   1043 C CA  . TRP A 1 146 ? 8.602   1.002   36.414 1.00 47.35  ? 138 TRP A CA  1 
ATOM   1044 C C   . TRP A 1 146 ? 8.480   2.415   35.865 1.00 45.93  ? 138 TRP A C   1 
ATOM   1045 O O   . TRP A 1 146 ? 8.678   3.353   36.618 1.00 48.54  ? 138 TRP A O   1 
ATOM   1046 C CB  . TRP A 1 146 ? 7.326   0.588   37.137 1.00 43.84  ? 138 TRP A CB  1 
ATOM   1047 C CG  . TRP A 1 146 ? 7.146   -0.896  37.176 1.00 42.07  ? 138 TRP A CG  1 
ATOM   1048 C CD1 . TRP A 1 146 ? 7.426   -1.749  38.202 1.00 34.00  ? 138 TRP A CD1 1 
ATOM   1049 C CD2 . TRP A 1 146 ? 6.606   -1.703  36.123 1.00 37.68  ? 138 TRP A CD2 1 
ATOM   1050 N NE1 . TRP A 1 146 ? 7.128   -3.045  37.849 1.00 42.02  ? 138 TRP A NE1 1 
ATOM   1051 C CE2 . TRP A 1 146 ? 6.587   -3.039  36.589 1.00 43.08  ? 138 TRP A CE2 1 
ATOM   1052 C CE3 . TRP A 1 146 ? 6.115   -1.435  34.854 1.00 39.54  ? 138 TRP A CE3 1 
ATOM   1053 C CZ2 . TRP A 1 146 ? 6.063   -4.076  35.825 1.00 45.78  ? 138 TRP A CZ2 1 
ATOM   1054 C CZ3 . TRP A 1 146 ? 5.603   -2.463  34.090 1.00 44.79  ? 138 TRP A CZ3 1 
ATOM   1055 C CH2 . TRP A 1 146 ? 5.600   -3.771  34.562 1.00 44.77  ? 138 TRP A CH2 1 
ATOM   1056 N N   . CYS A 1 147 ? 8.071   2.542   34.612 1.00 54.36  ? 139 CYS A N   1 
ATOM   1057 C CA  . CYS A 1 147 ? 7.964   3.841   33.917 1.00 43.82  ? 139 CYS A CA  1 
ATOM   1058 C C   . CYS A 1 147 ? 6.765   3.898   32.948 1.00 41.86  ? 139 CYS A C   1 
ATOM   1059 O O   . CYS A 1 147 ? 6.568   2.991   32.081 1.00 42.41  ? 139 CYS A O   1 
ATOM   1060 C CB  . CYS A 1 147 ? 9.264   4.071   33.165 1.00 55.10  ? 139 CYS A CB  1 
ATOM   1061 S SG  . CYS A 1 147 ? 9.190   5.610   32.225 1.00 55.90  ? 139 CYS A SG  1 
ATOM   1062 N N   . ARG A 1 148 ? 5.971   4.944   33.080 1.00 39.02  ? 140 ARG A N   1 
ATOM   1063 C CA  . ARG A 1 148 ? 4.819   5.246   32.201 1.00 46.55  ? 140 ARG A CA  1 
ATOM   1064 C C   . ARG A 1 148 ? 5.240   6.281   31.167 1.00 47.23  ? 140 ARG A C   1 
ATOM   1065 O O   . ARG A 1 148 ? 5.629   7.373   31.577 1.00 49.71  ? 140 ARG A O   1 
ATOM   1066 C CB  . ARG A 1 148 ? 3.649   5.800   33.015 1.00 57.40  ? 140 ARG A CB  1 
ATOM   1067 C CG  . ARG A 1 148 ? 2.374   6.066   32.223 1.00 58.37  ? 140 ARG A CG  1 
ATOM   1068 C CD  . ARG A 1 148 ? 1.279   6.539   33.157 1.00 53.59  ? 140 ARG A CD  1 
ATOM   1069 N NE  . ARG A 1 148 ? 0.032   6.678   32.432 1.00 59.86  ? 140 ARG A NE  1 
ATOM   1070 C CZ  . ARG A 1 148 ? -1.172  6.607   32.972 1.00 60.66  ? 140 ARG A CZ  1 
ATOM   1071 N NH1 . ARG A 1 148 ? -2.216  6.779   32.187 1.00 65.58  ? 140 ARG A NH1 1 
ATOM   1072 N NH2 . ARG A 1 148 ? -1.344  6.346   34.264 1.00 66.49  ? 140 ARG A NH2 1 
ATOM   1073 N N   . SER A 1 149 ? 5.126   5.956   29.880 1.00 43.56  ? 141 SER A N   1 
ATOM   1074 C CA  . SER A 1 149 ? 5.365   6.914   28.750 1.00 47.46  ? 141 SER A CA  1 
ATOM   1075 C C   . SER A 1 149 ? 4.043   7.500   28.251 1.00 45.30  ? 141 SER A C   1 
ATOM   1076 O O   . SER A 1 149 ? 3.050   6.825   28.332 1.00 51.79  ? 141 SER A O   1 
ATOM   1077 C CB  . SER A 1 149 ? 6.135   6.242   27.639 1.00 37.80  ? 141 SER A CB  1 
ATOM   1078 O OG  . SER A 1 149 ? 7.395   5.860   28.152 1.00 39.64  ? 141 SER A OG  1 
ATOM   1079 N N   . LYS A 1 150 ? 4.001   8.746   27.800 1.00 49.53  ? 142 LYS A N   1 
ATOM   1080 C CA  . LYS A 1 150 ? 2.766   9.298   27.182 1.00 52.61  ? 142 LYS A CA  1 
ATOM   1081 C C   . LYS A 1 150 ? 3.111   9.573   25.714 1.00 46.21  ? 142 LYS A C   1 
ATOM   1082 O O   . LYS A 1 150 ? 3.996   10.320  25.499 1.00 40.38  ? 142 LYS A O   1 
ATOM   1083 C CB  . LYS A 1 150 ? 2.302   10.492  28.027 1.00 57.23  ? 142 LYS A CB  1 
ATOM   1084 C CG  . LYS A 1 150 ? 1.223   11.443  27.482 1.00 60.45  ? 142 LYS A CG  1 
ATOM   1085 C CD  . LYS A 1 150 ? 1.338   12.816  28.165 1.00 69.17  ? 142 LYS A CD  1 
ATOM   1086 C CE  . LYS A 1 150 ? 0.810   13.999  27.387 1.00 79.48  ? 142 LYS A CE  1 
ATOM   1087 N NZ  . LYS A 1 150 ? -0.557  14.340  27.845 1.00 80.78  ? 142 LYS A NZ  1 
ATOM   1088 N N   . LYS A 1 151 ? 2.448   8.967   24.744 1.00 50.37  ? 143 LYS A N   1 
ATOM   1089 C CA  . LYS A 1 151 ? 2.780   9.205   23.310 1.00 55.71  ? 143 LYS A CA  1 
ATOM   1090 C C   . LYS A 1 151 ? 1.735   10.136  22.661 1.00 63.12  ? 143 LYS A C   1 
ATOM   1091 O O   . LYS A 1 151 ? 0.515   9.862   22.821 1.00 57.39  ? 143 LYS A O   1 
ATOM   1092 C CB  . LYS A 1 151 ? 2.909   7.853   22.603 1.00 51.53  ? 143 LYS A CB  1 
ATOM   1093 C CG  . LYS A 1 151 ? 4.269   7.217   22.823 1.00 54.22  ? 143 LYS A CG  1 
ATOM   1094 C CD  . LYS A 1 151 ? 4.435   5.786   22.315 1.00 57.05  ? 143 LYS A CD  1 
ATOM   1095 C CE  . LYS A 1 151 ? 5.847   5.254   22.497 1.00 55.12  ? 143 LYS A CE  1 
ATOM   1096 N NZ  . LYS A 1 151 ? 6.298   5.228   23.916 1.00 60.50  ? 143 LYS A NZ  1 
ATOM   1097 N N   . THR A 1 152 ? 2.166   11.208  21.970 1.00 52.74  ? 144 THR A N   1 
ATOM   1098 C CA  . THR A 1 152 ? 1.248   12.110  21.231 1.00 49.54  ? 144 THR A CA  1 
ATOM   1099 C C   . THR A 1 152 ? 1.791   12.302  19.822 1.00 53.98  ? 144 THR A C   1 
ATOM   1100 O O   . THR A 1 152 ? 2.987   12.026  19.615 1.00 56.74  ? 144 THR A O   1 
ATOM   1101 C CB  . THR A 1 152 ? 1.007   13.448  21.940 1.00 49.90  ? 144 THR A CB  1 
ATOM   1102 O OG1 . THR A 1 152 ? 2.240   14.116  22.183 1.00 51.95  ? 144 THR A OG1 1 
ATOM   1103 C CG2 . THR A 1 152 ? 0.291   13.291  23.260 1.00 56.28  ? 144 THR A CG2 1 
ATOM   1104 N N   . TYR A 1 153 ? 0.916   12.767  18.928 1.00 52.05  ? 145 TYR A N   1 
ATOM   1105 C CA  . TYR A 1 153 ? 1.038   12.717  17.451 1.00 58.16  ? 145 TYR A CA  1 
ATOM   1106 C C   . TYR A 1 153 ? 0.702   14.119  16.953 1.00 58.48  ? 145 TYR A C   1 
ATOM   1107 O O   . TYR A 1 153 ? -0.406  14.368  16.506 1.00 59.32  ? 145 TYR A O   1 
ATOM   1108 C CB  . TYR A 1 153 ? 0.100   11.676  16.804 1.00 62.16  ? 145 TYR A CB  1 
ATOM   1109 C CG  . TYR A 1 153 ? 0.036   10.284  17.418 1.00 70.34  ? 145 TYR A CG  1 
ATOM   1110 C CD1 . TYR A 1 153 ? -0.655  10.041  18.599 1.00 70.20  ? 145 TYR A CD1 1 
ATOM   1111 C CD2 . TYR A 1 153 ? 0.591   9.177   16.797 1.00 67.00  ? 145 TYR A CD2 1 
ATOM   1112 C CE1 . TYR A 1 153 ? -0.748  8.775   19.162 1.00 69.56  ? 145 TYR A CE1 1 
ATOM   1113 C CE2 . TYR A 1 153 ? 0.484   7.894   17.336 1.00 69.47  ? 145 TYR A CE2 1 
ATOM   1114 C CZ  . TYR A 1 153 ? -0.189  7.682   18.527 1.00 59.40  ? 145 TYR A CZ  1 
ATOM   1115 O OH  . TYR A 1 153 ? -0.322  6.450   19.115 1.00 66.54  ? 145 TYR A OH  1 
ATOM   1116 N N   . PRO A 1 154 ? 1.615   15.098  17.049 1.00 52.64  ? 146 PRO A N   1 
ATOM   1117 C CA  . PRO A 1 154 ? 1.252   16.469  16.690 1.00 50.21  ? 146 PRO A CA  1 
ATOM   1118 C C   . PRO A 1 154 ? 1.003   16.641  15.179 1.00 50.92  ? 146 PRO A C   1 
ATOM   1119 O O   . PRO A 1 154 ? 0.338   17.544  14.842 1.00 55.89  ? 146 PRO A O   1 
ATOM   1120 C CB  . PRO A 1 154 ? 2.486   17.237  17.122 1.00 50.44  ? 146 PRO A CB  1 
ATOM   1121 C CG  . PRO A 1 154 ? 3.597   16.214  16.884 1.00 53.75  ? 146 PRO A CG  1 
ATOM   1122 C CD  . PRO A 1 154 ? 3.018   14.933  17.441 1.00 46.41  ? 146 PRO A CD  1 
ATOM   1123 N N   . ASN A 1 155 ? 1.612   15.822  14.316 1.00 56.79  ? 147 ASN A N   1 
ATOM   1124 C CA  . ASN A 1 155 ? 1.201   15.642  12.905 1.00 48.54  ? 147 ASN A CA  1 
ATOM   1125 C C   . ASN A 1 155 ? 1.397   14.180  12.558 1.00 50.26  ? 147 ASN A C   1 
ATOM   1126 O O   . ASN A 1 155 ? 1.847   13.397  13.418 1.00 52.34  ? 147 ASN A O   1 
ATOM   1127 C CB  . ASN A 1 155 ? 1.986   16.521  11.944 1.00 52.21  ? 147 ASN A CB  1 
ATOM   1128 C CG  . ASN A 1 155 ? 3.427   16.083  11.809 1.00 59.59  ? 147 ASN A CG  1 
ATOM   1129 O OD1 . ASN A 1 155 ? 3.740   14.903  11.653 1.00 56.55  ? 147 ASN A OD1 1 
ATOM   1130 N ND2 . ASN A 1 155 ? 4.333   17.037  11.903 1.00 58.82  ? 147 ASN A ND2 1 
ATOM   1131 N N   . ASP A 1 156 ? 1.246   13.858  11.287 1.00 52.35  ? 148 ASP A N   1 
ATOM   1132 C CA  . ASP A 1 156 ? 1.124   12.457  10.840 1.00 47.36  ? 148 ASP A CA  1 
ATOM   1133 C C   . ASP A 1 156 ? 2.481   11.817  10.600 1.00 43.06  ? 148 ASP A C   1 
ATOM   1134 O O   . ASP A 1 156 ? 2.522   10.558  10.282 1.00 49.09  ? 148 ASP A O   1 
ATOM   1135 C CB  . ASP A 1 156 ? 0.300   12.365  9.563  1.00 51.96  ? 148 ASP A CB  1 
ATOM   1136 C CG  . ASP A 1 156 ? 0.875   13.073  8.348  1.00 51.20  ? 148 ASP A CG  1 
ATOM   1137 O OD1 . ASP A 1 156 ? 1.998   13.681  8.413  1.00 58.93  ? 148 ASP A OD1 1 
ATOM   1138 O OD2 . ASP A 1 156 ? 0.139   13.066  7.359  1.00 51.55  ? 148 ASP A OD2 1 
ATOM   1139 N N   . LYS A 1 157 ? 3.561   12.575  10.707 1.00 45.72  ? 149 LYS A N   1 
ATOM   1140 C CA  . LYS A 1 157 ? 4.894   11.958  10.522 1.00 52.59  ? 149 LYS A CA  1 
ATOM   1141 C C   . LYS A 1 157 ? 5.666   12.013  11.828 1.00 54.95  ? 149 LYS A C   1 
ATOM   1142 O O   . LYS A 1 157 ? 6.858   11.674  11.810 1.00 60.80  ? 149 LYS A O   1 
ATOM   1143 C CB  . LYS A 1 157 ? 5.619   12.650  9.373  1.00 50.27  ? 149 LYS A CB  1 
ATOM   1144 C CG  . LYS A 1 157 ? 5.065   12.307  8.004  1.00 61.16  ? 149 LYS A CG  1 
ATOM   1145 C CD  . LYS A 1 157 ? 5.617   13.244  6.962  1.00 64.20  ? 149 LYS A CD  1 
ATOM   1146 C CE  . LYS A 1 157 ? 4.694   13.433  5.795  1.00 67.59  ? 149 LYS A CE  1 
ATOM   1147 N NZ  . LYS A 1 157 ? 5.463   13.269  4.540  1.00 88.60  ? 149 LYS A NZ  1 
ATOM   1148 N N   . THR A 1 158 ? 5.051   12.462  12.916 1.00 57.48  ? 150 THR A N   1 
ATOM   1149 C CA  . THR A 1 158 ? 5.806   12.612  14.176 1.00 54.15  ? 150 THR A CA  1 
ATOM   1150 C C   . THR A 1 158 ? 5.050   11.967  15.302 1.00 55.63  ? 150 THR A C   1 
ATOM   1151 O O   . THR A 1 158 ? 3.822   12.013  15.267 1.00 55.23  ? 150 THR A O   1 
ATOM   1152 C CB  . THR A 1 158 ? 5.994   14.057  14.620 1.00 57.96  ? 150 THR A CB  1 
ATOM   1153 O OG1 . THR A 1 158 ? 6.450   14.718  13.450 1.00 64.33  ? 150 THR A OG1 1 
ATOM   1154 C CG2 . THR A 1 158 ? 6.997   14.216  15.738 1.00 60.29  ? 150 THR A CG2 1 
ATOM   1155 N N   . ILE A 1 159 ? 5.801   11.449  16.263 1.00 51.58  ? 151 ILE A N   1 
ATOM   1156 C CA  . ILE A 1 159 ? 5.284   11.101  17.604 1.00 50.10  ? 151 ILE A CA  1 
ATOM   1157 C C   . ILE A 1 159 ? 6.225   11.747  18.588 1.00 45.51  ? 151 ILE A C   1 
ATOM   1158 O O   . ILE A 1 159 ? 7.426   11.722  18.348 1.00 53.80  ? 151 ILE A O   1 
ATOM   1159 C CB  . ILE A 1 159 ? 5.176   9.572   17.742 1.00 47.97  ? 151 ILE A CB  1 
ATOM   1160 C CG1 . ILE A 1 159 ? 4.078   9.047   16.824 1.00 49.06  ? 151 ILE A CG1 1 
ATOM   1161 C CG2 . ILE A 1 159 ? 4.970   9.117   19.179 1.00 47.88  ? 151 ILE A CG2 1 
ATOM   1162 C CD1 . ILE A 1 159 ? 4.217   7.581   16.573 1.00 59.93  ? 151 ILE A CD1 1 
ATOM   1163 N N   . ILE A 1 160 ? 5.653   12.290  19.642 1.00 42.66  ? 152 ILE A N   1 
ATOM   1164 C CA  . ILE A 1 160 ? 6.380   12.642  20.890 1.00 44.93  ? 152 ILE A CA  1 
ATOM   1165 C C   . ILE A 1 160 ? 5.995   11.702  22.039 1.00 46.51  ? 152 ILE A C   1 
ATOM   1166 O O   . ILE A 1 160 ? 4.804   11.563  22.378 1.00 51.39  ? 152 ILE A O   1 
ATOM   1167 C CB  . ILE A 1 160 ? 6.005   14.068  21.273 1.00 52.49  ? 152 ILE A CB  1 
ATOM   1168 C CG1 . ILE A 1 160 ? 6.123   15.033  20.073 1.00 58.35  ? 152 ILE A CG1 1 
ATOM   1169 C CG2 . ILE A 1 160 ? 6.793   14.454  22.516 1.00 46.93  ? 152 ILE A CG2 1 
ATOM   1170 C CD1 . ILE A 1 160 ? 7.523   15.207  19.466 1.00 61.49  ? 152 ILE A CD1 1 
ATOM   1171 N N   . SER A 1 161 ? 7.000   11.168  22.689 1.00 45.59  ? 153 SER A N   1 
ATOM   1172 C CA  . SER A 1 161 ? 6.927   10.396  23.946 1.00 46.07  ? 153 SER A CA  1 
ATOM   1173 C C   . SER A 1 161 ? 7.695   11.122  25.054 1.00 44.04  ? 153 SER A C   1 
ATOM   1174 O O   . SER A 1 161 ? 8.925   11.320  24.895 1.00 47.71  ? 153 SER A O   1 
ATOM   1175 C CB  . SER A 1 161 ? 7.524   9.013   23.777 1.00 40.75  ? 153 SER A CB  1 
ATOM   1176 O OG  . SER A 1 161 ? 7.884   8.471   25.048 1.00 48.60  ? 153 SER A OG  1 
ATOM   1177 N N   . THR A 1 162 ? 7.041   11.316  26.191 1.00 40.31  ? 154 THR A N   1 
ATOM   1178 C CA  . THR A 1 162 ? 7.656   11.941  27.386 1.00 44.60  ? 154 THR A CA  1 
ATOM   1179 C C   . THR A 1 162 ? 7.495   11.031  28.584 1.00 41.84  ? 154 THR A C   1 
ATOM   1180 O O   . THR A 1 162 ? 6.486   10.319  28.692 1.00 41.95  ? 154 THR A O   1 
ATOM   1181 C CB  . THR A 1 162 ? 6.992   13.276  27.680 1.00 42.57  ? 154 THR A CB  1 
ATOM   1182 O OG1 . THR A 1 162 ? 5.642   12.893  27.855 1.00 48.34  ? 154 THR A OG1 1 
ATOM   1183 C CG2 . THR A 1 162 ? 7.080   14.271  26.542 1.00 47.34  ? 154 THR A CG2 1 
ATOM   1184 N N   . PHE A 1 163 ? 8.449   11.047  29.478 1.00 43.32  ? 155 PHE A N   1 
ATOM   1185 C CA  . PHE A 1 163 ? 8.264   10.303  30.742 1.00 44.22  ? 155 PHE A CA  1 
ATOM   1186 C C   . PHE A 1 163 ? 9.213   10.809  31.799 1.00 45.91  ? 155 PHE A C   1 
ATOM   1187 O O   . PHE A 1 163 ? 10.253  11.448  31.474 1.00 46.54  ? 155 PHE A O   1 
ATOM   1188 C CB  . PHE A 1 163 ? 8.569   8.822   30.544 1.00 44.13  ? 155 PHE A CB  1 
ATOM   1189 C CG  . PHE A 1 163 ? 9.837   8.515   29.777 1.00 46.97  ? 155 PHE A CG  1 
ATOM   1190 C CD1 . PHE A 1 163 ? 11.027  8.369   30.446 1.00 43.46  ? 155 PHE A CD1 1 
ATOM   1191 C CD2 . PHE A 1 163 ? 9.815   8.310   28.396 1.00 54.60  ? 155 PHE A CD2 1 
ATOM   1192 C CE1 . PHE A 1 163 ? 12.191  8.074   29.750 1.00 52.68  ? 155 PHE A CE1 1 
ATOM   1193 C CE2 . PHE A 1 163 ? 10.970  8.007   27.695 1.00 50.77  ? 155 PHE A CE2 1 
ATOM   1194 C CZ  . PHE A 1 163 ? 12.161  7.902   28.379 1.00 54.92  ? 155 PHE A CZ  1 
ATOM   1195 N N   . LYS A 1 164 ? 8.843   10.494  33.025 1.00 43.98  ? 156 LYS A N   1 
ATOM   1196 C CA  . LYS A 1 164 ? 9.682   10.701  34.218 1.00 52.79  ? 156 LYS A CA  1 
ATOM   1197 C C   . LYS A 1 164 ? 10.467  9.398   34.358 1.00 51.85  ? 156 LYS A C   1 
ATOM   1198 O O   . LYS A 1 164 ? 9.902   8.310   34.139 1.00 50.44  ? 156 LYS A O   1 
ATOM   1199 C CB  . LYS A 1 164 ? 8.782   11.152  35.383 1.00 53.42  ? 156 LYS A CB  1 
ATOM   1200 C CG  . LYS A 1 164 ? 8.036   12.486  35.156 1.00 59.88  ? 156 LYS A CG  1 
ATOM   1201 C CD  . LYS A 1 164 ? 7.119   12.980  36.322 1.00 62.78  ? 156 LYS A CD  1 
ATOM   1202 C CE  . LYS A 1 164 ? 7.186   14.459  36.674 1.00 50.91  ? 156 LYS A CE  1 
ATOM   1203 N N   . TRP A 1 165 ? 11.751  9.469   34.662 1.00 54.46  ? 157 TRP A N   1 
ATOM   1204 C CA  . TRP A 1 165 ? 12.546  8.236   34.878 1.00 49.59  ? 157 TRP A CA  1 
ATOM   1205 C C   . TRP A 1 165 ? 13.142  8.190   36.292 1.00 48.96  ? 157 TRP A C   1 
ATOM   1206 O O   . TRP A 1 165 ? 13.472  9.226   36.827 1.00 37.25  ? 157 TRP A O   1 
ATOM   1207 C CB  . TRP A 1 165 ? 13.628  8.153   33.811 1.00 53.01  ? 157 TRP A CB  1 
ATOM   1208 C CG  . TRP A 1 165 ? 14.478  6.937   33.963 1.00 48.69  ? 157 TRP A CG  1 
ATOM   1209 C CD1 . TRP A 1 165 ? 15.675  6.833   34.607 1.00 45.64  ? 157 TRP A CD1 1 
ATOM   1210 C CD2 . TRP A 1 165 ? 14.194  5.640   33.415 1.00 42.61  ? 157 TRP A CD2 1 
ATOM   1211 N NE1 . TRP A 1 165 ? 16.156  5.549   34.492 1.00 42.67  ? 157 TRP A NE1 1 
ATOM   1212 C CE2 . TRP A 1 165 ? 15.247  4.787   33.805 1.00 39.40  ? 157 TRP A CE2 1 
ATOM   1213 C CE3 . TRP A 1 165 ? 13.156  5.120   32.636 1.00 45.88  ? 157 TRP A CE3 1 
ATOM   1214 C CZ2 . TRP A 1 165 ? 15.284  3.441   33.447 1.00 43.24  ? 157 TRP A CZ2 1 
ATOM   1215 C CZ3 . TRP A 1 165 ? 13.183  3.783   32.318 1.00 42.76  ? 157 TRP A CZ3 1 
ATOM   1216 C CH2 . TRP A 1 165 ? 14.225  2.956   32.727 1.00 38.11  ? 157 TRP A CH2 1 
ATOM   1217 N N   . SER A 1 166 ? 13.380  7.006   36.848 1.00 50.93  ? 158 SER A N   1 
ATOM   1218 C CA  . SER A 1 166 ? 14.049  6.901   38.162 1.00 47.44  ? 158 SER A CA  1 
ATOM   1219 C C   . SER A 1 166 ? 14.919  5.649   38.270 1.00 41.73  ? 158 SER A C   1 
ATOM   1220 O O   . SER A 1 166 ? 14.415  4.560   38.083 1.00 41.04  ? 158 SER A O   1 
ATOM   1221 C CB  . SER A 1 166 ? 13.029  6.997   39.246 1.00 57.26  ? 158 SER A CB  1 
ATOM   1222 O OG  . SER A 1 166 ? 13.586  7.705   40.333 1.00 67.57  ? 158 SER A OG  1 
ATOM   1223 N N   . TYR A 1 167 ? 16.194  5.802   38.631 1.00 47.90  ? 159 TYR A N   1 
ATOM   1224 C CA  . TYR A 1 167 ? 17.076  4.681   39.067 1.00 44.65  ? 159 TYR A CA  1 
ATOM   1225 C C   . TYR A 1 167 ? 17.076  4.605   40.586 1.00 44.59  ? 159 TYR A C   1 
ATOM   1226 O O   . TYR A 1 167 ? 16.813  5.606   41.265 1.00 41.71  ? 159 TYR A O   1 
ATOM   1227 C CB  . TYR A 1 167 ? 18.541  4.852   38.638 1.00 49.29  ? 159 TYR A CB  1 
ATOM   1228 C CG  . TYR A 1 167 ? 18.779  5.028   37.154 1.00 50.73  ? 159 TYR A CG  1 
ATOM   1229 C CD1 . TYR A 1 167 ? 18.924  3.946   36.294 1.00 54.25  ? 159 TYR A CD1 1 
ATOM   1230 C CD2 . TYR A 1 167 ? 18.906  6.294   36.603 1.00 47.23  ? 159 TYR A CD2 1 
ATOM   1231 C CE1 . TYR A 1 167 ? 19.203  4.110   34.933 1.00 57.90  ? 159 TYR A CE1 1 
ATOM   1232 C CE2 . TYR A 1 167 ? 19.166  6.479   35.253 1.00 56.37  ? 159 TYR A CE2 1 
ATOM   1233 C CZ  . TYR A 1 167 ? 19.309  5.390   34.406 1.00 55.33  ? 159 TYR A CZ  1 
ATOM   1234 O OH  . TYR A 1 167 ? 19.570  5.634   33.089 1.00 50.88  ? 159 TYR A OH  1 
ATOM   1235 N N   . THR A 1 168 ? 17.338  3.419   41.104 1.00 49.44  ? 160 THR A N   1 
ATOM   1236 C CA  . THR A 1 168 ? 17.639  3.240   42.537 1.00 61.82  ? 160 THR A CA  1 
ATOM   1237 C C   . THR A 1 168 ? 19.158  3.275   42.624 1.00 59.78  ? 160 THR A C   1 
ATOM   1238 O O   . THR A 1 168 ? 19.782  2.706   41.751 1.00 61.00  ? 160 THR A O   1 
ATOM   1239 C CB  . THR A 1 168 ? 17.025  1.943   43.092 1.00 62.79  ? 160 THR A CB  1 
ATOM   1240 O OG1 . THR A 1 168 ? 15.605  2.087   43.099 1.00 70.55  ? 160 THR A OG1 1 
ATOM   1241 C CG2 . THR A 1 168 ? 17.492  1.635   44.498 1.00 67.15  ? 160 THR A CG2 1 
ATOM   1242 N N   . THR A 1 169 ? 19.732  3.873   43.651 1.00 62.92  ? 161 THR A N   1 
ATOM   1243 C CA  . THR A 1 169 ? 21.196  3.814   43.875 1.00 75.19  ? 161 THR A CA  1 
ATOM   1244 C C   . THR A 1 169 ? 21.631  2.604   44.696 1.00 87.05  ? 161 THR A C   1 
ATOM   1245 O O   . THR A 1 169 ? 20.788  1.719   44.970 1.00 87.59  ? 161 THR A O   1 
ATOM   1246 C CB  . THR A 1 169 ? 21.655  4.914   44.814 1.00 80.50  ? 161 THR A CB  1 
ATOM   1247 O OG1 . THR A 1 169 ? 21.103  4.391   46.030 1.00 67.70  ? 161 THR A OG1 1 
ATOM   1248 C CG2 . THR A 1 169 ? 21.172  6.276   44.369 1.00 67.17  ? 161 THR A CG2 1 
ATOM   1249 N N   . GLY A 1 170 ? 22.903  2.628   45.117 1.00 91.31  ? 162 GLY A N   1 
ATOM   1250 C CA  . GLY A 1 170 ? 23.398  1.887   46.288 1.00 89.79  ? 162 GLY A CA  1 
ATOM   1251 C C   . GLY A 1 170 ? 22.356  1.854   47.413 1.00 84.22  ? 162 GLY A C   1 
ATOM   1252 O O   . GLY A 1 170 ? 21.856  0.779   47.677 1.00 71.01  ? 162 GLY A O   1 
ATOM   1253 N N   . ASN A 1 171 ? 21.990  2.969   48.064 1.00 76.00  ? 163 ASN A N   1 
ATOM   1254 C CA  . ASN A 1 171 ? 21.478  2.895   49.468 1.00 82.53  ? 163 ASN A CA  1 
ATOM   1255 C C   . ASN A 1 171 ? 19.961  2.851   49.567 1.00 82.17  ? 163 ASN A C   1 
ATOM   1256 O O   . ASN A 1 171 ? 19.476  2.961   50.694 1.00 86.34  ? 163 ASN A O   1 
ATOM   1257 C CB  . ASN A 1 171 ? 21.929  4.078   50.316 1.00 92.71  ? 163 ASN A CB  1 
ATOM   1258 C CG  . ASN A 1 171 ? 23.422  4.276   50.229 1.00 104.72 ? 163 ASN A CG  1 
ATOM   1259 O OD1 . ASN A 1 171 ? 24.148  3.369   49.818 1.00 109.97 ? 163 ASN A OD1 1 
ATOM   1260 N ND2 . ASN A 1 171 ? 23.880  5.463   50.579 1.00 107.42 ? 163 ASN A ND2 1 
ATOM   1261 N N   . GLY A 1 172 ? 19.241  2.674   48.461 1.00 82.46  ? 164 GLY A N   1 
ATOM   1262 C CA  . GLY A 1 172 ? 17.769  2.756   48.463 1.00 73.46  ? 164 GLY A CA  1 
ATOM   1263 C C   . GLY A 1 172 ? 17.306  4.166   48.148 1.00 72.87  ? 164 GLY A C   1 
ATOM   1264 O O   . GLY A 1 172 ? 16.076  4.341   48.155 1.00 70.80  ? 164 GLY A O   1 
ATOM   1265 N N   . LYS A 1 173 ? 18.250  5.097   47.855 1.00 63.52  ? 165 LYS A N   1 
ATOM   1266 C CA  . LYS A 1 173 ? 18.021  6.477   47.341 1.00 58.01  ? 165 LYS A CA  1 
ATOM   1267 C C   . LYS A 1 173 ? 17.670  6.427   45.826 1.00 66.71  ? 165 LYS A C   1 
ATOM   1268 O O   . LYS A 1 173 ? 17.792  5.368   45.180 1.00 61.15  ? 165 LYS A O   1 
ATOM   1269 C CB  . LYS A 1 173 ? 19.249  7.333   47.680 1.00 54.85  ? 165 LYS A CB  1 
ATOM   1270 N N   . ARG A 1 174 ? 17.201  7.534   45.257 1.00 74.43  ? 166 ARG A N   1 
ATOM   1271 C CA  . ARG A 1 174 ? 16.638  7.608   43.873 1.00 77.23  ? 166 ARG A CA  1 
ATOM   1272 C C   . ARG A 1 174 ? 17.379  8.691   43.051 1.00 79.37  ? 166 ARG A C   1 
ATOM   1273 O O   . ARG A 1 174 ? 17.534  9.819   43.556 1.00 74.70  ? 166 ARG A O   1 
ATOM   1274 C CB  . ARG A 1 174 ? 15.134  7.908   43.971 1.00 76.72  ? 166 ARG A CB  1 
ATOM   1275 C CG  . ARG A 1 174 ? 14.213  6.691   44.044 1.00 85.22  ? 166 ARG A CG  1 
ATOM   1276 C CD  . ARG A 1 174 ? 12.767  7.064   44.374 1.00 90.98  ? 166 ARG A CD  1 
ATOM   1277 N NE  . ARG A 1 174 ? 12.321  8.367   43.859 1.00 98.24  ? 166 ARG A NE  1 
ATOM   1278 C CZ  . ARG A 1 174 ? 11.677  8.582   42.700 1.00 99.32  ? 166 ARG A CZ  1 
ATOM   1279 N NH1 . ARG A 1 174 ? 11.375  7.573   41.900 1.00 116.84 ? 166 ARG A NH1 1 
ATOM   1280 N NH2 . ARG A 1 174 ? 11.327  9.809   42.342 1.00 83.97  ? 166 ARG A NH2 1 
ATOM   1281 N N   . TYR A 1 175 ? 17.805  8.404   41.812 1.00 72.44  ? 167 TYR A N   1 
ATOM   1282 C CA  . TYR A 1 175 ? 18.416  9.399   40.875 1.00 60.95  ? 167 TYR A CA  1 
ATOM   1283 C C   . TYR A 1 175 ? 17.522  9.601   39.643 1.00 53.74  ? 167 TYR A C   1 
ATOM   1284 O O   . TYR A 1 175 ? 17.385  8.659   38.842 1.00 61.80  ? 167 TYR A O   1 
ATOM   1285 C CB  . TYR A 1 175 ? 19.801  8.881   40.483 1.00 68.50  ? 167 TYR A CB  1 
ATOM   1286 C CG  . TYR A 1 175 ? 20.562  9.758   39.524 1.00 62.28  ? 167 TYR A CG  1 
ATOM   1287 C CD1 . TYR A 1 175 ? 20.832  11.087  39.814 1.00 55.90  ? 167 TYR A CD1 1 
ATOM   1288 C CD2 . TYR A 1 175 ? 21.002  9.254   38.316 1.00 61.18  ? 167 TYR A CD2 1 
ATOM   1289 C CE1 . TYR A 1 175 ? 21.535  11.888  38.930 1.00 56.21  ? 167 TYR A CE1 1 
ATOM   1290 C CE2 . TYR A 1 175 ? 21.703  10.036  37.419 1.00 62.46  ? 167 TYR A CE2 1 
ATOM   1291 C CZ  . TYR A 1 175 ? 21.983  11.354  37.727 1.00 61.61  ? 167 TYR A CZ  1 
ATOM   1292 O OH  . TYR A 1 175 ? 22.668  12.096  36.807 1.00 56.23  ? 167 TYR A OH  1 
ATOM   1293 N N   . ARG A 1 176 ? 16.887  10.768  39.511 1.00 60.22  ? 168 ARG A N   1 
ATOM   1294 C CA  . ARG A 1 176 ? 15.774  11.002  38.561 1.00 52.79  ? 168 ARG A CA  1 
ATOM   1295 C C   . ARG A 1 176 ? 16.262  11.696  37.290 1.00 56.79  ? 168 ARG A C   1 
ATOM   1296 O O   . ARG A 1 176 ? 17.346  12.351  37.301 1.00 42.64  ? 168 ARG A O   1 
ATOM   1297 C CB  . ARG A 1 176 ? 14.680  11.903  39.138 1.00 69.62  ? 168 ARG A CB  1 
ATOM   1298 C CG  . ARG A 1 176 ? 13.585  11.181  39.916 1.00 76.36  ? 168 ARG A CG  1 
ATOM   1299 C CD  . ARG A 1 176 ? 13.267  11.987  41.159 1.00 77.41  ? 168 ARG A CD  1 
ATOM   1300 N NE  . ARG A 1 176 ? 14.456  11.974  42.011 1.00 93.91  ? 168 ARG A NE  1 
ATOM   1301 C CZ  . ARG A 1 176 ? 14.492  12.126  43.342 1.00 90.15  ? 168 ARG A CZ  1 
ATOM   1302 N NH1 . ARG A 1 176 ? 13.390  12.314  44.048 1.00 79.11  ? 168 ARG A NH1 1 
ATOM   1303 N NH2 . ARG A 1 176 ? 15.656  12.066  43.968 1.00 86.71  ? 168 ARG A NH2 1 
ATOM   1304 N N   . SER A 1 177 ? 15.410  11.619  36.272 1.00 51.01  ? 169 SER A N   1 
ATOM   1305 C CA  . SER A 1 177 ? 15.537  12.314  34.971 1.00 50.76  ? 169 SER A CA  1 
ATOM   1306 C C   . SER A 1 177 ? 14.149  12.487  34.338 1.00 54.73  ? 169 SER A C   1 
ATOM   1307 O O   . SER A 1 177 ? 13.125  12.017  34.893 1.00 62.42  ? 169 SER A O   1 
ATOM   1308 C CB  . SER A 1 177 ? 16.525  11.617  34.068 1.00 50.72  ? 169 SER A CB  1 
ATOM   1309 O OG  . SER A 1 177 ? 16.306  10.200  33.899 1.00 49.49  ? 169 SER A OG  1 
ATOM   1310 N N   . THR A 1 178 ? 14.104  13.234  33.254 1.00 46.96  ? 170 THR A N   1 
ATOM   1311 C CA  . THR A 1 178 ? 12.913  13.447  32.402 1.00 44.72  ? 170 THR A CA  1 
ATOM   1312 C C   . THR A 1 178 ? 13.423  13.348  30.964 1.00 42.48  ? 170 THR A C   1 
ATOM   1313 O O   . THR A 1 178 ? 14.608  13.456  30.727 1.00 48.12  ? 170 THR A O   1 
ATOM   1314 C CB  . THR A 1 178 ? 12.220  14.759  32.789 1.00 49.10  ? 170 THR A CB  1 
ATOM   1315 O OG1 . THR A 1 178 ? 13.143  15.754  32.383 1.00 63.37  ? 170 THR A OG1 1 
ATOM   1316 C CG2 . THR A 1 178 ? 11.959  14.942  34.276 1.00 54.90  ? 170 THR A CG2 1 
ATOM   1317 N N   . ALA A 1 179 ? 12.550  13.117  30.019 1.00 42.35  ? 171 ALA A N   1 
ATOM   1318 C CA  . ALA A 1 179 ? 12.948  12.529  28.738 1.00 41.50  ? 171 ALA A CA  1 
ATOM   1319 C C   . ALA A 1 179 ? 11.893  12.995  27.803 1.00 36.90  ? 171 ALA A C   1 
ATOM   1320 O O   . ALA A 1 179 ? 10.801  13.152  28.190 1.00 38.91  ? 171 ALA A O   1 
ATOM   1321 C CB  . ALA A 1 179 ? 13.067  11.001  28.747 1.00 38.84  ? 171 ALA A CB  1 
ATOM   1322 N N   . ARG A 1 180 ? 12.306  13.286  26.613 1.00 41.24  ? 172 ARG A N   1 
ATOM   1323 C CA  . ARG A 1 180 ? 11.373  13.612  25.530 1.00 39.82  ? 172 ARG A CA  1 
ATOM   1324 C C   . ARG A 1 180 ? 11.966  12.894  24.338 1.00 39.05  ? 172 ARG A C   1 
ATOM   1325 O O   . ARG A 1 180 ? 13.205  12.904  24.180 1.00 38.82  ? 172 ARG A O   1 
ATOM   1326 C CB  . ARG A 1 180 ? 11.363  15.128  25.319 1.00 47.96  ? 172 ARG A CB  1 
ATOM   1327 C CG  . ARG A 1 180 ? 10.545  15.579  24.122 1.00 53.73  ? 172 ARG A CG  1 
ATOM   1328 C CD  . ARG A 1 180 ? 10.911  16.990  23.754 1.00 59.36  ? 172 ARG A CD  1 
ATOM   1329 N NE  . ARG A 1 180 ? 9.977   17.398  22.735 1.00 60.80  ? 172 ARG A NE  1 
ATOM   1330 C CZ  . ARG A 1 180 ? 8.754   17.863  22.981 1.00 61.50  ? 172 ARG A CZ  1 
ATOM   1331 N NH1 . ARG A 1 180 ? 8.317   18.004  24.226 1.00 57.57  ? 172 ARG A NH1 1 
ATOM   1332 N NH2 . ARG A 1 180 ? 7.981   18.178  21.953 1.00 62.16  ? 172 ARG A NH2 1 
ATOM   1333 N N   . THR A 1 181 ? 11.145  12.189  23.616 1.00 36.60  ? 173 THR A N   1 
ATOM   1334 C CA  . THR A 1 181 ? 11.664  11.357  22.544 1.00 41.82  ? 173 THR A CA  1 
ATOM   1335 C C   . THR A 1 181 ? 10.838  11.761  21.351 1.00 34.14  ? 173 THR A C   1 
ATOM   1336 O O   . THR A 1 181 ? 9.623   11.828  21.523 1.00 34.79  ? 173 THR A O   1 
ATOM   1337 C CB  . THR A 1 181 ? 11.558  9.831   22.828 1.00 46.74  ? 173 THR A CB  1 
ATOM   1338 O OG1 . THR A 1 181 ? 12.250  9.378   24.003 1.00 45.92  ? 173 THR A OG1 1 
ATOM   1339 C CG2 . THR A 1 181 ? 12.097  9.082   21.625 1.00 42.78  ? 173 THR A CG2 1 
ATOM   1340 N N   . THR A 1 182 ? 11.460  11.816  20.193 1.00 32.63  ? 174 THR A N   1 
ATOM   1341 C CA  . THR A 1 182 ? 10.819  12.301  18.951 1.00 38.33  ? 174 THR A CA  1 
ATOM   1342 C C   . THR A 1 182 ? 11.044  11.264  17.865 1.00 31.63  ? 174 THR A C   1 
ATOM   1343 O O   . THR A 1 182 ? 12.216  10.923  17.579 1.00 35.81  ? 174 THR A O   1 
ATOM   1344 C CB  . THR A 1 182 ? 11.395  13.679  18.586 1.00 41.14  ? 174 THR A CB  1 
ATOM   1345 O OG1 . THR A 1 182 ? 11.185  14.592  19.670 1.00 43.11  ? 174 THR A OG1 1 
ATOM   1346 C CG2 . THR A 1 182 ? 10.781  14.223  17.317 1.00 44.15  ? 174 THR A CG2 1 
ATOM   1347 N N   . TYR A 1 183 ? 9.965   10.712  17.367 1.00 42.64  ? 175 TYR A N   1 
ATOM   1348 C CA  . TYR A 1 183 ? 9.958   9.727   16.272 1.00 47.50  ? 175 TYR A CA  1 
ATOM   1349 C C   . TYR A 1 183 ? 9.544   10.429  14.993 1.00 47.16  ? 175 TYR A C   1 
ATOM   1350 O O   . TYR A 1 183 ? 8.506   11.116  14.993 1.00 47.85  ? 175 TYR A O   1 
ATOM   1351 C CB  . TYR A 1 183 ? 8.956   8.597   16.548 1.00 53.57  ? 175 TYR A CB  1 
ATOM   1352 C CG  . TYR A 1 183 ? 9.262   7.899   17.837 1.00 48.71  ? 175 TYR A CG  1 
ATOM   1353 C CD1 . TYR A 1 183 ? 10.141  6.822   17.842 1.00 56.20  ? 175 TYR A CD1 1 
ATOM   1354 C CD2 . TYR A 1 183 ? 8.757   8.365   19.043 1.00 42.52  ? 175 TYR A CD2 1 
ATOM   1355 C CE1 . TYR A 1 183 ? 10.502  6.183   19.014 1.00 53.84  ? 175 TYR A CE1 1 
ATOM   1356 C CE2 . TYR A 1 183 ? 9.116   7.747   20.234 1.00 50.77  ? 175 TYR A CE2 1 
ATOM   1357 C CZ  . TYR A 1 183 ? 9.997   6.663   20.210 1.00 56.38  ? 175 TYR A CZ  1 
ATOM   1358 O OH  . TYR A 1 183 ? 10.387  6.052   21.356 1.00 53.87  ? 175 TYR A OH  1 
ATOM   1359 N N   . THR A 1 184 ? 10.297  10.189  13.936 1.00 44.41  ? 176 THR A N   1 
ATOM   1360 C CA  . THR A 1 184 ? 10.145  10.892  12.634 1.00 49.39  ? 176 THR A CA  1 
ATOM   1361 C C   . THR A 1 184 ? 10.021  9.806   11.576 1.00 41.26  ? 176 THR A C   1 
ATOM   1362 O O   . THR A 1 184 ? 11.036  9.124   11.327 1.00 45.68  ? 176 THR A O   1 
ATOM   1363 C CB  . THR A 1 184 ? 11.300  11.893  12.384 1.00 52.18  ? 176 THR A CB  1 
ATOM   1364 O OG1 . THR A 1 184 ? 11.298  12.833  13.472 1.00 44.49  ? 176 THR A OG1 1 
ATOM   1365 C CG2 . THR A 1 184 ? 11.196  12.611  11.046 1.00 44.04  ? 176 THR A CG2 1 
ATOM   1366 N N   . PHE A 1 185 ? 8.806   9.646   11.058 1.00 42.83  ? 177 PHE A N   1 
ATOM   1367 C CA  . PHE A 1 185 ? 8.372   8.628   10.076 1.00 50.91  ? 177 PHE A CA  1 
ATOM   1368 C C   . PHE A 1 185 ? 8.450   9.201   8.661  1.00 52.54  ? 177 PHE A C   1 
ATOM   1369 O O   . PHE A 1 185 ? 7.932   10.350  8.402  1.00 50.75  ? 177 PHE A O   1 
ATOM   1370 C CB  . PHE A 1 185 ? 6.913   8.225   10.327 1.00 44.16  ? 177 PHE A CB  1 
ATOM   1371 C CG  . PHE A 1 185 ? 6.729   7.435   11.596 1.00 52.11  ? 177 PHE A CG  1 
ATOM   1372 C CD1 . PHE A 1 185 ? 6.740   8.085   12.829 1.00 39.97  ? 177 PHE A CD1 1 
ATOM   1373 C CD2 . PHE A 1 185 ? 6.574   6.040   11.568 1.00 48.56  ? 177 PHE A CD2 1 
ATOM   1374 C CE1 . PHE A 1 185 ? 6.584   7.365   14.009 1.00 45.52  ? 177 PHE A CE1 1 
ATOM   1375 C CE2 . PHE A 1 185 ? 6.421   5.328   12.760 1.00 46.20  ? 177 PHE A CE2 1 
ATOM   1376 C CZ  . PHE A 1 185 ? 6.438   5.986   13.976 1.00 42.87  ? 177 PHE A CZ  1 
ATOM   1377 N N   . ALA A 1 186 ? 8.964   8.374   7.763  1.00 48.96  ? 178 ALA A N   1 
ATOM   1378 C CA  . ALA A 1 186 ? 9.130   8.710   6.332  1.00 57.26  ? 178 ALA A CA  1 
ATOM   1379 C C   . ALA A 1 186 ? 7.728   8.758   5.682  1.00 49.66  ? 178 ALA A C   1 
ATOM   1380 O O   . ALA A 1 186 ? 7.453   9.673   4.874  1.00 61.76  ? 178 ALA A O   1 
ATOM   1381 C CB  . ALA A 1 186 ? 10.122  7.736   5.706  1.00 59.72  ? 178 ALA A CB  1 
ATOM   1382 N N   . LYS A 1 187 ? 6.810   7.883   6.073  1.00 50.60  ? 179 LYS A N   1 
ATOM   1383 C CA  . LYS A 1 187 ? 5.411   7.893   5.554  1.00 50.64  ? 179 LYS A CA  1 
ATOM   1384 C C   . LYS A 1 187 ? 4.446   8.380   6.617  1.00 52.35  ? 179 LYS A C   1 
ATOM   1385 O O   . LYS A 1 187 ? 4.723   8.223   7.801  1.00 56.10  ? 179 LYS A O   1 
ATOM   1386 C CB  . LYS A 1 187 ? 4.935   6.517   5.102  1.00 58.76  ? 179 LYS A CB  1 
ATOM   1387 C CG  . LYS A 1 187 ? 5.444   6.122   3.742  1.00 71.44  ? 179 LYS A CG  1 
ATOM   1388 C CD  . LYS A 1 187 ? 4.673   5.043   3.072  1.00 72.20  ? 179 LYS A CD  1 
ATOM   1389 C CE  . LYS A 1 187 ? 5.388   4.692   1.786  1.00 79.94  ? 179 LYS A CE  1 
ATOM   1390 N NZ  . LYS A 1 187 ? 5.214   3.258   1.467  1.00 90.72  ? 179 LYS A NZ  1 
ATOM   1391 N N   . PRO A 1 188 ? 3.328   9.029   6.199  1.00 68.84  ? 180 PRO A N   1 
ATOM   1392 C CA  . PRO A 1 188 ? 2.274   9.478   7.110  1.00 66.88  0 180 PRO A CA  1 
ATOM   1393 C C   . PRO A 1 188 ? 1.743   8.245   7.826  1.00 60.83  ? 180 PRO A C   1 
ATOM   1394 O O   . PRO A 1 188 ? 1.603   7.252   7.130  1.00 64.36  ? 180 PRO A O   1 
ATOM   1395 C CB  . PRO A 1 188 ? 1.129   10.032  6.227  1.00 66.47  ? 180 PRO A CB  1 
ATOM   1396 C CG  . PRO A 1 188 ? 1.786   10.286  4.873  1.00 69.49  ? 180 PRO A CG  1 
ATOM   1397 C CD  . PRO A 1 188 ? 3.003   9.366   4.799  1.00 59.08  ? 180 PRO A CD  1 
ATOM   1398 N N   . MET A 1 189 ? 1.504   8.341   9.144  1.00 68.56  ? 181 MET A N   1 
ATOM   1399 C CA  . MET A 1 189 ? 0.885   7.265   9.969  1.00 70.45  ? 181 MET A CA  1 
ATOM   1400 C C   . MET A 1 189 ? -0.533  7.012   9.477  1.00 62.36  ? 181 MET A C   1 
ATOM   1401 O O   . MET A 1 189 ? -1.022  7.871   8.758  1.00 69.34  ? 181 MET A O   1 
ATOM   1402 C CB  . MET A 1 189 ? 0.786   7.680   11.430 1.00 73.59  ? 181 MET A CB  1 
ATOM   1403 C CG  . MET A 1 189 ? 2.009   7.349   12.186 1.00 67.45  ? 181 MET A CG  1 
ATOM   1404 S SD  . MET A 1 189 ? 1.816   8.249   13.664 1.00 72.84  ? 181 MET A SD  1 
ATOM   1405 C CE  . MET A 1 189 ? 2.801   9.694   13.317 1.00 71.14  ? 181 MET A CE  1 
ATOM   1406 N N   . ALA A 1 190 ? -1.153  5.889   9.861  1.00 58.30  ? 182 ALA A N   1 
ATOM   1407 C CA  . ALA A 1 190 ? -2.580  5.583   9.568  1.00 55.14  ? 182 ALA A CA  1 
ATOM   1408 C C   . ALA A 1 190 ? -3.502  6.402   10.509 1.00 59.89  ? 182 ALA A C   1 
ATOM   1409 O O   . ALA A 1 190 ? -3.167  6.641   11.704 1.00 53.58  ? 182 ALA A O   1 
ATOM   1410 C CB  . ALA A 1 190 ? -2.802  4.102   9.651  1.00 57.21  ? 182 ALA A CB  1 
ATOM   1411 N N   . ALA A 1 191 ? -4.632  6.866   9.983  1.00 59.12  ? 183 ALA A N   1 
ATOM   1412 C CA  . ALA A 1 191 ? -5.542  7.827   10.649 1.00 64.39  ? 183 ALA A CA  1 
ATOM   1413 C C   . ALA A 1 191 ? -5.917  7.307   12.048 1.00 66.72  ? 183 ALA A C   1 
ATOM   1414 O O   . ALA A 1 191 ? -6.168  8.096   12.983 1.00 68.59  ? 183 ALA A O   1 
ATOM   1415 C CB  . ALA A 1 191 ? -6.738  8.002   9.758  1.00 58.23  ? 183 ALA A CB  1 
ATOM   1416 N N   . ASN A 1 192 ? -5.995  5.989   12.156 1.00 62.15  ? 184 ASN A N   1 
ATOM   1417 C CA  . ASN A 1 192 ? -6.326  5.264   13.391 1.00 64.25  ? 184 ASN A CA  1 
ATOM   1418 C C   . ASN A 1 192 ? -5.635  5.902   14.567 1.00 68.42  ? 184 ASN A C   1 
ATOM   1419 O O   . ASN A 1 192 ? -6.329  6.301   15.535 1.00 67.00  ? 184 ASN A O   1 
ATOM   1420 C CB  . ASN A 1 192 ? -5.837  3.827   13.349 1.00 73.06  ? 184 ASN A CB  1 
ATOM   1421 C CG  . ASN A 1 192 ? -7.022  2.982   13.004 1.00 78.66  ? 184 ASN A CG  1 
ATOM   1422 O OD1 . ASN A 1 192 ? -7.892  2.799   13.841 1.00 91.41  ? 184 ASN A OD1 1 
ATOM   1423 N ND2 . ASN A 1 192 ? -7.138  2.608   11.746 1.00 100.01 ? 184 ASN A ND2 1 
ATOM   1424 N N   . TYR A 1 193 ? -4.310  5.937   14.479 1.00 62.63  ? 185 TYR A N   1 
ATOM   1425 C CA  . TYR A 1 193 ? -3.429  6.363   15.598 1.00 60.16  ? 185 TYR A CA  1 
ATOM   1426 C C   . TYR A 1 193 ? -3.801  7.803   15.989 1.00 60.29  ? 185 TYR A C   1 
ATOM   1427 O O   . TYR A 1 193 ? -4.040  8.106   17.204 1.00 69.71  ? 185 TYR A O   1 
ATOM   1428 C CB  . TYR A 1 193 ? -1.959  6.209   15.212 1.00 56.56  ? 185 TYR A CB  1 
ATOM   1429 C CG  . TYR A 1 193 ? -1.563  4.846   14.719 1.00 49.35  ? 185 TYR A CG  1 
ATOM   1430 C CD1 . TYR A 1 193 ? -1.520  3.765   15.575 1.00 44.40  ? 185 TYR A CD1 1 
ATOM   1431 C CD2 . TYR A 1 193 ? -1.201  4.660   13.396 1.00 52.38  ? 185 TYR A CD2 1 
ATOM   1432 C CE1 . TYR A 1 193 ? -1.155  2.517   15.114 1.00 48.12  ? 185 TYR A CE1 1 
ATOM   1433 C CE2 . TYR A 1 193 ? -0.820  3.417   12.919 1.00 58.68  ? 185 TYR A CE2 1 
ATOM   1434 C CZ  . TYR A 1 193 ? -0.795  2.347   13.786 1.00 54.59  ? 185 TYR A CZ  1 
ATOM   1435 O OH  . TYR A 1 193 ? -0.386  1.151   13.283 1.00 65.77  ? 185 TYR A OH  1 
ATOM   1436 N N   . LEU A 1 194 ? -3.956  8.658   14.985 1.00 63.99  ? 186 LEU A N   1 
ATOM   1437 C CA  . LEU A 1 194 ? -4.273  10.091  15.204 1.00 74.84  ? 186 LEU A CA  1 
ATOM   1438 C C   . LEU A 1 194 ? -5.492  10.157  16.144 1.00 63.24  ? 186 LEU A C   1 
ATOM   1439 O O   . LEU A 1 194 ? -5.477  10.973  17.050 1.00 63.23  ? 186 LEU A O   1 
ATOM   1440 C CB  . LEU A 1 194 ? -4.431  10.778  13.830 1.00 81.27  ? 186 LEU A CB  1 
ATOM   1441 C CG  . LEU A 1 194 ? -3.194  10.727  12.902 1.00 87.91  ? 186 LEU A CG  1 
ATOM   1442 C CD1 . LEU A 1 194 ? -3.545  11.099  11.455 1.00 80.00  ? 186 LEU A CD1 1 
ATOM   1443 C CD2 . LEU A 1 194 ? -2.056  11.622  13.419 1.00 86.77  ? 186 LEU A CD2 1 
ATOM   1444 N N   . LYS A 1 195 ? -6.434  9.214   16.040 1.00 70.20  ? 187 LYS A N   1 
ATOM   1445 C CA  . LYS A 1 195 ? -7.730  9.277   16.764 1.00 64.33  ? 187 LYS A CA  1 
ATOM   1446 C C   . LYS A 1 195 ? -7.591  8.842   18.214 1.00 65.81  ? 187 LYS A C   1 
ATOM   1447 O O   . LYS A 1 195 ? -8.270  9.437   19.016 1.00 72.70  ? 187 LYS A O   1 
ATOM   1448 C CB  . LYS A 1 195 ? -8.825  8.495   16.039 1.00 78.44  ? 187 LYS A CB  1 
ATOM   1449 C CG  . LYS A 1 195 ? -9.558  9.343   15.007 1.00 87.52  ? 187 LYS A CG  1 
ATOM   1450 C CD  . LYS A 1 195 ? -10.973 8.905   14.678 1.00 102.19 ? 187 LYS A CD  1 
ATOM   1451 C CE  . LYS A 1 195 ? -11.066 7.587   13.935 1.00 110.14 ? 187 LYS A CE  1 
ATOM   1452 N NZ  . LYS A 1 195 ? -10.086 7.495   12.828 1.00 111.82 ? 187 LYS A NZ  1 
ATOM   1453 N N   . ASN A 1 196 ? -6.793  7.838   18.553 1.00 69.56  ? 188 ASN A N   1 
ATOM   1454 C CA  . ASN A 1 196 ? -6.570  7.488   19.979 1.00 67.80  ? 188 ASN A CA  1 
ATOM   1455 C C   . ASN A 1 196 ? -5.255  8.107   20.422 1.00 69.11  ? 188 ASN A C   1 
ATOM   1456 O O   . ASN A 1 196 ? -4.212  7.428   20.382 1.00 101.85 ? 188 ASN A O   1 
ATOM   1457 C CB  . ASN A 1 196 ? -6.550  5.984   20.255 1.00 79.58  ? 188 ASN A CB  1 
ATOM   1458 C CG  . ASN A 1 196 ? -7.606  5.225   19.491 1.00 77.22  ? 188 ASN A CG  1 
ATOM   1459 O OD1 . ASN A 1 196 ? -8.796  5.313   19.779 1.00 97.10  ? 188 ASN A OD1 1 
ATOM   1460 N ND2 . ASN A 1 196 ? -7.175  4.465   18.508 1.00 72.37  ? 188 ASN A ND2 1 
ATOM   1461 N N   . GLN A 1 197 ? -5.299  9.376   20.764 1.00 67.53  ? 189 GLN A N   1 
ATOM   1462 C CA  . GLN A 1 197 ? -4.233  10.062  21.525 1.00 70.33  ? 189 GLN A CA  1 
ATOM   1463 C C   . GLN A 1 197 ? -4.767  10.322  22.916 1.00 59.19  ? 189 GLN A C   1 
ATOM   1464 O O   . GLN A 1 197 ? -5.970  10.452  23.015 1.00 68.94  ? 189 GLN A O   1 
ATOM   1465 C CB  . GLN A 1 197 ? -3.992  11.477  21.014 1.00 77.54  ? 189 GLN A CB  1 
ATOM   1466 C CG  . GLN A 1 197 ? -4.033  11.570  19.509 1.00 79.60  ? 189 GLN A CG  1 
ATOM   1467 C CD  . GLN A 1 197 ? -3.030  12.569  18.996 1.00 81.97  ? 189 GLN A CD  1 
ATOM   1468 O OE1 . GLN A 1 197 ? -3.046  12.897  17.810 1.00 98.97  ? 189 GLN A OE1 1 
ATOM   1469 N NE2 . GLN A 1 197 ? -2.126  13.017  19.864 1.00 63.18  ? 189 GLN A NE2 1 
ATOM   1470 N N   . PRO A 1 198 ? -3.928  10.457  23.974 1.00 50.62  ? 190 PRO A N   1 
ATOM   1471 C CA  . PRO A 1 198 ? -2.570  9.936   23.955 1.00 53.10  ? 190 PRO A CA  1 
ATOM   1472 C C   . PRO A 1 198 ? -2.617  8.395   24.022 1.00 57.71  ? 190 PRO A C   1 
ATOM   1473 O O   . PRO A 1 198 ? -3.701  7.838   24.175 1.00 58.88  ? 190 PRO A O   1 
ATOM   1474 C CB  . PRO A 1 198 ? -1.897  10.663  25.135 1.00 50.51  ? 190 PRO A CB  1 
ATOM   1475 C CG  . PRO A 1 198 ? -3.010  10.871  26.096 1.00 52.56  ? 190 PRO A CG  1 
ATOM   1476 C CD  . PRO A 1 198 ? -4.203  11.179  25.218 1.00 50.88  ? 190 PRO A CD  1 
ATOM   1477 N N   . MET A 1 199 ? -1.483  7.746   23.712 1.00 54.69  ? 191 MET A N   1 
ATOM   1478 C CA  . MET A 1 199 ? -1.200  6.327   23.995 1.00 47.24  ? 191 MET A CA  1 
ATOM   1479 C C   . MET A 1 199 ? -0.206  6.300   25.174 1.00 50.38  ? 191 MET A C   1 
ATOM   1480 O O   . MET A 1 199 ? 0.757   7.058   25.187 1.00 48.68  ? 191 MET A O   1 
ATOM   1481 C CB  . MET A 1 199 ? -0.680  5.624   22.748 1.00 47.02  ? 191 MET A CB  1 
ATOM   1482 C CG  . MET A 1 199 ? -0.480  4.144   22.953 1.00 56.72  ? 191 MET A CG  1 
ATOM   1483 S SD  . MET A 1 199 ? -1.998  3.188   23.337 1.00 49.58  ? 191 MET A SD  1 
ATOM   1484 C CE  . MET A 1 199 ? -2.972  3.365   21.829 1.00 43.51  ? 191 MET A CE  1 
ATOM   1485 N N   . TYR A 1 200 ? -0.549  5.605   26.248 1.00 47.29  ? 192 TYR A N   1 
ATOM   1486 C CA  . TYR A 1 200 ? 0.372   5.371   27.389 1.00 47.50  ? 192 TYR A CA  1 
ATOM   1487 C C   . TYR A 1 200 ? 1.070   4.036   27.160 1.00 44.93  ? 192 TYR A C   1 
ATOM   1488 O O   . TYR A 1 200 ? 0.477   3.195   26.509 1.00 46.16  ? 192 TYR A O   1 
ATOM   1489 C CB  . TYR A 1 200 ? -0.385  5.411   28.726 1.00 48.52  ? 192 TYR A CB  1 
ATOM   1490 C CG  . TYR A 1 200 ? -1.083  6.723   28.919 1.00 42.62  ? 192 TYR A CG  1 
ATOM   1491 C CD1 . TYR A 1 200 ? -0.354  7.857   29.215 1.00 53.31  ? 192 TYR A CD1 1 
ATOM   1492 C CD2 . TYR A 1 200 ? -2.444  6.860   28.696 1.00 46.85  ? 192 TYR A CD2 1 
ATOM   1493 C CE1 . TYR A 1 200 ? -0.975  9.094   29.362 1.00 58.23  ? 192 TYR A CE1 1 
ATOM   1494 C CE2 . TYR A 1 200 ? -3.084  8.078   28.851 1.00 44.15  ? 192 TYR A CE2 1 
ATOM   1495 C CZ  . TYR A 1 200 ? -2.341  9.206   29.161 1.00 53.48  ? 192 TYR A CZ  1 
ATOM   1496 O OH  . TYR A 1 200 ? -2.959  10.420  29.288 1.00 52.75  ? 192 TYR A OH  1 
ATOM   1497 N N   . VAL A 1 201 ? 2.304   3.878   27.637 1.00 45.42  ? 193 VAL A N   1 
ATOM   1498 C CA  . VAL A 1 201 ? 2.976   2.554   27.729 1.00 43.99  ? 193 VAL A CA  1 
ATOM   1499 C C   . VAL A 1 201 ? 3.674   2.434   29.087 1.00 48.62  ? 193 VAL A C   1 
ATOM   1500 O O   . VAL A 1 201 ? 4.441   3.345   29.502 1.00 45.96  ? 193 VAL A O   1 
ATOM   1501 C CB  . VAL A 1 201 ? 3.952   2.322   26.565 1.00 46.49  ? 193 VAL A CB  1 
ATOM   1502 C CG1 . VAL A 1 201 ? 4.381   0.868   26.508 1.00 47.45  ? 193 VAL A CG1 1 
ATOM   1503 C CG2 . VAL A 1 201 ? 3.339   2.738   25.238 1.00 46.31  ? 193 VAL A CG2 1 
ATOM   1504 N N   . PHE A 1 202 ? 3.419   1.316   29.754 1.00 47.38  ? 194 PHE A N   1 
ATOM   1505 C CA  . PHE A 1 202 ? 4.107   0.946   31.005 1.00 46.12  ? 194 PHE A CA  1 
ATOM   1506 C C   . PHE A 1 202 ? 5.266   0.028   30.646 1.00 37.94  ? 194 PHE A C   1 
ATOM   1507 O O   . PHE A 1 202 ? 5.046   -0.794  29.854 1.00 35.72  ? 194 PHE A O   1 
ATOM   1508 C CB  . PHE A 1 202 ? 3.110   0.298   31.952 1.00 44.42  ? 194 PHE A CB  1 
ATOM   1509 C CG  . PHE A 1 202 ? 2.686   1.200   33.080 1.00 47.62  ? 194 PHE A CG  1 
ATOM   1510 C CD1 . PHE A 1 202 ? 3.649   1.762   33.906 1.00 40.14  ? 194 PHE A CD1 1 
ATOM   1511 C CD2 . PHE A 1 202 ? 1.346   1.395   33.391 1.00 52.05  ? 194 PHE A CD2 1 
ATOM   1512 C CE1 . PHE A 1 202 ? 3.288   2.535   35.000 1.00 46.18  ? 194 PHE A CE1 1 
ATOM   1513 C CE2 . PHE A 1 202 ? 0.989   2.192   34.478 1.00 46.23  ? 194 PHE A CE2 1 
ATOM   1514 C CZ  . PHE A 1 202 ? 1.959   2.759   35.266 1.00 47.14  ? 194 PHE A CZ  1 
ATOM   1515 N N   . ARG A 1 203 ? 6.467   0.203   31.182 1.00 42.28  ? 195 ARG A N   1 
ATOM   1516 C CA  . ARG A 1 203 ? 7.618   -0.672  30.839 1.00 48.26  ? 195 ARG A CA  1 
ATOM   1517 C C   . ARG A 1 203 ? 8.448   -0.965  32.097 1.00 48.35  ? 195 ARG A C   1 
ATOM   1518 O O   . ARG A 1 203 ? 8.586   -0.067  32.929 1.00 42.99  ? 195 ARG A O   1 
ATOM   1519 C CB  . ARG A 1 203 ? 8.489   -0.003  29.775 1.00 45.71  ? 195 ARG A CB  1 
ATOM   1520 C CG  . ARG A 1 203 ? 7.743   0.378   28.504 1.00 47.04  ? 195 ARG A CG  1 
ATOM   1521 C CD  . ARG A 1 203 ? 8.736   0.861   27.455 1.00 45.20  ? 195 ARG A CD  1 
ATOM   1522 N NE  . ARG A 1 203 ? 8.194   1.104   26.123 1.00 40.69  ? 195 ARG A NE  1 
ATOM   1523 C CZ  . ARG A 1 203 ? 7.779   2.277   25.669 1.00 41.74  ? 195 ARG A CZ  1 
ATOM   1524 N NH1 . ARG A 1 203 ? 7.728   3.332   26.471 1.00 39.70  ? 195 ARG A NH1 1 
ATOM   1525 N NH2 . ARG A 1 203 ? 7.408   2.375   24.405 1.00 44.59  ? 195 ARG A NH2 1 
ATOM   1526 N N   . LYS A 1 204 ? 8.980   -2.183  32.207 1.00 45.50  ? 196 LYS A N   1 
ATOM   1527 C CA  . LYS A 1 204 ? 10.007  -2.506  33.217 1.00 43.27  ? 196 LYS A CA  1 
ATOM   1528 C C   . LYS A 1 204 ? 11.270  -2.917  32.472 1.00 43.12  ? 196 LYS A C   1 
ATOM   1529 O O   . LYS A 1 204 ? 11.180  -3.611  31.449 1.00 41.54  ? 196 LYS A O   1 
ATOM   1530 C CB  . LYS A 1 204 ? 9.503   -3.598  34.163 1.00 43.28  ? 196 LYS A CB  1 
ATOM   1531 C CG  . LYS A 1 204 ? 10.299  -3.808  35.459 1.00 43.72  ? 196 LYS A CG  1 
ATOM   1532 C CD  . LYS A 1 204 ? 10.464  -2.553  36.267 1.00 51.42  ? 196 LYS A CD  1 
ATOM   1533 C CE  . LYS A 1 204 ? 10.789  -2.759  37.740 1.00 53.53  ? 196 LYS A CE  1 
ATOM   1534 N NZ  . LYS A 1 204 ? 12.182  -3.214  37.911 1.00 58.38  ? 196 LYS A NZ  1 
ATOM   1535 N N   . THR A 1 205 ? 12.419  -2.532  33.002 1.00 44.06  ? 197 THR A N   1 
ATOM   1536 C CA  . THR A 1 205 ? 13.745  -2.921  32.472 1.00 51.17  ? 197 THR A CA  1 
ATOM   1537 C C   . THR A 1 205 ? 14.508  -3.750  33.498 1.00 49.91  ? 197 THR A C   1 
ATOM   1538 O O   . THR A 1 205 ? 14.560  -3.392  34.697 1.00 43.89  ? 197 THR A O   1 
ATOM   1539 C CB  . THR A 1 205 ? 14.552  -1.682  32.052 1.00 49.71  ? 197 THR A CB  1 
ATOM   1540 O OG1 . THR A 1 205 ? 14.640  -0.750  33.140 1.00 54.48  ? 197 THR A OG1 1 
ATOM   1541 C CG2 . THR A 1 205 ? 13.934  -1.012  30.849 1.00 45.67  ? 197 THR A CG2 1 
ATOM   1542 N N   . GLU A 1 206 ? 15.199  -4.769  33.029 1.00 52.48  ? 198 GLU A N   1 
ATOM   1543 C CA  . GLU A 1 206 ? 16.159  -5.427  33.940 1.00 51.56  ? 198 GLU A CA  1 
ATOM   1544 C C   . GLU A 1 206 ? 17.543  -5.386  33.286 1.00 51.79  ? 198 GLU A C   1 
ATOM   1545 O O   . GLU A 1 206 ? 17.668  -5.379  31.970 1.00 41.29  ? 198 GLU A O   1 
ATOM   1546 C CB  . GLU A 1 206 ? 15.561  -6.774  34.338 1.00 55.77  ? 198 GLU A CB  1 
ATOM   1547 C CG  . GLU A 1 206 ? 16.592  -7.738  34.876 1.00 64.19  ? 198 GLU A CG  1 
ATOM   1548 C CD  . GLU A 1 206 ? 16.080  -9.144  35.132 1.00 80.09  ? 198 GLU A CD  1 
ATOM   1549 O OE1 . GLU A 1 206 ? 14.878  -9.284  35.453 1.00 97.58  ? 198 GLU A OE1 1 
ATOM   1550 O OE2 . GLU A 1 206 ? 16.880  -10.102 34.998 1.00 86.46  ? 198 GLU A OE2 1 
ATOM   1551 N N   . LEU A 1 207 ? 18.562  -5.334  34.143 1.00 45.56  ? 199 LEU A N   1 
ATOM   1552 C CA  . LEU A 1 207 ? 19.966  -5.298  33.681 1.00 44.78  ? 199 LEU A CA  1 
ATOM   1553 C C   . LEU A 1 207 ? 20.916  -6.082  34.580 1.00 45.76  ? 199 LEU A C   1 
ATOM   1554 O O   . LEU A 1 207 ? 21.013  -5.752  35.768 1.00 60.81  ? 199 LEU A O   1 
ATOM   1555 C CB  . LEU A 1 207 ? 20.436  -3.845  33.629 1.00 48.17  ? 199 LEU A CB  1 
ATOM   1556 C CG  . LEU A 1 207 ? 21.756  -3.656  32.866 1.00 50.67  ? 199 LEU A CG  1 
ATOM   1557 C CD1 . LEU A 1 207 ? 21.594  -4.053  31.406 1.00 55.85  ? 199 LEU A CD1 1 
ATOM   1558 C CD2 . LEU A 1 207 ? 22.257  -2.224  32.917 1.00 60.01  ? 199 LEU A CD2 1 
ATOM   1559 N N   . LYS A 1 208 ? 21.701  -6.981  34.004 1.00 51.12  ? 200 LYS A N   1 
ATOM   1560 C CA  . LYS A 1 208 ? 22.884  -7.600  34.675 1.00 57.13  ? 200 LYS A CA  1 
ATOM   1561 C C   . LYS A 1 208 ? 24.107  -7.154  33.898 1.00 53.78  ? 200 LYS A C   1 
ATOM   1562 O O   . LYS A 1 208 ? 24.041  -7.146  32.627 1.00 48.00  ? 200 LYS A O   1 
ATOM   1563 C CB  . LYS A 1 208 ? 22.922  -9.133  34.642 1.00 57.23  ? 200 LYS A CB  1 
ATOM   1564 C CG  . LYS A 1 208 ? 21.573  -9.829  34.578 1.00 66.23  ? 200 LYS A CG  1 
ATOM   1565 C CD  . LYS A 1 208 ? 21.240  -10.615 35.807 1.00 73.57  ? 200 LYS A CD  1 
ATOM   1566 C CE  . LYS A 1 208 ? 20.109  -11.590 35.578 1.00 70.47  ? 200 LYS A CE  1 
ATOM   1567 N NZ  . LYS A 1 208 ? 19.205  -11.598 36.752 1.00 82.44  ? 200 LYS A NZ  1 
ATOM   1568 N N   . HIS A 1 209 ? 25.156  -6.760  34.599 1.00 45.31  ? 201 HIS A N   1 
ATOM   1569 C CA  . HIS A 1 209 ? 26.283  -6.073  33.924 1.00 48.73  ? 201 HIS A CA  1 
ATOM   1570 C C   . HIS A 1 209 ? 27.563  -6.388  34.648 1.00 53.34  ? 201 HIS A C   1 
ATOM   1571 O O   . HIS A 1 209 ? 27.574  -6.276  35.887 1.00 59.98  ? 201 HIS A O   1 
ATOM   1572 C CB  . HIS A 1 209 ? 26.079  -4.547  33.869 1.00 49.00  ? 201 HIS A CB  1 
ATOM   1573 C CG  . HIS A 1 209 ? 26.040  -3.831  35.180 1.00 49.08  ? 201 HIS A CG  1 
ATOM   1574 N ND1 . HIS A 1 209 ? 24.894  -3.736  35.939 1.00 50.45  ? 201 HIS A ND1 1 
ATOM   1575 C CD2 . HIS A 1 209 ? 26.986  -3.133  35.865 1.00 55.96  ? 201 HIS A CD2 1 
ATOM   1576 C CE1 . HIS A 1 209 ? 25.139  -3.002  37.028 1.00 49.87  ? 201 HIS A CE1 1 
ATOM   1577 N NE2 . HIS A 1 209 ? 26.427  -2.630  37.023 1.00 45.88  ? 201 HIS A NE2 1 
ATOM   1578 N N   . SER A 1 210 ? 28.575  -6.757  33.868 1.00 63.22  ? 202 SER A N   1 
ATOM   1579 C CA  . SER A 1 210 ? 30.000  -6.753  34.242 1.00 61.55  ? 202 SER A CA  1 
ATOM   1580 C C   . SER A 1 210 ? 30.566  -5.382  33.858 1.00 74.28  ? 202 SER A C   1 
ATOM   1581 O O   . SER A 1 210 ? 29.761  -4.471  33.676 1.00 77.17  ? 202 SER A O   1 
ATOM   1582 C CB  . SER A 1 210 ? 30.666  -7.866  33.542 1.00 70.48  ? 202 SER A CB  1 
ATOM   1583 O OG  . SER A 1 210 ? 30.294  -7.823  32.178 1.00 73.32  ? 202 SER A OG  1 
ATOM   1584 N N   . LYS A 1 211 ? 31.887  -5.232  33.734 1.00 71.92  ? 203 LYS A N   1 
ATOM   1585 C CA  . LYS A 1 211 ? 32.540  -3.990  33.239 1.00 66.53  ? 203 LYS A CA  1 
ATOM   1586 C C   . LYS A 1 211 ? 32.446  -3.896  31.700 1.00 70.02  ? 203 LYS A C   1 
ATOM   1587 O O   . LYS A 1 211 ? 32.601  -2.786  31.141 1.00 66.55  ? 203 LYS A O   1 
ATOM   1588 C CB  . LYS A 1 211 ? 34.030  -4.012  33.584 1.00 72.89  ? 203 LYS A CB  1 
ATOM   1589 C CG  . LYS A 1 211 ? 34.384  -4.037  35.057 1.00 80.70  ? 203 LYS A CG  1 
ATOM   1590 C CD  . LYS A 1 211 ? 34.428  -2.652  35.603 1.00 82.48  ? 203 LYS A CD  1 
ATOM   1591 C CE  . LYS A 1 211 ? 33.456  -2.472  36.742 1.00 100.95 ? 203 LYS A CE  1 
ATOM   1592 N NZ  . LYS A 1 211 ? 33.647  -1.142  37.373 1.00 118.24 ? 203 LYS A NZ  1 
ATOM   1593 N N   . THR A 1 212 ? 32.268  -5.026  31.020 1.00 53.93  ? 204 THR A N   1 
ATOM   1594 C CA  . THR A 1 212 ? 32.433  -5.161  29.550 1.00 61.56  ? 204 THR A CA  1 
ATOM   1595 C C   . THR A 1 212 ? 31.159  -5.662  28.850 1.00 55.06  ? 204 THR A C   1 
ATOM   1596 O O   . THR A 1 212 ? 31.092  -5.535  27.588 1.00 53.69  ? 204 THR A O   1 
ATOM   1597 C CB  . THR A 1 212 ? 33.529  -6.180  29.222 1.00 56.92  ? 204 THR A CB  1 
ATOM   1598 O OG1 . THR A 1 212 ? 33.036  -7.335  29.899 1.00 67.77  ? 204 THR A OG1 1 
ATOM   1599 C CG2 . THR A 1 212 ? 34.923  -5.765  29.642 1.00 53.50  ? 204 THR A CG2 1 
ATOM   1600 N N   . GLU A 1 213 ? 30.187  -6.189  29.604 1.00 54.68  ? 205 GLU A N   1 
ATOM   1601 C CA  . GLU A 1 213 ? 29.116  -7.089  29.097 1.00 51.77  ? 205 GLU A CA  1 
ATOM   1602 C C   . GLU A 1 213 ? 27.832  -6.778  29.849 1.00 61.77  ? 205 GLU A C   1 
ATOM   1603 O O   . GLU A 1 213 ? 27.901  -6.303  31.024 1.00 55.05  ? 205 GLU A O   1 
ATOM   1604 C CB  . GLU A 1 213 ? 29.541  -8.546  29.286 1.00 56.64  ? 205 GLU A CB  1 
ATOM   1605 C CG  . GLU A 1 213 ? 28.583  -9.598  28.771 1.00 58.48  ? 205 GLU A CG  1 
ATOM   1606 C CD  . GLU A 1 213 ? 29.319  -10.883 28.445 1.00 71.64  ? 205 GLU A CD  1 
ATOM   1607 O OE1 . GLU A 1 213 ? 29.973  -11.436 29.345 1.00 81.21  ? 205 GLU A OE1 1 
ATOM   1608 O OE2 . GLU A 1 213 ? 29.267  -11.310 27.288 1.00 84.62  ? 205 GLU A OE2 1 
ATOM   1609 N N   . LEU A 1 214 ? 26.699  -7.053  29.214 1.00 55.87  ? 206 LEU A N   1 
ATOM   1610 C CA  . LEU A 1 214 ? 25.433  -6.870  29.929 1.00 59.80  ? 206 LEU A CA  1 
ATOM   1611 C C   . LEU A 1 214 ? 24.307  -7.529  29.151 1.00 60.00  ? 206 LEU A C   1 
ATOM   1612 O O   . LEU A 1 214 ? 24.427  -7.614  27.876 1.00 63.88  ? 206 LEU A O   1 
ATOM   1613 C CB  . LEU A 1 214 ? 25.209  -5.378  30.196 1.00 60.89  ? 206 LEU A CB  1 
ATOM   1614 C CG  . LEU A 1 214 ? 25.093  -4.473  28.988 1.00 56.17  ? 206 LEU A CG  1 
ATOM   1615 C CD1 . LEU A 1 214 ? 23.805  -4.740  28.228 1.00 61.74  ? 206 LEU A CD1 1 
ATOM   1616 C CD2 . LEU A 1 214 ? 25.109  -3.041  29.429 1.00 51.81  ? 206 LEU A CD2 1 
ATOM   1617 N N   . ASN A 1 215 ? 23.311  -7.991  29.926 1.00 44.06  ? 207 ASN A N   1 
ATOM   1618 C CA  . ASN A 1 215 ? 22.070  -8.712  29.494 1.00 51.62  ? 207 ASN A CA  1 
ATOM   1619 C C   . ASN A 1 215 ? 20.874  -7.871  29.948 1.00 39.47  ? 207 ASN A C   1 
ATOM   1620 O O   . ASN A 1 215 ? 20.802  -7.462  31.177 1.00 37.72  ? 207 ASN A O   1 
ATOM   1621 C CB  . ASN A 1 215 ? 22.050  -10.181 29.956 1.00 48.08  ? 207 ASN A CB  1 
ATOM   1622 C CG  . ASN A 1 215 ? 23.253  -10.877 29.364 1.00 64.41  ? 207 ASN A CG  1 
ATOM   1623 O OD1 . ASN A 1 215 ? 24.280  -11.034 30.038 1.00 83.68  ? 207 ASN A OD1 1 
ATOM   1624 N ND2 . ASN A 1 215 ? 23.178  -11.162 28.067 1.00 68.51  ? 207 ASN A ND2 1 
ATOM   1625 N N   . PHE A 1 216 ? 20.097  -7.445  28.966 1.00 40.75  ? 208 PHE A N   1 
ATOM   1626 C CA  . PHE A 1 216 ? 19.072  -6.382  29.148 1.00 46.34  ? 208 PHE A CA  1 
ATOM   1627 C C   . PHE A 1 216 ? 17.745  -7.047  28.868 1.00 41.91  ? 208 PHE A C   1 
ATOM   1628 O O   . PHE A 1 216 ? 17.779  -7.924  28.038 1.00 48.57  ? 208 PHE A O   1 
ATOM   1629 C CB  . PHE A 1 216 ? 19.263  -5.191  28.212 1.00 47.40  ? 208 PHE A CB  1 
ATOM   1630 C CG  . PHE A 1 216 ? 18.063  -4.286  28.104 1.00 41.28  ? 208 PHE A CG  1 
ATOM   1631 C CD1 . PHE A 1 216 ? 17.789  -3.364  29.088 1.00 44.90  ? 208 PHE A CD1 1 
ATOM   1632 C CD2 . PHE A 1 216 ? 17.241  -4.317  26.997 1.00 52.49  ? 208 PHE A CD2 1 
ATOM   1633 C CE1 . PHE A 1 216 ? 16.682  -2.545  29.008 1.00 45.82  ? 208 PHE A CE1 1 
ATOM   1634 C CE2 . PHE A 1 216 ? 16.145  -3.474  26.900 1.00 48.73  ? 208 PHE A CE2 1 
ATOM   1635 C CZ  . PHE A 1 216 ? 15.871  -2.586  27.910 1.00 51.55  ? 208 PHE A CZ  1 
ATOM   1636 N N   . LYS A 1 217 ? 16.673  -6.693  29.577 1.00 47.87  ? 209 LYS A N   1 
ATOM   1637 C CA  . LYS A 1 217 ? 15.320  -7.189  29.228 1.00 44.77  ? 209 LYS A CA  1 
ATOM   1638 C C   . LYS A 1 217 ? 14.356  -6.058  29.468 1.00 45.63  ? 209 LYS A C   1 
ATOM   1639 O O   . LYS A 1 217 ? 14.626  -5.239  30.357 1.00 39.76  ? 209 LYS A O   1 
ATOM   1640 C CB  . LYS A 1 217 ? 14.914  -8.389  30.069 1.00 50.66  ? 209 LYS A CB  1 
ATOM   1641 C CG  . LYS A 1 217 ? 15.978  -9.457  30.143 1.00 53.49  ? 209 LYS A CG  1 
ATOM   1642 C CD  . LYS A 1 217 ? 15.651  -10.514 31.093 1.00 58.85  ? 209 LYS A CD  1 
ATOM   1643 C CE  . LYS A 1 217 ? 16.593  -11.677 30.902 1.00 72.28  ? 209 LYS A CE  1 
ATOM   1644 N NZ  . LYS A 1 217 ? 15.827  -12.931 31.017 1.00 80.06  ? 209 LYS A NZ  1 
ATOM   1645 N N   . GLU A 1 218 ? 13.290  -6.077  28.682 1.00 50.50  ? 210 GLU A N   1 
ATOM   1646 C CA  . GLU A 1 218 ? 12.197  -5.089  28.713 1.00 49.23  ? 210 GLU A CA  1 
ATOM   1647 C C   . GLU A 1 218 ? 10.855  -5.791  28.507 1.00 47.60  ? 210 GLU A C   1 
ATOM   1648 O O   . GLU A 1 218 ? 10.809  -6.784  27.736 1.00 48.33  ? 210 GLU A O   1 
ATOM   1649 C CB  . GLU A 1 218 ? 12.430  -4.061  27.619 1.00 48.56  ? 210 GLU A CB  1 
ATOM   1650 C CG  . GLU A 1 218 ? 11.359  -3.001  27.539 1.00 48.41  ? 210 GLU A CG  1 
ATOM   1651 C CD  . GLU A 1 218 ? 11.779  -1.947  26.534 1.00 49.12  ? 210 GLU A CD  1 
ATOM   1652 O OE1 . GLU A 1 218 ? 12.896  -1.423  26.737 1.00 43.01  ? 210 GLU A OE1 1 
ATOM   1653 O OE2 . GLU A 1 218 ? 11.020  -1.675  25.549 1.00 41.14  ? 210 GLU A OE2 1 
ATOM   1654 N N   . TRP A 1 219 ? 9.830   -5.223  29.155 1.00 43.02  ? 211 TRP A N   1 
ATOM   1655 C CA  . TRP A 1 219 ? 8.406   -5.639  29.180 1.00 41.34  ? 211 TRP A CA  1 
ATOM   1656 C C   . TRP A 1 219 ? 7.655   -4.337  28.985 1.00 37.87  ? 211 TRP A C   1 
ATOM   1657 O O   . TRP A 1 219 ? 8.165   -3.345  29.469 1.00 42.53  ? 211 TRP A O   1 
ATOM   1658 C CB  . TRP A 1 219 ? 8.057   -6.341  30.505 1.00 47.55  ? 211 TRP A CB  1 
ATOM   1659 C CG  . TRP A 1 219 ? 8.717   -7.669  30.743 1.00 37.53  ? 211 TRP A CG  1 
ATOM   1660 C CD1 . TRP A 1 219 ? 8.220   -8.892  30.421 1.00 45.88  ? 211 TRP A CD1 1 
ATOM   1661 C CD2 . TRP A 1 219 ? 9.927   -7.917  31.460 1.00 41.08  ? 211 TRP A CD2 1 
ATOM   1662 N NE1 . TRP A 1 219 ? 9.068   -9.882  30.834 1.00 45.03  ? 211 TRP A NE1 1 
ATOM   1663 C CE2 . TRP A 1 219 ? 10.126  -9.316  31.461 1.00 39.96  ? 211 TRP A CE2 1 
ATOM   1664 C CE3 . TRP A 1 219 ? 10.897  -7.094  32.046 1.00 39.94  ? 211 TRP A CE3 1 
ATOM   1665 C CZ2 . TRP A 1 219 ? 11.247  -9.915  32.026 1.00 47.89  ? 211 TRP A CZ2 1 
ATOM   1666 C CZ3 . TRP A 1 219 ? 12.005  -7.683  32.612 1.00 39.35  ? 211 TRP A CZ3 1 
ATOM   1667 C CH2 . TRP A 1 219 ? 12.186  -9.080  32.593 1.00 42.25  ? 211 TRP A CH2 1 
ATOM   1668 N N   . GLN A 1 220 ? 6.611   -4.328  28.170 1.00 42.56  ? 212 GLN A N   1 
ATOM   1669 C CA  . GLN A 1 220 ? 6.003   -3.109  27.613 1.00 45.03  ? 212 GLN A CA  1 
ATOM   1670 C C   . GLN A 1 220 ? 4.554   -3.457  27.354 1.00 40.65  ? 212 GLN A C   1 
ATOM   1671 O O   . GLN A 1 220 ? 4.368   -4.556  26.789 1.00 43.74  ? 212 GLN A O   1 
ATOM   1672 C CB  . GLN A 1 220 ? 6.470   -2.721  26.207 1.00 46.79  ? 212 GLN A CB  1 
ATOM   1673 C CG  . GLN A 1 220 ? 7.958   -2.775  25.923 1.00 49.76  ? 212 GLN A CG  1 
ATOM   1674 C CD  . GLN A 1 220 ? 8.188   -2.142  24.555 1.00 56.24  ? 212 GLN A CD  1 
ATOM   1675 O OE1 . GLN A 1 220 ? 7.849   -0.966  24.320 1.00 52.19  ? 212 GLN A OE1 1 
ATOM   1676 N NE2 . GLN A 1 220 ? 8.726   -2.914  23.621 1.00 46.57  ? 212 GLN A NE2 1 
ATOM   1677 N N   . LYS A 1 221 ? 3.632   -2.554  27.699 1.00 40.76  ? 213 LYS A N   1 
ATOM   1678 C CA  . LYS A 1 221 ? 2.160   -2.666  27.458 1.00 45.35  ? 213 LYS A CA  1 
ATOM   1679 C C   . LYS A 1 221 ? 1.595   -1.269  27.155 1.00 43.52  ? 213 LYS A C   1 
ATOM   1680 O O   . LYS A 1 221 ? 1.736   -0.353  28.010 1.00 54.54  ? 213 LYS A O   1 
ATOM   1681 C CB  . LYS A 1 221 ? 1.466   -3.314  28.679 1.00 43.74  ? 213 LYS A CB  1 
ATOM   1682 C CG  . LYS A 1 221 ? -0.045  -3.499  28.575 1.00 37.42  ? 213 LYS A CG  1 
ATOM   1683 C CD  . LYS A 1 221 ? -0.478  -4.237  27.339 1.00 36.57  ? 213 LYS A CD  1 
ATOM   1684 C CE  . LYS A 1 221 ? -1.980  -4.310  27.229 1.00 33.03  ? 213 LYS A CE  1 
ATOM   1685 N NZ  . LYS A 1 221 ? -2.263  -5.122  26.038 1.00 39.56  ? 213 LYS A NZ  1 
ATOM   1686 N N   . ALA A 1 222 ? 0.981   -1.140  25.990 1.00 49.90  ? 214 ALA A N   1 
ATOM   1687 C CA  . ALA A 1 222 ? 0.302   0.057   25.469 1.00 42.48  ? 214 ALA A CA  1 
ATOM   1688 C C   . ALA A 1 222 ? -1.180  -0.047  25.877 1.00 52.31  ? 214 ALA A C   1 
ATOM   1689 O O   . ALA A 1 222 ? -1.825  -1.117  25.598 1.00 51.91  ? 214 ALA A O   1 
ATOM   1690 C CB  . ALA A 1 222 ? 0.460   0.060   23.950 1.00 39.10  ? 214 ALA A CB  1 
ATOM   1691 N N   . PHE A 1 223 ? -1.696  1.041   26.465 1.00 45.59  ? 215 PHE A N   1 
ATOM   1692 C CA  . PHE A 1 223 ? -3.098  1.269   26.893 1.00 47.08  ? 215 PHE A CA  1 
ATOM   1693 C C   . PHE A 1 223 ? -3.450  2.746   26.708 1.00 38.90  ? 215 PHE A C   1 
ATOM   1694 O O   . PHE A 1 223 ? -2.539  3.555   26.773 1.00 40.18  ? 215 PHE A O   1 
ATOM   1695 C CB  . PHE A 1 223 ? -3.279  0.876   28.365 1.00 44.44  ? 215 PHE A CB  1 
ATOM   1696 C CG  . PHE A 1 223 ? -2.548  1.724   29.380 1.00 46.84  ? 215 PHE A CG  1 
ATOM   1697 C CD1 . PHE A 1 223 ? -1.158  1.670   29.472 1.00 50.86  ? 215 PHE A CD1 1 
ATOM   1698 C CD2 . PHE A 1 223 ? -3.246  2.548   30.258 1.00 47.73  ? 215 PHE A CD2 1 
ATOM   1699 C CE1 . PHE A 1 223 ? -0.480  2.409   30.426 1.00 50.53  ? 215 PHE A CE1 1 
ATOM   1700 C CE2 . PHE A 1 223 ? -2.569  3.260   31.234 1.00 47.16  ? 215 PHE A CE2 1 
ATOM   1701 C CZ  . PHE A 1 223 ? -1.192  3.200   31.302 1.00 52.45  ? 215 PHE A CZ  1 
ATOM   1702 N N   . THR A 1 224 ? -4.723  3.027   26.447 1.00 48.43  ? 216 THR A N   1 
ATOM   1703 C CA  . THR A 1 224 ? -5.375  4.354   26.437 1.00 49.73  ? 216 THR A CA  1 
ATOM   1704 C C   . THR A 1 224 ? -6.031  4.584   27.813 1.00 62.73  ? 216 THR A C   1 
ATOM   1705 O O   . THR A 1 224 ? -5.952  3.681   28.670 1.00 61.13  ? 216 THR A O   1 
ATOM   1706 C CB  . THR A 1 224 ? -6.356  4.405   25.263 1.00 56.31  ? 216 THR A CB  1 
ATOM   1707 O OG1 . THR A 1 224 ? -7.455  3.592   25.629 1.00 61.27  ? 216 THR A OG1 1 
ATOM   1708 C CG2 . THR A 1 224 ? -5.800  3.889   23.946 1.00 58.24  ? 216 THR A CG2 1 
ATOM   1709 N N   . ASP A 1 225 ? -6.646  5.762   28.009 1.00 86.12  ? 217 ASP A N   1 
ATOM   1710 C CA  . ASP A 1 225 ? -7.473  6.178   29.179 1.00 79.43  ? 217 ASP A CA  1 
ATOM   1711 C C   . ASP A 1 225 ? -8.908  5.610   29.060 1.00 86.33  ? 217 ASP A C   1 
ATOM   1712 O O   . ASP A 1 225 ? -9.809  6.234   29.656 1.00 107.31 ? 217 ASP A O   1 
ATOM   1713 C CB  . ASP A 1 225 ? -7.497  7.718   29.273 1.00 72.54  ? 217 ASP A CB  1 
ATOM   1714 N N   . VAL A 1 226 ? -9.136  4.491   28.338 1.00 81.19  ? 218 VAL A N   1 
ATOM   1715 C CA  . VAL A 1 226 ? -10.480 3.978   27.935 1.00 93.41  ? 218 VAL A CA  1 
ATOM   1716 C C   . VAL A 1 226 ? -11.127 3.171   29.074 1.00 80.59  ? 218 VAL A C   1 
ATOM   1717 O O   . VAL A 1 226 ? -12.161 2.538   28.782 1.00 69.79  ? 218 VAL A O   1 
ATOM   1718 C CB  . VAL A 1 226 ? -10.395 3.159   26.657 1.00 95.77  ? 218 VAL A CB  1 
HETATM 1719 S S   . SO4 B 2 .   ? 8.440   0.540   40.949 1.00 68.81  ? 301 SO4 A S   1 
HETATM 1720 O O1  . SO4 B 2 .   ? 9.547   -0.143  40.302 1.00 61.00  ? 301 SO4 A O1  1 
HETATM 1721 O O2  . SO4 B 2 .   ? 7.817   1.455   40.056 1.00 46.65  ? 301 SO4 A O2  1 
HETATM 1722 O O3  . SO4 B 2 .   ? 7.457   -0.464  41.388 1.00 54.21  ? 301 SO4 A O3  1 
HETATM 1723 O O4  . SO4 B 2 .   ? 8.900   1.280   42.124 1.00 78.01  ? 301 SO4 A O4  1 
HETATM 1724 O O   . HOH C 3 .   ? 11.570  -0.998  22.996 1.00 42.35  ? 401 HOH A O   1 
HETATM 1725 O O   . HOH C 3 .   ? 12.556  12.534  15.455 1.00 48.33  ? 402 HOH A O   1 
HETATM 1726 O O   . HOH C 3 .   ? 14.307  1.240   41.161 1.00 48.57  ? 403 HOH A O   1 
HETATM 1727 O O   . HOH C 3 .   ? -1.790  -2.931  23.986 1.00 42.19  ? 404 HOH A O   1 
HETATM 1728 O O   . HOH C 3 .   ? 18.286  11.218  15.271 1.00 47.68  ? 405 HOH A O   1 
HETATM 1729 O O   . HOH C 3 .   ? 13.385  2.472   10.898 1.00 47.18  ? 406 HOH A O   1 
HETATM 1730 O O   . HOH C 3 .   ? 7.704   3.641   29.385 1.00 50.02  ? 407 HOH A O   1 
HETATM 1731 O O   . HOH C 3 .   ? 6.178   -7.368  27.389 1.00 41.83  ? 408 HOH A O   1 
HETATM 1732 O O   . HOH C 3 .   ? 10.369  6.510   23.964 1.00 43.49  ? 409 HOH A O   1 
HETATM 1733 O O   . HOH C 3 .   ? 16.948  17.333  28.809 1.00 50.37  ? 410 HOH A O   1 
HETATM 1734 O O   . HOH C 3 .   ? 10.999  1.042   32.540 1.00 45.18  ? 411 HOH A O   1 
HETATM 1735 O O   . HOH C 3 .   ? 5.527   -2.334  41.498 1.00 39.20  ? 412 HOH A O   1 
HETATM 1736 O O   . HOH C 3 .   ? 19.985  7.384   30.673 1.00 40.91  ? 413 HOH A O   1 
HETATM 1737 O O   . HOH C 3 .   ? 12.271  -0.294  34.747 1.00 56.47  ? 414 HOH A O   1 
HETATM 1738 O O   . HOH C 3 .   ? 14.646  2.509   8.585  1.00 52.79  ? 415 HOH A O   1 
HETATM 1739 O O   . HOH C 3 .   ? 1.436   -3.407  24.093 1.00 45.51  ? 416 HOH A O   1 
HETATM 1740 O O   . HOH C 3 .   ? 16.871  -4.366  23.092 1.00 46.70  ? 417 HOH A O   1 
HETATM 1741 O O   . HOH C 3 .   ? 0.854   3.699   10.095 1.00 50.23  ? 418 HOH A O   1 
HETATM 1742 O O   . HOH C 3 .   ? 30.211  -2.333  35.801 1.00 57.87  ? 419 HOH A O   1 
HETATM 1743 O O   . HOH C 3 .   ? -8.806  3.657   31.449 1.00 68.66  ? 420 HOH A O   1 
HETATM 1744 O O   . HOH C 3 .   ? -5.374  5.374   33.170 0.50 64.20  ? 421 HOH A O   1 
# 
