data_9G6R
# 
_entry.id   9G6R 
# 
_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   9G6R         pdb_00009g6r 10.2210/pdb9g6r/pdb 
WWPDB D_1292139340 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-02-12 ? 
2 'Structure model' 1 1 2025-05-21 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume' 
2 2 'Structure model' '_citation.page_first'     
3 2 'Structure model' '_citation.page_last'      
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9G6R 
_pdbx_database_status.recvd_initial_deposition_date   2024-07-19 
_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_contact_author.id                 3 
_pdbx_contact_author.email              pierre.bruhns@pasteur.fr 
_pdbx_contact_author.name_first         Pierre 
_pdbx_contact_author.name_last          Bruhns 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-4709-8936 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Haouz, A.'  1 ? 
'Saul, F.A.' 2 ? 
'Bruhns, P.' 3 ? 
# 
_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                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'J.Allergy Clin.Immunol.' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1097-6825 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            155 
_citation.language                  ? 
_citation.page_first                1557 
_citation.page_last                 1574 
_citation.title                     
'Antibody-secreting cell repertoires hold high-affinity anti-rocuronium specificities that can induce anaphylaxis in vivo.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1016/j.jaci.2025.01.025 
_citation.pdbx_database_id_PubMed   39892658 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Dejoux, A.'          1  ? 
primary 'Zhu, Q.'             2  ? 
primary 'Woolfe, A.'          3  ? 
primary 'Godon, O.'           4  ? 
primary 'Ellouze, S.'         5  ? 
primary 'Mottet, G.'          6  ? 
primary 'Castrillon, C.'      7  ? 
primary 'Gillis, C.'          8  ? 
primary 'Pecalvel, C.'        9  ? 
primary 'Ganneau, C.'         10 ? 
primary 'Iannascoli, B.'      11 ? 
primary 'Lemoine, F.'         12 ? 
primary 'Saul, F.'            13 ? 
primary 'England, P.'         14 ? 
primary 'Reber, L.L.'         15 ? 
primary 'Gouel-Cheron, A.'    16 ? 
primary 'de Chaisemartin, L.' 17 ? 
primary 'Haouz, A.'           18 ? 
primary 'Millot, G.A.'        19 ? 
primary 'Bay, S.'             20 ? 
primary 'Gerard, A.'          21 ? 
primary 'Jonsson, F.'         22 ? 
primary 'Chollet-Martin, S.'  23 ? 
primary 'Bruhns, P.'          24 ? 
# 
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 'Fab-IP8 Heavy chain' 24046.760 1   ? ? ? ? 
2 polymer     man 'Fab-IP8 Light chain' 23988.676 1   ? ? ? ? 
3 non-polymer syn rocuronium            529.774   1   ? ? ? ? 
4 water       nat water                 18.015    354 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no yes 
;(PCA)VQLQQSGAELAKPGASVKLSCKASGYTFTSNWMHWVKQRPGQGLEWIGYINPSSGYSKYNQKFKDKATLTADKSS
STAYMQLSSLTYEDSAVYFCARLSYYDYDGGYFFDFWGQGTTLTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYF
PEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEP
;
;QVQLQQSGAELAKPGASVKLSCKASGYTFTSNWMHWVKQRPGQGLEWIGYINPSSGYSKYNQKFKDKATLTADKSSSTAY
MQLSSLTYEDSAVYFCARLSYYDYDGGYFFDFWGQGTTLTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPV
TVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEP
;
H ? 
2 'polypeptide(L)' no no  
;DIVITQDELSSPVTSGESVSISCRSSKSLLYKDGKTYLNWFLQRPGQSPQILIYLMSTRASGVSDRFSGSGSGTDFTLEI
SRVKAEDVGVYYCQQVVEYPYTFGGGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQ
SGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE
;
;DIVITQDELSSPVTSGESVSISCRSSKSLLYKDGKTYLNWFLQRPGQSPQILIYLMSTRASGVSDRFSGSGSGTDFTLEI
SRVKAEDVGVYYCQQVVEYPYTFGGGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQ
SGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE
;
L ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 rocuronium RBR 
4 water      HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   PCA n 
1 2   VAL n 
1 3   GLN n 
1 4   LEU n 
1 5   GLN n 
1 6   GLN n 
1 7   SER n 
1 8   GLY n 
1 9   ALA n 
1 10  GLU n 
1 11  LEU n 
1 12  ALA n 
1 13  LYS n 
1 14  PRO n 
1 15  GLY n 
1 16  ALA n 
1 17  SER n 
1 18  VAL n 
1 19  LYS n 
1 20  LEU n 
1 21  SER n 
1 22  CYS n 
1 23  LYS n 
1 24  ALA n 
1 25  SER n 
1 26  GLY n 
1 27  TYR n 
1 28  THR n 
1 29  PHE n 
1 30  THR n 
1 31  SER n 
1 32  ASN n 
1 33  TRP n 
1 34  MET n 
1 35  HIS n 
1 36  TRP n 
1 37  VAL n 
1 38  LYS n 
1 39  GLN n 
1 40  ARG n 
1 41  PRO n 
1 42  GLY n 
1 43  GLN n 
1 44  GLY n 
1 45  LEU n 
1 46  GLU n 
1 47  TRP n 
1 48  ILE n 
1 49  GLY n 
1 50  TYR n 
1 51  ILE n 
1 52  ASN n 
1 53  PRO n 
1 54  SER n 
1 55  SER n 
1 56  GLY n 
1 57  TYR n 
1 58  SER n 
1 59  LYS n 
1 60  TYR n 
1 61  ASN n 
1 62  GLN n 
1 63  LYS n 
1 64  PHE n 
1 65  LYS n 
1 66  ASP n 
1 67  LYS n 
1 68  ALA n 
1 69  THR n 
1 70  LEU n 
1 71  THR n 
1 72  ALA n 
1 73  ASP n 
1 74  LYS n 
1 75  SER n 
1 76  SER n 
1 77  SER n 
1 78  THR n 
1 79  ALA n 
1 80  TYR n 
1 81  MET n 
1 82  GLN n 
1 83  LEU n 
1 84  SER n 
1 85  SER n 
1 86  LEU n 
1 87  THR n 
1 88  TYR n 
1 89  GLU n 
1 90  ASP n 
1 91  SER n 
1 92  ALA n 
1 93  VAL n 
1 94  TYR n 
1 95  PHE n 
1 96  CYS n 
1 97  ALA n 
1 98  ARG n 
1 99  LEU n 
1 100 SER n 
1 101 TYR n 
1 102 TYR n 
1 103 ASP n 
1 104 TYR n 
1 105 ASP n 
1 106 GLY n 
1 107 GLY n 
1 108 TYR n 
1 109 PHE n 
1 110 PHE n 
1 111 ASP n 
1 112 PHE n 
1 113 TRP n 
1 114 GLY n 
1 115 GLN n 
1 116 GLY n 
1 117 THR n 
1 118 THR n 
1 119 LEU n 
1 120 THR n 
1 121 VAL n 
1 122 SER n 
1 123 SER n 
1 124 ALA n 
1 125 SER n 
1 126 THR n 
1 127 LYS n 
1 128 GLY n 
1 129 PRO n 
1 130 SER n 
1 131 VAL n 
1 132 PHE n 
1 133 PRO n 
1 134 LEU n 
1 135 ALA n 
1 136 PRO n 
1 137 SER n 
1 138 SER n 
1 139 LYS n 
1 140 SER n 
1 141 THR n 
1 142 SER n 
1 143 GLY n 
1 144 GLY n 
1 145 THR n 
1 146 ALA n 
1 147 ALA n 
1 148 LEU n 
1 149 GLY n 
1 150 CYS n 
1 151 LEU n 
1 152 VAL n 
1 153 LYS n 
1 154 ASP n 
1 155 TYR n 
1 156 PHE n 
1 157 PRO n 
1 158 GLU n 
1 159 PRO n 
1 160 VAL n 
1 161 THR n 
1 162 VAL n 
1 163 SER n 
1 164 TRP n 
1 165 ASN n 
1 166 SER n 
1 167 GLY n 
1 168 ALA n 
1 169 LEU n 
1 170 THR n 
1 171 SER n 
1 172 GLY n 
1 173 VAL n 
1 174 HIS n 
1 175 THR n 
1 176 PHE n 
1 177 PRO n 
1 178 ALA n 
1 179 VAL n 
1 180 LEU n 
1 181 GLN n 
1 182 SER n 
1 183 SER n 
1 184 GLY n 
1 185 LEU n 
1 186 TYR n 
1 187 SER n 
1 188 LEU n 
1 189 SER n 
1 190 SER n 
1 191 VAL n 
1 192 VAL n 
1 193 THR n 
1 194 VAL n 
1 195 PRO n 
1 196 SER n 
1 197 SER n 
1 198 SER n 
1 199 LEU n 
1 200 GLY n 
1 201 THR n 
1 202 GLN n 
1 203 THR n 
1 204 TYR n 
1 205 ILE n 
1 206 CYS n 
1 207 ASN n 
1 208 VAL n 
1 209 ASN n 
1 210 HIS n 
1 211 LYS n 
1 212 PRO n 
1 213 SER n 
1 214 ASN n 
1 215 THR n 
1 216 LYS n 
1 217 VAL n 
1 218 ASP n 
1 219 LYS n 
1 220 ARG n 
1 221 VAL n 
1 222 GLU n 
1 223 PRO n 
2 1   ASP n 
2 2   ILE n 
2 3   VAL n 
2 4   ILE n 
2 5   THR n 
2 6   GLN n 
2 7   ASP n 
2 8   GLU n 
2 9   LEU n 
2 10  SER n 
2 11  SER n 
2 12  PRO n 
2 13  VAL n 
2 14  THR n 
2 15  SER n 
2 16  GLY n 
2 17  GLU n 
2 18  SER n 
2 19  VAL n 
2 20  SER n 
2 21  ILE n 
2 22  SER n 
2 23  CYS n 
2 24  ARG n 
2 25  SER n 
2 26  SER n 
2 27  LYS n 
2 28  SER n 
2 29  LEU n 
2 30  LEU n 
2 31  TYR n 
2 32  LYS n 
2 33  ASP n 
2 34  GLY n 
2 35  LYS n 
2 36  THR n 
2 37  TYR n 
2 38  LEU n 
2 39  ASN n 
2 40  TRP n 
2 41  PHE n 
2 42  LEU n 
2 43  GLN n 
2 44  ARG n 
2 45  PRO n 
2 46  GLY n 
2 47  GLN n 
2 48  SER n 
2 49  PRO n 
2 50  GLN n 
2 51  ILE n 
2 52  LEU n 
2 53  ILE n 
2 54  TYR n 
2 55  LEU n 
2 56  MET n 
2 57  SER n 
2 58  THR n 
2 59  ARG n 
2 60  ALA n 
2 61  SER n 
2 62  GLY n 
2 63  VAL n 
2 64  SER n 
2 65  ASP n 
2 66  ARG n 
2 67  PHE n 
2 68  SER n 
2 69  GLY n 
2 70  SER n 
2 71  GLY n 
2 72  SER n 
2 73  GLY n 
2 74  THR n 
2 75  ASP n 
2 76  PHE n 
2 77  THR n 
2 78  LEU n 
2 79  GLU n 
2 80  ILE n 
2 81  SER n 
2 82  ARG n 
2 83  VAL n 
2 84  LYS n 
2 85  ALA n 
2 86  GLU n 
2 87  ASP n 
2 88  VAL n 
2 89  GLY n 
2 90  VAL n 
2 91  TYR n 
2 92  TYR n 
2 93  CYS n 
2 94  GLN n 
2 95  GLN n 
2 96  VAL n 
2 97  VAL n 
2 98  GLU n 
2 99  TYR n 
2 100 PRO n 
2 101 TYR n 
2 102 THR n 
2 103 PHE n 
2 104 GLY n 
2 105 GLY n 
2 106 GLY n 
2 107 THR n 
2 108 LYS n 
2 109 LEU n 
2 110 GLU n 
2 111 ILE n 
2 112 LYS n 
2 113 ARG n 
2 114 THR n 
2 115 VAL n 
2 116 ALA n 
2 117 ALA n 
2 118 PRO n 
2 119 SER n 
2 120 VAL n 
2 121 PHE n 
2 122 ILE n 
2 123 PHE n 
2 124 PRO n 
2 125 PRO n 
2 126 SER n 
2 127 ASP n 
2 128 GLU n 
2 129 GLN n 
2 130 LEU n 
2 131 LYS n 
2 132 SER n 
2 133 GLY n 
2 134 THR n 
2 135 ALA n 
2 136 SER n 
2 137 VAL n 
2 138 VAL n 
2 139 CYS n 
2 140 LEU n 
2 141 LEU n 
2 142 ASN n 
2 143 ASN n 
2 144 PHE n 
2 145 TYR n 
2 146 PRO n 
2 147 ARG n 
2 148 GLU n 
2 149 ALA n 
2 150 LYS n 
2 151 VAL n 
2 152 GLN n 
2 153 TRP n 
2 154 LYS n 
2 155 VAL n 
2 156 ASP n 
2 157 ASN n 
2 158 ALA n 
2 159 LEU n 
2 160 GLN n 
2 161 SER n 
2 162 GLY n 
2 163 ASN n 
2 164 SER n 
2 165 GLN n 
2 166 GLU n 
2 167 SER n 
2 168 VAL n 
2 169 THR n 
2 170 GLU n 
2 171 GLN n 
2 172 ASP n 
2 173 SER n 
2 174 LYS n 
2 175 ASP n 
2 176 SER n 
2 177 THR n 
2 178 TYR n 
2 179 SER n 
2 180 LEU n 
2 181 SER n 
2 182 SER n 
2 183 THR n 
2 184 LEU n 
2 185 THR n 
2 186 LEU n 
2 187 SER n 
2 188 LYS n 
2 189 ALA n 
2 190 ASP n 
2 191 TYR n 
2 192 GLU n 
2 193 LYS n 
2 194 HIS n 
2 195 LYS n 
2 196 VAL n 
2 197 TYR n 
2 198 ALA n 
2 199 CYS n 
2 200 GLU n 
2 201 VAL n 
2 202 THR n 
2 203 HIS n 
2 204 GLN n 
2 205 GLY n 
2 206 LEU n 
2 207 SER n 
2 208 SER n 
2 209 PRO n 
2 210 VAL n 
2 211 THR n 
2 212 LYS n 
2 213 SER n 
2 214 PHE n 
2 215 ASN n 
2 216 ARG n 
2 217 GLY n 
2 218 GLU n 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_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 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_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 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_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 
1 1 sample 'Biological sequence' 1 223 ? ? ? ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 
'HEK 293-F Cells' ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 218 ? ? ? ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 
'HEK 293-F Cells' ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE             ? 'C3 H7 N O2'      89.093  
ARG 'L-peptide linking' y ARGININE            ? 'C6 H15 N4 O2 1'  175.209 
ASN 'L-peptide linking' y ASPARAGINE          ? 'C4 H8 N2 O3'     132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'     ? 'C4 H7 N O4'      133.103 
CYS 'L-peptide linking' y CYSTEINE            ? 'C3 H7 N O2 S'    121.158 
GLN 'L-peptide linking' y GLUTAMINE           ? 'C5 H10 N2 O3'    146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'     ? 'C5 H9 N O4'      147.129 
GLY 'peptide linking'   y GLYCINE             ? 'C2 H5 N O2'      75.067  
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 
PCA 'L-peptide linking' n 'PYROGLUTAMIC ACID' ? 'C5 H7 N O3'      129.114 
PHE 'L-peptide linking' y PHENYLALANINE       ? 'C9 H11 N O2'     165.189 
PRO 'L-peptide linking' y PROLINE             ? 'C5 H9 N O2'      115.130 
RBR non-polymer         . rocuronium          ? 'C32 H53 N2 O4 1' 529.774 
SER 'L-peptide linking' y SERINE              ? 'C3 H7 N O3'      105.093 
THR 'L-peptide linking' y THREONINE           ? 'C4 H9 N O3'      119.119 
TRP 'L-peptide linking' y TRYPTOPHAN          ? 'C11 H12 N2 O2'   204.225 
TYR 'L-peptide linking' y TYROSINE            ? 'C9 H11 N O3'     181.189 
VAL 'L-peptide linking' y VALINE              ? 'C5 H11 N O2'     117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   PCA 1   1   1   PCA PCA H . n 
A 1 2   VAL 2   2   2   VAL VAL H . n 
A 1 3   GLN 3   3   3   GLN GLN H . n 
A 1 4   LEU 4   4   4   LEU LEU H . n 
A 1 5   GLN 5   5   5   GLN GLN H . n 
A 1 6   GLN 6   6   6   GLN GLN H . n 
A 1 7   SER 7   7   7   SER SER H . n 
A 1 8   GLY 8   8   8   GLY GLY H . n 
A 1 9   ALA 9   9   9   ALA ALA H . n 
A 1 10  GLU 10  10  10  GLU GLU H . n 
A 1 11  LEU 11  11  11  LEU LEU H . n 
A 1 12  ALA 12  12  12  ALA ALA H . n 
A 1 13  LYS 13  13  13  LYS LYS H . n 
A 1 14  PRO 14  14  14  PRO PRO H . n 
A 1 15  GLY 15  15  15  GLY GLY H . n 
A 1 16  ALA 16  16  16  ALA ALA H . n 
A 1 17  SER 17  17  17  SER SER H . n 
A 1 18  VAL 18  18  18  VAL VAL H . n 
A 1 19  LYS 19  19  19  LYS LYS H . n 
A 1 20  LEU 20  20  20  LEU LEU H . n 
A 1 21  SER 21  21  21  SER SER H . n 
A 1 22  CYS 22  22  22  CYS CYS H . n 
A 1 23  LYS 23  23  23  LYS LYS H . n 
A 1 24  ALA 24  24  24  ALA ALA H . n 
A 1 25  SER 25  25  25  SER SER H . n 
A 1 26  GLY 26  26  26  GLY GLY H . n 
A 1 27  TYR 27  27  27  TYR TYR H . n 
A 1 28  THR 28  28  28  THR THR H . n 
A 1 29  PHE 29  29  29  PHE PHE H . n 
A 1 30  THR 30  30  30  THR THR H . n 
A 1 31  SER 31  31  31  SER SER H . n 
A 1 32  ASN 32  32  32  ASN ASN H . n 
A 1 33  TRP 33  33  33  TRP TRP H . n 
A 1 34  MET 34  34  34  MET MET H . n 
A 1 35  HIS 35  35  35  HIS HIS H . n 
A 1 36  TRP 36  36  36  TRP TRP H . n 
A 1 37  VAL 37  37  37  VAL VAL H . n 
A 1 38  LYS 38  38  38  LYS LYS H . n 
A 1 39  GLN 39  39  39  GLN GLN H . n 
A 1 40  ARG 40  40  40  ARG ARG H . n 
A 1 41  PRO 41  41  41  PRO PRO H . n 
A 1 42  GLY 42  42  42  GLY GLY H . n 
A 1 43  GLN 43  43  43  GLN GLN H . n 
A 1 44  GLY 44  44  44  GLY GLY H . n 
A 1 45  LEU 45  45  45  LEU LEU H . n 
A 1 46  GLU 46  46  46  GLU GLU H . n 
A 1 47  TRP 47  47  47  TRP TRP H . n 
A 1 48  ILE 48  48  48  ILE ILE H . n 
A 1 49  GLY 49  49  49  GLY GLY H . n 
A 1 50  TYR 50  50  50  TYR TYR H . n 
A 1 51  ILE 51  51  51  ILE ILE H . n 
A 1 52  ASN 52  52  52  ASN ASN H . n 
A 1 53  PRO 53  52  52  PRO PRO H A n 
A 1 54  SER 54  53  53  SER SER H . n 
A 1 55  SER 55  54  54  SER SER H . n 
A 1 56  GLY 56  55  55  GLY GLY H . n 
A 1 57  TYR 57  56  56  TYR TYR H . n 
A 1 58  SER 58  57  57  SER SER H . n 
A 1 59  LYS 59  58  58  LYS LYS H . n 
A 1 60  TYR 60  59  59  TYR TYR H . n 
A 1 61  ASN 61  60  60  ASN ASN H . n 
A 1 62  GLN 62  61  61  GLN GLN H . n 
A 1 63  LYS 63  62  62  LYS LYS H . n 
A 1 64  PHE 64  63  63  PHE PHE H . n 
A 1 65  LYS 65  64  64  LYS LYS H . n 
A 1 66  ASP 66  65  65  ASP ASP H . n 
A 1 67  LYS 67  66  66  LYS LYS H . n 
A 1 68  ALA 68  67  67  ALA ALA H . n 
A 1 69  THR 69  68  68  THR THR H . n 
A 1 70  LEU 70  69  69  LEU LEU H . n 
A 1 71  THR 71  70  70  THR THR H . n 
A 1 72  ALA 72  71  71  ALA ALA H . n 
A 1 73  ASP 73  72  72  ASP ASP H . n 
A 1 74  LYS 74  73  73  LYS LYS H . n 
A 1 75  SER 75  74  74  SER SER H . n 
A 1 76  SER 76  75  75  SER SER H . n 
A 1 77  SER 77  76  76  SER SER H . n 
A 1 78  THR 78  77  77  THR THR H . n 
A 1 79  ALA 79  78  78  ALA ALA H . n 
A 1 80  TYR 80  79  79  TYR TYR H . n 
A 1 81  MET 81  80  80  MET MET H . n 
A 1 82  GLN 82  81  81  GLN GLN H . n 
A 1 83  LEU 83  82  82  LEU LEU H . n 
A 1 84  SER 84  82  82  SER SER H A n 
A 1 85  SER 85  82  82  SER SER H B n 
A 1 86  LEU 86  82  82  LEU LEU H C n 
A 1 87  THR 87  83  83  THR THR H . n 
A 1 88  TYR 88  84  84  TYR TYR H . n 
A 1 89  GLU 89  85  85  GLU GLU H . n 
A 1 90  ASP 90  86  86  ASP ASP H . n 
A 1 91  SER 91  87  87  SER SER H . n 
A 1 92  ALA 92  88  88  ALA ALA H . n 
A 1 93  VAL 93  89  89  VAL VAL H . n 
A 1 94  TYR 94  90  90  TYR TYR H . n 
A 1 95  PHE 95  91  91  PHE PHE H . n 
A 1 96  CYS 96  92  92  CYS CYS H . n 
A 1 97  ALA 97  93  93  ALA ALA H . n 
A 1 98  ARG 98  94  94  ARG ARG H . n 
A 1 99  LEU 99  95  95  LEU LEU H . n 
A 1 100 SER 100 96  96  SER SER H . n 
A 1 101 TYR 101 97  97  TYR TYR H . n 
A 1 102 TYR 102 98  98  TYR TYR H . n 
A 1 103 ASP 103 99  99  ASP ASP H . n 
A 1 104 TYR 104 100 100 TYR TYR H . n 
A 1 105 ASP 105 100 100 ASP ASP H A n 
A 1 106 GLY 106 100 100 GLY GLY H B n 
A 1 107 GLY 107 100 100 GLY GLY H C n 
A 1 108 TYR 108 100 100 TYR TYR H D n 
A 1 109 PHE 109 100 100 PHE PHE H E n 
A 1 110 PHE 110 100 100 PHE PHE H F n 
A 1 111 ASP 111 101 101 ASP ASP H . n 
A 1 112 PHE 112 102 102 PHE PHE H . n 
A 1 113 TRP 113 103 103 TRP TRP H . n 
A 1 114 GLY 114 104 104 GLY GLY H . n 
A 1 115 GLN 115 105 105 GLN GLN H . n 
A 1 116 GLY 116 106 106 GLY GLY H . n 
A 1 117 THR 117 107 107 THR THR H . n 
A 1 118 THR 118 108 108 THR THR H . n 
A 1 119 LEU 119 109 109 LEU LEU H . n 
A 1 120 THR 120 110 110 THR THR H . n 
A 1 121 VAL 121 111 111 VAL VAL H . n 
A 1 122 SER 122 112 112 SER SER H . n 
A 1 123 SER 123 113 113 SER SER H . n 
A 1 124 ALA 124 114 114 ALA ALA H . n 
A 1 125 SER 125 115 115 SER SER H . n 
A 1 126 THR 126 116 116 THR THR H . n 
A 1 127 LYS 127 117 117 LYS LYS H . n 
A 1 128 GLY 128 118 118 GLY GLY H . n 
A 1 129 PRO 129 119 119 PRO PRO H . n 
A 1 130 SER 130 120 120 SER SER H . n 
A 1 131 VAL 131 121 121 VAL VAL H . n 
A 1 132 PHE 132 122 122 PHE PHE H . n 
A 1 133 PRO 133 123 123 PRO PRO H . n 
A 1 134 LEU 134 124 124 LEU LEU H . n 
A 1 135 ALA 135 125 125 ALA ALA H . n 
A 1 136 PRO 136 126 126 PRO PRO H . n 
A 1 137 SER 137 127 127 SER SER H . n 
A 1 138 SER 138 128 128 SER SER H . n 
A 1 139 LYS 139 129 129 LYS LYS H . n 
A 1 140 SER 140 130 130 SER SER H . n 
A 1 141 THR 141 131 131 THR THR H . n 
A 1 142 SER 142 132 132 SER SER H . n 
A 1 143 GLY 143 133 133 GLY GLY H . n 
A 1 144 GLY 144 134 134 GLY GLY H . n 
A 1 145 THR 145 135 135 THR THR H . n 
A 1 146 ALA 146 136 136 ALA ALA H . n 
A 1 147 ALA 147 137 137 ALA ALA H . n 
A 1 148 LEU 148 138 138 LEU LEU H . n 
A 1 149 GLY 149 139 139 GLY GLY H . n 
A 1 150 CYS 150 140 140 CYS CYS H . n 
A 1 151 LEU 151 141 141 LEU LEU H . n 
A 1 152 VAL 152 142 142 VAL VAL H . n 
A 1 153 LYS 153 143 143 LYS LYS H . n 
A 1 154 ASP 154 144 144 ASP ASP H . n 
A 1 155 TYR 155 145 145 TYR TYR H . n 
A 1 156 PHE 156 146 146 PHE PHE H . n 
A 1 157 PRO 157 147 147 PRO PRO H . n 
A 1 158 GLU 158 148 148 GLU GLU H . n 
A 1 159 PRO 159 149 149 PRO PRO H . n 
A 1 160 VAL 160 150 150 VAL VAL H . n 
A 1 161 THR 161 151 151 THR THR H . n 
A 1 162 VAL 162 152 152 VAL VAL H . n 
A 1 163 SER 163 153 153 SER SER H . n 
A 1 164 TRP 164 154 154 TRP TRP H . n 
A 1 165 ASN 165 155 155 ASN ASN H . n 
A 1 166 SER 166 156 156 SER SER H . n 
A 1 167 GLY 167 157 157 GLY GLY H . n 
A 1 168 ALA 168 158 158 ALA ALA H . n 
A 1 169 LEU 169 159 159 LEU LEU H . n 
A 1 170 THR 170 160 160 THR THR H . n 
A 1 171 SER 171 161 161 SER SER H . n 
A 1 172 GLY 172 162 162 GLY GLY H . n 
A 1 173 VAL 173 163 163 VAL VAL H . n 
A 1 174 HIS 174 164 164 HIS HIS H . n 
A 1 175 THR 175 165 165 THR THR H . n 
A 1 176 PHE 176 166 166 PHE PHE H . n 
A 1 177 PRO 177 167 167 PRO PRO H . n 
A 1 178 ALA 178 168 168 ALA ALA H . n 
A 1 179 VAL 179 169 169 VAL VAL H . n 
A 1 180 LEU 180 170 170 LEU LEU H . n 
A 1 181 GLN 181 171 171 GLN GLN H . n 
A 1 182 SER 182 172 172 SER SER H . n 
A 1 183 SER 183 173 173 SER SER H . n 
A 1 184 GLY 184 174 174 GLY GLY H . n 
A 1 185 LEU 185 175 175 LEU LEU H . n 
A 1 186 TYR 186 176 176 TYR TYR H . n 
A 1 187 SER 187 177 177 SER SER H . n 
A 1 188 LEU 188 178 178 LEU LEU H . n 
A 1 189 SER 189 179 179 SER SER H . n 
A 1 190 SER 190 180 180 SER SER H . n 
A 1 191 VAL 191 181 181 VAL VAL H . n 
A 1 192 VAL 192 182 182 VAL VAL H . n 
A 1 193 THR 193 183 183 THR THR H . n 
A 1 194 VAL 194 184 184 VAL VAL H . n 
A 1 195 PRO 195 185 185 PRO PRO H . n 
A 1 196 SER 196 186 186 SER SER H . n 
A 1 197 SER 197 187 187 SER SER H . n 
A 1 198 SER 198 188 188 SER SER H . n 
A 1 199 LEU 199 189 189 LEU LEU H . n 
A 1 200 GLY 200 190 190 GLY GLY H . n 
A 1 201 THR 201 191 191 THR THR H . n 
A 1 202 GLN 202 192 192 GLN GLN H . n 
A 1 203 THR 203 193 193 THR THR H . n 
A 1 204 TYR 204 194 194 TYR TYR H . n 
A 1 205 ILE 205 195 195 ILE ILE H . n 
A 1 206 CYS 206 196 196 CYS CYS H . n 
A 1 207 ASN 207 197 197 ASN ASN H . n 
A 1 208 VAL 208 198 198 VAL VAL H . n 
A 1 209 ASN 209 199 199 ASN ASN H . n 
A 1 210 HIS 210 200 200 HIS HIS H . n 
A 1 211 LYS 211 201 201 LYS LYS H . n 
A 1 212 PRO 212 202 202 PRO PRO H . n 
A 1 213 SER 213 203 203 SER SER H . n 
A 1 214 ASN 214 204 204 ASN ASN H . n 
A 1 215 THR 215 205 205 THR THR H . n 
A 1 216 LYS 216 206 206 LYS LYS H . n 
A 1 217 VAL 217 207 207 VAL VAL H . n 
A 1 218 ASP 218 208 208 ASP ASP H . n 
A 1 219 LYS 219 209 209 LYS LYS H . n 
A 1 220 ARG 220 210 210 ARG ARG H . n 
A 1 221 VAL 221 211 211 VAL VAL H . n 
A 1 222 GLU 222 212 212 GLU GLU H . n 
A 1 223 PRO 223 213 213 PRO PRO H . n 
B 2 1   ASP 1   1   1   ASP ASP L . n 
B 2 2   ILE 2   2   2   ILE ILE L . n 
B 2 3   VAL 3   3   3   VAL VAL L . n 
B 2 4   ILE 4   4   4   ILE ILE L . n 
B 2 5   THR 5   5   5   THR THR L . n 
B 2 6   GLN 6   6   6   GLN GLN L . n 
B 2 7   ASP 7   7   7   ASP ASP L . n 
B 2 8   GLU 8   8   8   GLU GLU L . n 
B 2 9   LEU 9   9   9   LEU LEU L . n 
B 2 10  SER 10  10  10  SER SER L . n 
B 2 11  SER 11  11  11  SER SER L . n 
B 2 12  PRO 12  12  12  PRO PRO L . n 
B 2 13  VAL 13  13  13  VAL VAL L . n 
B 2 14  THR 14  14  14  THR THR L . n 
B 2 15  SER 15  15  15  SER SER L . n 
B 2 16  GLY 16  16  16  GLY GLY L . n 
B 2 17  GLU 17  17  17  GLU GLU L . n 
B 2 18  SER 18  18  18  SER SER L . n 
B 2 19  VAL 19  19  19  VAL VAL L . n 
B 2 20  SER 20  20  20  SER SER L . n 
B 2 21  ILE 21  21  21  ILE ILE L . n 
B 2 22  SER 22  22  22  SER SER L . n 
B 2 23  CYS 23  23  23  CYS CYS L . n 
B 2 24  ARG 24  24  24  ARG ARG L . n 
B 2 25  SER 25  25  25  SER SER L . n 
B 2 26  SER 26  26  26  SER SER L . n 
B 2 27  LYS 27  27  27  LYS LYS L . n 
B 2 28  SER 28  28  28  SER SER L . n 
B 2 29  LEU 29  29  29  LEU LEU L . n 
B 2 30  LEU 30  30  30  LEU LEU L . n 
B 2 31  TYR 31  30  30  TYR TYR L A n 
B 2 32  LYS 32  30  30  LYS LYS L B n 
B 2 33  ASP 33  30  30  ASP ASP L C n 
B 2 34  GLY 34  30  30  GLY GLY L D n 
B 2 35  LYS 35  30  30  LYS LYS L E n 
B 2 36  THR 36  31  31  THR THR L . n 
B 2 37  TYR 37  32  32  TYR TYR L . n 
B 2 38  LEU 38  33  33  LEU LEU L . n 
B 2 39  ASN 39  34  34  ASN ASN L . n 
B 2 40  TRP 40  35  35  TRP TRP L . n 
B 2 41  PHE 41  36  36  PHE PHE L . n 
B 2 42  LEU 42  37  37  LEU LEU L . n 
B 2 43  GLN 43  38  38  GLN GLN L . n 
B 2 44  ARG 44  39  39  ARG ARG L . n 
B 2 45  PRO 45  40  40  PRO PRO L . n 
B 2 46  GLY 46  41  41  GLY GLY L . n 
B 2 47  GLN 47  42  42  GLN GLN L . n 
B 2 48  SER 48  43  43  SER SER L . n 
B 2 49  PRO 49  44  44  PRO PRO L . n 
B 2 50  GLN 50  45  45  GLN GLN L . n 
B 2 51  ILE 51  46  46  ILE ILE L . n 
B 2 52  LEU 52  47  47  LEU LEU L . n 
B 2 53  ILE 53  48  48  ILE ILE L . n 
B 2 54  TYR 54  49  49  TYR TYR L . n 
B 2 55  LEU 55  50  50  LEU LEU L . n 
B 2 56  MET 56  51  51  MET MET L . n 
B 2 57  SER 57  52  52  SER SER L . n 
B 2 58  THR 58  53  53  THR THR L . n 
B 2 59  ARG 59  54  54  ARG ARG L . n 
B 2 60  ALA 60  55  55  ALA ALA L . n 
B 2 61  SER 61  56  56  SER SER L . n 
B 2 62  GLY 62  57  57  GLY GLY L . n 
B 2 63  VAL 63  58  58  VAL VAL L . n 
B 2 64  SER 64  59  59  SER SER L . n 
B 2 65  ASP 65  60  60  ASP ASP L . n 
B 2 66  ARG 66  61  61  ARG ARG L . n 
B 2 67  PHE 67  62  62  PHE PHE L . n 
B 2 68  SER 68  63  63  SER SER L . n 
B 2 69  GLY 69  64  64  GLY GLY L . n 
B 2 70  SER 70  65  65  SER SER L . n 
B 2 71  GLY 71  66  66  GLY GLY L . n 
B 2 72  SER 72  67  67  SER SER L . n 
B 2 73  GLY 73  68  68  GLY GLY L . n 
B 2 74  THR 74  69  69  THR THR L . n 
B 2 75  ASP 75  70  70  ASP ASP L . n 
B 2 76  PHE 76  71  71  PHE PHE L . n 
B 2 77  THR 77  72  72  THR THR L . n 
B 2 78  LEU 78  73  73  LEU LEU L . n 
B 2 79  GLU 79  74  74  GLU GLU L . n 
B 2 80  ILE 80  75  75  ILE ILE L . n 
B 2 81  SER 81  76  76  SER SER L . n 
B 2 82  ARG 82  77  77  ARG ARG L . n 
B 2 83  VAL 83  78  78  VAL VAL L . n 
B 2 84  LYS 84  79  79  LYS LYS L . n 
B 2 85  ALA 85  80  80  ALA ALA L . n 
B 2 86  GLU 86  81  81  GLU GLU L . n 
B 2 87  ASP 87  82  82  ASP ASP L . n 
B 2 88  VAL 88  83  83  VAL VAL L . n 
B 2 89  GLY 89  84  84  GLY GLY L . n 
B 2 90  VAL 90  85  85  VAL VAL L . n 
B 2 91  TYR 91  86  86  TYR TYR L . n 
B 2 92  TYR 92  87  87  TYR TYR L . n 
B 2 93  CYS 93  88  88  CYS CYS L . n 
B 2 94  GLN 94  89  89  GLN GLN L . n 
B 2 95  GLN 95  90  90  GLN GLN L . n 
B 2 96  VAL 96  91  91  VAL VAL L . n 
B 2 97  VAL 97  92  92  VAL VAL L . n 
B 2 98  GLU 98  93  93  GLU GLU L . n 
B 2 99  TYR 99  94  94  TYR TYR L . n 
B 2 100 PRO 100 95  95  PRO PRO L . n 
B 2 101 TYR 101 96  96  TYR TYR L . n 
B 2 102 THR 102 97  97  THR THR L . n 
B 2 103 PHE 103 98  98  PHE PHE L . n 
B 2 104 GLY 104 99  99  GLY GLY L . n 
B 2 105 GLY 105 100 100 GLY GLY L . n 
B 2 106 GLY 106 101 101 GLY GLY L . n 
B 2 107 THR 107 102 102 THR THR L . n 
B 2 108 LYS 108 103 103 LYS LYS L . n 
B 2 109 LEU 109 104 104 LEU LEU L . n 
B 2 110 GLU 110 105 105 GLU GLU L . n 
B 2 111 ILE 111 106 106 ILE ILE L . n 
B 2 112 LYS 112 107 107 LYS LYS L . n 
B 2 113 ARG 113 108 108 ARG ARG L . n 
B 2 114 THR 114 109 109 THR THR L . n 
B 2 115 VAL 115 110 110 VAL VAL L . n 
B 2 116 ALA 116 111 111 ALA ALA L . n 
B 2 117 ALA 117 112 112 ALA ALA L . n 
B 2 118 PRO 118 113 113 PRO PRO L . n 
B 2 119 SER 119 114 114 SER SER L . n 
B 2 120 VAL 120 115 115 VAL VAL L . n 
B 2 121 PHE 121 116 116 PHE PHE L . n 
B 2 122 ILE 122 117 117 ILE ILE L . n 
B 2 123 PHE 123 118 118 PHE PHE L . n 
B 2 124 PRO 124 119 119 PRO PRO L . n 
B 2 125 PRO 125 120 120 PRO PRO L . n 
B 2 126 SER 126 121 121 SER SER L . n 
B 2 127 ASP 127 122 122 ASP ASP L . n 
B 2 128 GLU 128 123 123 GLU GLU L . n 
B 2 129 GLN 129 124 124 GLN GLN L . n 
B 2 130 LEU 130 125 125 LEU LEU L . n 
B 2 131 LYS 131 126 126 LYS LYS L . n 
B 2 132 SER 132 127 127 SER SER L . n 
B 2 133 GLY 133 128 128 GLY GLY L . n 
B 2 134 THR 134 129 129 THR THR L . n 
B 2 135 ALA 135 130 130 ALA ALA L . n 
B 2 136 SER 136 131 131 SER SER L . n 
B 2 137 VAL 137 132 132 VAL VAL L . n 
B 2 138 VAL 138 133 133 VAL VAL L . n 
B 2 139 CYS 139 134 134 CYS CYS L . n 
B 2 140 LEU 140 135 135 LEU LEU L . n 
B 2 141 LEU 141 136 136 LEU LEU L . n 
B 2 142 ASN 142 137 137 ASN ASN L . n 
B 2 143 ASN 143 138 138 ASN ASN L . n 
B 2 144 PHE 144 139 139 PHE PHE L . n 
B 2 145 TYR 145 140 140 TYR TYR L . n 
B 2 146 PRO 146 141 141 PRO PRO L . n 
B 2 147 ARG 147 142 142 ARG ARG L . n 
B 2 148 GLU 148 143 143 GLU GLU L . n 
B 2 149 ALA 149 144 144 ALA ALA L . n 
B 2 150 LYS 150 145 145 LYS LYS L . n 
B 2 151 VAL 151 146 146 VAL VAL L . n 
B 2 152 GLN 152 147 147 GLN GLN L . n 
B 2 153 TRP 153 148 148 TRP TRP L . n 
B 2 154 LYS 154 149 149 LYS LYS L . n 
B 2 155 VAL 155 150 150 VAL VAL L . n 
B 2 156 ASP 156 151 151 ASP ASP L . n 
B 2 157 ASN 157 152 152 ASN ASN L . n 
B 2 158 ALA 158 153 153 ALA ALA L . n 
B 2 159 LEU 159 154 154 LEU LEU L . n 
B 2 160 GLN 160 155 155 GLN GLN L . n 
B 2 161 SER 161 156 156 SER SER L . n 
B 2 162 GLY 162 157 157 GLY GLY L . n 
B 2 163 ASN 163 158 158 ASN ASN L . n 
B 2 164 SER 164 159 159 SER SER L . n 
B 2 165 GLN 165 160 160 GLN GLN L . n 
B 2 166 GLU 166 161 161 GLU GLU L . n 
B 2 167 SER 167 162 162 SER SER L . n 
B 2 168 VAL 168 163 163 VAL VAL L . n 
B 2 169 THR 169 164 164 THR THR L . n 
B 2 170 GLU 170 165 165 GLU GLU L . n 
B 2 171 GLN 171 166 166 GLN GLN L . n 
B 2 172 ASP 172 167 167 ASP ASP L . n 
B 2 173 SER 173 168 168 SER SER L . n 
B 2 174 LYS 174 169 169 LYS LYS L . n 
B 2 175 ASP 175 170 170 ASP ASP L . n 
B 2 176 SER 176 171 171 SER SER L . n 
B 2 177 THR 177 172 172 THR THR L . n 
B 2 178 TYR 178 173 173 TYR TYR L . n 
B 2 179 SER 179 174 174 SER SER L . n 
B 2 180 LEU 180 175 175 LEU LEU L . n 
B 2 181 SER 181 176 176 SER SER L . n 
B 2 182 SER 182 177 177 SER SER L . n 
B 2 183 THR 183 178 178 THR THR L . n 
B 2 184 LEU 184 179 179 LEU LEU L . n 
B 2 185 THR 185 180 180 THR THR L . n 
B 2 186 LEU 186 181 181 LEU LEU L . n 
B 2 187 SER 187 182 182 SER SER L . n 
B 2 188 LYS 188 183 183 LYS LYS L . n 
B 2 189 ALA 189 184 184 ALA ALA L . n 
B 2 190 ASP 190 185 185 ASP ASP L . n 
B 2 191 TYR 191 186 186 TYR TYR L . n 
B 2 192 GLU 192 187 187 GLU GLU L . n 
B 2 193 LYS 193 188 188 LYS LYS L . n 
B 2 194 HIS 194 189 189 HIS HIS L . n 
B 2 195 LYS 195 190 190 LYS LYS L . n 
B 2 196 VAL 196 191 191 VAL VAL L . n 
B 2 197 TYR 197 192 192 TYR TYR L . n 
B 2 198 ALA 198 193 193 ALA ALA L . n 
B 2 199 CYS 199 194 194 CYS CYS L . n 
B 2 200 GLU 200 195 195 GLU GLU L . n 
B 2 201 VAL 201 196 196 VAL VAL L . n 
B 2 202 THR 202 197 197 THR THR L . n 
B 2 203 HIS 203 198 198 HIS HIS L . n 
B 2 204 GLN 204 199 199 GLN GLN L . n 
B 2 205 GLY 205 200 200 GLY GLY L . n 
B 2 206 LEU 206 201 201 LEU LEU L . n 
B 2 207 SER 207 202 202 SER SER L . n 
B 2 208 SER 208 203 203 SER SER L . n 
B 2 209 PRO 209 204 204 PRO PRO L . n 
B 2 210 VAL 210 205 205 VAL VAL L . n 
B 2 211 THR 211 206 206 THR THR L . n 
B 2 212 LYS 212 207 207 LYS LYS L . n 
B 2 213 SER 213 208 208 SER SER L . n 
B 2 214 PHE 214 209 209 PHE PHE L . n 
B 2 215 ASN 215 210 210 ASN ASN L . n 
B 2 216 ARG 216 211 211 ARG ARG L . n 
B 2 217 GLY 217 212 212 GLY GLY L . n 
B 2 218 GLU 218 213 213 GLU GLU L . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        RBR 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   RBR 
_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 
C 3 RBR 1   301 1   RBR RBR H . 
D 4 HOH 1   401 324 HOH HOH H . 
D 4 HOH 2   402 321 HOH HOH H . 
D 4 HOH 3   403 126 HOH HOH H . 
D 4 HOH 4   404 320 HOH HOH H . 
D 4 HOH 5   405 230 HOH HOH H . 
D 4 HOH 6   406 123 HOH HOH H . 
D 4 HOH 7   407 328 HOH HOH H . 
D 4 HOH 8   408 50  HOH HOH H . 
D 4 HOH 9   409 317 HOH HOH H . 
D 4 HOH 10  410 69  HOH HOH H . 
D 4 HOH 11  411 318 HOH HOH H . 
D 4 HOH 12  412 40  HOH HOH H . 
D 4 HOH 13  413 81  HOH HOH H . 
D 4 HOH 14  414 228 HOH HOH H . 
D 4 HOH 15  415 252 HOH HOH H . 
D 4 HOH 16  416 111 HOH HOH H . 
D 4 HOH 17  417 227 HOH HOH H . 
D 4 HOH 18  418 258 HOH HOH H . 
D 4 HOH 19  419 60  HOH HOH H . 
D 4 HOH 20  420 303 HOH HOH H . 
D 4 HOH 21  421 144 HOH HOH H . 
D 4 HOH 22  422 325 HOH HOH H . 
D 4 HOH 23  423 75  HOH HOH H . 
D 4 HOH 24  424 246 HOH HOH H . 
D 4 HOH 25  425 11  HOH HOH H . 
D 4 HOH 26  426 35  HOH HOH H . 
D 4 HOH 27  427 285 HOH HOH H . 
D 4 HOH 28  428 181 HOH HOH H . 
D 4 HOH 29  429 20  HOH HOH H . 
D 4 HOH 30  430 242 HOH HOH H . 
D 4 HOH 31  431 61  HOH HOH H . 
D 4 HOH 32  432 93  HOH HOH H . 
D 4 HOH 33  433 204 HOH HOH H . 
D 4 HOH 34  434 104 HOH HOH H . 
D 4 HOH 35  435 58  HOH HOH H . 
D 4 HOH 36  436 96  HOH HOH H . 
D 4 HOH 37  437 166 HOH HOH H . 
D 4 HOH 38  438 135 HOH HOH H . 
D 4 HOH 39  439 218 HOH HOH H . 
D 4 HOH 40  440 131 HOH HOH H . 
D 4 HOH 41  441 156 HOH HOH H . 
D 4 HOH 42  442 86  HOH HOH H . 
D 4 HOH 43  443 195 HOH HOH H . 
D 4 HOH 44  444 44  HOH HOH H . 
D 4 HOH 45  445 122 HOH HOH H . 
D 4 HOH 46  446 56  HOH HOH H . 
D 4 HOH 47  447 120 HOH HOH H . 
D 4 HOH 48  448 200 HOH HOH H . 
D 4 HOH 49  449 29  HOH HOH H . 
D 4 HOH 50  450 289 HOH HOH H . 
D 4 HOH 51  451 277 HOH HOH H . 
D 4 HOH 52  452 188 HOH HOH H . 
D 4 HOH 53  453 133 HOH HOH H . 
D 4 HOH 54  454 87  HOH HOH H . 
D 4 HOH 55  455 179 HOH HOH H . 
D 4 HOH 56  456 46  HOH HOH H . 
D 4 HOH 57  457 10  HOH HOH H . 
D 4 HOH 58  458 137 HOH HOH H . 
D 4 HOH 59  459 107 HOH HOH H . 
D 4 HOH 60  460 109 HOH HOH H . 
D 4 HOH 61  461 23  HOH HOH H . 
D 4 HOH 62  462 3   HOH HOH H . 
D 4 HOH 63  463 141 HOH HOH H . 
D 4 HOH 64  464 245 HOH HOH H . 
D 4 HOH 65  465 167 HOH HOH H . 
D 4 HOH 66  466 148 HOH HOH H . 
D 4 HOH 67  467 71  HOH HOH H . 
D 4 HOH 68  468 42  HOH HOH H . 
D 4 HOH 69  469 27  HOH HOH H . 
D 4 HOH 70  470 8   HOH HOH H . 
D 4 HOH 71  471 308 HOH HOH H . 
D 4 HOH 72  472 74  HOH HOH H . 
D 4 HOH 73  473 82  HOH HOH H . 
D 4 HOH 74  474 16  HOH HOH H . 
D 4 HOH 75  475 95  HOH HOH H . 
D 4 HOH 76  476 63  HOH HOH H . 
D 4 HOH 77  477 255 HOH HOH H . 
D 4 HOH 78  478 30  HOH HOH H . 
D 4 HOH 79  479 77  HOH HOH H . 
D 4 HOH 80  480 129 HOH HOH H . 
D 4 HOH 81  481 25  HOH HOH H . 
D 4 HOH 82  482 12  HOH HOH H . 
D 4 HOH 83  483 161 HOH HOH H . 
D 4 HOH 84  484 100 HOH HOH H . 
D 4 HOH 85  485 136 HOH HOH H . 
D 4 HOH 86  486 127 HOH HOH H . 
D 4 HOH 87  487 191 HOH HOH H . 
D 4 HOH 88  488 158 HOH HOH H . 
D 4 HOH 89  489 106 HOH HOH H . 
D 4 HOH 90  490 250 HOH HOH H . 
D 4 HOH 91  491 15  HOH HOH H . 
D 4 HOH 92  492 33  HOH HOH H . 
D 4 HOH 93  493 264 HOH HOH H . 
D 4 HOH 94  494 21  HOH HOH H . 
D 4 HOH 95  495 45  HOH HOH H . 
D 4 HOH 96  496 19  HOH HOH H . 
D 4 HOH 97  497 4   HOH HOH H . 
D 4 HOH 98  498 5   HOH HOH H . 
D 4 HOH 99  499 2   HOH HOH H . 
D 4 HOH 100 500 99  HOH HOH H . 
D 4 HOH 101 501 286 HOH HOH H . 
D 4 HOH 102 502 213 HOH HOH H . 
D 4 HOH 103 503 293 HOH HOH H . 
D 4 HOH 104 504 243 HOH HOH H . 
D 4 HOH 105 505 276 HOH HOH H . 
D 4 HOH 106 506 162 HOH HOH H . 
D 4 HOH 107 507 353 HOH HOH H . 
D 4 HOH 108 508 28  HOH HOH H . 
D 4 HOH 109 509 88  HOH HOH H . 
D 4 HOH 110 510 85  HOH HOH H . 
D 4 HOH 111 511 36  HOH HOH H . 
D 4 HOH 112 512 72  HOH HOH H . 
D 4 HOH 113 513 177 HOH HOH H . 
D 4 HOH 114 514 196 HOH HOH H . 
D 4 HOH 115 515 232 HOH HOH H . 
D 4 HOH 116 516 39  HOH HOH H . 
D 4 HOH 117 517 132 HOH HOH H . 
D 4 HOH 118 518 192 HOH HOH H . 
D 4 HOH 119 519 160 HOH HOH H . 
D 4 HOH 120 520 89  HOH HOH H . 
D 4 HOH 121 521 178 HOH HOH H . 
D 4 HOH 122 522 142 HOH HOH H . 
D 4 HOH 123 523 134 HOH HOH H . 
D 4 HOH 124 524 92  HOH HOH H . 
D 4 HOH 125 525 47  HOH HOH H . 
D 4 HOH 126 526 6   HOH HOH H . 
D 4 HOH 127 527 55  HOH HOH H . 
D 4 HOH 128 528 17  HOH HOH H . 
D 4 HOH 129 529 145 HOH HOH H . 
D 4 HOH 130 530 18  HOH HOH H . 
D 4 HOH 131 531 9   HOH HOH H . 
D 4 HOH 132 532 62  HOH HOH H . 
D 4 HOH 133 533 53  HOH HOH H . 
D 4 HOH 134 534 41  HOH HOH H . 
D 4 HOH 135 535 26  HOH HOH H . 
D 4 HOH 136 536 172 HOH HOH H . 
D 4 HOH 137 537 261 HOH HOH H . 
D 4 HOH 138 538 70  HOH HOH H . 
D 4 HOH 139 539 97  HOH HOH H . 
D 4 HOH 140 540 13  HOH HOH H . 
D 4 HOH 141 541 288 HOH HOH H . 
D 4 HOH 142 542 14  HOH HOH H . 
D 4 HOH 143 543 143 HOH HOH H . 
D 4 HOH 144 544 67  HOH HOH H . 
D 4 HOH 145 545 248 HOH HOH H . 
D 4 HOH 146 546 207 HOH HOH H . 
D 4 HOH 147 547 31  HOH HOH H . 
D 4 HOH 148 548 203 HOH HOH H . 
D 4 HOH 149 549 263 HOH HOH H . 
D 4 HOH 150 550 215 HOH HOH H . 
D 4 HOH 151 551 91  HOH HOH H . 
D 4 HOH 152 552 189 HOH HOH H . 
D 4 HOH 153 553 290 HOH HOH H . 
D 4 HOH 154 554 176 HOH HOH H . 
D 4 HOH 155 555 311 HOH HOH H . 
D 4 HOH 156 556 130 HOH HOH H . 
D 4 HOH 157 557 119 HOH HOH H . 
D 4 HOH 158 558 24  HOH HOH H . 
D 4 HOH 159 559 153 HOH HOH H . 
D 4 HOH 160 560 73  HOH HOH H . 
D 4 HOH 161 561 199 HOH HOH H . 
D 4 HOH 162 562 217 HOH HOH H . 
D 4 HOH 163 563 147 HOH HOH H . 
D 4 HOH 164 564 52  HOH HOH H . 
D 4 HOH 165 565 205 HOH HOH H . 
D 4 HOH 166 566 57  HOH HOH H . 
D 4 HOH 167 567 302 HOH HOH H . 
D 4 HOH 168 568 112 HOH HOH H . 
D 4 HOH 169 569 84  HOH HOH H . 
D 4 HOH 170 570 197 HOH HOH H . 
D 4 HOH 171 571 322 HOH HOH H . 
D 4 HOH 172 572 342 HOH HOH H . 
D 4 HOH 173 573 214 HOH HOH H . 
D 4 HOH 174 574 312 HOH HOH H . 
D 4 HOH 175 575 345 HOH HOH H . 
D 4 HOH 176 576 150 HOH HOH H . 
D 4 HOH 177 577 237 HOH HOH H . 
D 4 HOH 178 578 313 HOH HOH H . 
D 4 HOH 179 579 348 HOH HOH H . 
D 4 HOH 180 580 163 HOH HOH H . 
D 4 HOH 181 581 231 HOH HOH H . 
D 4 HOH 182 582 101 HOH HOH H . 
D 4 HOH 183 583 346 HOH HOH H . 
D 4 HOH 184 584 351 HOH HOH H . 
D 4 HOH 185 585 198 HOH HOH H . 
D 4 HOH 186 586 336 HOH HOH H . 
D 4 HOH 187 587 291 HOH HOH H . 
D 4 HOH 188 588 262 HOH HOH H . 
D 4 HOH 189 589 301 HOH HOH H . 
D 4 HOH 190 590 281 HOH HOH H . 
D 4 HOH 191 591 219 HOH HOH H . 
D 4 HOH 192 592 265 HOH HOH H . 
D 4 HOH 193 593 341 HOH HOH H . 
D 4 HOH 194 594 210 HOH HOH H . 
D 4 HOH 195 595 282 HOH HOH H . 
D 4 HOH 196 596 297 HOH HOH H . 
D 4 HOH 197 597 323 HOH HOH H . 
D 4 HOH 198 598 298 HOH HOH H . 
D 4 HOH 199 599 115 HOH HOH H . 
D 4 HOH 200 600 350 HOH HOH H . 
D 4 HOH 201 601 253 HOH HOH H . 
D 4 HOH 202 602 339 HOH HOH H . 
D 4 HOH 203 603 270 HOH HOH H . 
D 4 HOH 204 604 352 HOH HOH H . 
D 4 HOH 205 605 225 HOH HOH H . 
D 4 HOH 206 606 272 HOH HOH H . 
D 4 HOH 207 607 331 HOH HOH H . 
D 4 HOH 208 608 222 HOH HOH H . 
D 4 HOH 209 609 201 HOH HOH H . 
D 4 HOH 210 610 173 HOH HOH H . 
D 4 HOH 211 611 326 HOH HOH H . 
D 4 HOH 212 612 273 HOH HOH H . 
D 4 HOH 213 613 354 HOH HOH H . 
D 4 HOH 214 614 294 HOH HOH H . 
D 4 HOH 215 615 139 HOH HOH H . 
D 4 HOH 216 616 251 HOH HOH H . 
D 4 HOH 217 617 208 HOH HOH H . 
D 4 HOH 218 618 249 HOH HOH H . 
D 4 HOH 219 619 335 HOH HOH H . 
D 4 HOH 220 620 338 HOH HOH H . 
E 4 HOH 1   301 319 HOH HOH L . 
E 4 HOH 2   302 193 HOH HOH L . 
E 4 HOH 3   303 194 HOH HOH L . 
E 4 HOH 4   304 90  HOH HOH L . 
E 4 HOH 5   305 151 HOH HOH L . 
E 4 HOH 6   306 149 HOH HOH L . 
E 4 HOH 7   307 140 HOH HOH L . 
E 4 HOH 8   308 102 HOH HOH L . 
E 4 HOH 9   309 165 HOH HOH L . 
E 4 HOH 10  310 171 HOH HOH L . 
E 4 HOH 11  311 105 HOH HOH L . 
E 4 HOH 12  312 332 HOH HOH L . 
E 4 HOH 13  313 206 HOH HOH L . 
E 4 HOH 14  314 116 HOH HOH L . 
E 4 HOH 15  315 94  HOH HOH L . 
E 4 HOH 16  316 83  HOH HOH L . 
E 4 HOH 17  317 38  HOH HOH L . 
E 4 HOH 18  318 274 HOH HOH L . 
E 4 HOH 19  319 236 HOH HOH L . 
E 4 HOH 20  320 233 HOH HOH L . 
E 4 HOH 21  321 48  HOH HOH L . 
E 4 HOH 22  322 266 HOH HOH L . 
E 4 HOH 23  323 267 HOH HOH L . 
E 4 HOH 24  324 169 HOH HOH L . 
E 4 HOH 25  325 43  HOH HOH L . 
E 4 HOH 26  326 343 HOH HOH L . 
E 4 HOH 27  327 152 HOH HOH L . 
E 4 HOH 28  328 349 HOH HOH L . 
E 4 HOH 29  329 315 HOH HOH L . 
E 4 HOH 30  330 337 HOH HOH L . 
E 4 HOH 31  331 54  HOH HOH L . 
E 4 HOH 32  332 284 HOH HOH L . 
E 4 HOH 33  333 309 HOH HOH L . 
E 4 HOH 34  334 154 HOH HOH L . 
E 4 HOH 35  335 333 HOH HOH L . 
E 4 HOH 36  336 307 HOH HOH L . 
E 4 HOH 37  337 128 HOH HOH L . 
E 4 HOH 38  338 275 HOH HOH L . 
E 4 HOH 39  339 269 HOH HOH L . 
E 4 HOH 40  340 306 HOH HOH L . 
E 4 HOH 41  341 310 HOH HOH L . 
E 4 HOH 42  342 76  HOH HOH L . 
E 4 HOH 43  343 234 HOH HOH L . 
E 4 HOH 44  344 125 HOH HOH L . 
E 4 HOH 45  345 117 HOH HOH L . 
E 4 HOH 46  346 124 HOH HOH L . 
E 4 HOH 47  347 211 HOH HOH L . 
E 4 HOH 48  348 180 HOH HOH L . 
E 4 HOH 49  349 118 HOH HOH L . 
E 4 HOH 50  350 247 HOH HOH L . 
E 4 HOH 51  351 51  HOH HOH L . 
E 4 HOH 52  352 103 HOH HOH L . 
E 4 HOH 53  353 113 HOH HOH L . 
E 4 HOH 54  354 65  HOH HOH L . 
E 4 HOH 55  355 49  HOH HOH L . 
E 4 HOH 56  356 175 HOH HOH L . 
E 4 HOH 57  357 174 HOH HOH L . 
E 4 HOH 58  358 22  HOH HOH L . 
E 4 HOH 59  359 108 HOH HOH L . 
E 4 HOH 60  360 34  HOH HOH L . 
E 4 HOH 61  361 98  HOH HOH L . 
E 4 HOH 62  362 110 HOH HOH L . 
E 4 HOH 63  363 121 HOH HOH L . 
E 4 HOH 64  364 37  HOH HOH L . 
E 4 HOH 65  365 238 HOH HOH L . 
E 4 HOH 66  366 182 HOH HOH L . 
E 4 HOH 67  367 78  HOH HOH L . 
E 4 HOH 68  368 1   HOH HOH L . 
E 4 HOH 69  369 280 HOH HOH L . 
E 4 HOH 70  370 256 HOH HOH L . 
E 4 HOH 71  371 300 HOH HOH L . 
E 4 HOH 72  372 159 HOH HOH L . 
E 4 HOH 73  373 190 HOH HOH L . 
E 4 HOH 74  374 66  HOH HOH L . 
E 4 HOH 75  375 241 HOH HOH L . 
E 4 HOH 76  376 244 HOH HOH L . 
E 4 HOH 77  377 32  HOH HOH L . 
E 4 HOH 78  378 80  HOH HOH L . 
E 4 HOH 79  379 202 HOH HOH L . 
E 4 HOH 80  380 79  HOH HOH L . 
E 4 HOH 81  381 316 HOH HOH L . 
E 4 HOH 82  382 114 HOH HOH L . 
E 4 HOH 83  383 170 HOH HOH L . 
E 4 HOH 84  384 340 HOH HOH L . 
E 4 HOH 85  385 7   HOH HOH L . 
E 4 HOH 86  386 278 HOH HOH L . 
E 4 HOH 87  387 295 HOH HOH L . 
E 4 HOH 88  388 157 HOH HOH L . 
E 4 HOH 89  389 138 HOH HOH L . 
E 4 HOH 90  390 239 HOH HOH L . 
E 4 HOH 91  391 164 HOH HOH L . 
E 4 HOH 92  392 64  HOH HOH L . 
E 4 HOH 93  393 155 HOH HOH L . 
E 4 HOH 94  394 226 HOH HOH L . 
E 4 HOH 95  395 220 HOH HOH L . 
E 4 HOH 96  396 221 HOH HOH L . 
E 4 HOH 97  397 168 HOH HOH L . 
E 4 HOH 98  398 59  HOH HOH L . 
E 4 HOH 99  399 216 HOH HOH L . 
E 4 HOH 100 400 260 HOH HOH L . 
E 4 HOH 101 401 184 HOH HOH L . 
E 4 HOH 102 402 257 HOH HOH L . 
E 4 HOH 103 403 240 HOH HOH L . 
E 4 HOH 104 404 68  HOH HOH L . 
E 4 HOH 105 405 330 HOH HOH L . 
E 4 HOH 106 406 235 HOH HOH L . 
E 4 HOH 107 407 304 HOH HOH L . 
E 4 HOH 108 408 209 HOH HOH L . 
E 4 HOH 109 409 259 HOH HOH L . 
E 4 HOH 110 410 347 HOH HOH L . 
E 4 HOH 111 411 224 HOH HOH L . 
E 4 HOH 112 412 223 HOH HOH L . 
E 4 HOH 113 413 183 HOH HOH L . 
E 4 HOH 114 414 299 HOH HOH L . 
E 4 HOH 115 415 187 HOH HOH L . 
E 4 HOH 116 416 268 HOH HOH L . 
E 4 HOH 117 417 212 HOH HOH L . 
E 4 HOH 118 418 271 HOH HOH L . 
E 4 HOH 119 419 305 HOH HOH L . 
E 4 HOH 120 420 334 HOH HOH L . 
E 4 HOH 121 421 327 HOH HOH L . 
E 4 HOH 122 422 292 HOH HOH L . 
E 4 HOH 123 423 283 HOH HOH L . 
E 4 HOH 124 424 314 HOH HOH L . 
E 4 HOH 125 425 186 HOH HOH L . 
E 4 HOH 126 426 296 HOH HOH L . 
E 4 HOH 127 427 185 HOH HOH L . 
E 4 HOH 128 428 287 HOH HOH L . 
E 4 HOH 129 429 229 HOH HOH L . 
E 4 HOH 130 430 146 HOH HOH L . 
E 4 HOH 131 431 344 HOH HOH L . 
E 4 HOH 132 432 254 HOH HOH L . 
E 4 HOH 133 433 279 HOH HOH L . 
E 4 HOH 134 434 329 HOH HOH L . 
# 
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  ? ? ? 5.8.0425 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER  ? ? ? .        4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   104.87 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9G6R 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     56.496 
_cell.length_a_esd                 ? 
_cell.length_b                     55.170 
_cell.length_b_esd                 ? 
_cell.length_c                     76.892 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        2 
_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                         9G6R 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9G6R 
_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             2.41 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          48.99 
_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              ? 
_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    
;60 % (w/v) MPD
0.01 M CaCl2 
0.1 M Na Acetate pH 4.6
;
_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                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2019-02-28 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9785657 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SOLEIL BEAMLINE PROXIMA 1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.9785657 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   'PROXIMA 1' 
_diffrn_source.pdbx_synchrotron_site       SOLEIL 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9G6R 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.72 
_reflns.d_resolution_low                               44.3 
_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                                     48808 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.3 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                8.5 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          13.9 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.72 
_reflns_shell.d_res_low                                     1.76 
_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                             3369 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.706 
_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               ? 
# 
_refine.aniso_B[1][1]                            -0.57 
_refine.aniso_B[1][2]                            0.00 
_refine.aniso_B[1][3]                            0.06 
_refine.aniso_B[2][2]                            -1.71 
_refine.aniso_B[2][3]                            0.00 
_refine.aniso_B[3][3]                            1.96 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               44.160 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.976 
_refine.correlation_coeff_Fo_to_Fc_free          0.959 
_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                                 9G6R 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.72 
_refine.ls_d_res_low                             39.47 
_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                     47138 
_refine.ls_number_reflns_R_free                  1489 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.69 
_refine.ls_percent_reflns_R_free                 3.1 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.16345 
_refine.ls_R_factor_R_free                       0.20281 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.16222 
_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                       0.097 
_refine.pdbx_overall_ESU_R_Free                  0.100 
_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                             2.859 
_refine.overall_SU_ML                            0.086 
_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                       1.72 
_refine_hist.d_res_low                        39.47 
_refine_hist.number_atoms_solvent             354 
_refine_hist.number_atoms_total               3773 
_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        3381 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         38 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.008  0.012  3505 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  3199 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 1.592  1.824  4770 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 0.568  1.759  7430 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 7.356  5.000  439  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 7.922  5.000  12   ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 11.958 10.000 561  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.080  0.200  535  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  4036 ? r_gen_planes_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  780  ? 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' ? 3.688  4.639  1762 ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 3.672  4.639  1762 ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 4.641  8.324  2199 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 4.640  8.325  2200 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 4.641  4.979  1743 ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 4.640  4.978  1744 ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 6.706  8.935  2572 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 8.203  46.02  3826 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 8.149  45.25  3760 ? 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                       1.720 
_refine_ls_shell.d_res_low                        1.742 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             53 
_refine_ls_shell.number_reflns_R_work             1701 
_refine_ls_shell.percent_reflns_obs               98.93 
_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                  0.302 
_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   40 
_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                  0.302 
# 
_struct.entry_id                     9G6R 
_struct.title                        'Fab-IP8 in complex with rocuronium' 
_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        9G6R 
_struct_keywords.text            'immunotherapy, anaphylaxis, IMMUNE SYSTEM' 
_struct_keywords.pdbx_keywords   'IMMUNE SYSTEM' 
# 
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 ? 
D N N 4 ? 
E N N 4 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 PDB 9G6R 9G6R ? 1 ? 1 
2 PDB 9G6R 9G6R ? 2 ? 1 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 9G6R H 1 ? 223 ? 9G6R 1 ? 213 ? 1 213 
2 2 9G6R L 1 ? 218 ? 9G6R 1 ? 213 ? 1 213 
# 
_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   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
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)' 3920  ? 
1 MORE         -26   ? 
1 'SSA (A^2)'  19750 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 THR A 28  ? ASN A 32  ? THR H 28  ASN H 32  5 ? 5 
HELX_P HELX_P2  AA2 GLN A 62  ? LYS A 65  ? GLN H 61  LYS H 64  5 ? 4 
HELX_P HELX_P3  AA3 THR A 87  ? SER A 91  ? THR H 83  SER H 87  5 ? 5 
HELX_P HELX_P4  AA4 SER A 137 ? LYS A 139 ? SER H 127 LYS H 129 5 ? 3 
HELX_P HELX_P5  AA5 SER A 166 ? ALA A 168 ? SER H 156 ALA H 158 5 ? 3 
HELX_P HELX_P6  AA6 SER A 197 ? THR A 201 ? SER H 187 THR H 191 5 ? 5 
HELX_P HELX_P7  AA7 LYS A 211 ? ASN A 214 ? LYS H 201 ASN H 204 5 ? 4 
HELX_P HELX_P8  AA8 LYS B 84  ? VAL B 88  ? LYS L 79  VAL L 83  5 ? 5 
HELX_P HELX_P9  AA9 SER B 126 ? SER B 132 ? SER L 121 SER L 127 1 ? 7 
HELX_P HELX_P10 AB1 LYS B 188 ? LYS B 193 ? LYS L 183 LYS L 188 1 ? 6 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ?    ? A CYS 22  SG ? ? ? 1_555 A CYS 96  SG ? ? H CYS 22  H CYS 92  1_555 ? ? ? ? ? ? ? 2.108 ? ? 
disulf2 disulf ?    ? A CYS 150 SG ? ? ? 1_555 A CYS 206 SG ? ? H CYS 140 H CYS 196 1_555 ? ? ? ? ? ? ? 2.133 ? ? 
disulf3 disulf ?    ? B CYS 23  SG ? ? ? 1_555 B CYS 93  SG ? ? L CYS 23  L CYS 88  1_555 ? ? ? ? ? ? ? 2.344 ? ? 
disulf4 disulf ?    ? B CYS 139 SG ? ? ? 1_555 B CYS 199 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 2.131 ? ? 
covale1 covale both ? A PCA 1   C  ? ? ? 1_555 A VAL 2   N  ? ? H PCA 1   H VAL 2   1_555 ? ? ? ? ? ? ? 1.323 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 PCA A 1   ? .   . .   . PCA H 1   ? 1_555 .   . .   . .     .  .  GLN 1 PCA 'Pyrrolidone carboxylic acid' 
'Named protein modification' 
2 CYS A 22  ? CYS A 96  ? CYS H 22  ? 1_555 CYS H 92  ? 1_555 SG SG .   . .   None                          'Disulfide bridge' 
3 CYS A 150 ? CYS A 206 ? CYS H 140 ? 1_555 CYS H 196 ? 1_555 SG SG .   . .   None                          'Disulfide bridge' 
4 CYS B 23  ? CYS B 93  ? CYS L 23  ? 1_555 CYS L 88  ? 1_555 SG SG .   . .   None                          'Disulfide bridge' 
5 CYS B 139 ? CYS B 199 ? CYS L 134 ? 1_555 CYS L 194 ? 1_555 SG SG .   . .   None                          'Disulfide bridge' 
# 
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 PHE 156 A . ? PHE 146 H PRO 157 A ? PRO 147 H 1 -11.17 
2 GLU 158 A . ? GLU 148 H PRO 159 A ? PRO 149 H 1 -10.42 
3 TYR 99  B . ? TYR 94  L PRO 100 B ? PRO 95  L 1 -1.36  
4 TYR 145 B . ? TYR 140 L PRO 146 B ? PRO 141 L 1 -3.99  
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 4 ? 
AA2 ? 6 ? 
AA3 ? 4 ? 
AA4 ? 4 ? 
AA5 ? 4 ? 
AA6 ? 3 ? 
AA7 ? 4 ? 
AA8 ? 2 ? 
AA9 ? 5 ? 
AB1 ? 5 ? 
AB2 ? 4 ? 
AB3 ? 4 ? 
# 
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 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA2 5 6 ? anti-parallel 
AA3 1 2 ? parallel      
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA4 2 3 ? anti-parallel 
AA4 3 4 ? anti-parallel 
AA5 1 2 ? anti-parallel 
AA5 2 3 ? anti-parallel 
AA5 3 4 ? anti-parallel 
AA6 1 2 ? anti-parallel 
AA6 2 3 ? anti-parallel 
AA7 1 2 ? anti-parallel 
AA7 2 3 ? anti-parallel 
AA7 3 4 ? anti-parallel 
AA8 1 2 ? parallel      
AA9 1 2 ? anti-parallel 
AA9 2 3 ? anti-parallel 
AA9 3 4 ? anti-parallel 
AA9 4 5 ? anti-parallel 
AB1 1 2 ? anti-parallel 
AB1 2 3 ? anti-parallel 
AB1 3 4 ? anti-parallel 
AB1 4 5 ? anti-parallel 
AB2 1 2 ? anti-parallel 
AB2 2 3 ? anti-parallel 
AB2 3 4 ? anti-parallel 
AB3 1 2 ? anti-parallel 
AB3 2 3 ? anti-parallel 
AB3 3 4 ? 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 GLN A 3   ? GLN A 6   ? GLN H 3   GLN H 6   
AA1 2 VAL A 18  ? SER A 25  ? VAL H 18  SER H 25  
AA1 3 THR A 78  ? LEU A 83  ? THR H 77  LEU H 82  
AA1 4 ALA A 68  ? ASP A 73  ? ALA H 67  ASP H 72  
AA2 1 GLU A 10  ? ALA A 12  ? GLU H 10  ALA H 12  
AA2 2 THR A 117 ? VAL A 121 ? THR H 107 VAL H 111 
AA2 3 ALA A 92  ? TYR A 101 ? ALA H 88  TYR H 97  
AA2 4 MET A 34  ? GLN A 39  ? MET H 34  GLN H 39  
AA2 5 LEU A 45  ? ILE A 51  ? LEU H 45  ILE H 51  
AA2 6 SER A 58  ? TYR A 60  ? SER H 57  TYR H 59  
AA3 1 GLU A 10  ? ALA A 12  ? GLU H 10  ALA H 12  
AA3 2 THR A 117 ? VAL A 121 ? THR H 107 VAL H 111 
AA3 3 ALA A 92  ? TYR A 101 ? ALA H 88  TYR H 97  
AA3 4 TYR A 108 D TRP A 113 ? TYR H 100 TRP H 103 
AA4 1 SER A 130 ? LEU A 134 ? SER H 120 LEU H 124 
AA4 2 THR A 145 ? TYR A 155 ? THR H 135 TYR H 145 
AA4 3 TYR A 186 ? PRO A 195 ? TYR H 176 PRO H 185 
AA4 4 HIS A 174 ? THR A 175 ? HIS H 164 THR H 165 
AA5 1 THR A 141 ? SER A 142 ? THR H 131 SER H 132 
AA5 2 THR A 145 ? TYR A 155 ? THR H 135 TYR H 145 
AA5 3 TYR A 186 ? PRO A 195 ? TYR H 176 PRO H 185 
AA5 4 VAL A 179 ? LEU A 180 ? VAL H 169 LEU H 170 
AA6 1 THR A 161 ? TRP A 164 ? THR H 151 TRP H 154 
AA6 2 ILE A 205 ? HIS A 210 ? ILE H 195 HIS H 200 
AA6 3 THR A 215 ? ARG A 220 ? THR H 205 ARG H 210 
AA7 1 ILE B 4   ? GLN B 6   ? ILE L 4   GLN L 6   
AA7 2 VAL B 19  ? SER B 25  ? VAL L 19  SER L 25  
AA7 3 ASP B 75  ? ILE B 80  ? ASP L 70  ILE L 75  
AA7 4 PHE B 67  ? GLY B 71  ? PHE L 62  GLY L 66  
AA8 1 VAL B 13  ? THR B 14  ? VAL L 13  THR L 14  
AA8 2 ILE B 111 ? LYS B 112 ? ILE L 106 LYS L 107 
AA9 1 THR B 58  ? ARG B 59  ? THR L 53  ARG L 54  
AA9 2 GLN B 50  ? TYR B 54  ? GLN L 45  TYR L 49  
AA9 3 LEU B 38  ? GLN B 43  ? LEU L 33  GLN L 38  
AA9 4 GLY B 89  ? GLN B 95  ? GLY L 84  GLN L 90  
AA9 5 THR B 102 ? PHE B 103 ? THR L 97  PHE L 98  
AB1 1 THR B 58  ? ARG B 59  ? THR L 53  ARG L 54  
AB1 2 GLN B 50  ? TYR B 54  ? GLN L 45  TYR L 49  
AB1 3 LEU B 38  ? GLN B 43  ? LEU L 33  GLN L 38  
AB1 4 GLY B 89  ? GLN B 95  ? GLY L 84  GLN L 90  
AB1 5 THR B 107 ? LEU B 109 ? THR L 102 LEU L 104 
AB2 1 SER B 119 ? PHE B 123 ? SER L 114 PHE L 118 
AB2 2 THR B 134 ? PHE B 144 ? THR L 129 PHE L 139 
AB2 3 TYR B 178 ? SER B 187 ? TYR L 173 SER L 182 
AB2 4 SER B 164 ? VAL B 168 ? SER L 159 VAL L 163 
AB3 1 ALA B 158 ? LEU B 159 ? ALA L 153 LEU L 154 
AB3 2 LYS B 150 ? VAL B 155 ? LYS L 145 VAL L 150 
AB3 3 VAL B 196 ? THR B 202 ? VAL L 191 THR L 197 
AB3 4 VAL B 210 ? ASN B 215 ? VAL L 205 ASN L 210 
# 
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 GLN A 5   ? N GLN H 5   O LYS A 23  ? O LYS H 23  
AA1 2 3 N LEU A 20  ? N LEU H 20  O MET A 81  ? O MET H 80  
AA1 3 4 O THR A 78  ? O THR H 77  N ASP A 73  ? N ASP H 72  
AA2 1 2 N ALA A 12  ? N ALA H 12  O THR A 120 ? O THR H 110 
AA2 2 3 O LEU A 119 ? O LEU H 109 N ALA A 92  ? N ALA H 88  
AA2 3 4 O ALA A 97  ? O ALA H 93  N HIS A 35  ? N HIS H 35  
AA2 4 5 N LYS A 38  ? N LYS H 38  O GLU A 46  ? O GLU H 46  
AA2 5 6 N TYR A 50  ? N TYR H 50  O LYS A 59  ? O LYS H 58  
AA3 1 2 N ALA A 12  ? N ALA H 12  O THR A 120 ? O THR H 110 
AA3 2 3 O LEU A 119 ? O LEU H 109 N ALA A 92  ? N ALA H 88  
AA3 3 4 N SER A 100 ? N SER H 96  O PHE A 109 E O PHE H 100 
AA4 1 2 N SER A 130 ? N SER H 120 O LYS A 153 ? O LYS H 143 
AA4 2 3 N VAL A 152 ? N VAL H 142 O LEU A 188 ? O LEU H 178 
AA4 3 4 O VAL A 191 ? O VAL H 181 N HIS A 174 ? N HIS H 164 
AA5 1 2 N SER A 142 ? N SER H 132 O THR A 145 ? O THR H 135 
AA5 2 3 N VAL A 152 ? N VAL H 142 O LEU A 188 ? O LEU H 178 
AA5 3 4 O SER A 187 ? O SER H 177 N VAL A 179 ? N VAL H 169 
AA6 1 2 N SER A 163 ? N SER H 153 O ASN A 207 ? O ASN H 197 
AA6 2 3 N VAL A 208 ? N VAL H 198 O VAL A 217 ? O VAL H 207 
AA7 1 2 N THR B 5   ? N THR L 5   O ARG B 24  ? O ARG L 24  
AA7 2 3 N ILE B 21  ? N ILE L 21  O LEU B 78  ? O LEU L 73  
AA7 3 4 O GLU B 79  ? O GLU L 74  N SER B 68  ? N SER L 63  
AA8 1 2 N VAL B 13  ? N VAL L 13  O LYS B 112 ? O LYS L 107 
AA9 1 2 O THR B 58  ? O THR L 53  N TYR B 54  ? N TYR L 49  
AA9 2 3 O LEU B 52  ? O LEU L 47  N TRP B 40  ? N TRP L 35  
AA9 3 4 N GLN B 43  ? N GLN L 38  O VAL B 90  ? O VAL L 85  
AA9 4 5 N GLN B 95  ? N GLN L 90  O THR B 102 ? O THR L 97  
AB1 1 2 O THR B 58  ? O THR L 53  N TYR B 54  ? N TYR L 49  
AB1 2 3 O LEU B 52  ? O LEU L 47  N TRP B 40  ? N TRP L 35  
AB1 3 4 N GLN B 43  ? N GLN L 38  O VAL B 90  ? O VAL L 85  
AB1 4 5 N GLY B 89  ? N GLY L 84  O LEU B 109 ? O LEU L 104 
AB2 1 2 N SER B 119 ? N SER L 114 O ASN B 142 ? O ASN L 137 
AB2 2 3 N ALA B 135 ? N ALA L 130 O LEU B 186 ? O LEU L 181 
AB2 3 4 O THR B 183 ? O THR L 178 N GLN B 165 ? N GLN L 160 
AB3 1 2 O ALA B 158 ? O ALA L 153 N VAL B 155 ? N VAL L 150 
AB3 2 3 N GLN B 152 ? N GLN L 147 O GLU B 200 ? O GLU L 195 
AB3 3 4 N CYS B 199 ? N CYS L 194 O LYS B 212 ? O LYS L 207 
# 
_pdbx_entry_details.entry_id                   9G6R 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
_pdbx_validate_close_contact.id               1 
_pdbx_validate_close_contact.PDB_model_num    1 
_pdbx_validate_close_contact.auth_atom_id_1   OD2 
_pdbx_validate_close_contact.auth_asym_id_1   H 
_pdbx_validate_close_contact.auth_comp_id_1   ASP 
_pdbx_validate_close_contact.auth_seq_id_1    208 
_pdbx_validate_close_contact.PDB_ins_code_1   ? 
_pdbx_validate_close_contact.label_alt_id_1   ? 
_pdbx_validate_close_contact.auth_atom_id_2   O 
_pdbx_validate_close_contact.auth_asym_id_2   H 
_pdbx_validate_close_contact.auth_comp_id_2   HOH 
_pdbx_validate_close_contact.auth_seq_id_2    401 
_pdbx_validate_close_contact.PDB_ins_code_2   ? 
_pdbx_validate_close_contact.label_alt_id_2   ? 
_pdbx_validate_close_contact.dist             2.18 
# 
_pdbx_validate_rmsd_angle.id                         1 
_pdbx_validate_rmsd_angle.PDB_model_num              1 
_pdbx_validate_rmsd_angle.auth_atom_id_1             NE 
_pdbx_validate_rmsd_angle.auth_asym_id_1             H 
_pdbx_validate_rmsd_angle.auth_comp_id_1             ARG 
_pdbx_validate_rmsd_angle.auth_seq_id_1              40 
_pdbx_validate_rmsd_angle.PDB_ins_code_1             ? 
_pdbx_validate_rmsd_angle.label_alt_id_1             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_2             CZ 
_pdbx_validate_rmsd_angle.auth_asym_id_2             H 
_pdbx_validate_rmsd_angle.auth_comp_id_2             ARG 
_pdbx_validate_rmsd_angle.auth_seq_id_2              40 
_pdbx_validate_rmsd_angle.PDB_ins_code_2             ? 
_pdbx_validate_rmsd_angle.label_alt_id_2             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_3             NH1 
_pdbx_validate_rmsd_angle.auth_asym_id_3             H 
_pdbx_validate_rmsd_angle.auth_comp_id_3             ARG 
_pdbx_validate_rmsd_angle.auth_seq_id_3              40 
_pdbx_validate_rmsd_angle.PDB_ins_code_3             ? 
_pdbx_validate_rmsd_angle.label_alt_id_3             ? 
_pdbx_validate_rmsd_angle.angle_value                116.71 
_pdbx_validate_rmsd_angle.angle_target_value         120.30 
_pdbx_validate_rmsd_angle.angle_deviation            -3.59 
_pdbx_validate_rmsd_angle.angle_standard_deviation   0.50 
_pdbx_validate_rmsd_angle.linker_flag                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 SER H 132 ? ? -164.96 116.09  
2 1 MET L 51  ? ? 71.49   -33.68  
3 1 SER L 67  ? ? -89.87  -150.65 
4 1 ASN L 138 ? ? 62.88   66.65   
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? H HOH 619 ? .    6.55 
2 1 O ? H HOH 620 ? 8.34 .    
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
HIS N    N N N 137 
HIS CA   C N S 138 
HIS C    C N N 139 
HIS O    O N N 140 
HIS CB   C N N 141 
HIS CG   C Y N 142 
HIS ND1  N Y N 143 
HIS CD2  C Y N 144 
HIS CE1  C Y N 145 
HIS NE2  N Y N 146 
HIS OXT  O N N 147 
HIS H    H N N 148 
HIS H2   H N N 149 
HIS HA   H N N 150 
HIS HB2  H N N 151 
HIS HB3  H N N 152 
HIS HD1  H N N 153 
HIS HD2  H N N 154 
HIS HE1  H N N 155 
HIS HE2  H N N 156 
HIS HXT  H N N 157 
HOH O    O N N 158 
HOH H1   H N N 159 
HOH H2   H N N 160 
ILE N    N N N 161 
ILE CA   C N S 162 
ILE C    C N N 163 
ILE O    O N N 164 
ILE CB   C N S 165 
ILE CG1  C N N 166 
ILE CG2  C N N 167 
ILE CD1  C N N 168 
ILE OXT  O N N 169 
ILE H    H N N 170 
ILE H2   H N N 171 
ILE HA   H N N 172 
ILE HB   H N N 173 
ILE HG12 H N N 174 
ILE HG13 H N N 175 
ILE HG21 H N N 176 
ILE HG22 H N N 177 
ILE HG23 H N N 178 
ILE HD11 H N N 179 
ILE HD12 H N N 180 
ILE HD13 H N N 181 
ILE HXT  H N N 182 
LEU N    N N N 183 
LEU CA   C N S 184 
LEU C    C N N 185 
LEU O    O N N 186 
LEU CB   C N N 187 
LEU CG   C N N 188 
LEU CD1  C N N 189 
LEU CD2  C N N 190 
LEU OXT  O N N 191 
LEU H    H N N 192 
LEU H2   H N N 193 
LEU HA   H N N 194 
LEU HB2  H N N 195 
LEU HB3  H N N 196 
LEU HG   H N N 197 
LEU HD11 H N N 198 
LEU HD12 H N N 199 
LEU HD13 H N N 200 
LEU HD21 H N N 201 
LEU HD22 H N N 202 
LEU HD23 H N N 203 
LEU HXT  H N N 204 
LYS N    N N N 205 
LYS CA   C N S 206 
LYS C    C N N 207 
LYS O    O N N 208 
LYS CB   C N N 209 
LYS CG   C N N 210 
LYS CD   C N N 211 
LYS CE   C N N 212 
LYS NZ   N N N 213 
LYS OXT  O N N 214 
LYS H    H N N 215 
LYS H2   H N N 216 
LYS HA   H N N 217 
LYS HB2  H N N 218 
LYS HB3  H N N 219 
LYS HG2  H N N 220 
LYS HG3  H N N 221 
LYS HD2  H N N 222 
LYS HD3  H N N 223 
LYS HE2  H N N 224 
LYS HE3  H N N 225 
LYS HZ1  H N N 226 
LYS HZ2  H N N 227 
LYS HZ3  H N N 228 
LYS HXT  H N N 229 
MET N    N N N 230 
MET CA   C N S 231 
MET C    C N N 232 
MET O    O N N 233 
MET CB   C N N 234 
MET CG   C N N 235 
MET SD   S N N 236 
MET CE   C N N 237 
MET OXT  O N N 238 
MET H    H N N 239 
MET H2   H N N 240 
MET HA   H N N 241 
MET HB2  H N N 242 
MET HB3  H N N 243 
MET HG2  H N N 244 
MET HG3  H N N 245 
MET HE1  H N N 246 
MET HE2  H N N 247 
MET HE3  H N N 248 
MET HXT  H N N 249 
PCA N    N N N 250 
PCA CA   C N S 251 
PCA CB   C N N 252 
PCA CG   C N N 253 
PCA CD   C N N 254 
PCA OE   O N N 255 
PCA C    C N N 256 
PCA O    O N N 257 
PCA OXT  O N N 258 
PCA H    H N N 259 
PCA HA   H N N 260 
PCA HB2  H N N 261 
PCA HB3  H N N 262 
PCA HG2  H N N 263 
PCA HG3  H N N 264 
PCA HXT  H N N 265 
PHE N    N N N 266 
PHE CA   C N S 267 
PHE C    C N N 268 
PHE O    O N N 269 
PHE CB   C N N 270 
PHE CG   C Y N 271 
PHE CD1  C Y N 272 
PHE CD2  C Y N 273 
PHE CE1  C Y N 274 
PHE CE2  C Y N 275 
PHE CZ   C Y N 276 
PHE OXT  O N N 277 
PHE H    H N N 278 
PHE H2   H N N 279 
PHE HA   H N N 280 
PHE HB2  H N N 281 
PHE HB3  H N N 282 
PHE HD1  H N N 283 
PHE HD2  H N N 284 
PHE HE1  H N N 285 
PHE HE2  H N N 286 
PHE HZ   H N N 287 
PHE HXT  H N N 288 
PRO N    N N N 289 
PRO CA   C N S 290 
PRO C    C N N 291 
PRO O    O N N 292 
PRO CB   C N N 293 
PRO CG   C N N 294 
PRO CD   C N N 295 
PRO OXT  O N N 296 
PRO H    H N N 297 
PRO HA   H N N 298 
PRO HB2  H N N 299 
PRO HB3  H N N 300 
PRO HG2  H N N 301 
PRO HG3  H N N 302 
PRO HD2  H N N 303 
PRO HD3  H N N 304 
PRO HXT  H N N 305 
RBR C1   C N S 306 
RBR C10  C N N 307 
RBR C11  C N N 308 
RBR C12  C N N 309 
RBR C13  C N S 310 
RBR C14  C N R 311 
RBR C15  C N N 312 
RBR C16  C N N 313 
RBR C17  C N S 314 
RBR C18  C N N 315 
RBR C19  C N S 316 
RBR C2   C N N 317 
RBR C21  C N S 318 
RBR C22  C N N 319 
RBR C23  C N S 320 
RBR C24  C N N 321 
RBR C26  C N N 322 
RBR C27  C N N 323 
RBR C29  C N N 324 
RBR C3   C N S 325 
RBR C30  C N N 326 
RBR C32  C N N 327 
RBR C33  C N N 328 
RBR C34  C N N 329 
RBR C35  C N N 330 
RBR C36  C N N 331 
RBR C37  C N N 332 
RBR C38  C N N 333 
RBR C4   C N R 334 
RBR C6   C N N 335 
RBR C7   C N N 336 
RBR C9   C N S 337 
RBR N25  N N N 338 
RBR N31  N N N 339 
RBR O20  O N N 340 
RBR O28  O N N 341 
RBR O5   O N N 342 
RBR O8   O N N 343 
RBR H1   H N N 344 
RBR H2   H N N 345 
RBR H3   H N N 346 
RBR H4   H N N 347 
RBR H5   H N N 348 
RBR H6   H N N 349 
RBR H7   H N N 350 
RBR H8   H N N 351 
RBR H9   H N N 352 
RBR H10  H N N 353 
RBR H11  H N N 354 
RBR H12  H N N 355 
RBR H13  H N N 356 
RBR H14  H N N 357 
RBR H15  H N N 358 
RBR H16  H N N 359 
RBR H17  H N N 360 
RBR H18  H N N 361 
RBR H19  H N N 362 
RBR H20  H N N 363 
RBR H21  H N N 364 
RBR H22  H N N 365 
RBR H23  H N N 366 
RBR H24  H N N 367 
RBR H25  H N N 368 
RBR H26  H N N 369 
RBR H27  H N N 370 
RBR H28  H N N 371 
RBR H29  H N N 372 
RBR H30  H N N 373 
RBR H31  H N N 374 
RBR H32  H N N 375 
RBR H33  H N N 376 
RBR H34  H N N 377 
RBR H35  H N N 378 
RBR H36  H N N 379 
RBR H37  H N N 380 
RBR H38  H N N 381 
RBR H39  H N N 382 
RBR H40  H N N 383 
RBR H41  H N N 384 
RBR H42  H N N 385 
RBR H43  H N N 386 
RBR H44  H N N 387 
RBR H45  H N N 388 
RBR H46  H N N 389 
RBR H47  H N N 390 
RBR H48  H N N 391 
RBR H49  H N N 392 
RBR H50  H N N 393 
RBR H51  H N N 394 
RBR H52  H N N 395 
RBR H54  H N N 396 
SER N    N N N 397 
SER CA   C N S 398 
SER C    C N N 399 
SER O    O N N 400 
SER CB   C N N 401 
SER OG   O N N 402 
SER OXT  O N N 403 
SER H    H N N 404 
SER H2   H N N 405 
SER HA   H N N 406 
SER HB2  H N N 407 
SER HB3  H N N 408 
SER HG   H N N 409 
SER HXT  H N N 410 
THR N    N N N 411 
THR CA   C N S 412 
THR C    C N N 413 
THR O    O N N 414 
THR CB   C N R 415 
THR OG1  O N N 416 
THR CG2  C N N 417 
THR OXT  O N N 418 
THR H    H N N 419 
THR H2   H N N 420 
THR HA   H N N 421 
THR HB   H N N 422 
THR HG1  H N N 423 
THR HG21 H N N 424 
THR HG22 H N N 425 
THR HG23 H N N 426 
THR HXT  H N N 427 
TRP N    N N N 428 
TRP CA   C N S 429 
TRP C    C N N 430 
TRP O    O N N 431 
TRP CB   C N N 432 
TRP CG   C Y N 433 
TRP CD1  C Y N 434 
TRP CD2  C Y N 435 
TRP NE1  N Y N 436 
TRP CE2  C Y N 437 
TRP CE3  C Y N 438 
TRP CZ2  C Y N 439 
TRP CZ3  C Y N 440 
TRP CH2  C Y N 441 
TRP OXT  O N N 442 
TRP H    H N N 443 
TRP H2   H N N 444 
TRP HA   H N N 445 
TRP HB2  H N N 446 
TRP HB3  H N N 447 
TRP HD1  H N N 448 
TRP HE1  H N N 449 
TRP HE3  H N N 450 
TRP HZ2  H N N 451 
TRP HZ3  H N N 452 
TRP HH2  H N N 453 
TRP HXT  H N N 454 
TYR N    N N N 455 
TYR CA   C N S 456 
TYR C    C N N 457 
TYR O    O N N 458 
TYR CB   C N N 459 
TYR CG   C Y N 460 
TYR CD1  C Y N 461 
TYR CD2  C Y N 462 
TYR CE1  C Y N 463 
TYR CE2  C Y N 464 
TYR CZ   C Y N 465 
TYR OH   O N N 466 
TYR OXT  O N N 467 
TYR H    H N N 468 
TYR H2   H N N 469 
TYR HA   H N N 470 
TYR HB2  H N N 471 
TYR HB3  H N N 472 
TYR HD1  H N N 473 
TYR HD2  H N N 474 
TYR HE1  H N N 475 
TYR HE2  H N N 476 
TYR HH   H N N 477 
TYR HXT  H N N 478 
VAL N    N N N 479 
VAL CA   C N S 480 
VAL C    C N N 481 
VAL O    O N N 482 
VAL CB   C N N 483 
VAL CG1  C N N 484 
VAL CG2  C N N 485 
VAL OXT  O N N 486 
VAL H    H N N 487 
VAL H2   H N N 488 
VAL HA   H N N 489 
VAL HB   H N N 490 
VAL HG11 H N N 491 
VAL HG12 H N N 492 
VAL HG13 H N N 493 
VAL HG21 H N N 494 
VAL HG22 H N N 495 
VAL HG23 H N N 496 
VAL HXT  H N N 497 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
PCA N   CA   sing N N 237 
PCA N   CD   sing N N 238 
PCA N   H    sing N N 239 
PCA CA  CB   sing N N 240 
PCA CA  C    sing N N 241 
PCA CA  HA   sing N N 242 
PCA CB  CG   sing N N 243 
PCA CB  HB2  sing N N 244 
PCA CB  HB3  sing N N 245 
PCA CG  CD   sing N N 246 
PCA CG  HG2  sing N N 247 
PCA CG  HG3  sing N N 248 
PCA CD  OE   doub N N 249 
PCA C   O    doub N N 250 
PCA C   OXT  sing N N 251 
PCA OXT HXT  sing N N 252 
PHE N   CA   sing N N 253 
PHE N   H    sing N N 254 
PHE N   H2   sing N N 255 
PHE CA  C    sing N N 256 
PHE CA  CB   sing N N 257 
PHE CA  HA   sing N N 258 
PHE C   O    doub N N 259 
PHE C   OXT  sing N N 260 
PHE CB  CG   sing N N 261 
PHE CB  HB2  sing N N 262 
PHE CB  HB3  sing N N 263 
PHE CG  CD1  doub Y N 264 
PHE CG  CD2  sing Y N 265 
PHE CD1 CE1  sing Y N 266 
PHE CD1 HD1  sing N N 267 
PHE CD2 CE2  doub Y N 268 
PHE CD2 HD2  sing N N 269 
PHE CE1 CZ   doub Y N 270 
PHE CE1 HE1  sing N N 271 
PHE CE2 CZ   sing Y N 272 
PHE CE2 HE2  sing N N 273 
PHE CZ  HZ   sing N N 274 
PHE OXT HXT  sing N N 275 
PRO N   CA   sing N N 276 
PRO N   CD   sing N N 277 
PRO N   H    sing N N 278 
PRO CA  C    sing N N 279 
PRO CA  CB   sing N N 280 
PRO CA  HA   sing N N 281 
PRO C   O    doub N N 282 
PRO C   OXT  sing N N 283 
PRO CB  CG   sing N N 284 
PRO CB  HB2  sing N N 285 
PRO CB  HB3  sing N N 286 
PRO CG  CD   sing N N 287 
PRO CG  HG2  sing N N 288 
PRO CG  HG3  sing N N 289 
PRO CD  HD2  sing N N 290 
PRO CD  HD3  sing N N 291 
PRO OXT HXT  sing N N 292 
RBR C34 C33  doub N N 293 
RBR C33 C32  sing N N 294 
RBR C32 N31  sing N N 295 
RBR C37 C38  sing N N 296 
RBR C37 C36  sing N N 297 
RBR C35 C36  sing N N 298 
RBR C35 N31  sing N N 299 
RBR C38 N31  sing N N 300 
RBR N31 C3   sing N N 301 
RBR C3  C2   sing N N 302 
RBR C3  C4   sing N N 303 
RBR C2  C1   sing N N 304 
RBR C15 C16  sing N N 305 
RBR C15 C14  sing N N 306 
RBR O5  C4   sing N N 307 
RBR O5  C6   sing N N 308 
RBR C4  C9   sing N N 309 
RBR C1  C14  sing N N 310 
RBR C1  C9   sing N N 311 
RBR C16 C17  sing N N 312 
RBR C14 C13  sing N N 313 
RBR C6  O8   doub N N 314 
RBR C6  C7   sing N N 315 
RBR C9  C10  sing N N 316 
RBR C9  C11  sing N N 317 
RBR C17 C18  sing N N 318 
RBR C17 C23  sing N N 319 
RBR C13 C23  sing N N 320 
RBR C13 C12  sing N N 321 
RBR C11 C12  sing N N 322 
RBR C18 C19  sing N N 323 
RBR C23 C24  sing N N 324 
RBR C23 C22  sing N N 325 
RBR O20 C19  sing N N 326 
RBR C19 C21  sing N N 327 
RBR C22 C21  sing N N 328 
RBR C21 N25  sing N N 329 
RBR N25 C30  sing N N 330 
RBR N25 C26  sing N N 331 
RBR C30 C29  sing N N 332 
RBR C26 C27  sing N N 333 
RBR C29 O28  sing N N 334 
RBR C27 O28  sing N N 335 
RBR C1  H1   sing N N 336 
RBR C10 H2   sing N N 337 
RBR C10 H3   sing N N 338 
RBR C10 H4   sing N N 339 
RBR C11 H5   sing N N 340 
RBR C11 H6   sing N N 341 
RBR C12 H7   sing N N 342 
RBR C12 H8   sing N N 343 
RBR C13 H9   sing N N 344 
RBR C14 H10  sing N N 345 
RBR C15 H11  sing N N 346 
RBR C15 H12  sing N N 347 
RBR C16 H13  sing N N 348 
RBR C16 H14  sing N N 349 
RBR C17 H15  sing N N 350 
RBR C18 H16  sing N N 351 
RBR C18 H17  sing N N 352 
RBR C19 H18  sing N N 353 
RBR C2  H19  sing N N 354 
RBR C2  H20  sing N N 355 
RBR C21 H21  sing N N 356 
RBR C22 H22  sing N N 357 
RBR C22 H23  sing N N 358 
RBR C24 H24  sing N N 359 
RBR C24 H25  sing N N 360 
RBR C24 H26  sing N N 361 
RBR C26 H27  sing N N 362 
RBR C26 H28  sing N N 363 
RBR C27 H29  sing N N 364 
RBR C27 H30  sing N N 365 
RBR C29 H31  sing N N 366 
RBR C29 H32  sing N N 367 
RBR C3  H33  sing N N 368 
RBR C30 H34  sing N N 369 
RBR C30 H35  sing N N 370 
RBR C32 H36  sing N N 371 
RBR C32 H37  sing N N 372 
RBR C33 H38  sing N N 373 
RBR C34 H39  sing N N 374 
RBR C34 H40  sing N N 375 
RBR C35 H41  sing N N 376 
RBR C35 H42  sing N N 377 
RBR C36 H43  sing N N 378 
RBR C36 H44  sing N N 379 
RBR C37 H45  sing N N 380 
RBR C37 H46  sing N N 381 
RBR C38 H47  sing N N 382 
RBR C38 H48  sing N N 383 
RBR C4  H49  sing N N 384 
RBR C7  H50  sing N N 385 
RBR C7  H51  sing N N 386 
RBR C7  H52  sing N N 387 
RBR O20 H54  sing N N 388 
SER N   CA   sing N N 389 
SER N   H    sing N N 390 
SER N   H2   sing N N 391 
SER CA  C    sing N N 392 
SER CA  CB   sing N N 393 
SER CA  HA   sing N N 394 
SER C   O    doub N N 395 
SER C   OXT  sing N N 396 
SER CB  OG   sing N N 397 
SER CB  HB2  sing N N 398 
SER CB  HB3  sing N N 399 
SER OG  HG   sing N N 400 
SER OXT HXT  sing N N 401 
THR N   CA   sing N N 402 
THR N   H    sing N N 403 
THR N   H2   sing N N 404 
THR CA  C    sing N N 405 
THR CA  CB   sing N N 406 
THR CA  HA   sing N N 407 
THR C   O    doub N N 408 
THR C   OXT  sing N N 409 
THR CB  OG1  sing N N 410 
THR CB  CG2  sing N N 411 
THR CB  HB   sing N N 412 
THR OG1 HG1  sing N N 413 
THR CG2 HG21 sing N N 414 
THR CG2 HG22 sing N N 415 
THR CG2 HG23 sing N N 416 
THR OXT HXT  sing N N 417 
TRP N   CA   sing N N 418 
TRP N   H    sing N N 419 
TRP N   H2   sing N N 420 
TRP CA  C    sing N N 421 
TRP CA  CB   sing N N 422 
TRP CA  HA   sing N N 423 
TRP C   O    doub N N 424 
TRP C   OXT  sing N N 425 
TRP CB  CG   sing N N 426 
TRP CB  HB2  sing N N 427 
TRP CB  HB3  sing N N 428 
TRP CG  CD1  doub Y N 429 
TRP CG  CD2  sing Y N 430 
TRP CD1 NE1  sing Y N 431 
TRP CD1 HD1  sing N N 432 
TRP CD2 CE2  doub Y N 433 
TRP CD2 CE3  sing Y N 434 
TRP NE1 CE2  sing Y N 435 
TRP NE1 HE1  sing N N 436 
TRP CE2 CZ2  sing Y N 437 
TRP CE3 CZ3  doub Y N 438 
TRP CE3 HE3  sing N N 439 
TRP CZ2 CH2  doub Y N 440 
TRP CZ2 HZ2  sing N N 441 
TRP CZ3 CH2  sing Y N 442 
TRP CZ3 HZ3  sing N N 443 
TRP CH2 HH2  sing N N 444 
TRP OXT HXT  sing N N 445 
TYR N   CA   sing N N 446 
TYR N   H    sing N N 447 
TYR N   H2   sing N N 448 
TYR CA  C    sing N N 449 
TYR CA  CB   sing N N 450 
TYR CA  HA   sing N N 451 
TYR C   O    doub N N 452 
TYR C   OXT  sing N N 453 
TYR CB  CG   sing N N 454 
TYR CB  HB2  sing N N 455 
TYR CB  HB3  sing N N 456 
TYR CG  CD1  doub Y N 457 
TYR CG  CD2  sing Y N 458 
TYR CD1 CE1  sing Y N 459 
TYR CD1 HD1  sing N N 460 
TYR CD2 CE2  doub Y N 461 
TYR CD2 HD2  sing N N 462 
TYR CE1 CZ   doub Y N 463 
TYR CE1 HE1  sing N N 464 
TYR CE2 CZ   sing Y N 465 
TYR CE2 HE2  sing N N 466 
TYR CZ  OH   sing N N 467 
TYR OH  HH   sing N N 468 
TYR OXT HXT  sing N N 469 
VAL N   CA   sing N N 470 
VAL N   H    sing N N 471 
VAL N   H2   sing N N 472 
VAL CA  C    sing N N 473 
VAL CA  CB   sing N N 474 
VAL CA  HA   sing N N 475 
VAL C   O    doub N N 476 
VAL C   OXT  sing N N 477 
VAL CB  CG1  sing N N 478 
VAL CB  CG2  sing N N 479 
VAL CB  HB   sing N N 480 
VAL CG1 HG11 sing N N 481 
VAL CG1 HG12 sing N N 482 
VAL CG1 HG13 sing N N 483 
VAL CG2 HG21 sing N N 484 
VAL CG2 HG22 sing N N 485 
VAL CG2 HG23 sing N N 486 
VAL OXT HXT  sing N N 487 
# 
_pdbx_audit_support.funding_organization   'Pasteur Institute' 
_pdbx_audit_support.country                France 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   2AJU 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9G6R 
_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]   0.017700 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.004700 
_atom_sites.fract_transf_matrix[2][1]   -0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.018126 
_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]   0.013456 
_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 
HETATM 1    N N   . PCA A 1 1   ? -0.407  15.459  72.119  1.00 63.25  ? 1   PCA H N   1 
HETATM 2    C CA  . PCA A 1 1   ? -0.595  14.605  73.257  1.00 49.71  ? 1   PCA H CA  1 
HETATM 3    C CB  . PCA A 1 1   ? -1.362  15.515  74.229  1.00 56.37  ? 1   PCA H CB  1 
HETATM 4    C CG  . PCA A 1 1   ? -1.966  16.587  73.325  1.00 59.22  ? 1   PCA H CG  1 
HETATM 5    C CD  . PCA A 1 1   ? -1.332  16.383  71.977  1.00 62.87  ? 1   PCA H CD  1 
HETATM 6    O OE  . PCA A 1 1   ? -1.540  17.012  70.933  1.00 87.13  ? 1   PCA H OE  1 
HETATM 7    C C   . PCA A 1 1   ? -1.352  13.391  72.682  1.00 39.82  ? 1   PCA H C   1 
HETATM 8    O O   . PCA A 1 1   ? -2.509  13.488  72.265  1.00 38.05  ? 1   PCA H O   1 
ATOM   9    N N   . VAL A 1 2   ? -0.662  12.263  72.635  1.00 39.04  ? 2   VAL H N   1 
ATOM   10   C CA  . VAL A 1 2   ? -1.355  10.973  72.399  1.00 36.15  ? 2   VAL H CA  1 
ATOM   11   C C   . VAL A 1 2   ? -2.240  10.736  73.615  1.00 36.52  ? 2   VAL H C   1 
ATOM   12   O O   . VAL A 1 2   ? -1.775  10.771  74.752  1.00 36.58  ? 2   VAL H O   1 
ATOM   13   C CB  . VAL A 1 2   ? -0.300  9.886   72.166  1.00 38.31  ? 2   VAL H CB  1 
ATOM   14   C CG1 . VAL A 1 2   ? -0.883  8.477   72.183  1.00 39.40  ? 2   VAL H CG1 1 
ATOM   15   C CG2 . VAL A 1 2   ? 0.403   10.136  70.847  1.00 41.31  ? 2   VAL H CG2 1 
ATOM   16   N N   . GLN A 1 3   ? -3.524  10.512  73.363  1.00 37.08  ? 3   GLN H N   1 
ATOM   17   C CA  . GLN A 1 3   ? -4.405  10.062  74.411  1.00 37.55  ? 3   GLN H CA  1 
ATOM   18   C C   . GLN A 1 3   ? -5.610  9.328   73.822  1.00 33.95  ? 3   GLN H C   1 
ATOM   19   O O   . GLN A 1 3   ? -5.975  9.489   72.643  1.00 34.69  ? 3   GLN H O   1 
ATOM   20   C CB  . GLN A 1 3   ? -4.906  11.162  75.320  1.00 39.82  ? 3   GLN H CB  1 
ATOM   21   C CG  . GLN A 1 3   ? -5.655  12.243  74.586  1.00 44.14  ? 3   GLN H CG  1 
ATOM   22   C CD  . GLN A 1 3   ? -6.186  13.314  75.525  1.00 58.66  ? 3   GLN H CD  1 
ATOM   23   O OE1 . GLN A 1 3   ? -6.473  13.089  76.717  1.00 54.34  ? 3   GLN H OE1 1 
ATOM   24   N NE2 . GLN A 1 3   ? -6.369  14.490  74.953  1.00 57.73  ? 3   GLN H NE2 1 
ATOM   25   N N   . LEU A 1 4   ? -6.162  8.471   74.672  1.00 31.94  ? 4   LEU H N   1 
ATOM   26   C CA  . LEU A 1 4   ? -7.402  7.773   74.385  1.00 29.94  ? 4   LEU H CA  1 
ATOM   27   C C   . LEU A 1 4   ? -8.441  8.276   75.372  1.00 31.21  ? 4   LEU H C   1 
ATOM   28   O O   . LEU A 1 4   ? -8.197  8.243   76.584  1.00 32.13  ? 4   LEU H O   1 
ATOM   29   C CB  . LEU A 1 4   ? -7.183  6.252   74.549  1.00 30.19  ? 4   LEU H CB  1 
ATOM   30   C CG  . LEU A 1 4   ? -6.146  5.597   73.645  1.00 31.00  ? 4   LEU H CG  1 
ATOM   31   C CD1 . LEU A 1 4   ? -6.155  4.066   73.761  1.00 31.55  ? 4   LEU H CD1 1 
ATOM   32   C CD2 . LEU A 1 4   ? -6.291  5.937   72.192  1.00 35.36  ? 4   LEU H CD2 1 
ATOM   33   N N   . GLN A 1 5   ? -9.653  8.574   74.863  1.00 32.07  ? 5   GLN H N   1 
ATOM   34   C CA  . GLN A 1 5   ? -10.714 9.065   75.711  1.00 30.76  ? 5   GLN H CA  1 
ATOM   35   C C   . GLN A 1 5   ? -11.980 8.264   75.457  1.00 28.49  ? 5   GLN H C   1 
ATOM   36   O O   . GLN A 1 5   ? -12.392 8.080   74.301  1.00 30.55  ? 5   GLN H O   1 
ATOM   37   C CB  . GLN A 1 5   ? -10.977 10.558  75.450  1.00 35.01  ? 5   GLN H CB  1 
ATOM   38   C CG  . GLN A 1 5   ? -9.780  11.436  75.798  1.00 38.56  ? 5   GLN H CG  1 
ATOM   39   C CD  . GLN A 1 5   ? -10.076 12.881  75.457  1.00 47.54  ? 5   GLN H CD  1 
ATOM   40   O OE1 . GLN A 1 5   ? -10.362 13.693  76.336  1.00 54.14  ? 5   GLN H OE1 1 
ATOM   41   N NE2 . GLN A 1 5   ? -10.103 13.190  74.171  1.00 47.41  ? 5   GLN H NE2 1 
ATOM   42   N N   . GLN A 1 6   ? -12.503 7.746   76.555  1.00 30.91  ? 6   GLN H N   1 
ATOM   43   C CA  . GLN A 1 6   ? -13.606 6.804   76.492  1.00 31.25  ? 6   GLN H CA  1 
ATOM   44   C C   . GLN A 1 6   ? -14.912 7.492   76.871  1.00 31.94  ? 6   GLN H C   1 
ATOM   45   O O   . GLN A 1 6   ? -14.891 8.466   77.601  1.00 32.69  ? 6   GLN H O   1 
ATOM   46   C CB  . GLN A 1 6   ? -13.333 5.585   77.366  1.00 31.15  ? 6   GLN H CB  1 
ATOM   47   C CG  . GLN A 1 6   ? -12.288 4.670   76.759  1.00 31.86  ? 6   GLN H CG  1 
ATOM   48   C CD  . GLN A 1 6   ? -12.036 3.439   77.600  1.00 32.75  ? 6   GLN H CD  1 
ATOM   49   O OE1 . GLN A 1 6   ? -11.002 3.307   78.268  1.00 33.25  ? 6   GLN H OE1 1 
ATOM   50   N NE2 . GLN A 1 6   ? -13.017 2.541   77.649  1.00 32.76  ? 6   GLN H NE2 1 
ATOM   51   N N   . SER A 1 7   ? -16.016 6.874   76.436  1.00 32.01  ? 7   SER H N   1 
ATOM   52   C CA  . SER A 1 7   ? -17.380 7.336   76.726  1.00 33.26  ? 7   SER H CA  1 
ATOM   53   C C   . SER A 1 7   ? -17.694 7.152   78.205  1.00 33.34  ? 7   SER H C   1 
ATOM   54   O O   . SER A 1 7   ? -17.099 6.319   78.913  1.00 33.53  ? 7   SER H O   1 
ATOM   55   C CB  . SER A 1 7   ? -18.369 6.641   75.856  1.00 35.39  ? 7   SER H CB  1 
ATOM   56   O OG  . SER A 1 7   ? -18.183 5.236   75.871  1.00 33.42  ? 7   SER H OG  1 
ATOM   57   N N   . GLY A 1 8   ? -18.653 7.943   78.678  1.00 33.82  ? 8   GLY H N   1 
ATOM   58   C CA  . GLY A 1 8   ? -18.988 7.946   80.084  1.00 33.14  ? 8   GLY H CA  1 
ATOM   59   C C   . GLY A 1 8   ? -19.786 6.690   80.465  1.00 31.63  ? 8   GLY H C   1 
ATOM   60   O O   . GLY A 1 8   ? -20.317 5.995   79.614  1.00 32.52  ? 8   GLY H O   1 
ATOM   61   N N   . ALA A 1 9   ? -19.871 6.481   81.783  1.00 31.27  ? 9   ALA H N   1 
ATOM   62   C CA  . ALA A 1 9   ? -20.533 5.331   82.393  1.00 32.69  ? 9   ALA H CA  1 
ATOM   63   C C   . ALA A 1 9   ? -21.976 5.177   81.932  1.00 35.64  ? 9   ALA H C   1 
ATOM   64   O O   . ALA A 1 9   ? -22.693 6.151   81.684  1.00 32.70  ? 9   ALA H O   1 
ATOM   65   C CB  . ALA A 1 9   ? -20.407 5.444   83.915  1.00 32.73  ? 9   ALA H CB  1 
ATOM   66   N N   . GLU A 1 10  ? -22.443 3.927   81.961  1.00 33.61  ? 10  GLU H N   1 
ATOM   67   C CA  . GLU A 1 10  ? -23.725 3.571   81.414  1.00 36.03  ? 10  GLU H CA  1 
ATOM   68   C C   . GLU A 1 10  ? -24.396 2.549   82.320  1.00 36.05  ? 10  GLU H C   1 
ATOM   69   O O   . GLU A 1 10  ? -23.719 1.761   83.011  1.00 35.64  ? 10  GLU H O   1 
ATOM   70   C CB  . GLU A 1 10  ? -23.519 2.995   80.016  1.00 44.47  ? 10  GLU H CB  1 
ATOM   71   C CG  . GLU A 1 10  ? -24.120 3.853   78.914  1.00 59.01  ? 10  GLU H CG  1 
ATOM   72   C CD  . GLU A 1 10  ? -23.896 3.263   77.533  1.00 63.48  ? 10  GLU H CD  1 
ATOM   73   O OE1 . GLU A 1 10  ? -22.773 3.323   76.975  1.00 61.69  ? 10  GLU H OE1 1 
ATOM   74   O OE2 . GLU A 1 10  ? -24.905 2.750   77.022  1.00 53.92  ? 10  GLU H OE2 1 
ATOM   75   N N   . LEU A 1 11  ? -25.729 2.658   82.351  1.00 31.85  ? 11  LEU H N   1 
ATOM   76   C CA  . LEU A 1 11  ? -26.612 1.601   82.857  1.00 34.62  ? 11  LEU H CA  1 
ATOM   77   C C   . LEU A 1 11  ? -27.304 0.930   81.677  1.00 32.93  ? 11  LEU H C   1 
ATOM   78   O O   . LEU A 1 11  ? -27.767 1.602   80.740  1.00 35.23  ? 11  LEU H O   1 
ATOM   79   C CB  . LEU A 1 11  ? -27.632 2.236   83.805  1.00 34.03  ? 11  LEU H CB  1 
ATOM   80   C CG  . LEU A 1 11  ? -28.740 1.321   84.334  1.00 37.59  ? 11  LEU H CG  1 
ATOM   81   C CD1 . LEU A 1 11  ? -28.241 0.288   85.304  1.00 39.13  ? 11  LEU H CD1 1 
ATOM   82   C CD2 . LEU A 1 11  ? -29.861 2.170   84.934  1.00 42.07  ? 11  LEU H CD2 1 
ATOM   83   N N   . ALA A 1 12  ? -27.428 -0.413  81.729  1.00 35.00  ? 12  ALA H N   1 
ATOM   84   C CA  . ALA A 1 12  ? -28.197 -1.110  80.714  1.00 34.13  ? 12  ALA H CA  1 
ATOM   85   C C   . ALA A 1 12  ? -28.976 -2.245  81.382  1.00 34.50  ? 12  ALA H C   1 
ATOM   86   O O   . ALA A 1 12  ? -28.611 -2.668  82.486  1.00 35.12  ? 12  ALA H O   1 
ATOM   87   C CB  . ALA A 1 12  ? -27.306 -1.638  79.616  1.00 37.82  ? 12  ALA H CB  1 
ATOM   88   N N   . LYS A 1 13  ? -30.078 -2.617  80.726  1.00 38.92  ? 13  LYS H N   1 
ATOM   89   C CA  . LYS A 1 13  ? -30.967 -3.662  81.198  1.00 40.12  ? 13  LYS H CA  1 
ATOM   90   C C   . LYS A 1 13  ? -30.413 -5.025  80.784  1.00 39.19  ? 13  LYS H C   1 
ATOM   91   O O   . LYS A 1 13  ? -29.851 -5.168  79.689  1.00 36.21  ? 13  LYS H O   1 
ATOM   92   C CB  . LYS A 1 13  ? -32.392 -3.452  80.649  1.00 41.14  ? 13  LYS H CB  1 
ATOM   93   C CG  . LYS A 1 13  ? -33.020 -2.152  81.152  1.00 45.84  ? 13  LYS H CG  1 
ATOM   94   C CD  . LYS A 1 13  ? -34.513 -1.916  81.013  0.92 49.77  ? 13  LYS H CD  1 
ATOM   95   C CE  . LYS A 1 13  ? -34.991 -0.660  81.718  0.60 43.17  ? 13  LYS H CE  1 
ATOM   96   N NZ  . LYS A 1 13  ? -34.989 -0.742  83.182  0.74 44.90  ? 13  LYS H NZ  1 
ATOM   97   N N   . PRO A 1 14  ? -30.653 -6.059  81.613  1.00 36.83  ? 14  PRO H N   1 
ATOM   98   C CA  . PRO A 1 14  ? -30.429 -7.454  81.200  1.00 37.16  ? 14  PRO H CA  1 
ATOM   99   C C   . PRO A 1 14  ? -31.043 -7.724  79.835  1.00 40.28  ? 14  PRO H C   1 
ATOM   100  O O   . PRO A 1 14  ? -32.197 -7.364  79.574  1.00 40.30  ? 14  PRO H O   1 
ATOM   101  C CB  . PRO A 1 14  ? -31.087 -8.279  82.308  1.00 41.79  ? 14  PRO H CB  1 
ATOM   102  C CG  . PRO A 1 14  ? -31.092 -7.389  83.535  1.00 43.72  ? 14  PRO H CG  1 
ATOM   103  C CD  . PRO A 1 14  ? -31.146 -5.973  82.997  1.00 40.60  ? 14  PRO H CD  1 
ATOM   104  N N   . GLY A 1 15  ? -30.235 -8.305  78.948  1.00 37.80  ? 15  GLY H N   1 
ATOM   105  C CA  . GLY A 1 15  ? -30.655 -8.634  77.594  1.00 36.82  ? 15  GLY H CA  1 
ATOM   106  C C   . GLY A 1 15  ? -30.460 -7.566  76.534  1.00 38.75  ? 15  GLY H C   1 
ATOM   107  O O   . GLY A 1 15  ? -30.533 -7.881  75.333  1.00 38.60  ? 15  GLY H O   1 
ATOM   108  N N   . ALA A 1 16  ? -30.200 -6.312  76.959  1.00 36.84  ? 16  ALA H N   1 
ATOM   109  C CA  . ALA A 1 16  ? -29.979 -5.241  76.007  1.00 36.73  ? 16  ALA H CA  1 
ATOM   110  C C   . ALA A 1 16  ? -28.522 -5.272  75.503  1.00 35.24  ? 16  ALA H C   1 
ATOM   111  O O   . ALA A 1 16  ? -27.760 -6.187  75.824  1.00 35.46  ? 16  ALA H O   1 
ATOM   112  C CB  . ALA A 1 16  ? -30.334 -3.919  76.648  1.00 39.11  ? 16  ALA H CB  1 
ATOM   113  N N   . SER A 1 17  ? -28.195 -4.303  74.646  1.00 37.64  ? 17  SER H N   1 
ATOM   114  C CA  . SER A 1 17  ? -26.830 -4.098  74.164  1.00 35.34  ? 17  SER H CA  1 
ATOM   115  C C   . SER A 1 17  ? -26.404 -2.684  74.502  1.00 38.64  ? 17  SER H C   1 
ATOM   116  O O   . SER A 1 17  ? -27.235 -1.802  74.717  1.00 37.51  ? 17  SER H O   1 
ATOM   117  C CB  . SER A 1 17  ? -26.746 -4.307  72.687  1.00 36.95  ? 17  SER H CB  1 
ATOM   118  O OG  . SER A 1 17  ? -27.061 -5.661  72.401  1.00 49.94  ? 17  SER H OG  1 
ATOM   119  N N   . VAL A 1 18  ? -25.087 -2.491  74.528  1.00 32.62  ? 18  VAL H N   1 
ATOM   120  C CA  . VAL A 1 18  ? -24.500 -1.168  74.687  1.00 32.98  ? 18  VAL H CA  1 
ATOM   121  C C   . VAL A 1 18  ? -23.361 -1.055  73.701  1.00 35.17  ? 18  VAL H C   1 
ATOM   122  O O   . VAL A 1 18  ? -22.806 -2.063  73.255  1.00 33.24  ? 18  VAL H O   1 
ATOM   123  C CB  . VAL A 1 18  ? -23.961 -0.830  76.086  1.00 39.72  ? 18  VAL H CB  1 
ATOM   124  C CG1 . VAL A 1 18  ? -25.072 -0.673  77.083  1.00 42.82  ? 18  VAL H CG1 1 
ATOM   125  C CG2 . VAL A 1 18  ? -22.920 -1.835  76.577  1.00 36.57  ? 18  VAL H CG2 1 
ATOM   126  N N   . LYS A 1 19  ? -23.022 0.191   73.365  1.00 33.82  ? 19  LYS H N   1 
ATOM   127  C CA  . LYS A 1 19  ? -21.888 0.427   72.503  1.00 35.96  ? 19  LYS H CA  1 
ATOM   128  C C   . LYS A 1 19  ? -21.000 1.494   73.133  1.00 38.52  ? 19  LYS H C   1 
ATOM   129  O O   . LYS A 1 19  ? -21.413 2.637   73.328  1.00 35.93  ? 19  LYS H O   1 
ATOM   130  C CB  . LYS A 1 19  ? -22.280 0.765   71.064  1.00 37.10  ? 19  LYS H CB  1 
ATOM   131  C CG  . LYS A 1 19  ? -21.105 0.751   70.132  1.00 45.12  ? 19  LYS H CG  1 
ATOM   132  C CD  . LYS A 1 19  ? -21.350 1.290   68.732  1.00 49.05  ? 19  LYS H CD  1 
ATOM   133  C CE  . LYS A 1 19  ? -21.819 0.312   67.757  1.00 55.34  ? 19  LYS H CE  1 
ATOM   134  N NZ  . LYS A 1 19  ? -21.835 0.970   66.443  1.00 55.80  ? 19  LYS H NZ  1 
ATOM   135  N N   . LEU A 1 20  ? -19.777 1.087   73.452  1.00 34.58  ? 20  LEU H N   1 
ATOM   136  C CA  . LEU A 1 20  ? -18.794 1.916   74.157  1.00 35.09  ? 20  LEU H CA  1 
ATOM   137  C C   . LEU A 1 20  ? -17.830 2.484   73.130  1.00 33.60  ? 20  LEU H C   1 
ATOM   138  O O   . LEU A 1 20  ? -17.559 1.835   72.124  1.00 32.45  ? 20  LEU H O   1 
ATOM   139  C CB  . LEU A 1 20  ? -18.003 1.121   75.197  1.00 33.22  ? 20  LEU H CB  1 
ATOM   140  C CG  . LEU A 1 20  ? -18.786 0.251   76.184  1.00 39.80  ? 20  LEU H CG  1 
ATOM   141  C CD1 . LEU A 1 20  ? -17.841 -0.278  77.259  1.00 38.08  ? 20  LEU H CD1 1 
ATOM   142  C CD2 . LEU A 1 20  ? -19.990 0.928   76.814  1.00 46.42  ? 20  LEU H CD2 1 
ATOM   143  N N   . SER A 1 21  ? -17.374 3.736   73.347  1.00 32.47  ? 21  SER H N   1 
ATOM   144  C CA  . SER A 1 21  ? -16.458 4.386   72.406  1.00 32.39  ? 21  SER H CA  1 
ATOM   145  C C   . SER A 1 21  ? -15.107 4.710   73.046  1.00 29.60  ? 21  SER H C   1 
ATOM   146  O O   . SER A 1 21  ? -14.978 4.884   74.259  1.00 30.90  ? 21  SER H O   1 
ATOM   147  C CB  . SER A 1 21  ? -17.054 5.636   71.790  1.00 35.90  ? 21  SER H CB  1 
ATOM   148  O OG  . SER A 1 21  ? -17.272 6.602   72.768  1.00 37.75  ? 21  SER H OG  1 
ATOM   149  N N   . CYS A 1 22  ? -14.130 4.782   72.147  1.00 32.30  ? 22  CYS H N   1 
ATOM   150  C CA  . CYS A 1 22  ? -12.744 5.105   72.450  1.00 31.96  ? 22  CYS H CA  1 
ATOM   151  C C   . CYS A 1 22  ? -12.173 5.983   71.349  1.00 32.58  ? 22  CYS H C   1 
ATOM   152  O O   . CYS A 1 22  ? -11.845 5.487   70.288  1.00 31.81  ? 22  CYS H O   1 
ATOM   153  C CB  . CYS A 1 22  ? -12.016 3.772   72.588  1.00 33.75  ? 22  CYS H CB  1 
ATOM   154  S SG  . CYS A 1 22  ? -10.230 3.998   72.837  1.00 35.29  ? 22  CYS H SG  1 
ATOM   155  N N   . LYS A 1 23  ? -12.077 7.303   71.614  1.00 32.23  ? 23  LYS H N   1 
ATOM   156  C CA  . LYS A 1 23  ? -11.518 8.234   70.673  1.00 31.10  ? 23  LYS H CA  1 
ATOM   157  C C   . LYS A 1 23  ? -10.013 8.382   70.851  1.00 31.39  ? 23  LYS H C   1 
ATOM   158  O O   . LYS A 1 23  ? -9.536  8.682   71.944  1.00 32.04  ? 23  LYS H O   1 
ATOM   159  C CB  . LYS A 1 23  ? -12.225 9.586   70.822  1.00 34.24  ? 23  LYS H CB  1 
ATOM   160  C CG  . LYS A 1 23  ? -11.615 10.563  69.804  1.00 36.44  ? 23  LYS H CG  1 
ATOM   161  C CD  . LYS A 1 23  ? -12.244 11.955  69.808  1.00 44.88  ? 23  LYS H CD  1 
ATOM   162  C CE  . LYS A 1 23  ? -11.831 12.786  70.993  1.00 46.80  ? 23  LYS H CE  1 
ATOM   163  N NZ  . LYS A 1 23  ? -12.174 14.208  70.777  1.00 43.29  ? 23  LYS H NZ  1 
ATOM   164  N N   . ALA A 1 24  ? -9.310  8.273   69.735  1.00 30.35  ? 24  ALA H N   1 
ATOM   165  C CA  . ALA A 1 24  ? -7.853  8.343   69.721  1.00 33.83  ? 24  ALA H CA  1 
ATOM   166  C C   . ALA A 1 24  ? -7.445  9.709   69.194  1.00 34.19  ? 24  ALA H C   1 
ATOM   167  O O   . ALA A 1 24  ? -7.959  10.149  68.172  1.00 38.26  ? 24  ALA H O   1 
ATOM   168  C CB  . ALA A 1 24  ? -7.344  7.243   68.865  1.00 35.51  ? 24  ALA H CB  1 
ATOM   169  N N   . SER A 1 25  ? -6.573  10.405  69.912  1.00 34.01  ? 25  SER H N   1 
ATOM   170  C CA  . SER A 1 25  ? -6.064  11.632  69.339  1.00 36.82  ? 25  SER H CA  1 
ATOM   171  C C   . SER A 1 25  ? -4.548  11.718  69.505  1.00 38.99  ? 25  SER H C   1 
ATOM   172  O O   . SER A 1 25  ? -3.951  10.999  70.311  1.00 36.13  ? 25  SER H O   1 
ATOM   173  C CB  . SER A 1 25  ? -6.825  12.783  69.883  1.00 45.84  ? 25  SER H CB  1 
ATOM   174  O OG  . SER A 1 25  ? -6.573  12.874  71.246  1.00 45.41  ? 25  SER H OG  1 
ATOM   175  N N   . GLY A 1 26  ? -3.929  12.538  68.653  1.00 36.18  ? 26  GLY H N   1 
ATOM   176  C CA  . GLY A 1 26  ? -2.507  12.822  68.765  1.00 36.50  ? 26  GLY H CA  1 
ATOM   177  C C   . GLY A 1 26  ? -1.610  11.896  67.941  1.00 38.08  ? 26  GLY H C   1 
ATOM   178  O O   . GLY A 1 26  ? -0.388  12.049  67.978  1.00 36.25  ? 26  GLY H O   1 
ATOM   179  N N   . TYR A 1 27  ? -2.207  11.006  67.147  1.00 38.36  ? 27  TYR H N   1 
ATOM   180  C CA  . TYR A 1 27  ? -1.502  10.105  66.249  1.00 39.53  ? 27  TYR H CA  1 
ATOM   181  C C   . TYR A 1 27  ? -2.489  9.648   65.180  1.00 36.78  ? 27  TYR H C   1 
ATOM   182  O O   . TYR A 1 27  ? -3.696  9.885   65.313  1.00 35.38  ? 27  TYR H O   1 
ATOM   183  C CB  . TYR A 1 27  ? -0.921  8.916   67.018  1.00 34.61  ? 27  TYR H CB  1 
ATOM   184  C CG  . TYR A 1 27  ? -1.956  7.909   67.506  1.00 30.74  ? 27  TYR H CG  1 
ATOM   185  C CD1 . TYR A 1 27  ? -2.697  8.128   68.657  1.00 32.24  ? 27  TYR H CD1 1 
ATOM   186  C CD2 . TYR A 1 27  ? -2.167  6.723   66.812  1.00 34.04  ? 27  TYR H CD2 1 
ATOM   187  C CE1 . TYR A 1 27  ? -3.613  7.188   69.116  1.00 33.24  ? 27  TYR H CE1 1 
ATOM   188  C CE2 . TYR A 1 27  ? -3.116  5.803   67.231  1.00 34.22  ? 27  TYR H CE2 1 
ATOM   189  C CZ  . TYR A 1 27  ? -3.821  6.027   68.400  1.00 33.10  ? 27  TYR H CZ  1 
ATOM   190  O OH  . TYR A 1 27  ? -4.746  5.100   68.821  1.00 33.56  ? 27  TYR H OH  1 
ATOM   191  N N   . THR A 1 28  ? -1.972  8.970   64.158  1.00 35.63  ? 28  THR H N   1 
ATOM   192  C CA  . THR A 1 28  ? -2.786  8.463   63.065  1.00 37.99  ? 28  THR H CA  1 
ATOM   193  C C   . THR A 1 28  ? -3.502  7.188   63.543  1.00 35.61  ? 28  THR H C   1 
ATOM   194  O O   . THR A 1 28  ? -2.868  6.149   63.760  1.00 36.11  ? 28  THR H O   1 
ATOM   195  C CB  . THR A 1 28  ? -1.942  8.191   61.827  1.00 42.48  ? 28  THR H CB  1 
ATOM   196  O OG1 . THR A 1 28  ? -1.318  9.437   61.498  1.00 38.35  ? 28  THR H OG1 1 
ATOM   197  C CG2 . THR A 1 28  ? -2.787  7.695   60.668  1.00 43.50  ? 28  THR H CG2 1 
ATOM   198  N N   . PHE A 1 29  ? -4.822  7.283   63.700  1.00 35.00  ? 29  PHE H N   1 
ATOM   199  C CA  . PHE A 1 29  ? -5.597  6.220   64.333  1.00 35.52  ? 29  PHE H CA  1 
ATOM   200  C C   . PHE A 1 29  ? -5.362  4.870   63.666  1.00 35.87  ? 29  PHE H C   1 
ATOM   201  O O   . PHE A 1 29  ? -5.276  3.842   64.321  1.00 34.76  ? 29  PHE H O   1 
ATOM   202  C CB  . PHE A 1 29  ? -7.076  6.616   64.304  1.00 35.84  ? 29  PHE H CB  1 
ATOM   203  C CG  . PHE A 1 29  ? -8.090  5.554   64.708  1.00 36.03  ? 29  PHE H CG  1 
ATOM   204  C CD1 . PHE A 1 29  ? -8.162  5.062   66.009  1.00 34.50  ? 29  PHE H CD1 1 
ATOM   205  C CD2 . PHE A 1 29  ? -9.025  5.105   63.785  1.00 36.23  ? 29  PHE H CD2 1 
ATOM   206  C CE1 . PHE A 1 29  ? -9.118  4.133   66.349  1.00 34.53  ? 29  PHE H CE1 1 
ATOM   207  C CE2 . PHE A 1 29  ? -10.028 4.209   64.162  1.00 36.12  ? 29  PHE H CE2 1 
ATOM   208  C CZ  . PHE A 1 29  ? -10.051 3.712   65.449  1.00 33.95  ? 29  PHE H CZ  1 
ATOM   209  N N   . THR A 1 30  ? -5.299  4.840   62.339  1.00 35.69  ? 30  THR H N   1 
ATOM   210  C CA  . THR A 1 30  ? -5.177  3.590   61.618  1.00 36.45  ? 30  THR H CA  1 
ATOM   211  C C   . THR A 1 30  ? -3.831  2.896   61.815  1.00 36.81  ? 30  THR H C   1 
ATOM   212  O O   . THR A 1 30  ? -3.709  1.753   61.386  1.00 36.18  ? 30  THR H O   1 
ATOM   213  C CB  . THR A 1 30  ? -5.444  3.828   60.124  1.00 39.69  ? 30  THR H CB  1 
ATOM   214  O OG1 . THR A 1 30  ? -4.609  4.899   59.691  1.00 39.66  ? 30  THR H OG1 1 
ATOM   215  C CG2 . THR A 1 30  ? -6.894  4.177   59.861  1.00 40.11  ? 30  THR H CG2 1 
ATOM   216  N N   . SER A 1 31  ? -2.849  3.534   62.472  1.00 37.19  ? 31  SER H N   1 
ATOM   217  C CA  . SER A 1 31  ? -1.490  3.006   62.577  1.00 36.36  ? 31  SER H CA  1 
ATOM   218  C C   . SER A 1 31  ? -1.306  2.015   63.734  1.00 32.73  ? 31  SER H C   1 
ATOM   219  O O   . SER A 1 31  ? -0.234  1.409   63.846  1.00 32.19  ? 31  SER H O   1 
ATOM   220  C CB  . SER A 1 31  ? -0.509  4.178   62.682  1.00 41.36  ? 31  SER H CB  1 
ATOM   221  O OG  . SER A 1 31  ? -0.532  4.879   61.445  1.00 38.93  ? 31  SER H OG  1 
ATOM   222  N N   . ASN A 1 32  ? -2.282  1.922   64.657  1.00 33.45  ? 32  ASN H N   1 
ATOM   223  C CA  . ASN A 1 32  ? -2.122  1.154   65.889  1.00 30.14  ? 32  ASN H CA  1 
ATOM   224  C C   . ASN A 1 32  ? -3.370  0.310   66.151  1.00 28.97  ? 32  ASN H C   1 
ATOM   225  O O   . ASN A 1 32  ? -4.487  0.809   66.181  1.00 33.93  ? 32  ASN H O   1 
ATOM   226  C CB  . ASN A 1 32  ? -1.797  1.980   67.142  1.00 30.83  ? 32  ASN H CB  1 
ATOM   227  C CG  . ASN A 1 32  ? -0.478  2.720   67.040  1.00 34.33  ? 32  ASN H CG  1 
ATOM   228  O OD1 . ASN A 1 32  ? 0.526   2.356   67.680  1.00 35.64  ? 32  ASN H OD1 1 
ATOM   229  N ND2 . ASN A 1 32  ? -0.486  3.767   66.238  1.00 30.68  ? 32  ASN H ND2 1 
ATOM   230  N N   . TRP A 1 33  ? -3.137  -0.986  66.334  1.00 32.01  ? 33  TRP H N   1 
ATOM   231  C CA  . TRP A 1 33  ? -4.213  -1.860  66.756  1.00 30.40  ? 33  TRP H CA  1 
ATOM   232  C C   . TRP A 1 33  ? -4.785  -1.404  68.088  1.00 30.60  ? 33  TRP H C   1 
ATOM   233  O O   . TRP A 1 33  ? -4.047  -1.061  69.016  1.00 32.11  ? 33  TRP H O   1 
ATOM   234  C CB  . TRP A 1 33  ? -3.677  -3.287  66.870  1.00 31.14  ? 33  TRP H CB  1 
ATOM   235  C CG  . TRP A 1 33  ? -3.228  -3.894  65.571  1.00 31.86  ? 33  TRP H CG  1 
ATOM   236  C CD1 . TRP A 1 33  ? -3.263  -3.368  64.317  1.00 33.86  ? 33  TRP H CD1 1 
ATOM   237  C CD2 . TRP A 1 33  ? -2.609  -5.191  65.456  1.00 32.49  ? 33  TRP H CD2 1 
ATOM   238  N NE1 . TRP A 1 33  ? -2.706  -4.244  63.424  1.00 35.25  ? 33  TRP H NE1 1 
ATOM   239  C CE2 . TRP A 1 33  ? -2.321  -5.385  64.084  1.00 35.06  ? 33  TRP H CE2 1 
ATOM   240  C CE3 . TRP A 1 33  ? -2.295  -6.199  66.373  1.00 35.71  ? 33  TRP H CE3 1 
ATOM   241  C CZ2 . TRP A 1 33  ? -1.708  -6.555  63.619  1.00 37.85  ? 33  TRP H CZ2 1 
ATOM   242  C CZ3 . TRP A 1 33  ? -1.693  -7.356  65.915  1.00 36.43  ? 33  TRP H CZ3 1 
ATOM   243  C CH2 . TRP A 1 33  ? -1.425  -7.525  64.542  1.00 37.55  ? 33  TRP H CH2 1 
ATOM   244  N N   . MET A 1 34  ? -6.122  -1.494  68.221  1.00 32.10  ? 34  MET H N   1 
ATOM   245  C CA  . MET A 1 34  ? -6.751  -1.051  69.448  1.00 29.67  ? 34  MET H CA  1 
ATOM   246  C C   . MET A 1 34  ? -7.293  -2.279  70.170  1.00 31.24  ? 34  MET H C   1 
ATOM   247  O O   . MET A 1 34  ? -8.119  -3.006  69.600  1.00 31.62  ? 34  MET H O   1 
ATOM   248  C CB  . MET A 1 34  ? -7.899  -0.080  69.161  1.00 30.80  ? 34  MET H CB  1 
ATOM   249  C CG  . MET A 1 34  ? -8.451  0.550   70.438  1.00 31.08  ? 34  MET H CG  1 
ATOM   250  S SD  . MET A 1 34  ? -7.298  1.678   71.244  1.00 34.26  ? 34  MET H SD  1 
ATOM   251  C CE  . MET A 1 34  ? -7.399  3.151   70.215  1.00 33.96  ? 34  MET H CE  1 
ATOM   252  N N   . HIS A 1 35  ? -6.835  -2.468  71.419  1.00 30.45  ? 35  HIS H N   1 
ATOM   253  C CA  . HIS A 1 35  ? -7.256  -3.580  72.257  1.00 31.80  ? 35  HIS H CA  1 
ATOM   254  C C   . HIS A 1 35  ? -8.289  -3.133  73.283  1.00 32.51  ? 35  HIS H C   1 
ATOM   255  O O   . HIS A 1 35  ? -8.451  -1.949  73.544  1.00 32.01  ? 35  HIS H O   1 
ATOM   256  C CB  . HIS A 1 35  ? -6.027  -4.176  72.934  1.00 30.69  ? 35  HIS H CB  1 
ATOM   257  C CG  . HIS A 1 35  ? -5.140  -4.904  72.005  1.00 33.89  ? 35  HIS H CG  1 
ATOM   258  N ND1 . HIS A 1 35  ? -4.948  -6.258  72.196  1.00 32.68  ? 35  HIS H ND1 1 
ATOM   259  C CD2 . HIS A 1 35  ? -4.319  -4.527  70.995  1.00 31.59  ? 35  HIS H CD2 1 
ATOM   260  C CE1 . HIS A 1 35  ? -4.103  -6.697  71.277  1.00 31.70  ? 35  HIS H CE1 1 
ATOM   261  N NE2 . HIS A 1 35  ? -3.678  -5.645  70.547  1.00 33.90  ? 35  HIS H NE2 1 
ATOM   262  N N   . TRP A 1 36  ? -9.060  -4.081  73.813  1.00 30.01  ? 36  TRP H N   1 
ATOM   263  C CA  . TRP A 1 36  ? -10.004 -3.834  74.898  1.00 31.80  ? 36  TRP H CA  1 
ATOM   264  C C   . TRP A 1 36  ? -9.810  -4.849  76.024  1.00 29.75  ? 36  TRP H C   1 
ATOM   265  O O   . TRP A 1 36  ? -9.421  -5.999  75.768  1.00 32.31  ? 36  TRP H O   1 
ATOM   266  C CB  . TRP A 1 36  ? -11.444 -3.937  74.379  1.00 28.72  ? 36  TRP H CB  1 
ATOM   267  C CG  . TRP A 1 36  ? -11.743 -2.888  73.353  1.00 30.16  ? 36  TRP H CG  1 
ATOM   268  C CD1 . TRP A 1 36  ? -11.446 -2.907  72.028  1.00 31.52  ? 36  TRP H CD1 1 
ATOM   269  C CD2 . TRP A 1 36  ? -12.468 -1.662  73.598  1.00 29.36  ? 36  TRP H CD2 1 
ATOM   270  N NE1 . TRP A 1 36  ? -11.895 -1.755  71.438  1.00 32.16  ? 36  TRP H NE1 1 
ATOM   271  C CE2 . TRP A 1 36  ? -12.573 -1.001  72.361  1.00 31.59  ? 36  TRP H CE2 1 
ATOM   272  C CE3 . TRP A 1 36  ? -13.036 -1.085  74.714  1.00 27.14  ? 36  TRP H CE3 1 
ATOM   273  C CZ2 . TRP A 1 36  ? -13.239 0.219   72.219  1.00 31.74  ? 36  TRP H CZ2 1 
ATOM   274  C CZ3 . TRP A 1 36  ? -13.751 0.105   74.562  1.00 31.33  ? 36  TRP H CZ3 1 
ATOM   275  C CH2 . TRP A 1 36  ? -13.885 0.719   73.321  1.00 29.53  ? 36  TRP H CH2 1 
ATOM   276  N N   . VAL A 1 37  ? -9.993  -4.376  77.249  1.00 30.15  ? 37  VAL H N   1 
ATOM   277  C CA  . VAL A 1 37  ? -9.728  -5.103  78.479  1.00 32.00  ? 37  VAL H CA  1 
ATOM   278  C C   . VAL A 1 37  ? -10.871 -4.892  79.448  1.00 34.55  ? 37  VAL H C   1 
ATOM   279  O O   . VAL A 1 37  ? -11.380 -3.782  79.554  1.00 32.63  ? 37  VAL H O   1 
ATOM   280  C CB  . VAL A 1 37  ? -8.401  -4.612  79.077  1.00 31.64  ? 37  VAL H CB  1 
ATOM   281  C CG1 . VAL A 1 37  ? -8.145  -5.214  80.451  1.00 36.17  ? 37  VAL H CG1 1 
ATOM   282  C CG2 . VAL A 1 37  ? -7.251  -4.969  78.165  1.00 35.21  ? 37  VAL H CG2 1 
ATOM   283  N N   . LYS A 1 38  ? -11.275 -5.968  80.127  1.00 31.41  ? 38  LYS H N   1 
ATOM   284  C CA  . LYS A 1 38  ? -12.312 -5.911  81.142  1.00 32.08  ? 38  LYS H CA  1 
ATOM   285  C C   . LYS A 1 38  ? -11.707 -5.992  82.536  1.00 36.09  ? 38  LYS H C   1 
ATOM   286  O O   . LYS A 1 38  ? -10.807 -6.776  82.814  1.00 37.47  ? 38  LYS H O   1 
ATOM   287  C CB  . LYS A 1 38  ? -13.264 -7.094  80.958  1.00 30.74  ? 38  LYS H CB  1 
ATOM   288  C CG  . LYS A 1 38  ? -14.474 -7.157  81.862  1.00 33.05  ? 38  LYS H CG  1 
ATOM   289  C CD  . LYS A 1 38  ? -15.297 -8.422  81.695  1.00 34.49  ? 38  LYS H CD  1 
ATOM   290  C CE  . LYS A 1 38  ? -16.435 -8.542  82.664  1.00 35.35  ? 38  LYS H CE  1 
ATOM   291  N NZ  . LYS A 1 38  ? -17.257 -9.701  82.247  1.00 35.83  ? 38  LYS H NZ  1 
ATOM   292  N N   . GLN A 1 39  ? -12.241 -5.203  83.454  1.00 32.53  ? 39  GLN H N   1 
ATOM   293  C CA  . GLN A 1 39  ? -11.780 -5.218  84.824  1.00 34.65  ? 39  GLN H CA  1 
ATOM   294  C C   . GLN A 1 39  ? -12.955 -5.254  85.793  1.00 41.32  ? 39  GLN H C   1 
ATOM   295  O O   . GLN A 1 39  ? -13.737 -4.317  85.839  1.00 34.68  ? 39  GLN H O   1 
ATOM   296  C CB  . GLN A 1 39  ? -10.914 -4.024  85.202  1.00 35.75  ? 39  GLN H CB  1 
ATOM   297  C CG  . GLN A 1 39  ? -10.381 -4.123  86.631  1.00 39.53  ? 39  GLN H CG  1 
ATOM   298  C CD  . GLN A 1 39  ? -9.263  -3.152  86.911  1.00 41.49  ? 39  GLN H CD  1 
ATOM   299  O OE1 . GLN A 1 39  ? -9.301  -1.993  86.476  1.00 39.37  ? 39  GLN H OE1 1 
ATOM   300  N NE2 . GLN A 1 39  ? -8.245  -3.616  87.618  1.00 45.41  ? 39  GLN H NE2 1 
ATOM   301  N N   . ARG A 1 40  ? -13.004 -6.311  86.614  1.00 48.50  ? 40  ARG H N   1 
ATOM   302  C CA  . ARG A 1 40  ? -13.911 -6.401  87.752  1.00 51.15  ? 40  ARG H CA  1 
ATOM   303  C C   . ARG A 1 40  ? -13.161 -6.693  89.041  1.00 58.35  ? 40  ARG H C   1 
ATOM   304  O O   . ARG A 1 40  ? -12.150 -7.402  89.036  1.00 59.91  ? 40  ARG H O   1 
ATOM   305  C CB  . ARG A 1 40  ? -14.829 -7.606  87.667  1.00 50.60  ? 40  ARG H CB  1 
ATOM   306  C CG  . ARG A 1 40  ? -15.674 -7.526  86.417  1.00 51.59  ? 40  ARG H CG  1 
ATOM   307  C CD  . ARG A 1 40  ? -16.901 -8.383  86.630  1.00 57.13  ? 40  ARG H CD  1 
ATOM   308  N NE  . ARG A 1 40  ? -16.616 -9.780  86.300  1.00 59.94  ? 40  ARG H NE  1 
ATOM   309  C CZ  . ARG A 1 40  ? -17.473 -10.723 86.549  0.55 60.05  ? 40  ARG H CZ  1 
ATOM   310  N NH1 . ARG A 1 40  ? -18.513 -10.397 87.282  1.00 62.34  ? 40  ARG H NH1 1 
ATOM   311  N NH2 . ARG A 1 40  ? -17.271 -11.948 86.097  0.76 67.21  ? 40  ARG H NH2 1 
ATOM   312  N N   . PRO A 1 41  ? -13.665 -6.220  90.202  1.00 67.86  ? 41  PRO H N   1 
ATOM   313  C CA  . PRO A 1 41  ? -12.981 -6.485  91.474  1.00 66.56  ? 41  PRO H CA  1 
ATOM   314  C C   . PRO A 1 41  ? -12.722 -7.970  91.742  1.00 64.25  ? 41  PRO H C   1 
ATOM   315  O O   . PRO A 1 41  ? -13.595 -8.810  91.534  1.00 56.54  ? 41  PRO H O   1 
ATOM   316  C CB  . PRO A 1 41  ? -13.963 -5.842  92.449  1.00 66.47  ? 41  PRO H CB  1 
ATOM   317  C CG  . PRO A 1 41  ? -14.533 -4.701  91.662  1.00 65.48  ? 41  PRO H CG  1 
ATOM   318  C CD  . PRO A 1 41  ? -14.867 -5.373  90.347  1.00 65.61  ? 41  PRO H CD  1 
ATOM   319  N N   . GLY A 1 42  ? -11.471 -8.292  92.112  1.00 68.73  ? 42  GLY H N   1 
ATOM   320  C CA  . GLY A 1 42  ? -11.062 -9.664  92.380  1.00 70.26  ? 42  GLY H CA  1 
ATOM   321  C C   . GLY A 1 42  ? -11.273 -10.605 91.188  1.00 78.62  ? 42  GLY H C   1 
ATOM   322  O O   . GLY A 1 42  ? -11.421 -11.811 91.379  1.00 75.50  ? 42  GLY H O   1 
ATOM   323  N N   . GLN A 1 43  ? -11.299 -10.053 89.962  1.00 70.76  ? 43  GLN H N   1 
ATOM   324  C CA  . GLN A 1 43  ? -11.290 -10.840 88.732  1.00 65.38  ? 43  GLN H CA  1 
ATOM   325  C C   . GLN A 1 43  ? -10.154 -10.398 87.807  1.00 59.59  ? 43  GLN H C   1 
ATOM   326  O O   . GLN A 1 43  ? -10.138 -10.779 86.628  1.00 53.39  ? 43  GLN H O   1 
ATOM   327  C CB  . GLN A 1 43  ? -12.630 -10.673 88.017  1.00 71.11  ? 43  GLN H CB  1 
ATOM   328  C CG  . GLN A 1 43  ? -13.793 -11.260 88.797  1.00 77.75  ? 43  GLN H CG  1 
ATOM   329  C CD  . GLN A 1 43  ? -13.634 -12.756 88.913  1.00 92.06  ? 43  GLN H CD  1 
ATOM   330  O OE1 . GLN A 1 43  ? -13.574 -13.468 87.904  1.00 97.42  ? 43  GLN H OE1 1 
ATOM   331  N NE2 . GLN A 1 43  ? -13.494 -13.231 90.141  1.00 96.21  ? 43  GLN H NE2 1 
ATOM   332  N N   . GLY A 1 44  ? -9.231  -9.590  88.365  1.00 52.76  ? 44  GLY H N   1 
ATOM   333  C CA  . GLY A 1 44  ? -8.037  -9.116  87.687  1.00 54.83  ? 44  GLY H CA  1 
ATOM   334  C C   . GLY A 1 44  ? -8.427  -8.338  86.435  1.00 44.84  ? 44  GLY H C   1 
ATOM   335  O O   . GLY A 1 44  ? -9.435  -7.654  86.417  1.00 47.84  ? 44  GLY H O   1 
ATOM   336  N N   . LEU A 1 45  ? -7.697  -8.604  85.364  1.00 42.97  ? 45  LEU H N   1 
ATOM   337  C CA  . LEU A 1 45  ? -7.968  -8.049  84.056  1.00 37.49  ? 45  LEU H CA  1 
ATOM   338  C C   . LEU A 1 45  ? -8.188  -9.206  83.111  1.00 38.94  ? 45  LEU H C   1 
ATOM   339  O O   . LEU A 1 45  ? -7.477  -10.208 83.187  1.00 38.11  ? 45  LEU H O   1 
ATOM   340  C CB  . LEU A 1 45  ? -6.725  -7.252  83.690  1.00 35.54  ? 45  LEU H CB  1 
ATOM   341  C CG  . LEU A 1 45  ? -6.439  -6.021  84.546  1.00 36.55  ? 45  LEU H CG  1 
ATOM   342  C CD1 . LEU A 1 45  ? -5.111  -5.432  84.198  1.00 38.45  ? 45  LEU H CD1 1 
ATOM   343  C CD2 . LEU A 1 45  ? -7.518  -4.984  84.317  1.00 35.92  ? 45  LEU H CD2 1 
ATOM   344  N N   . GLU A 1 46  ? -9.134  -9.049  82.183  1.00 34.43  ? 46  GLU H N   1 
ATOM   345  C CA  . GLU A 1 46  ? -9.323  -10.023 81.123  1.00 37.17  ? 46  GLU H CA  1 
ATOM   346  C C   . GLU A 1 46  ? -9.220  -9.322  79.780  1.00 37.24  ? 46  GLU H C   1 
ATOM   347  O O   . GLU A 1 46  ? -9.764  -8.240  79.593  1.00 35.90  ? 46  GLU H O   1 
ATOM   348  C CB  . GLU A 1 46  ? -10.682 -10.705 81.186  1.00 39.22  ? 46  GLU H CB  1 
ATOM   349  C CG  . GLU A 1 46  ? -10.873 -11.420 82.512  1.00 41.83  ? 46  GLU H CG  1 
ATOM   350  C CD  . GLU A 1 46  ? -12.224 -12.097 82.479  1.00 44.38  ? 46  GLU H CD  1 
ATOM   351  O OE1 . GLU A 1 46  ? -12.315 -13.284 82.138  1.00 46.17  ? 46  GLU H OE1 1 
ATOM   352  O OE2 . GLU A 1 46  ? -13.187 -11.391 82.749  1.00 41.24  ? 46  GLU H OE2 1 
ATOM   353  N N   . TRP A 1 47  ? -8.461  -9.935  78.877  1.00 32.44  ? 47  TRP H N   1 
ATOM   354  C CA  . TRP A 1 47  ? -8.328  -9.430  77.515  1.00 33.08  ? 47  TRP H CA  1 
ATOM   355  C C   . TRP A 1 47  ? -9.522  -9.826  76.672  1.00 32.27  ? 47  TRP H C   1 
ATOM   356  O O   . TRP A 1 47  ? -9.890  -10.999 76.608  1.00 32.84  ? 47  TRP H O   1 
ATOM   357  C CB  . TRP A 1 47  ? -6.994  -9.922  76.918  1.00 29.94  ? 47  TRP H CB  1 
ATOM   358  C CG  . TRP A 1 47  ? -6.731  -9.476  75.509  1.00 28.77  ? 47  TRP H CG  1 
ATOM   359  C CD1 . TRP A 1 47  ? -6.323  -8.234  75.108  1.00 31.30  ? 47  TRP H CD1 1 
ATOM   360  C CD2 . TRP A 1 47  ? -6.853  -10.280 74.329  1.00 32.43  ? 47  TRP H CD2 1 
ATOM   361  N NE1 . TRP A 1 47  ? -6.189  -8.223  73.742  1.00 33.31  ? 47  TRP H NE1 1 
ATOM   362  C CE2 . TRP A 1 47  ? -6.483  -9.464  73.244  1.00 32.01  ? 47  TRP H CE2 1 
ATOM   363  C CE3 . TRP A 1 47  ? -7.191  -11.617 74.079  1.00 33.57  ? 47  TRP H CE3 1 
ATOM   364  C CZ2 . TRP A 1 47  ? -6.501  -9.917  71.927  1.00 32.43  ? 47  TRP H CZ2 1 
ATOM   365  C CZ3 . TRP A 1 47  ? -7.236  -12.052 72.779  1.00 34.87  ? 47  TRP H CZ3 1 
ATOM   366  C CH2 . TRP A 1 47  ? -6.865  -11.221 71.714  1.00 35.99  ? 47  TRP H CH2 1 
ATOM   367  N N   . ILE A 1 48  ? -10.120 -8.850  75.960  1.00 31.32  ? 48  ILE H N   1 
ATOM   368  C CA  . ILE A 1 48  ? -11.301 -9.097  75.157  1.00 31.45  ? 48  ILE H CA  1 
ATOM   369  C C   . ILE A 1 48  ? -10.945 -9.377  73.708  1.00 30.85  ? 48  ILE H C   1 
ATOM   370  O O   . ILE A 1 48  ? -11.426 -10.358 73.140  1.00 31.73  ? 48  ILE H O   1 
ATOM   371  C CB  . ILE A 1 48  ? -12.311 -7.934  75.290  1.00 29.56  ? 48  ILE H CB  1 
ATOM   372  C CG1 . ILE A 1 48  ? -12.821 -7.853  76.727  1.00 31.34  ? 48  ILE H CG1 1 
ATOM   373  C CG2 . ILE A 1 48  ? -13.459 -8.035  74.284  1.00 32.33  ? 48  ILE H CG2 1 
ATOM   374  C CD1 . ILE A 1 48  ? -13.583 -6.565  77.028  1.00 35.91  ? 48  ILE H CD1 1 
ATOM   375  N N   . GLY A 1 49  ? -10.033 -8.573  73.140  1.00 30.38  ? 49  GLY H N   1 
ATOM   376  C CA  . GLY A 1 49  ? -9.817  -8.631  71.695  1.00 29.98  ? 49  GLY H CA  1 
ATOM   377  C C   . GLY A 1 49  ? -9.107  -7.383  71.200  1.00 30.94  ? 49  GLY H C   1 
ATOM   378  O O   . GLY A 1 49  ? -8.846  -6.490  71.995  1.00 31.16  ? 49  GLY H O   1 
ATOM   379  N N   . TYR A 1 50  ? -8.915  -7.312  69.883  1.00 29.94  ? 50  TYR H N   1 
ATOM   380  C CA  . TYR A 1 50  ? -8.342  -6.126  69.277  1.00 30.14  ? 50  TYR H CA  1 
ATOM   381  C C   . TYR A 1 50  ? -8.963  -5.964  67.903  1.00 32.85  ? 50  TYR H C   1 
ATOM   382  O O   . TYR A 1 50  ? -9.437  -6.908  67.305  1.00 32.48  ? 50  TYR H O   1 
ATOM   383  C CB  . TYR A 1 50  ? -6.810  -6.123  69.154  1.00 30.07  ? 50  TYR H CB  1 
ATOM   384  C CG  . TYR A 1 50  ? -6.191  -6.960  68.061  1.00 32.94  ? 50  TYR H CG  1 
ATOM   385  C CD1 . TYR A 1 50  ? -6.078  -6.472  66.759  1.00 36.74  ? 50  TYR H CD1 1 
ATOM   386  C CD2 . TYR A 1 50  ? -5.766  -8.252  68.296  1.00 35.03  ? 50  TYR H CD2 1 
ATOM   387  C CE1 . TYR A 1 50  ? -5.533  -7.232  65.747  1.00 36.49  ? 50  TYR H CE1 1 
ATOM   388  C CE2 . TYR A 1 50  ? -5.190  -9.018  67.294  1.00 33.94  ? 50  TYR H CE2 1 
ATOM   389  C CZ  . TYR A 1 50  ? -5.135  -8.529  66.010  1.00 36.51  ? 50  TYR H CZ  1 
ATOM   390  O OH  . TYR A 1 50  ? -4.580  -9.293  65.043  1.00 38.52  ? 50  TYR H OH  1 
ATOM   391  N N   . ILE A 1 51  ? -8.928  -4.734  67.413  1.00 31.20  ? 51  ILE H N   1 
ATOM   392  C CA  . ILE A 1 51  ? -9.219  -4.453  66.024  1.00 30.66  ? 51  ILE H CA  1 
ATOM   393  C C   . ILE A 1 51  ? -8.019  -3.804  65.375  1.00 35.11  ? 51  ILE H C   1 
ATOM   394  O O   . ILE A 1 51  ? -7.336  -2.978  65.996  1.00 32.40  ? 51  ILE H O   1 
ATOM   395  C CB  . ILE A 1 51  ? -10.474 -3.584  65.894  1.00 31.39  ? 51  ILE H CB  1 
ATOM   396  C CG1 . ILE A 1 51  ? -10.905 -3.382  64.414  1.00 31.64  ? 51  ILE H CG1 1 
ATOM   397  C CG2 . ILE A 1 51  ? -10.302 -2.253  66.629  1.00 33.74  ? 51  ILE H CG2 1 
ATOM   398  C CD1 . ILE A 1 51  ? -12.333 -2.892  64.248  1.00 34.66  ? 51  ILE H CD1 1 
ATOM   399  N N   . ASN A 1 52  ? -7.814  -4.190  64.109  1.00 35.43  ? 52  ASN H N   1 
ATOM   400  C CA  . ASN A 1 52  ? -6.911  -3.456  63.229  1.00 35.06  ? 52  ASN H CA  1 
ATOM   401  C C   . ASN A 1 52  ? -7.730  -2.356  62.565  1.00 35.83  ? 52  ASN H C   1 
ATOM   402  O O   . ASN A 1 52  ? -8.475  -2.637  61.626  1.00 34.69  ? 52  ASN H O   1 
ATOM   403  C CB  . ASN A 1 52  ? -6.315  -4.403  62.186  1.00 34.77  ? 52  ASN H CB  1 
ATOM   404  C CG  . ASN A 1 52  ? -5.397  -3.683  61.222  1.00 34.60  ? 52  ASN H CG  1 
ATOM   405  O OD1 . ASN A 1 52  ? -5.308  -2.461  61.261  1.00 36.92  ? 52  ASN H OD1 1 
ATOM   406  N ND2 . ASN A 1 52  ? -4.602  -4.417  60.477  1.00 38.22  ? 52  ASN H ND2 1 
ATOM   407  N N   . PRO A 1 53  A -7.625  -1.075  62.984  1.00 34.69  ? 52  PRO H N   1 
ATOM   408  C CA  . PRO A 1 53  A -8.445  -0.028  62.386  1.00 37.41  ? 52  PRO H CA  1 
ATOM   409  C C   . PRO A 1 53  A -8.171  0.296   60.915  1.00 35.83  ? 52  PRO H C   1 
ATOM   410  O O   . PRO A 1 53  A -8.997  0.903   60.258  1.00 39.51  ? 52  PRO H O   1 
ATOM   411  C CB  . PRO A 1 53  A -8.210  1.183   63.271  1.00 35.04  ? 52  PRO H CB  1 
ATOM   412  C CG  . PRO A 1 53  A -7.114  0.852   64.162  1.00 39.42  ? 52  PRO H CG  1 
ATOM   413  C CD  . PRO A 1 53  A -6.674  -0.569  63.962  1.00 36.56  ? 52  PRO H CD  1 
ATOM   414  N N   . SER A 1 54  ? -7.007  -0.079  60.414  1.00 35.42  ? 53  SER H N   1 
ATOM   415  C CA  . SER A 1 54  ? -6.702  0.107   58.999  1.00 36.24  ? 53  SER H CA  1 
ATOM   416  C C   . SER A 1 54  ? -7.524  -0.837  58.125  1.00 40.78  ? 53  SER H C   1 
ATOM   417  O O   . SER A 1 54  ? -7.976  -0.433  57.061  1.00 40.33  ? 53  SER H O   1 
ATOM   418  C CB  . SER A 1 54  ? -5.215  -0.078  58.753  1.00 41.60  ? 53  SER H CB  1 
ATOM   419  O OG  . SER A 1 54  ? -4.910  0.220   57.398  1.00 44.62  ? 53  SER H OG  1 
ATOM   420  N N   . SER A 1 55  ? -7.682  -2.107  58.551  1.00 40.10  ? 54  SER H N   1 
ATOM   421  C CA  . SER A 1 55  ? -8.291  -3.156  57.745  1.00 41.63  ? 54  SER H CA  1 
ATOM   422  C C   . SER A 1 55  ? -9.746  -3.415  58.138  1.00 40.80  ? 54  SER H C   1 
ATOM   423  O O   . SER A 1 55  ? -10.513 -3.901  57.324  1.00 39.90  ? 54  SER H O   1 
ATOM   424  C CB  . SER A 1 55  ? -7.502  -4.444  57.827  1.00 40.13  ? 54  SER H CB  1 
ATOM   425  O OG  . SER A 1 55  ? -7.647  -5.065  59.107  1.00 37.32  ? 54  SER H OG  1 
ATOM   426  N N   . GLY A 1 56  ? -10.111 -3.135  59.391  1.00 35.17  ? 55  GLY H N   1 
ATOM   427  C CA  . GLY A 1 56  ? -11.434 -3.406  59.927  1.00 36.91  ? 55  GLY H CA  1 
ATOM   428  C C   . GLY A 1 56  ? -11.550 -4.811  60.537  1.00 35.41  ? 55  GLY H C   1 
ATOM   429  O O   . GLY A 1 56  ? -12.602 -5.166  61.063  1.00 38.87  ? 55  GLY H O   1 
ATOM   430  N N   . TYR A 1 57  ? -10.499 -5.617  60.423  1.00 34.51  ? 56  TYR H N   1 
ATOM   431  C CA  . TYR A 1 57  ? -10.540 -6.973  60.961  1.00 35.71  ? 56  TYR H CA  1 
ATOM   432  C C   . TYR A 1 57  ? -10.300 -6.961  62.470  1.00 35.19  ? 56  TYR H C   1 
ATOM   433  O O   . TYR A 1 57  ? -9.453  -6.232  62.987  1.00 35.29  ? 56  TYR H O   1 
ATOM   434  C CB  . TYR A 1 57  ? -9.549  -7.904  60.263  1.00 39.07  ? 56  TYR H CB  1 
ATOM   435  C CG  . TYR A 1 57  ? -9.937  -8.280  58.831  1.00 41.42  ? 56  TYR H CG  1 
ATOM   436  C CD1 . TYR A 1 57  ? -9.682  -7.427  57.772  1.00 38.43  ? 56  TYR H CD1 1 
ATOM   437  C CD2 . TYR A 1 57  ? -10.455 -9.549  58.516  1.00 43.41  ? 56  TYR H CD2 1 
ATOM   438  C CE1 . TYR A 1 57  ? -10.020 -7.751  56.461  1.00 41.88  ? 56  TYR H CE1 1 
ATOM   439  C CE2 . TYR A 1 57  ? -10.731 -9.912  57.203  1.00 40.89  ? 56  TYR H CE2 1 
ATOM   440  C CZ  . TYR A 1 57  ? -10.547 -8.995  56.177  1.00 43.28  ? 56  TYR H CZ  1 
ATOM   441  O OH  . TYR A 1 57  ? -10.819 -9.310  54.869  1.00 43.02  ? 56  TYR H OH  1 
ATOM   442  N N   . SER A 1 58  ? -11.043 -7.818  63.193  1.00 32.10  ? 57  SER H N   1 
ATOM   443  C CA  . SER A 1 58  ? -10.887 -7.904  64.639  1.00 32.59  ? 57  SER H CA  1 
ATOM   444  C C   . SER A 1 58  ? -10.685 -9.358  65.060  1.00 34.56  ? 57  SER H C   1 
ATOM   445  O O   . SER A 1 58  ? -11.109 -10.283 64.350  1.00 35.84  ? 57  SER H O   1 
ATOM   446  C CB  . SER A 1 58  ? -12.063 -7.263  65.357  1.00 35.47  ? 57  SER H CB  1 
ATOM   447  O OG  . SER A 1 58  ? -13.319 -7.800  64.958  1.00 33.78  ? 57  SER H OG  1 
ATOM   448  N N   . LYS A 1 59  ? -10.021 -9.540  66.210  1.00 32.73  ? 58  LYS H N   1 
ATOM   449  C CA  . LYS A 1 59  ? -9.687  -10.859 66.737  1.00 32.64  ? 58  LYS H CA  1 
ATOM   450  C C   . LYS A 1 59  ? -10.046 -10.881 68.209  1.00 35.44  ? 58  LYS H C   1 
ATOM   451  O O   . LYS A 1 59  ? -9.927  -9.863  68.868  1.00 34.05  ? 58  LYS H O   1 
ATOM   452  C CB  . LYS A 1 59  ? -8.191  -11.100 66.577  1.00 34.72  ? 58  LYS H CB  1 
ATOM   453  C CG  . LYS A 1 59  ? -7.594  -12.317 67.238  1.00 47.61  ? 58  LYS H CG  1 
ATOM   454  C CD  . LYS A 1 59  ? -7.836  -13.591 66.444  1.00 56.63  ? 58  LYS H CD  1 
ATOM   455  C CE  . LYS A 1 59  ? -7.153  -14.795 67.045  1.00 66.96  ? 58  LYS H CE  1 
ATOM   456  N NZ  . LYS A 1 59  ? -7.341  -15.949 66.153  1.00 70.31  ? 58  LYS H NZ  1 
ATOM   457  N N   . TYR A 1 60  ? -10.581 -12.001 68.697  1.00 31.70  ? 59  TYR H N   1 
ATOM   458  C CA  . TYR A 1 60  ? -11.198 -12.057 70.017  1.00 32.18  ? 59  TYR H CA  1 
ATOM   459  C C   . TYR A 1 60  ? -10.573 -13.146 70.865  1.00 33.93  ? 59  TYR H C   1 
ATOM   460  O O   . TYR A 1 60  ? -10.177 -14.206 70.373  1.00 34.17  ? 59  TYR H O   1 
ATOM   461  C CB  . TYR A 1 60  ? -12.730 -12.298 69.934  1.00 31.44  ? 59  TYR H CB  1 
ATOM   462  C CG  . TYR A 1 60  ? -13.378 -11.177 69.174  1.00 32.02  ? 59  TYR H CG  1 
ATOM   463  C CD1 . TYR A 1 60  ? -13.305 -11.138 67.780  1.00 30.85  ? 59  TYR H CD1 1 
ATOM   464  C CD2 . TYR A 1 60  ? -14.044 -10.153 69.836  1.00 34.67  ? 59  TYR H CD2 1 
ATOM   465  C CE1 . TYR A 1 60  ? -13.803 -10.065 67.073  1.00 33.48  ? 59  TYR H CE1 1 
ATOM   466  C CE2 . TYR A 1 60  ? -14.506 -9.058  69.138  1.00 32.37  ? 59  TYR H CE2 1 
ATOM   467  C CZ  . TYR A 1 60  ? -14.420 -9.030  67.752  1.00 31.47  ? 59  TYR H CZ  1 
ATOM   468  O OH  . TYR A 1 60  ? -14.890 -7.952  67.076  1.00 32.94  ? 59  TYR H OH  1 
ATOM   469  N N   . ASN A 1 61  ? -10.603 -12.907 72.177  1.00 33.54  ? 60  ASN H N   1 
ATOM   470  C CA  . ASN A 1 61  ? -10.582 -13.984 73.138  1.00 32.53  ? 60  ASN H CA  1 
ATOM   471  C C   . ASN A 1 61  ? -11.811 -14.851 72.883  1.00 30.67  ? 60  ASN H C   1 
ATOM   472  O O   . ASN A 1 61  ? -12.929 -14.331 72.864  1.00 32.04  ? 60  ASN H O   1 
ATOM   473  C CB  . ASN A 1 61  ? -10.542 -13.380 74.530  1.00 31.48  ? 60  ASN H CB  1 
ATOM   474  C CG  . ASN A 1 61  ? -10.354 -14.356 75.666  1.00 33.69  ? 60  ASN H CG  1 
ATOM   475  O OD1 . ASN A 1 61  ? -10.674 -15.558 75.564  1.00 34.68  ? 60  ASN H OD1 1 
ATOM   476  N ND2 . ASN A 1 61  ? -9.952  -13.813 76.807  1.00 33.35  ? 60  ASN H ND2 1 
ATOM   477  N N   . GLN A 1 62  ? -11.604 -16.172 72.785  1.00 32.37  ? 61  GLN H N   1 
ATOM   478  C CA  . GLN A 1 62  ? -12.732 -17.077 72.620  1.00 34.12  ? 61  GLN H CA  1 
ATOM   479  C C   . GLN A 1 62  ? -13.860 -16.821 73.617  1.00 34.36  ? 61  GLN H C   1 
ATOM   480  O O   . GLN A 1 62  ? -15.033 -16.987 73.267  1.00 35.60  ? 61  GLN H O   1 
ATOM   481  C CB  . GLN A 1 62  ? -12.219 -18.513 72.695  1.00 38.09  ? 61  GLN H CB  1 
ATOM   482  C CG  . GLN A 1 62  ? -13.278 -19.529 72.294  1.00 46.99  ? 61  GLN H CG  1 
ATOM   483  C CD  . GLN A 1 62  ? -12.714 -20.906 71.994  1.00 55.88  ? 61  GLN H CD  1 
ATOM   484  O OE1 . GLN A 1 62  ? -11.551 -21.065 71.604  1.00 62.19  ? 61  GLN H OE1 1 
ATOM   485  N NE2 . GLN A 1 62  ? -13.582 -21.902 72.075  1.00 50.45  ? 61  GLN H NE2 1 
ATOM   486  N N   . LYS A 1 63  ? -13.494 -16.455 74.864  1.00 33.39  ? 62  LYS H N   1 
ATOM   487  C CA  . LYS A 1 63  ? -14.440 -16.208 75.935  1.00 36.54  ? 62  LYS H CA  1 
ATOM   488  C C   . LYS A 1 63  ? -15.378 -15.051 75.618  1.00 35.47  ? 62  LYS H C   1 
ATOM   489  O O   . LYS A 1 63  ? -16.506 -15.059 76.088  1.00 34.21  ? 62  LYS H O   1 
ATOM   490  C CB  . LYS A 1 63  ? -13.680 -15.955 77.235  1.00 38.58  ? 62  LYS H CB  1 
ATOM   491  C CG  . LYS A 1 63  ? -14.584 -15.520 78.391  1.00 49.33  ? 62  LYS H CG  1 
ATOM   492  C CD  . LYS A 1 63  ? -13.904 -15.355 79.747  1.00 49.88  ? 62  LYS H CD  1 
ATOM   493  C CE  . LYS A 1 63  ? -14.934 -15.192 80.831  1.00 55.50  ? 62  LYS H CE  1 
ATOM   494  N NZ  . LYS A 1 63  ? -14.312 -15.092 82.151  1.00 51.95  ? 62  LYS H NZ  1 
ATOM   495  N N   . PHE A 1 64  ? -14.932 -14.094 74.789  1.00 33.17  ? 63  PHE H N   1 
ATOM   496  C CA  . PHE A 1 64  ? -15.703 -12.913 74.427  1.00 32.19  ? 63  PHE H CA  1 
ATOM   497  C C   . PHE A 1 64  ? -16.179 -12.927 72.988  1.00 33.54  ? 63  PHE H C   1 
ATOM   498  O O   . PHE A 1 64  ? -16.799 -11.969 72.542  1.00 34.00  ? 63  PHE H O   1 
ATOM   499  C CB  . PHE A 1 64  ? -14.851 -11.659 74.696  1.00 32.08  ? 63  PHE H CB  1 
ATOM   500  C CG  . PHE A 1 64  ? -14.645 -11.443 76.177  1.00 31.36  ? 63  PHE H CG  1 
ATOM   501  C CD1 . PHE A 1 64  ? -15.635 -10.856 76.951  1.00 36.72  ? 63  PHE H CD1 1 
ATOM   502  C CD2 . PHE A 1 64  ? -13.472 -11.838 76.809  1.00 30.34  ? 63  PHE H CD2 1 
ATOM   503  C CE1 . PHE A 1 64  ? -15.463 -10.708 78.321  1.00 37.85  ? 63  PHE H CE1 1 
ATOM   504  C CE2 . PHE A 1 64  ? -13.303 -11.695 78.184  1.00 33.67  ? 63  PHE H CE2 1 
ATOM   505  C CZ  . PHE A 1 64  ? -14.298 -11.115 78.927  1.00 38.18  ? 63  PHE H CZ  1 
ATOM   506  N N   . LYS A 1 65  ? -15.974 -14.014 72.242  1.00 32.75  ? 64  LYS H N   1 
ATOM   507  C CA  . LYS A 1 65  ? -16.289 -13.994 70.818  1.00 31.68  ? 64  LYS H CA  1 
ATOM   508  C C   . LYS A 1 65  ? -17.788 -13.785 70.539  1.00 32.83  ? 64  LYS H C   1 
ATOM   509  O O   . LYS A 1 65  ? -18.124 -13.321 69.447  1.00 33.75  ? 64  LYS H O   1 
ATOM   510  C CB  . LYS A 1 65  ? -15.802 -15.238 70.087  1.00 37.43  ? 64  LYS H CB  1 
ATOM   511  C CG  . LYS A 1 65  ? -16.629 -16.451 70.386  1.00 38.37  ? 64  LYS H CG  1 
ATOM   512  C CD  . LYS A 1 65  ? -16.042 -17.763 69.836  1.00 38.19  ? 64  LYS H CD  1 
ATOM   513  C CE  . LYS A 1 65  ? -16.960 -18.927 70.053  1.00 42.68  ? 64  LYS H CE  1 
ATOM   514  N NZ  . LYS A 1 65  ? -16.340 -20.227 69.702  1.00 45.94  ? 64  LYS H NZ  1 
ATOM   515  N N   . ASP A 1 66  ? -18.646 -14.168 71.495  1.00 34.62  ? 65  ASP H N   1 
ATOM   516  C CA  . ASP A 1 66  ? -20.093 -14.036 71.363  1.00 33.78  ? 65  ASP H CA  1 
ATOM   517  C C   . ASP A 1 66  ? -20.617 -12.829 72.140  1.00 40.56  ? 65  ASP H C   1 
ATOM   518  O O   . ASP A 1 66  ? -21.815 -12.587 72.143  1.00 47.77  ? 65  ASP H O   1 
ATOM   519  C CB  . ASP A 1 66  ? -20.812 -15.293 71.824  1.00 34.46  ? 65  ASP H CB  1 
ATOM   520  C CG  . ASP A 1 66  ? -20.389 -16.581 71.120  1.00 34.74  ? 65  ASP H CG  1 
ATOM   521  O OD1 . ASP A 1 66  ? -20.267 -16.543 69.876  1.00 36.90  ? 65  ASP H OD1 1 
ATOM   522  O OD2 . ASP A 1 66  ? -20.173 -17.591 71.806  1.00 34.89  ? 65  ASP H OD2 1 
ATOM   523  N N   . LYS A 1 67  ? -19.757 -12.101 72.834  1.00 33.84  ? 66  LYS H N   1 
ATOM   524  C CA  . LYS A 1 67  ? -20.196 -11.007 73.683  1.00 32.22  ? 66  LYS H CA  1 
ATOM   525  C C   . LYS A 1 67  ? -19.850 -9.660  73.064  1.00 33.26  ? 66  LYS H C   1 
ATOM   526  O O   . LYS A 1 67  ? -20.682 -8.746  73.092  1.00 37.10  ? 66  LYS H O   1 
ATOM   527  C CB  . LYS A 1 67  ? -19.550 -11.156 75.049  1.00 31.68  ? 66  LYS H CB  1 
ATOM   528  C CG  . LYS A 1 67  ? -19.826 -10.103 76.129  1.00 33.45  ? 66  LYS H CG  1 
ATOM   529  C CD  . LYS A 1 67  ? -21.309 -9.892  76.440  1.00 33.68  ? 66  LYS H CD  1 
ATOM   530  C CE  . LYS A 1 67  ? -21.926 -11.185 76.952  1.00 33.78  ? 66  LYS H CE  1 
ATOM   531  N NZ  . LYS A 1 67  ? -23.272 -10.953 77.490  1.00 34.67  ? 66  LYS H NZ  1 
ATOM   532  N N   . ALA A 1 68  ? -18.620 -9.547  72.563  1.00 31.24  ? 67  ALA H N   1 
ATOM   533  C CA  . ALA A 1 68  ? -18.078 -8.272  72.129  1.00 33.13  ? 67  ALA H CA  1 
ATOM   534  C C   . ALA A 1 68  ? -18.034 -8.233  70.605  1.00 33.81  ? 67  ALA H C   1 
ATOM   535  O O   . ALA A 1 68  ? -17.668 -9.222  69.977  1.00 33.91  ? 67  ALA H O   1 
ATOM   536  C CB  . ALA A 1 68  ? -16.668 -8.120  72.696  1.00 31.75  ? 67  ALA H CB  1 
ATOM   537  N N   . THR A 1 69  ? -18.269 -7.046  70.038  1.00 31.36  ? 68  THR H N   1 
ATOM   538  C CA  . THR A 1 69  ? -18.072 -6.796  68.614  1.00 32.15  ? 68  THR H CA  1 
ATOM   539  C C   . THR A 1 69  ? -17.326 -5.469  68.499  1.00 31.93  ? 68  THR H C   1 
ATOM   540  O O   . THR A 1 69  ? -17.849 -4.462  68.934  1.00 33.08  ? 68  THR H O   1 
ATOM   541  C CB  . THR A 1 69  ? -19.395 -6.721  67.841  1.00 34.10  ? 68  THR H CB  1 
ATOM   542  O OG1 . THR A 1 69  ? -20.142 -7.918  68.082  1.00 36.90  ? 68  THR H OG1 1 
ATOM   543  C CG2 . THR A 1 69  ? -19.184 -6.552  66.353  1.00 35.97  ? 68  THR H CG2 1 
ATOM   544  N N   . LEU A 1 70  ? -16.125 -5.516  67.934  1.00 33.37  ? 69  LEU H N   1 
ATOM   545  C CA  . LEU A 1 70  ? -15.266 -4.354  67.785  1.00 29.89  ? 69  LEU H CA  1 
ATOM   546  C C   . LEU A 1 70  ? -15.432 -3.781  66.391  1.00 32.53  ? 69  LEU H C   1 
ATOM   547  O O   . LEU A 1 70  ? -15.395 -4.526  65.423  1.00 34.39  ? 69  LEU H O   1 
ATOM   548  C CB  . LEU A 1 70  ? -13.817 -4.789  68.027  1.00 32.73  ? 69  LEU H CB  1 
ATOM   549  C CG  . LEU A 1 70  ? -13.569 -5.412  69.400  1.00 32.47  ? 69  LEU H CG  1 
ATOM   550  C CD1 . LEU A 1 70  ? -12.092 -5.734  69.495  1.00 37.88  ? 69  LEU H CD1 1 
ATOM   551  C CD2 . LEU A 1 70  ? -14.070 -4.648  70.612  1.00 33.67  ? 69  LEU H CD2 1 
ATOM   552  N N   . THR A 1 71  ? -15.559 -2.443  66.307  1.00 32.65  ? 70  THR H N   1 
ATOM   553  C CA  . THR A 1 71  ? -15.551 -1.739  65.042  1.00 33.11  ? 70  THR H CA  1 
ATOM   554  C C   . THR A 1 71  ? -14.677 -0.498  65.195  1.00 32.51  ? 70  THR H C   1 
ATOM   555  O O   . THR A 1 71  ? -14.221 -0.136  66.280  1.00 31.19  ? 70  THR H O   1 
ATOM   556  C CB  . THR A 1 71  ? -16.978 -1.388  64.587  1.00 36.66  ? 70  THR H CB  1 
ATOM   557  O OG1 . THR A 1 71  ? -17.540 -0.645  65.659  1.00 34.31  ? 70  THR H OG1 1 
ATOM   558  C CG2 . THR A 1 71  ? -17.824 -2.624  64.320  1.00 36.56  ? 70  THR H CG2 1 
ATOM   559  N N   . ALA A 1 72  ? -14.405 0.128   64.069  1.00 32.73  ? 71  ALA H N   1 
ATOM   560  C CA  . ALA A 1 72  ? -13.582 1.340   64.068  1.00 36.35  ? 71  ALA H CA  1 
ATOM   561  C C   . ALA A 1 72  ? -14.090 2.301   62.993  1.00 44.23  ? 71  ALA H C   1 
ATOM   562  O O   . ALA A 1 72  ? -14.443 1.849   61.899  1.00 42.05  ? 71  ALA H O   1 
ATOM   563  C CB  . ALA A 1 72  ? -12.165 0.954   63.831  1.00 36.50  ? 71  ALA H CB  1 
ATOM   564  N N   . ASP A 1 73  ? -14.166 3.609   63.319  1.00 36.15  ? 72  ASP H N   1 
ATOM   565  C CA  . ASP A 1 73  ? -14.508 4.611   62.326  1.00 40.15  ? 72  ASP H CA  1 
ATOM   566  C C   . ASP A 1 73  ? -13.262 5.441   62.024  1.00 39.69  ? 72  ASP H C   1 
ATOM   567  O O   . ASP A 1 73  ? -12.788 6.200   62.866  1.00 36.92  ? 72  ASP H O   1 
ATOM   568  C CB  . ASP A 1 73  ? -15.699 5.425   62.801  1.00 41.30  ? 72  ASP H CB  1 
ATOM   569  C CG  . ASP A 1 73  ? -16.169 6.559   61.888  1.00 48.30  ? 72  ASP H CG  1 
ATOM   570  O OD1 . ASP A 1 73  ? -15.382 7.039   61.065  1.00 49.40  ? 72  ASP H OD1 1 
ATOM   571  O OD2 . ASP A 1 73  ? -17.315 6.989   62.067  1.00 60.01  ? 72  ASP H OD2 1 
ATOM   572  N N   . LYS A 1 74  ? -12.726 5.300   60.815  1.00 37.12  ? 73  LYS H N   1 
ATOM   573  C CA  . LYS A 1 74  ? -11.478 5.978   60.465  1.00 39.26  ? 73  LYS H CA  1 
ATOM   574  C C   . LYS A 1 74  ? -11.671 7.499   60.408  1.00 44.47  ? 73  LYS H C   1 
ATOM   575  O O   . LYS A 1 74  ? -10.784 8.250   60.818  1.00 46.55  ? 73  LYS H O   1 
ATOM   576  C CB  . LYS A 1 74  ? -10.978 5.589   59.072  1.00 45.68  ? 73  LYS H CB  1 
ATOM   577  C CG  . LYS A 1 74  ? -10.724 4.126   58.871  1.00 45.83  ? 73  LYS H CG  1 
ATOM   578  C CD  . LYS A 1 74  ? -10.022 3.832   57.551  1.00 47.46  ? 73  LYS H CD  1 
ATOM   579  C CE  . LYS A 1 74  ? -9.779  2.387   57.416  1.00 50.98  ? 73  LYS H CE  1 
ATOM   580  N NZ  . LYS A 1 74  ? -9.043  2.067   56.185  1.00 51.78  ? 73  LYS H NZ  1 
ATOM   581  N N   . SER A 1 75  ? -12.824 7.967   59.927  1.00 40.78  ? 74  SER H N   1 
ATOM   582  C CA  . SER A 1 75  ? -13.017 9.407   59.788  1.00 39.78  ? 74  SER H CA  1 
ATOM   583  C C   . SER A 1 75  ? -13.018 10.098  61.154  1.00 45.65  ? 74  SER H C   1 
ATOM   584  O O   . SER A 1 75  ? -12.435 11.173  61.292  1.00 45.83  ? 74  SER H O   1 
ATOM   585  C CB  . SER A 1 75  ? -14.246 9.727   58.967  1.00 48.25  ? 74  SER H CB  1 
ATOM   586  O OG  . SER A 1 75  ? -15.429 9.170   59.529  1.00 62.64  ? 74  SER H OG  1 
ATOM   587  N N   . SER A 1 76  ? -13.597 9.458   62.184  1.00 41.05  ? 75  SER H N   1 
ATOM   588  C CA  . SER A 1 76  ? -13.698 10.074  63.503  1.00 39.67  ? 75  SER H CA  1 
ATOM   589  C C   . SER A 1 76  ? -12.618 9.580   64.477  1.00 33.83  ? 75  SER H C   1 
ATOM   590  O O   . SER A 1 76  ? -12.641 9.965   65.647  1.00 34.71  ? 75  SER H O   1 
ATOM   591  C CB  . SER A 1 76  ? -15.087 9.859   64.077  1.00 41.68  ? 75  SER H CB  1 
ATOM   592  O OG  . SER A 1 76  ? -15.293 8.482   64.353  1.00 40.28  ? 75  SER H OG  1 
ATOM   593  N N   . SER A 1 77  ? -11.684 8.733   64.021  1.00 34.88  ? 76  SER H N   1 
ATOM   594  C CA  . SER A 1 77  ? -10.607 8.234   64.862  1.00 33.29  ? 76  SER H CA  1 
ATOM   595  C C   . SER A 1 77  ? -11.130 7.577   66.133  1.00 31.07  ? 76  SER H C   1 
ATOM   596  O O   . SER A 1 77  ? -10.576 7.789   67.222  1.00 33.34  ? 76  SER H O   1 
ATOM   597  C CB  . SER A 1 77  ? -9.640  9.349   65.191  1.00 39.02  ? 76  SER H CB  1 
ATOM   598  O OG  . SER A 1 77  ? -9.081  9.813   63.975  1.00 40.83  ? 76  SER H OG  1 
ATOM   599  N N   . THR A 1 78  ? -12.240 6.833   65.997  1.00 30.64  ? 77  THR H N   1 
ATOM   600  C CA  . THR A 1 78  ? -12.931 6.277   67.152  1.00 33.85  ? 77  THR H CA  1 
ATOM   601  C C   . THR A 1 78  ? -13.079 4.764   66.970  1.00 30.97  ? 77  THR H C   1 
ATOM   602  O O   . THR A 1 78  ? -13.507 4.266   65.915  1.00 32.94  ? 77  THR H O   1 
ATOM   603  C CB  . THR A 1 78  ? -14.289 6.960   67.383  1.00 32.82  ? 77  THR H CB  1 
ATOM   604  O OG1 . THR A 1 78  ? -13.968 8.339   67.616  1.00 32.86  ? 77  THR H OG1 1 
ATOM   605  C CG2 . THR A 1 78  ? -14.943 6.453   68.653  1.00 35.15  ? 77  THR H CG2 1 
ATOM   606  N N   . ALA A 1 79  ? -12.728 4.055   68.038  1.00 31.73  ? 78  ALA H N   1 
ATOM   607  C CA  . ALA A 1 79  ? -12.936 2.613   68.131  1.00 32.36  ? 78  ALA H CA  1 
ATOM   608  C C   . ALA A 1 79  ? -14.184 2.373   68.967  1.00 30.14  ? 78  ALA H C   1 
ATOM   609  O O   . ALA A 1 79  ? -14.418 3.039   69.971  1.00 31.92  ? 78  ALA H O   1 
ATOM   610  C CB  . ALA A 1 79  ? -11.724 1.942   68.724  1.00 34.51  ? 78  ALA H CB  1 
ATOM   611  N N   . TYR A 1 80  ? -14.926 1.317   68.639  1.00 30.15  ? 79  TYR H N   1 
ATOM   612  C CA  . TYR A 1 80  ? -16.149 1.019   69.357  1.00 29.46  ? 79  TYR H CA  1 
ATOM   613  C C   . TYR A 1 80  ? -16.153 -0.427  69.804  1.00 31.40  ? 79  TYR H C   1 
ATOM   614  O O   . TYR A 1 80  ? -15.620 -1.292  69.111  1.00 31.40  ? 79  TYR H O   1 
ATOM   615  C CB  . TYR A 1 80  ? -17.413 1.243   68.514  1.00 32.14  ? 79  TYR H CB  1 
ATOM   616  C CG  . TYR A 1 80  ? -17.589 2.676   68.054  1.00 34.39  ? 79  TYR H CG  1 
ATOM   617  C CD1 . TYR A 1 80  ? -18.222 3.588   68.868  1.00 36.06  ? 79  TYR H CD1 1 
ATOM   618  C CD2 . TYR A 1 80  ? -17.085 3.109   66.831  1.00 39.42  ? 79  TYR H CD2 1 
ATOM   619  C CE1 . TYR A 1 80  ? -18.370 4.905   68.469  1.00 36.82  ? 79  TYR H CE1 1 
ATOM   620  C CE2 . TYR A 1 80  ? -17.261 4.417   66.408  1.00 39.00  ? 79  TYR H CE2 1 
ATOM   621  C CZ  . TYR A 1 80  ? -17.903 5.305   67.233  1.00 38.03  ? 79  TYR H CZ  1 
ATOM   622  O OH  . TYR A 1 80  ? -18.064 6.626   66.902  1.00 41.76  ? 79  TYR H OH  1 
ATOM   623  N N   . MET A 1 81  ? -16.757 -0.662  70.962  1.00 30.58  ? 80  MET H N   1 
ATOM   624  C CA  . MET A 1 81  ? -17.040 -2.025  71.388  1.00 30.70  ? 80  MET H CA  1 
ATOM   625  C C   . MET A 1 81  ? -18.522 -2.124  71.724  1.00 31.28  ? 80  MET H C   1 
ATOM   626  O O   . MET A 1 81  ? -18.990 -1.497  72.658  1.00 32.93  ? 80  MET H O   1 
ATOM   627  C CB  . MET A 1 81  ? -16.218 -2.435  72.604  1.00 32.26  ? 80  MET H CB  1 
ATOM   628  C CG  . MET A 1 81  ? -16.528 -3.856  73.115  1.00 32.87  ? 80  MET H CG  1 
ATOM   629  S SD  . MET A 1 81  ? -15.349 -4.467  74.331  1.00 34.02  ? 80  MET H SD  1 
ATOM   630  C CE  . MET A 1 81  ? -15.631 -3.419  75.736  1.00 34.68  ? 80  MET H CE  1 
ATOM   631  N N   . GLN A 1 82  ? -19.203 -3.023  71.014  1.00 32.47  ? 81  GLN H N   1 
ATOM   632  C CA  . GLN A 1 82  ? -20.580 -3.376  71.340  1.00 33.81  ? 81  GLN H CA  1 
ATOM   633  C C   . GLN A 1 82  ? -20.573 -4.619  72.211  1.00 33.85  ? 81  GLN H C   1 
ATOM   634  O O   . GLN A 1 82  ? -19.833 -5.564  71.913  1.00 34.47  ? 81  GLN H O   1 
ATOM   635  C CB  . GLN A 1 82  ? -21.366 -3.620  70.057  1.00 35.02  ? 81  GLN H CB  1 
ATOM   636  C CG  . GLN A 1 82  ? -22.828 -3.951  70.365  1.00 40.82  ? 81  GLN H CG  1 
ATOM   637  C CD  . GLN A 1 82  ? -23.694 -3.965  69.134  1.00 53.81  ? 81  GLN H CD  1 
ATOM   638  O OE1 . GLN A 1 82  ? -23.335 -3.421  68.087  1.00 65.84  ? 81  GLN H OE1 1 
ATOM   639  N NE2 . GLN A 1 82  ? -24.865 -4.568  69.270  1.00 66.72  ? 81  GLN H NE2 1 
ATOM   640  N N   . LEU A 1 83  ? -21.362 -4.584  73.279  1.00 32.77  ? 82  LEU H N   1 
ATOM   641  C CA  . LEU A 1 83  ? -21.531 -5.699  74.185  1.00 33.54  ? 82  LEU H CA  1 
ATOM   642  C C   . LEU A 1 83  ? -22.997 -6.102  74.128  1.00 36.35  ? 82  LEU H C   1 
ATOM   643  O O   . LEU A 1 83  ? -23.833 -5.253  74.364  1.00 34.59  ? 82  LEU H O   1 
ATOM   644  C CB  . LEU A 1 83  ? -21.104 -5.313  75.591  1.00 32.12  ? 82  LEU H CB  1 
ATOM   645  C CG  . LEU A 1 83  ? -19.629 -4.966  75.812  1.00 33.17  ? 82  LEU H CG  1 
ATOM   646  C CD1 . LEU A 1 83  ? -19.464 -4.417  77.206  1.00 34.65  ? 82  LEU H CD1 1 
ATOM   647  C CD2 . LEU A 1 83  ? -18.755 -6.189  75.683  1.00 31.14  ? 82  LEU H CD2 1 
ATOM   648  N N   . SER A 1 84  A -23.264 -7.376  73.770  1.00 33.35  ? 82  SER H N   1 
ATOM   649  C CA  . SER A 1 84  A -24.570 -7.889  73.396  1.00 36.51  ? 82  SER H CA  1 
ATOM   650  C C   . SER A 1 84  A -25.139 -8.767  74.498  1.00 34.92  ? 82  SER H C   1 
ATOM   651  O O   . SER A 1 84  A -24.401 -9.310  75.317  1.00 35.54  ? 82  SER H O   1 
ATOM   652  C CB  . SER A 1 84  A -24.474 -8.699  72.141  1.00 38.32  ? 82  SER H CB  1 
ATOM   653  O OG  . SER A 1 84  A -24.254 -7.807  71.078  1.00 49.27  ? 82  SER H OG  1 
ATOM   654  N N   . SER A 1 85  B -26.478 -8.873  74.518  1.00 35.27  ? 82  SER H N   1 
ATOM   655  C CA  . SER A 1 85  B -27.177 -9.817  75.393  1.00 35.27  ? 82  SER H CA  1 
ATOM   656  C C   . SER A 1 85  B -26.687 -9.747  76.837  1.00 33.04  ? 82  SER H C   1 
ATOM   657  O O   . SER A 1 85  B -26.195 -10.704 77.444  1.00 33.66  ? 82  SER H O   1 
ATOM   658  C CB  . SER A 1 85  B -27.111 -11.225 74.823  1.00 44.71  ? 82  SER H CB  1 
ATOM   659  O OG  . SER A 1 85  B -28.043 -12.058 75.511  1.00 45.25  ? 82  SER H OG  1 
ATOM   660  N N   . LEU A 1 86  C -26.812 -8.556  77.434  1.00 34.26  ? 82  LEU H N   1 
ATOM   661  C CA  . LEU A 1 86  C -26.113 -8.236  78.666  1.00 33.16  ? 82  LEU H CA  1 
ATOM   662  C C   . LEU A 1 86  C -26.627 -9.009  79.872  1.00 35.82  ? 82  LEU H C   1 
ATOM   663  O O   . LEU A 1 86  C -27.830 -9.265  79.984  1.00 39.35  ? 82  LEU H O   1 
ATOM   664  C CB  . LEU A 1 86  C -26.145 -6.723  78.896  1.00 32.20  ? 82  LEU H CB  1 
ATOM   665  C CG  . LEU A 1 86  C -25.295 -5.906  77.927  1.00 35.30  ? 82  LEU H CG  1 
ATOM   666  C CD1 . LEU A 1 86  C -25.750 -4.422  78.055  1.00 35.02  ? 82  LEU H CD1 1 
ATOM   667  C CD2 . LEU A 1 86  C -23.790 -6.055  78.194  1.00 37.07  ? 82  LEU H CD2 1 
ATOM   668  N N   . THR A 1 87  ? -25.697 -9.355  80.764  1.00 32.86  ? 83  THR H N   1 
ATOM   669  C CA  . THR A 1 87  ? -25.999 -9.985  82.044  1.00 35.03  ? 83  THR H CA  1 
ATOM   670  C C   . THR A 1 87  ? -25.261 -9.261  83.140  1.00 38.95  ? 83  THR H C   1 
ATOM   671  O O   . THR A 1 87  ? -24.368 -8.427  82.879  1.00 37.05  ? 83  THR H O   1 
ATOM   672  C CB  . THR A 1 87  ? -25.629 -11.480 82.089  1.00 37.19  ? 83  THR H CB  1 
ATOM   673  O OG1 . THR A 1 87  ? -24.213 -11.591 82.225  1.00 38.05  ? 83  THR H OG1 1 
ATOM   674  C CG2 . THR A 1 87  ? -26.117 -12.201 80.849  1.00 41.72  ? 83  THR H CG2 1 
ATOM   675  N N   . TYR A 1 88  ? -25.580 -9.676  84.391  1.00 36.04  ? 84  TYR H N   1 
ATOM   676  C CA  . TYR A 1 88  ? -24.946 -9.090  85.553  1.00 39.08  ? 84  TYR H CA  1 
ATOM   677  C C   . TYR A 1 88  ? -23.438 -9.353  85.494  1.00 38.24  ? 84  TYR H C   1 
ATOM   678  O O   . TYR A 1 88  ? -22.672 -8.568  86.025  1.00 38.15  ? 84  TYR H O   1 
ATOM   679  C CB  . TYR A 1 88  ? -25.574 -9.594  86.855  1.00 44.54  ? 84  TYR H CB  1 
ATOM   680  C CG  . TYR A 1 88  ? -25.227 -11.055 87.090  1.00 54.34  ? 84  TYR H CG  1 
ATOM   681  C CD1 . TYR A 1 88  ? -26.016 -12.068 86.537  1.00 58.06  ? 84  TYR H CD1 1 
ATOM   682  C CD2 . TYR A 1 88  ? -24.109 -11.435 87.841  1.00 61.69  ? 84  TYR H CD2 1 
ATOM   683  C CE1 . TYR A 1 88  ? -25.695 -13.406 86.705  1.00 59.41  ? 84  TYR H CE1 1 
ATOM   684  C CE2 . TYR A 1 88  ? -23.780 -12.777 88.016  1.00 61.07  ? 84  TYR H CE2 1 
ATOM   685  C CZ  . TYR A 1 88  ? -24.579 -13.760 87.447  1.00 62.05  ? 84  TYR H CZ  1 
ATOM   686  O OH  . TYR A 1 88  ? -24.281 -15.088 87.585  1.00 65.24  ? 84  TYR H OH  1 
ATOM   687  N N   . GLU A 1 89  ? -22.992 -10.427 84.836  1.00 35.29  ? 85  GLU H N   1 
ATOM   688  C CA  . GLU A 1 89  ? -21.563 -10.730 84.748  1.00 36.76  ? 85  GLU H CA  1 
ATOM   689  C C   . GLU A 1 89  ? -20.800 -9.748  83.858  1.00 34.83  ? 85  GLU H C   1 
ATOM   690  O O   . GLU A 1 89  ? -19.546 -9.718  83.863  1.00 35.68  ? 85  GLU H O   1 
ATOM   691  C CB  . GLU A 1 89  ? -21.347 -12.156 84.235  1.00 44.48  ? 85  GLU H CB  1 
ATOM   692  C CG  . GLU A 1 89  ? -21.957 -13.212 85.153  1.00 57.54  ? 85  GLU H CG  1 
ATOM   693  C CD  . GLU A 1 89  ? -21.543 -14.624 84.737  1.00 70.90  ? 85  GLU H CD  1 
ATOM   694  O OE1 . GLU A 1 89  ? -22.067 -15.155 83.719  1.00 67.71  ? 85  GLU H OE1 1 
ATOM   695  O OE2 . GLU A 1 89  ? -20.639 -15.165 85.418  1.00 72.74  ? 85  GLU H OE2 1 
ATOM   696  N N   . ASP A 1 90  ? -21.544 -8.955  83.069  1.00 35.71  ? 86  ASP H N   1 
ATOM   697  C CA  . ASP A 1 90  ? -20.962 -7.925  82.221  1.00 32.79  ? 86  ASP H CA  1 
ATOM   698  C C   . ASP A 1 90  ? -20.752 -6.592  82.939  1.00 35.82  ? 86  ASP H C   1 
ATOM   699  O O   . ASP A 1 90  ? -20.115 -5.729  82.360  1.00 35.33  ? 86  ASP H O   1 
ATOM   700  C CB  . ASP A 1 90  ? -21.754 -7.723  80.938  1.00 35.02  ? 86  ASP H CB  1 
ATOM   701  C CG  . ASP A 1 90  ? -21.937 -8.985  80.119  1.00 39.25  ? 86  ASP H CG  1 
ATOM   702  O OD1 . ASP A 1 90  ? -20.910 -9.687  79.921  1.00 34.15  ? 86  ASP H OD1 1 
ATOM   703  O OD2 . ASP A 1 90  ? -23.079 -9.229  79.692  1.00 34.17  ? 86  ASP H OD2 1 
ATOM   704  N N   . SER A 1 91  ? -21.231 -6.430  84.176  1.00 34.32  ? 87  SER H N   1 
ATOM   705  C CA  . SER A 1 91  ? -20.979 -5.216  84.941  1.00 34.50  ? 87  SER H CA  1 
ATOM   706  C C   . SER A 1 91  ? -19.497 -5.171  85.303  1.00 35.89  ? 87  SER H C   1 
ATOM   707  O O   . SER A 1 91  ? -18.986 -6.098  85.936  1.00 35.42  ? 87  SER H O   1 
ATOM   708  C CB  . SER A 1 91  ? -21.818 -5.145  86.199  1.00 34.68  ? 87  SER H CB  1 
ATOM   709  O OG  . SER A 1 91  ? -23.209 -5.214  85.906  1.00 32.74  ? 87  SER H OG  1 
ATOM   710  N N   . ALA A 1 92  ? -18.810 -4.099  84.890  1.00 34.29  ? 88  ALA H N   1 
ATOM   711  C CA  . ALA A 1 92  ? -17.356 -4.038  84.921  1.00 33.05  ? 88  ALA H CA  1 
ATOM   712  C C   . ALA A 1 92  ? -16.900 -2.661  84.456  1.00 32.84  ? 88  ALA H C   1 
ATOM   713  O O   . ALA A 1 92  ? -17.689 -1.908  83.911  1.00 32.84  ? 88  ALA H O   1 
ATOM   714  C CB  . ALA A 1 92  ? -16.732 -5.106  84.040  1.00 32.15  ? 88  ALA H CB  1 
ATOM   715  N N   . VAL A 1 93  ? -15.595 -2.455  84.559  1.00 30.12  ? 89  VAL H N   1 
ATOM   716  C CA  . VAL A 1 93  ? -14.905 -1.347  83.928  1.00 31.98  ? 89  VAL H CA  1 
ATOM   717  C C   . VAL A 1 93  ? -14.249 -1.911  82.678  1.00 31.83  ? 89  VAL H C   1 
ATOM   718  O O   . VAL A 1 93  ? -13.603 -2.959  82.728  1.00 32.37  ? 89  VAL H O   1 
ATOM   719  C CB  . VAL A 1 93  ? -13.881 -0.626  84.826  1.00 36.03  ? 89  VAL H CB  1 
ATOM   720  C CG1 . VAL A 1 93  ? -13.084 0.417   84.048  1.00 38.28  ? 89  VAL H CG1 1 
ATOM   721  C CG2 . VAL A 1 93  ? -14.525 0.012   86.042  1.00 36.23  ? 89  VAL H CG2 1 
ATOM   722  N N   . TYR A 1 94  ? -14.434 -1.210  81.554  1.00 29.90  ? 90  TYR H N   1 
ATOM   723  C CA  . TYR A 1 94  ? -13.887 -1.612  80.288  1.00 29.86  ? 90  TYR H CA  1 
ATOM   724  C C   . TYR A 1 94  ? -12.902 -0.538  79.823  1.00 32.70  ? 90  TYR H C   1 
ATOM   725  O O   . TYR A 1 94  ? -13.225 0.644   79.863  1.00 32.69  ? 90  TYR H O   1 
ATOM   726  C CB  . TYR A 1 94  ? -14.947 -1.820  79.217  1.00 30.99  ? 90  TYR H CB  1 
ATOM   727  C CG  . TYR A 1 94  ? -15.876 -2.973  79.560  1.00 30.05  ? 90  TYR H CG  1 
ATOM   728  C CD1 . TYR A 1 94  ? -15.550 -4.265  79.159  1.00 31.62  ? 90  TYR H CD1 1 
ATOM   729  C CD2 . TYR A 1 94  ? -17.017 -2.785  80.344  1.00 31.53  ? 90  TYR H CD2 1 
ATOM   730  C CE1 . TYR A 1 94  ? -16.380 -5.323  79.475  1.00 30.94  ? 90  TYR H CE1 1 
ATOM   731  C CE2 . TYR A 1 94  ? -17.880 -3.835  80.625  1.00 29.79  ? 90  TYR H CE2 1 
ATOM   732  C CZ  . TYR A 1 94  ? -17.555 -5.111  80.194  1.00 30.95  ? 90  TYR H CZ  1 
ATOM   733  O OH  . TYR A 1 94  ? -18.318 -6.220  80.529  1.00 32.64  ? 90  TYR H OH  1 
ATOM   734  N N   . PHE A 1 95  ? -11.707 -0.981  79.444  1.00 31.84  ? 91  PHE H N   1 
ATOM   735  C CA  . PHE A 1 95  ? -10.656 -0.098  78.941  1.00 30.27  ? 91  PHE H CA  1 
ATOM   736  C C   . PHE A 1 95  ? -10.425 -0.366  77.448  1.00 32.21  ? 91  PHE H C   1 
ATOM   737  O O   . PHE A 1 95  ? -10.437 -1.509  76.976  1.00 31.72  ? 91  PHE H O   1 
ATOM   738  C CB  . PHE A 1 95  ? -9.329  -0.339  79.652  1.00 30.74  ? 91  PHE H CB  1 
ATOM   739  C CG  . PHE A 1 95  ? -9.322  -0.039  81.128  1.00 29.76  ? 91  PHE H CG  1 
ATOM   740  C CD1 . PHE A 1 95  ? -9.154  1.259   81.579  1.00 31.87  ? 91  PHE H CD1 1 
ATOM   741  C CD2 . PHE A 1 95  ? -9.463  -1.066  82.033  1.00 36.08  ? 91  PHE H CD2 1 
ATOM   742  C CE1 . PHE A 1 95  ? -9.156  1.536   82.937  1.00 34.87  ? 91  PHE H CE1 1 
ATOM   743  C CE2 . PHE A 1 95  ? -9.432  -0.788  83.387  1.00 36.33  ? 91  PHE H CE2 1 
ATOM   744  C CZ  . PHE A 1 95  ? -9.315  0.508   83.817  1.00 32.06  ? 91  PHE H CZ  1 
ATOM   745  N N   . CYS A 1 96  ? -10.083 0.699   76.708  1.00 30.40  ? 92  CYS H N   1 
ATOM   746  C CA  . CYS A 1 96  ? -9.382  0.496   75.464  1.00 29.36  ? 92  CYS H CA  1 
ATOM   747  C C   . CYS A 1 96  ? -7.893  0.785   75.728  1.00 30.55  ? 92  CYS H C   1 
ATOM   748  O O   . CYS A 1 96  ? -7.522  1.526   76.646  1.00 32.33  ? 92  CYS H O   1 
ATOM   749  C CB  . CYS A 1 96  ? -9.943  1.386   74.362  1.00 34.11  ? 92  CYS H CB  1 
ATOM   750  S SG  . CYS A 1 96  ? -9.870  3.156   74.736  1.00 33.22  ? 92  CYS H SG  1 
ATOM   751  N N   . ALA A 1 97  ? -7.054  0.174   74.904  1.00 31.04  ? 93  ALA H N   1 
ATOM   752  C CA  . ALA A 1 97  ? -5.612  0.350   75.016  1.00 31.43  ? 93  ALA H CA  1 
ATOM   753  C C   . ALA A 1 97  ? -4.984  0.163   73.648  1.00 30.71  ? 93  ALA H C   1 
ATOM   754  O O   . ALA A 1 97  ? -5.266  -0.778  72.943  1.00 33.67  ? 93  ALA H O   1 
ATOM   755  C CB  . ALA A 1 97  ? -5.039  -0.641  76.005  1.00 33.25  ? 93  ALA H CB  1 
ATOM   756  N N   . ARG A 1 98  ? -4.032  1.025   73.329  1.00 30.90  ? 94  ARG H N   1 
ATOM   757  C CA  . ARG A 1 98  ? -3.340  0.982   72.059  1.00 31.84  ? 94  ARG H CA  1 
ATOM   758  C C   . ARG A 1 98  ? -2.119  0.050   72.154  1.00 32.00  ? 94  ARG H C   1 
ATOM   759  O O   . ARG A 1 98  ? -1.410  0.064   73.141  1.00 31.82  ? 94  ARG H O   1 
ATOM   760  C CB  . ARG A 1 98  ? -2.831  2.408   71.797  1.00 33.78  ? 94  ARG H CB  1 
ATOM   761  C CG  . ARG A 1 98  ? -2.311  2.546   70.397  1.00 39.43  ? 94  ARG H CG  1 
ATOM   762  C CD  . ARG A 1 98  ? -1.777  3.974   70.224  1.00 41.23  ? 94  ARG H CD  1 
ATOM   763  N NE  . ARG A 1 98  ? -0.433  4.213   70.757  1.00 37.18  ? 94  ARG H NE  1 
ATOM   764  C CZ  . ARG A 1 98  ? 0.408   5.050   70.178  1.00 37.13  ? 94  ARG H CZ  1 
ATOM   765  N NH1 . ARG A 1 98  ? 1.688   5.024   70.493  1.00 36.93  ? 94  ARG H NH1 1 
ATOM   766  N NH2 . ARG A 1 98  ? -0.020  5.879   69.221  1.00 36.21  ? 94  ARG H NH2 1 
ATOM   767  N N   . LEU A 1 99  ? -1.870  -0.690  71.088  1.00 31.60  ? 95  LEU H N   1 
ATOM   768  C CA  . LEU A 1 99  ? -0.677  -1.532  70.992  1.00 32.81  ? 95  LEU H CA  1 
ATOM   769  C C   . LEU A 1 99  ? 0.418   -0.735  70.292  1.00 34.19  ? 95  LEU H C   1 
ATOM   770  O O   . LEU A 1 99  ? 0.188   -0.206  69.197  1.00 36.89  ? 95  LEU H O   1 
ATOM   771  C CB  . LEU A 1 99  ? -0.960  -2.739  70.120  1.00 33.12  ? 95  LEU H CB  1 
ATOM   772  C CG  . LEU A 1 99  ? 0.188   -3.751  69.966  1.00 34.97  ? 95  LEU H CG  1 
ATOM   773  C CD1 . LEU A 1 99  ? 0.436   -4.468  71.275  1.00 34.19  ? 95  LEU H CD1 1 
ATOM   774  C CD2 . LEU A 1 99  ? -0.134  -4.761  68.883  1.00 38.57  ? 95  LEU H CD2 1 
ATOM   775  N N   . SER A 1 100 ? 1.632   -0.800  70.830  1.00 34.92  ? 96  SER H N   1 
ATOM   776  C CA  . SER A 1 100 ? 2.781   -0.318  70.096  1.00 32.88  ? 96  SER H CA  1 
ATOM   777  C C   . SER A 1 100 ? 3.775   -1.457  69.928  1.00 38.06  ? 96  SER H C   1 
ATOM   778  O O   . SER A 1 100 ? 3.793   -2.353  70.742  1.00 37.72  ? 96  SER H O   1 
ATOM   779  C CB  . SER A 1 100 ? 3.417   0.832   70.803  1.00 42.53  ? 96  SER H CB  1 
ATOM   780  O OG  . SER A 1 100 ? 2.702   2.012   70.457  1.00 50.20  ? 96  SER H OG  1 
ATOM   781  N N   . TYR A 1 101 ? 4.586   -1.371  68.875  1.00 36.72  ? 97  TYR H N   1 
ATOM   782  C CA  . TYR A 1 101 ? 5.657   -2.320  68.601  1.00 36.32  ? 97  TYR H CA  1 
ATOM   783  C C   . TYR A 1 101 ? 6.946   -1.534  68.320  1.00 40.73  ? 97  TYR H C   1 
ATOM   784  O O   . TYR A 1 101 ? 6.922   -0.522  67.610  1.00 40.08  ? 97  TYR H O   1 
ATOM   785  C CB  . TYR A 1 101 ? 5.213   -3.161  67.409  1.00 35.16  ? 97  TYR H CB  1 
ATOM   786  C CG  . TYR A 1 101 ? 6.285   -4.102  66.869  1.00 40.11  ? 97  TYR H CG  1 
ATOM   787  C CD1 . TYR A 1 101 ? 6.556   -5.307  67.519  1.00 41.10  ? 97  TYR H CD1 1 
ATOM   788  C CD2 . TYR A 1 101 ? 6.927   -3.840  65.660  1.00 43.52  ? 97  TYR H CD2 1 
ATOM   789  C CE1 . TYR A 1 101 ? 7.515   -6.181  67.041  1.00 42.80  ? 97  TYR H CE1 1 
ATOM   790  C CE2 . TYR A 1 101 ? 7.852   -4.735  65.144  1.00 42.77  ? 97  TYR H CE2 1 
ATOM   791  C CZ  . TYR A 1 101 ? 8.171   -5.874  65.861  1.00 48.05  ? 97  TYR H CZ  1 
ATOM   792  O OH  . TYR A 1 101 ? 9.073   -6.775  65.401  1.00 45.77  ? 97  TYR H OH  1 
ATOM   793  N N   . TYR A 1 102 ? 8.057   -2.052  68.832  1.00 37.26  ? 98  TYR H N   1 
ATOM   794  C CA  . TYR A 1 102 ? 9.373   -1.448  68.625  1.00 38.83  ? 98  TYR H CA  1 
ATOM   795  C C   . TYR A 1 102 ? 10.215  -2.421  67.818  1.00 39.83  ? 98  TYR H C   1 
ATOM   796  O O   . TYR A 1 102 ? 10.584  -3.481  68.321  1.00 39.55  ? 98  TYR H O   1 
ATOM   797  C CB  . TYR A 1 102 ? 10.051  -1.194  69.959  1.00 40.41  ? 98  TYR H CB  1 
ATOM   798  C CG  . TYR A 1 102 ? 9.432   -0.169  70.899  1.00 45.55  ? 98  TYR H CG  1 
ATOM   799  C CD1 . TYR A 1 102 ? 8.557   0.815   70.458  1.00 50.24  ? 98  TYR H CD1 1 
ATOM   800  C CD2 . TYR A 1 102 ? 9.756   -0.191  72.258  1.00 50.45  ? 98  TYR H CD2 1 
ATOM   801  C CE1 . TYR A 1 102 ? 8.028   1.751   71.333  1.00 49.38  ? 98  TYR H CE1 1 
ATOM   802  C CE2 . TYR A 1 102 ? 9.248   0.749   73.138  1.00 46.93  ? 98  TYR H CE2 1 
ATOM   803  C CZ  . TYR A 1 102 ? 8.360   1.706   72.672  1.00 48.73  ? 98  TYR H CZ  1 
ATOM   804  O OH  . TYR A 1 102 ? 7.778   2.635   73.484  1.00 48.05  ? 98  TYR H OH  1 
ATOM   805  N N   . ASP A 1 103 ? 10.406  -2.092  66.535  1.00 43.76  ? 99  ASP H N   1 
ATOM   806  C CA  . ASP A 1 103 ? 11.123  -2.944  65.593  1.00 47.23  ? 99  ASP H CA  1 
ATOM   807  C C   . ASP A 1 103 ? 12.546  -3.260  66.067  1.00 48.09  ? 99  ASP H C   1 
ATOM   808  O O   . ASP A 1 103 ? 13.067  -4.333  65.749  1.00 53.30  ? 99  ASP H O   1 
ATOM   809  C CB  . ASP A 1 103 ? 11.089  -2.372  64.182  1.00 52.54  ? 99  ASP H CB  1 
ATOM   810  C CG  . ASP A 1 103 ? 11.724  -1.005  63.961  1.00 58.94  ? 99  ASP H CG  1 
ATOM   811  O OD1 . ASP A 1 103 ? 12.219  -0.396  64.953  1.00 58.68  ? 99  ASP H OD1 1 
ATOM   812  O OD2 . ASP A 1 103 ? 11.693  -0.547  62.792  1.00 70.25  ? 99  ASP H OD2 1 
ATOM   813  N N   . TYR A 1 104 ? 13.130  -2.364  66.869  1.00 46.19  ? 100 TYR H N   1 
ATOM   814  C CA  . TYR A 1 104 ? 14.515  -2.450  67.307  1.00 48.87  ? 100 TYR H CA  1 
ATOM   815  C C   . TYR A 1 104 ? 14.714  -3.517  68.380  1.00 52.62  ? 100 TYR H C   1 
ATOM   816  O O   . TYR A 1 104 ? 15.812  -4.034  68.478  1.00 49.34  ? 100 TYR H O   1 
ATOM   817  C CB  . TYR A 1 104 ? 15.069  -1.092  67.776  1.00 53.79  ? 100 TYR H CB  1 
ATOM   818  C CG  . TYR A 1 104 ? 14.139  -0.137  68.529  1.00 53.52  ? 100 TYR H CG  1 
ATOM   819  C CD1 . TYR A 1 104 ? 13.339  0.753   67.820  1.00 60.79  ? 100 TYR H CD1 1 
ATOM   820  C CD2 . TYR A 1 104 ? 14.064  -0.097  69.922  1.00 55.93  ? 100 TYR H CD2 1 
ATOM   821  C CE1 . TYR A 1 104 ? 12.473  1.628   68.455  1.00 56.36  ? 100 TYR H CE1 1 
ATOM   822  C CE2 . TYR A 1 104 ? 13.218  0.798   70.573  1.00 54.06  ? 100 TYR H CE2 1 
ATOM   823  C CZ  . TYR A 1 104 ? 12.430  1.677   69.837  1.00 55.47  ? 100 TYR H CZ  1 
ATOM   824  O OH  . TYR A 1 104 ? 11.557  2.589   70.405  1.00 57.36  ? 100 TYR H OH  1 
ATOM   825  N N   . ASP A 1 105 A 13.689  -3.902  69.161  1.00 46.80  ? 100 ASP H N   1 
ATOM   826  C CA  . ASP A 1 105 A 13.851  -4.977  70.136  1.00 44.91  ? 100 ASP H CA  1 
ATOM   827  C C   . ASP A 1 105 A 12.730  -6.023  70.064  1.00 43.91  ? 100 ASP H C   1 
ATOM   828  O O   . ASP A 1 105 A 12.769  -7.009  70.795  1.00 51.18  ? 100 ASP H O   1 
ATOM   829  C CB  . ASP A 1 105 A 14.083  -4.389  71.520  1.00 50.11  ? 100 ASP H CB  1 
ATOM   830  C CG  . ASP A 1 105 A 12.895  -3.651  72.110  1.00 48.11  ? 100 ASP H CG  1 
ATOM   831  O OD1 . ASP A 1 105 A 11.811  -3.808  71.520  1.00 43.53  ? 100 ASP H OD1 1 
ATOM   832  O OD2 . ASP A 1 105 A 13.076  -2.922  73.121  1.00 49.17  ? 100 ASP H OD2 1 
ATOM   833  N N   . GLY A 1 106 B 11.768  -5.867  69.141  1.00 40.19  ? 100 GLY H N   1 
ATOM   834  C CA  . GLY A 1 106 B 10.687  -6.828  68.977  1.00 40.45  ? 100 GLY H CA  1 
ATOM   835  C C   . GLY A 1 106 B 9.629   -6.700  70.090  1.00 36.64  ? 100 GLY H C   1 
ATOM   836  O O   . GLY A 1 106 B 8.712   -7.523  70.162  1.00 40.06  ? 100 GLY H O   1 
ATOM   837  N N   . GLY A 1 107 C 9.746   -5.676  70.945  1.00 38.68  ? 100 GLY H N   1 
ATOM   838  C CA  . GLY A 1 107 C 8.818   -5.501  72.069  1.00 42.55  ? 100 GLY H CA  1 
ATOM   839  C C   . GLY A 1 107 C 7.469   -4.918  71.624  1.00 38.71  ? 100 GLY H C   1 
ATOM   840  O O   . GLY A 1 107 C 7.390   -4.103  70.695  1.00 37.05  ? 100 GLY H O   1 
ATOM   841  N N   . TYR A 1 108 D 6.380   -5.392  72.235  1.00 36.60  ? 100 TYR H N   1 
ATOM   842  C CA  . TYR A 1 108 D 5.056   -4.815  71.967  1.00 35.77  ? 100 TYR H CA  1 
ATOM   843  C C   . TYR A 1 108 D 4.259   -4.886  73.269  1.00 36.51  ? 100 TYR H C   1 
ATOM   844  O O   . TYR A 1 108 D 4.362   -5.848  74.031  1.00 36.03  ? 100 TYR H O   1 
ATOM   845  C CB  . TYR A 1 108 D 4.344   -5.505  70.799  1.00 35.18  ? 100 TYR H CB  1 
ATOM   846  C CG  . TYR A 1 108 D 4.240   -7.006  70.974  1.00 35.66  ? 100 TYR H CG  1 
ATOM   847  C CD1 . TYR A 1 108 D 5.277   -7.824  70.531  1.00 34.73  ? 100 TYR H CD1 1 
ATOM   848  C CD2 . TYR A 1 108 D 3.174   -7.612  71.635  1.00 35.12  ? 100 TYR H CD2 1 
ATOM   849  C CE1 . TYR A 1 108 D 5.257   -9.192  70.708  1.00 34.82  ? 100 TYR H CE1 1 
ATOM   850  C CE2 . TYR A 1 108 D 3.141   -8.980  71.802  1.00 34.34  ? 100 TYR H CE2 1 
ATOM   851  C CZ  . TYR A 1 108 D 4.199   -9.773  71.372  1.00 36.40  ? 100 TYR H CZ  1 
ATOM   852  O OH  . TYR A 1 108 D 4.196   -11.129 71.542  1.00 34.47  ? 100 TYR H OH  1 
ATOM   853  N N   . PHE A 1 109 E 3.403   -3.897  73.469  1.00 34.49  ? 100 PHE H N   1 
ATOM   854  C CA  . PHE A 1 109 E 2.674   -3.761  74.713  1.00 33.57  ? 100 PHE H CA  1 
ATOM   855  C C   . PHE A 1 109 E 1.673   -2.624  74.530  1.00 32.76  ? 100 PHE H C   1 
ATOM   856  O O   . PHE A 1 109 E 1.780   -1.856  73.571  1.00 32.93  ? 100 PHE H O   1 
ATOM   857  C CB  . PHE A 1 109 E 3.590   -3.503  75.915  1.00 34.49  ? 100 PHE H CB  1 
ATOM   858  C CG  . PHE A 1 109 E 4.573   -2.377  75.660  1.00 33.85  ? 100 PHE H CG  1 
ATOM   859  C CD1 . PHE A 1 109 E 4.243   -1.057  75.951  1.00 33.34  ? 100 PHE H CD1 1 
ATOM   860  C CD2 . PHE A 1 109 E 5.828   -2.652  75.103  1.00 37.09  ? 100 PHE H CD2 1 
ATOM   861  C CE1 . PHE A 1 109 E 5.119   -0.038  75.655  1.00 37.57  ? 100 PHE H CE1 1 
ATOM   862  C CE2 . PHE A 1 109 E 6.716   -1.624  74.852  1.00 41.96  ? 100 PHE H CE2 1 
ATOM   863  C CZ  . PHE A 1 109 E 6.360   -0.330  75.141  1.00 41.08  ? 100 PHE H CZ  1 
ATOM   864  N N   . PHE A 1 110 F 0.785   -2.508  75.517  1.00 33.07  ? 100 PHE H N   1 
ATOM   865  C CA  . PHE A 1 110 F -0.193  -1.434  75.581  1.00 31.02  ? 100 PHE H CA  1 
ATOM   866  C C   . PHE A 1 110 F 0.486   -0.216  76.184  1.00 32.00  ? 100 PHE H C   1 
ATOM   867  O O   . PHE A 1 110 F 0.785   -0.221  77.382  1.00 35.20  ? 100 PHE H O   1 
ATOM   868  C CB  . PHE A 1 110 F -1.389  -1.888  76.419  1.00 32.40  ? 100 PHE H CB  1 
ATOM   869  C CG  . PHE A 1 110 F -2.101  -3.137  75.961  1.00 33.02  ? 100 PHE H CG  1 
ATOM   870  C CD1 . PHE A 1 110 F -2.017  -3.578  74.649  1.00 33.25  ? 100 PHE H CD1 1 
ATOM   871  C CD2 . PHE A 1 110 F -2.935  -3.820  76.832  1.00 33.47  ? 100 PHE H CD2 1 
ATOM   872  C CE1 . PHE A 1 110 F -2.668  -4.725  74.248  1.00 35.30  ? 100 PHE H CE1 1 
ATOM   873  C CE2 . PHE A 1 110 F -3.557  -4.966  76.434  1.00 33.76  ? 100 PHE H CE2 1 
ATOM   874  C CZ  . PHE A 1 110 F -3.482  -5.392  75.118  1.00 32.64  ? 100 PHE H CZ  1 
ATOM   875  N N   . ASP A 1 111 ? 0.673   0.841   75.382  1.00 32.79  ? 101 ASP H N   1 
ATOM   876  C CA  . ASP A 1 111 ? 1.430   2.018   75.819  1.00 35.68  ? 101 ASP H CA  1 
ATOM   877  C C   . ASP A 1 111 ? 0.516   3.110   76.342  1.00 37.99  ? 101 ASP H C   1 
ATOM   878  O O   . ASP A 1 111 ? 0.945   3.881   77.178  1.00 44.78  ? 101 ASP H O   1 
ATOM   879  C CB  . ASP A 1 111 ? 2.385   2.571   74.759  1.00 38.76  ? 101 ASP H CB  1 
ATOM   880  C CG  . ASP A 1 111 ? 1.815   2.919   73.389  1.00 39.03  ? 101 ASP H CG  1 
ATOM   881  O OD1 . ASP A 1 111 ? 0.589   2.710   73.152  1.00 34.77  ? 101 ASP H OD1 1 
ATOM   882  O OD2 . ASP A 1 111 ? 2.595   3.447   72.568  1.00 36.79  ? 101 ASP H OD2 1 
ATOM   883  N N   . PHE A 1 112 ? -0.673  3.261   75.757  1.00 31.96  ? 102 PHE H N   1 
ATOM   884  C CA  . PHE A 1 112 ? -1.625  4.254   76.204  1.00 31.35  ? 102 PHE H CA  1 
ATOM   885  C C   . PHE A 1 112 ? -2.988  3.578   76.388  1.00 31.87  ? 102 PHE H C   1 
ATOM   886  O O   . PHE A 1 112 ? -3.358  2.770   75.540  1.00 34.20  ? 102 PHE H O   1 
ATOM   887  C CB  . PHE A 1 112 ? -1.793  5.356   75.172  1.00 35.70  ? 102 PHE H CB  1 
ATOM   888  C CG  . PHE A 1 112 ? -0.519  6.186   75.164  1.00 37.70  ? 102 PHE H CG  1 
ATOM   889  C CD1 . PHE A 1 112 ? -0.354  7.233   76.055  1.00 37.10  ? 102 PHE H CD1 1 
ATOM   890  C CD2 . PHE A 1 112 ? 0.520   5.843   74.304  1.00 37.75  ? 102 PHE H CD2 1 
ATOM   891  C CE1 . PHE A 1 112 ? 0.828   7.957   76.054  1.00 42.90  ? 102 PHE H CE1 1 
ATOM   892  C CE2 . PHE A 1 112 ? 1.721   6.548   74.346  1.00 40.77  ? 102 PHE H CE2 1 
ATOM   893  C CZ  . PHE A 1 112 ? 1.855   7.610   75.200  1.00 41.14  ? 102 PHE H CZ  1 
ATOM   894  N N   . TRP A 1 113 ? -3.695  3.974   77.459  1.00 30.63  ? 103 TRP H N   1 
ATOM   895  C CA  . TRP A 1 113 ? -4.993  3.412   77.852  1.00 32.52  ? 103 TRP H CA  1 
ATOM   896  C C   . TRP A 1 113 ? -6.015  4.531   77.909  1.00 33.38  ? 103 TRP H C   1 
ATOM   897  O O   . TRP A 1 113 ? -5.688  5.668   78.270  1.00 34.44  ? 103 TRP H O   1 
ATOM   898  C CB  . TRP A 1 113 ? -4.931  2.733   79.230  1.00 34.34  ? 103 TRP H CB  1 
ATOM   899  C CG  . TRP A 1 113 ? -4.014  1.532   79.327  1.00 30.19  ? 103 TRP H CG  1 
ATOM   900  C CD1 . TRP A 1 113 ? -2.647  1.516   79.245  1.00 33.14  ? 103 TRP H CD1 1 
ATOM   901  C CD2 . TRP A 1 113 ? -4.416  0.198   79.667  1.00 31.00  ? 103 TRP H CD2 1 
ATOM   902  N NE1 . TRP A 1 113 ? -2.181  0.222   79.407  1.00 32.83  ? 103 TRP H NE1 1 
ATOM   903  C CE2 . TRP A 1 113 ? -3.252  -0.598  79.687  1.00 30.72  ? 103 TRP H CE2 1 
ATOM   904  C CE3 . TRP A 1 113 ? -5.650  -0.411  79.939  1.00 33.09  ? 103 TRP H CE3 1 
ATOM   905  C CZ2 . TRP A 1 113 ? -3.293  -1.955  80.000  1.00 32.36  ? 103 TRP H CZ2 1 
ATOM   906  C CZ3 . TRP A 1 113 ? -5.680  -1.743  80.253  1.00 33.63  ? 103 TRP H CZ3 1 
ATOM   907  C CH2 . TRP A 1 113 ? -4.510  -2.498  80.352  1.00 32.90  ? 103 TRP H CH2 1 
ATOM   908  N N   . GLY A 1 114 ? -7.282  4.187   77.614  1.00 33.00  ? 104 GLY H N   1 
ATOM   909  C CA  . GLY A 1 114 ? -8.385  5.041   77.993  1.00 31.27  ? 104 GLY H CA  1 
ATOM   910  C C   . GLY A 1 114 ? -8.517  5.087   79.518  1.00 32.72  ? 104 GLY H C   1 
ATOM   911  O O   . GLY A 1 114 ? -7.890  4.288   80.205  1.00 33.60  ? 104 GLY H O   1 
ATOM   912  N N   . GLN A 1 115 ? -9.390  5.987   80.017  1.00 30.83  ? 105 GLN H N   1 
ATOM   913  C CA  . GLN A 1 115 ? -9.622  6.161   81.445  1.00 33.27  ? 105 GLN H CA  1 
ATOM   914  C C   . GLN A 1 115 ? -10.604 5.136   81.985  1.00 31.57  ? 105 GLN H C   1 
ATOM   915  O O   . GLN A 1 115 ? -10.835 5.063   83.192  1.00 31.36  ? 105 GLN H O   1 
ATOM   916  C CB  . GLN A 1 115 ? -10.071 7.593   81.708  1.00 36.23  ? 105 GLN H CB  1 
ATOM   917  C CG  . GLN A 1 115 ? -11.560 7.907   81.538  1.00 37.32  ? 105 GLN H CG  1 
ATOM   918  C CD  . GLN A 1 115 ? -12.007 8.119   80.105  1.00 35.52  ? 105 GLN H CD  1 
ATOM   919  O OE1 . GLN A 1 115 ? -11.308 7.826   79.114  1.00 31.98  ? 105 GLN H OE1 1 
ATOM   920  N NE2 . GLN A 1 115 ? -13.234 8.598   79.999  1.00 38.45  ? 105 GLN H NE2 1 
ATOM   921  N N   . GLY A 1 116 ? -11.176 4.350   81.085  1.00 31.40  ? 106 GLY H N   1 
ATOM   922  C CA  . GLY A 1 116 ? -12.135 3.298   81.425  1.00 30.00  ? 106 GLY H CA  1 
ATOM   923  C C   . GLY A 1 116 ? -13.572 3.791   81.349  1.00 31.70  ? 106 GLY H C   1 
ATOM   924  O O   . GLY A 1 116 ? -13.861 4.959   81.598  1.00 33.53  ? 106 GLY H O   1 
ATOM   925  N N   . THR A 1 117 ? -14.485 2.835   81.126  1.00 31.53  ? 107 THR H N   1 
ATOM   926  C CA  . THR A 1 117 ? -15.900 3.088   81.130  1.00 32.25  ? 107 THR H CA  1 
ATOM   927  C C   . THR A 1 117 ? -16.553 2.103   82.080  1.00 32.09  ? 107 THR H C   1 
ATOM   928  O O   . THR A 1 117 ? -16.438 0.902   81.844  1.00 34.50  ? 107 THR H O   1 
ATOM   929  C CB  . THR A 1 117 ? -16.495 2.918   79.729  1.00 31.92  ? 107 THR H CB  1 
ATOM   930  O OG1 . THR A 1 117 ? -15.957 3.882   78.826  1.00 32.76  ? 107 THR H OG1 1 
ATOM   931  C CG2 . THR A 1 117 ? -18.014 3.080   79.782  1.00 34.06  ? 107 THR H CG2 1 
ATOM   932  N N   . THR A 1 118 ? -17.324 2.605   83.062  1.00 32.95  ? 108 THR H N   1 
ATOM   933  C CA  . THR A 1 118 ? -18.079 1.706   83.930  1.00 33.56  ? 108 THR H CA  1 
ATOM   934  C C   . THR A 1 118 ? -19.430 1.388   83.297  1.00 34.44  ? 108 THR H C   1 
ATOM   935  O O   . THR A 1 118 ? -20.196 2.278   82.921  1.00 34.08  ? 108 THR H O   1 
ATOM   936  C CB  . THR A 1 118 ? -18.211 2.266   85.332  1.00 32.16  ? 108 THR H CB  1 
ATOM   937  O OG1 . THR A 1 118 ? -16.901 2.638   85.808  1.00 33.65  ? 108 THR H OG1 1 
ATOM   938  C CG2 . THR A 1 118 ? -18.934 1.315   86.266  1.00 38.89  ? 108 THR H CG2 1 
ATOM   939  N N   . LEU A 1 119 ? -19.732 0.079   83.257  1.00 32.78  ? 109 LEU H N   1 
ATOM   940  C CA  . LEU A 1 119 ? -21.010 -0.455  82.826  1.00 33.81  ? 109 LEU H CA  1 
ATOM   941  C C   . LEU A 1 119 ? -21.641 -1.214  83.993  1.00 32.98  ? 109 LEU H C   1 
ATOM   942  O O   . LEU A 1 119 ? -20.979 -2.054  84.597  1.00 35.03  ? 109 LEU H O   1 
ATOM   943  C CB  . LEU A 1 119 ? -20.849 -1.419  81.649  1.00 33.72  ? 109 LEU H CB  1 
ATOM   944  C CG  . LEU A 1 119 ? -22.140 -2.118  81.189  1.00 33.85  ? 109 LEU H CG  1 
ATOM   945  C CD1 . LEU A 1 119 ? -23.137 -1.106  80.614  1.00 34.50  ? 109 LEU H CD1 1 
ATOM   946  C CD2 . LEU A 1 119 ? -21.863 -3.202  80.205  1.00 35.56  ? 109 LEU H CD2 1 
ATOM   947  N N   . THR A 1 120 ? -22.908 -0.861  84.313  1.00 33.12  ? 110 THR H N   1 
ATOM   948  C CA  . THR A 1 120 ? -23.723 -1.624  85.236  1.00 33.57  ? 110 THR H CA  1 
ATOM   949  C C   . THR A 1 120 ? -24.925 -2.180  84.482  1.00 36.40  ? 110 THR H C   1 
ATOM   950  O O   . THR A 1 120 ? -25.652 -1.455  83.791  1.00 35.19  ? 110 THR H O   1 
ATOM   951  C CB  . THR A 1 120 ? -24.167 -0.756  86.407  1.00 35.84  ? 110 THR H CB  1 
ATOM   952  O OG1 . THR A 1 120 ? -23.017 -0.169  87.009  1.00 35.85  ? 110 THR H OG1 1 
ATOM   953  C CG2 . THR A 1 120 ? -24.954 -1.575  87.419  1.00 36.08  ? 110 THR H CG2 1 
ATOM   954  N N   . VAL A 1 121 ? -25.133 -3.498  84.640  1.00 36.80  ? 111 VAL H N   1 
ATOM   955  C CA  . VAL A 1 121 ? -26.275 -4.191  84.059  1.00 34.94  ? 111 VAL H CA  1 
ATOM   956  C C   . VAL A 1 121 ? -27.264 -4.462  85.190  1.00 36.85  ? 111 VAL H C   1 
ATOM   957  O O   . VAL A 1 121 ? -26.947 -5.147  86.137  1.00 38.91  ? 111 VAL H O   1 
ATOM   958  C CB  . VAL A 1 121 ? -25.883 -5.496  83.340  1.00 38.05  ? 111 VAL H CB  1 
ATOM   959  C CG1 . VAL A 1 121 ? -27.099 -6.196  82.729  1.00 37.47  ? 111 VAL H CG1 1 
ATOM   960  C CG2 . VAL A 1 121 ? -24.850 -5.260  82.242  1.00 37.43  ? 111 VAL H CG2 1 
ATOM   961  N N   . SER A 1 122 ? -28.458 -3.882  85.098  1.00 42.62  ? 112 SER H N   1 
ATOM   962  C CA  . SER A 1 122 ? -29.435 -3.983  86.161  1.00 40.92  ? 112 SER H CA  1 
ATOM   963  C C   . SER A 1 122 ? -30.814 -3.629  85.621  1.00 41.85  ? 112 SER H C   1 
ATOM   964  O O   . SER A 1 122 ? -30.948 -2.865  84.671  1.00 37.84  ? 112 SER H O   1 
ATOM   965  C CB  . SER A 1 122 ? -29.058 -3.100  87.331  1.00 43.06  ? 112 SER H CB  1 
ATOM   966  O OG  . SER A 1 122 ? -30.141 -3.003  88.250  1.00 43.26  ? 112 SER H OG  1 
ATOM   967  N N   . SER A 1 123 ? -31.853 -4.237  86.217  1.00 41.07  ? 113 SER H N   1 
ATOM   968  C CA  . SER A 1 123 ? -33.223 -3.873  85.911  1.00 39.33  ? 113 SER H CA  1 
ATOM   969  C C   . SER A 1 123 ? -33.691 -2.606  86.621  1.00 40.64  ? 113 SER H C   1 
ATOM   970  O O   . SER A 1 123 ? -34.729 -2.065  86.241  1.00 45.54  ? 113 SER H O   1 
ATOM   971  C CB  . SER A 1 123 ? -34.164 -5.015  86.262  1.00 43.45  ? 113 SER H CB  1 
ATOM   972  O OG  . SER A 1 123 ? -34.160 -5.900  85.155  1.00 49.20  ? 113 SER H OG  1 
ATOM   973  N N   . ALA A 1 124 ? -32.988 -2.180  87.664  1.00 42.02  ? 114 ALA H N   1 
ATOM   974  C CA  . ALA A 1 124 ? -33.395 -1.010  88.422  1.00 42.32  ? 114 ALA H CA  1 
ATOM   975  C C   . ALA A 1 124 ? -33.180 0.246   87.588  1.00 43.24  ? 114 ALA H C   1 
ATOM   976  O O   . ALA A 1 124 ? -32.250 0.336   86.784  1.00 43.75  ? 114 ALA H O   1 
ATOM   977  C CB  . ALA A 1 124 ? -32.654 -0.966  89.731  1.00 40.90  ? 114 ALA H CB  1 
ATOM   978  N N   . SER A 1 125 ? -34.013 1.249   87.852  1.00 40.82  ? 115 SER H N   1 
ATOM   979  C CA  . SER A 1 125 ? -33.973 2.516   87.136  1.00 44.21  ? 115 SER H CA  1 
ATOM   980  C C   . SER A 1 125 ? -32.805 3.358   87.644  1.00 37.53  ? 115 SER H C   1 
ATOM   981  O O   . SER A 1 125 ? -32.417 3.227   88.796  1.00 41.13  ? 115 SER H O   1 
ATOM   982  C CB  . SER A 1 125 ? -35.296 3.260   87.287  1.00 47.54  ? 115 SER H CB  1 
ATOM   983  O OG  . SER A 1 125 ? -36.274 2.687   86.423  1.00 55.30  ? 115 SER H OG  1 
ATOM   984  N N   . THR A 1 126 ? -32.269 4.233   86.782  1.00 38.55  ? 116 THR H N   1 
ATOM   985  C CA  . THR A 1 126 ? -31.240 5.158   87.198  1.00 39.01  ? 116 THR H CA  1 
ATOM   986  C C   . THR A 1 126 ? -31.862 6.182   88.139  1.00 41.69  ? 116 THR H C   1 
ATOM   987  O O   . THR A 1 126 ? -33.063 6.481   88.080  1.00 40.56  ? 116 THR H O   1 
ATOM   988  C CB  . THR A 1 126 ? -30.562 5.783   85.962  1.00 42.27  ? 116 THR H CB  1 
ATOM   989  O OG1 . THR A 1 126 ? -29.292 6.300   86.335  1.00 45.22  ? 116 THR H OG1 1 
ATOM   990  C CG2 . THR A 1 126 ? -31.390 6.849   85.264  1.00 44.73  ? 116 THR H CG2 1 
ATOM   991  N N   . LYS A 1 127 ? -31.016 6.706   89.021  1.00 41.02  ? 117 LYS H N   1 
ATOM   992  C CA  . LYS A 1 127 ? -31.359 7.854   89.841  1.00 41.86  ? 117 LYS H CA  1 
ATOM   993  C C   . LYS A 1 127 ? -30.133 8.755   89.958  1.00 41.32  ? 117 LYS H C   1 
ATOM   994  O O   . LYS A 1 127 ? -29.075 8.336   90.427  1.00 37.69  ? 117 LYS H O   1 
ATOM   995  C CB  . LYS A 1 127 ? -31.860 7.440   91.220  1.00 45.67  ? 117 LYS H CB  1 
ATOM   996  C CG  . LYS A 1 127 ? -32.470 8.645   91.994  1.00 48.44  ? 117 LYS H CG  1 
ATOM   997  C CD  . LYS A 1 127 ? -32.923 8.301   93.407  1.00 53.62  ? 117 LYS H CD  1 
ATOM   998  C CE  . LYS A 1 127 ? -33.255 9.500   94.254  1.00 57.38  ? 117 LYS H CE  1 
ATOM   999  N NZ  . LYS A 1 127 ? -32.109 10.410  94.366  1.00 60.31  ? 117 LYS H NZ  1 
ATOM   1000 N N   . GLY A 1 128 ? -30.274 10.018  89.548  1.00 38.78  ? 118 GLY H N   1 
ATOM   1001 C CA  . GLY A 1 128 ? -29.199 10.964  89.721  1.00 38.92  ? 118 GLY H CA  1 
ATOM   1002 C C   . GLY A 1 128 ? -29.076 11.394  91.181  1.00 39.77  ? 118 GLY H C   1 
ATOM   1003 O O   . GLY A 1 128 ? -30.035 11.328  91.933  1.00 39.57  ? 118 GLY H O   1 
ATOM   1004 N N   . PRO A 1 129 ? -27.904 11.913  91.580  1.00 40.34  ? 119 PRO H N   1 
ATOM   1005 C CA  . PRO A 1 129 ? -27.615 12.269  92.974  1.00 38.44  ? 119 PRO H CA  1 
ATOM   1006 C C   . PRO A 1 129 ? -28.250 13.582  93.389  1.00 42.00  ? 119 PRO H C   1 
ATOM   1007 O O   . PRO A 1 129 ? -28.539 14.414  92.531  1.00 40.39  ? 119 PRO H O   1 
ATOM   1008 C CB  . PRO A 1 129 ? -26.079 12.391  92.973  1.00 39.10  ? 119 PRO H CB  1 
ATOM   1009 C CG  . PRO A 1 129 ? -25.718 12.789  91.567  1.00 40.16  ? 119 PRO H CG  1 
ATOM   1010 C CD  . PRO A 1 129 ? -26.745 12.119  90.699  1.00 40.67  ? 119 PRO H CD  1 
ATOM   1011 N N   . SER A 1 130 ? -28.434 13.715  94.703  1.00 42.75  ? 120 SER H N   1 
ATOM   1012 C CA  . SER A 1 130 ? -28.623 15.000  95.362  1.00 42.94  ? 120 SER H CA  1 
ATOM   1013 C C   . SER A 1 130 ? -27.272 15.445  95.884  1.00 40.74  ? 120 SER H C   1 
ATOM   1014 O O   . SER A 1 130 ? -26.606 14.650  96.541  1.00 42.56  ? 120 SER H O   1 
ATOM   1015 C CB  . SER A 1 130 ? -29.611 14.861  96.470  1.00 47.37  ? 120 SER H CB  1 
ATOM   1016 O OG  . SER A 1 130 ? -30.917 14.732  95.928  1.00 45.38  ? 120 SER H OG  1 
ATOM   1017 N N   . VAL A 1 131 ? -26.879 16.689  95.606  1.00 38.25  ? 121 VAL H N   1 
ATOM   1018 C CA  . VAL A 1 131 ? -25.575 17.176  96.000  1.00 41.24  ? 121 VAL H CA  1 
ATOM   1019 C C   . VAL A 1 131 ? -25.724 18.288  97.043  1.00 40.26  ? 121 VAL H C   1 
ATOM   1020 O O   . VAL A 1 131 ? -26.391 19.289  96.795  1.00 41.63  ? 121 VAL H O   1 
ATOM   1021 C CB  . VAL A 1 131 ? -24.770 17.632  94.765  1.00 42.09  ? 121 VAL H CB  1 
ATOM   1022 C CG1 . VAL A 1 131 ? -23.417 18.191  95.176  1.00 43.64  ? 121 VAL H CG1 1 
ATOM   1023 C CG2 . VAL A 1 131 ? -24.593 16.471  93.776  1.00 42.57  ? 121 VAL H CG2 1 
ATOM   1024 N N   . PHE A 1 132 ? -25.136 18.068  98.226  1.00 42.45  ? 122 PHE H N   1 
ATOM   1025 C CA  . PHE A 1 132 ? -25.227 19.023  99.333  1.00 39.93  ? 122 PHE H CA  1 
ATOM   1026 C C   . PHE A 1 132 ? -23.844 19.555  99.686  1.00 41.53  ? 122 PHE H C   1 
ATOM   1027 O O   . PHE A 1 132 ? -22.864 18.820  99.655  1.00 40.62  ? 122 PHE H O   1 
ATOM   1028 C CB  . PHE A 1 132 ? -25.846 18.344  100.558 1.00 40.86  ? 122 PHE H CB  1 
ATOM   1029 C CG  . PHE A 1 132 ? -27.223 17.809  100.229 1.00 42.03  ? 122 PHE H CG  1 
ATOM   1030 C CD1 . PHE A 1 132 ? -28.255 18.677  99.888  1.00 44.16  ? 122 PHE H CD1 1 
ATOM   1031 C CD2 . PHE A 1 132 ? -27.496 16.452  100.254 1.00 41.31  ? 122 PHE H CD2 1 
ATOM   1032 C CE1 . PHE A 1 132 ? -29.497 18.201  99.524  1.00 41.21  ? 122 PHE H CE1 1 
ATOM   1033 C CE2 . PHE A 1 132 ? -28.770 15.979  99.955  1.00 43.36  ? 122 PHE H CE2 1 
ATOM   1034 C CZ  . PHE A 1 132 ? -29.765 16.847  99.585  1.00 44.69  ? 122 PHE H CZ  1 
ATOM   1035 N N   . PRO A 1 133 ? -23.717 20.831  100.115 1.00 38.97  ? 123 PRO H N   1 
ATOM   1036 C CA  . PRO A 1 133 ? -22.430 21.357  100.539 1.00 43.29  ? 123 PRO H CA  1 
ATOM   1037 C C   . PRO A 1 133 ? -22.015 20.782  101.892 1.00 41.81  ? 123 PRO H C   1 
ATOM   1038 O O   . PRO A 1 133 ? -22.861 20.519  102.741 1.00 43.61  ? 123 PRO H O   1 
ATOM   1039 C CB  . PRO A 1 133 ? -22.688 22.876  100.615 1.00 47.85  ? 123 PRO H CB  1 
ATOM   1040 C CG  . PRO A 1 133 ? -24.144 22.981  100.978 1.00 47.23  ? 123 PRO H CG  1 
ATOM   1041 C CD  . PRO A 1 133 ? -24.809 21.805  100.269 1.00 45.91  ? 123 PRO H CD  1 
ATOM   1042 N N   . LEU A 1 134 ? -20.709 20.540  102.031 1.00 43.74  ? 124 LEU H N   1 
ATOM   1043 C CA  . LEU A 1 134 ? -20.052 20.366  103.322 1.00 44.58  ? 124 LEU H CA  1 
ATOM   1044 C C   . LEU A 1 134 ? -19.317 21.672  103.624 1.00 42.53  ? 124 LEU H C   1 
ATOM   1045 O O   . LEU A 1 134 ? -18.216 21.911  103.127 1.00 41.64  ? 124 LEU H O   1 
ATOM   1046 C CB  . LEU A 1 134 ? -19.120 19.157  103.249 1.00 46.01  ? 124 LEU H CB  1 
ATOM   1047 C CG  . LEU A 1 134 ? -19.816 17.819  103.001 1.00 44.89  ? 124 LEU H CG  1 
ATOM   1048 C CD1 . LEU A 1 134 ? -18.808 16.757  102.662 1.00 49.60  ? 124 LEU H CD1 1 
ATOM   1049 C CD2 . LEU A 1 134 ? -20.667 17.391  104.185 1.00 46.53  ? 124 LEU H CD2 1 
ATOM   1050 N N   . ALA A 1 135 ? -19.985 22.574  104.353 1.00 45.85  ? 125 ALA H N   1 
ATOM   1051 C CA  . ALA A 1 135 ? -19.507 23.951  104.440 1.00 47.65  ? 125 ALA H CA  1 
ATOM   1052 C C   . ALA A 1 135 ? -18.275 24.068  105.333 1.00 44.32  ? 125 ALA H C   1 
ATOM   1053 O O   . ALA A 1 135 ? -18.246 23.479  106.408 1.00 49.41  ? 125 ALA H O   1 
ATOM   1054 C CB  . ALA A 1 135 ? -20.609 24.848  104.966 1.00 47.26  ? 125 ALA H CB  1 
ATOM   1055 N N   . PRO A 1 136 ? -17.264 24.876  104.957 1.00 50.37  ? 126 PRO H N   1 
ATOM   1056 C CA  . PRO A 1 136 ? -16.128 25.127  105.840 1.00 51.54  ? 126 PRO H CA  1 
ATOM   1057 C C   . PRO A 1 136 ? -16.609 25.986  107.008 1.00 59.94  ? 126 PRO H C   1 
ATOM   1058 O O   . PRO A 1 136 ? -17.507 26.817  106.847 1.00 57.52  ? 126 PRO H O   1 
ATOM   1059 C CB  . PRO A 1 136 ? -15.116 25.853  104.959 1.00 49.52  ? 126 PRO H CB  1 
ATOM   1060 C CG  . PRO A 1 136 ? -15.994 26.578  103.959 1.00 52.87  ? 126 PRO H CG  1 
ATOM   1061 C CD  . PRO A 1 136 ? -17.161 25.627  103.699 1.00 47.77  ? 126 PRO H CD  1 
ATOM   1062 N N   . SER A 1 137 ? -16.022 25.733  108.184 1.00 56.11  ? 127 SER H N   1 
ATOM   1063 C CA  . SER A 1 137 ? -16.317 26.483  109.391 1.00 56.34  ? 127 SER H CA  1 
ATOM   1064 C C   . SER A 1 137 ? -15.164 26.317  110.375 1.00 63.65  ? 127 SER H C   1 
ATOM   1065 O O   . SER A 1 137 ? -14.112 25.745  110.055 1.00 62.48  ? 127 SER H O   1 
ATOM   1066 C CB  . SER A 1 137 ? -17.621 26.045  110.003 1.00 55.82  ? 127 SER H CB  1 
ATOM   1067 O OG  . SER A 1 137 ? -17.494 24.762  110.609 1.00 55.34  ? 127 SER H OG  1 
ATOM   1068 N N   . SER A 1 138 ? -15.371 26.854  111.581 1.00 66.68  ? 128 SER H N   1 
ATOM   1069 C CA  . SER A 1 138 ? -14.411 26.699  112.659 1.00 63.85  ? 128 SER H CA  1 
ATOM   1070 C C   . SER A 1 138 ? -14.298 25.217  113.009 1.00 63.60  ? 128 SER H C   1 
ATOM   1071 O O   . SER A 1 138 ? -13.238 24.766  113.427 1.00 59.33  ? 128 SER H O   1 
ATOM   1072 C CB  . SER A 1 138 ? -14.811 27.523  113.847 1.00 69.65  ? 128 SER H CB  1 
ATOM   1073 O OG  . SER A 1 138 ? -16.057 27.047  114.340 1.00 73.88  ? 128 SER H OG  1 
ATOM   1074 N N   . LYS A 1 139 ? -15.379 24.455  112.776 1.00 64.21  ? 129 LYS H N   1 
ATOM   1075 C CA  . LYS A 1 139 ? -15.384 23.026  113.068 1.00 64.47  ? 129 LYS H CA  1 
ATOM   1076 C C   . LYS A 1 139 ? -14.600 22.204  112.033 1.00 62.40  ? 129 LYS H C   1 
ATOM   1077 O O   . LYS A 1 139 ? -14.472 20.979  112.195 1.00 56.45  ? 129 LYS H O   1 
ATOM   1078 C CB  . LYS A 1 139 ? -16.840 22.582  113.240 1.00 70.86  ? 129 LYS H CB  1 
ATOM   1079 C CG  . LYS A 1 139 ? -17.555 23.198  114.450 1.00 81.29  ? 129 LYS H CG  1 
ATOM   1080 C CD  . LYS A 1 139 ? -16.987 22.797  115.810 1.00 83.48  ? 129 LYS H CD  1 
ATOM   1081 C CE  . LYS A 1 139 ? -17.494 23.600  116.983 1.00 85.62  ? 129 LYS H CE  1 
ATOM   1082 N NZ  . LYS A 1 139 ? -18.945 23.812  116.981 1.00 91.20  ? 129 LYS H NZ  1 
ATOM   1083 N N   . SER A 1 140 ? -14.052 22.870  111.000 1.00 58.65  ? 130 SER H N   1 
ATOM   1084 C CA  . SER A 1 140 ? -13.300 22.200  109.947 1.00 60.54  ? 130 SER H CA  1 
ATOM   1085 C C   . SER A 1 140 ? -11.974 22.913  109.653 1.00 66.48  ? 130 SER H C   1 
ATOM   1086 O O   . SER A 1 140 ? -11.322 22.624  108.642 1.00 55.84  ? 130 SER H O   1 
ATOM   1087 C CB  . SER A 1 140 ? -14.152 22.036  108.680 1.00 57.35  ? 130 SER H CB  1 
ATOM   1088 O OG  . SER A 1 140 ? -14.145 23.211  107.883 1.00 52.42  ? 130 SER H OG  1 
ATOM   1089 N N   . THR A 1 141 ? -11.519 23.785  110.571 1.00 65.97  ? 131 THR H N   1 
ATOM   1090 C CA  . THR A 1 141 ? -10.225 24.444  110.401 1.00 65.80  ? 131 THR H CA  1 
ATOM   1091 C C   . THR A 1 141 ? -9.143  23.734  111.214 1.00 60.89  ? 131 THR H C   1 
ATOM   1092 O O   . THR A 1 141 ? -9.427  23.019  112.173 1.00 60.29  ? 131 THR H O   1 
ATOM   1093 C CB  . THR A 1 141 ? -10.310 25.914  110.800 1.00 68.86  ? 131 THR H CB  1 
ATOM   1094 O OG1 . THR A 1 141 ? -10.829 25.824  112.123 1.00 74.35  ? 131 THR H OG1 1 
ATOM   1095 C CG2 . THR A 1 141 ? -11.195 26.723  109.872 1.00 65.45  ? 131 THR H CG2 1 
ATOM   1096 N N   . SER A 1 142 ? -7.898  23.955  110.796 1.00 59.93  ? 132 SER H N   1 
ATOM   1097 C CA  . SER A 1 142 ? -6.713  23.425  111.455 1.00 66.30  ? 132 SER H CA  1 
ATOM   1098 C C   . SER A 1 142 ? -5.489  24.177  110.936 1.00 68.07  ? 132 SER H C   1 
ATOM   1099 O O   . SER A 1 142 ? -5.175  24.126  109.748 1.00 68.89  ? 132 SER H O   1 
ATOM   1100 C CB  . SER A 1 142 ? -6.574  21.944  111.239 1.00 70.56  ? 132 SER H CB  1 
ATOM   1101 O OG  . SER A 1 142 ? -5.289  21.492  111.644 1.00 74.78  ? 132 SER H OG  1 
ATOM   1102 N N   . GLY A 1 143 ? -4.813  24.906  111.828 1.00 71.41  ? 133 GLY H N   1 
ATOM   1103 C CA  . GLY A 1 143 ? -3.739  25.789  111.412 1.00 66.93  ? 133 GLY H CA  1 
ATOM   1104 C C   . GLY A 1 143 ? -4.342  26.997  110.707 1.00 67.07  ? 133 GLY H C   1 
ATOM   1105 O O   . GLY A 1 143 ? -5.251  27.637  111.241 1.00 74.80  ? 133 GLY H O   1 
ATOM   1106 N N   . GLY A 1 144 ? -3.831  27.292  109.510 1.00 68.30  ? 134 GLY H N   1 
ATOM   1107 C CA  . GLY A 1 144 ? -4.496  28.215  108.607 1.00 65.63  ? 134 GLY H CA  1 
ATOM   1108 C C   . GLY A 1 144 ? -5.078  27.461  107.410 1.00 62.24  ? 134 GLY H C   1 
ATOM   1109 O O   . GLY A 1 144 ? -5.072  27.994  106.311 1.00 65.31  ? 134 GLY H O   1 
ATOM   1110 N N   . THR A 1 145 ? -5.588  26.237  107.634 1.00 63.56  ? 135 THR H N   1 
ATOM   1111 C CA  . THR A 1 145 ? -6.256  25.485  106.574 1.00 65.10  ? 135 THR H CA  1 
ATOM   1112 C C   . THR A 1 145 ? -7.679  25.113  106.995 1.00 58.06  ? 135 THR H C   1 
ATOM   1113 O O   . THR A 1 145 ? -7.983  24.895  108.168 1.00 55.93  ? 135 THR H O   1 
ATOM   1114 C CB  . THR A 1 145 ? -5.459  24.244  106.155 1.00 66.84  ? 135 THR H CB  1 
ATOM   1115 O OG1 . THR A 1 145 ? -5.576  23.283  107.201 1.00 70.20  ? 135 THR H OG1 1 
ATOM   1116 C CG2 . THR A 1 145 ? -4.009  24.548  105.820 1.00 72.24  ? 135 THR H CG2 1 
ATOM   1117 N N   . ALA A 1 146 ? -8.564  25.018  105.996 1.00 56.30  ? 136 ALA H N   1 
ATOM   1118 C CA  . ALA A 1 146 ? -9.940  24.612  106.237 1.00 53.78  ? 136 ALA H CA  1 
ATOM   1119 C C   . ALA A 1 146 ? -10.316 23.495  105.261 1.00 52.02  ? 136 ALA H C   1 
ATOM   1120 O O   . ALA A 1 146 ? -9.916  23.538  104.104 1.00 54.44  ? 136 ALA H O   1 
ATOM   1121 C CB  . ALA A 1 146 ? -10.845 25.803  106.064 1.00 56.45  ? 136 ALA H CB  1 
ATOM   1122 N N   . ALA A 1 147 ? -11.070 22.508  105.754 1.00 53.04  ? 137 ALA H N   1 
ATOM   1123 C CA  . ALA A 1 147 ? -11.677 21.483  104.915 1.00 50.66  ? 137 ALA H CA  1 
ATOM   1124 C C   . ALA A 1 147 ? -13.070 21.941  104.483 1.00 47.94  ? 137 ALA H C   1 
ATOM   1125 O O   . ALA A 1 147 ? -13.797 22.581  105.244 1.00 46.98  ? 137 ALA H O   1 
ATOM   1126 C CB  . ALA A 1 147 ? -11.726 20.165  105.652 1.00 47.47  ? 137 ALA H CB  1 
ATOM   1127 N N   . LEU A 1 148 ? -13.419 21.619  103.236 1.00 43.80  ? 138 LEU H N   1 
ATOM   1128 C CA  . LEU A 1 148 ? -14.784 21.758  102.746 1.00 45.05  ? 138 LEU H CA  1 
ATOM   1129 C C   . LEU A 1 148 ? -15.031 20.606  101.773 1.00 44.19  ? 138 LEU H C   1 
ATOM   1130 O O   . LEU A 1 148 ? -14.078 19.918  101.419 1.00 42.28  ? 138 LEU H O   1 
ATOM   1131 C CB  . LEU A 1 148 ? -15.019 23.100  102.073 1.00 44.30  ? 138 LEU H CB  1 
ATOM   1132 C CG  . LEU A 1 148 ? -14.053 23.447  100.931 1.00 50.70  ? 138 LEU H CG  1 
ATOM   1133 C CD1 . LEU A 1 148 ? -14.584 23.057  99.566  1.00 52.00  ? 138 LEU H CD1 1 
ATOM   1134 C CD2 . LEU A 1 148 ? -13.685 24.923  100.903 1.00 57.72  ? 138 LEU H CD2 1 
ATOM   1135 N N   . GLY A 1 149 ? -16.295 20.407  101.366 1.00 44.09  ? 139 GLY H N   1 
ATOM   1136 C CA  . GLY A 1 149 ? -16.607 19.336  100.433 1.00 45.10  ? 139 GLY H CA  1 
ATOM   1137 C C   . GLY A 1 149 ? -18.043 19.357  99.912  1.00 45.13  ? 139 GLY H C   1 
ATOM   1138 O O   . GLY A 1 149 ? -18.783 20.318  100.091 1.00 41.53  ? 139 GLY H O   1 
ATOM   1139 N N   . CYS A 1 150 ? -18.385 18.263  99.213  1.00 41.51  ? 140 CYS H N   1 
ATOM   1140 C CA  . CYS A 1 150 ? -19.716 18.004  98.711  1.00 39.30  ? 140 CYS H CA  1 
ATOM   1141 C C   . CYS A 1 150 ? -20.106 16.580  99.051  1.00 35.26  ? 140 CYS H C   1 
ATOM   1142 O O   . CYS A 1 150 ? -19.342 15.642  98.839  1.00 39.48  ? 140 CYS H O   1 
ATOM   1143 C CB  . CYS A 1 150 ? -19.786 18.221  97.190  1.00 41.21  ? 140 CYS H CB  1 
ATOM   1144 S SG  . CYS A 1 150 ? -19.843 19.986  96.791  1.00 45.27  ? 140 CYS H SG  1 
ATOM   1145 N N   . LEU A 1 151 ? -21.318 16.463  99.570  1.00 37.35  ? 141 LEU H N   1 
ATOM   1146 C CA  . LEU A 1 151 ? -21.983 15.202  99.804  1.00 40.15  ? 141 LEU H CA  1 
ATOM   1147 C C   . LEU A 1 151 ? -22.839 14.877  98.579  1.00 38.44  ? 141 LEU H C   1 
ATOM   1148 O O   . LEU A 1 151 ? -23.714 15.647  98.217  1.00 40.49  ? 141 LEU H O   1 
ATOM   1149 C CB  . LEU A 1 151 ? -22.825 15.296  101.077 1.00 40.72  ? 141 LEU H CB  1 
ATOM   1150 C CG  . LEU A 1 151 ? -23.764 14.120  101.367 1.00 43.24  ? 141 LEU H CG  1 
ATOM   1151 C CD1 . LEU A 1 151 ? -22.963 12.797  101.506 1.00 39.57  ? 141 LEU H CD1 1 
ATOM   1152 C CD2 . LEU A 1 151 ? -24.599 14.375  102.609 1.00 46.08  ? 141 LEU H CD2 1 
ATOM   1153 N N   . VAL A 1 152 ? -22.589 13.701  97.988  1.00 38.63  ? 142 VAL H N   1 
ATOM   1154 C CA  . VAL A 1 152 ? -23.213 13.265  96.745  1.00 38.57  ? 142 VAL H CA  1 
ATOM   1155 C C   . VAL A 1 152 ? -24.073 12.062  97.095  1.00 38.34  ? 142 VAL H C   1 
ATOM   1156 O O   . VAL A 1 152 ? -23.548 10.951  97.191  1.00 38.17  ? 142 VAL H O   1 
ATOM   1157 C CB  . VAL A 1 152 ? -22.151 12.944  95.672  1.00 37.38  ? 142 VAL H CB  1 
ATOM   1158 C CG1 . VAL A 1 152 ? -22.766 12.598  94.329  1.00 40.09  ? 142 VAL H CG1 1 
ATOM   1159 C CG2 . VAL A 1 152 ? -21.199 14.122  95.502  1.00 39.12  ? 142 VAL H CG2 1 
ATOM   1160 N N   . LYS A 1 153 ? -25.373 12.305  97.298  1.00 41.54  ? 143 LYS H N   1 
ATOM   1161 C CA  . LYS A 1 153 ? -26.236 11.339  97.966  1.00 47.16  ? 143 LYS H CA  1 
ATOM   1162 C C   . LYS A 1 153 ? -27.270 10.721  97.024  1.00 42.31  ? 143 LYS H C   1 
ATOM   1163 O O   . LYS A 1 153 ? -27.827 11.367  96.151  1.00 41.62  ? 143 LYS H O   1 
ATOM   1164 C CB  . LYS A 1 153 ? -26.933 12.019  99.152  1.00 52.13  ? 143 LYS H CB  1 
ATOM   1165 C CG  . LYS A 1 153 ? -27.316 11.069  100.288 1.00 60.26  ? 143 LYS H CG  1 
ATOM   1166 C CD  . LYS A 1 153 ? -28.210 11.715  101.336 1.00 64.33  ? 143 LYS H CD  1 
ATOM   1167 C CE  . LYS A 1 153 ? -28.560 10.830  102.483 1.00 61.86  ? 143 LYS H CE  1 
ATOM   1168 N NZ  . LYS A 1 153 ? -29.045 9.506   102.108 1.00 68.14  ? 143 LYS H NZ  1 
ATOM   1169 N N   . ASP A 1 154 ? -27.549 9.439   97.261  1.00 43.09  ? 144 ASP H N   1 
ATOM   1170 C CA  . ASP A 1 154 ? -28.751 8.786   96.765  1.00 39.83  ? 144 ASP H CA  1 
ATOM   1171 C C   . ASP A 1 154 ? -28.790 8.647   95.245  1.00 41.27  ? 144 ASP H C   1 
ATOM   1172 O O   . ASP A 1 154 ? -29.764 9.065   94.628  1.00 42.07  ? 144 ASP H O   1 
ATOM   1173 C CB  . ASP A 1 154 ? -29.992 9.493   97.296  1.00 40.29  ? 144 ASP H CB  1 
ATOM   1174 C CG  . ASP A 1 154 ? -30.205 9.333   98.792  1.00 46.65  ? 144 ASP H CG  1 
ATOM   1175 O OD1 . ASP A 1 154 ? -29.615 8.402   99.392  1.00 50.01  ? 144 ASP H OD1 1 
ATOM   1176 O OD2 . ASP A 1 154 ? -30.907 10.186  99.354  1.00 52.91  ? 144 ASP H OD2 1 
ATOM   1177 N N   . TYR A 1 155 ? -27.783 7.988   94.651  1.00 36.02  ? 145 TYR H N   1 
ATOM   1178 C CA  . TYR A 1 155 ? -27.762 7.796   93.210  1.00 35.75  ? 145 TYR H CA  1 
ATOM   1179 C C   . TYR A 1 155 ? -27.632 6.311   92.909  1.00 38.68  ? 145 TYR H C   1 
ATOM   1180 O O   . TYR A 1 155 ? -27.179 5.537   93.768  1.00 38.95  ? 145 TYR H O   1 
ATOM   1181 C CB  . TYR A 1 155 ? -26.603 8.539   92.550  1.00 39.92  ? 145 TYR H CB  1 
ATOM   1182 C CG  . TYR A 1 155 ? -25.208 8.206   93.047  1.00 36.90  ? 145 TYR H CG  1 
ATOM   1183 C CD1 . TYR A 1 155 ? -24.636 8.874   94.130  1.00 37.03  ? 145 TYR H CD1 1 
ATOM   1184 C CD2 . TYR A 1 155 ? -24.442 7.226   92.418  1.00 37.21  ? 145 TYR H CD2 1 
ATOM   1185 C CE1 . TYR A 1 155 ? -23.365 8.561   94.599  1.00 36.90  ? 145 TYR H CE1 1 
ATOM   1186 C CE2 . TYR A 1 155 ? -23.163 6.925   92.866  1.00 37.49  ? 145 TYR H CE2 1 
ATOM   1187 C CZ  . TYR A 1 155 ? -22.620 7.589   93.961  1.00 38.73  ? 145 TYR H CZ  1 
ATOM   1188 O OH  . TYR A 1 155 ? -21.356 7.255   94.375  1.00 39.16  ? 145 TYR H OH  1 
ATOM   1189 N N   . PHE A 1 156 ? -27.962 5.964   91.665  1.00 37.41  ? 146 PHE H N   1 
ATOM   1190 C CA  . PHE A 1 156 ? -27.814 4.599   91.187  1.00 38.81  ? 146 PHE H CA  1 
ATOM   1191 C C   . PHE A 1 156 ? -27.748 4.610   89.666  1.00 37.57  ? 146 PHE H C   1 
ATOM   1192 O O   . PHE A 1 156 ? -28.492 5.351   89.034  1.00 35.66  ? 146 PHE H O   1 
ATOM   1193 C CB  . PHE A 1 156 ? -29.013 3.756   91.635  1.00 39.58  ? 146 PHE H CB  1 
ATOM   1194 C CG  . PHE A 1 156 ? -28.902 2.324   91.139  1.00 36.70  ? 146 PHE H CG  1 
ATOM   1195 C CD1 . PHE A 1 156 ? -28.192 1.386   91.872  1.00 39.51  ? 146 PHE H CD1 1 
ATOM   1196 C CD2 . PHE A 1 156 ? -29.392 1.959   89.897  1.00 38.49  ? 146 PHE H CD2 1 
ATOM   1197 C CE1 . PHE A 1 156 ? -28.046 0.092   91.400  1.00 38.44  ? 146 PHE H CE1 1 
ATOM   1198 C CE2 . PHE A 1 156 ? -29.265 0.659   89.434  1.00 38.51  ? 146 PHE H CE2 1 
ATOM   1199 C CZ  . PHE A 1 156 ? -28.550 -0.251  90.166  1.00 39.76  ? 146 PHE H CZ  1 
ATOM   1200 N N   . PRO A 1 157 ? -26.893 3.811   89.006  1.00 35.14  ? 147 PRO H N   1 
ATOM   1201 C CA  . PRO A 1 157 ? -25.808 3.052   89.641  1.00 36.76  ? 147 PRO H CA  1 
ATOM   1202 C C   . PRO A 1 157 ? -24.549 3.871   89.887  1.00 37.64  ? 147 PRO H C   1 
ATOM   1203 O O   . PRO A 1 157 ? -24.536 5.091   89.705  1.00 35.46  ? 147 PRO H O   1 
ATOM   1204 C CB  . PRO A 1 157 ? -25.575 1.983   88.559  1.00 37.49  ? 147 PRO H CB  1 
ATOM   1205 C CG  . PRO A 1 157 ? -25.674 2.784   87.262  1.00 37.06  ? 147 PRO H CG  1 
ATOM   1206 C CD  . PRO A 1 157 ? -26.914 3.635   87.540  1.00 37.43  ? 147 PRO H CD  1 
ATOM   1207 N N   . GLU A 1 158 ? -23.474 3.192   90.308  1.00 37.04  ? 148 GLU H N   1 
ATOM   1208 C CA  . GLU A 1 158 ? -22.179 3.840   90.242  1.00 34.89  ? 148 GLU H CA  1 
ATOM   1209 C C   . GLU A 1 158 ? -21.803 4.093   88.786  1.00 35.13  ? 148 GLU H C   1 
ATOM   1210 O O   . GLU A 1 158 ? -22.346 3.461   87.883  1.00 35.34  ? 148 GLU H O   1 
ATOM   1211 C CB  . GLU A 1 158 ? -21.086 2.973   90.858  1.00 37.05  ? 148 GLU H CB  1 
ATOM   1212 C CG  . GLU A 1 158 ? -21.306 2.774   92.352  1.00 40.91  ? 148 GLU H CG  1 
ATOM   1213 C CD  . GLU A 1 158 ? -20.021 2.459   93.056  1.00 55.25  ? 148 GLU H CD  1 
ATOM   1214 O OE1 . GLU A 1 158 ? -19.210 3.378   93.311  1.00 54.84  ? 148 GLU H OE1 1 
ATOM   1215 O OE2 . GLU A 1 158 ? -19.829 1.251   93.247  1.00 52.18  ? 148 GLU H OE2 1 
ATOM   1216 N N   . PRO A 1 159 ? -20.813 4.964   88.476  1.00 35.46  ? 149 PRO H N   1 
ATOM   1217 C CA  . PRO A 1 159 ? -20.153 5.896   89.392  1.00 36.45  ? 149 PRO H CA  1 
ATOM   1218 C C   . PRO A 1 159 ? -20.598 7.348   89.212  1.00 39.59  ? 149 PRO H C   1 
ATOM   1219 O O   . PRO A 1 159 ? -21.182 7.715   88.189  1.00 37.31  ? 149 PRO H O   1 
ATOM   1220 C CB  . PRO A 1 159 ? -18.710 5.797   88.903  1.00 37.69  ? 149 PRO H CB  1 
ATOM   1221 C CG  . PRO A 1 159 ? -18.875 5.729   87.364  1.00 37.44  ? 149 PRO H CG  1 
ATOM   1222 C CD  . PRO A 1 159 ? -20.230 5.041   87.132  1.00 39.24  ? 149 PRO H CD  1 
ATOM   1223 N N   . VAL A 1 160 ? -20.232 8.169   90.181  1.00 39.59  ? 150 VAL H N   1 
ATOM   1224 C CA  . VAL A 1 160 ? -20.183 9.608   89.964  1.00 36.50  ? 150 VAL H CA  1 
ATOM   1225 C C   . VAL A 1 160 ? -18.725 10.035  89.828  1.00 38.27  ? 150 VAL H C   1 
ATOM   1226 O O   . VAL A 1 160 ? -17.820 9.345   90.306  1.00 38.07  ? 150 VAL H O   1 
ATOM   1227 C CB  . VAL A 1 160 ? -20.882 10.376  91.089  1.00 37.76  ? 150 VAL H CB  1 
ATOM   1228 C CG1 . VAL A 1 160 ? -22.380 10.127  91.134  1.00 37.99  ? 150 VAL H CG1 1 
ATOM   1229 C CG2 . VAL A 1 160 ? -20.261 10.117  92.456  1.00 40.64  ? 150 VAL H CG2 1 
ATOM   1230 N N   . THR A 1 161 ? -18.491 11.196  89.217  1.00 35.86  ? 151 THR H N   1 
ATOM   1231 C CA  . THR A 1 161 ? -17.170 11.796  89.251  1.00 37.20  ? 151 THR H CA  1 
ATOM   1232 C C   . THR A 1 161 ? -17.329 13.162  89.893  1.00 39.36  ? 151 THR H C   1 
ATOM   1233 O O   . THR A 1 161 ? -18.412 13.746  89.801  1.00 37.63  ? 151 THR H O   1 
ATOM   1234 C CB  . THR A 1 161 ? -16.532 11.909  87.870  1.00 39.39  ? 151 THR H CB  1 
ATOM   1235 O OG1 . THR A 1 161 ? -17.312 12.815  87.110  1.00 39.10  ? 151 THR H OG1 1 
ATOM   1236 C CG2 . THR A 1 161 ? -16.442 10.574  87.158  1.00 42.93  ? 151 THR H CG2 1 
ATOM   1237 N N   . VAL A 1 162 ? -16.266 13.634  90.554  1.00 41.13  ? 152 VAL H N   1 
ATOM   1238 C CA  . VAL A 1 162 ? -16.308 14.943  91.195  1.00 38.22  ? 152 VAL H CA  1 
ATOM   1239 C C   . VAL A 1 162 ? -15.021 15.676  90.843  1.00 39.12  ? 152 VAL H C   1 
ATOM   1240 O O   . VAL A 1 162 ? -13.939 15.153  91.045  1.00 41.00  ? 152 VAL H O   1 
ATOM   1241 C CB  . VAL A 1 162 ? -16.505 14.874  92.715  1.00 42.26  ? 152 VAL H CB  1 
ATOM   1242 C CG1 . VAL A 1 162 ? -16.564 16.275  93.305  1.00 45.26  ? 152 VAL H CG1 1 
ATOM   1243 C CG2 . VAL A 1 162 ? -17.760 14.088  93.103  1.00 43.21  ? 152 VAL H CG2 1 
ATOM   1244 N N   . SER A 1 163 ? -15.142 16.861  90.269  1.00 40.84  ? 153 SER H N   1 
ATOM   1245 C CA  . SER A 1 163 ? -13.981 17.735  90.153  1.00 39.74  ? 153 SER H CA  1 
ATOM   1246 C C   . SER A 1 163 ? -14.238 18.980  90.996  1.00 41.94  ? 153 SER H C   1 
ATOM   1247 O O   . SER A 1 163 ? -15.367 19.221  91.408  1.00 39.87  ? 153 SER H O   1 
ATOM   1248 C CB  . SER A 1 163 ? -13.694 18.079  88.707  1.00 39.17  ? 153 SER H CB  1 
ATOM   1249 O OG  . SER A 1 163 ? -14.764 18.806  88.127  1.00 39.53  ? 153 SER H OG  1 
ATOM   1250 N N   . TRP A 1 164 ? -13.181 19.769  91.205  1.00 40.51  ? 154 TRP H N   1 
ATOM   1251 C CA  . TRP A 1 164 ? -13.274 21.006  91.959  1.00 44.33  ? 154 TRP H CA  1 
ATOM   1252 C C   . TRP A 1 164 ? -12.805 22.161  91.080  1.00 41.75  ? 154 TRP H C   1 
ATOM   1253 O O   . TRP A 1 164 ? -11.703 22.092  90.529  1.00 44.48  ? 154 TRP H O   1 
ATOM   1254 C CB  . TRP A 1 164 ? -12.453 20.891  93.258  1.00 44.00  ? 154 TRP H CB  1 
ATOM   1255 C CG  . TRP A 1 164 ? -13.142 20.034  94.275  1.00 42.33  ? 154 TRP H CG  1 
ATOM   1256 C CD1 . TRP A 1 164 ? -13.005 18.688  94.454  1.00 43.04  ? 154 TRP H CD1 1 
ATOM   1257 C CD2 . TRP A 1 164 ? -14.161 20.467  95.197  1.00 39.35  ? 154 TRP H CD2 1 
ATOM   1258 N NE1 . TRP A 1 164 ? -13.831 18.256  95.455  1.00 41.68  ? 154 TRP H NE1 1 
ATOM   1259 C CE2 . TRP A 1 164 ? -14.541 19.328  95.940  1.00 40.52  ? 154 TRP H CE2 1 
ATOM   1260 C CE3 . TRP A 1 164 ? -14.757 21.701  95.480  1.00 38.29  ? 154 TRP H CE3 1 
ATOM   1261 C CZ2 . TRP A 1 164 ? -15.524 19.381  96.923  1.00 41.29  ? 154 TRP H CZ2 1 
ATOM   1262 C CZ3 . TRP A 1 164 ? -15.710 21.765  96.467  1.00 44.99  ? 154 TRP H CZ3 1 
ATOM   1263 C CH2 . TRP A 1 164 ? -16.102 20.610  97.168  1.00 43.80  ? 154 TRP H CH2 1 
ATOM   1264 N N   . ASN A 1 165 ? -13.650 23.195  90.978  1.00 44.29  ? 155 ASN H N   1 
ATOM   1265 C CA  . ASN A 1 165 ? -13.331 24.389  90.207  1.00 51.54  ? 155 ASN H CA  1 
ATOM   1266 C C   . ASN A 1 165 ? -12.906 23.984  88.797  1.00 51.98  ? 155 ASN H C   1 
ATOM   1267 O O   . ASN A 1 165 ? -11.851 24.402  88.311  1.00 46.45  ? 155 ASN H O   1 
ATOM   1268 C CB  . ASN A 1 165 ? -12.273 25.242  90.915  1.00 52.20  ? 155 ASN H CB  1 
ATOM   1269 C CG  . ASN A 1 165 ? -12.797 25.856  92.190  1.00 52.12  ? 155 ASN H CG  1 
ATOM   1270 O OD1 . ASN A 1 165 ? -14.010 25.895  92.419  1.00 48.71  ? 155 ASN H OD1 1 
ATOM   1271 N ND2 . ASN A 1 165 ? -11.903 26.421  92.990  1.00 58.12  ? 155 ASN H ND2 1 
ATOM   1272 N N   . SER A 1 166 ? -13.710 23.098  88.189  1.00 48.61  ? 156 SER H N   1 
ATOM   1273 C CA  . SER A 1 166 ? -13.488 22.568  86.845  1.00 46.97  ? 156 SER H CA  1 
ATOM   1274 C C   . SER A 1 166 ? -12.105 21.944  86.648  1.00 50.43  ? 156 SER H C   1 
ATOM   1275 O O   . SER A 1 166 ? -11.593 21.893  85.536  1.00 52.64  ? 156 SER H O   1 
ATOM   1276 C CB  . SER A 1 166 ? -13.818 23.615  85.816  1.00 48.73  ? 156 SER H CB  1 
ATOM   1277 O OG  . SER A 1 166 ? -15.110 24.157  86.073  1.00 47.57  ? 156 SER H OG  1 
ATOM   1278 N N   . GLY A 1 167 ? -11.504 21.398  87.713  1.00 46.47  ? 157 GLY H N   1 
ATOM   1279 C CA  . GLY A 1 167 ? -10.250 20.679  87.589  1.00 47.01  ? 157 GLY H CA  1 
ATOM   1280 C C   . GLY A 1 167 ? -9.036  21.544  87.933  1.00 52.77  ? 157 GLY H C   1 
ATOM   1281 O O   . GLY A 1 167 ? -7.908  21.047  87.917  1.00 57.50  ? 157 GLY H O   1 
ATOM   1282 N N   . ALA A 1 168 ? -9.271  22.817  88.283  1.00 51.01  ? 158 ALA H N   1 
ATOM   1283 C CA  . ALA A 1 168 ? -8.202  23.725  88.690  1.00 53.78  ? 158 ALA H CA  1 
ATOM   1284 C C   . ALA A 1 168 ? -7.704  23.377  90.092  1.00 57.59  ? 158 ALA H C   1 
ATOM   1285 O O   . ALA A 1 168 ? -6.554  23.652  90.440  1.00 52.51  ? 158 ALA H O   1 
ATOM   1286 C CB  . ALA A 1 168 ? -8.704  25.149  88.613  1.00 55.90  ? 158 ALA H CB  1 
ATOM   1287 N N   . LEU A 1 169 ? -8.570  22.767  90.906  1.00 52.62  ? 159 LEU H N   1 
ATOM   1288 C CA  . LEU A 1 169 ? -8.182  22.384  92.254  1.00 46.55  ? 159 LEU H CA  1 
ATOM   1289 C C   . LEU A 1 169 ? -8.109  20.865  92.344  1.00 52.74  ? 159 LEU H C   1 
ATOM   1290 O O   . LEU A 1 169 ? -9.136  20.201  92.199  1.00 48.42  ? 159 LEU H O   1 
ATOM   1291 C CB  . LEU A 1 169 ? -9.205  23.022  93.199  1.00 49.25  ? 159 LEU H CB  1 
ATOM   1292 C CG  . LEU A 1 169 ? -9.151  22.581  94.666  1.00 50.14  ? 159 LEU H CG  1 
ATOM   1293 C CD1 . LEU A 1 169 ? -7.749  22.809  95.262  1.00 53.61  ? 159 LEU H CD1 1 
ATOM   1294 C CD2 . LEU A 1 169 ? -10.210 23.263  95.492  1.00 50.59  ? 159 LEU H CD2 1 
ATOM   1295 N N   . THR A 1 170 ? -6.893  20.334  92.589  1.00 48.71  ? 160 THR H N   1 
ATOM   1296 C CA  . THR A 1 170 ? -6.630  18.901  92.640  1.00 52.03  ? 160 THR H CA  1 
ATOM   1297 C C   . THR A 1 170 ? -5.869  18.497  93.910  1.00 50.92  ? 160 THR H C   1 
ATOM   1298 O O   . THR A 1 170 ? -6.065  17.418  94.465  1.00 51.05  ? 160 THR H O   1 
ATOM   1299 C CB  . THR A 1 170 ? -5.854  18.532  91.377  1.00 59.55  ? 160 THR H CB  1 
ATOM   1300 O OG1 . THR A 1 170 ? -4.745  19.430  91.299  1.00 57.52  ? 160 THR H OG1 1 
ATOM   1301 C CG2 . THR A 1 170 ? -6.705  18.647  90.123  1.00 59.02  ? 160 THR H CG2 1 
ATOM   1302 N N   . SER A 1 171 ? -4.983  19.370  94.380  1.00 55.68  ? 161 SER H N   1 
ATOM   1303 C CA  . SER A 1 171 ? -4.219  19.143  95.596  1.00 58.34  ? 161 SER H CA  1 
ATOM   1304 C C   . SER A 1 171 ? -5.125  19.191  96.831  1.00 47.70  ? 161 SER H C   1 
ATOM   1305 O O   . SER A 1 171 ? -5.940  20.099  96.986  1.00 57.34  ? 161 SER H O   1 
ATOM   1306 C CB  . SER A 1 171 ? -3.105  20.161  95.679  1.00 60.68  ? 161 SER H CB  1 
ATOM   1307 O OG  . SER A 1 171 ? -2.432  20.040  96.916  1.00 69.07  ? 161 SER H OG  1 
ATOM   1308 N N   . GLY A 1 172 ? -5.012  18.157  97.670  1.00 54.67  ? 162 GLY H N   1 
ATOM   1309 C CA  . GLY A 1 172 ? -5.787  18.039  98.899  1.00 56.26  ? 162 GLY H CA  1 
ATOM   1310 C C   . GLY A 1 172 ? -7.139  17.353  98.706  1.00 52.66  ? 162 GLY H C   1 
ATOM   1311 O O   . GLY A 1 172 ? -7.878  17.146  99.665  1.00 49.24  ? 162 GLY H O   1 
ATOM   1312 N N   . VAL A 1 173 ? -7.463  16.970  97.465  1.00 47.67  ? 163 VAL H N   1 
ATOM   1313 C CA  . VAL A 1 173 ? -8.787  16.436  97.186  1.00 46.77  ? 163 VAL H CA  1 
ATOM   1314 C C   . VAL A 1 173 ? -8.779  14.976  97.603  1.00 49.15  ? 163 VAL H C   1 
ATOM   1315 O O   . VAL A 1 173 ? -7.859  14.251  97.251  1.00 45.73  ? 163 VAL H O   1 
ATOM   1316 C CB  . VAL A 1 173 ? -9.199  16.591  95.706  1.00 45.59  ? 163 VAL H CB  1 
ATOM   1317 C CG1 . VAL A 1 173 ? -10.514 15.876  95.414  1.00 44.37  ? 163 VAL H CG1 1 
ATOM   1318 C CG2 . VAL A 1 173 ? -9.305  18.057  95.325  1.00 44.30  ? 163 VAL H CG2 1 
ATOM   1319 N N   . HIS A 1 174 ? -9.781  14.582  98.386  1.00 44.24  ? 164 HIS H N   1 
ATOM   1320 C CA  . HIS A 1 174 ? -10.056 13.182  98.630  1.00 46.70  ? 164 HIS H CA  1 
ATOM   1321 C C   . HIS A 1 174 ? -11.501 12.899  98.245  1.00 44.86  ? 164 HIS H C   1 
ATOM   1322 O O   . HIS A 1 174 ? -12.425 13.367  98.908  1.00 44.00  ? 164 HIS H O   1 
ATOM   1323 C CB  . HIS A 1 174 ? -9.803  12.780  100.094 1.00 46.50  ? 164 HIS H CB  1 
ATOM   1324 C CG  . HIS A 1 174 ? -8.393  12.957  100.553 1.00 52.91  ? 164 HIS H CG  1 
ATOM   1325 N ND1 . HIS A 1 174 ? -7.348  12.212  100.052 1.00 53.11  ? 164 HIS H ND1 1 
ATOM   1326 C CD2 . HIS A 1 174 ? -7.852  13.787  101.466 1.00 55.55  ? 164 HIS H CD2 1 
ATOM   1327 C CE1 . HIS A 1 174 ? -6.218  12.593  100.630 1.00 54.24  ? 164 HIS H CE1 1 
ATOM   1328 N NE2 . HIS A 1 174 ? -6.504  13.541  101.493 1.00 57.16  ? 164 HIS H NE2 1 
ATOM   1329 N N   . THR A 1 175 ? -11.708 12.143  97.153  1.00 48.31  ? 165 THR H N   1 
ATOM   1330 C CA  . THR A 1 175 ? -13.050 11.670  96.842  1.00 43.82  ? 165 THR H CA  1 
ATOM   1331 C C   . THR A 1 175 ? -13.146 10.241  97.355  1.00 41.97  ? 165 THR H C   1 
ATOM   1332 O O   . THR A 1 175 ? -12.400 9.373   96.908  1.00 46.67  ? 165 THR H O   1 
ATOM   1333 C CB  . THR A 1 175 ? -13.340 11.798  95.334  1.00 46.03  ? 165 THR H CB  1 
ATOM   1334 O OG1 . THR A 1 175 ? -13.199 13.191  95.061  1.00 45.84  ? 165 THR H OG1 1 
ATOM   1335 C CG2 . THR A 1 175 ? -14.743 11.353  94.953  1.00 45.84  ? 165 THR H CG2 1 
ATOM   1336 N N   . PHE A 1 176 ? -14.063 9.993   98.282  1.00 42.55  ? 166 PHE H N   1 
ATOM   1337 C CA  . PHE A 1 176 ? -14.172 8.698   98.936  1.00 44.63  ? 166 PHE H CA  1 
ATOM   1338 C C   . PHE A 1 176 ? -14.830 7.681   98.013  1.00 47.49  ? 166 PHE H C   1 
ATOM   1339 O O   . PHE A 1 176 ? -15.643 8.014   97.146  1.00 43.90  ? 166 PHE H O   1 
ATOM   1340 C CB  . PHE A 1 176 ? -14.957 8.806   100.256 1.00 44.64  ? 166 PHE H CB  1 
ATOM   1341 C CG  . PHE A 1 176 ? -14.150 9.564   101.292 1.00 46.68  ? 166 PHE H CG  1 
ATOM   1342 C CD1 . PHE A 1 176 ? -13.162 8.908   102.022 1.00 49.54  ? 166 PHE H CD1 1 
ATOM   1343 C CD2 . PHE A 1 176 ? -14.315 10.933  101.479 1.00 43.63  ? 166 PHE H CD2 1 
ATOM   1344 C CE1 . PHE A 1 176 ? -12.354 9.616   102.895 1.00 45.93  ? 166 PHE H CE1 1 
ATOM   1345 C CE2 . PHE A 1 176 ? -13.501 11.638  102.358 1.00 45.92  ? 166 PHE H CE2 1 
ATOM   1346 C CZ  . PHE A 1 176 ? -12.526 10.975  103.069 1.00 48.03  ? 166 PHE H CZ  1 
ATOM   1347 N N   . PRO A 1 177 ? -14.500 6.388   98.199  1.00 44.11  ? 167 PRO H N   1 
ATOM   1348 C CA  . PRO A 1 177 ? -15.301 5.308   97.643  1.00 45.94  ? 167 PRO H CA  1 
ATOM   1349 C C   . PRO A 1 177 ? -16.762 5.470   98.037  1.00 41.61  ? 167 PRO H C   1 
ATOM   1350 O O   . PRO A 1 177 ? -17.084 5.807   99.179  1.00 42.90  ? 167 PRO H O   1 
ATOM   1351 C CB  . PRO A 1 177 ? -14.692 4.042   98.303  1.00 44.12  ? 167 PRO H CB  1 
ATOM   1352 C CG  . PRO A 1 177 ? -13.297 4.436   98.646  1.00 45.84  ? 167 PRO H CG  1 
ATOM   1353 C CD  . PRO A 1 177 ? -13.356 5.908   98.990  1.00 44.17  ? 167 PRO H CD  1 
ATOM   1354 N N   . ALA A 1 178 ? -17.645 5.130   97.103  1.00 41.67  ? 168 ALA H N   1 
ATOM   1355 C CA  . ALA A 1 178 ? -19.062 5.114   97.380  1.00 44.01  ? 168 ALA H CA  1 
ATOM   1356 C C   . ALA A 1 178 ? -19.371 4.005   98.366  1.00 45.69  ? 168 ALA H C   1 
ATOM   1357 O O   . ALA A 1 178 ? -18.702 2.971   98.409  1.00 45.65  ? 168 ALA H O   1 
ATOM   1358 C CB  . ALA A 1 178 ? -19.848 4.893   96.104  1.00 49.09  ? 168 ALA H CB  1 
ATOM   1359 N N   . VAL A 1 179 ? -20.429 4.241   99.114  1.00 41.98  ? 169 VAL H N   1 
ATOM   1360 C CA  . VAL A 1 179 ? -21.008 3.234   99.972  1.00 52.07  ? 169 VAL H CA  1 
ATOM   1361 C C   . VAL A 1 179 ? -22.430 2.949   99.524  1.00 47.63  ? 169 VAL H C   1 
ATOM   1362 O O   . VAL A 1 179 ? -23.173 3.878   99.199  1.00 45.87  ? 169 VAL H O   1 
ATOM   1363 C CB  . VAL A 1 179 ? -20.974 3.785   101.408 1.00 55.61  ? 169 VAL H CB  1 
ATOM   1364 C CG1 . VAL A 1 179 ? -21.819 2.939   102.334 1.00 61.45  ? 169 VAL H CG1 1 
ATOM   1365 C CG2 . VAL A 1 179 ? -19.548 3.901   101.922 1.00 55.31  ? 169 VAL H CG2 1 
ATOM   1366 N N   . LEU A 1 180 ? -22.817 1.668   99.594  1.00 44.97  ? 170 LEU H N   1 
ATOM   1367 C CA  . LEU A 1 180 ? -24.180 1.252   99.306  1.00 45.04  ? 170 LEU H CA  1 
ATOM   1368 C C   . LEU A 1 180 ? -25.043 1.426   100.552 1.00 47.61  ? 170 LEU H C   1 
ATOM   1369 O O   . LEU A 1 180 ? -24.730 0.882   101.589 1.00 48.91  ? 170 LEU H O   1 
ATOM   1370 C CB  . LEU A 1 180 ? -24.153 -0.190  98.793  1.00 48.08  ? 170 LEU H CB  1 
ATOM   1371 C CG  . LEU A 1 180 ? -25.498 -0.831  98.424  1.00 51.89  ? 170 LEU H CG  1 
ATOM   1372 C CD1 . LEU A 1 180 ? -26.319 -0.096  97.394  1.00 52.42  ? 170 LEU H CD1 1 
ATOM   1373 C CD2 . LEU A 1 180 ? -25.218 -2.234  97.911  1.00 53.70  ? 170 LEU H CD2 1 
ATOM   1374 N N   . GLN A 1 181 ? -26.109 2.223   100.447 1.00 50.21  ? 171 GLN H N   1 
ATOM   1375 C CA  . GLN A 1 181 ? -27.000 2.512   101.557 1.00 47.26  ? 171 GLN H CA  1 
ATOM   1376 C C   . GLN A 1 181 ? -28.045 1.396   101.614 1.00 53.22  ? 171 GLN H C   1 
ATOM   1377 O O   . GLN A 1 181 ? -28.219 0.649   100.657 1.00 50.02  ? 171 GLN H O   1 
ATOM   1378 C CB  . GLN A 1 181 ? -27.641 3.895   101.408 1.00 50.10  ? 171 GLN H CB  1 
ATOM   1379 C CG  . GLN A 1 181 ? -26.627 5.043   101.390 1.00 58.01  ? 171 GLN H CG  1 
ATOM   1380 C CD  . GLN A 1 181 ? -27.184 6.388   100.951 1.00 63.81  ? 171 GLN H CD  1 
ATOM   1381 O OE1 . GLN A 1 181 ? -27.238 7.355   101.727 1.00 54.06  ? 171 GLN H OE1 1 
ATOM   1382 N NE2 . GLN A 1 181 ? -27.558 6.491   99.683  1.00 59.61  ? 171 GLN H NE2 1 
ATOM   1383 N N   . SER A 1 182 ? -28.760 1.311   102.743 1.00 56.07  ? 172 SER H N   1 
ATOM   1384 C CA  . SER A 1 182 ? -29.769 0.280   102.944 1.00 61.37  ? 172 SER H CA  1 
ATOM   1385 C C   . SER A 1 182 ? -30.884 0.427   101.908 1.00 60.08  ? 172 SER H C   1 
ATOM   1386 O O   . SER A 1 182 ? -31.518 -0.559  101.540 1.00 62.50  ? 172 SER H O   1 
ATOM   1387 C CB  . SER A 1 182 ? -30.308 0.324   104.357 1.00 66.18  ? 172 SER H CB  1 
ATOM   1388 O OG  . SER A 1 182 ? -30.981 1.552   104.609 1.00 71.54  ? 172 SER H OG  1 
ATOM   1389 N N   . SER A 1 183 ? -31.057 1.655   101.392 1.00 52.02  ? 173 SER H N   1 
ATOM   1390 C CA  . SER A 1 183 ? -32.055 1.989   100.382 1.00 53.94  ? 173 SER H CA  1 
ATOM   1391 C C   . SER A 1 183 ? -31.761 1.362   99.023  1.00 49.45  ? 173 SER H C   1 
ATOM   1392 O O   . SER A 1 183 ? -32.620 1.417   98.146  1.00 55.42  ? 173 SER H O   1 
ATOM   1393 C CB  . SER A 1 183 ? -32.156 3.494   100.218 1.00 53.75  ? 173 SER H CB  1 
ATOM   1394 O OG  . SER A 1 183 ? -30.891 4.037   99.849  1.00 51.33  ? 173 SER H OG  1 
ATOM   1395 N N   . GLY A 1 184 ? -30.544 0.830   98.826  1.00 49.53  ? 174 GLY H N   1 
ATOM   1396 C CA  . GLY A 1 184 ? -30.099 0.352   97.523  1.00 48.81  ? 174 GLY H CA  1 
ATOM   1397 C C   . GLY A 1 184 ? -29.436 1.440   96.665  1.00 46.76  ? 174 GLY H C   1 
ATOM   1398 O O   . GLY A 1 184 ? -29.016 1.147   95.544  1.00 44.95  ? 174 GLY H O   1 
ATOM   1399 N N   . LEU A 1 185 ? -29.370 2.676   97.180  1.00 43.83  ? 175 LEU H N   1 
ATOM   1400 C CA  . LEU A 1 185 ? -28.714 3.788   96.505  1.00 45.60  ? 175 LEU H CA  1 
ATOM   1401 C C   . LEU A 1 185 ? -27.322 4.004   97.079  1.00 48.01  ? 175 LEU H C   1 
ATOM   1402 O O   . LEU A 1 185 ? -27.095 3.710   98.242  1.00 50.67  ? 175 LEU H O   1 
ATOM   1403 C CB  . LEU A 1 185 ? -29.553 5.057   96.656  1.00 43.43  ? 175 LEU H CB  1 
ATOM   1404 C CG  . LEU A 1 185 ? -30.997 4.969   96.155  1.00 47.34  ? 175 LEU H CG  1 
ATOM   1405 C CD1 . LEU A 1 185 ? -31.770 6.218   96.558  1.00 53.25  ? 175 LEU H CD1 1 
ATOM   1406 C CD2 . LEU A 1 185 ? -31.078 4.790   94.659  1.00 45.76  ? 175 LEU H CD2 1 
ATOM   1407 N N   . TYR A 1 186 ? -26.424 4.609   96.277  1.00 40.58  ? 176 TYR H N   1 
ATOM   1408 C CA  . TYR A 1 186 ? -25.067 4.902   96.688  1.00 39.29  ? 176 TYR H CA  1 
ATOM   1409 C C   . TYR A 1 186 ? -24.960 6.337   97.198  1.00 39.16  ? 176 TYR H C   1 
ATOM   1410 O O   . TYR A 1 186 ? -25.780 7.198   96.872  1.00 40.79  ? 176 TYR H O   1 
ATOM   1411 C CB  . TYR A 1 186 ? -24.116 4.720   95.497  1.00 40.05  ? 176 TYR H CB  1 
ATOM   1412 C CG  . TYR A 1 186 ? -23.974 3.260   95.083  1.00 39.19  ? 176 TYR H CG  1 
ATOM   1413 C CD1 . TYR A 1 186 ? -24.830 2.705   94.143  1.00 40.21  ? 176 TYR H CD1 1 
ATOM   1414 C CD2 . TYR A 1 186 ? -23.009 2.445   95.650  1.00 42.25  ? 176 TYR H CD2 1 
ATOM   1415 C CE1 . TYR A 1 186 ? -24.766 1.367   93.819  1.00 40.56  ? 176 TYR H CE1 1 
ATOM   1416 C CE2 . TYR A 1 186 ? -22.897 1.109   95.298  1.00 42.08  ? 176 TYR H CE2 1 
ATOM   1417 C CZ  . TYR A 1 186 ? -23.786 0.574   94.384  1.00 46.81  ? 176 TYR H CZ  1 
ATOM   1418 O OH  . TYR A 1 186 ? -23.784 -0.725  93.985  1.00 42.56  ? 176 TYR H OH  1 
ATOM   1419 N N   . SER A 1 187 ? -23.916 6.581   97.981  1.00 38.64  ? 177 SER H N   1 
ATOM   1420 C CA  . SER A 1 187 ? -23.589 7.910   98.481  1.00 41.42  ? 177 SER H CA  1 
ATOM   1421 C C   . SER A 1 187 ? -22.077 8.049   98.604  1.00 41.07  ? 177 SER H C   1 
ATOM   1422 O O   . SER A 1 187 ? -21.397 7.094   98.971  1.00 43.04  ? 177 SER H O   1 
ATOM   1423 C CB  . SER A 1 187 ? -24.267 8.110   99.805  1.00 45.07  ? 177 SER H CB  1 
ATOM   1424 O OG  . SER A 1 187 ? -24.152 9.451   100.231 1.00 52.93  ? 177 SER H OG  1 
ATOM   1425 N N   . LEU A 1 188 ? -21.532 9.247   98.381  1.00 38.85  ? 178 LEU H N   1 
ATOM   1426 C CA  . LEU A 1 188 ? -20.125 9.492   98.644  1.00 42.29  ? 178 LEU H CA  1 
ATOM   1427 C C   . LEU A 1 188 ? -19.924 10.974  98.954  1.00 42.69  ? 178 LEU H C   1 
ATOM   1428 O O   . LEU A 1 188 ? -20.798 11.784  98.649  1.00 39.68  ? 178 LEU H O   1 
ATOM   1429 C CB  . LEU A 1 188 ? -19.173 8.976   97.549  1.00 45.13  ? 178 LEU H CB  1 
ATOM   1430 C CG  . LEU A 1 188 ? -19.138 9.648   96.170  1.00 42.13  ? 178 LEU H CG  1 
ATOM   1431 C CD1 . LEU A 1 188 ? -18.502 11.062  96.156  1.00 43.29  ? 178 LEU H CD1 1 
ATOM   1432 C CD2 . LEU A 1 188 ? -18.409 8.797   95.132  1.00 44.23  ? 178 LEU H CD2 1 
ATOM   1433 N N   . SER A 1 189 ? -18.798 11.294  99.621  1.00 40.09  ? 179 SER H N   1 
ATOM   1434 C CA  . SER A 1 189 ? -18.353 12.664  99.774  1.00 42.12  ? 179 SER H CA  1 
ATOM   1435 C C   . SER A 1 189 ? -17.022 12.874  99.059  1.00 41.49  ? 179 SER H C   1 
ATOM   1436 O O   . SER A 1 189 ? -16.220 11.955  98.924  1.00 44.61  ? 179 SER H O   1 
ATOM   1437 C CB  . SER A 1 189 ? -18.242 13.023  101.247 1.00 43.35  ? 179 SER H CB  1 
ATOM   1438 O OG  . SER A 1 189 ? -19.537 13.199  101.802 1.00 45.99  ? 179 SER H OG  1 
ATOM   1439 N N   . SER A 1 190 ? -16.816 14.102  98.598  1.00 40.39  ? 180 SER H N   1 
ATOM   1440 C CA  . SER A 1 190 ? -15.535 14.578  98.127  1.00 40.55  ? 180 SER H CA  1 
ATOM   1441 C C   . SER A 1 190 ? -15.159 15.774  98.989  1.00 44.90  ? 180 SER H C   1 
ATOM   1442 O O   . SER A 1 190 ? -15.998 16.666  99.167  1.00 40.58  ? 180 SER H O   1 
ATOM   1443 C CB  . SER A 1 190 ? -15.637 14.992  96.671  1.00 41.32  ? 180 SER H CB  1 
ATOM   1444 O OG  . SER A 1 190 ? -14.387 15.444  96.182  1.00 42.24  ? 180 SER H OG  1 
ATOM   1445 N N   . VAL A 1 191 ? -13.907 15.785  99.471  1.00 45.16  ? 181 VAL H N   1 
ATOM   1446 C CA  . VAL A 1 191 ? -13.437 16.835  100.361 1.00 46.78  ? 181 VAL H CA  1 
ATOM   1447 C C   . VAL A 1 191 ? -12.122 17.395  99.846  1.00 44.25  ? 181 VAL H C   1 
ATOM   1448 O O   . VAL A 1 191 ? -11.370 16.730  99.119  1.00 44.98  ? 181 VAL H O   1 
ATOM   1449 C CB  . VAL A 1 191 ? -13.280 16.400  101.825 1.00 44.16  ? 181 VAL H CB  1 
ATOM   1450 C CG1 . VAL A 1 191 ? -14.614 15.960  102.391 1.00 44.45  ? 181 VAL H CG1 1 
ATOM   1451 C CG2 . VAL A 1 191 ? -12.194 15.346  101.978 1.00 45.40  ? 181 VAL H CG2 1 
ATOM   1452 N N   . VAL A 1 192 ? -11.862 18.644  100.246 1.00 44.77  ? 182 VAL H N   1 
ATOM   1453 C CA  . VAL A 1 192 ? -10.593 19.294  99.958  1.00 49.29  ? 182 VAL H CA  1 
ATOM   1454 C C   . VAL A 1 192 ? -10.222 20.216  101.127 1.00 49.80  ? 182 VAL H C   1 
ATOM   1455 O O   . VAL A 1 192 ? -11.099 20.770  101.788 1.00 49.24  ? 182 VAL H O   1 
ATOM   1456 C CB  . VAL A 1 192 ? -10.699 20.051  98.617  1.00 46.96  ? 182 VAL H CB  1 
ATOM   1457 C CG1 . VAL A 1 192 ? -11.798 21.110  98.611  1.00 45.15  ? 182 VAL H CG1 1 
ATOM   1458 C CG2 . VAL A 1 192 ? -9.364  20.646  98.186  1.00 52.58  ? 182 VAL H CG2 1 
ATOM   1459 N N   . THR A 1 193 ? -8.914  20.398  101.336 1.00 51.90  ? 183 THR H N   1 
ATOM   1460 C CA  . THR A 1 193 ? -8.406  21.363  102.303 1.00 53.61  ? 183 THR H CA  1 
ATOM   1461 C C   . THR A 1 193 ? -7.791  22.524  101.536 1.00 54.76  ? 183 THR H C   1 
ATOM   1462 O O   . THR A 1 193 ? -7.106  22.314  100.528 1.00 57.64  ? 183 THR H O   1 
ATOM   1463 C CB  . THR A 1 193 ? -7.391  20.701  103.234 1.00 55.53  ? 183 THR H CB  1 
ATOM   1464 O OG1 . THR A 1 193 ? -6.422  20.153  102.354 1.00 58.51  ? 183 THR H OG1 1 
ATOM   1465 C CG2 . THR A 1 193 ? -8.007  19.594  104.052 1.00 52.76  ? 183 THR H CG2 1 
ATOM   1466 N N   . VAL A 1 194 ? -8.090  23.741  102.013 1.00 56.85  ? 184 VAL H N   1 
ATOM   1467 C CA  . VAL A 1 194 ? -7.674  24.974  101.368 1.00 59.53  ? 184 VAL H CA  1 
ATOM   1468 C C   . VAL A 1 194 ? -7.172  25.955  102.435 1.00 60.11  ? 184 VAL H C   1 
ATOM   1469 O O   . VAL A 1 194 ? -7.434  25.760  103.629 1.00 61.62  ? 184 VAL H O   1 
ATOM   1470 C CB  . VAL A 1 194 ? -8.833  25.567  100.543 1.00 55.69  ? 184 VAL H CB  1 
ATOM   1471 C CG1 . VAL A 1 194 ? -9.275  24.618  99.426  1.00 58.40  ? 184 VAL H CG1 1 
ATOM   1472 C CG2 . VAL A 1 194 ? -10.022 25.957  101.411 1.00 58.15  ? 184 VAL H CG2 1 
ATOM   1473 N N   . PRO A 1 195 ? -6.450  27.038  102.048 1.00 61.75  ? 185 PRO H N   1 
ATOM   1474 C CA  . PRO A 1 195 ? -6.142  28.126  102.986 1.00 61.68  ? 185 PRO H CA  1 
ATOM   1475 C C   . PRO A 1 195 ? -7.395  28.777  103.577 1.00 58.37  ? 185 PRO H C   1 
ATOM   1476 O O   . PRO A 1 195 ? -8.278  29.211  102.832 1.00 59.37  ? 185 PRO H O   1 
ATOM   1477 C CB  . PRO A 1 195 ? -5.313  29.116  102.146 1.00 63.78  ? 185 PRO H CB  1 
ATOM   1478 C CG  . PRO A 1 195 ? -4.774  28.289  100.986 1.00 68.06  ? 185 PRO H CG  1 
ATOM   1479 C CD  . PRO A 1 195 ? -5.853  27.248  100.716 1.00 69.04  ? 185 PRO H CD  1 
ATOM   1480 N N   . SER A 1 196 ? -7.474  28.825  104.920 1.00 62.87  ? 186 SER H N   1 
ATOM   1481 C CA  . SER A 1 196 ? -8.552  29.513  105.621 1.00 61.74  ? 186 SER H CA  1 
ATOM   1482 C C   . SER A 1 196 ? -8.604  30.970  105.190 1.00 63.30  ? 186 SER H C   1 
ATOM   1483 O O   . SER A 1 196 ? -9.678  31.569  105.136 1.00 66.09  ? 186 SER H O   1 
ATOM   1484 C CB  . SER A 1 196 ? -8.398  29.439  107.115 1.00 68.80  ? 186 SER H CB  1 
ATOM   1485 O OG  . SER A 1 196 ? -8.927  28.227  107.628 1.00 80.39  ? 186 SER H OG  1 
ATOM   1486 N N   . SER A 1 197 ? -7.421  31.533  104.928 1.00 61.73  ? 187 SER H N   1 
ATOM   1487 C CA  . SER A 1 197 ? -7.299  32.887  104.404 1.00 72.37  ? 187 SER H CA  1 
ATOM   1488 C C   . SER A 1 197 ? -8.120  33.077  103.121 1.00 72.77  ? 187 SER H C   1 
ATOM   1489 O O   . SER A 1 197 ? -8.621  34.167  102.872 1.00 70.61  ? 187 SER H O   1 
ATOM   1490 C CB  . SER A 1 197 ? -5.830  33.248  104.207 1.00 66.12  ? 187 SER H CB  1 
ATOM   1491 O OG  . SER A 1 197 ? -5.010  32.091  104.094 1.00 73.45  ? 187 SER H OG  1 
ATOM   1492 N N   . SER A 1 198 ? -8.306  32.009  102.328 1.00 78.28  ? 188 SER H N   1 
ATOM   1493 C CA  . SER A 1 198 ? -8.881  32.129  100.996 1.00 74.06  ? 188 SER H CA  1 
ATOM   1494 C C   . SER A 1 198 ? -10.412 32.096  101.003 1.00 70.66  ? 188 SER H C   1 
ATOM   1495 O O   . SER A 1 198 ? -11.023 32.356  99.971  1.00 79.51  ? 188 SER H O   1 
ATOM   1496 C CB  . SER A 1 198 ? -8.327  31.054  100.096 1.00 77.82  ? 188 SER H CB  1 
ATOM   1497 O OG  . SER A 1 198 ? -8.746  29.760  100.521 1.00 70.72  ? 188 SER H OG  1 
ATOM   1498 N N   . LEU A 1 199 ? -11.043 31.793  102.146 1.00 67.14  ? 189 LEU H N   1 
ATOM   1499 C CA  . LEU A 1 199 ? -12.468 31.482  102.175 1.00 64.89  ? 189 LEU H CA  1 
ATOM   1500 C C   . LEU A 1 199 ? -13.318 32.701  101.834 1.00 67.69  ? 189 LEU H C   1 
ATOM   1501 O O   . LEU A 1 199 ? -14.490 32.559  101.476 1.00 63.20  ? 189 LEU H O   1 
ATOM   1502 C CB  . LEU A 1 199 ? -12.898 30.915  103.524 1.00 59.90  ? 189 LEU H CB  1 
ATOM   1503 C CG  . LEU A 1 199 ? -12.425 29.498  103.857 1.00 69.49  ? 189 LEU H CG  1 
ATOM   1504 C CD1 . LEU A 1 199 ? -12.990 29.034  105.194 1.00 65.01  ? 189 LEU H CD1 1 
ATOM   1505 C CD2 . LEU A 1 199 ? -12.790 28.512  102.752 1.00 71.42  ? 189 LEU H CD2 1 
ATOM   1506 N N   . GLY A 1 200 ? -12.745 33.900  101.969 1.00 71.16  ? 190 GLY H N   1 
ATOM   1507 C CA  . GLY A 1 200 ? -13.504 35.119  101.745 1.00 72.57  ? 190 GLY H CA  1 
ATOM   1508 C C   . GLY A 1 200 ? -13.493 35.556  100.282 1.00 74.52  ? 190 GLY H C   1 
ATOM   1509 O O   . GLY A 1 200 ? -14.422 36.231  99.835  1.00 80.79  ? 190 GLY H O   1 
ATOM   1510 N N   . THR A 1 201 ? -12.437 35.180  99.547  1.00 83.48  ? 191 THR H N   1 
ATOM   1511 C CA  . THR A 1 201 ? -12.211 35.713  98.210  1.00 86.48  ? 191 THR H CA  1 
ATOM   1512 C C   . THR A 1 201 ? -12.146 34.615  97.145  1.00 78.51  ? 191 THR H C   1 
ATOM   1513 O O   . THR A 1 201 ? -12.191 34.940  95.958  1.00 84.19  ? 191 THR H O   1 
ATOM   1514 C CB  . THR A 1 201 ? -10.935 36.554  98.213  1.00 85.30  ? 191 THR H CB  1 
ATOM   1515 O OG1 . THR A 1 201 ? -9.943  35.763  98.863  1.00 82.42  ? 191 THR H OG1 1 
ATOM   1516 C CG2 . THR A 1 201 ? -11.125 37.869  98.947  1.00 85.89  ? 191 THR H CG2 1 
ATOM   1517 N N   . GLN A 1 202 ? -12.032 33.339  97.547  1.00 68.82  ? 192 GLN H N   1 
ATOM   1518 C CA  . GLN A 1 202 ? -11.891 32.255  96.580  1.00 72.71  ? 192 GLN H CA  1 
ATOM   1519 C C   . GLN A 1 202 ? -13.182 31.429  96.520  1.00 61.94  ? 192 GLN H C   1 
ATOM   1520 O O   . GLN A 1 202 ? -13.687 30.965  97.539  1.00 64.13  ? 192 GLN H O   1 
ATOM   1521 C CB  . GLN A 1 202 ? -10.664 31.408  96.906  1.00 73.12  ? 192 GLN H CB  1 
ATOM   1522 C CG  . GLN A 1 202 ? -10.411 30.270  95.922  1.00 80.87  ? 192 GLN H CG  1 
ATOM   1523 C CD  . GLN A 1 202 ? -10.138 30.740  94.510  1.00 85.43  ? 192 GLN H CD  1 
ATOM   1524 O OE1 . GLN A 1 202 ? -10.929 30.504  93.588  1.00 81.19  ? 192 GLN H OE1 1 
ATOM   1525 N NE2 . GLN A 1 202 ? -9.006  31.407  94.330  1.00 84.50  ? 192 GLN H NE2 1 
ATOM   1526 N N   . THR A 1 203 ? -13.731 31.281  95.313  1.00 57.35  ? 193 THR H N   1 
ATOM   1527 C CA  . THR A 1 203 ? -14.944 30.493  95.117  1.00 60.30  ? 193 THR H CA  1 
ATOM   1528 C C   . THR A 1 203 ? -14.569 29.010  95.062  1.00 50.04  ? 193 THR H C   1 
ATOM   1529 O O   . THR A 1 203 ? -13.526 28.662  94.518  1.00 55.33  ? 193 THR H O   1 
ATOM   1530 C CB  . THR A 1 203 ? -15.671 30.949  93.853  1.00 62.40  ? 193 THR H CB  1 
ATOM   1531 O OG1 . THR A 1 203 ? -16.300 32.144  94.296  1.00 60.62  ? 193 THR H OG1 1 
ATOM   1532 C CG2 . THR A 1 203 ? -16.747 29.980  93.401  1.00 70.62  ? 193 THR H CG2 1 
ATOM   1533 N N   . TYR A 1 204 ? -15.376 28.164  95.718  1.00 47.13  ? 194 TYR H N   1 
ATOM   1534 C CA  . TYR A 1 204 ? -15.215 26.719  95.633  1.00 48.40  ? 194 TYR H CA  1 
ATOM   1535 C C   . TYR A 1 204 ? -16.531 26.091  95.174  1.00 43.59  ? 194 TYR H C   1 
ATOM   1536 O O   . TYR A 1 204 ? -17.565 26.258  95.808  1.00 48.93  ? 194 TYR H O   1 
ATOM   1537 C CB  . TYR A 1 204 ? -14.754 26.137  96.976  1.00 50.19  ? 194 TYR H CB  1 
ATOM   1538 C CG  . TYR A 1 204 ? -13.372 26.639  97.368  1.00 49.44  ? 194 TYR H CG  1 
ATOM   1539 C CD1 . TYR A 1 204 ? -12.234 26.218  96.696  1.00 52.43  ? 194 TYR H CD1 1 
ATOM   1540 C CD2 . TYR A 1 204 ? -13.209 27.586  98.382  1.00 57.92  ? 194 TYR H CD2 1 
ATOM   1541 C CE1 . TYR A 1 204 ? -10.979 26.704  97.017  1.00 54.08  ? 194 TYR H CE1 1 
ATOM   1542 C CE2 . TYR A 1 204 ? -11.952 28.066  98.725  1.00 56.88  ? 194 TYR H CE2 1 
ATOM   1543 C CZ  . TYR A 1 204 ? -10.831 27.620  98.046  1.00 57.04  ? 194 TYR H CZ  1 
ATOM   1544 O OH  . TYR A 1 204 ? -9.579  28.080  98.369  1.00 55.85  ? 194 TYR H OH  1 
ATOM   1545 N N   . ILE A 1 205 ? -16.462 25.372  94.050  1.00 45.87  ? 195 ILE H N   1 
ATOM   1546 C CA  . ILE A 1 205 ? -17.595 24.717  93.407  1.00 42.92  ? 195 ILE H CA  1 
ATOM   1547 C C   . ILE A 1 205 ? -17.197 23.269  93.147  1.00 40.04  ? 195 ILE H C   1 
ATOM   1548 O O   . ILE A 1 205 ? -16.118 23.011  92.596  1.00 41.36  ? 195 ILE H O   1 
ATOM   1549 C CB  . ILE A 1 205 ? -17.935 25.391  92.063  1.00 46.38  ? 195 ILE H CB  1 
ATOM   1550 C CG1 . ILE A 1 205 ? -18.314 26.860  92.248  1.00 48.19  ? 195 ILE H CG1 1 
ATOM   1551 C CG2 . ILE A 1 205 ? -19.034 24.640  91.302  1.00 43.36  ? 195 ILE H CG2 1 
ATOM   1552 C CD1 . ILE A 1 205 ? -18.264 27.662  90.955  1.00 49.63  ? 195 ILE H CD1 1 
ATOM   1553 N N   . CYS A 1 206 ? -18.073 22.339  93.514  1.00 41.58  ? 196 CYS H N   1 
ATOM   1554 C CA  . CYS A 1 206 ? -17.845 20.963  93.090  1.00 39.90  ? 196 CYS H CA  1 
ATOM   1555 C C   . CYS A 1 206 ? -18.685 20.676  91.838  1.00 38.81  ? 196 CYS H C   1 
ATOM   1556 O O   . CYS A 1 206 ? -19.836 21.096  91.756  1.00 42.92  ? 196 CYS H O   1 
ATOM   1557 C CB  . CYS A 1 206 ? -18.132 19.973  94.199  1.00 37.47  ? 196 CYS H CB  1 
ATOM   1558 S SG  . CYS A 1 206 ? -19.866 19.946  94.658  1.00 42.78  ? 196 CYS H SG  1 
ATOM   1559 N N   . ASN A 1 207 ? -18.058 19.977  90.890  1.00 37.34  ? 197 ASN H N   1 
ATOM   1560 C CA  . ASN A 1 207 ? -18.644 19.677  89.598  1.00 35.06  ? 197 ASN H CA  1 
ATOM   1561 C C   . ASN A 1 207 ? -18.907 18.174  89.593  1.00 35.60  ? 197 ASN H C   1 
ATOM   1562 O O   . ASN A 1 207 ? -17.946 17.412  89.593  1.00 36.43  ? 197 ASN H O   1 
ATOM   1563 C CB  . ASN A 1 207 ? -17.741 20.088  88.446  1.00 37.98  ? 197 ASN H CB  1 
ATOM   1564 C CG  . ASN A 1 207 ? -16.929 21.346  88.695  1.00 40.05  ? 197 ASN H CG  1 
ATOM   1565 O OD1 . ASN A 1 207 ? -15.700 21.285  88.829  1.00 40.50  ? 197 ASN H OD1 1 
ATOM   1566 N ND2 . ASN A 1 207 ? -17.580 22.487  88.671  1.00 41.95  ? 197 ASN H ND2 1 
ATOM   1567 N N   . VAL A 1 208 ? -20.178 17.792  89.701  1.00 34.17  ? 198 VAL H N   1 
ATOM   1568 C CA  . VAL A 1 208 ? -20.561 16.404  89.931  1.00 38.55  ? 198 VAL H CA  1 
ATOM   1569 C C   . VAL A 1 208 ? -21.165 15.876  88.629  1.00 38.25  ? 198 VAL H C   1 
ATOM   1570 O O   . VAL A 1 208 ? -22.079 16.503  88.097  1.00 40.25  ? 198 VAL H O   1 
ATOM   1571 C CB  . VAL A 1 208 ? -21.550 16.243  91.103  1.00 38.51  ? 198 VAL H CB  1 
ATOM   1572 C CG1 . VAL A 1 208 ? -21.952 14.793  91.359  1.00 36.46  ? 198 VAL H CG1 1 
ATOM   1573 C CG2 . VAL A 1 208 ? -20.996 16.856  92.380  1.00 42.06  ? 198 VAL H CG2 1 
ATOM   1574 N N   . ASN A 1 209 ? -20.664 14.735  88.132  1.00 34.34  ? 199 ASN H N   1 
ATOM   1575 C CA  . ASN A 1 209 ? -21.248 14.112  86.956  1.00 34.59  ? 199 ASN H CA  1 
ATOM   1576 C C   . ASN A 1 209 ? -21.804 12.746  87.369  1.00 34.70  ? 199 ASN H C   1 
ATOM   1577 O O   . ASN A 1 209 ? -21.187 12.035  88.165  1.00 35.28  ? 199 ASN H O   1 
ATOM   1578 C CB  . ASN A 1 209 ? -20.249 13.918  85.823  1.00 37.22  ? 199 ASN H CB  1 
ATOM   1579 C CG  . ASN A 1 209 ? -19.751 15.198  85.185  1.00 41.57  ? 199 ASN H CG  1 
ATOM   1580 O OD1 . ASN A 1 209 ? -20.221 16.308  85.469  1.00 47.40  ? 199 ASN H OD1 1 
ATOM   1581 N ND2 . ASN A 1 209 ? -18.802 15.066  84.286  1.00 50.56  ? 199 ASN H ND2 1 
ATOM   1582 N N   . HIS A 1 210 ? -22.983 12.428  86.851  1.00 31.81  ? 200 HIS H N   1 
ATOM   1583 C CA  . HIS A 1 210 ? -23.542 11.081  86.968  1.00 33.36  ? 200 HIS H CA  1 
ATOM   1584 C C   . HIS A 1 210 ? -23.947 10.649  85.558  1.00 31.34  ? 200 HIS H C   1 
ATOM   1585 O O   . HIS A 1 210 ? -25.103 10.718  85.168  1.00 32.08  ? 200 HIS H O   1 
ATOM   1586 C CB  . HIS A 1 210 ? -24.721 11.043  87.938  1.00 34.46  ? 200 HIS H CB  1 
ATOM   1587 C CG  . HIS A 1 210 ? -25.206 9.642   88.180  1.00 35.34  ? 200 HIS H CG  1 
ATOM   1588 N ND1 . HIS A 1 210 ? -26.508 9.253   87.984  1.00 33.78  ? 200 HIS H ND1 1 
ATOM   1589 C CD2 . HIS A 1 210 ? -24.527 8.553   88.620  1.00 33.73  ? 200 HIS H CD2 1 
ATOM   1590 C CE1 . HIS A 1 210 ? -26.609 7.936   88.278  1.00 36.32  ? 200 HIS H CE1 1 
ATOM   1591 N NE2 . HIS A 1 210 ? -25.436 7.499   88.698  1.00 33.00  ? 200 HIS H NE2 1 
ATOM   1592 N N   . LYS A 1 211 ? -22.962 10.127  84.827  1.00 30.00  ? 201 LYS H N   1 
ATOM   1593 C CA  . LYS A 1 211 ? -23.143 9.796   83.437  1.00 30.33  ? 201 LYS H CA  1 
ATOM   1594 C C   . LYS A 1 211 ? -24.259 8.768   83.252  1.00 34.09  ? 201 LYS H C   1 
ATOM   1595 O O   . LYS A 1 211 ? -24.976 8.833   82.250  1.00 32.30  ? 201 LYS H O   1 
ATOM   1596 C CB  . LYS A 1 211 ? -21.796 9.343   82.842  1.00 35.53  ? 201 LYS H CB  1 
ATOM   1597 C CG  . LYS A 1 211 ? -20.743 10.412  82.724  1.00 38.69  ? 201 LYS H CG  1 
ATOM   1598 C CD  . LYS A 1 211 ? -21.029 11.543  81.751  1.00 35.50  ? 201 LYS H CD  1 
ATOM   1599 C CE  . LYS A 1 211 ? -20.026 12.677  81.734  1.00 34.64  ? 201 LYS H CE  1 
ATOM   1600 N NZ  . LYS A 1 211 ? -18.743 12.257  81.171  1.00 36.78  ? 201 LYS H NZ  1 
ATOM   1601 N N   . PRO A 1 212 ? -24.438 7.752   84.122  1.00 32.99  ? 202 PRO H N   1 
ATOM   1602 C CA  . PRO A 1 212 ? -25.507 6.768   83.863  1.00 32.95  ? 202 PRO H CA  1 
ATOM   1603 C C   . PRO A 1 212 ? -26.931 7.324   83.800  1.00 33.40  ? 202 PRO H C   1 
ATOM   1604 O O   . PRO A 1 212 ? -27.773 6.765   83.114  1.00 34.84  ? 202 PRO H O   1 
ATOM   1605 C CB  . PRO A 1 212 ? -25.332 5.774   85.017  1.00 33.43  ? 202 PRO H CB  1 
ATOM   1606 C CG  . PRO A 1 212 ? -23.860 5.867   85.398  1.00 36.25  ? 202 PRO H CG  1 
ATOM   1607 C CD  . PRO A 1 212 ? -23.550 7.365   85.243  1.00 34.60  ? 202 PRO H CD  1 
ATOM   1608 N N   . SER A 1 213 ? -27.184 8.455   84.464  1.00 33.25  ? 203 SER H N   1 
ATOM   1609 C CA  . SER A 1 213 ? -28.470 9.140   84.386  1.00 33.92  ? 203 SER H CA  1 
ATOM   1610 C C   . SER A 1 213 ? -28.435 10.337  83.444  1.00 32.50  ? 203 SER H C   1 
ATOM   1611 O O   . SER A 1 213 ? -29.407 11.072  83.368  1.00 34.13  ? 203 SER H O   1 
ATOM   1612 C CB  . SER A 1 213 ? -28.948 9.602   85.746  1.00 34.41  ? 203 SER H CB  1 
ATOM   1613 O OG  . SER A 1 213 ? -28.109 10.586  86.348  1.00 33.14  ? 203 SER H OG  1 
ATOM   1614 N N   . ASN A 1 214 ? -27.304 10.595  82.800  1.00 33.29  ? 204 ASN H N   1 
ATOM   1615 C CA  . ASN A 1 214 ? -27.129 11.741  81.923  1.00 34.19  ? 204 ASN H CA  1 
ATOM   1616 C C   . ASN A 1 214 ? -27.366 13.051  82.673  1.00 33.50  ? 204 ASN H C   1 
ATOM   1617 O O   . ASN A 1 214 ? -27.996 13.965  82.135  1.00 35.63  ? 204 ASN H O   1 
ATOM   1618 C CB  . ASN A 1 214 ? -27.980 11.620  80.660  1.00 34.15  ? 204 ASN H CB  1 
ATOM   1619 C CG  . ASN A 1 214 ? -27.760 10.334  79.895  1.00 36.06  ? 204 ASN H CG  1 
ATOM   1620 O OD1 . ASN A 1 214 ? -28.733 9.630   79.580  1.00 46.25  ? 204 ASN H OD1 1 
ATOM   1621 N ND2 . ASN A 1 214 ? -26.546 10.071  79.496  1.00 37.43  ? 204 ASN H ND2 1 
ATOM   1622 N N   . THR A 1 215 ? -26.871 13.148  83.905  1.00 35.07  ? 205 THR H N   1 
ATOM   1623 C CA  . THR A 1 215 ? -27.036 14.374  84.688  1.00 37.84  ? 205 THR H CA  1 
ATOM   1624 C C   . THR A 1 215 ? -25.701 14.925  85.187  1.00 38.92  ? 205 THR H C   1 
ATOM   1625 O O   . THR A 1 215 ? -24.708 14.232  85.307  1.00 33.43  ? 205 THR H O   1 
ATOM   1626 C CB  . THR A 1 215 ? -28.024 14.172  85.839  1.00 45.50  ? 205 THR H CB  1 
ATOM   1627 O OG1 . THR A 1 215 ? -27.466 13.206  86.687  1.00 43.51  ? 205 THR H OG1 1 
ATOM   1628 C CG2 . THR A 1 215 ? -29.342 13.571  85.421  1.00 47.25  ? 205 THR H CG2 1 
ATOM   1629 N N   . LYS A 1 216 ? -25.677 16.238  85.434  1.00 34.94  ? 206 LYS H N   1 
ATOM   1630 C CA  . LYS A 1 216 ? -24.514 16.948  85.935  1.00 36.57  ? 206 LYS H CA  1 
ATOM   1631 C C   . LYS A 1 216 ? -25.035 18.051  86.842  1.00 39.98  ? 206 LYS H C   1 
ATOM   1632 O O   . LYS A 1 216 ? -26.174 18.492  86.655  1.00 37.14  ? 206 LYS H O   1 
ATOM   1633 C CB  . LYS A 1 216 ? -23.618 17.593  84.875  1.00 35.67  ? 206 LYS H CB  1 
ATOM   1634 C CG  . LYS A 1 216 ? -23.077 16.614  83.846  1.00 39.26  ? 206 LYS H CG  1 
ATOM   1635 C CD  . LYS A 1 216 ? -22.105 17.256  82.854  1.00 38.83  ? 206 LYS H CD  1 
ATOM   1636 C CE  . LYS A 1 216 ? -21.911 16.338  81.667  1.00 38.41  ? 206 LYS H CE  1 
ATOM   1637 N NZ  . LYS A 1 216 ? -20.802 16.760  80.829  1.00 38.98  ? 206 LYS H NZ  1 
ATOM   1638 N N   . VAL A 1 217 ? -24.261 18.386  87.885  1.00 36.44  ? 207 VAL H N   1 
ATOM   1639 C CA  . VAL A 1 217 ? -24.594 19.571  88.672  1.00 38.61  ? 207 VAL H CA  1 
ATOM   1640 C C   . VAL A 1 217 ? -23.337 20.238  89.223  1.00 40.21  ? 207 VAL H C   1 
ATOM   1641 O O   . VAL A 1 217 ? -22.308 19.593  89.408  1.00 38.72  ? 207 VAL H O   1 
ATOM   1642 C CB  . VAL A 1 217 ? -25.582 19.230  89.785  1.00 42.40  ? 207 VAL H CB  1 
ATOM   1643 C CG1 . VAL A 1 217 ? -25.022 18.199  90.750  1.00 49.25  ? 207 VAL H CG1 1 
ATOM   1644 C CG2 . VAL A 1 217 ? -26.029 20.511  90.498  1.00 44.45  ? 207 VAL H CG2 1 
ATOM   1645 N N   . ASP A 1 218 ? -23.407 21.565  89.406  1.00 39.52  ? 208 ASP H N   1 
ATOM   1646 C CA  . ASP A 1 218 ? -22.381 22.309  90.112  1.00 41.29  ? 208 ASP H CA  1 
ATOM   1647 C C   . ASP A 1 218 ? -23.002 22.756  91.434  1.00 44.36  ? 208 ASP H C   1 
ATOM   1648 O O   . ASP A 1 218 ? -24.160 23.173  91.459  1.00 42.91  ? 208 ASP H O   1 
ATOM   1649 C CB  . ASP A 1 218 ? -21.963 23.555  89.358  1.00 45.70  ? 208 ASP H CB  1 
ATOM   1650 C CG  . ASP A 1 218 ? -20.904 23.427  88.276  1.00 55.17  ? 208 ASP H CG  1 
ATOM   1651 O OD1 . ASP A 1 218 ? -20.438 22.284  88.004  1.00 46.79  ? 208 ASP H OD1 1 
ATOM   1652 O OD2 . ASP A 1 218 ? -20.488 24.518  87.777  1.00 56.95  ? 208 ASP H OD2 1 
ATOM   1653 N N   . LYS A 1 219 ? -22.237 22.664  92.519  1.00 43.18  ? 209 LYS H N   1 
ATOM   1654 C CA  . LYS A 1 219 ? -22.713 23.102  93.833  1.00 46.65  ? 209 LYS H CA  1 
ATOM   1655 C C   . LYS A 1 219 ? -21.659 24.034  94.425  1.00 44.79  ? 209 LYS H C   1 
ATOM   1656 O O   . LYS A 1 219 ? -20.494 23.661  94.539  1.00 41.25  ? 209 LYS H O   1 
ATOM   1657 C CB  . LYS A 1 219 ? -23.013 21.895  94.728  1.00 51.59  ? 209 LYS H CB  1 
ATOM   1658 C CG  . LYS A 1 219 ? -23.509 22.248  96.127  1.00 58.49  ? 209 LYS H CG  1 
ATOM   1659 C CD  . LYS A 1 219 ? -24.773 23.103  96.135  1.00 57.75  ? 209 LYS H CD  1 
ATOM   1660 C CE  . LYS A 1 219 ? -25.899 22.484  95.375  1.00 58.29  ? 209 LYS H CE  1 
ATOM   1661 N NZ  . LYS A 1 219 ? -27.194 23.032  95.792  1.00 57.93  ? 209 LYS H NZ  1 
ATOM   1662 N N   . ARG A 1 220 ? -22.046 25.303  94.639  1.00 44.16  ? 210 ARG H N   1 
ATOM   1663 C CA  . ARG A 1 220 ? -21.163 26.270  95.256  1.00 51.23  ? 210 ARG H CA  1 
ATOM   1664 C C   . ARG A 1 220 ? -21.111 25.933  96.744  1.00 42.22  ? 210 ARG H C   1 
ATOM   1665 O O   . ARG A 1 220 ? -22.135 25.568  97.320  1.00 46.54  ? 210 ARG H O   1 
ATOM   1666 C CB  . ARG A 1 220 ? -21.686 27.691  95.001  1.00 61.46  ? 210 ARG H CB  1 
ATOM   1667 C CG  . ARG A 1 220 ? -20.677 28.733  95.441  1.00 73.73  ? 210 ARG H CG  1 
ATOM   1668 C CD  . ARG A 1 220 ? -21.159 30.149  95.247  1.00 86.72  ? 210 ARG H CD  1 
ATOM   1669 N NE  . ARG A 1 220 ? -20.034 30.998  95.651  1.00 100.00 ? 210 ARG H NE  1 
ATOM   1670 C CZ  . ARG A 1 220 ? -20.103 32.291  95.932  1.00 100.00 ? 210 ARG H CZ  1 
ATOM   1671 N NH1 . ARG A 1 220 ? -21.264 32.922  95.866  1.00 100.00 ? 210 ARG H NH1 1 
ATOM   1672 N NH2 . ARG A 1 220 ? -19.009 32.946  96.290  1.00 100.00 ? 210 ARG H NH2 1 
ATOM   1673 N N   . VAL A 1 221 ? -19.906 25.949  97.326  1.00 46.58  ? 211 VAL H N   1 
ATOM   1674 C CA  . VAL A 1 221 ? -19.765 25.588  98.733  1.00 45.12  ? 211 VAL H CA  1 
ATOM   1675 C C   . VAL A 1 221 ? -19.271 26.822  99.482  1.00 48.93  ? 211 VAL H C   1 
ATOM   1676 O O   . VAL A 1 221 ? -18.127 27.248  99.289  1.00 47.06  ? 211 VAL H O   1 
ATOM   1677 C CB  . VAL A 1 221 ? -18.824 24.399  98.963  1.00 47.47  ? 211 VAL H CB  1 
ATOM   1678 C CG1 . VAL A 1 221 ? -18.719 24.055  100.449 1.00 50.66  ? 211 VAL H CG1 1 
ATOM   1679 C CG2 . VAL A 1 221 ? -19.271 23.172  98.173  1.00 42.51  ? 211 VAL H CG2 1 
ATOM   1680 N N   . GLU A 1 222 ? -20.160 27.364  100.321 1.00 51.95  ? 212 GLU H N   1 
ATOM   1681 C CA  . GLU A 1 222 ? -19.919 28.627  101.005 1.00 57.75  ? 212 GLU H CA  1 
ATOM   1682 C C   . GLU A 1 222 ? -19.684 28.403  102.497 1.00 51.37  ? 212 GLU H C   1 
ATOM   1683 O O   . GLU A 1 222 ? -20.277 27.504  103.089 1.00 49.66  ? 212 GLU H O   1 
ATOM   1684 C CB  . GLU A 1 222 ? -21.137 29.514  100.781 1.00 59.93  ? 212 GLU H CB  1 
ATOM   1685 C CG  . GLU A 1 222 ? -21.261 29.945  99.325  1.00 68.40  ? 212 GLU H CG  1 
ATOM   1686 C CD  . GLU A 1 222 ? -22.262 31.064  99.156  1.00 77.50  ? 212 GLU H CD  1 
ATOM   1687 O OE1 . GLU A 1 222 ? -21.865 32.119  98.633  1.00 96.79  ? 212 GLU H OE1 1 
ATOM   1688 O OE2 . GLU A 1 222 ? -23.417 30.885  99.578  1.00 76.17  ? 212 GLU H OE2 1 
ATOM   1689 N N   . PRO A 1 223 ? -18.844 29.238  103.154 1.00 54.86  ? 213 PRO H N   1 
ATOM   1690 C CA  . PRO A 1 223 ? -18.667 29.160  104.606 1.00 54.44  ? 213 PRO H CA  1 
ATOM   1691 C C   . PRO A 1 223 ? -19.929 29.362  105.449 1.00 56.73  ? 213 PRO H C   1 
ATOM   1692 O O   . PRO A 1 223 ? -20.802 30.065  104.897 1.00 55.07  ? 213 PRO H O   1 
ATOM   1693 C CB  . PRO A 1 223 ? -17.583 30.199  104.933 1.00 57.90  ? 213 PRO H CB  1 
ATOM   1694 C CG  . PRO A 1 223 ? -17.248 30.903  103.646 1.00 59.88  ? 213 PRO H CG  1 
ATOM   1695 C CD  . PRO A 1 223 ? -17.967 30.224  102.504 1.00 53.37  ? 213 PRO H CD  1 
ATOM   1696 N N   . ASP B 2 1   ? -5.405  -22.103 76.974  1.00 54.42  ? 1   ASP L N   1 
ATOM   1697 C CA  . ASP B 2 1   ? -4.977  -20.756 77.422  1.00 48.64  ? 1   ASP L CA  1 
ATOM   1698 C C   . ASP B 2 1   ? -3.950  -20.869 78.529  1.00 47.45  ? 1   ASP L C   1 
ATOM   1699 O O   . ASP B 2 1   ? -3.990  -21.784 79.350  1.00 56.21  ? 1   ASP L O   1 
ATOM   1700 C CB  . ASP B 2 1   ? -6.143  -19.942 77.966  1.00 45.34  ? 1   ASP L CB  1 
ATOM   1701 C CG  . ASP B 2 1   ? -7.310  -19.808 77.006  1.00 50.39  ? 1   ASP L CG  1 
ATOM   1702 O OD1 . ASP B 2 1   ? -7.170  -20.315 75.864  1.00 47.33  ? 1   ASP L OD1 1 
ATOM   1703 O OD2 . ASP B 2 1   ? -8.336  -19.203 77.419  1.00 52.63  ? 1   ASP L OD2 1 
ATOM   1704 N N   . ILE B 2 2   ? -3.105  -19.854 78.612  1.00 41.66  ? 2   ILE L N   1 
ATOM   1705 C CA  . ILE B 2 2   ? -2.136  -19.751 79.680  1.00 39.63  ? 2   ILE L CA  1 
ATOM   1706 C C   . ILE B 2 2   ? -2.756  -19.084 80.904  1.00 42.72  ? 2   ILE L C   1 
ATOM   1707 O O   . ILE B 2 2   ? -3.370  -18.002 80.834  1.00 41.27  ? 2   ILE L O   1 
ATOM   1708 C CB  . ILE B 2 2   ? -0.879  -19.023 79.156  1.00 40.43  ? 2   ILE L CB  1 
ATOM   1709 C CG1 . ILE B 2 2   ? -0.339  -19.718 77.901  1.00 36.10  ? 2   ILE L CG1 1 
ATOM   1710 C CG2 . ILE B 2 2   ? 0.171   -18.846 80.252  1.00 40.14  ? 2   ILE L CG2 1 
ATOM   1711 C CD1 . ILE B 2 2   ? 0.904   -19.076 77.327  1.00 39.34  ? 2   ILE L CD1 1 
ATOM   1712 N N   . VAL B 2 3   ? -2.563  -19.747 82.046  1.00 43.27  ? 3   VAL L N   1 
ATOM   1713 C CA  . VAL B 2 3   ? -2.967  -19.227 83.338  1.00 42.06  ? 3   VAL L CA  1 
ATOM   1714 C C   . VAL B 2 3   ? -1.767  -18.572 83.995  1.00 41.56  ? 3   VAL L C   1 
ATOM   1715 O O   . VAL B 2 3   ? -0.683  -19.154 84.075  1.00 42.98  ? 3   VAL L O   1 
ATOM   1716 C CB  . VAL B 2 3   ? -3.580  -20.306 84.241  1.00 41.38  ? 3   VAL L CB  1 
ATOM   1717 C CG1 . VAL B 2 3   ? -3.959  -19.714 85.587  1.00 48.07  ? 3   VAL L CG1 1 
ATOM   1718 C CG2 . VAL B 2 3   ? -4.758  -20.948 83.545  1.00 46.70  ? 3   VAL L CG2 1 
ATOM   1719 N N   . ILE B 2 4   ? -1.967  -17.318 84.413  1.00 41.17  ? 4   ILE L N   1 
ATOM   1720 C CA  . ILE B 2 4   ? -0.961  -16.501 85.067  1.00 41.06  ? 4   ILE L CA  1 
ATOM   1721 C C   . ILE B 2 4   ? -1.402  -16.298 86.511  1.00 48.76  ? 4   ILE L C   1 
ATOM   1722 O O   . ILE B 2 4   ? -2.532  -15.853 86.753  1.00 45.12  ? 4   ILE L O   1 
ATOM   1723 C CB  . ILE B 2 4   ? -0.761  -15.151 84.352  1.00 43.16  ? 4   ILE L CB  1 
ATOM   1724 C CG1 . ILE B 2 4   ? -0.448  -15.280 82.873  1.00 44.04  ? 4   ILE L CG1 1 
ATOM   1725 C CG2 . ILE B 2 4   ? 0.285   -14.322 85.074  1.00 44.69  ? 4   ILE L CG2 1 
ATOM   1726 C CD1 . ILE B 2 4   ? 0.861   -15.992 82.545  1.00 47.54  ? 4   ILE L CD1 1 
ATOM   1727 N N   . THR B 2 5   ? -0.503  -16.619 87.461  1.00 46.79  ? 5   THR L N   1 
ATOM   1728 C CA  . THR B 2 5   ? -0.816  -16.593 88.888  1.00 50.19  ? 5   THR L CA  1 
ATOM   1729 C C   . THR B 2 5   ? 0.146   -15.652 89.586  1.00 50.52  ? 5   THR L C   1 
ATOM   1730 O O   . THR B 2 5   ? 1.341   -15.729 89.362  1.00 53.02  ? 5   THR L O   1 
ATOM   1731 C CB  . THR B 2 5   ? -0.704  -17.992 89.498  1.00 55.70  ? 5   THR L CB  1 
ATOM   1732 O OG1 . THR B 2 5   ? -1.515  -18.903 88.767  1.00 59.69  ? 5   THR L OG1 1 
ATOM   1733 C CG2 . THR B 2 5   ? -1.192  -18.052 90.932  1.00 64.57  ? 5   THR L CG2 1 
ATOM   1734 N N   . GLN B 2 6   ? -0.391  -14.780 90.451  1.00 46.76  ? 6   GLN L N   1 
ATOM   1735 C CA  . GLN B 2 6   ? 0.381   -13.930 91.341  1.00 47.53  ? 6   GLN L CA  1 
ATOM   1736 C C   . GLN B 2 6   ? -0.172  -14.050 92.765  1.00 51.39  ? 6   GLN L C   1 
ATOM   1737 O O   . GLN B 2 6   ? -1.339  -14.380 92.952  1.00 57.84  ? 6   GLN L O   1 
ATOM   1738 C CB  . GLN B 2 6   ? 0.197   -12.435 91.063  1.00 51.54  ? 6   GLN L CB  1 
ATOM   1739 C CG  . GLN B 2 6   ? 0.611   -11.961 89.680  1.00 51.26  ? 6   GLN L CG  1 
ATOM   1740 C CD  . GLN B 2 6   ? 0.216   -10.523 89.405  1.00 47.78  ? 6   GLN L CD  1 
ATOM   1741 O OE1 . GLN B 2 6   ? -0.491  -10.229 88.439  1.00 45.71  ? 6   GLN L OE1 1 
ATOM   1742 N NE2 . GLN B 2 6   ? 0.686   -9.602  90.217  1.00 45.42  ? 6   GLN L NE2 1 
ATOM   1743 N N   . ASP B 2 7   ? 0.600   -13.596 93.750  1.00 63.58  ? 7   ASP L N   1 
ATOM   1744 C CA  . ASP B 2 7   ? 0.090   -13.420 95.103  1.00 71.60  ? 7   ASP L CA  1 
ATOM   1745 C C   . ASP B 2 7   ? -0.762  -12.161 95.239  1.00 76.98  ? 7   ASP L C   1 
ATOM   1746 O O   . ASP B 2 7   ? -0.456  -11.109 94.670  1.00 63.44  ? 7   ASP L O   1 
ATOM   1747 C CB  . ASP B 2 7   ? 1.232   -13.417 96.096  1.00 83.97  ? 7   ASP L CB  1 
ATOM   1748 C CG  . ASP B 2 7   ? 1.978   -14.738 96.076  1.00 96.32  ? 7   ASP L CG  1 
ATOM   1749 O OD1 . ASP B 2 7   ? 1.368   -15.747 96.494  1.00 95.03  ? 7   ASP L OD1 1 
ATOM   1750 O OD2 . ASP B 2 7   ? 3.113   -14.757 95.549  1.00 100.00 ? 7   ASP L OD2 1 
ATOM   1751 N N   . GLU B 2 8   ? -1.803  -12.278 96.074  1.00 80.38  ? 8   GLU L N   1 
ATOM   1752 C CA  . GLU B 2 8   ? -2.781  -11.220 96.290  1.00 79.62  ? 8   GLU L CA  1 
ATOM   1753 C C   . GLU B 2 8   ? -2.139  -10.020 96.986  1.00 79.29  ? 8   GLU L C   1 
ATOM   1754 O O   . GLU B 2 8   ? -2.424  -8.846  96.670  1.00 61.09  ? 8   GLU L O   1 
ATOM   1755 C CB  . GLU B 2 8   ? -3.891  -11.805 97.161  1.00 83.44  ? 8   GLU L CB  1 
ATOM   1756 C CG  . GLU B 2 8   ? -5.217  -11.071 97.030  1.00 89.31  ? 8   GLU L CG  1 
ATOM   1757 C CD  . GLU B 2 8   ? -6.266  -11.705 97.920  1.00 100.00 ? 8   GLU L CD  1 
ATOM   1758 O OE1 . GLU B 2 8   ? -6.296  -11.389 99.135  1.00 100.00 ? 8   GLU L OE1 1 
ATOM   1759 O OE2 . GLU B 2 8   ? -7.021  -12.553 97.395  1.00 100.00 ? 8   GLU L OE2 1 
ATOM   1760 N N   . LEU B 2 9   ? -1.270  -10.331 97.959  1.00 78.79  ? 9   LEU L N   1 
ATOM   1761 C CA  . LEU B 2 9   ? -0.641  -9.298  98.766  1.00 79.80  ? 9   LEU L CA  1 
ATOM   1762 C C   . LEU B 2 9   ? 0.877   -9.462  98.752  1.00 73.18  ? 9   LEU L C   1 
ATOM   1763 O O   . LEU B 2 9   ? 1.412   -10.554 98.537  1.00 72.69  ? 9   LEU L O   1 
ATOM   1764 C CB  . LEU B 2 9   ? -1.207  -9.302  100.187 1.00 94.44  ? 9   LEU L CB  1 
ATOM   1765 C CG  . LEU B 2 9   ? -2.303  -8.269  100.470 1.00 94.47  ? 9   LEU L CG  1 
ATOM   1766 C CD1 . LEU B 2 9   ? -3.139  -8.661  101.683 1.00 90.75  ? 9   LEU L CD1 1 
ATOM   1767 C CD2 . LEU B 2 9   ? -1.670  -6.886  100.650 1.00 86.68  ? 9   LEU L CD2 1 
ATOM   1768 N N   . SER B 2 10  ? 1.534   -8.305  98.892  1.00 67.79  ? 10  SER L N   1 
ATOM   1769 C CA  . SER B 2 10  ? 2.959   -8.174  99.137  1.00 63.84  ? 10  SER L CA  1 
ATOM   1770 C C   . SER B 2 10  ? 3.112   -7.673  100.572 1.00 69.55  ? 10  SER L C   1 
ATOM   1771 O O   . SER B 2 10  ? 2.364   -6.799  101.002 1.00 70.61  ? 10  SER L O   1 
ATOM   1772 C CB  . SER B 2 10  ? 3.570   -7.216  98.152  1.00 57.79  ? 10  SER L CB  1 
ATOM   1773 O OG  . SER B 2 10  ? 4.968   -7.072  98.324  1.00 64.36  ? 10  SER L OG  1 
ATOM   1774 N N   . SER B 2 11  ? 4.048   -8.252  101.328 1.00 78.54  ? 11  SER L N   1 
ATOM   1775 C CA  . SER B 2 11  ? 4.228   -7.862  102.717 1.00 77.13  ? 11  SER L CA  1 
ATOM   1776 C C   . SER B 2 11  ? 4.656   -6.397  102.761 1.00 68.69  ? 11  SER L C   1 
ATOM   1777 O O   . SER B 2 11  ? 5.675   -6.037  102.166 1.00 75.84  ? 11  SER L O   1 
ATOM   1778 C CB  . SER B 2 11  ? 5.222   -8.756  103.417 1.00 81.41  ? 11  SER L CB  1 
ATOM   1779 O OG  . SER B 2 11  ? 5.193   -8.514  104.816 1.00 83.92  ? 11  SER L OG  1 
ATOM   1780 N N   . PRO B 2 12  ? 3.896   -5.500  103.430 1.00 66.50  ? 12  PRO L N   1 
ATOM   1781 C CA  . PRO B 2 12  ? 4.184   -4.073  103.350 1.00 61.84  ? 12  PRO L CA  1 
ATOM   1782 C C   . PRO B 2 12  ? 5.649   -3.806  103.667 1.00 69.76  ? 12  PRO L C   1 
ATOM   1783 O O   . PRO B 2 12  ? 6.305   -4.536  104.405 1.00 74.09  ? 12  PRO L O   1 
ATOM   1784 C CB  . PRO B 2 12  ? 3.224   -3.401  104.336 1.00 62.59  ? 12  PRO L CB  1 
ATOM   1785 C CG  . PRO B 2 12  ? 2.104   -4.418  104.515 1.00 68.88  ? 12  PRO L CG  1 
ATOM   1786 C CD  . PRO B 2 12  ? 2.727   -5.789  104.280 1.00 67.18  ? 12  PRO L CD  1 
ATOM   1787 N N   . VAL B 2 13  ? 6.119   -2.707  103.101 1.00 64.16  ? 13  VAL L N   1 
ATOM   1788 C CA  . VAL B 2 13  ? 7.520   -2.372  103.011 1.00 65.84  ? 13  VAL L CA  1 
ATOM   1789 C C   . VAL B 2 13  ? 7.615   -0.916  103.437 1.00 55.75  ? 13  VAL L C   1 
ATOM   1790 O O   . VAL B 2 13  ? 6.674   -0.166  103.209 1.00 61.74  ? 13  VAL L O   1 
ATOM   1791 C CB  . VAL B 2 13  ? 7.941   -2.608  101.539 1.00 75.70  ? 13  VAL L CB  1 
ATOM   1792 C CG1 . VAL B 2 13  ? 6.956   -1.996  100.542 1.00 71.00  ? 13  VAL L CG1 1 
ATOM   1793 C CG2 . VAL B 2 13  ? 9.361   -2.150  101.242 1.00 71.32  ? 13  VAL L CG2 1 
ATOM   1794 N N   . THR B 2 14  ? 8.741   -0.524  104.024 1.00 47.82  ? 14  THR L N   1 
ATOM   1795 C CA  . THR B 2 14  ? 9.004   0.861   104.377 1.00 53.21  ? 14  THR L CA  1 
ATOM   1796 C C   . THR B 2 14  ? 9.769   1.531   103.243 1.00 48.75  ? 14  THR L C   1 
ATOM   1797 O O   . THR B 2 14  ? 10.558  0.879   102.570 1.00 56.18  ? 14  THR L O   1 
ATOM   1798 C CB  . THR B 2 14  ? 9.819   0.890   105.675 1.00 60.32  ? 14  THR L CB  1 
ATOM   1799 O OG1 . THR B 2 14  ? 8.925   0.342   106.636 1.00 67.68  ? 14  THR L OG1 1 
ATOM   1800 C CG2 . THR B 2 14  ? 10.242  2.287   106.083 1.00 60.83  ? 14  THR L CG2 1 
ATOM   1801 N N   . SER B 2 15  ? 9.570   2.841   103.066 1.00 49.88  ? 15  SER L N   1 
ATOM   1802 C CA  . SER B 2 15  ? 10.287  3.584   102.036 1.00 60.00  ? 15  SER L CA  1 
ATOM   1803 C C   . SER B 2 15  ? 11.781  3.306   102.142 1.00 64.06  ? 15  SER L C   1 
ATOM   1804 O O   . SER B 2 15  ? 12.309  3.367   103.247 1.00 67.52  ? 15  SER L O   1 
ATOM   1805 C CB  . SER B 2 15  ? 10.035  5.051   102.150 1.00 66.37  ? 15  SER L CB  1 
ATOM   1806 O OG  . SER B 2 15  ? 8.814   5.273   102.844 1.00 76.74  ? 15  SER L OG  1 
ATOM   1807 N N   . GLY B 2 16  ? 12.421  2.989   101.003 1.00 65.01  ? 16  GLY L N   1 
ATOM   1808 C CA  . GLY B 2 16  ? 13.844  2.677   100.917 1.00 58.25  ? 16  GLY L CA  1 
ATOM   1809 C C   . GLY B 2 16  ? 14.138  1.174   100.949 1.00 59.39  ? 16  GLY L C   1 
ATOM   1810 O O   . GLY B 2 16  ? 15.228  0.753   100.583 1.00 65.96  ? 16  GLY L O   1 
ATOM   1811 N N   . GLU B 2 17  ? 13.202  0.361   101.437 1.00 57.35  ? 17  GLU L N   1 
ATOM   1812 C CA  . GLU B 2 17  ? 13.392  -1.077  101.448 1.00 64.10  ? 17  GLU L CA  1 
ATOM   1813 C C   . GLU B 2 17  ? 13.111  -1.620  100.045 1.00 67.13  ? 17  GLU L C   1 
ATOM   1814 O O   . GLU B 2 17  ? 12.446  -0.978  99.239  1.00 68.70  ? 17  GLU L O   1 
ATOM   1815 C CB  . GLU B 2 17  ? 12.536  -1.740  102.530 1.00 71.77  ? 17  GLU L CB  1 
ATOM   1816 C CG  . GLU B 2 17  ? 12.992  -1.447  103.959 1.00 80.29  ? 17  GLU L CG  1 
ATOM   1817 C CD  . GLU B 2 17  ? 12.094  -2.015  105.059 1.00 87.58  ? 17  GLU L CD  1 
ATOM   1818 O OE1 . GLU B 2 17  ? 11.064  -2.673  104.770 1.00 81.03  ? 17  GLU L OE1 1 
ATOM   1819 O OE2 . GLU B 2 17  ? 12.422  -1.772  106.240 1.00 94.00  ? 17  GLU L OE2 1 
ATOM   1820 N N   . SER B 2 18  ? 13.661  -2.800  99.757  1.00 65.46  ? 18  SER L N   1 
ATOM   1821 C CA  . SER B 2 18  ? 13.474  -3.451  98.481  1.00 63.12  ? 18  SER L CA  1 
ATOM   1822 C C   . SER B 2 18  ? 12.176  -4.226  98.560  1.00 66.81  ? 18  SER L C   1 
ATOM   1823 O O   . SER B 2 18  ? 11.747  -4.561  99.659  1.00 66.10  ? 18  SER L O   1 
ATOM   1824 C CB  . SER B 2 18  ? 14.619  -4.346  98.152  1.00 66.08  ? 18  SER L CB  1 
ATOM   1825 O OG  . SER B 2 18  ? 15.737  -3.544  97.811  1.00 80.00  ? 18  SER L OG  1 
ATOM   1826 N N   . VAL B 2 19  ? 11.555  -4.496  97.408  1.00 52.66  ? 19  VAL L N   1 
ATOM   1827 C CA  . VAL B 2 19  ? 10.457  -5.438  97.411  1.00 54.04  ? 19  VAL L CA  1 
ATOM   1828 C C   . VAL B 2 19  ? 10.472  -6.247  96.127  1.00 49.97  ? 19  VAL L C   1 
ATOM   1829 O O   . VAL B 2 19  ? 11.043  -5.819  95.126  1.00 55.57  ? 19  VAL L O   1 
ATOM   1830 C CB  . VAL B 2 19  ? 9.115   -4.726  97.644  1.00 60.79  ? 19  VAL L CB  1 
ATOM   1831 C CG1 . VAL B 2 19  ? 8.702   -3.898  96.437  1.00 64.02  ? 19  VAL L CG1 1 
ATOM   1832 C CG2 . VAL B 2 19  ? 8.023   -5.713  98.035  1.00 65.31  ? 19  VAL L CG2 1 
ATOM   1833 N N   . SER B 2 20  ? 9.845   -7.424  96.216  1.00 53.69  ? 20  SER L N   1 
ATOM   1834 C CA  . SER B 2 20  ? 9.888   -8.426  95.181  1.00 55.00  ? 20  SER L CA  1 
ATOM   1835 C C   . SER B 2 20  ? 8.503   -9.028  94.975  1.00 58.76  ? 20  SER L C   1 
ATOM   1836 O O   . SER B 2 20  ? 7.932   -9.607  95.892  1.00 53.67  ? 20  SER L O   1 
ATOM   1837 C CB  . SER B 2 20  ? 10.913  -9.449  95.550  1.00 56.44  ? 20  SER L CB  1 
ATOM   1838 O OG  . SER B 2 20  ? 10.728  -10.621 94.788  1.00 59.88  ? 20  SER L OG  1 
ATOM   1839 N N   . ILE B 2 21  ? 7.982   -8.921  93.741  1.00 58.10  ? 21  ILE L N   1 
ATOM   1840 C CA  . ILE B 2 21  ? 6.648   -9.409  93.415  1.00 52.76  ? 21  ILE L CA  1 
ATOM   1841 C C   . ILE B 2 21  ? 6.772   -10.510 92.381  1.00 45.46  ? 21  ILE L C   1 
ATOM   1842 O O   . ILE B 2 21  ? 7.419   -10.331 91.355  1.00 50.37  ? 21  ILE L O   1 
ATOM   1843 C CB  . ILE B 2 21  ? 5.748   -8.257  92.911  1.00 55.85  ? 21  ILE L CB  1 
ATOM   1844 C CG1 . ILE B 2 21  ? 5.561   -7.189  93.995  1.00 58.92  ? 21  ILE L CG1 1 
ATOM   1845 C CG2 . ILE B 2 21  ? 4.400   -8.781  92.388  1.00 57.81  ? 21  ILE L CG2 1 
ATOM   1846 C CD1 . ILE B 2 21  ? 5.001   -5.873  93.484  1.00 59.13  ? 21  ILE L CD1 1 
ATOM   1847 N N   . SER B 2 22  ? 6.119   -11.639 92.622  1.00 44.96  ? 22  SER L N   1 
ATOM   1848 C CA  . SER B 2 22  ? 6.277   -12.771 91.744  1.00 56.08  ? 22  SER L CA  1 
ATOM   1849 C C   . SER B 2 22  ? 5.029   -13.035 90.908  1.00 47.85  ? 22  SER L C   1 
ATOM   1850 O O   . SER B 2 22  ? 3.906   -12.709 91.269  1.00 54.43  ? 22  SER L O   1 
ATOM   1851 C CB  . SER B 2 22  ? 6.702   -13.971 92.520  1.00 65.46  ? 22  SER L CB  1 
ATOM   1852 O OG  . SER B 2 22  ? 8.071   -13.795 92.850  1.00 81.16  ? 22  SER L OG  1 
ATOM   1853 N N   . CYS B 2 23  ? 5.269   -13.741 89.830  1.00 44.25  ? 23  CYS L N   1 
ATOM   1854 C CA  . CYS B 2 23  ? 4.246   -14.093 88.874  1.00 46.39  ? 23  CYS L CA  1 
ATOM   1855 C C   . CYS B 2 23  ? 4.641   -15.441 88.290  1.00 44.83  ? 23  CYS L C   1 
ATOM   1856 O O   . CYS B 2 23  ? 5.835   -15.734 88.159  1.00 50.64  ? 23  CYS L O   1 
ATOM   1857 C CB  . CYS B 2 23  ? 4.177   -12.908 87.916  1.00 49.54  ? 23  CYS L CB  1 
ATOM   1858 S SG  . CYS B 2 23  ? 3.543   -13.358 86.301  1.00 53.34  ? 23  CYS L SG  1 
ATOM   1859 N N   . ARG B 2 24  ? 3.677   -16.277 87.917  1.00 46.73  ? 24  ARG L N   1 
ATOM   1860 C CA  . ARG B 2 24  ? 4.020   -17.547 87.299  1.00 46.73  ? 24  ARG L CA  1 
ATOM   1861 C C   . ARG B 2 24  ? 3.011   -17.902 86.216  1.00 52.91  ? 24  ARG L C   1 
ATOM   1862 O O   . ARG B 2 24  ? 1.844   -17.521 86.303  1.00 54.46  ? 24  ARG L O   1 
ATOM   1863 C CB  . ARG B 2 24  ? 4.188   -18.542 88.455  1.00 58.77  ? 24  ARG L CB  1 
ATOM   1864 C CG  . ARG B 2 24  ? 3.107   -19.566 88.751  1.00 71.20  ? 24  ARG L CG  1 
ATOM   1865 C CD  . ARG B 2 24  ? 3.252   -20.843 87.916  1.00 85.87  ? 24  ARG L CD  1 
ATOM   1866 N NE  . ARG B 2 24  ? 4.599   -21.428 87.925  1.00 97.61  ? 24  ARG L NE  1 
ATOM   1867 C CZ  . ARG B 2 24  ? 5.038   -22.421 87.137  1.00 100.00 ? 24  ARG L CZ  1 
ATOM   1868 N NH1 . ARG B 2 24  ? 4.204   -23.111 86.361  1.00 87.50  ? 24  ARG L NH1 1 
ATOM   1869 N NH2 . ARG B 2 24  ? 6.327   -22.740 87.157  1.00 100.00 ? 24  ARG L NH2 1 
ATOM   1870 N N   . SER B 2 25  ? 3.483   -18.618 85.182  1.00 42.22  ? 25  SER L N   1 
ATOM   1871 C CA  . SER B 2 25  ? 2.657   -19.024 84.068  1.00 43.91  ? 25  SER L CA  1 
ATOM   1872 C C   . SER B 2 25  ? 2.567   -20.538 84.027  1.00 51.03  ? 25  SER L C   1 
ATOM   1873 O O   . SER B 2 25  ? 3.531   -21.222 84.383  1.00 50.26  ? 25  SER L O   1 
ATOM   1874 C CB  . SER B 2 25  ? 3.220   -18.496 82.768  1.00 42.81  ? 25  SER L CB  1 
ATOM   1875 O OG  . SER B 2 25  ? 4.601   -18.793 82.689  1.00 50.89  ? 25  SER L OG  1 
ATOM   1876 N N   . SER B 2 26  ? 1.458   -21.013 83.475  1.00 44.92  ? 26  SER L N   1 
ATOM   1877 C CA  . SER B 2 26  ? 1.167   -22.429 83.363  1.00 47.87  ? 26  SER L CA  1 
ATOM   1878 C C   . SER B 2 26  ? 1.910   -23.043 82.168  1.00 54.54  ? 26  SER L C   1 
ATOM   1879 O O   . SER B 2 26  ? 1.985   -24.270 82.043  1.00 50.62  ? 26  SER L O   1 
ATOM   1880 C CB  . SER B 2 26  ? -0.329  -22.617 83.256  1.00 51.38  ? 26  SER L CB  1 
ATOM   1881 O OG  . SER B 2 26  ? -0.821  -22.174 81.995  1.00 44.56  ? 26  SER L OG  1 
ATOM   1882 N N   . LYS B 2 27  ? 2.406   -22.186 81.257  1.00 49.16  ? 27  LYS L N   1 
ATOM   1883 C CA  . LYS B 2 27  ? 3.199   -22.588 80.094  1.00 45.16  ? 27  LYS L CA  1 
ATOM   1884 C C   . LYS B 2 27  ? 4.407   -21.659 79.988  1.00 47.54  ? 27  LYS L C   1 
ATOM   1885 O O   . LYS B 2 27  ? 4.382   -20.508 80.407  1.00 43.10  ? 27  LYS L O   1 
ATOM   1886 C CB  . LYS B 2 27  ? 2.590   -22.412 78.692  1.00 56.28  ? 27  LYS L CB  1 
ATOM   1887 C CG  . LYS B 2 27  ? 1.919   -23.566 77.992  1.00 65.65  ? 27  LYS L CG  1 
ATOM   1888 C CD  . LYS B 2 27  ? 0.504   -23.827 78.469  1.00 71.97  ? 27  LYS L CD  1 
ATOM   1889 C CE  . LYS B 2 27  ? -0.271  -24.655 77.504  1.00 77.60  ? 27  LYS L CE  1 
ATOM   1890 N NZ  . LYS B 2 27  ? -1.697  -24.383 77.697  1.00 76.78  ? 27  LYS L NZ  1 
ATOM   1891 N N   . SER B 2 28  ? 5.467   -22.113 79.308  1.00 45.68  ? 28  SER L N   1 
ATOM   1892 C CA  . SER B 2 28  ? 6.620   -21.247 79.112  1.00 40.59  ? 28  SER L CA  1 
ATOM   1893 C C   . SER B 2 28  ? 6.248   -20.040 78.244  1.00 36.90  ? 28  SER L C   1 
ATOM   1894 O O   . SER B 2 28  ? 5.590   -20.230 77.211  1.00 42.36  ? 28  SER L O   1 
ATOM   1895 C CB  . SER B 2 28  ? 7.728   -21.991 78.438  1.00 39.46  ? 28  SER L CB  1 
ATOM   1896 O OG  . SER B 2 28  ? 8.851   -21.143 78.272  1.00 42.21  ? 28  SER L OG  1 
ATOM   1897 N N   . LEU B 2 29  ? 6.799   -18.872 78.597  1.00 39.03  ? 29  LEU L N   1 
ATOM   1898 C CA  . LEU B 2 29  ? 6.652   -17.644 77.818  1.00 40.93  ? 29  LEU L CA  1 
ATOM   1899 C C   . LEU B 2 29  ? 7.936   -17.301 77.055  1.00 43.33  ? 29  LEU L C   1 
ATOM   1900 O O   . LEU B 2 29  ? 8.031   -16.219 76.473  1.00 41.58  ? 29  LEU L O   1 
ATOM   1901 C CB  . LEU B 2 29  ? 6.311   -16.514 78.767  1.00 39.63  ? 29  LEU L CB  1 
ATOM   1902 C CG  . LEU B 2 29  ? 5.091   -16.746 79.674  1.00 39.59  ? 29  LEU L CG  1 
ATOM   1903 C CD1 . LEU B 2 29  ? 4.889   -15.505 80.522  1.00 40.12  ? 29  LEU L CD1 1 
ATOM   1904 C CD2 . LEU B 2 29  ? 3.884   -17.117 78.872  1.00 39.11  ? 29  LEU L CD2 1 
ATOM   1905 N N   . LEU B 2 30  ? 8.926   -18.204 77.096  1.00 38.56  ? 30  LEU L N   1 
ATOM   1906 C CA  . LEU B 2 30  ? 10.147  -18.078 76.325  1.00 37.09  ? 30  LEU L CA  1 
ATOM   1907 C C   . LEU B 2 30  ? 9.873   -18.572 74.906  1.00 37.91  ? 30  LEU L C   1 
ATOM   1908 O O   . LEU B 2 30  ? 9.521   -19.740 74.706  1.00 44.30  ? 30  LEU L O   1 
ATOM   1909 C CB  . LEU B 2 30  ? 11.221  -18.943 77.011  1.00 36.62  ? 30  LEU L CB  1 
ATOM   1910 C CG  . LEU B 2 30  ? 12.554  -19.059 76.273  1.00 37.32  ? 30  LEU L CG  1 
ATOM   1911 C CD1 . LEU B 2 30  ? 13.122  -17.668 76.017  1.00 37.48  ? 30  LEU L CD1 1 
ATOM   1912 C CD2 . LEU B 2 30  ? 13.483  -19.878 77.151  1.00 40.80  ? 30  LEU L CD2 1 
ATOM   1913 N N   . TYR B 2 31  A 10.014  -17.674 73.928  1.00 37.80  ? 30  TYR L N   1 
ATOM   1914 C CA  . TYR B 2 31  A 9.843   -18.017 72.529  1.00 38.96  ? 30  TYR L CA  1 
ATOM   1915 C C   . TYR B 2 31  A 11.173  -18.446 71.890  1.00 42.45  ? 30  TYR L C   1 
ATOM   1916 O O   . TYR B 2 31  A 12.256  -18.225 72.442  1.00 40.96  ? 30  TYR L O   1 
ATOM   1917 C CB  . TYR B 2 31  A 9.240   -16.747 71.925  1.00 39.33  ? 30  TYR L CB  1 
ATOM   1918 C CG  . TYR B 2 31  A 8.612   -16.946 70.556  1.00 36.10  ? 30  TYR L CG  1 
ATOM   1919 C CD1 . TYR B 2 31  A 7.446   -17.688 70.414  1.00 39.86  ? 30  TYR L CD1 1 
ATOM   1920 C CD2 . TYR B 2 31  A 9.168   -16.374 69.419  1.00 38.77  ? 30  TYR L CD2 1 
ATOM   1921 C CE1 . TYR B 2 31  A 6.850   -17.866 69.182  1.00 39.41  ? 30  TYR L CE1 1 
ATOM   1922 C CE2 . TYR B 2 31  A 8.589   -16.565 68.174  1.00 41.48  ? 30  TYR L CE2 1 
ATOM   1923 C CZ  . TYR B 2 31  A 7.418   -17.294 68.064  1.00 41.75  ? 30  TYR L CZ  1 
ATOM   1924 O OH  . TYR B 2 31  A 6.807   -17.488 66.868  1.00 45.13  ? 30  TYR L OH  1 
ATOM   1925 N N   . LYS B 2 32  B 11.068  -18.943 70.652  1.00 41.83  ? 30  LYS L N   1 
ATOM   1926 C CA  . LYS B 2 32  B 12.193  -19.569 69.975  1.00 43.67  ? 30  LYS L CA  1 
ATOM   1927 C C   . LYS B 2 32  B 13.300  -18.559 69.715  1.00 43.98  ? 30  LYS L C   1 
ATOM   1928 O O   . LYS B 2 32  B 14.459  -18.928 69.603  1.00 44.92  ? 30  LYS L O   1 
ATOM   1929 C CB  . LYS B 2 32  B 11.724  -20.257 68.697  1.00 43.21  ? 30  LYS L CB  1 
ATOM   1930 C CG  . LYS B 2 32  B 11.353  -19.304 67.588  1.00 45.33  ? 30  LYS L CG  1 
ATOM   1931 C CD  . LYS B 2 32  B 10.930  -20.057 66.344  1.00 45.44  ? 30  LYS L CD  1 
ATOM   1932 C CE  . LYS B 2 32  B 10.686  -19.096 65.243  1.00 52.57  ? 30  LYS L CE  1 
ATOM   1933 N NZ  . LYS B 2 32  B 10.236  -19.812 64.051  1.00 61.69  ? 30  LYS L NZ  1 
ATOM   1934 N N   . ASP B 2 33  C 12.956  -17.270 69.662  1.00 42.97  ? 30  ASP L N   1 
ATOM   1935 C CA  . ASP B 2 33  C 13.906  -16.196 69.452  1.00 39.20  ? 30  ASP L CA  1 
ATOM   1936 C C   . ASP B 2 33  C 14.658  -15.830 70.727  1.00 39.32  ? 30  ASP L C   1 
ATOM   1937 O O   . ASP B 2 33  C 15.397  -14.844 70.740  1.00 43.70  ? 30  ASP L O   1 
ATOM   1938 C CB  . ASP B 2 33  C 13.209  -14.924 68.937  1.00 43.13  ? 30  ASP L CB  1 
ATOM   1939 C CG  . ASP B 2 33  C 12.160  -14.320 69.864  1.00 46.70  ? 30  ASP L CG  1 
ATOM   1940 O OD1 . ASP B 2 33  C 12.013  -14.856 70.981  1.00 39.23  ? 30  ASP L OD1 1 
ATOM   1941 O OD2 . ASP B 2 33  C 11.507  -13.292 69.476  1.00 42.65  ? 30  ASP L OD2 1 
ATOM   1942 N N   . GLY B 2 34  D 14.447  -16.547 71.835  1.00 39.90  ? 30  GLY L N   1 
ATOM   1943 C CA  . GLY B 2 34  D 15.178  -16.236 73.055  1.00 38.21  ? 30  GLY L CA  1 
ATOM   1944 C C   . GLY B 2 34  D 14.570  -15.151 73.936  1.00 42.39  ? 30  GLY L C   1 
ATOM   1945 O O   . GLY B 2 34  D 15.104  -14.863 75.018  1.00 39.03  ? 30  GLY L O   1 
ATOM   1946 N N   . LYS B 2 35  E 13.466  -14.543 73.470  1.00 41.45  ? 30  LYS L N   1 
ATOM   1947 C CA  . LYS B 2 35  E 12.811  -13.488 74.240  1.00 39.49  ? 30  LYS L CA  1 
ATOM   1948 C C   . LYS B 2 35  E 11.604  -14.060 74.997  1.00 36.85  ? 30  LYS L C   1 
ATOM   1949 O O   . LYS B 2 35  E 10.998  -15.044 74.568  1.00 37.28  ? 30  LYS L O   1 
ATOM   1950 C CB  . LYS B 2 35  E 12.381  -12.349 73.309  1.00 41.14  ? 30  LYS L CB  1 
ATOM   1951 C CG  . LYS B 2 35  E 13.470  -11.555 72.593  1.00 42.87  ? 30  LYS L CG  1 
ATOM   1952 C CD  . LYS B 2 35  E 12.896  -10.783 71.409  1.00 50.21  ? 30  LYS L CD  1 
ATOM   1953 C CE  . LYS B 2 35  E 13.934  -10.217 70.498  1.00 56.84  ? 30  LYS L CE  1 
ATOM   1954 N NZ  . LYS B 2 35  E 14.706  -9.271  71.294  1.00 57.93  ? 30  LYS L NZ  1 
ATOM   1955 N N   . THR B 2 36  ? 11.309  -13.448 76.147  1.00 40.20  ? 31  THR L N   1 
ATOM   1956 C CA  . THR B 2 36  ? 10.255  -13.919 77.027  1.00 37.33  ? 31  THR L CA  1 
ATOM   1957 C C   . THR B 2 36  ? 9.157   -12.847 77.069  1.00 33.71  ? 31  THR L C   1 
ATOM   1958 O O   . THR B 2 36  ? 9.460   -11.730 77.491  1.00 37.90  ? 31  THR L O   1 
ATOM   1959 C CB  . THR B 2 36  ? 10.795  -14.209 78.421  1.00 40.19  ? 31  THR L CB  1 
ATOM   1960 O OG1 . THR B 2 36  ? 11.939  -15.060 78.292  1.00 39.02  ? 31  THR L OG1 1 
ATOM   1961 C CG2 . THR B 2 36  ? 9.743   -14.880 79.291  1.00 38.47  ? 31  THR L CG2 1 
ATOM   1962 N N   . TYR B 2 37  ? 7.943   -13.236 76.679  1.00 35.47  ? 32  TYR L N   1 
ATOM   1963 C CA  . TYR B 2 37  ? 6.882   -12.273 76.336  1.00 34.28  ? 32  TYR L CA  1 
ATOM   1964 C C   . TYR B 2 37  ? 5.998   -12.056 77.562  1.00 36.48  ? 32  TYR L C   1 
ATOM   1965 O O   . TYR B 2 37  ? 4.831   -12.461 77.571  1.00 38.15  ? 32  TYR L O   1 
ATOM   1966 C CB  . TYR B 2 37  ? 6.211   -12.722 75.036  1.00 35.30  ? 32  TYR L CB  1 
ATOM   1967 C CG  . TYR B 2 37  ? 7.104   -12.487 73.822  1.00 37.83  ? 32  TYR L CG  1 
ATOM   1968 C CD1 . TYR B 2 37  ? 7.129   -11.245 73.186  1.00 38.21  ? 32  TYR L CD1 1 
ATOM   1969 C CD2 . TYR B 2 37  ? 8.012   -13.455 73.372  1.00 38.95  ? 32  TYR L CD2 1 
ATOM   1970 C CE1 . TYR B 2 37  ? 7.952   -11.000 72.099  1.00 39.68  ? 32  TYR L CE1 1 
ATOM   1971 C CE2 . TYR B 2 37  ? 8.887   -13.193 72.319  1.00 40.62  ? 32  TYR L CE2 1 
ATOM   1972 C CZ  . TYR B 2 37  ? 8.860   -11.960 71.673  1.00 44.07  ? 32  TYR L CZ  1 
ATOM   1973 O OH  . TYR B 2 37  ? 9.662   -11.663 70.590  1.00 39.03  ? 32  TYR L OH  1 
ATOM   1974 N N   . LEU B 2 38  ? 6.584   -11.390 78.555  1.00 35.36  ? 33  LEU L N   1 
ATOM   1975 C CA  . LEU B 2 38  ? 5.938   -11.061 79.822  1.00 42.55  ? 33  LEU L CA  1 
ATOM   1976 C C   . LEU B 2 38  ? 6.073   -9.559  80.104  1.00 39.12  ? 33  LEU L C   1 
ATOM   1977 O O   . LEU B 2 38  ? 7.139   -8.946  80.021  1.00 39.13  ? 33  LEU L O   1 
ATOM   1978 C CB  . LEU B 2 38  ? 6.616   -11.964 80.868  1.00 41.01  ? 33  LEU L CB  1 
ATOM   1979 C CG  . LEU B 2 38  ? 6.132   -11.961 82.325  1.00 42.00  ? 33  LEU L CG  1 
ATOM   1980 C CD1 . LEU B 2 38  ? 6.516   -10.713 83.043  1.00 46.17  ? 33  LEU L CD1 1 
ATOM   1981 C CD2 . LEU B 2 38  ? 4.659   -12.250 82.483  1.00 41.52  ? 33  LEU L CD2 1 
ATOM   1982 N N   . ASN B 2 39  ? 4.937   -8.928  80.435  1.00 36.21  ? 34  ASN L N   1 
ATOM   1983 C CA  . ASN B 2 39  ? 4.873   -7.512  80.725  1.00 35.91  ? 34  ASN L CA  1 
ATOM   1984 C C   . ASN B 2 39  ? 4.438   -7.326  82.191  1.00 32.79  ? 34  ASN L C   1 
ATOM   1985 O O   . ASN B 2 39  ? 3.706   -8.174  82.738  1.00 38.54  ? 34  ASN L O   1 
ATOM   1986 C CB  . ASN B 2 39  ? 3.843   -6.793  79.831  1.00 34.80  ? 34  ASN L CB  1 
ATOM   1987 C CG  . ASN B 2 39  ? 4.122   -6.902  78.353  1.00 36.92  ? 34  ASN L CG  1 
ATOM   1988 O OD1 . ASN B 2 39  ? 5.283   -6.986  77.954  1.00 36.50  ? 34  ASN L OD1 1 
ATOM   1989 N ND2 . ASN B 2 39  ? 3.091   -6.927  77.513  1.00 35.96  ? 34  ASN L ND2 1 
ATOM   1990 N N   . TRP B 2 40  ? 4.884   -6.228  82.779  1.00 37.07  ? 35  TRP L N   1 
ATOM   1991 C CA  . TRP B 2 40  ? 4.476   -5.768  84.094  1.00 42.49  ? 35  TRP L CA  1 
ATOM   1992 C C   . TRP B 2 40  ? 3.821   -4.410  83.948  1.00 39.32  ? 35  TRP L C   1 
ATOM   1993 O O   . TRP B 2 40  ? 4.364   -3.532  83.275  1.00 39.01  ? 35  TRP L O   1 
ATOM   1994 C CB  . TRP B 2 40  ? 5.665   -5.641  85.065  1.00 42.33  ? 35  TRP L CB  1 
ATOM   1995 C CG  . TRP B 2 40  ? 6.184   -6.958  85.575  1.00 41.89  ? 35  TRP L CG  1 
ATOM   1996 C CD1 . TRP B 2 40  ? 7.251   -7.656  85.090  1.00 43.67  ? 35  TRP L CD1 1 
ATOM   1997 C CD2 . TRP B 2 40  ? 5.648   -7.759  86.647  1.00 44.47  ? 35  TRP L CD2 1 
ATOM   1998 N NE1 . TRP B 2 40  ? 7.417   -8.819  85.780  1.00 43.33  ? 35  TRP L NE1 1 
ATOM   1999 C CE2 . TRP B 2 40  ? 6.476   -8.905  86.762  1.00 45.43  ? 35  TRP L CE2 1 
ATOM   2000 C CE3 . TRP B 2 40  ? 4.591   -7.615  87.546  1.00 43.18  ? 35  TRP L CE3 1 
ATOM   2001 C CZ2 . TRP B 2 40  ? 6.265   -9.891  87.726  1.00 44.08  ? 35  TRP L CZ2 1 
ATOM   2002 C CZ3 . TRP B 2 40  ? 4.362   -8.601  88.485  1.00 44.72  ? 35  TRP L CZ3 1 
ATOM   2003 C CH2 . TRP B 2 40  ? 5.198   -9.719  88.581  1.00 42.84  ? 35  TRP L CH2 1 
ATOM   2004 N N   . PHE B 2 41  ? 2.678   -4.252  84.631  1.00 36.52  ? 36  PHE L N   1 
ATOM   2005 C CA  . PHE B 2 41  ? 2.000   -2.965  84.740  1.00 35.95  ? 36  PHE L CA  1 
ATOM   2006 C C   . PHE B 2 41  ? 1.751   -2.585  86.205  1.00 37.14  ? 36  PHE L C   1 
ATOM   2007 O O   . PHE B 2 41  ? 1.478   -3.454  87.042  1.00 39.80  ? 36  PHE L O   1 
ATOM   2008 C CB  . PHE B 2 41  ? 0.599   -3.013  84.109  1.00 37.84  ? 36  PHE L CB  1 
ATOM   2009 C CG  . PHE B 2 41  ? 0.548   -3.333  82.623  1.00 33.70  ? 36  PHE L CG  1 
ATOM   2010 C CD1 . PHE B 2 41  ? 0.600   -4.651  82.191  1.00 34.14  ? 36  PHE L CD1 1 
ATOM   2011 C CD2 . PHE B 2 41  ? 0.498   -2.330  81.667  1.00 35.16  ? 36  PHE L CD2 1 
ATOM   2012 C CE1 . PHE B 2 41  ? 0.542   -4.966  80.835  1.00 35.95  ? 36  PHE L CE1 1 
ATOM   2013 C CE2 . PHE B 2 41  ? 0.469   -2.650  80.309  1.00 32.88  ? 36  PHE L CE2 1 
ATOM   2014 C CZ  . PHE B 2 41  ? 0.515   -3.964  79.895  1.00 33.50  ? 36  PHE L CZ  1 
ATOM   2015 N N   . LEU B 2 42  ? 1.692   -1.280  86.446  1.00 38.47  ? 37  LEU L N   1 
ATOM   2016 C CA  . LEU B 2 42  ? 1.239   -0.724  87.708  1.00 40.17  ? 37  LEU L CA  1 
ATOM   2017 C C   . LEU B 2 42  ? -0.064  0.045   87.482  1.00 38.46  ? 37  LEU L C   1 
ATOM   2018 O O   . LEU B 2 42  ? -0.113  0.936   86.629  1.00 39.59  ? 37  LEU L O   1 
ATOM   2019 C CB  . LEU B 2 42  ? 2.295   0.216   88.267  1.00 39.85  ? 37  LEU L CB  1 
ATOM   2020 C CG  . LEU B 2 42  ? 1.790   1.159   89.361  1.00 41.58  ? 37  LEU L CG  1 
ATOM   2021 C CD1 . LEU B 2 42  ? 1.392   0.325   90.562  1.00 43.62  ? 37  LEU L CD1 1 
ATOM   2022 C CD2 . LEU B 2 42  ? 2.812   2.216   89.765  1.00 48.19  ? 37  LEU L CD2 1 
ATOM   2023 N N   . GLN B 2 43  ? -1.100  -0.324  88.242  1.00 37.57  ? 38  GLN L N   1 
ATOM   2024 C CA  . GLN B 2 43  ? -2.324  0.460   88.271  1.00 35.08  ? 38  GLN L CA  1 
ATOM   2025 C C   . GLN B 2 43  ? -2.417  1.207   89.588  1.00 38.28  ? 38  GLN L C   1 
ATOM   2026 O O   . GLN B 2 43  ? -2.629  0.586   90.635  1.00 43.22  ? 38  GLN L O   1 
ATOM   2027 C CB  . GLN B 2 43  ? -3.515  -0.474  88.118  1.00 39.25  ? 38  GLN L CB  1 
ATOM   2028 C CG  . GLN B 2 43  ? -4.850  0.271   88.043  1.00 40.08  ? 38  GLN L CG  1 
ATOM   2029 C CD  . GLN B 2 43  ? -5.999  -0.649  87.687  1.00 41.09  ? 38  GLN L CD  1 
ATOM   2030 O OE1 . GLN B 2 43  ? -6.081  -1.804  88.131  1.00 40.90  ? 38  GLN L OE1 1 
ATOM   2031 N NE2 . GLN B 2 43  ? -6.859  -0.178  86.785  1.00 45.03  ? 38  GLN L NE2 1 
ATOM   2032 N N   . ARG B 2 44  ? -2.289  2.529   89.504  1.00 44.15  ? 39  ARG L N   1 
ATOM   2033 C CA  . ARG B 2 44  ? -2.417  3.401   90.655  1.00 56.10  ? 39  ARG L CA  1 
ATOM   2034 C C   . ARG B 2 44  ? -3.898  3.600   90.935  1.00 53.04  ? 39  ARG L C   1 
ATOM   2035 O O   . ARG B 2 44  ? -4.724  3.391   90.054  1.00 57.02  ? 39  ARG L O   1 
ATOM   2036 C CB  . ARG B 2 44  ? -1.694  4.737   90.475  1.00 50.90  ? 39  ARG L CB  1 
ATOM   2037 C CG  . ARG B 2 44  ? -0.185  4.596   90.410  1.00 57.19  ? 39  ARG L CG  1 
ATOM   2038 C CD  . ARG B 2 44  ? 0.445   5.961   90.191  1.00 63.64  ? 39  ARG L CD  1 
ATOM   2039 N NE  . ARG B 2 44  ? 1.901   5.869   90.339  1.00 68.52  ? 39  ARG L NE  1 
ATOM   2040 C CZ  . ARG B 2 44  ? 2.745   5.809   89.321  1.00 78.28  ? 39  ARG L CZ  1 
ATOM   2041 N NH1 . ARG B 2 44  ? 2.295   5.859   88.081  1.00 81.78  ? 39  ARG L NH1 1 
ATOM   2042 N NH2 . ARG B 2 44  ? 4.040   5.700   89.534  1.00 80.14  ? 39  ARG L NH2 1 
ATOM   2043 N N   . PRO B 2 45  ? -4.283  3.936   92.189  1.00 64.54  ? 40  PRO L N   1 
ATOM   2044 C CA  . PRO B 2 45  ? -5.700  4.057   92.545  1.00 64.01  ? 40  PRO L CA  1 
ATOM   2045 C C   . PRO B 2 45  ? -6.493  4.987   91.619  1.00 57.11  ? 40  PRO L C   1 
ATOM   2046 O O   . PRO B 2 45  ? -6.088  6.123   91.412  1.00 64.06  ? 40  PRO L O   1 
ATOM   2047 C CB  . PRO B 2 45  ? -5.613  4.596   93.989  1.00 70.83  ? 40  PRO L CB  1 
ATOM   2048 C CG  . PRO B 2 45  ? -4.309  4.037   94.516  1.00 70.22  ? 40  PRO L CG  1 
ATOM   2049 C CD  . PRO B 2 45  ? -3.374  4.177   93.329  1.00 71.03  ? 40  PRO L CD  1 
ATOM   2050 N N   . GLY B 2 46  ? -7.575  4.459   91.032  1.00 52.76  ? 41  GLY L N   1 
ATOM   2051 C CA  . GLY B 2 46  ? -8.500  5.193   90.177  1.00 64.32  ? 41  GLY L CA  1 
ATOM   2052 C C   . GLY B 2 46  ? -8.071  5.266   88.706  1.00 68.79  ? 41  GLY L C   1 
ATOM   2053 O O   . GLY B 2 46  ? -8.839  5.727   87.859  1.00 60.67  ? 41  GLY L O   1 
ATOM   2054 N N   . GLN B 2 47  ? -6.844  4.824   88.392  1.00 60.36  ? 42  GLN L N   1 
ATOM   2055 C CA  . GLN B 2 47  ? -6.293  5.053   87.066  1.00 52.36  ? 42  GLN L CA  1 
ATOM   2056 C C   . GLN B 2 47  ? -6.193  3.781   86.255  1.00 48.63  ? 42  GLN L C   1 
ATOM   2057 O O   . GLN B 2 47  ? -6.460  2.687   86.741  1.00 47.04  ? 42  GLN L O   1 
ATOM   2058 C CB  . GLN B 2 47  ? -4.900  5.633   87.172  1.00 52.15  ? 42  GLN L CB  1 
ATOM   2059 C CG  . GLN B 2 47  ? -4.905  6.954   87.912  1.00 60.80  ? 42  GLN L CG  1 
ATOM   2060 C CD  . GLN B 2 47  ? -3.542  7.582   87.877  1.00 65.47  ? 42  GLN L CD  1 
ATOM   2061 O OE1 . GLN B 2 47  ? -2.609  7.030   87.289  1.00 84.01  ? 42  GLN L OE1 1 
ATOM   2062 N NE2 . GLN B 2 47  ? -3.420  8.733   88.516  1.00 79.49  ? 42  GLN L NE2 1 
ATOM   2063 N N   . SER B 2 48  ? -5.861  3.961   84.968  1.00 42.93  ? 43  SER L N   1 
ATOM   2064 C CA  . SER B 2 48  ? -5.604  2.830   84.099  1.00 44.71  ? 43  SER L CA  1 
ATOM   2065 C C   . SER B 2 48  ? -4.259  2.205   84.461  1.00 39.59  ? 43  SER L C   1 
ATOM   2066 O O   . SER B 2 48  ? -3.366  2.900   84.951  1.00 40.00  ? 43  SER L O   1 
ATOM   2067 C CB  . SER B 2 48  ? -5.574  3.268   82.643  1.00 48.77  ? 43  SER L CB  1 
ATOM   2068 O OG  . SER B 2 48  ? -6.752  4.025   82.409  1.00 60.65  ? 43  SER L OG  1 
ATOM   2069 N N   . PRO B 2 49  ? -4.044  0.917   84.115  1.00 35.93  ? 44  PRO L N   1 
ATOM   2070 C CA  . PRO B 2 49  ? -2.710  0.315   84.185  1.00 37.21  ? 44  PRO L CA  1 
ATOM   2071 C C   . PRO B 2 49  ? -1.698  1.092   83.364  1.00 38.42  ? 44  PRO L C   1 
ATOM   2072 O O   . PRO B 2 49  ? -2.027  1.617   82.320  1.00 37.47  ? 44  PRO L O   1 
ATOM   2073 C CB  . PRO B 2 49  ? -2.947  -1.118  83.655  1.00 37.43  ? 44  PRO L CB  1 
ATOM   2074 C CG  . PRO B 2 49  ? -4.437  -1.348  83.891  1.00 38.07  ? 44  PRO L CG  1 
ATOM   2075 C CD  . PRO B 2 49  ? -5.022  -0.009  83.544  1.00 38.71  ? 44  PRO L CD  1 
ATOM   2076 N N   . GLN B 2 50  ? -0.432  1.107   83.800  1.00 37.23  ? 45  GLN L N   1 
ATOM   2077 C CA  . GLN B 2 50  ? 0.633   1.734   83.046  1.00 37.46  ? 45  GLN L CA  1 
ATOM   2078 C C   . GLN B 2 50  ? 1.814   0.765   82.945  1.00 38.14  ? 45  GLN L C   1 
ATOM   2079 O O   . GLN B 2 50  ? 2.226   0.194   83.955  1.00 38.05  ? 45  GLN L O   1 
ATOM   2080 C CB  . GLN B 2 50  ? 1.060   3.007   83.770  1.00 44.25  ? 45  GLN L CB  1 
ATOM   2081 C CG  . GLN B 2 50  ? 2.208   3.733   83.080  1.00 51.10  ? 45  GLN L CG  1 
ATOM   2082 C CD  . GLN B 2 50  ? 1.805   4.257   81.710  1.00 66.83  ? 45  GLN L CD  1 
ATOM   2083 O OE1 . GLN B 2 50  ? 0.618   4.481   81.421  1.00 63.05  ? 45  GLN L OE1 1 
ATOM   2084 N NE2 . GLN B 2 50  ? 2.791   4.467   80.845  1.00 56.90  ? 45  GLN L NE2 1 
ATOM   2085 N N   . ILE B 2 51  ? 2.332   0.589   81.732  1.00 36.27  ? 46  ILE L N   1 
ATOM   2086 C CA  . ILE B 2 51  ? 3.429   -0.349  81.446  1.00 38.23  ? 46  ILE L CA  1 
ATOM   2087 C C   . ILE B 2 51  ? 4.682   0.023   82.246  1.00 36.13  ? 46  ILE L C   1 
ATOM   2088 O O   . ILE B 2 51  ? 5.046   1.189   82.279  1.00 36.52  ? 46  ILE L O   1 
ATOM   2089 C CB  . ILE B 2 51  ? 3.744   -0.399  79.935  1.00 36.51  ? 46  ILE L CB  1 
ATOM   2090 C CG1 . ILE B 2 51  ? 4.724   -1.523  79.564  1.00 36.56  ? 46  ILE L CG1 1 
ATOM   2091 C CG2 . ILE B 2 51  ? 4.260   0.961   79.461  1.00 40.84  ? 46  ILE L CG2 1 
ATOM   2092 C CD1 . ILE B 2 51  ? 4.203   -2.953  79.760  1.00 36.58  ? 46  ILE L CD1 1 
ATOM   2093 N N   . LEU B 2 52  ? 5.348   -1.004  82.816  1.00 41.24  ? 47  LEU L N   1 
ATOM   2094 C CA  . LEU B 2 52  ? 6.617   -0.846  83.531  1.00 40.77  ? 47  LEU L CA  1 
ATOM   2095 C C   . LEU B 2 52  ? 7.749   -1.568  82.803  1.00 37.03  ? 47  LEU L C   1 
ATOM   2096 O O   . LEU B 2 52  ? 8.802   -0.977  82.561  1.00 41.84  ? 47  LEU L O   1 
ATOM   2097 C CB  . LEU B 2 52  ? 6.477   -1.433  84.937  1.00 40.59  ? 47  LEU L CB  1 
ATOM   2098 C CG  . LEU B 2 52  ? 5.542   -0.734  85.925  1.00 42.81  ? 47  LEU L CG  1 
ATOM   2099 C CD1 . LEU B 2 52  ? 5.534   -1.505  87.243  1.00 49.34  ? 47  LEU L CD1 1 
ATOM   2100 C CD2 . LEU B 2 52  ? 5.872   0.713   86.187  1.00 44.32  ? 47  LEU L CD2 1 
ATOM   2101 N N   . ILE B 2 53  ? 7.519   -2.838  82.505  1.00 38.60  ? 48  ILE L N   1 
ATOM   2102 C CA  . ILE B 2 53  ? 8.506   -3.753  81.953  1.00 37.52  ? 48  ILE L CA  1 
ATOM   2103 C C   . ILE B 2 53  ? 7.858   -4.513  80.803  1.00 39.78  ? 48  ILE L C   1 
ATOM   2104 O O   . ILE B 2 53  ? 6.732   -5.031  80.927  1.00 38.86  ? 48  ILE L O   1 
ATOM   2105 C CB  . ILE B 2 53  ? 8.965   -4.730  83.055  1.00 40.71  ? 48  ILE L CB  1 
ATOM   2106 C CG1 . ILE B 2 53  ? 9.630   -4.018  84.262  1.00 45.84  ? 48  ILE L CG1 1 
ATOM   2107 C CG2 . ILE B 2 53  ? 9.834   -5.855  82.495  1.00 44.56  ? 48  ILE L CG2 1 
ATOM   2108 C CD1 . ILE B 2 53  ? 10.998  -3.442  84.016  1.00 46.61  ? 48  ILE L CD1 1 
ATOM   2109 N N   . TYR B 2 54  ? 8.596   -4.681  79.704  1.00 36.67  ? 49  TYR L N   1 
ATOM   2110 C CA  . TYR B 2 54  ? 8.204   -5.623  78.666  1.00 36.90  ? 49  TYR L CA  1 
ATOM   2111 C C   . TYR B 2 54  ? 9.399   -6.526  78.333  1.00 36.44  ? 49  TYR L C   1 
ATOM   2112 O O   . TYR B 2 54  ? 10.513  -6.215  78.737  1.00 37.05  ? 49  TYR L O   1 
ATOM   2113 C CB  . TYR B 2 54  ? 7.667   -4.863  77.446  1.00 37.25  ? 49  TYR L CB  1 
ATOM   2114 C CG  . TYR B 2 54  ? 8.701   -4.007  76.748  1.00 38.61  ? 49  TYR L CG  1 
ATOM   2115 C CD1 . TYR B 2 54  ? 9.051   -2.768  77.250  1.00 39.70  ? 49  TYR L CD1 1 
ATOM   2116 C CD2 . TYR B 2 54  ? 9.348   -4.440  75.579  1.00 36.87  ? 49  TYR L CD2 1 
ATOM   2117 C CE1 . TYR B 2 54  ? 10.001  -1.976  76.615  1.00 43.87  ? 49  TYR L CE1 1 
ATOM   2118 C CE2 . TYR B 2 54  ? 10.331  -3.669  74.973  1.00 38.01  ? 49  TYR L CE2 1 
ATOM   2119 C CZ  . TYR B 2 54  ? 10.619  -2.417  75.459  1.00 40.42  ? 49  TYR L CZ  1 
ATOM   2120 O OH  . TYR B 2 54  ? 11.546  -1.612  74.830  1.00 46.52  ? 49  TYR L OH  1 
ATOM   2121 N N   . LEU B 2 55  ? 9.132   -7.597  77.590  1.00 38.06  ? 50  LEU L N   1 
ATOM   2122 C CA  . LEU B 2 55  ? 10.104  -8.665  77.316  1.00 38.77  ? 50  LEU L CA  1 
ATOM   2123 C C   . LEU B 2 55  ? 10.793  -9.131  78.608  1.00 40.84  ? 50  LEU L C   1 
ATOM   2124 O O   . LEU B 2 55  ? 12.000  -9.401  78.631  1.00 41.16  ? 50  LEU L O   1 
ATOM   2125 C CB  . LEU B 2 55  ? 11.097  -8.152  76.285  1.00 36.02  ? 50  LEU L CB  1 
ATOM   2126 C CG  . LEU B 2 55  ? 10.543  -7.921  74.884  1.00 38.96  ? 50  LEU L CG  1 
ATOM   2127 C CD1 . LEU B 2 55  ? 11.576  -7.233  74.009  1.00 43.52  ? 50  LEU L CD1 1 
ATOM   2128 C CD2 . LEU B 2 55  ? 10.010  -9.179  74.258  1.00 41.55  ? 50  LEU L CD2 1 
ATOM   2129 N N   . MET B 2 56  ? 10.011  -9.219  79.678  1.00 35.15  ? 51  MET L N   1 
ATOM   2130 C CA  . MET B 2 56  ? 10.404  -9.753  80.968  1.00 40.24  ? 51  MET L CA  1 
ATOM   2131 C C   . MET B 2 56  ? 11.365  -8.837  81.725  1.00 40.51  ? 51  MET L C   1 
ATOM   2132 O O   . MET B 2 56  ? 11.254  -8.725  82.946  1.00 42.42  ? 51  MET L O   1 
ATOM   2133 C CB  . MET B 2 56  ? 10.986  -11.170 80.840  1.00 40.91  ? 51  MET L CB  1 
ATOM   2134 C CG  . MET B 2 56  ? 11.180  -11.893 82.172  1.00 47.08  ? 51  MET L CG  1 
ATOM   2135 S SD  . MET B 2 56  ? 11.973  -13.517 82.013  1.00 48.69  ? 51  MET L SD  1 
ATOM   2136 C CE  . MET B 2 56  ? 13.631  -12.969 81.616  1.00 45.95  ? 51  MET L CE  1 
ATOM   2137 N N   . SER B 2 57  ? 12.254  -8.106  81.051  1.00 41.69  ? 52  SER L N   1 
ATOM   2138 C CA  . SER B 2 57  ? 13.233  -7.329  81.797  1.00 42.75  ? 52  SER L CA  1 
ATOM   2139 C C   . SER B 2 57  ? 13.598  -5.989  81.160  1.00 46.51  ? 52  SER L C   1 
ATOM   2140 O O   . SER B 2 57  ? 14.509  -5.349  81.669  1.00 50.15  ? 52  SER L O   1 
ATOM   2141 C CB  . SER B 2 57  ? 14.481  -8.166  82.003  1.00 47.66  ? 52  SER L CB  1 
ATOM   2142 O OG  . SER B 2 57  ? 14.875  -8.690  80.752  1.00 48.99  ? 52  SER L OG  1 
ATOM   2143 N N   . THR B 2 58  ? 12.889  -5.519  80.116  1.00 44.66  ? 53  THR L N   1 
ATOM   2144 C CA  . THR B 2 58  ? 13.158  -4.193  79.568  1.00 38.95  ? 53  THR L CA  1 
ATOM   2145 C C   . THR B 2 58  ? 12.234  -3.139  80.189  1.00 45.57  ? 53  THR L C   1 
ATOM   2146 O O   . THR B 2 58  ? 11.015  -3.277  80.141  1.00 43.28  ? 53  THR L O   1 
ATOM   2147 C CB  . THR B 2 58  ? 13.036  -4.239  78.042  1.00 45.07  ? 53  THR L CB  1 
ATOM   2148 O OG1 . THR B 2 58  ? 13.966  -5.216  77.588  1.00 44.04  ? 53  THR L OG1 1 
ATOM   2149 C CG2 . THR B 2 58  ? 13.321  -2.906  77.397  1.00 44.99  ? 53  THR L CG2 1 
ATOM   2150 N N   . ARG B 2 59  ? 12.809  -2.069  80.751  1.00 40.12  ? 54  ARG L N   1 
ATOM   2151 C CA  . ARG B 2 59  ? 12.033  -0.935  81.239  1.00 47.11  ? 54  ARG L CA  1 
ATOM   2152 C C   . ARG B 2 59  ? 11.422  -0.151  80.082  1.00 45.07  ? 54  ARG L C   1 
ATOM   2153 O O   . ARG B 2 59  ? 12.094  0.135   79.103  1.00 41.58  ? 54  ARG L O   1 
ATOM   2154 C CB  . ARG B 2 59  ? 12.819  0.022   82.142  1.00 49.48  ? 54  ARG L CB  1 
ATOM   2155 C CG  . ARG B 2 59  ? 13.171  -0.602  83.478  0.85 49.44  ? 54  ARG L CG  1 
ATOM   2156 C CD  . ARG B 2 59  ? 13.757  0.443   84.410  1.00 60.03  ? 54  ARG L CD  1 
ATOM   2157 N NE  . ARG B 2 59  ? 14.957  1.068   83.852  1.00 60.75  ? 54  ARG L NE  1 
ATOM   2158 C CZ  . ARG B 2 59  ? 16.190  0.670   84.121  0.66 67.17  ? 54  ARG L CZ  1 
ATOM   2159 N NH1 . ARG B 2 59  ? 16.398  -0.402  84.865  1.00 72.23  ? 54  ARG L NH1 1 
ATOM   2160 N NH2 . ARG B 2 59  ? 17.214  1.332   83.630  0.76 62.20  ? 54  ARG L NH2 1 
ATOM   2161 N N   . ALA B 2 60  ? 10.143  0.233   80.231  1.00 42.77  ? 55  ALA L N   1 
ATOM   2162 C CA  . ALA B 2 60  ? 9.462   1.041   79.236  1.00 44.83  ? 55  ALA L CA  1 
ATOM   2163 C C   . ALA B 2 60  ? 9.863   2.501   79.441  1.00 45.80  ? 55  ALA L C   1 
ATOM   2164 O O   . ALA B 2 60  ? 10.517  2.819   80.443  1.00 43.11  ? 55  ALA L O   1 
ATOM   2165 C CB  . ALA B 2 60  ? 7.959   0.840   79.337  1.00 44.43  ? 55  ALA L CB  1 
ATOM   2166 N N   . SER B 2 61  ? 9.322   3.368   78.571  1.00 49.16  ? 56  SER L N   1 
ATOM   2167 C CA  . SER B 2 61  ? 9.474   4.819   78.635  1.00 48.29  ? 56  SER L CA  1 
ATOM   2168 C C   . SER B 2 61  ? 9.225   5.389   80.021  1.00 52.20  ? 56  SER L C   1 
ATOM   2169 O O   . SER B 2 61  ? 8.121   5.256   80.547  1.00 48.23  ? 56  SER L O   1 
ATOM   2170 C CB  . SER B 2 61  ? 8.524   5.496   77.696  1.00 52.17  ? 56  SER L CB  1 
ATOM   2171 O OG  . SER B 2 61  ? 8.624   6.906   77.814  1.00 47.66  ? 56  SER L OG  1 
ATOM   2172 N N   . GLY B 2 62  ? 10.219  6.118   80.553  1.00 45.59  ? 57  GLY L N   1 
ATOM   2173 C CA  . GLY B 2 62  ? 10.016  6.949   81.724  1.00 49.07  ? 57  GLY L CA  1 
ATOM   2174 C C   . GLY B 2 62  ? 9.795   6.137   82.996  1.00 47.51  ? 57  GLY L C   1 
ATOM   2175 O O   . GLY B 2 62  ? 9.217   6.632   83.953  1.00 53.18  ? 57  GLY L O   1 
ATOM   2176 N N   . VAL B 2 63  ? 10.192  4.869   82.965  1.00 44.10  ? 58  VAL L N   1 
ATOM   2177 C CA  . VAL B 2 63  ? 10.046  3.993   84.112  1.00 44.74  ? 58  VAL L CA  1 
ATOM   2178 C C   . VAL B 2 63  ? 11.343  4.061   84.908  1.00 52.19  ? 58  VAL L C   1 
ATOM   2179 O O   . VAL B 2 63  ? 12.428  3.848   84.352  1.00 50.37  ? 58  VAL L O   1 
ATOM   2180 C CB  . VAL B 2 63  ? 9.740   2.571   83.635  1.00 45.63  ? 58  VAL L CB  1 
ATOM   2181 C CG1 . VAL B 2 63  ? 9.723   1.563   84.779  1.00 45.24  ? 58  VAL L CG1 1 
ATOM   2182 C CG2 . VAL B 2 63  ? 8.444   2.536   82.811  1.00 45.18  ? 58  VAL L CG2 1 
ATOM   2183 N N   . SER B 2 64  ? 11.185  4.344   86.206  1.00 49.20  ? 59  SER L N   1 
ATOM   2184 C CA  . SER B 2 64  ? 12.301  4.516   87.126  1.00 53.88  ? 59  SER L CA  1 
ATOM   2185 C C   . SER B 2 64  ? 13.263  3.333   87.042  1.00 52.44  ? 59  SER L C   1 
ATOM   2186 O O   . SER B 2 64  ? 12.848  2.167   86.947  1.00 48.47  ? 59  SER L O   1 
ATOM   2187 C CB  . SER B 2 64  ? 11.790  4.687   88.528  1.00 59.24  ? 59  SER L CB  1 
ATOM   2188 O OG  . SER B 2 64  ? 12.788  4.330   89.472  1.00 57.47  ? 59  SER L OG  1 
ATOM   2189 N N   . ASP B 2 65  ? 14.563  3.620   87.185  1.00 49.35  ? 60  ASP L N   1 
ATOM   2190 C CA  . ASP B 2 65  ? 15.545  2.551   87.127  1.00 52.67  ? 60  ASP L CA  1 
ATOM   2191 C C   . ASP B 2 65  ? 15.516  1.718   88.413  1.00 48.02  ? 60  ASP L C   1 
ATOM   2192 O O   . ASP B 2 65  ? 16.179  0.687   88.474  1.00 54.50  ? 60  ASP L O   1 
ATOM   2193 C CB  . ASP B 2 65  ? 16.904  3.068   86.678  1.00 56.02  ? 60  ASP L CB  1 
ATOM   2194 C CG  . ASP B 2 65  ? 17.550  4.082   87.608  1.00 57.16  ? 60  ASP L CG  1 
ATOM   2195 O OD1 . ASP B 2 65  ? 17.411  3.903   88.824  1.00 68.15  ? 60  ASP L OD1 1 
ATOM   2196 O OD2 . ASP B 2 65  ? 18.215  5.008   87.104  1.00 68.96  ? 60  ASP L OD2 1 
ATOM   2197 N N   . ARG B 2 66  ? 14.638  2.051   89.379  1.00 48.26  ? 61  ARG L N   1 
ATOM   2198 C CA  . ARG B 2 66  ? 14.436  1.209   90.552  1.00 48.65  ? 61  ARG L CA  1 
ATOM   2199 C C   . ARG B 2 66  ? 13.670  -0.076  90.239  1.00 49.53  ? 61  ARG L C   1 
ATOM   2200 O O   . ARG B 2 66  ? 13.647  -1.002  91.062  1.00 48.60  ? 61  ARG L O   1 
ATOM   2201 C CB  . ARG B 2 66  ? 13.738  1.999   91.667  1.00 52.91  ? 61  ARG L CB  1 
ATOM   2202 C CG  . ARG B 2 66  ? 14.420  3.286   92.100  1.00 55.64  ? 61  ARG L CG  1 
ATOM   2203 C CD  . ARG B 2 66  ? 13.637  4.013   93.194  1.00 59.91  ? 61  ARG L CD  1 
ATOM   2204 N NE  . ARG B 2 66  ? 12.384  4.600   92.698  1.00 59.99  ? 61  ARG L NE  1 
ATOM   2205 C CZ  . ARG B 2 66  ? 11.153  4.085   92.858  1.00 60.28  ? 61  ARG L CZ  1 
ATOM   2206 N NH1 . ARG B 2 66  ? 10.959  2.955   93.508  1.00 53.92  ? 61  ARG L NH1 1 
ATOM   2207 N NH2 . ARG B 2 66  ? 10.102  4.704   92.338  1.00 59.09  ? 61  ARG L NH2 1 
ATOM   2208 N N   . PHE B 2 67  ? 13.015  -0.130  89.065  1.00 47.79  ? 62  PHE L N   1 
ATOM   2209 C CA  . PHE B 2 67  ? 12.261  -1.313  88.678  1.00 47.75  ? 62  PHE L CA  1 
ATOM   2210 C C   . PHE B 2 67  ? 13.131  -2.181  87.782  1.00 42.79  ? 62  PHE L C   1 
ATOM   2211 O O   . PHE B 2 67  ? 13.737  -1.639  86.872  1.00 49.78  ? 62  PHE L O   1 
ATOM   2212 C CB  . PHE B 2 67  ? 10.969  -0.973  87.911  1.00 47.66  ? 62  PHE L CB  1 
ATOM   2213 C CG  . PHE B 2 67  ? 9.930   -0.249  88.749  1.00 44.95  ? 62  PHE L CG  1 
ATOM   2214 C CD1 . PHE B 2 67  ? 9.010   -0.962  89.508  1.00 48.53  ? 62  PHE L CD1 1 
ATOM   2215 C CD2 . PHE B 2 67  ? 9.927   1.128   88.851  1.00 47.84  ? 62  PHE L CD2 1 
ATOM   2216 C CE1 . PHE B 2 67  ? 8.081   -0.306  90.300  1.00 47.80  ? 62  PHE L CE1 1 
ATOM   2217 C CE2 . PHE B 2 67  ? 8.995   1.780   89.650  1.00 55.49  ? 62  PHE L CE2 1 
ATOM   2218 C CZ  . PHE B 2 67  ? 8.070   1.062   90.365  1.00 45.75  ? 62  PHE L CZ  1 
ATOM   2219 N N   . SER B 2 68  ? 13.080  -3.509  87.989  1.00 45.67  ? 63  SER L N   1 
ATOM   2220 C CA  . SER B 2 68  ? 13.715  -4.466  87.106  1.00 47.19  ? 63  SER L CA  1 
ATOM   2221 C C   . SER B 2 68  ? 12.950  -5.780  87.141  1.00 46.01  ? 63  SER L C   1 
ATOM   2222 O O   . SER B 2 68  ? 12.290  -6.092  88.129  1.00 51.87  ? 63  SER L O   1 
ATOM   2223 C CB  . SER B 2 68  ? 15.193  -4.644  87.489  1.00 51.49  ? 63  SER L CB  1 
ATOM   2224 O OG  . SER B 2 68  ? 15.289  -5.191  88.794  1.00 50.22  ? 63  SER L OG  1 
ATOM   2225 N N   . GLY B 2 69  ? 13.106  -6.585  86.080  1.00 43.21  ? 64  GLY L N   1 
ATOM   2226 C CA  . GLY B 2 69  ? 12.407  -7.856  85.961  1.00 44.35  ? 64  GLY L CA  1 
ATOM   2227 C C   . GLY B 2 69  ? 13.385  -8.987  85.658  1.00 48.31  ? 64  GLY L C   1 
ATOM   2228 O O   . GLY B 2 69  ? 14.384  -8.744  84.996  1.00 49.34  ? 64  GLY L O   1 
ATOM   2229 N N   . SER B 2 70  ? 13.062  -10.210 86.099  1.00 48.35  ? 65  SER L N   1 
ATOM   2230 C CA  . SER B 2 70  ? 13.809  -11.400 85.711  1.00 50.97  ? 65  SER L CA  1 
ATOM   2231 C C   . SER B 2 70  ? 12.882  -12.606 85.711  1.00 52.48  ? 65  SER L C   1 
ATOM   2232 O O   . SER B 2 70  ? 11.699  -12.450 86.034  1.00 47.35  ? 65  SER L O   1 
ATOM   2233 C CB  . SER B 2 70  ? 14.944  -11.615 86.680  1.00 61.36  ? 65  SER L CB  1 
ATOM   2234 O OG  . SER B 2 70  ? 14.426  -11.711 88.002  1.00 56.60  ? 65  SER L OG  1 
ATOM   2235 N N   . GLY B 2 71  ? 13.425  -13.791 85.366  1.00 51.29  ? 66  GLY L N   1 
ATOM   2236 C CA  . GLY B 2 71  ? 12.740  -15.045 85.612  1.00 53.30  ? 66  GLY L CA  1 
ATOM   2237 C C   . GLY B 2 71  ? 13.179  -16.158 84.677  1.00 53.61  ? 66  GLY L C   1 
ATOM   2238 O O   . GLY B 2 71  ? 14.028  -15.956 83.814  1.00 55.39  ? 66  GLY L O   1 
ATOM   2239 N N   . SER B 2 72  ? 12.535  -17.322 84.844  1.00 49.70  ? 67  SER L N   1 
ATOM   2240 C CA  . SER B 2 72  ? 12.734  -18.481 83.979  1.00 50.86  ? 67  SER L CA  1 
ATOM   2241 C C   . SER B 2 72  ? 11.753  -18.445 82.798  1.00 60.72  ? 67  SER L C   1 
ATOM   2242 O O   . SER B 2 72  ? 11.301  -17.380 82.391  1.00 51.21  ? 67  SER L O   1 
ATOM   2243 C CB  . SER B 2 72  ? 12.506  -19.720 84.768  1.00 56.06  ? 67  SER L CB  1 
ATOM   2244 O OG  . SER B 2 72  ? 11.109  -19.968 84.930  1.00 55.04  ? 67  SER L OG  1 
ATOM   2245 N N   . GLY B 2 73  ? 11.371  -19.624 82.282  1.00 60.59  ? 68  GLY L N   1 
ATOM   2246 C CA  . GLY B 2 73  ? 10.332  -19.719 81.265  1.00 61.24  ? 68  GLY L CA  1 
ATOM   2247 C C   . GLY B 2 73  ? 8.937   -19.510 81.870  1.00 57.43  ? 68  GLY L C   1 
ATOM   2248 O O   . GLY B 2 73  ? 8.008   -19.119 81.149  1.00 47.79  ? 68  GLY L O   1 
ATOM   2249 N N   . THR B 2 74  ? 8.805   -19.757 83.189  1.00 52.54  ? 69  THR L N   1 
ATOM   2250 C CA  . THR B 2 74  ? 7.498   -19.899 83.823  1.00 53.68  ? 69  THR L CA  1 
ATOM   2251 C C   . THR B 2 74  ? 7.418   -19.223 85.188  1.00 48.10  ? 69  THR L C   1 
ATOM   2252 O O   . THR B 2 74  ? 6.326   -19.151 85.731  1.00 52.27  ? 69  THR L O   1 
ATOM   2253 C CB  . THR B 2 74  ? 7.090   -21.365 83.981  1.00 52.83  ? 69  THR L CB  1 
ATOM   2254 O OG1 . THR B 2 74  ? 8.097   -21.883 84.833  1.00 53.43  ? 69  THR L OG1 1 
ATOM   2255 C CG2 . THR B 2 74  ? 7.034   -22.147 82.689  1.00 52.52  ? 69  THR L CG2 1 
ATOM   2256 N N   . ASP B 2 75  ? 8.530   -18.743 85.752  1.00 44.01  ? 70  ASP L N   1 
ATOM   2257 C CA  . ASP B 2 75  ? 8.533   -18.023 87.019  1.00 48.63  ? 70  ASP L CA  1 
ATOM   2258 C C   . ASP B 2 75  ? 9.220   -16.662 86.928  1.00 49.32  ? 70  ASP L C   1 
ATOM   2259 O O   . ASP B 2 75  ? 10.379  -16.588 86.538  1.00 52.77  ? 70  ASP L O   1 
ATOM   2260 C CB  . ASP B 2 75  ? 9.213   -18.821 88.114  1.00 56.55  ? 70  ASP L CB  1 
ATOM   2261 C CG  . ASP B 2 75  ? 8.290   -19.856 88.727  1.00 67.18  ? 70  ASP L CG  1 
ATOM   2262 O OD1 . ASP B 2 75  ? 8.092   -20.924 88.082  1.00 70.29  ? 70  ASP L OD1 1 
ATOM   2263 O OD2 . ASP B 2 75  ? 7.702   -19.530 89.783  1.00 70.60  ? 70  ASP L OD2 1 
ATOM   2264 N N   . PHE B 2 76  ? 8.535   -15.591 87.369  1.00 44.07  ? 71  PHE L N   1 
ATOM   2265 C CA  . PHE B 2 76  ? 9.026   -14.240 87.130  1.00 45.88  ? 71  PHE L CA  1 
ATOM   2266 C C   . PHE B 2 76  ? 8.963   -13.383 88.375  1.00 41.49  ? 71  PHE L C   1 
ATOM   2267 O O   . PHE B 2 76  ? 8.097   -13.541 89.227  1.00 47.99  ? 71  PHE L O   1 
ATOM   2268 C CB  . PHE B 2 76  ? 8.230   -13.487 86.049  1.00 45.16  ? 71  PHE L CB  1 
ATOM   2269 C CG  . PHE B 2 76  ? 7.944   -14.412 84.890  1.00 43.34  ? 71  PHE L CG  1 
ATOM   2270 C CD1 . PHE B 2 76  ? 8.901   -14.611 83.905  1.00 47.86  ? 71  PHE L CD1 1 
ATOM   2271 C CD2 . PHE B 2 76  ? 6.764   -15.142 84.835  1.00 43.86  ? 71  PHE L CD2 1 
ATOM   2272 C CE1 . PHE B 2 76  ? 8.673   -15.501 82.875  1.00 42.31  ? 71  PHE L CE1 1 
ATOM   2273 C CE2 . PHE B 2 76  ? 6.545   -16.047 83.806  1.00 47.03  ? 71  PHE L CE2 1 
ATOM   2274 C CZ  . PHE B 2 76  ? 7.508   -16.230 82.828  1.00 44.98  ? 71  PHE L CZ  1 
ATOM   2275 N N   . THR B 2 77  ? 9.822   -12.374 88.380  1.00 40.24  ? 72  THR L N   1 
ATOM   2276 C CA  . THR B 2 77  ? 9.952   -11.473 89.497  1.00 45.09  ? 72  THR L CA  1 
ATOM   2277 C C   . THR B 2 77  ? 10.081  -10.033 89.035  1.00 43.89  ? 72  THR L C   1 
ATOM   2278 O O   . THR B 2 77  ? 10.961  -9.669  88.254  1.00 51.62  ? 72  THR L O   1 
ATOM   2279 C CB  . THR B 2 77  ? 11.181  -11.861 90.326  1.00 52.44  ? 72  THR L CB  1 
ATOM   2280 O OG1 . THR B 2 77  ? 10.876  -13.156 90.833  1.00 54.60  ? 72  THR L OG1 1 
ATOM   2281 C CG2 . THR B 2 77  ? 11.425  -10.862 91.432  1.00 54.06  ? 72  THR L CG2 1 
ATOM   2282 N N   . LEU B 2 78  ? 9.232   -9.192  89.609  1.00 44.00  ? 73  LEU L N   1 
ATOM   2283 C CA  . LEU B 2 78  ? 9.416   -7.765  89.581  1.00 40.65  ? 73  LEU L CA  1 
ATOM   2284 C C   . LEU B 2 78  ? 10.095  -7.336  90.875  1.00 49.57  ? 73  LEU L C   1 
ATOM   2285 O O   . LEU B 2 78  ? 9.575   -7.591  91.960  1.00 51.60  ? 73  LEU L O   1 
ATOM   2286 C CB  . LEU B 2 78  ? 8.090   -7.014  89.410  1.00 43.26  ? 73  LEU L CB  1 
ATOM   2287 C CG  . LEU B 2 78  ? 8.217   -5.492  89.366  1.00 45.22  ? 73  LEU L CG  1 
ATOM   2288 C CD1 . LEU B 2 78  ? 8.934   -5.024  88.095  1.00 50.83  ? 73  LEU L CD1 1 
ATOM   2289 C CD2 . LEU B 2 78  ? 6.837   -4.846  89.459  1.00 55.19  ? 73  LEU L CD2 1 
ATOM   2290 N N   . GLU B 2 79  ? 11.200  -6.598  90.704  1.00 50.07  ? 74  GLU L N   1 
ATOM   2291 C CA  . GLU B 2 79  ? 12.041  -6.130  91.792  1.00 54.27  ? 74  GLU L CA  1 
ATOM   2292 C C   . GLU B 2 79  ? 11.998  -4.611  91.838  1.00 48.02  ? 74  GLU L C   1 
ATOM   2293 O O   . GLU B 2 79  ? 12.281  -3.947  90.837  1.00 49.63  ? 74  GLU L O   1 
ATOM   2294 C CB  . GLU B 2 79  ? 13.492  -6.572  91.568  1.00 57.66  ? 74  GLU L CB  1 
ATOM   2295 C CG  . GLU B 2 79  ? 13.776  -7.983  92.068  1.00 70.15  ? 74  GLU L CG  1 
ATOM   2296 C CD  . GLU B 2 79  ? 13.984  -8.095  93.570  1.00 77.92  ? 74  GLU L CD  1 
ATOM   2297 O OE1 . GLU B 2 79  ? 14.000  -7.070  94.304  1.00 80.54  ? 74  GLU L OE1 1 
ATOM   2298 O OE2 . GLU B 2 79  ? 14.139  -9.259  93.994  1.00 92.35  ? 74  GLU L OE2 1 
ATOM   2299 N N   . ILE B 2 80  ? 11.593  -4.075  92.988  1.00 48.98  ? 75  ILE L N   1 
ATOM   2300 C CA  . ILE B 2 80  ? 11.689  -2.653  93.257  1.00 51.25  ? 75  ILE L CA  1 
ATOM   2301 C C   . ILE B 2 80  ? 12.801  -2.488  94.292  1.00 61.28  ? 75  ILE L C   1 
ATOM   2302 O O   . ILE B 2 80  ? 12.716  -3.031  95.388  1.00 59.21  ? 75  ILE L O   1 
ATOM   2303 C CB  . ILE B 2 80  ? 10.354  -2.043  93.737  1.00 56.10  ? 75  ILE L CB  1 
ATOM   2304 C CG1 . ILE B 2 80  ? 9.125   -2.571  92.975  1.00 60.48  ? 75  ILE L CG1 1 
ATOM   2305 C CG2 . ILE B 2 80  ? 10.424  -0.524  93.668  1.00 55.39  ? 75  ILE L CG2 1 
ATOM   2306 C CD1 . ILE B 2 80  ? 7.786   -2.118  93.548  1.00 60.24  ? 75  ILE L CD1 1 
ATOM   2307 N N   . SER B 2 81  ? 13.853  -1.762  93.919  1.00 62.81  ? 76  SER L N   1 
ATOM   2308 C CA  . SER B 2 81  ? 15.098  -1.793  94.673  1.00 73.16  ? 76  SER L CA  1 
ATOM   2309 C C   . SER B 2 81  ? 14.964  -0.925  95.923  1.00 76.73  ? 76  SER L C   1 
ATOM   2310 O O   . SER B 2 81  ? 15.288  -1.377  97.024  1.00 87.59  ? 76  SER L O   1 
ATOM   2311 C CB  . SER B 2 81  ? 16.283  -1.377  93.814  1.00 60.39  ? 76  SER L CB  1 
ATOM   2312 O OG  . SER B 2 81  ? 16.191  -0.011  93.435  1.00 63.87  ? 76  SER L OG  1 
ATOM   2313 N N   . ARG B 2 82  ? 14.463  0.306   95.741  1.00 71.58  ? 77  ARG L N   1 
ATOM   2314 C CA  . ARG B 2 82  ? 14.264  1.249   96.833  1.00 66.41  ? 77  ARG L CA  1 
ATOM   2315 C C   . ARG B 2 82  ? 12.864  1.858   96.738  1.00 69.37  ? 77  ARG L C   1 
ATOM   2316 O O   . ARG B 2 82  ? 12.689  2.952   96.203  1.00 70.85  ? 77  ARG L O   1 
ATOM   2317 C CB  . ARG B 2 82  ? 15.331  2.346   96.796  1.00 74.90  ? 77  ARG L CB  1 
ATOM   2318 C CG  . ARG B 2 82  ? 16.668  1.920   97.391  1.00 88.72  ? 77  ARG L CG  1 
ATOM   2319 C CD  . ARG B 2 82  ? 17.813  2.760   96.852  1.00 93.68  ? 77  ARG L CD  1 
ATOM   2320 N NE  . ARG B 2 82  ? 18.076  2.373   95.459  1.00 97.66  ? 77  ARG L NE  1 
ATOM   2321 C CZ  . ARG B 2 82  ? 17.736  3.042   94.351  1.00 89.21  ? 77  ARG L CZ  1 
ATOM   2322 N NH1 . ARG B 2 82  ? 17.208  4.255   94.424  1.00 79.03  ? 77  ARG L NH1 1 
ATOM   2323 N NH2 . ARG B 2 82  ? 17.931  2.481   93.166  1.00 81.69  ? 77  ARG L NH2 1 
ATOM   2324 N N   . VAL B 2 83  ? 11.892  1.164   97.345  1.00 72.82  ? 78  VAL L N   1 
ATOM   2325 C CA  . VAL B 2 83  ? 10.478  1.474   97.196  1.00 70.86  ? 78  VAL L CA  1 
ATOM   2326 C C   . VAL B 2 83  ? 10.233  2.924   97.602  1.00 61.16  ? 78  VAL L C   1 
ATOM   2327 O O   . VAL B 2 83  ? 10.908  3.442   98.480  1.00 64.44  ? 78  VAL L O   1 
ATOM   2328 C CB  . VAL B 2 83  ? 9.613   0.486   98.001  1.00 69.38  ? 78  VAL L CB  1 
ATOM   2329 C CG1 . VAL B 2 83  ? 9.680   0.746   99.499  1.00 84.72  ? 78  VAL L CG1 1 
ATOM   2330 C CG2 . VAL B 2 83  ? 8.159   0.506   97.566  1.00 71.01  ? 78  VAL L CG2 1 
ATOM   2331 N N   . LYS B 2 84  ? 9.289   3.583   96.922  1.00 63.76  ? 79  LYS L N   1 
ATOM   2332 C CA  . LYS B 2 84  ? 8.891   4.948   97.236  1.00 62.56  ? 79  LYS L CA  1 
ATOM   2333 C C   . LYS B 2 84  ? 7.368   5.055   97.327  1.00 64.99  ? 79  LYS L C   1 
ATOM   2334 O O   . LYS B 2 84  ? 6.645   4.111   97.008  1.00 59.45  ? 79  LYS L O   1 
ATOM   2335 C CB  . LYS B 2 84  ? 9.354   5.964   96.194  1.00 65.62  ? 79  LYS L CB  1 
ATOM   2336 C CG  . LYS B 2 84  ? 10.855  6.097   96.084  1.00 77.71  ? 79  LYS L CG  1 
ATOM   2337 C CD  . LYS B 2 84  ? 11.241  7.297   95.228  1.00 82.88  ? 79  LYS L CD  1 
ATOM   2338 C CE  . LYS B 2 84  ? 12.709  7.367   94.942  1.00 85.43  ? 79  LYS L CE  1 
ATOM   2339 N NZ  . LYS B 2 84  ? 13.029  8.639   94.290  1.00 88.55  ? 79  LYS L NZ  1 
ATOM   2340 N N   . ALA B 2 85  ? 6.903   6.225   97.783  1.00 65.84  ? 80  ALA L N   1 
ATOM   2341 C CA  . ALA B 2 85  ? 5.496   6.459   98.057  1.00 61.11  ? 80  ALA L CA  1 
ATOM   2342 C C   . ALA B 2 85  ? 4.650   6.189   96.813  1.00 59.81  ? 80  ALA L C   1 
ATOM   2343 O O   . ALA B 2 85  ? 3.583   5.586   96.916  1.00 57.11  ? 80  ALA L O   1 
ATOM   2344 C CB  . ALA B 2 85  ? 5.313   7.871   98.553  1.00 55.45  ? 80  ALA L CB  1 
ATOM   2345 N N   . GLU B 2 86  ? 5.155   6.626   95.650  1.00 59.84  ? 81  GLU L N   1 
ATOM   2346 C CA  . GLU B 2 86  ? 4.409   6.682   94.398  1.00 57.98  ? 81  GLU L CA  1 
ATOM   2347 C C   . GLU B 2 86  ? 4.270   5.301   93.770  1.00 59.37  ? 81  GLU L C   1 
ATOM   2348 O O   . GLU B 2 86  ? 3.564   5.150   92.776  1.00 61.47  ? 81  GLU L O   1 
ATOM   2349 C CB  . GLU B 2 86  ? 5.087   7.590   93.367  1.00 59.02  ? 81  GLU L CB  1 
ATOM   2350 C CG  . GLU B 2 86  ? 6.564   7.274   93.140  1.00 68.82  ? 81  GLU L CG  1 
ATOM   2351 C CD  . GLU B 2 86  ? 7.539   8.138   93.944  1.00 82.45  ? 81  GLU L CD  1 
ATOM   2352 O OE1 . GLU B 2 86  ? 7.278   8.510   95.137  1.00 73.54  ? 81  GLU L OE1 1 
ATOM   2353 O OE2 . GLU B 2 86  ? 8.602   8.423   93.337  1.00 76.03  ? 81  GLU L OE2 1 
ATOM   2354 N N   . ASP B 2 87  ? 4.951   4.307   94.347  1.00 49.13  ? 82  ASP L N   1 
ATOM   2355 C CA  . ASP B 2 87  ? 4.886   2.937   93.889  1.00 49.71  ? 82  ASP L CA  1 
ATOM   2356 C C   . ASP B 2 87  ? 3.596   2.244   94.312  1.00 47.69  ? 82  ASP L C   1 
ATOM   2357 O O   . ASP B 2 87  ? 3.335   1.127   93.868  1.00 47.70  ? 82  ASP L O   1 
ATOM   2358 C CB  . ASP B 2 87  ? 6.095   2.159   94.380  1.00 52.56  ? 82  ASP L CB  1 
ATOM   2359 C CG  . ASP B 2 87  ? 7.439   2.758   93.981  1.00 55.96  ? 82  ASP L CG  1 
ATOM   2360 O OD1 . ASP B 2 87  ? 7.472   3.635   93.086  1.00 53.39  ? 82  ASP L OD1 1 
ATOM   2361 O OD2 . ASP B 2 87  ? 8.443   2.362   94.601  1.00 61.34  ? 82  ASP L OD2 1 
ATOM   2362 N N   . VAL B 2 88  ? 2.798   2.883   95.180  1.00 51.02  ? 83  VAL L N   1 
ATOM   2363 C CA  . VAL B 2 88  ? 1.638   2.215   95.762  1.00 52.58  ? 83  VAL L CA  1 
ATOM   2364 C C   . VAL B 2 88  ? 0.612   1.969   94.651  1.00 46.03  ? 83  VAL L C   1 
ATOM   2365 O O   . VAL B 2 88  ? 0.486   2.794   93.755  1.00 47.91  ? 83  VAL L O   1 
ATOM   2366 C CB  . VAL B 2 88  ? 1.034   2.987   96.965  1.00 56.85  ? 83  VAL L CB  1 
ATOM   2367 C CG1 . VAL B 2 88  ? 0.482   4.361   96.620  1.00 55.32  ? 83  VAL L CG1 1 
ATOM   2368 C CG2 . VAL B 2 88  ? -0.065  2.195   97.649  1.00 66.60  ? 83  VAL L CG2 1 
ATOM   2369 N N   . GLY B 2 89  ? -0.079  0.825   94.720  1.00 45.24  ? 84  GLY L N   1 
ATOM   2370 C CA  . GLY B 2 89  ? -1.022  0.421   93.693  1.00 47.79  ? 84  GLY L CA  1 
ATOM   2371 C C   . GLY B 2 89  ? -1.052  -1.090  93.546  1.00 50.67  ? 84  GLY L C   1 
ATOM   2372 O O   . GLY B 2 89  ? -0.577  -1.816  94.423  1.00 49.11  ? 84  GLY L O   1 
ATOM   2373 N N   . VAL B 2 90  ? -1.628  -1.553  92.428  1.00 41.47  ? 85  VAL L N   1 
ATOM   2374 C CA  . VAL B 2 90  ? -1.682  -2.969  92.117  1.00 41.61  ? 85  VAL L CA  1 
ATOM   2375 C C   . VAL B 2 90  ? -0.787  -3.208  90.905  1.00 44.26  ? 85  VAL L C   1 
ATOM   2376 O O   . VAL B 2 90  ? -0.925  -2.505  89.887  1.00 42.91  ? 85  VAL L O   1 
ATOM   2377 C CB  . VAL B 2 90  ? -3.127  -3.420  91.847  1.00 42.97  ? 85  VAL L CB  1 
ATOM   2378 C CG1 . VAL B 2 90  ? -3.216  -4.915  91.573  1.00 43.96  ? 85  VAL L CG1 1 
ATOM   2379 C CG2 . VAL B 2 90  ? -4.047  -3.009  92.996  1.00 47.02  ? 85  VAL L CG2 1 
ATOM   2380 N N   . TYR B 2 91  ? 0.054   -4.243  91.024  1.00 42.13  ? 86  TYR L N   1 
ATOM   2381 C CA  . TYR B 2 91  ? 0.959   -4.703  89.984  1.00 43.88  ? 86  TYR L CA  1 
ATOM   2382 C C   . TYR B 2 91  ? 0.340   -5.904  89.290  1.00 38.65  ? 86  TYR L C   1 
ATOM   2383 O O   . TYR B 2 91  ? -0.121  -6.835  89.940  1.00 43.37  ? 86  TYR L O   1 
ATOM   2384 C CB  . TYR B 2 91  ? 2.346   -4.991  90.593  1.00 49.10  ? 86  TYR L CB  1 
ATOM   2385 C CG  . TYR B 2 91  ? 3.057   -3.723  91.031  1.00 42.27  ? 86  TYR L CG  1 
ATOM   2386 C CD1 . TYR B 2 91  ? 2.808   -3.147  92.279  1.00 43.23  ? 86  TYR L CD1 1 
ATOM   2387 C CD2 . TYR B 2 91  ? 3.937   -3.061  90.189  1.00 39.73  ? 86  TYR L CD2 1 
ATOM   2388 C CE1 . TYR B 2 91  ? 3.412   -1.962  92.658  1.00 42.67  ? 86  TYR L CE1 1 
ATOM   2389 C CE2 . TYR B 2 91  ? 4.522   -1.864  90.555  1.00 42.65  ? 86  TYR L CE2 1 
ATOM   2390 C CZ  . TYR B 2 91  ? 4.289   -1.327  91.808  1.00 44.42  ? 86  TYR L CZ  1 
ATOM   2391 O OH  . TYR B 2 91  ? 4.868   -0.139  92.137  1.00 43.22  ? 86  TYR L OH  1 
ATOM   2392 N N   . TYR B 2 92  ? 0.347   -5.894  87.942  1.00 38.76  ? 87  TYR L N   1 
ATOM   2393 C CA  . TYR B 2 92  ? -0.130  -7.004  87.148  1.00 40.75  ? 87  TYR L CA  1 
ATOM   2394 C C   . TYR B 2 92  ? 0.951   -7.481  86.183  1.00 39.03  ? 87  TYR L C   1 
ATOM   2395 O O   . TYR B 2 92  ? 1.602   -6.663  85.533  1.00 38.73  ? 87  TYR L O   1 
ATOM   2396 C CB  . TYR B 2 92  ? -1.315  -6.541  86.306  1.00 41.32  ? 87  TYR L CB  1 
ATOM   2397 C CG  . TYR B 2 92  ? -2.574  -6.209  87.088  1.00 36.87  ? 87  TYR L CG  1 
ATOM   2398 C CD1 . TYR B 2 92  ? -3.478  -7.214  87.440  1.00 39.52  ? 87  TYR L CD1 1 
ATOM   2399 C CD2 . TYR B 2 92  ? -2.872  -4.894  87.427  1.00 39.64  ? 87  TYR L CD2 1 
ATOM   2400 C CE1 . TYR B 2 92  ? -4.658  -6.915  88.106  1.00 42.95  ? 87  TYR L CE1 1 
ATOM   2401 C CE2 . TYR B 2 92  ? -4.040  -4.590  88.111  1.00 40.17  ? 87  TYR L CE2 1 
ATOM   2402 C CZ  . TYR B 2 92  ? -4.920  -5.602  88.451  1.00 39.31  ? 87  TYR L CZ  1 
ATOM   2403 O OH  . TYR B 2 92  ? -6.062  -5.315  89.108  1.00 46.89  ? 87  TYR L OH  1 
ATOM   2404 N N   . CYS B 2 93  ? 1.092   -8.800  86.098  1.00 39.99  ? 88  CYS L N   1 
ATOM   2405 C CA  . CYS B 2 93  ? 1.830   -9.409  85.009  1.00 41.24  ? 88  CYS L CA  1 
ATOM   2406 C C   . CYS B 2 93  ? 0.846   -9.808  83.918  1.00 37.12  ? 88  CYS L C   1 
ATOM   2407 O O   . CYS B 2 93  ? -0.327  -10.146 84.145  1.00 37.34  ? 88  CYS L O   1 
ATOM   2408 C CB  . CYS B 2 93  ? 2.763   -10.500 85.535  1.00 46.78  ? 88  CYS L CB  1 
ATOM   2409 S SG  . CYS B 2 93  ? 1.826   -11.766 86.399  1.00 54.97  ? 88  CYS L SG  1 
ATOM   2410 N N   . GLN B 2 94  ? 1.347   -9.806  82.693  1.00 33.66  ? 89  GLN L N   1 
ATOM   2411 C CA  . GLN B 2 94  ? 0.575   -10.168 81.526  1.00 34.97  ? 89  GLN L CA  1 
ATOM   2412 C C   . GLN B 2 94  ? 1.482   -10.958 80.583  1.00 34.60  ? 89  GLN L C   1 
ATOM   2413 O O   . GLN B 2 94  ? 2.594   -10.502 80.322  1.00 38.58  ? 89  GLN L O   1 
ATOM   2414 C CB  . GLN B 2 94  ? 0.099   -8.896  80.806  1.00 34.80  ? 89  GLN L CB  1 
ATOM   2415 C CG  . GLN B 2 94  ? -0.698  -9.163  79.531  1.00 32.88  ? 89  GLN L CG  1 
ATOM   2416 C CD  . GLN B 2 94  ? -0.786  -7.983  78.568  1.00 35.38  ? 89  GLN L CD  1 
ATOM   2417 O OE1 . GLN B 2 94  ? 0.146   -7.182  78.399  1.00 36.27  ? 89  GLN L OE1 1 
ATOM   2418 N NE2 . GLN B 2 94  ? -1.908  -7.902  77.869  1.00 34.74  ? 89  GLN L NE2 1 
ATOM   2419 N N   . GLN B 2 95  ? 1.012   -12.099 80.076  1.00 35.93  ? 90  GLN L N   1 
ATOM   2420 C CA  . GLN B 2 95  ? 1.720   -12.817 79.039  1.00 36.86  ? 90  GLN L CA  1 
ATOM   2421 C C   . GLN B 2 95  ? 1.132   -12.372 77.699  1.00 35.70  ? 90  GLN L C   1 
ATOM   2422 O O   . GLN B 2 95  ? -0.094  -12.211 77.541  1.00 36.08  ? 90  GLN L O   1 
ATOM   2423 C CB  . GLN B 2 95  ? 1.676   -14.335 79.172  1.00 36.00  ? 90  GLN L CB  1 
ATOM   2424 C CG  . GLN B 2 95  ? 0.353   -15.019 78.864  1.00 35.71  ? 90  GLN L CG  1 
ATOM   2425 C CD  . GLN B 2 95  ? 0.029   -15.188 77.386  1.00 36.60  ? 90  GLN L CD  1 
ATOM   2426 O OE1 . GLN B 2 95  ? 0.879   -15.177 76.487  1.00 38.80  ? 90  GLN L OE1 1 
ATOM   2427 N NE2 . GLN B 2 95  ? -1.234  -15.415 77.093  1.00 36.64  ? 90  GLN L NE2 1 
ATOM   2428 N N   . VAL B 2 96  ? 2.025   -12.145 76.739  1.00 33.15  ? 91  VAL L N   1 
ATOM   2429 C CA  . VAL B 2 96  ? 1.625   -11.839 75.370  1.00 33.32  ? 91  VAL L CA  1 
ATOM   2430 C C   . VAL B 2 96  ? 2.324   -12.744 74.352  1.00 37.30  ? 91  VAL L C   1 
ATOM   2431 O O   . VAL B 2 96  ? 2.440   -12.361 73.169  1.00 33.21  ? 91  VAL L O   1 
ATOM   2432 C CB  . VAL B 2 96  ? 1.839   -10.336 75.064  1.00 34.23  ? 91  VAL L CB  1 
ATOM   2433 C CG1 . VAL B 2 96  ? 0.932   -9.470  75.933  1.00 36.09  ? 91  VAL L CG1 1 
ATOM   2434 C CG2 . VAL B 2 96  ? 3.300   -9.881  75.135  1.00 35.04  ? 91  VAL L CG2 1 
ATOM   2435 N N   . VAL B 2 97  ? 2.730   -13.972 74.761  1.00 37.78  ? 92  VAL L N   1 
ATOM   2436 C CA  . VAL B 2 97  ? 3.395   -14.888 73.831  1.00 36.56  ? 92  VAL L CA  1 
ATOM   2437 C C   . VAL B 2 97  ? 2.410   -15.522 72.863  1.00 40.11  ? 92  VAL L C   1 
ATOM   2438 O O   . VAL B 2 97  ? 2.796   -15.936 71.765  1.00 39.93  ? 92  VAL L O   1 
ATOM   2439 C CB  . VAL B 2 97  ? 4.218   -15.970 74.575  1.00 40.12  ? 92  VAL L CB  1 
ATOM   2440 C CG1 . VAL B 2 97  ? 3.363   -17.109 75.107  1.00 38.19  ? 92  VAL L CG1 1 
ATOM   2441 C CG2 . VAL B 2 97  ? 5.359   -16.507 73.708  1.00 37.18  ? 92  VAL L CG2 1 
ATOM   2442 N N   . GLU B 2 98  ? 1.120   -15.534 73.237  1.00 36.89  ? 93  GLU L N   1 
ATOM   2443 C CA  . GLU B 2 98  ? 0.079   -16.149 72.453  1.00 35.91  ? 93  GLU L CA  1 
ATOM   2444 C C   . GLU B 2 98  ? -1.250  -15.456 72.767  1.00 34.67  ? 93  GLU L C   1 
ATOM   2445 O O   . GLU B 2 98  ? -1.438  -14.954 73.881  1.00 36.15  ? 93  GLU L O   1 
ATOM   2446 C CB  . GLU B 2 98  ? -0.123  -17.639 72.727  1.00 38.55  ? 93  GLU L CB  1 
ATOM   2447 C CG  . GLU B 2 98  ? -0.555  -17.995 74.157  1.00 43.86  ? 93  GLU L CG  1 
ATOM   2448 C CD  . GLU B 2 98  ? -1.022  -19.445 74.360  1.00 52.15  ? 93  GLU L CD  1 
ATOM   2449 O OE1 . GLU B 2 98  ? -0.302  -20.325 73.827  1.00 47.06  ? 93  GLU L OE1 1 
ATOM   2450 O OE2 . GLU B 2 98  ? -2.091  -19.708 75.009  1.00 48.63  ? 93  GLU L OE2 1 
ATOM   2451 N N   . TYR B 2 99  ? -2.154  -15.507 71.807  1.00 37.02  ? 94  TYR L N   1 
ATOM   2452 C CA  . TYR B 2 99  ? -3.547  -15.213 72.131  1.00 34.77  ? 94  TYR L CA  1 
ATOM   2453 C C   . TYR B 2 99  ? -4.241  -16.450 72.714  1.00 37.22  ? 94  TYR L C   1 
ATOM   2454 O O   . TYR B 2 99  ? -3.974  -17.590 72.298  1.00 36.55  ? 94  TYR L O   1 
ATOM   2455 C CB  . TYR B 2 99  ? -4.281  -14.788 70.868  1.00 37.16  ? 94  TYR L CB  1 
ATOM   2456 C CG  . TYR B 2 99  ? -3.663  -13.609 70.138  1.00 34.11  ? 94  TYR L CG  1 
ATOM   2457 C CD1 . TYR B 2 99  ? -3.573  -12.359 70.737  1.00 33.98  ? 94  TYR L CD1 1 
ATOM   2458 C CD2 . TYR B 2 99  ? -3.175  -13.762 68.850  1.00 39.09  ? 94  TYR L CD2 1 
ATOM   2459 C CE1 . TYR B 2 99  ? -3.052  -11.266 70.055  1.00 33.72  ? 94  TYR L CE1 1 
ATOM   2460 C CE2 . TYR B 2 99  ? -2.627  -12.684 68.168  1.00 39.37  ? 94  TYR L CE2 1 
ATOM   2461 C CZ  . TYR B 2 99  ? -2.601  -11.434 68.755  1.00 36.42  ? 94  TYR L CZ  1 
ATOM   2462 O OH  . TYR B 2 99  ? -2.056  -10.381 68.084  1.00 36.02  ? 94  TYR L OH  1 
ATOM   2463 N N   . PRO B 2 100 ? -5.175  -16.281 73.665  1.00 36.95  ? 95  PRO L N   1 
ATOM   2464 C CA  . PRO B 2 100 ? -5.540  -14.954 74.193  1.00 35.20  ? 95  PRO L CA  1 
ATOM   2465 C C   . PRO B 2 100 ? -4.495  -14.439 75.152  1.00 35.66  ? 95  PRO L C   1 
ATOM   2466 O O   . PRO B 2 100 ? -3.946  -15.210 75.930  1.00 35.49  ? 95  PRO L O   1 
ATOM   2467 C CB  . PRO B 2 100 ? -6.870  -15.210 74.943  1.00 37.21  ? 95  PRO L CB  1 
ATOM   2468 C CG  . PRO B 2 100 ? -6.772  -16.686 75.343  1.00 39.16  ? 95  PRO L CG  1 
ATOM   2469 C CD  . PRO B 2 100 ? -5.982  -17.363 74.242  1.00 38.70  ? 95  PRO L CD  1 
ATOM   2470 N N   . TYR B 2 101 ? -4.291  -13.114 75.187  1.00 32.47  ? 96  TYR L N   1 
ATOM   2471 C CA  . TYR B 2 101 ? -3.465  -12.540 76.225  1.00 32.74  ? 96  TYR L CA  1 
ATOM   2472 C C   . TYR B 2 101 ? -4.143  -12.785 77.568  1.00 36.98  ? 96  TYR L C   1 
ATOM   2473 O O   . TYR B 2 101 ? -5.367  -12.762 77.638  1.00 34.26  ? 96  TYR L O   1 
ATOM   2474 C CB  . TYR B 2 101 ? -3.295  -11.031 76.064  1.00 34.61  ? 96  TYR L CB  1 
ATOM   2475 C CG  . TYR B 2 101 ? -2.580  -10.573 74.813  1.00 34.67  ? 96  TYR L CG  1 
ATOM   2476 C CD1 . TYR B 2 101 ? -1.736  -11.402 74.088  1.00 32.70  ? 96  TYR L CD1 1 
ATOM   2477 C CD2 . TYR B 2 101 ? -2.637  -9.229  74.441  1.00 37.43  ? 96  TYR L CD2 1 
ATOM   2478 C CE1 . TYR B 2 101 ? -1.056  -10.934 72.974  1.00 35.64  ? 96  TYR L CE1 1 
ATOM   2479 C CE2 . TYR B 2 101 ? -1.944  -8.748  73.344  1.00 34.73  ? 96  TYR L CE2 1 
ATOM   2480 C CZ  . TYR B 2 101 ? -1.139  -9.602  72.606  1.00 36.39  ? 96  TYR L CZ  1 
ATOM   2481 O OH  . TYR B 2 101 ? -0.441  -9.135  71.518  1.00 33.94  ? 96  TYR L OH  1 
ATOM   2482 N N   . THR B 2 102 ? -3.339  -13.016 78.601  1.00 34.85  ? 97  THR L N   1 
ATOM   2483 C CA  . THR B 2 102 ? -3.863  -13.315 79.920  1.00 36.11  ? 97  THR L CA  1 
ATOM   2484 C C   . THR B 2 102 ? -3.043  -12.584 80.956  1.00 35.55  ? 97  THR L C   1 
ATOM   2485 O O   . THR B 2 102 ? -1.843  -12.323 80.793  1.00 35.47  ? 97  THR L O   1 
ATOM   2486 C CB  . THR B 2 102 ? -3.904  -14.810 80.249  1.00 38.84  ? 97  THR L CB  1 
ATOM   2487 O OG1 . THR B 2 102 ? -2.672  -15.443 79.897  1.00 38.61  ? 97  THR L OG1 1 
ATOM   2488 C CG2 . THR B 2 102 ? -5.035  -15.520 79.541  1.00 39.09  ? 97  THR L CG2 1 
ATOM   2489 N N   . PHE B 2 103 ? -3.725  -12.255 82.055  1.00 32.53  ? 98  PHE L N   1 
ATOM   2490 C CA  . PHE B 2 103 ? -3.151  -11.456 83.110  1.00 32.16  ? 98  PHE L CA  1 
ATOM   2491 C C   . PHE B 2 103 ? -3.190  -12.217 84.429  1.00 33.26  ? 98  PHE L C   1 
ATOM   2492 O O   . PHE B 2 103 ? -4.108  -12.992 84.675  1.00 37.05  ? 98  PHE L O   1 
ATOM   2493 C CB  . PHE B 2 103 ? -3.895  -10.133 83.399  1.00 35.87  ? 98  PHE L CB  1 
ATOM   2494 C CG  . PHE B 2 103 ? -3.938  -9.108  82.264  1.00 33.23  ? 98  PHE L CG  1 
ATOM   2495 C CD1 . PHE B 2 103 ? -4.847  -9.240  81.221  1.00 38.90  ? 98  PHE L CD1 1 
ATOM   2496 C CD2 . PHE B 2 103 ? -3.134  -7.972  82.309  1.00 34.97  ? 98  PHE L CD2 1 
ATOM   2497 C CE1 . PHE B 2 103 ? -4.939  -8.264  80.233  1.00 38.10  ? 98  PHE L CE1 1 
ATOM   2498 C CE2 . PHE B 2 103 ? -3.217  -7.009  81.324  1.00 37.24  ? 98  PHE L CE2 1 
ATOM   2499 C CZ  . PHE B 2 103 ? -4.115  -7.172  80.281  1.00 34.56  ? 98  PHE L CZ  1 
ATOM   2500 N N   . GLY B 2 104 ? -2.269  -11.872 85.309  1.00 36.91  ? 99  GLY L N   1 
ATOM   2501 C CA  . GLY B 2 104 ? -2.336  -12.305 86.697  1.00 41.84  ? 99  GLY L CA  1 
ATOM   2502 C C   . GLY B 2 104 ? -3.409  -11.535 87.455  1.00 41.36  ? 99  GLY L C   1 
ATOM   2503 O O   . GLY B 2 104 ? -3.976  -10.556 86.951  1.00 39.09  ? 99  GLY L O   1 
ATOM   2504 N N   . GLY B 2 105 ? -3.683  -11.987 88.684  1.00 42.68  ? 100 GLY L N   1 
ATOM   2505 C CA  . GLY B 2 105 ? -4.812  -11.479 89.444  1.00 42.63  ? 100 GLY L CA  1 
ATOM   2506 C C   . GLY B 2 105 ? -4.469  -10.153 90.098  1.00 43.27  ? 100 GLY L C   1 
ATOM   2507 O O   . GLY B 2 105 ? -5.345  -9.466  90.611  1.00 45.57  ? 100 GLY L O   1 
ATOM   2508 N N   . GLY B 2 106 ? -3.187  -9.770  90.065  1.00 42.30  ? 101 GLY L N   1 
ATOM   2509 C CA  . GLY B 2 106 ? -2.749  -8.517  90.632  1.00 41.60  ? 101 GLY L CA  1 
ATOM   2510 C C   . GLY B 2 106 ? -2.193  -8.704  92.047  1.00 43.81  ? 101 GLY L C   1 
ATOM   2511 O O   . GLY B 2 106 ? -2.575  -9.654  92.745  1.00 47.15  ? 101 GLY L O   1 
ATOM   2512 N N   . THR B 2 107 ? -1.219  -7.857  92.386  1.00 44.09  ? 102 THR L N   1 
ATOM   2513 C CA  . THR B 2 107 ? -0.567  -7.824  93.698  1.00 47.91  ? 102 THR L CA  1 
ATOM   2514 C C   . THR B 2 107 ? -0.621  -6.388  94.190  1.00 43.29  ? 102 THR L C   1 
ATOM   2515 O O   . THR B 2 107 ? 0.002   -5.514  93.591  1.00 47.70  ? 102 THR L O   1 
ATOM   2516 C CB  . THR B 2 107 ? 0.901   -8.282  93.671  1.00 48.49  ? 102 THR L CB  1 
ATOM   2517 O OG1 . THR B 2 107 ? 1.005   -9.577  93.101  1.00 42.69  ? 102 THR L OG1 1 
ATOM   2518 C CG2 . THR B 2 107 ? 1.507   -8.313  95.067  1.00 54.67  ? 102 THR L CG2 1 
ATOM   2519 N N   . LYS B 2 108 ? -1.355  -6.154  95.292  1.00 49.02  ? 103 LYS L N   1 
ATOM   2520 C CA  . LYS B 2 108 ? -1.411  -4.845  95.907  1.00 48.84  ? 103 LYS L CA  1 
ATOM   2521 C C   . LYS B 2 108 ? -0.149  -4.599  96.728  1.00 55.77  ? 103 LYS L C   1 
ATOM   2522 O O   . LYS B 2 108 ? 0.271   -5.446  97.518  1.00 54.43  ? 103 LYS L O   1 
ATOM   2523 C CB  . LYS B 2 108 ? -2.627  -4.594  96.822  1.00 51.11  ? 103 LYS L CB  1 
ATOM   2524 C CG  . LYS B 2 108 ? -2.692  -3.133  97.304  1.00 58.23  ? 103 LYS L CG  1 
ATOM   2525 C CD  . LYS B 2 108 ? -3.835  -2.756  98.241  1.00 63.66  ? 103 LYS L CD  1 
ATOM   2526 C CE  . LYS B 2 108 ? -5.134  -2.551  97.548  1.00 74.48  ? 103 LYS L CE  1 
ATOM   2527 N NZ  . LYS B 2 108 ? -6.208  -2.166  98.474  1.00 75.23  ? 103 LYS L NZ  1 
ATOM   2528 N N   . LEU B 2 109 ? 0.412   -3.404  96.551  1.00 49.06  ? 104 LEU L N   1 
ATOM   2529 C CA  . LEU B 2 109 ? 1.535   -2.946  97.342  1.00 54.76  ? 104 LEU L CA  1 
ATOM   2530 C C   . LEU B 2 109 ? 1.064   -1.813  98.235  1.00 55.66  ? 104 LEU L C   1 
ATOM   2531 O O   . LEU B 2 109 ? 0.572   -0.814  97.721  1.00 53.19  ? 104 LEU L O   1 
ATOM   2532 C CB  . LEU B 2 109 ? 2.655   -2.417  96.466  1.00 51.60  ? 104 LEU L CB  1 
ATOM   2533 C CG  . LEU B 2 109 ? 3.868   -1.874  97.221  1.00 57.57  ? 104 LEU L CG  1 
ATOM   2534 C CD1 . LEU B 2 109 ? 4.750   -3.077  97.511  1.00 62.58  ? 104 LEU L CD1 1 
ATOM   2535 C CD2 . LEU B 2 109 ? 4.607   -0.796  96.480  1.00 62.12  ? 104 LEU L CD2 1 
ATOM   2536 N N   . GLU B 2 110 ? 1.263   -1.996  99.548  1.00 58.19  ? 105 GLU L N   1 
ATOM   2537 C CA  . GLU B 2 110 ? 1.095   -0.956  100.552 1.00 58.29  ? 105 GLU L CA  1 
ATOM   2538 C C   . GLU B 2 110 ? 2.474   -0.635  101.121 1.00 56.46  ? 105 GLU L C   1 
ATOM   2539 O O   . GLU B 2 110 ? 3.331   -1.512  101.239 1.00 52.18  ? 105 GLU L O   1 
ATOM   2540 C CB  . GLU B 2 110 ? 0.217   -1.422  101.717 1.00 70.60  ? 105 GLU L CB  1 
ATOM   2541 C CG  . GLU B 2 110 ? -1.228  -1.773  101.361 1.00 79.58  ? 105 GLU L CG  1 
ATOM   2542 C CD  . GLU B 2 110 ? -2.141  -0.583  101.099 1.00 84.86  ? 105 GLU L CD  1 
ATOM   2543 O OE1 . GLU B 2 110 ? -1.778  0.250   100.211 1.00 74.95  ? 105 GLU L OE1 1 
ATOM   2544 O OE2 . GLU B 2 110 ? -3.212  -0.502  101.765 1.00 62.37  ? 105 GLU L OE2 1 
ATOM   2545 N N   . ILE B 2 111 ? 2.669   0.629   101.497 1.00 55.36  ? 106 ILE L N   1 
ATOM   2546 C CA  . ILE B 2 111 ? 3.921   1.071   102.069 1.00 62.07  ? 106 ILE L CA  1 
ATOM   2547 C C   . ILE B 2 111 ? 3.673   1.324   103.560 1.00 61.44  ? 106 ILE L C   1 
ATOM   2548 O O   . ILE B 2 111 ? 2.542   1.602   103.960 1.00 57.69  ? 106 ILE L O   1 
ATOM   2549 C CB  . ILE B 2 111 ? 4.446   2.268   101.250 1.00 69.48  ? 106 ILE L CB  1 
ATOM   2550 C CG1 . ILE B 2 111 ? 5.817   2.727   101.697 1.00 81.00  ? 106 ILE L CG1 1 
ATOM   2551 C CG2 . ILE B 2 111 ? 3.453   3.425   101.231 1.00 79.87  ? 106 ILE L CG2 1 
ATOM   2552 C CD1 . ILE B 2 111 ? 6.574   3.470   100.611 1.00 79.13  ? 106 ILE L CD1 1 
ATOM   2553 N N   . LYS B 2 112 ? 4.686   1.057   104.398 1.00 59.47  ? 107 LYS L N   1 
ATOM   2554 C CA  . LYS B 2 112 ? 4.622   1.362   105.827 1.00 58.38  ? 107 LYS L CA  1 
ATOM   2555 C C   . LYS B 2 112 ? 5.340   2.683   106.059 1.00 48.38  ? 107 LYS L C   1 
ATOM   2556 O O   . LYS B 2 112 ? 6.305   2.988   105.383 1.00 50.51  ? 107 LYS L O   1 
ATOM   2557 C CB  . LYS B 2 112 ? 5.292   0.313   106.720 1.00 60.13  ? 107 LYS L CB  1 
ATOM   2558 C CG  . LYS B 2 112 ? 4.613   -1.056  106.662 1.00 69.81  ? 107 LYS L CG  1 
ATOM   2559 C CD  . LYS B 2 112 ? 5.153   -2.079  107.658 1.00 82.82  ? 107 LYS L CD  1 
ATOM   2560 C CE  . LYS B 2 112 ? 6.588   -2.402  107.403 1.00 86.50  ? 107 LYS L CE  1 
ATOM   2561 N NZ  . LYS B 2 112 ? 7.117   -3.318  108.411 1.00 92.52  ? 107 LYS L NZ  1 
ATOM   2562 N N   . ARG B 2 113 ? 4.861   3.461   107.027 1.00 53.66  ? 108 ARG L N   1 
ATOM   2563 C CA  . ARG B 2 113 ? 5.464   4.747   107.332 1.00 55.09  ? 108 ARG L CA  1 
ATOM   2564 C C   . ARG B 2 113 ? 5.281   5.018   108.829 1.00 52.55  ? 108 ARG L C   1 
ATOM   2565 O O   . ARG B 2 113 ? 4.742   4.171   109.537 1.00 52.81  ? 108 ARG L O   1 
ATOM   2566 C CB  . ARG B 2 113 ? 4.851   5.820   106.423 1.00 51.66  ? 108 ARG L CB  1 
ATOM   2567 C CG  . ARG B 2 113 ? 3.332   5.892   106.558 1.00 56.55  ? 108 ARG L CG  1 
ATOM   2568 C CD  . ARG B 2 113 ? 2.810   7.302   106.333 1.00 55.37  ? 108 ARG L CD  1 
ATOM   2569 N NE  . ARG B 2 113 ? 3.124   8.173   107.473 1.00 54.29  ? 108 ARG L NE  1 
ATOM   2570 C CZ  . ARG B 2 113 ? 3.300   9.489   107.436 1.00 56.96  ? 108 ARG L CZ  1 
ATOM   2571 N NH1 . ARG B 2 113 ? 3.169   10.159  106.320 1.00 56.47  ? 108 ARG L NH1 1 
ATOM   2572 N NH2 . ARG B 2 113 ? 3.610   10.160  108.532 1.00 59.69  ? 108 ARG L NH2 1 
ATOM   2573 N N   . THR B 2 114 ? 5.700   6.211   109.281 1.00 60.83  ? 109 THR L N   1 
ATOM   2574 C CA  . THR B 2 114 ? 5.559   6.613   110.680 1.00 70.82  ? 109 THR L CA  1 
ATOM   2575 C C   . THR B 2 114 ? 4.084   6.848   111.024 1.00 67.16  ? 109 THR L C   1 
ATOM   2576 O O   . THR B 2 114 ? 3.312   7.293   110.175 1.00 57.82  ? 109 THR L O   1 
ATOM   2577 C CB  . THR B 2 114 ? 6.419   7.849   110.971 1.00 70.69  ? 109 THR L CB  1 
ATOM   2578 O OG1 . THR B 2 114 ? 6.156   8.836   109.976 1.00 64.48  ? 109 THR L OG1 1 
ATOM   2579 C CG2 . THR B 2 114 ? 7.904   7.532   110.955 1.00 68.18  ? 109 THR L CG2 1 
ATOM   2580 N N   . VAL B 2 115 ? 3.717   6.528   112.280 1.00 62.27  ? 110 VAL L N   1 
ATOM   2581 C CA  . VAL B 2 115 ? 2.375   6.740   112.809 1.00 57.78  ? 110 VAL L CA  1 
ATOM   2582 C C   . VAL B 2 115 ? 2.040   8.220   112.636 1.00 61.43  ? 110 VAL L C   1 
ATOM   2583 O O   . VAL B 2 115 ? 2.908   9.073   112.772 1.00 62.27  ? 110 VAL L O   1 
ATOM   2584 C CB  . VAL B 2 115 ? 2.224   6.274   114.277 1.00 63.11  ? 110 VAL L CB  1 
ATOM   2585 C CG1 . VAL B 2 115 ? 0.935   6.766   114.934 1.00 61.40  ? 110 VAL L CG1 1 
ATOM   2586 C CG2 . VAL B 2 115 ? 2.324   4.752   114.409 1.00 67.26  ? 110 VAL L CG2 1 
ATOM   2587 N N   . ALA B 2 116 ? 0.807   8.506   112.192 1.00 61.25  ? 111 ALA L N   1 
ATOM   2588 C CA  . ALA B 2 116 ? 0.374   9.871   111.939 1.00 56.83  ? 111 ALA L CA  1 
ATOM   2589 C C   . ALA B 2 116 ? -1.086  9.995   112.364 1.00 59.57  ? 111 ALA L C   1 
ATOM   2590 O O   . ALA B 2 116 ? -1.931  9.170   111.989 1.00 53.30  ? 111 ALA L O   1 
ATOM   2591 C CB  . ALA B 2 116 ? 0.589   10.238  110.485 1.00 55.86  ? 111 ALA L CB  1 
ATOM   2592 N N   . ALA B 2 117 ? -1.350  10.986  113.224 1.00 54.89  ? 112 ALA L N   1 
ATOM   2593 C CA  . ALA B 2 117 ? -2.669  11.182  113.801 1.00 59.10  ? 112 ALA L CA  1 
ATOM   2594 C C   . ALA B 2 117 ? -3.603  11.778  112.752 1.00 50.20  ? 112 ALA L C   1 
ATOM   2595 O O   . ALA B 2 117 ? -3.167  12.604  111.957 1.00 51.41  ? 112 ALA L O   1 
ATOM   2596 C CB  . ALA B 2 117 ? -2.576  12.117  114.998 1.00 60.56  ? 112 ALA L CB  1 
ATOM   2597 N N   . PRO B 2 118 ? -4.909  11.446  112.761 1.00 48.65  ? 113 PRO L N   1 
ATOM   2598 C CA  . PRO B 2 118 ? -5.867  12.132  111.894 1.00 51.49  ? 113 PRO L CA  1 
ATOM   2599 C C   . PRO B 2 118 ? -6.146  13.569  112.320 1.00 60.71  ? 113 PRO L C   1 
ATOM   2600 O O   . PRO B 2 118 ? -6.267  13.827  113.510 1.00 55.55  ? 113 PRO L O   1 
ATOM   2601 C CB  . PRO B 2 118 ? -7.108  11.285  112.037 1.00 51.44  ? 113 PRO L CB  1 
ATOM   2602 C CG  . PRO B 2 118 ? -7.004  10.719  113.425 1.00 56.93  ? 113 PRO L CG  1 
ATOM   2603 C CD  . PRO B 2 118 ? -5.530  10.390  113.569 1.00 51.93  ? 113 PRO L CD  1 
ATOM   2604 N N   . SER B 2 119 ? -6.220  14.490  111.350 1.00 53.53  ? 114 SER L N   1 
ATOM   2605 C CA  . SER B 2 119 ? -6.955  15.727  111.563 1.00 52.77  ? 114 SER L CA  1 
ATOM   2606 C C   . SER B 2 119 ? -8.440  15.406  111.477 1.00 53.07  ? 114 SER L C   1 
ATOM   2607 O O   . SER B 2 119 ? -8.863  14.735  110.538 1.00 52.40  ? 114 SER L O   1 
ATOM   2608 C CB  . SER B 2 119 ? -6.591  16.775  110.576 1.00 49.78  ? 114 SER L CB  1 
ATOM   2609 O OG  . SER B 2 119 ? -5.220  17.095  110.679 1.00 57.59  ? 114 SER L OG  1 
ATOM   2610 N N   . VAL B 2 120 ? -9.214  15.864  112.469 1.00 53.03  ? 115 VAL L N   1 
ATOM   2611 C CA  . VAL B 2 120 ? -10.609 15.498  112.581 1.00 49.99  ? 115 VAL L CA  1 
ATOM   2612 C C   . VAL B 2 120 ? -11.471 16.736  112.360 1.00 53.58  ? 115 VAL L C   1 
ATOM   2613 O O   . VAL B 2 120 ? -11.230 17.780  112.946 1.00 52.42  ? 115 VAL L O   1 
ATOM   2614 C CB  . VAL B 2 120 ? -10.954 14.844  113.919 1.00 50.66  ? 115 VAL L CB  1 
ATOM   2615 C CG1 . VAL B 2 120 ? -12.385 14.333  113.898 1.00 52.76  ? 115 VAL L CG1 1 
ATOM   2616 C CG2 . VAL B 2 120 ? -9.963  13.736  114.259 1.00 53.01  ? 115 VAL L CG2 1 
ATOM   2617 N N   . PHE B 2 121 ? -12.476 16.596  111.492 1.00 50.69  ? 116 PHE L N   1 
ATOM   2618 C CA  . PHE B 2 121 ? -13.296 17.722  111.060 1.00 48.36  ? 116 PHE L CA  1 
ATOM   2619 C C   . PHE B 2 121 ? -14.743 17.251  111.046 1.00 45.69  ? 116 PHE L C   1 
ATOM   2620 O O   . PHE B 2 121 ? -15.013 16.092  110.718 1.00 49.32  ? 116 PHE L O   1 
ATOM   2621 C CB  . PHE B 2 121 ? -12.881 18.245  109.683 1.00 50.44  ? 116 PHE L CB  1 
ATOM   2622 C CG  . PHE B 2 121 ? -11.423 18.655  109.521 1.00 53.63  ? 116 PHE L CG  1 
ATOM   2623 C CD1 . PHE B 2 121 ? -10.905 19.762  110.197 1.00 67.25  ? 116 PHE L CD1 1 
ATOM   2624 C CD2 . PHE B 2 121 ? -10.571 17.947  108.683 1.00 58.22  ? 116 PHE L CD2 1 
ATOM   2625 C CE1 . PHE B 2 121 ? -9.577  20.142  110.037 1.00 67.35  ? 116 PHE L CE1 1 
ATOM   2626 C CE2 . PHE B 2 121 ? -9.239  18.317  108.540 1.00 60.88  ? 116 PHE L CE2 1 
ATOM   2627 C CZ  . PHE B 2 121 ? -8.750  19.421  109.201 1.00 68.88  ? 116 PHE L CZ  1 
ATOM   2628 N N   . ILE B 2 122 ? -15.678 18.148  111.406 1.00 48.11  ? 117 ILE L N   1 
ATOM   2629 C CA  . ILE B 2 122 ? -17.082 17.767  111.473 1.00 47.35  ? 117 ILE L CA  1 
ATOM   2630 C C   . ILE B 2 122 ? -17.934 18.796  110.722 1.00 47.70  ? 117 ILE L C   1 
ATOM   2631 O O   . ILE B 2 122 ? -17.611 19.983  110.691 1.00 51.51  ? 117 ILE L O   1 
ATOM   2632 C CB  . ILE B 2 122 ? -17.551 17.507  112.922 1.00 51.21  ? 117 ILE L CB  1 
ATOM   2633 C CG1 . ILE B 2 122 ? -18.880 16.803  112.967 1.00 50.66  ? 117 ILE L CG1 1 
ATOM   2634 C CG2 . ILE B 2 122 ? -17.592 18.792  113.753 1.00 54.14  ? 117 ILE L CG2 1 
ATOM   2635 C CD1 . ILE B 2 122 ? -19.286 16.336  114.352 1.00 53.09  ? 117 ILE L CD1 1 
ATOM   2636 N N   . PHE B 2 123 ? -19.002 18.274  110.087 1.00 52.62  ? 118 PHE L N   1 
ATOM   2637 C CA  . PHE B 2 123 ? -19.827 18.978  109.116 1.00 46.68  ? 118 PHE L CA  1 
ATOM   2638 C C   . PHE B 2 123 ? -21.283 18.727  109.467 1.00 47.20  ? 118 PHE L C   1 
ATOM   2639 O O   . PHE B 2 123 ? -21.798 17.619  109.310 1.00 48.65  ? 118 PHE L O   1 
ATOM   2640 C CB  . PHE B 2 123 ? -19.564 18.551  107.666 1.00 46.17  ? 118 PHE L CB  1 
ATOM   2641 C CG  . PHE B 2 123 ? -18.179 18.903  107.134 1.00 43.95  ? 118 PHE L CG  1 
ATOM   2642 C CD1 . PHE B 2 123 ? -17.900 20.188  106.697 1.00 40.72  ? 118 PHE L CD1 1 
ATOM   2643 C CD2 . PHE B 2 123 ? -17.165 17.949  107.050 1.00 48.30  ? 118 PHE L CD2 1 
ATOM   2644 C CE1 . PHE B 2 123 ? -16.650 20.534  106.216 1.00 39.85  ? 118 PHE L CE1 1 
ATOM   2645 C CE2 . PHE B 2 123 ? -15.910 18.295  106.563 1.00 48.01  ? 118 PHE L CE2 1 
ATOM   2646 C CZ  . PHE B 2 123 ? -15.647 19.589  106.152 1.00 48.41  ? 118 PHE L CZ  1 
ATOM   2647 N N   . PRO B 2 124 ? -22.008 19.762  109.954 1.00 52.19  ? 119 PRO L N   1 
ATOM   2648 C CA  . PRO B 2 124 ? -23.447 19.630  110.181 1.00 49.84  ? 119 PRO L CA  1 
ATOM   2649 C C   . PRO B 2 124 ? -24.139 19.399  108.843 1.00 50.73  ? 119 PRO L C   1 
ATOM   2650 O O   . PRO B 2 124 ? -23.564 19.658  107.788 1.00 48.71  ? 119 PRO L O   1 
ATOM   2651 C CB  . PRO B 2 124 ? -23.885 20.947  110.842 1.00 52.72  ? 119 PRO L CB  1 
ATOM   2652 C CG  . PRO B 2 124 ? -22.597 21.712  111.107 1.00 57.94  ? 119 PRO L CG  1 
ATOM   2653 C CD  . PRO B 2 124 ? -21.490 21.096  110.282 1.00 52.07  ? 119 PRO L CD  1 
ATOM   2654 N N   . PRO B 2 125 ? -25.405 18.954  108.858 1.00 53.74  ? 120 PRO L N   1 
ATOM   2655 C CA  . PRO B 2 125 ? -26.197 18.840  107.638 1.00 51.53  ? 120 PRO L CA  1 
ATOM   2656 C C   . PRO B 2 125 ? -26.500 20.216  107.065 1.00 50.30  ? 120 PRO L C   1 
ATOM   2657 O O   . PRO B 2 125 ? -26.578 21.193  107.807 1.00 48.72  ? 120 PRO L O   1 
ATOM   2658 C CB  . PRO B 2 125 ? -27.461 18.111  108.118 1.00 49.98  ? 120 PRO L CB  1 
ATOM   2659 C CG  . PRO B 2 125 ? -27.588 18.542  109.562 1.00 54.63  ? 120 PRO L CG  1 
ATOM   2660 C CD  . PRO B 2 125 ? -26.163 18.591  110.068 1.00 55.68  ? 120 PRO L CD  1 
ATOM   2661 N N   . SER B 2 126 ? -26.661 20.285  105.736 1.00 46.05  ? 121 SER L N   1 
ATOM   2662 C CA  . SER B 2 126 ? -27.039 21.518  105.069 1.00 50.09  ? 121 SER L CA  1 
ATOM   2663 C C   . SER B 2 126 ? -28.525 21.795  105.309 1.00 44.26  ? 121 SER L C   1 
ATOM   2664 O O   . SER B 2 126 ? -29.336 20.877  105.422 1.00 46.97  ? 121 SER L O   1 
ATOM   2665 C CB  . SER B 2 126 ? -26.727 21.466  103.577 1.00 48.24  ? 121 SER L CB  1 
ATOM   2666 O OG  . SER B 2 126 ? -27.538 20.486  102.966 1.00 45.58  ? 121 SER L OG  1 
ATOM   2667 N N   . ASP B 2 127 ? -28.877 23.088  105.359 1.00 55.79  ? 122 ASP L N   1 
ATOM   2668 C CA  . ASP B 2 127 ? -30.266 23.512  105.433 1.00 57.92  ? 122 ASP L CA  1 
ATOM   2669 C C   . ASP B 2 127 ? -31.036 22.939  104.250 1.00 47.92  ? 122 ASP L C   1 
ATOM   2670 O O   . ASP B 2 127 ? -32.151 22.461  104.423 1.00 48.92  ? 122 ASP L O   1 
ATOM   2671 C CB  . ASP B 2 127 ? -30.355 25.027  105.529 1.00 63.89  ? 122 ASP L CB  1 
ATOM   2672 C CG  . ASP B 2 127 ? -30.009 25.598  106.899 1.00 70.51  ? 122 ASP L CG  1 
ATOM   2673 O OD1 . ASP B 2 127 ? -29.951 24.805  107.865 1.00 61.60  ? 122 ASP L OD1 1 
ATOM   2674 O OD2 . ASP B 2 127 ? -29.801 26.823  106.989 1.00 80.20  ? 122 ASP L OD2 1 
ATOM   2675 N N   . GLU B 2 128 ? -30.403 22.934  103.064 1.00 50.04  ? 123 GLU L N   1 
ATOM   2676 C CA  . GLU B 2 128 ? -31.012 22.344  101.873 1.00 50.02  ? 123 GLU L CA  1 
ATOM   2677 C C   . GLU B 2 128 ? -31.394 20.876  102.094 1.00 50.33  ? 123 GLU L C   1 
ATOM   2678 O O   . GLU B 2 128 ? -32.525 20.489  101.799 1.00 48.74  ? 123 GLU L O   1 
ATOM   2679 C CB  . GLU B 2 128 ? -30.087 22.495  100.670 1.00 53.16  ? 123 GLU L CB  1 
ATOM   2680 C CG  . GLU B 2 128 ? -30.713 21.945  99.392  1.00 54.11  ? 123 GLU L CG  1 
ATOM   2681 C CD  . GLU B 2 128 ? -29.806 21.890  98.183  1.00 55.03  ? 123 GLU L CD  1 
ATOM   2682 O OE1 . GLU B 2 128 ? -28.672 22.417  98.193  1.00 56.15  ? 123 GLU L OE1 1 
ATOM   2683 O OE2 . GLU B 2 128 ? -30.276 21.258  97.215  1.00 57.12  ? 123 GLU L OE2 1 
ATOM   2684 N N   . GLN B 2 129 ? -30.478 20.048  102.634 1.00 45.45  ? 124 GLN L N   1 
ATOM   2685 C CA  . GLN B 2 129 ? -30.815 18.653  102.887 1.00 45.43  ? 124 GLN L CA  1 
ATOM   2686 C C   . GLN B 2 129 ? -31.956 18.535  103.895 1.00 47.70  ? 124 GLN L C   1 
ATOM   2687 O O   . GLN B 2 129 ? -32.848 17.701  103.743 1.00 46.03  ? 124 GLN L O   1 
ATOM   2688 C CB  . GLN B 2 129 ? -29.620 17.821  103.354 1.00 43.15  ? 124 GLN L CB  1 
ATOM   2689 C CG  . GLN B 2 129 ? -29.882 16.322  103.378 1.00 48.94  ? 124 GLN L CG  1 
ATOM   2690 C CD  . GLN B 2 129 ? -28.778 15.496  104.036 1.00 46.53  ? 124 GLN L CD  1 
ATOM   2691 O OE1 . GLN B 2 129 ? -27.891 15.975  104.758 1.00 43.39  ? 124 GLN L OE1 1 
ATOM   2692 N NE2 . GLN B 2 129 ? -28.813 14.211  103.774 1.00 45.90  ? 124 GLN L NE2 1 
ATOM   2693 N N   . LEU B 2 130 ? -31.884 19.336  104.962 1.00 51.38  ? 125 LEU L N   1 
ATOM   2694 C CA  . LEU B 2 130 ? -32.878 19.251  106.022 1.00 62.05  ? 125 LEU L CA  1 
ATOM   2695 C C   . LEU B 2 130 ? -34.285 19.491  105.476 1.00 66.16  ? 125 LEU L C   1 
ATOM   2696 O O   . LEU B 2 130 ? -35.222 18.793  105.863 1.00 63.27  ? 125 LEU L O   1 
ATOM   2697 C CB  . LEU B 2 130 ? -32.528 20.244  107.130 1.00 62.57  ? 125 LEU L CB  1 
ATOM   2698 C CG  . LEU B 2 130 ? -31.388 19.815  108.054 1.00 65.81  ? 125 LEU L CG  1 
ATOM   2699 C CD1 . LEU B 2 130 ? -31.082 20.890  109.093 1.00 65.97  ? 125 LEU L CD1 1 
ATOM   2700 C CD2 . LEU B 2 130 ? -31.741 18.513  108.739 1.00 67.76  ? 125 LEU L CD2 1 
ATOM   2701 N N   . LYS B 2 131 ? -34.431 20.477  104.581 1.00 68.43  ? 126 LYS L N   1 
ATOM   2702 C CA  . LYS B 2 131 ? -35.728 20.786  104.001 1.00 72.57  ? 126 LYS L CA  1 
ATOM   2703 C C   . LYS B 2 131 ? -36.369 19.537  103.403 1.00 67.71  ? 126 LYS L C   1 
ATOM   2704 O O   . LYS B 2 131 ? -37.583 19.439  103.337 1.00 68.12  ? 126 LYS L O   1 
ATOM   2705 C CB  . LYS B 2 131 ? -35.648 21.850  102.903 1.00 77.65  ? 126 LYS L CB  1 
ATOM   2706 C CG  . LYS B 2 131 ? -35.395 23.246  103.435 1.00 90.01  ? 126 LYS L CG  1 
ATOM   2707 C CD  . LYS B 2 131 ? -35.749 24.342  102.438 1.00 100.00 ? 126 LYS L CD  1 
ATOM   2708 C CE  . LYS B 2 131 ? -35.349 25.697  102.932 1.00 100.00 ? 126 LYS L CE  1 
ATOM   2709 N NZ  . LYS B 2 131 ? -33.892 25.852  102.978 1.00 100.00 ? 126 LYS L NZ  1 
ATOM   2710 N N   . SER B 2 132 ? -35.555 18.587  102.950 1.00 66.48  ? 127 SER L N   1 
ATOM   2711 C CA  . SER B 2 132 ? -36.070 17.414  102.271 1.00 59.45  ? 127 SER L CA  1 
ATOM   2712 C C   . SER B 2 132 ? -36.250 16.235  103.227 1.00 62.35  ? 127 SER L C   1 
ATOM   2713 O O   . SER B 2 132 ? -36.562 15.141  102.761 1.00 68.51  ? 127 SER L O   1 
ATOM   2714 C CB  . SER B 2 132 ? -35.159 17.040  101.148 1.00 64.94  ? 127 SER L CB  1 
ATOM   2715 O OG  . SER B 2 132 ? -33.907 16.614  101.661 1.00 62.89  ? 127 SER L OG  1 
ATOM   2716 N N   . GLY B 2 133 ? -35.981 16.430  104.532 1.00 59.93  ? 128 GLY L N   1 
ATOM   2717 C CA  . GLY B 2 133 ? -36.403 15.483  105.559 1.00 63.15  ? 128 GLY L CA  1 
ATOM   2718 C C   . GLY B 2 133 ? -35.342 14.478  106.027 1.00 61.99  ? 128 GLY L C   1 
ATOM   2719 O O   . GLY B 2 133 ? -35.679 13.534  106.737 1.00 55.85  ? 128 GLY L O   1 
ATOM   2720 N N   . THR B 2 134 ? -34.069 14.667  105.647 1.00 67.15  ? 129 THR L N   1 
ATOM   2721 C CA  . THR B 2 134 ? -32.989 13.821  106.138 1.00 57.70  ? 129 THR L CA  1 
ATOM   2722 C C   . THR B 2 134 ? -31.841 14.699  106.636 1.00 52.33  ? 129 THR L C   1 
ATOM   2723 O O   . THR B 2 134 ? -31.623 15.808  106.151 1.00 51.74  ? 129 THR L O   1 
ATOM   2724 C CB  . THR B 2 134 ? -32.525 12.882  105.031 1.00 61.58  ? 129 THR L CB  1 
ATOM   2725 O OG1 . THR B 2 134 ? -33.711 12.275  104.538 1.00 61.02  ? 129 THR L OG1 1 
ATOM   2726 C CG2 . THR B 2 134 ? -31.610 11.783  105.543 1.00 66.87  ? 129 THR L CG2 1 
ATOM   2727 N N   . ALA B 2 135 ? -31.100 14.201  107.625 1.00 48.77  ? 130 ALA L N   1 
ATOM   2728 C CA  . ALA B 2 135 ? -29.882 14.861  108.053 1.00 53.73  ? 130 ALA L CA  1 
ATOM   2729 C C   . ALA B 2 135 ? -28.693 13.897  107.939 1.00 51.87  ? 130 ALA L C   1 
ATOM   2730 O O   . ALA B 2 135 ? -28.739 12.780  108.457 1.00 55.04  ? 130 ALA L O   1 
ATOM   2731 C CB  . ALA B 2 135 ? -30.044 15.395  109.461 1.00 54.17  ? 130 ALA L CB  1 
ATOM   2732 N N   . SER B 2 136 ? -27.648 14.352  107.236 1.00 45.49  ? 131 SER L N   1 
ATOM   2733 C CA  . SER B 2 136 ? -26.372 13.657  107.119 1.00 41.20  ? 131 SER L CA  1 
ATOM   2734 C C   . SER B 2 136 ? -25.313 14.508  107.816 1.00 43.58  ? 131 SER L C   1 
ATOM   2735 O O   . SER B 2 136 ? -25.110 15.685  107.484 1.00 44.42  ? 131 SER L O   1 
ATOM   2736 C CB  . SER B 2 136 ? -25.977 13.380  105.656 1.00 43.25  ? 131 SER L CB  1 
ATOM   2737 O OG  . SER B 2 136 ? -26.938 12.569  104.979 1.00 49.64  ? 131 SER L OG  1 
ATOM   2738 N N   . VAL B 2 137 ? -24.676 13.919  108.833 1.00 45.81  ? 132 VAL L N   1 
ATOM   2739 C CA  . VAL B 2 137 ? -23.588 14.546  109.562 1.00 42.32  ? 132 VAL L CA  1 
ATOM   2740 C C   . VAL B 2 137 ? -22.315 13.810  109.195 1.00 43.14  ? 132 VAL L C   1 
ATOM   2741 O O   . VAL B 2 137 ? -22.256 12.577  109.280 1.00 47.60  ? 132 VAL L O   1 
ATOM   2742 C CB  . VAL B 2 137 ? -23.795 14.451  111.084 1.00 43.53  ? 132 VAL L CB  1 
ATOM   2743 C CG1 . VAL B 2 137 ? -22.865 15.386  111.820 1.00 46.13  ? 132 VAL L CG1 1 
ATOM   2744 C CG2 . VAL B 2 137 ? -25.252 14.696  111.442 1.00 46.77  ? 132 VAL L CG2 1 
ATOM   2745 N N   . VAL B 2 138 ? -21.291 14.575  108.829 1.00 42.38  ? 133 VAL L N   1 
ATOM   2746 C CA  . VAL B 2 138 ? -20.082 13.992  108.288 1.00 43.21  ? 133 VAL L CA  1 
ATOM   2747 C C   . VAL B 2 138 ? -18.922 14.344  109.207 1.00 45.02  ? 133 VAL L C   1 
ATOM   2748 O O   . VAL B 2 138 ? -18.663 15.513  109.482 1.00 46.63  ? 133 VAL L O   1 
ATOM   2749 C CB  . VAL B 2 138 ? -19.763 14.457  106.854 1.00 41.60  ? 133 VAL L CB  1 
ATOM   2750 C CG1 . VAL B 2 138 ? -18.383 13.981  106.431 1.00 45.69  ? 133 VAL L CG1 1 
ATOM   2751 C CG2 . VAL B 2 138 ? -20.819 13.978  105.867 1.00 42.31  ? 133 VAL L CG2 1 
ATOM   2752 N N   . CYS B 2 139 ? -18.159 13.298  109.530 1.00 45.45  ? 134 CYS L N   1 
ATOM   2753 C CA  . CYS B 2 139 ? -16.911 13.408  110.253 1.00 47.89  ? 134 CYS L CA  1 
ATOM   2754 C C   . CYS B 2 139 ? -15.776 12.940  109.350 1.00 46.27  ? 134 CYS L C   1 
ATOM   2755 O O   . CYS B 2 139 ? -15.860 11.863  108.770 1.00 48.02  ? 134 CYS L O   1 
ATOM   2756 C CB  . CYS B 2 139 ? -17.012 12.556  111.510 1.00 52.19  ? 134 CYS L CB  1 
ATOM   2757 S SG  . CYS B 2 139 ? -15.550 12.720  112.553 1.00 56.55  ? 134 CYS L SG  1 
ATOM   2758 N N   . LEU B 2 140 ? -14.751 13.777  109.209 1.00 46.47  ? 135 LEU L N   1 
ATOM   2759 C CA  . LEU B 2 140 ? -13.618 13.484  108.353 1.00 48.08  ? 135 LEU L CA  1 
ATOM   2760 C C   . LEU B 2 140 ? -12.349 13.286  109.172 1.00 50.23  ? 135 LEU L C   1 
ATOM   2761 O O   . LEU B 2 140 ? -11.964 14.150  109.951 1.00 49.98  ? 135 LEU L O   1 
ATOM   2762 C CB  . LEU B 2 140 ? -13.474 14.687  107.438 1.00 45.25  ? 135 LEU L CB  1 
ATOM   2763 C CG  . LEU B 2 140 ? -12.220 14.694  106.570 1.00 46.41  ? 135 LEU L CG  1 
ATOM   2764 C CD1 . LEU B 2 140 ? -12.211 13.501  105.610 1.00 49.13  ? 135 LEU L CD1 1 
ATOM   2765 C CD2 . LEU B 2 140 ? -12.121 16.008  105.818 1.00 45.71  ? 135 LEU L CD2 1 
ATOM   2766 N N   . LEU B 2 141 ? -11.684 12.153  108.956 1.00 47.19  ? 136 LEU L N   1 
ATOM   2767 C CA  . LEU B 2 141 ? -10.355 11.916  109.479 1.00 46.23  ? 136 LEU L CA  1 
ATOM   2768 C C   . LEU B 2 141 ? -9.390  12.038  108.312 1.00 49.67  ? 136 LEU L C   1 
ATOM   2769 O O   . LEU B 2 141 ? -9.362  11.162  107.453 1.00 51.52  ? 136 LEU L O   1 
ATOM   2770 C CB  . LEU B 2 141 ? -10.265 10.527  110.104 1.00 48.03  ? 136 LEU L CB  1 
ATOM   2771 C CG  . LEU B 2 141 ? -11.017 10.289  111.410 1.00 45.61  ? 136 LEU L CG  1 
ATOM   2772 C CD1 . LEU B 2 141 ? -12.507 10.563  111.426 1.00 47.92  ? 136 LEU L CD1 1 
ATOM   2773 C CD2 . LEU B 2 141 ? -10.751 8.865   111.836 1.00 51.63  ? 136 LEU L CD2 1 
ATOM   2774 N N   . ASN B 2 142 ? -8.571  13.096  108.308 1.00 51.34  ? 137 ASN L N   1 
ATOM   2775 C CA  . ASN B 2 142 ? -7.675  13.359  107.203 1.00 50.09  ? 137 ASN L CA  1 
ATOM   2776 C C   . ASN B 2 142 ? -6.226  12.939  107.499 1.00 57.36  ? 137 ASN L C   1 
ATOM   2777 O O   . ASN B 2 142 ? -5.627  13.317  108.502 1.00 50.22  ? 137 ASN L O   1 
ATOM   2778 C CB  . ASN B 2 142 ? -7.741  14.831  106.827 1.00 51.50  ? 137 ASN L CB  1 
ATOM   2779 C CG  . ASN B 2 142 ? -7.810  15.010  105.334 1.00 60.97  ? 137 ASN L CG  1 
ATOM   2780 O OD1 . ASN B 2 142 ? -8.242  14.092  104.623 1.00 56.42  ? 137 ASN L OD1 1 
ATOM   2781 N ND2 . ASN B 2 142 ? -7.467  16.195  104.851 1.00 68.25  ? 137 ASN L ND2 1 
ATOM   2782 N N   . ASN B 2 143 ? -5.650  12.155  106.585 1.00 51.86  ? 138 ASN L N   1 
ATOM   2783 C CA  . ASN B 2 143 ? -4.214  11.925  106.467 1.00 52.41  ? 138 ASN L CA  1 
ATOM   2784 C C   . ASN B 2 143 ? -3.615  11.241  107.703 1.00 55.04  ? 138 ASN L C   1 
ATOM   2785 O O   . ASN B 2 143 ? -2.755  11.792  108.372 1.00 58.74  ? 138 ASN L O   1 
ATOM   2786 C CB  . ASN B 2 143 ? -3.480  13.211  106.112 1.00 57.37  ? 138 ASN L CB  1 
ATOM   2787 C CG  . ASN B 2 143 ? -4.034  13.888  104.877 1.00 61.91  ? 138 ASN L CG  1 
ATOM   2788 O OD1 . ASN B 2 143 ? -4.778  13.294  104.098 1.00 64.87  ? 138 ASN L OD1 1 
ATOM   2789 N ND2 . ASN B 2 143 ? -3.687  15.146  104.663 1.00 76.93  ? 138 ASN L ND2 1 
ATOM   2790 N N   . PHE B 2 144 ? -3.988  9.995   107.953 1.00 51.19  ? 139 PHE L N   1 
ATOM   2791 C CA  . PHE B 2 144 ? -3.468  9.267   109.098 1.00 51.72  ? 139 PHE L CA  1 
ATOM   2792 C C   . PHE B 2 144 ? -2.842  7.938   108.676 1.00 59.78  ? 139 PHE L C   1 
ATOM   2793 O O   . PHE B 2 144 ? -3.026  7.470   107.547 1.00 49.08  ? 139 PHE L O   1 
ATOM   2794 C CB  . PHE B 2 144 ? -4.642  9.122   110.058 1.00 51.93  ? 139 PHE L CB  1 
ATOM   2795 C CG  . PHE B 2 144 ? -5.818  8.308   109.541 1.00 51.73  ? 139 PHE L CG  1 
ATOM   2796 C CD1 . PHE B 2 144 ? -5.848  6.926   109.680 1.00 53.28  ? 139 PHE L CD1 1 
ATOM   2797 C CD2 . PHE B 2 144 ? -6.918  8.936   108.957 1.00 52.86  ? 139 PHE L CD2 1 
ATOM   2798 C CE1 . PHE B 2 144 ? -6.935  6.184   109.244 1.00 51.56  ? 139 PHE L CE1 1 
ATOM   2799 C CE2 . PHE B 2 144 ? -8.007  8.188   108.528 1.00 48.04  ? 139 PHE L CE2 1 
ATOM   2800 C CZ  . PHE B 2 144 ? -8.011  6.816   108.662 1.00 49.61  ? 139 PHE L CZ  1 
ATOM   2801 N N   . TYR B 2 145 ? -2.089  7.346   109.612 1.00 53.71  ? 140 TYR L N   1 
ATOM   2802 C CA  . TYR B 2 145 ? -1.458  6.045   109.439 1.00 51.49  ? 140 TYR L CA  1 
ATOM   2803 C C   . TYR B 2 145 ? -1.219  5.445   110.826 1.00 57.93  ? 140 TYR L C   1 
ATOM   2804 O O   . TYR B 2 145 ? -0.808  6.168   111.726 1.00 57.03  ? 140 TYR L O   1 
ATOM   2805 C CB  . TYR B 2 145 ? -0.138  6.187   108.680 1.00 48.89  ? 140 TYR L CB  1 
ATOM   2806 C CG  . TYR B 2 145 ? 0.455   4.813   108.416 1.00 50.22  ? 140 TYR L CG  1 
ATOM   2807 C CD1 . TYR B 2 145 ? 1.286   4.198   109.347 1.00 53.86  ? 140 TYR L CD1 1 
ATOM   2808 C CD2 . TYR B 2 145 ? 0.125   4.098   107.268 1.00 56.35  ? 140 TYR L CD2 1 
ATOM   2809 C CE1 . TYR B 2 145 ? 1.800   2.933   109.127 1.00 55.54  ? 140 TYR L CE1 1 
ATOM   2810 C CE2 . TYR B 2 145 ? 0.639   2.829   107.033 1.00 57.12  ? 140 TYR L CE2 1 
ATOM   2811 C CZ  . TYR B 2 145 ? 1.482   2.246   107.967 1.00 58.36  ? 140 TYR L CZ  1 
ATOM   2812 O OH  . TYR B 2 145 ? 1.965   0.979   107.788 1.00 62.05  ? 140 TYR L OH  1 
ATOM   2813 N N   . PRO B 2 146 ? -1.462  4.138   111.073 1.00 61.99  ? 141 PRO L N   1 
ATOM   2814 C CA  . PRO B 2 146 ? -2.043  3.216   110.088 1.00 55.64  ? 141 PRO L CA  1 
ATOM   2815 C C   . PRO B 2 146 ? -3.539  3.406   109.827 1.00 60.85  ? 141 PRO L C   1 
ATOM   2816 O O   . PRO B 2 146 ? -4.165  4.295   110.385 1.00 54.87  ? 141 PRO L O   1 
ATOM   2817 C CB  . PRO B 2 146 ? -1.759  1.860   110.766 1.00 62.94  ? 141 PRO L CB  1 
ATOM   2818 C CG  . PRO B 2 146 ? -1.923  2.170   112.243 1.00 63.72  ? 141 PRO L CG  1 
ATOM   2819 C CD  . PRO B 2 146 ? -1.193  3.489   112.370 1.00 59.74  ? 141 PRO L CD  1 
ATOM   2820 N N   . ARG B 2 147 ? -4.122  2.506   109.025 1.00 59.07  ? 142 ARG L N   1 
ATOM   2821 C CA  . ARG B 2 147 ? -5.492  2.643   108.553 1.00 59.64  ? 142 ARG L CA  1 
ATOM   2822 C C   . ARG B 2 147 ? -6.490  2.349   109.676 1.00 61.95  ? 142 ARG L C   1 
ATOM   2823 O O   . ARG B 2 147 ? -7.652  2.771   109.578 1.00 54.95  ? 142 ARG L O   1 
ATOM   2824 C CB  . ARG B 2 147 ? -5.724  1.739   107.326 1.00 64.90  ? 142 ARG L CB  1 
ATOM   2825 C CG  . ARG B 2 147 ? -7.100  1.834   106.676 1.00 66.01  ? 142 ARG L CG  1 
ATOM   2826 C CD  . ARG B 2 147 ? -7.531  0.596   105.876 1.00 76.71  ? 142 ARG L CD  1 
ATOM   2827 N NE  . ARG B 2 147 ? -7.023  0.602   104.501 1.00 80.80  ? 142 ARG L NE  1 
ATOM   2828 C CZ  . ARG B 2 147 ? -6.133  -0.257  103.985 1.00 92.62  ? 142 ARG L CZ  1 
ATOM   2829 N NH1 . ARG B 2 147 ? -5.572  -1.179  104.742 1.00 95.82  ? 142 ARG L NH1 1 
ATOM   2830 N NH2 . ARG B 2 147 ? -5.794  -0.200  102.703 1.00 86.91  ? 142 ARG L NH2 1 
ATOM   2831 N N   . GLU B 2 148 ? -6.077  1.608   110.721 1.00 50.63  ? 143 GLU L N   1 
ATOM   2832 C CA  . GLU B 2 148 ? -7.042  1.207   111.739 1.00 56.51  ? 143 GLU L CA  1 
ATOM   2833 C C   . GLU B 2 148 ? -7.446  2.472   112.506 1.00 53.92  ? 143 GLU L C   1 
ATOM   2834 O O   . GLU B 2 148 ? -6.592  3.288   112.844 1.00 55.37  ? 143 GLU L O   1 
ATOM   2835 C CB  . GLU B 2 148 ? -6.535  0.088   112.664 1.00 61.29  ? 143 GLU L CB  1 
ATOM   2836 C CG  . GLU B 2 148 ? -6.344  -1.276  111.993 1.00 63.54  ? 143 GLU L CG  1 
ATOM   2837 C CD  . GLU B 2 148 ? -5.329  -1.353  110.858 1.00 71.95  ? 143 GLU L CD  1 
ATOM   2838 O OE1 . GLU B 2 148 ? -4.286  -0.660  110.962 1.00 65.38  ? 143 GLU L OE1 1 
ATOM   2839 O OE2 . GLU B 2 148 ? -5.561  -2.103  109.871 1.00 72.27  ? 143 GLU L OE2 1 
ATOM   2840 N N   . ALA B 2 149 ? -8.754  2.653   112.706 1.00 52.26  ? 144 ALA L N   1 
ATOM   2841 C CA  . ALA B 2 149 ? -9.285  3.777   113.456 1.00 49.92  ? 144 ALA L CA  1 
ATOM   2842 C C   . ALA B 2 149 ? -10.699 3.439   113.906 1.00 54.53  ? 144 ALA L C   1 
ATOM   2843 O O   . ALA B 2 149 ? -11.382 2.637   113.277 1.00 54.41  ? 144 ALA L O   1 
ATOM   2844 C CB  . ALA B 2 149 ? -9.267  5.044   112.638 1.00 52.05  ? 144 ALA L CB  1 
ATOM   2845 N N   . LYS B 2 150 ? -11.111 4.024   115.032 1.00 55.70  ? 145 LYS L N   1 
ATOM   2846 C CA  . LYS B 2 150 ? -12.467 3.841   115.517 1.00 58.27  ? 145 LYS L CA  1 
ATOM   2847 C C   . LYS B 2 150 ? -13.125 5.216   115.562 1.00 54.60  ? 145 LYS L C   1 
ATOM   2848 O O   . LYS B 2 150 ? -12.543 6.182   116.043 1.00 59.69  ? 145 LYS L O   1 
ATOM   2849 C CB  . LYS B 2 150 ? -12.522 3.175   116.899 1.00 67.94  ? 145 LYS L CB  1 
ATOM   2850 C CG  . LYS B 2 150 ? -13.923 2.741   117.320 1.00 74.35  ? 145 LYS L CG  1 
ATOM   2851 C CD  . LYS B 2 150 ? -14.160 2.653   118.823 1.00 87.83  ? 145 LYS L CD  1 
ATOM   2852 C CE  . LYS B 2 150 ? -13.367 1.577   119.486 1.00 95.50  ? 145 LYS L CE  1 
ATOM   2853 N NZ  . LYS B 2 150 ? -13.825 1.365   120.863 1.00 98.10  ? 145 LYS L NZ  1 
ATOM   2854 N N   . VAL B 2 151 ? -14.338 5.293   115.028 1.00 58.39  ? 146 VAL L N   1 
ATOM   2855 C CA  . VAL B 2 151 ? -15.095 6.523   115.051 1.00 55.33  ? 146 VAL L CA  1 
ATOM   2856 C C   . VAL B 2 151 ? -16.435 6.182   115.674 1.00 54.68  ? 146 VAL L C   1 
ATOM   2857 O O   . VAL B 2 151 ? -17.121 5.296   115.184 1.00 61.40  ? 146 VAL L O   1 
ATOM   2858 C CB  . VAL B 2 151 ? -15.248 7.136   113.648 1.00 61.61  ? 146 VAL L CB  1 
ATOM   2859 C CG1 . VAL B 2 151 ? -16.139 8.368   113.663 1.00 59.17  ? 146 VAL L CG1 1 
ATOM   2860 C CG2 . VAL B 2 151 ? -13.890 7.464   113.045 1.00 67.78  ? 146 VAL L CG2 1 
ATOM   2861 N N   . GLN B 2 152 ? -16.742 6.832   116.806 1.00 57.77  ? 147 GLN L N   1 
ATOM   2862 C CA  . GLN B 2 152 ? -18.008 6.641   117.473 1.00 55.36  ? 147 GLN L CA  1 
ATOM   2863 C C   . GLN B 2 152 ? -18.759 7.955   117.423 1.00 51.22  ? 147 GLN L C   1 
ATOM   2864 O O   . GLN B 2 152 ? -18.165 9.008   117.586 1.00 56.22  ? 147 GLN L O   1 
ATOM   2865 C CB  . GLN B 2 152 ? -17.778 6.181   118.906 1.00 71.26  ? 147 GLN L CB  1 
ATOM   2866 C CG  . GLN B 2 152 ? -16.979 4.886   118.977 1.00 83.51  ? 147 GLN L CG  1 
ATOM   2867 C CD  . GLN B 2 152 ? -17.137 4.174   120.299 1.00 88.92  ? 147 GLN L CD  1 
ATOM   2868 O OE1 . GLN B 2 152 ? -17.860 3.177   120.409 1.00 83.32  ? 147 GLN L OE1 1 
ATOM   2869 N NE2 . GLN B 2 152 ? -16.470 4.701   121.316 1.00 93.23  ? 147 GLN L NE2 1 
ATOM   2870 N N   . TRP B 2 153 ? -20.060 7.851   117.173 1.00 51.97  ? 148 TRP L N   1 
ATOM   2871 C CA  . TRP B 2 153 ? -20.944 8.996   117.207 1.00 56.40  ? 148 TRP L CA  1 
ATOM   2872 C C   . TRP B 2 153 ? -21.685 9.046   118.539 1.00 56.86  ? 148 TRP L C   1 
ATOM   2873 O O   . TRP B 2 153 ? -22.208 8.023   118.985 1.00 62.08  ? 148 TRP L O   1 
ATOM   2874 C CB  . TRP B 2 153 ? -21.961 8.888   116.071 1.00 56.07  ? 148 TRP L CB  1 
ATOM   2875 C CG  . TRP B 2 153 ? -21.391 9.207   114.720 1.00 56.17  ? 148 TRP L CG  1 
ATOM   2876 C CD1 . TRP B 2 153 ? -20.949 8.323   113.780 1.00 58.56  ? 148 TRP L CD1 1 
ATOM   2877 C CD2 . TRP B 2 153 ? -21.214 10.525  114.165 1.00 53.00  ? 148 TRP L CD2 1 
ATOM   2878 N NE1 . TRP B 2 153 ? -20.521 8.997   112.667 1.00 54.68  ? 148 TRP L NE1 1 
ATOM   2879 C CE2 . TRP B 2 153 ? -20.664 10.344  112.875 1.00 54.31  ? 148 TRP L CE2 1 
ATOM   2880 C CE3 . TRP B 2 153 ? -21.475 11.824  114.614 1.00 52.24  ? 148 TRP L CE3 1 
ATOM   2881 C CZ2 . TRP B 2 153 ? -20.376 11.418  112.042 1.00 45.26  ? 148 TRP L CZ2 1 
ATOM   2882 C CZ3 . TRP B 2 153 ? -21.184 12.884  113.782 1.00 54.42  ? 148 TRP L CZ3 1 
ATOM   2883 C CH2 . TRP B 2 153 ? -20.632 12.682  112.521 1.00 54.61  ? 148 TRP L CH2 1 
ATOM   2884 N N   . LYS B 2 154 ? -21.807 10.259  119.092 1.00 58.47  ? 149 LYS L N   1 
ATOM   2885 C CA  . LYS B 2 154 ? -22.579 10.500  120.303 1.00 61.03  ? 149 LYS L CA  1 
ATOM   2886 C C   . LYS B 2 154 ? -23.566 11.627  120.026 1.00 59.88  ? 149 LYS L C   1 
ATOM   2887 O O   . LYS B 2 154 ? -23.163 12.663  119.505 1.00 56.68  ? 149 LYS L O   1 
ATOM   2888 C CB  . LYS B 2 154 ? -21.682 10.938  121.466 1.00 65.63  ? 149 LYS L CB  1 
ATOM   2889 C CG  . LYS B 2 154 ? -20.721 9.893   122.028 1.00 74.22  ? 149 LYS L CG  1 
ATOM   2890 C CD  . LYS B 2 154 ? -20.264 10.226  123.449 1.00 81.77  ? 149 LYS L CD  1 
ATOM   2891 C CE  . LYS B 2 154 ? -19.229 9.300   124.011 1.00 83.79  ? 149 LYS L CE  1 
ATOM   2892 N NZ  . LYS B 2 154 ? -17.896 9.612   123.488 1.00 82.25  ? 149 LYS L NZ  1 
ATOM   2893 N N   . VAL B 2 155 ? -24.845 11.395  120.340 1.00 52.23  ? 150 VAL L N   1 
ATOM   2894 C CA  . VAL B 2 155 ? -25.867 12.420  120.207 1.00 59.60  ? 150 VAL L CA  1 
ATOM   2895 C C   . VAL B 2 155 ? -26.411 12.710  121.613 1.00 62.33  ? 150 VAL L C   1 
ATOM   2896 O O   . VAL B 2 155 ? -27.041 11.844  122.229 1.00 58.50  ? 150 VAL L O   1 
ATOM   2897 C CB  . VAL B 2 155 ? -27.005 12.004  119.251 1.00 55.32  ? 150 VAL L CB  1 
ATOM   2898 C CG1 . VAL B 2 155 ? -28.067 13.093  119.106 1.00 59.40  ? 150 VAL L CG1 1 
ATOM   2899 C CG2 . VAL B 2 155 ? -26.494 11.586  117.876 1.00 59.52  ? 150 VAL L CG2 1 
ATOM   2900 N N   . ASP B 2 156 ? -26.203 13.946  122.097 1.00 65.69  ? 151 ASP L N   1 
ATOM   2901 C CA  . ASP B 2 156 ? -26.572 14.294  123.464 1.00 63.23  ? 151 ASP L CA  1 
ATOM   2902 C C   . ASP B 2 156 ? -26.005 13.220  124.384 1.00 62.43  ? 151 ASP L C   1 
ATOM   2903 O O   . ASP B 2 156 ? -26.725 12.676  125.217 1.00 66.48  ? 151 ASP L O   1 
ATOM   2904 C CB  . ASP B 2 156 ? -28.077 14.469  123.603 1.00 54.77  ? 151 ASP L CB  1 
ATOM   2905 C CG  . ASP B 2 156 ? -28.631 15.784  123.082 1.00 56.95  ? 151 ASP L CG  1 
ATOM   2906 O OD1 . ASP B 2 156 ? -27.838 16.742  122.974 1.00 61.35  ? 151 ASP L OD1 1 
ATOM   2907 O OD2 . ASP B 2 156 ? -29.840 15.828  122.768 1.00 60.33  ? 151 ASP L OD2 1 
ATOM   2908 N N   . ASN B 2 157 ? -24.731 12.879  124.130 1.00 63.93  ? 152 ASN L N   1 
ATOM   2909 C CA  . ASN B 2 157 ? -23.920 11.978  124.933 1.00 70.80  ? 152 ASN L CA  1 
ATOM   2910 C C   . ASN B 2 157 ? -24.375 10.519  124.882 1.00 67.25  ? 152 ASN L C   1 
ATOM   2911 O O   . ASN B 2 157 ? -23.767 9.688   125.548 1.00 79.60  ? 152 ASN L O   1 
ATOM   2912 C CB  . ASN B 2 157 ? -23.763 12.498  126.357 1.00 80.23  ? 152 ASN L CB  1 
ATOM   2913 C CG  . ASN B 2 157 ? -22.375 13.055  126.554 1.00 93.92  ? 152 ASN L CG  1 
ATOM   2914 O OD1 . ASN B 2 157 ? -21.394 12.302  126.482 1.00 89.05  ? 152 ASN L OD1 1 
ATOM   2915 N ND2 . ASN B 2 157 ? -22.268 14.362  126.756 1.00 99.35  ? 152 ASN L ND2 1 
ATOM   2916 N N   . ALA B 2 158 ? -25.403 10.190  124.091 1.00 64.64  ? 153 ALA L N   1 
ATOM   2917 C CA  . ALA B 2 158 ? -25.766 8.798   123.834 1.00 61.64  ? 153 ALA L CA  1 
ATOM   2918 C C   . ALA B 2 158 ? -24.966 8.240   122.648 1.00 66.64  ? 153 ALA L C   1 
ATOM   2919 O O   . ALA B 2 158 ? -24.980 8.807   121.557 1.00 59.36  ? 153 ALA L O   1 
ATOM   2920 C CB  . ALA B 2 158 ? -27.261 8.692   123.577 1.00 59.18  ? 153 ALA L CB  1 
ATOM   2921 N N   . LEU B 2 159 ? -24.301 7.094   122.857 1.00 70.51  ? 154 LEU L N   1 
ATOM   2922 C CA  . LEU B 2 159 ? -23.554 6.402   121.815 1.00 66.39  ? 154 LEU L CA  1 
ATOM   2923 C C   . LEU B 2 159 ? -24.518 5.878   120.755 1.00 63.97  ? 154 LEU L C   1 
ATOM   2924 O O   . LEU B 2 159 ? -25.535 5.269   121.069 1.00 67.72  ? 154 LEU L O   1 
ATOM   2925 C CB  . LEU B 2 159 ? -22.730 5.268   122.429 1.00 70.64  ? 154 LEU L CB  1 
ATOM   2926 C CG  . LEU B 2 159 ? -22.068 4.288   121.454 1.00 77.55  ? 154 LEU L CG  1 
ATOM   2927 C CD1 . LEU B 2 159 ? -21.094 4.925   120.455 1.00 82.17  ? 154 LEU L CD1 1 
ATOM   2928 C CD2 . LEU B 2 159 ? -21.360 3.241   122.288 1.00 83.83  ? 154 LEU L CD2 1 
ATOM   2929 N N   . GLN B 2 160 ? -24.182 6.113   119.484 1.00 62.14  ? 155 GLN L N   1 
ATOM   2930 C CA  . GLN B 2 160 ? -25.045 5.722   118.380 1.00 64.18  ? 155 GLN L CA  1 
ATOM   2931 C C   . GLN B 2 160 ? -24.635 4.348   117.862 1.00 60.47  ? 155 GLN L C   1 
ATOM   2932 O O   . GLN B 2 160 ? -23.462 3.984   117.909 1.00 62.96  ? 155 GLN L O   1 
ATOM   2933 C CB  . GLN B 2 160 ? -24.922 6.767   117.271 1.00 62.29  ? 155 GLN L CB  1 
ATOM   2934 C CG  . GLN B 2 160 ? -25.431 8.140   117.689 1.00 58.65  ? 155 GLN L CG  1 
ATOM   2935 C CD  . GLN B 2 160 ? -26.881 8.096   118.126 1.00 62.42  ? 155 GLN L CD  1 
ATOM   2936 O OE1 . GLN B 2 160 ? -27.767 7.708   117.363 1.00 58.67  ? 155 GLN L OE1 1 
ATOM   2937 N NE2 . GLN B 2 160 ? -27.143 8.469   119.370 1.00 69.72  ? 155 GLN L NE2 1 
ATOM   2938 N N   . SER B 2 161 ? -25.615 3.609   117.350 1.00 64.66  ? 156 SER L N   1 
ATOM   2939 C CA  . SER B 2 161 ? -25.346 2.302   116.782 1.00 62.73  ? 156 SER L CA  1 
ATOM   2940 C C   . SER B 2 161 ? -26.228 2.077   115.558 1.00 54.92  ? 156 SER L C   1 
ATOM   2941 O O   . SER B 2 161 ? -27.414 2.391   115.567 1.00 65.55  ? 156 SER L O   1 
ATOM   2942 C CB  . SER B 2 161 ? -25.517 1.220   117.819 1.00 66.52  ? 156 SER L CB  1 
ATOM   2943 O OG  . SER B 2 161 ? -25.636 -0.047  117.187 1.00 77.04  ? 156 SER L OG  1 
ATOM   2944 N N   . GLY B 2 162 ? -25.623 1.571   114.475 1.00 57.98  ? 157 GLY L N   1 
ATOM   2945 C CA  . GLY B 2 162 ? -26.375 1.090   113.328 1.00 58.82  ? 157 GLY L CA  1 
ATOM   2946 C C   . GLY B 2 162 ? -26.901 2.185   112.389 1.00 61.53  ? 157 GLY L C   1 
ATOM   2947 O O   . GLY B 2 162 ? -27.697 1.874   111.509 1.00 66.72  ? 157 GLY L O   1 
ATOM   2948 N N   . ASN B 2 163 ? -26.472 3.446   112.548 1.00 60.70  ? 158 ASN L N   1 
ATOM   2949 C CA  . ASN B 2 163 ? -26.987 4.538   111.723 1.00 58.43  ? 158 ASN L CA  1 
ATOM   2950 C C   . ASN B 2 163 ? -25.840 5.365   111.119 1.00 57.46  ? 158 ASN L C   1 
ATOM   2951 O O   . ASN B 2 163 ? -26.020 6.522   110.727 1.00 51.90  ? 158 ASN L O   1 
ATOM   2952 C CB  . ASN B 2 163 ? -27.974 5.389   112.520 1.00 57.72  ? 158 ASN L CB  1 
ATOM   2953 C CG  . ASN B 2 163 ? -27.368 5.907   113.807 1.00 57.75  ? 158 ASN L CG  1 
ATOM   2954 O OD1 . ASN B 2 163 ? -26.209 5.617   114.129 1.00 55.14  ? 158 ASN L OD1 1 
ATOM   2955 N ND2 . ASN B 2 163 ? -28.139 6.669   114.569 1.00 63.36  ? 158 ASN L ND2 1 
ATOM   2956 N N   . SER B 2 164 ? -24.658 4.757   110.982 1.00 51.72  ? 159 SER L N   1 
ATOM   2957 C CA  . SER B 2 164 ? -23.520 5.449   110.392 1.00 53.35  ? 159 SER L CA  1 
ATOM   2958 C C   . SER B 2 164 ? -22.827 4.535   109.379 1.00 55.28  ? 159 SER L C   1 
ATOM   2959 O O   . SER B 2 164 ? -22.882 3.327   109.504 1.00 51.99  ? 159 SER L O   1 
ATOM   2960 C CB  . SER B 2 164 ? -22.550 5.881   111.460 1.00 50.51  ? 159 SER L CB  1 
ATOM   2961 O OG  . SER B 2 164 ? -21.966 4.743   112.080 1.00 57.75  ? 159 SER L OG  1 
ATOM   2962 N N   . GLN B 2 165 ? -22.143 5.107   108.391 1.00 55.29  ? 160 GLN L N   1 
ATOM   2963 C CA  . GLN B 2 165 ? -21.338 4.303   107.489 1.00 48.60  ? 160 GLN L CA  1 
ATOM   2964 C C   . GLN B 2 165 ? -20.007 4.997   107.291 1.00 46.63  ? 160 GLN L C   1 
ATOM   2965 O O   . GLN B 2 165 ? -19.926 6.224   107.362 1.00 47.11  ? 160 GLN L O   1 
ATOM   2966 C CB  . GLN B 2 165 ? -22.066 4.075   106.165 1.00 54.17  ? 160 GLN L CB  1 
ATOM   2967 C CG  . GLN B 2 165 ? -23.356 3.271   106.263 1.00 59.21  ? 160 GLN L CG  1 
ATOM   2968 C CD  . GLN B 2 165 ? -23.989 3.029   104.905 1.00 63.47  ? 160 GLN L CD  1 
ATOM   2969 O OE1 . GLN B 2 165 ? -24.671 3.887   104.330 1.00 61.83  ? 160 GLN L OE1 1 
ATOM   2970 N NE2 . GLN B 2 165 ? -23.768 1.842   104.367 1.00 56.26  ? 160 GLN L NE2 1 
ATOM   2971 N N   . GLU B 2 166 ? -18.959 4.195   107.069 1.00 46.28  ? 161 GLU L N   1 
ATOM   2972 C CA  . GLU B 2 166 ? -17.611 4.696   106.872 1.00 47.64  ? 161 GLU L CA  1 
ATOM   2973 C C   . GLU B 2 166 ? -17.101 4.336   105.479 1.00 45.32  ? 161 GLU L C   1 
ATOM   2974 O O   . GLU B 2 166 ? -17.523 3.350   104.896 1.00 45.44  ? 161 GLU L O   1 
ATOM   2975 C CB  . GLU B 2 166 ? -16.615 4.038   107.829 1.00 53.22  ? 161 GLU L CB  1 
ATOM   2976 C CG  . GLU B 2 166 ? -16.892 4.362   109.289 1.00 62.04  ? 161 GLU L CG  1 
ATOM   2977 C CD  . GLU B 2 166 ? -15.765 3.948   110.220 1.00 71.45  ? 161 GLU L CD  1 
ATOM   2978 O OE1 . GLU B 2 166 ? -14.763 3.322   109.788 1.00 74.40  ? 161 GLU L OE1 1 
ATOM   2979 O OE2 . GLU B 2 166 ? -15.923 4.251   111.417 1.00 83.76  ? 161 GLU L OE2 1 
ATOM   2980 N N   . SER B 2 167 ? -16.153 5.133   104.991 1.00 44.42  ? 162 SER L N   1 
ATOM   2981 C CA  . SER B 2 167 ? -15.480 4.861   103.739 1.00 46.55  ? 162 SER L CA  1 
ATOM   2982 C C   . SER B 2 167 ? -14.063 5.367   103.885 1.00 42.47  ? 162 SER L C   1 
ATOM   2983 O O   . SER B 2 167 ? -13.853 6.393   104.531 1.00 42.50  ? 162 SER L O   1 
ATOM   2984 C CB  . SER B 2 167 ? -16.218 5.519   102.569 1.00 48.94  ? 162 SER L CB  1 
ATOM   2985 O OG  . SER B 2 167 ? -15.511 5.367   101.357 1.00 49.56  ? 162 SER L OG  1 
ATOM   2986 N N   . VAL B 2 168 ? -13.113 4.643   103.277 1.00 43.46  ? 163 VAL L N   1 
ATOM   2987 C CA  . VAL B 2 168 ? -11.698 4.939   103.407 1.00 43.08  ? 163 VAL L CA  1 
ATOM   2988 C C   . VAL B 2 168 ? -11.035 4.996   102.034 1.00 46.73  ? 163 VAL L C   1 
ATOM   2989 O O   . VAL B 2 168 ? -11.295 4.155   101.180 1.00 49.59  ? 163 VAL L O   1 
ATOM   2990 C CB  . VAL B 2 168 ? -11.014 3.904   104.331 1.00 48.79  ? 163 VAL L CB  1 
ATOM   2991 C CG1 . VAL B 2 168 ? -10.960 2.512   103.724 1.00 54.96  ? 163 VAL L CG1 1 
ATOM   2992 C CG2 . VAL B 2 168 ? -9.621  4.363   104.714 1.00 48.79  ? 163 VAL L CG2 1 
ATOM   2993 N N   . THR B 2 169 ? -10.134 5.963   101.856 1.00 42.02  ? 164 THR L N   1 
ATOM   2994 C CA  . THR B 2 169 ? -9.368  6.089   100.633 1.00 47.79  ? 164 THR L CA  1 
ATOM   2995 C C   . THR B 2 169 ? -8.277  5.030   100.625 1.00 50.05  ? 164 THR L C   1 
ATOM   2996 O O   . THR B 2 169 ? -7.942  4.447   101.655 1.00 46.92  ? 164 THR L O   1 
ATOM   2997 C CB  . THR B 2 169 ? -8.750  7.477   100.462 1.00 50.81  ? 164 THR L CB  1 
ATOM   2998 O OG1 . THR B 2 169 ? -7.972  7.740   101.631 1.00 51.12  ? 164 THR L OG1 1 
ATOM   2999 C CG2 . THR B 2 169 ? -9.791  8.558   100.225 1.00 49.72  ? 164 THR L CG2 1 
ATOM   3000 N N   . GLU B 2 170 ? -7.771  4.774   99.418  1.00 47.29  ? 165 GLU L N   1 
ATOM   3001 C CA  . GLU B 2 170 ? -6.560  3.994   99.228  1.00 53.07  ? 165 GLU L CA  1 
ATOM   3002 C C   . GLU B 2 170 ? -5.398  4.862   99.669  1.00 51.71  ? 165 GLU L C   1 
ATOM   3003 O O   . GLU B 2 170 ? -5.547  6.074   99.820  1.00 50.99  ? 165 GLU L O   1 
ATOM   3004 C CB  . GLU B 2 170 ? -6.360  3.545   97.770  1.00 51.27  ? 165 GLU L CB  1 
ATOM   3005 C CG  . GLU B 2 170 ? -7.413  2.526   97.345  1.00 55.87  ? 165 GLU L CG  1 
ATOM   3006 C CD  . GLU B 2 170 ? -7.292  1.223   98.127  1.00 69.74  ? 165 GLU L CD  1 
ATOM   3007 O OE1 . GLU B 2 170 ? -6.226  0.578   98.011  1.00 67.29  ? 165 GLU L OE1 1 
ATOM   3008 O OE2 . GLU B 2 170 ? -8.234  0.855   98.870  1.00 68.13  ? 165 GLU L OE2 1 
ATOM   3009 N N   . GLN B 2 171 ? -4.255  4.208   99.870  1.00 47.88  ? 166 GLN L N   1 
ATOM   3010 C CA  . GLN B 2 171 ? -3.084  4.878   100.395 1.00 51.06  ? 166 GLN L CA  1 
ATOM   3011 C C   . GLN B 2 171 ? -2.661  5.968   99.420  1.00 51.10  ? 166 GLN L C   1 
ATOM   3012 O O   . GLN B 2 171 ? -2.528  5.722   98.224  1.00 49.34  ? 166 GLN L O   1 
ATOM   3013 C CB  . GLN B 2 171 ? -2.012  3.819   100.653 1.00 50.98  ? 166 GLN L CB  1 
ATOM   3014 C CG  . GLN B 2 171 ? -0.764  4.375   101.316 1.00 56.11  ? 166 GLN L CG  1 
ATOM   3015 C CD  . GLN B 2 171 ? 0.118   3.287   101.886 1.00 60.69  ? 166 GLN L CD  1 
ATOM   3016 O OE1 . GLN B 2 171 ? 0.314   2.236   101.264 1.00 55.48  ? 166 GLN L OE1 1 
ATOM   3017 N NE2 . GLN B 2 171 ? 0.624   3.522   103.090 1.00 60.82  ? 166 GLN L NE2 1 
ATOM   3018 N N   . ASP B 2 172 ? -2.465  7.172   99.953  1.00 48.26  ? 167 ASP L N   1 
ATOM   3019 C CA  . ASP B 2 172 ? -2.018  8.311   99.181  1.00 50.54  ? 167 ASP L CA  1 
ATOM   3020 C C   . ASP B 2 172 ? -0.629  8.071   98.588  1.00 59.92  ? 167 ASP L C   1 
ATOM   3021 O O   . ASP B 2 172 ? 0.297   7.592   99.250  1.00 54.72  ? 167 ASP L O   1 
ATOM   3022 C CB  . ASP B 2 172 ? -2.032  9.553   100.055 1.00 57.51  ? 167 ASP L CB  1 
ATOM   3023 C CG  . ASP B 2 172 ? -1.771  10.860  99.325  1.00 56.07  ? 167 ASP L CG  1 
ATOM   3024 O OD1 . ASP B 2 172 ? -0.600  11.148  99.000  1.00 57.89  ? 167 ASP L OD1 1 
ATOM   3025 O OD2 . ASP B 2 172 ? -2.752  11.568  99.073  1.00 67.65  ? 167 ASP L OD2 1 
ATOM   3026 N N   . SER B 2 173 ? -0.472  8.479   97.330  1.00 55.53  ? 168 SER L N   1 
ATOM   3027 C CA  . SER B 2 173 ? 0.728   8.178   96.577  1.00 61.04  ? 168 SER L CA  1 
ATOM   3028 C C   . SER B 2 173 ? 1.846   9.191   96.856  1.00 54.18  ? 168 SER L C   1 
ATOM   3029 O O   . SER B 2 173 ? 2.952   8.964   96.398  1.00 56.32  ? 168 SER L O   1 
ATOM   3030 C CB  . SER B 2 173 ? 0.414   8.076   95.096  1.00 65.69  ? 168 SER L CB  1 
ATOM   3031 O OG  . SER B 2 173 ? 0.094   9.349   94.561  1.00 65.19  ? 168 SER L OG  1 
ATOM   3032 N N   . LYS B 2 174 ? 1.596   10.260  97.628  1.00 51.63  ? 169 LYS L N   1 
ATOM   3033 C CA  . LYS B 2 174 ? 2.661   11.180  98.037  1.00 58.79  ? 169 LYS L CA  1 
ATOM   3034 C C   . LYS B 2 174 ? 3.094   11.016  99.500  1.00 55.30  ? 169 LYS L C   1 
ATOM   3035 O O   . LYS B 2 174 ? 4.275   11.150  99.819  1.00 54.37  ? 169 LYS L O   1 
ATOM   3036 C CB  . LYS B 2 174 ? 2.228   12.631  97.832  1.00 63.73  ? 169 LYS L CB  1 
ATOM   3037 C CG  . LYS B 2 174 ? 1.969   13.010  96.378  1.00 78.13  ? 169 LYS L CG  1 
ATOM   3038 C CD  . LYS B 2 174 ? 0.920   14.112  96.246  1.00 88.70  ? 169 LYS L CD  1 
ATOM   3039 C CE  . LYS B 2 174 ? 0.732   14.578  94.836  1.00 92.04  ? 169 LYS L CE  1 
ATOM   3040 N NZ  . LYS B 2 174 ? 1.794   15.508  94.447  1.00 93.71  ? 169 LYS L NZ  1 
ATOM   3041 N N   . ASP B 2 175 ? 2.150   10.764  100.413 1.00 53.54  ? 170 ASP L N   1 
ATOM   3042 C CA  . ASP B 2 175 ? 2.466   10.808  101.831 1.00 52.73  ? 170 ASP L CA  1 
ATOM   3043 C C   . ASP B 2 175 ? 2.111   9.494   102.526 1.00 56.73  ? 170 ASP L C   1 
ATOM   3044 O O   . ASP B 2 175 ? 2.310   9.396   103.727 1.00 53.16  ? 170 ASP L O   1 
ATOM   3045 C CB  . ASP B 2 175 ? 1.803   12.017  102.477 1.00 58.77  ? 170 ASP L CB  1 
ATOM   3046 C CG  . ASP B 2 175 ? 0.288   11.926  102.647 1.00 62.27  ? 170 ASP L CG  1 
ATOM   3047 O OD1 . ASP B 2 175 ? -0.259  10.806  102.523 1.00 56.02  ? 170 ASP L OD1 1 
ATOM   3048 O OD2 . ASP B 2 175 ? -0.337  12.971  102.906 1.00 67.69  ? 170 ASP L OD2 1 
ATOM   3049 N N   . SER B 2 176 ? 1.518   8.529   101.796 1.00 46.69  ? 171 SER L N   1 
ATOM   3050 C CA  . SER B 2 176 ? 1.290   7.182   102.267 1.00 49.69  ? 171 SER L CA  1 
ATOM   3051 C C   . SER B 2 176 ? 0.291   7.137   103.418 1.00 46.14  ? 171 SER L C   1 
ATOM   3052 O O   . SER B 2 176 ? 0.303   6.154   104.175 1.00 50.20  ? 171 SER L O   1 
ATOM   3053 C CB  . SER B 2 176 ? 2.591   6.479   102.658 1.00 54.23  ? 171 SER L CB  1 
ATOM   3054 O OG  . SER B 2 176 ? 3.602   6.597   101.670 1.00 51.87  ? 171 SER L OG  1 
ATOM   3055 N N   . THR B 2 177 ? -0.571  8.162   103.529 1.00 44.96  ? 172 THR L N   1 
ATOM   3056 C CA  . THR B 2 177 ? -1.625  8.186   104.537 1.00 54.60  ? 172 THR L CA  1 
ATOM   3057 C C   . THR B 2 177 ? -2.942  7.687   103.946 1.00 53.35  ? 172 THR L C   1 
ATOM   3058 O O   . THR B 2 177 ? -3.058  7.481   102.742 1.00 53.67  ? 172 THR L O   1 
ATOM   3059 C CB  . THR B 2 177 ? -1.832  9.590   105.120 1.00 51.91  ? 172 THR L CB  1 
ATOM   3060 O OG1 . THR B 2 177 ? -2.259  10.468  104.084 1.00 48.81  ? 172 THR L OG1 1 
ATOM   3061 C CG2 . THR B 2 177 ? -0.593  10.126  105.816 1.00 55.43  ? 172 THR L CG2 1 
ATOM   3062 N N   . TYR B 2 178 ? -3.913  7.494   104.840 1.00 50.11  ? 173 TYR L N   1 
ATOM   3063 C CA  . TYR B 2 178 ? -5.303  7.252   104.500 1.00 49.56  ? 173 TYR L CA  1 
ATOM   3064 C C   . TYR B 2 178 ? -6.169  8.384   105.030 1.00 54.50  ? 173 TYR L C   1 
ATOM   3065 O O   . TYR B 2 178 ? -5.777  9.094   105.958 1.00 48.42  ? 173 TYR L O   1 
ATOM   3066 C CB  . TYR B 2 178 ? -5.782  5.973   105.179 1.00 51.43  ? 173 TYR L CB  1 
ATOM   3067 C CG  . TYR B 2 178 ? -4.923  4.784   104.793 1.00 55.51  ? 173 TYR L CG  1 
ATOM   3068 C CD1 . TYR B 2 178 ? -5.233  4.023   103.668 1.00 56.93  ? 173 TYR L CD1 1 
ATOM   3069 C CD2 . TYR B 2 178 ? -3.778  4.455   105.519 1.00 52.53  ? 173 TYR L CD2 1 
ATOM   3070 C CE1 . TYR B 2 178 ? -4.433  2.962   103.278 1.00 58.74  ? 173 TYR L CE1 1 
ATOM   3071 C CE2 . TYR B 2 178 ? -2.988  3.376   105.152 1.00 55.04  ? 173 TYR L CE2 1 
ATOM   3072 C CZ  . TYR B 2 178 ? -3.317  2.628   104.032 1.00 61.26  ? 173 TYR L CZ  1 
ATOM   3073 O OH  . TYR B 2 178 ? -2.538  1.583   103.638 1.00 56.34  ? 173 TYR L OH  1 
ATOM   3074 N N   . SER B 2 179 ? -7.353  8.537   104.432 1.00 47.69  ? 174 SER L N   1 
ATOM   3075 C CA  . SER B 2 179 ? -8.360  9.425   104.973 1.00 44.71  ? 174 SER L CA  1 
ATOM   3076 C C   . SER B 2 179 ? -9.654  8.638   105.035 1.00 47.62  ? 174 SER L C   1 
ATOM   3077 O O   . SER B 2 179 ? -9.805  7.654   104.320 1.00 45.14  ? 174 SER L O   1 
ATOM   3078 C CB  . SER B 2 179 ? -8.501  10.678  104.171 1.00 42.96  ? 174 SER L CB  1 
ATOM   3079 O OG  . SER B 2 179 ? -7.312  11.441  104.201 1.00 46.10  ? 174 SER L OG  1 
ATOM   3080 N N   . LEU B 2 180 ? -10.576 9.070   105.894 1.00 45.37  ? 175 LEU L N   1 
ATOM   3081 C CA  . LEU B 2 180 ? -11.772 8.301   106.167 1.00 43.34  ? 175 LEU L CA  1 
ATOM   3082 C C   . LEU B 2 180 ? -12.900 9.277   106.485 1.00 45.99  ? 175 LEU L C   1 
ATOM   3083 O O   . LEU B 2 180 ? -12.660 10.329  107.093 1.00 48.01  ? 175 LEU L O   1 
ATOM   3084 C CB  . LEU B 2 180 ? -11.499 7.307   107.295 1.00 44.93  ? 175 LEU L CB  1 
ATOM   3085 C CG  . LEU B 2 180 ? -12.681 6.484   107.812 1.00 47.45  ? 175 LEU L CG  1 
ATOM   3086 C CD1 . LEU B 2 180 ? -12.189 5.250   108.559 1.00 50.75  ? 175 LEU L CD1 1 
ATOM   3087 C CD2 . LEU B 2 180 ? -13.599 7.287   108.713 1.00 50.40  ? 175 LEU L CD2 1 
ATOM   3088 N N   . SER B 2 181 ? -14.091 8.935   105.977 1.00 45.83  ? 176 SER L N   1 
ATOM   3089 C CA  . SER B 2 181 ? -15.329 9.648   106.226 1.00 43.53  ? 176 SER L CA  1 
ATOM   3090 C C   . SER B 2 181 ? -16.213 8.754   107.074 1.00 45.74  ? 176 SER L C   1 
ATOM   3091 O O   . SER B 2 181 ? -16.284 7.556   106.826 1.00 48.02  ? 176 SER L O   1 
ATOM   3092 C CB  . SER B 2 181 ? -16.049 10.022  104.922 1.00 47.70  ? 176 SER L CB  1 
ATOM   3093 O OG  . SER B 2 181 ? -16.641 8.866   104.329 1.00 49.30  ? 176 SER L OG  1 
ATOM   3094 N N   . SER B 2 182 ? -16.901 9.347   108.057 1.00 46.35  ? 177 SER L N   1 
ATOM   3095 C CA  . SER B 2 182 ? -17.984 8.677   108.755 1.00 45.77  ? 177 SER L CA  1 
ATOM   3096 C C   . SER B 2 182 ? -19.224 9.551   108.649 1.00 52.17  ? 177 SER L C   1 
ATOM   3097 O O   . SER B 2 182 ? -19.184 10.742  108.967 1.00 50.23  ? 177 SER L O   1 
ATOM   3098 C CB  . SER B 2 182 ? -17.647 8.366   110.211 1.00 48.27  ? 177 SER L CB  1 
ATOM   3099 O OG  . SER B 2 182 ? -18.752 7.713   110.810 1.00 49.44  ? 177 SER L OG  1 
ATOM   3100 N N   . THR B 2 183 ? -20.288 8.963   108.107 1.00 45.44  ? 178 THR L N   1 
ATOM   3101 C CA  . THR B 2 183 ? -21.525 9.671   107.889 1.00 47.50  ? 178 THR L CA  1 
ATOM   3102 C C   . THR B 2 183 ? -22.610 9.061   108.770 1.00 45.05  ? 178 THR L C   1 
ATOM   3103 O O   . THR B 2 183 ? -22.917 7.874   108.667 1.00 46.92  ? 178 THR L O   1 
ATOM   3104 C CB  . THR B 2 183 ? -21.894 9.642   106.402 1.00 46.98  ? 178 THR L CB  1 
ATOM   3105 O OG1 . THR B 2 183 ? -20.743 10.107  105.705 1.00 46.37  ? 178 THR L OG1 1 
ATOM   3106 C CG2 . THR B 2 183 ? -23.089 10.525  106.100 1.00 49.13  ? 178 THR L CG2 1 
ATOM   3107 N N   . LEU B 2 184 ? -23.199 9.930   109.606 1.00 48.15  ? 179 LEU L N   1 
ATOM   3108 C CA  . LEU B 2 184 ? -24.335 9.600   110.459 1.00 49.94  ? 179 LEU L CA  1 
ATOM   3109 C C   . LEU B 2 184 ? -25.599 10.115  109.787 1.00 46.90  ? 179 LEU L C   1 
ATOM   3110 O O   . LEU B 2 184 ? -25.666 11.300  109.458 1.00 49.45  ? 179 LEU L O   1 
ATOM   3111 C CB  . LEU B 2 184 ? -24.091 10.302  111.803 1.00 51.33  ? 179 LEU L CB  1 
ATOM   3112 C CG  . LEU B 2 184 ? -25.197 10.195  112.866 1.00 51.61  ? 179 LEU L CG  1 
ATOM   3113 C CD1 . LEU B 2 184 ? -25.223 8.825   113.521 1.00 49.70  ? 179 LEU L CD1 1 
ATOM   3114 C CD2 . LEU B 2 184 ? -25.012 11.298  113.897 1.00 52.98  ? 179 LEU L CD2 1 
ATOM   3115 N N   . THR B 2 185 ? -26.596 9.236   109.619 1.00 50.91  ? 180 THR L N   1 
ATOM   3116 C CA  . THR B 2 185 ? -27.822 9.582   108.926 1.00 54.27  ? 180 THR L CA  1 
ATOM   3117 C C   . THR B 2 185 ? -29.018 9.542   109.874 1.00 58.66  ? 180 THR L C   1 
ATOM   3118 O O   . THR B 2 185 ? -29.311 8.507   110.472 1.00 56.34  ? 180 THR L O   1 
ATOM   3119 C CB  . THR B 2 185 ? -28.011 8.631   107.745 1.00 62.40  ? 180 THR L CB  1 
ATOM   3120 O OG1 . THR B 2 185 ? -26.852 8.887   106.963 1.00 63.92  ? 180 THR L OG1 1 
ATOM   3121 C CG2 . THR B 2 185 ? -29.267 8.924   106.941 1.00 65.12  ? 180 THR L CG2 1 
ATOM   3122 N N   . LEU B 2 186 ? -29.726 10.674  109.965 1.00 55.77  ? 181 LEU L N   1 
ATOM   3123 C CA  . LEU B 2 186 ? -30.914 10.767  110.805 1.00 61.79  ? 181 LEU L CA  1 
ATOM   3124 C C   . LEU B 2 186 ? -32.070 11.334  109.994 1.00 58.66  ? 181 LEU L C   1 
ATOM   3125 O O   . LEU B 2 186 ? -31.867 12.002  108.985 1.00 58.54  ? 181 LEU L O   1 
ATOM   3126 C CB  . LEU B 2 186 ? -30.655 11.641  112.033 1.00 59.91  ? 181 LEU L CB  1 
ATOM   3127 C CG  . LEU B 2 186 ? -29.462 11.252  112.905 1.00 65.67  ? 181 LEU L CG  1 
ATOM   3128 C CD1 . LEU B 2 186 ? -29.357 12.192  114.096 1.00 73.24  ? 181 LEU L CD1 1 
ATOM   3129 C CD2 . LEU B 2 186 ? -29.580 9.819   113.364 1.00 67.40  ? 181 LEU L CD2 1 
ATOM   3130 N N   . SER B 2 187 ? -33.294 11.087  110.468 1.00 56.49  ? 182 SER L N   1 
ATOM   3131 C CA  . SER B 2 187 ? -34.437 11.813  109.952 1.00 56.24  ? 182 SER L CA  1 
ATOM   3132 C C   . SER B 2 187 ? -34.348 13.256  110.442 1.00 55.46  ? 182 SER L C   1 
ATOM   3133 O O   . SER B 2 187 ? -33.678 13.550  111.429 1.00 59.10  ? 182 SER L O   1 
ATOM   3134 C CB  . SER B 2 187 ? -35.741 11.161  110.349 1.00 58.12  ? 182 SER L CB  1 
ATOM   3135 O OG  . SER B 2 187 ? -35.853 11.099  111.759 1.00 58.07  ? 182 SER L OG  1 
ATOM   3136 N N   . LYS B 2 188 ? -34.995 14.157  109.715 1.00 62.58  ? 183 LYS L N   1 
ATOM   3137 C CA  . LYS B 2 188 ? -35.116 15.549  110.124 1.00 66.78  ? 183 LYS L CA  1 
ATOM   3138 C C   . LYS B 2 188 ? -35.724 15.646  111.528 1.00 70.82  ? 183 LYS L C   1 
ATOM   3139 O O   . LYS B 2 188 ? -35.297 16.488  112.324 1.00 63.20  ? 183 LYS L O   1 
ATOM   3140 C CB  . LYS B 2 188 ? -35.989 16.254  109.081 1.00 65.99  ? 183 LYS L CB  1 
ATOM   3141 C CG  . LYS B 2 188 ? -36.340 17.701  109.362 1.00 74.53  ? 183 LYS L CG  1 
ATOM   3142 C CD  . LYS B 2 188 ? -37.308 18.261  108.325 1.00 81.41  ? 183 LYS L CD  1 
ATOM   3143 C CE  . LYS B 2 188 ? -37.460 19.744  108.413 1.00 79.42  ? 183 LYS L CE  1 
ATOM   3144 N NZ  . LYS B 2 188 ? -37.987 20.124  109.724 1.00 81.77  ? 183 LYS L NZ  1 
ATOM   3145 N N   . ALA B 2 189 ? -36.730 14.797  111.809 1.00 62.26  ? 184 ALA L N   1 
ATOM   3146 C CA  . ALA B 2 189 ? -37.440 14.804  113.085 1.00 71.18  ? 184 ALA L CA  1 
ATOM   3147 C C   . ALA B 2 189 ? -36.484 14.502  114.242 1.00 67.34  ? 184 ALA L C   1 
ATOM   3148 O O   . ALA B 2 189 ? -36.413 15.270  115.200 1.00 72.26  ? 184 ALA L O   1 
ATOM   3149 C CB  . ALA B 2 189 ? -38.581 13.807  113.038 1.00 71.04  ? 184 ALA L CB  1 
ATOM   3150 N N   . ASP B 2 190 ? -35.733 13.397  114.115 1.00 61.96  ? 185 ASP L N   1 
ATOM   3151 C CA  . ASP B 2 190 ? -34.766 12.965  115.114 1.00 59.77  ? 185 ASP L CA  1 
ATOM   3152 C C   . ASP B 2 190 ? -33.640 13.979  115.257 1.00 64.03  ? 185 ASP L C   1 
ATOM   3153 O O   . ASP B 2 190 ? -33.218 14.272  116.369 1.00 70.84  ? 185 ASP L O   1 
ATOM   3154 C CB  . ASP B 2 190 ? -34.193 11.598  114.793 1.00 57.64  ? 185 ASP L CB  1 
ATOM   3155 C CG  . ASP B 2 190 ? -35.236 10.495  114.764 1.00 71.46  ? 185 ASP L CG  1 
ATOM   3156 O OD1 . ASP B 2 190 ? -36.428 10.839  114.819 1.00 73.60  ? 185 ASP L OD1 1 
ATOM   3157 O OD2 . ASP B 2 190 ? -34.851 9.315   114.708 1.00 68.35  ? 185 ASP L OD2 1 
ATOM   3158 N N   . TYR B 2 191 ? -33.150 14.525  114.140 1.00 61.88  ? 186 TYR L N   1 
ATOM   3159 C CA  . TYR B 2 191 ? -32.061 15.483  114.227 1.00 59.23  ? 186 TYR L CA  1 
ATOM   3160 C C   . TYR B 2 191 ? -32.495 16.655  115.112 1.00 59.98  ? 186 TYR L C   1 
ATOM   3161 O O   . TYR B 2 191 ? -31.740 17.107  115.967 1.00 60.67  ? 186 TYR L O   1 
ATOM   3162 C CB  . TYR B 2 191 ? -31.605 15.918  112.830 1.00 53.82  ? 186 TYR L CB  1 
ATOM   3163 C CG  . TYR B 2 191 ? -30.496 16.960  112.829 1.00 48.98  ? 186 TYR L CG  1 
ATOM   3164 C CD1 . TYR B 2 191 ? -29.194 16.636  113.181 1.00 53.29  ? 186 TYR L CD1 1 
ATOM   3165 C CD2 . TYR B 2 191 ? -30.757 18.272  112.467 1.00 49.44  ? 186 TYR L CD2 1 
ATOM   3166 C CE1 . TYR B 2 191 ? -28.181 17.586  113.172 1.00 50.53  ? 186 TYR L CE1 1 
ATOM   3167 C CE2 . TYR B 2 191 ? -29.764 19.234  112.460 1.00 47.66  ? 186 TYR L CE2 1 
ATOM   3168 C CZ  . TYR B 2 191 ? -28.471 18.889  112.803 1.00 44.83  ? 186 TYR L CZ  1 
ATOM   3169 O OH  . TYR B 2 191 ? -27.527 19.869  112.792 1.00 51.57  ? 186 TYR L OH  1 
ATOM   3170 N N   . GLU B 2 192 ? -33.731 17.125  114.914 1.00 67.33  ? 187 GLU L N   1 
ATOM   3171 C CA  . GLU B 2 192 ? -34.188 18.376  115.501 1.00 70.45  ? 187 GLU L CA  1 
ATOM   3172 C C   . GLU B 2 192 ? -34.601 18.182  116.956 1.00 70.37  ? 187 GLU L C   1 
ATOM   3173 O O   . GLU B 2 192 ? -34.824 19.169  117.649 1.00 75.69  ? 187 GLU L O   1 
ATOM   3174 C CB  . GLU B 2 192 ? -35.294 18.981  114.641 1.00 73.27  ? 187 GLU L CB  1 
ATOM   3175 C CG  . GLU B 2 192 ? -34.713 19.731  113.445 1.00 80.13  ? 187 GLU L CG  1 
ATOM   3176 C CD  . GLU B 2 192 ? -35.720 20.261  112.442 1.00 87.98  ? 187 GLU L CD  1 
ATOM   3177 O OE1 . GLU B 2 192 ? -36.942 20.113  112.671 1.00 84.02  ? 187 GLU L OE1 1 
ATOM   3178 O OE2 . GLU B 2 192 ? -35.261 20.810  111.414 1.00 98.90  ? 187 GLU L OE2 1 
ATOM   3179 N N   . LYS B 2 193 ? -34.626 16.928  117.428 1.00 62.87  ? 188 LYS L N   1 
ATOM   3180 C CA  . LYS B 2 193 ? -34.930 16.637  118.820 1.00 70.33  ? 188 LYS L CA  1 
ATOM   3181 C C   . LYS B 2 193 ? -33.668 16.647  119.680 1.00 67.66  ? 188 LYS L C   1 
ATOM   3182 O O   . LYS B 2 193 ? -33.756 16.377  120.874 1.00 67.88  ? 188 LYS L O   1 
ATOM   3183 C CB  . LYS B 2 193 ? -35.648 15.285  118.922 1.00 80.47  ? 188 LYS L CB  1 
ATOM   3184 C CG  . LYS B 2 193 ? -37.110 15.325  118.486 1.00 86.75  ? 188 LYS L CG  1 
ATOM   3185 C CD  . LYS B 2 193 ? -37.654 14.020  117.918 1.00 92.92  ? 188 LYS L CD  1 
ATOM   3186 C CE  . LYS B 2 193 ? -37.576 12.880  118.878 1.00 94.43  ? 188 LYS L CE  1 
ATOM   3187 N NZ  . LYS B 2 193 ? -38.063 11.657  118.239 1.00 100.00 ? 188 LYS L NZ  1 
ATOM   3188 N N   . HIS B 2 194 ? -32.491 16.916  119.092 1.00 58.09  ? 189 HIS L N   1 
ATOM   3189 C CA  . HIS B 2 194 ? -31.254 16.782  119.846 1.00 57.73  ? 189 HIS L CA  1 
ATOM   3190 C C   . HIS B 2 194 ? -30.367 17.971  119.533 1.00 55.74  ? 189 HIS L C   1 
ATOM   3191 O O   . HIS B 2 194 ? -30.603 18.685  118.559 1.00 60.01  ? 189 HIS L O   1 
ATOM   3192 C CB  . HIS B 2 194 ? -30.564 15.430  119.627 1.00 59.58  ? 189 HIS L CB  1 
ATOM   3193 C CG  . HIS B 2 194 ? -31.392 14.256  120.035 1.00 74.60  ? 189 HIS L CG  1 
ATOM   3194 N ND1 . HIS B 2 194 ? -31.511 13.824  121.341 1.00 71.74  ? 189 HIS L ND1 1 
ATOM   3195 C CD2 . HIS B 2 194 ? -32.161 13.440  119.301 1.00 69.94  ? 189 HIS L CD2 1 
ATOM   3196 C CE1 . HIS B 2 194 ? -32.333 12.785  121.381 1.00 76.96  ? 189 HIS L CE1 1 
ATOM   3197 N NE2 . HIS B 2 194 ? -32.736 12.533  120.155 1.00 80.32  ? 189 HIS L NE2 1 
ATOM   3198 N N   . LYS B 2 195 ? -29.380 18.160  120.410 1.00 55.91  ? 190 LYS L N   1 
ATOM   3199 C CA  . LYS B 2 195 ? -28.585 19.361  120.460 1.00 63.15  ? 190 LYS L CA  1 
ATOM   3200 C C   . LYS B 2 195 ? -27.131 19.068  120.112 1.00 63.26  ? 190 LYS L C   1 
ATOM   3201 O O   . LYS B 2 195 ? -26.572 19.728  119.236 1.00 61.91  ? 190 LYS L O   1 
ATOM   3202 C CB  . LYS B 2 195 ? -28.688 19.995  121.851 1.00 71.86  ? 190 LYS L CB  1 
ATOM   3203 C CG  . LYS B 2 195 ? -27.810 21.237  122.049 1.00 74.60  ? 190 LYS L CG  1 
ATOM   3204 C CD  . LYS B 2 195 ? -28.455 22.292  122.946 1.00 84.37  ? 190 LYS L CD  1 
ATOM   3205 C CE  . LYS B 2 195 ? -27.486 23.250  123.565 1.00 83.86  ? 190 LYS L CE  1 
ATOM   3206 N NZ  . LYS B 2 195 ? -26.819 22.635  124.715 1.00 86.68  ? 190 LYS L NZ  1 
ATOM   3207 N N   . VAL B 2 196 ? -26.506 18.149  120.859 1.00 64.70  ? 191 VAL L N   1 
ATOM   3208 C CA  . VAL B 2 196 ? -25.066 17.966  120.767 1.00 58.77  ? 191 VAL L CA  1 
ATOM   3209 C C   . VAL B 2 196 ? -24.743 16.778  119.853 1.00 57.05  ? 191 VAL L C   1 
ATOM   3210 O O   . VAL B 2 196 ? -25.179 15.660  120.088 1.00 58.27  ? 191 VAL L O   1 
ATOM   3211 C CB  . VAL B 2 196 ? -24.423 17.794  122.152 1.00 64.97  ? 191 VAL L CB  1 
ATOM   3212 C CG1 . VAL B 2 196 ? -22.905 17.715  122.039 1.00 65.60  ? 191 VAL L CG1 1 
ATOM   3213 C CG2 . VAL B 2 196 ? -24.845 18.899  123.120 1.00 63.44  ? 191 VAL L CG2 1 
ATOM   3214 N N   . TYR B 2 197 ? -23.943 17.045  118.815 1.00 56.89  ? 192 TYR L N   1 
ATOM   3215 C CA  . TYR B 2 197 ? -23.551 16.043  117.838 1.00 51.94  ? 192 TYR L CA  1 
ATOM   3216 C C   . TYR B 2 197 ? -22.042 15.907  117.919 1.00 48.45  ? 192 TYR L C   1 
ATOM   3217 O O   . TYR B 2 197 ? -21.312 16.868  117.716 1.00 53.69  ? 192 TYR L O   1 
ATOM   3218 C CB  . TYR B 2 197 ? -24.028 16.459  116.436 1.00 52.49  ? 192 TYR L CB  1 
ATOM   3219 C CG  . TYR B 2 197 ? -25.525 16.236  116.322 1.00 46.83  ? 192 TYR L CG  1 
ATOM   3220 C CD1 . TYR B 2 197 ? -26.024 14.992  115.962 1.00 48.38  ? 192 TYR L CD1 1 
ATOM   3221 C CD2 . TYR B 2 197 ? -26.435 17.229  116.648 1.00 51.54  ? 192 TYR L CD2 1 
ATOM   3222 C CE1 . TYR B 2 197 ? -27.379 14.749  115.915 1.00 47.44  ? 192 TYR L CE1 1 
ATOM   3223 C CE2 . TYR B 2 197 ? -27.796 16.991  116.605 1.00 48.19  ? 192 TYR L CE2 1 
ATOM   3224 C CZ  . TYR B 2 197 ? -28.271 15.742  116.260 1.00 47.04  ? 192 TYR L CZ  1 
ATOM   3225 O OH  . TYR B 2 197 ? -29.608 15.444  116.206 1.00 59.90  ? 192 TYR L OH  1 
ATOM   3226 N N   . ALA B 2 198 ? -21.560 14.707  118.222 1.00 51.25  ? 193 ALA L N   1 
ATOM   3227 C CA  . ALA B 2 198 ? -20.133 14.573  118.427 1.00 52.22  ? 193 ALA L CA  1 
ATOM   3228 C C   . ALA B 2 198 ? -19.604 13.335  117.709 1.00 48.78  ? 193 ALA L C   1 
ATOM   3229 O O   . ALA B 2 198 ? -20.232 12.277  117.683 1.00 51.21  ? 193 ALA L O   1 
ATOM   3230 C CB  . ALA B 2 198 ? -19.824 14.532  119.915 1.00 53.32  ? 193 ALA L CB  1 
ATOM   3231 N N   . CYS B 2 199 ? -18.402 13.518  117.171 1.00 51.14  ? 194 CYS L N   1 
ATOM   3232 C CA  . CYS B 2 199 ? -17.636 12.471  116.539 1.00 53.77  ? 194 CYS L CA  1 
ATOM   3233 C C   . CYS B 2 199 ? -16.391 12.202  117.382 1.00 47.59  ? 194 CYS L C   1 
ATOM   3234 O O   . CYS B 2 199 ? -15.587 13.114  117.556 1.00 53.84  ? 194 CYS L O   1 
ATOM   3235 C CB  . CYS B 2 199 ? -17.220 12.949  115.151 1.00 55.05  ? 194 CYS L CB  1 
ATOM   3236 S SG  . CYS B 2 199 ? -16.209 11.715  114.313 1.00 68.13  ? 194 CYS L SG  1 
ATOM   3237 N N   . GLU B 2 200 ? -16.233 10.966  117.885 1.00 53.40  ? 195 GLU L N   1 
ATOM   3238 C CA  . GLU B 2 200 ? -15.116 10.635  118.770 1.00 53.42  ? 195 GLU L CA  1 
ATOM   3239 C C   . GLU B 2 200 ? -14.186 9.659   118.063 1.00 45.76  ? 195 GLU L C   1 
ATOM   3240 O O   . GLU B 2 200 ? -14.630 8.578   117.706 1.00 51.12  ? 195 GLU L O   1 
ATOM   3241 C CB  . GLU B 2 200 ? -15.618 9.970   120.053 1.00 55.23  ? 195 GLU L CB  1 
ATOM   3242 C CG  . GLU B 2 200 ? -14.503 9.523   120.995 1.00 64.78  ? 195 GLU L CG  1 
ATOM   3243 C CD  . GLU B 2 200 ? -14.988 8.475   121.982 1.00 71.83  ? 195 GLU L CD  1 
ATOM   3244 O OE1 . GLU B 2 200 ? -15.056 8.824   123.166 1.00 73.58  ? 195 GLU L OE1 1 
ATOM   3245 O OE2 . GLU B 2 200 ? -15.306 7.332   121.583 1.00 74.88  ? 195 GLU L OE2 1 
ATOM   3246 N N   . VAL B 2 201 ? -12.915 10.032  117.879 1.00 47.08  ? 196 VAL L N   1 
ATOM   3247 C CA  . VAL B 2 201 ? -12.026 9.180   117.111 1.00 51.98  ? 196 VAL L CA  1 
ATOM   3248 C C   . VAL B 2 201 ? -10.908 8.640   117.997 1.00 53.13  ? 196 VAL L C   1 
ATOM   3249 O O   . VAL B 2 201 ? -10.225 9.396   118.677 1.00 55.72  ? 196 VAL L O   1 
ATOM   3250 C CB  . VAL B 2 201 ? -11.469 9.838   115.836 1.00 55.62  ? 196 VAL L CB  1 
ATOM   3251 C CG1 . VAL B 2 201 ? -12.459 10.815  115.219 1.00 57.54  ? 196 VAL L CG1 1 
ATOM   3252 C CG2 . VAL B 2 201 ? -10.121 10.504  116.011 1.00 65.35  ? 196 VAL L CG2 1 
ATOM   3253 N N   . THR B 2 202 ? -10.714 7.320   117.925 1.00 55.83  ? 197 THR L N   1 
ATOM   3254 C CA  . THR B 2 202 ? -9.588  6.662   118.568 1.00 60.65  ? 197 THR L CA  1 
ATOM   3255 C C   . THR B 2 202 ? -8.613  6.236   117.488 1.00 54.48  ? 197 THR L C   1 
ATOM   3256 O O   . THR B 2 202 ? -9.033  5.703   116.469 1.00 57.76  ? 197 THR L O   1 
ATOM   3257 C CB  . THR B 2 202 ? -10.074 5.454   119.364 1.00 65.26  ? 197 THR L CB  1 
ATOM   3258 O OG1 . THR B 2 202 ? -11.072 5.980   120.239 1.00 60.25  ? 197 THR L OG1 1 
ATOM   3259 C CG2 . THR B 2 202 ? -8.942  4.801   120.140 1.00 70.02  ? 197 THR L CG2 1 
ATOM   3260 N N   . HIS B 2 203 ? -7.327  6.483   117.722 1.00 56.52  ? 198 HIS L N   1 
ATOM   3261 C CA  . HIS B 2 203 ? -6.289  6.122   116.770 1.00 56.69  ? 198 HIS L CA  1 
ATOM   3262 C C   . HIS B 2 203 ? -4.954  6.081   117.498 1.00 62.18  ? 198 HIS L C   1 
ATOM   3263 O O   . HIS B 2 203 ? -4.752  6.863   118.438 1.00 55.49  ? 198 HIS L O   1 
ATOM   3264 C CB  . HIS B 2 203 ? -6.207  7.149   115.636 1.00 57.02  ? 198 HIS L CB  1 
ATOM   3265 C CG  . HIS B 2 203 ? -5.291  6.759   114.519 1.00 56.07  ? 198 HIS L CG  1 
ATOM   3266 N ND1 . HIS B 2 203 ? -3.998  7.227   114.417 1.00 54.71  ? 198 HIS L ND1 1 
ATOM   3267 C CD2 . HIS B 2 203 ? -5.487  5.976   113.439 1.00 54.66  ? 198 HIS L CD2 1 
ATOM   3268 C CE1 . HIS B 2 203 ? -3.434  6.744   113.317 1.00 53.93  ? 198 HIS L CE1 1 
ATOM   3269 N NE2 . HIS B 2 203 ? -4.310  5.954   112.720 1.00 53.69  ? 198 HIS L NE2 1 
ATOM   3270 N N   . GLN B 2 204 ? -4.050  5.202   117.022 1.00 56.98  ? 199 GLN L N   1 
ATOM   3271 C CA  . GLN B 2 204 ? -2.755  4.993   117.659 1.00 62.00  ? 199 GLN L CA  1 
ATOM   3272 C C   . GLN B 2 204 ? -1.932  6.279   117.707 1.00 62.25  ? 199 GLN L C   1 
ATOM   3273 O O   . GLN B 2 204 ? -1.089  6.452   118.582 1.00 66.47  ? 199 GLN L O   1 
ATOM   3274 C CB  . GLN B 2 204 ? -1.972  3.868   116.981 1.00 66.50  ? 199 GLN L CB  1 
ATOM   3275 C CG  . GLN B 2 204 ? -2.551  2.486   117.281 1.00 77.17  ? 199 GLN L CG  1 
ATOM   3276 C CD  . GLN B 2 204 ? -2.138  1.424   116.284 1.00 81.46  ? 199 GLN L CD  1 
ATOM   3277 O OE1 . GLN B 2 204 ? -2.975  0.874   115.561 1.00 73.58  ? 199 GLN L OE1 1 
ATOM   3278 N NE2 . GLN B 2 204 ? -0.848  1.130   116.233 1.00 81.20  ? 199 GLN L NE2 1 
ATOM   3279 N N   . GLY B 2 205 ? -2.160  7.192   116.767 1.00 55.38  ? 200 GLY L N   1 
ATOM   3280 C CA  . GLY B 2 205 ? -1.427  8.450   116.761 1.00 57.27  ? 200 GLY L CA  1 
ATOM   3281 C C   . GLY B 2 205 ? -1.973  9.455   117.783 1.00 53.75  ? 200 GLY L C   1 
ATOM   3282 O O   . GLY B 2 205 ? -1.478  10.573  117.847 1.00 53.68  ? 200 GLY L O   1 
ATOM   3283 N N   . LEU B 2 206 ? -2.986  9.054   118.563 1.00 57.06  ? 201 LEU L N   1 
ATOM   3284 C CA  . LEU B 2 206 ? -3.655  9.931   119.511 1.00 60.83  ? 201 LEU L CA  1 
ATOM   3285 C C   . LEU B 2 206 ? -3.528  9.365   120.923 1.00 62.60  ? 201 LEU L C   1 
ATOM   3286 O O   . LEU B 2 206 ? -4.067  8.285   121.192 1.00 59.70  ? 201 LEU L O   1 
ATOM   3287 C CB  . LEU B 2 206 ? -5.142  10.058  119.159 1.00 61.46  ? 201 LEU L CB  1 
ATOM   3288 C CG  . LEU B 2 206 ? -5.495  10.732  117.827 1.00 62.69  ? 201 LEU L CG  1 
ATOM   3289 C CD1 . LEU B 2 206 ? -6.987  10.608  117.582 1.00 59.08  ? 201 LEU L CD1 1 
ATOM   3290 C CD2 . LEU B 2 206 ? -5.063  12.183  117.797 1.00 63.05  ? 201 LEU L CD2 1 
ATOM   3291 N N   . SER B 2 207 ? -2.941  10.169  121.830 1.00 65.21  ? 202 SER L N   1 
ATOM   3292 C CA  . SER B 2 207 ? -2.766  9.799   123.231 1.00 63.64  ? 202 SER L CA  1 
ATOM   3293 C C   . SER B 2 207 ? -4.079  9.322   123.820 1.00 63.57  ? 202 SER L C   1 
ATOM   3294 O O   . SER B 2 207 ? -4.128  8.308   124.514 1.00 63.96  ? 202 SER L O   1 
ATOM   3295 C CB  . SER B 2 207 ? -2.237  10.931  124.043 1.00 62.14  ? 202 SER L CB  1 
ATOM   3296 O OG  . SER B 2 207 ? -1.027  11.382  123.468 1.00 75.39  ? 202 SER L OG  1 
ATOM   3297 N N   . SER B 2 208 ? -5.142  10.069  123.513 1.00 64.29  ? 203 SER L N   1 
ATOM   3298 C CA  . SER B 2 208 ? -6.476  9.681   123.930 1.00 69.77  ? 203 SER L CA  1 
ATOM   3299 C C   . SER B 2 208 ? -7.468  10.144  122.871 1.00 62.38  ? 203 SER L C   1 
ATOM   3300 O O   . SER B 2 208 ? -7.100  10.945  122.012 1.00 58.66  ? 203 SER L O   1 
ATOM   3301 C CB  . SER B 2 208 ? -6.801  10.258  125.286 1.00 72.59  ? 203 SER L CB  1 
ATOM   3302 O OG  . SER B 2 208 ? -6.810  11.674  125.217 1.00 69.27  ? 203 SER L OG  1 
ATOM   3303 N N   . PRO B 2 209 ? -8.729  9.657   122.907 1.00 62.99  ? 204 PRO L N   1 
ATOM   3304 C CA  . PRO B 2 209 ? -9.703  9.975   121.864 1.00 65.98  ? 204 PRO L CA  1 
ATOM   3305 C C   . PRO B 2 209 ? -9.960  11.469  121.737 1.00 67.45  ? 204 PRO L C   1 
ATOM   3306 O O   . PRO B 2 209 ? -10.159 12.144  122.741 1.00 64.11  ? 204 PRO L O   1 
ATOM   3307 C CB  . PRO B 2 209 ? -10.974 9.209   122.287 1.00 69.39  ? 204 PRO L CB  1 
ATOM   3308 C CG  . PRO B 2 209 ? -10.454 8.087   123.165 1.00 69.73  ? 204 PRO L CG  1 
ATOM   3309 C CD  . PRO B 2 209 ? -9.265  8.708   123.897 1.00 66.09  ? 204 PRO L CD  1 
ATOM   3310 N N   . VAL B 2 210 ? -9.951  11.954  120.490 1.00 63.87  ? 205 VAL L N   1 
ATOM   3311 C CA  . VAL B 2 210 ? -10.340 13.317  120.168 1.00 60.77  ? 205 VAL L CA  1 
ATOM   3312 C C   . VAL B 2 210 ? -11.836 13.338  119.856 1.00 58.63  ? 205 VAL L C   1 
ATOM   3313 O O   . VAL B 2 210 ? -12.363 12.422  119.235 1.00 60.00  ? 205 VAL L O   1 
ATOM   3314 C CB  . VAL B 2 210 ? -9.498  13.833  118.991 1.00 62.30  ? 205 VAL L CB  1 
ATOM   3315 C CG1 . VAL B 2 210 ? -10.020 15.152  118.428 1.00 70.93  ? 205 VAL L CG1 1 
ATOM   3316 C CG2 . VAL B 2 210 ? -8.040  13.963  119.389 1.00 66.35  ? 205 VAL L CG2 1 
ATOM   3317 N N   . THR B 2 211 ? -12.532 14.381  120.320 1.00 54.92  ? 206 THR L N   1 
ATOM   3318 C CA  . THR B 2 211 ? -13.958 14.517  120.067 1.00 56.04  ? 206 THR L CA  1 
ATOM   3319 C C   . THR B 2 211 ? -14.159 15.845  119.361 1.00 56.05  ? 206 THR L C   1 
ATOM   3320 O O   . THR B 2 211 ? -13.649 16.850  119.824 1.00 59.50  ? 206 THR L O   1 
ATOM   3321 C CB  . THR B 2 211 ? -14.777 14.423  121.355 1.00 59.22  ? 206 THR L CB  1 
ATOM   3322 O OG1 . THR B 2 211 ? -14.572 13.089  121.800 1.00 60.01  ? 206 THR L OG1 1 
ATOM   3323 C CG2 . THR B 2 211 ? -16.267 14.620  121.150 1.00 57.55  ? 206 THR L CG2 1 
ATOM   3324 N N   . LYS B 2 212 ? -14.852 15.831  118.213 1.00 61.21  ? 207 LYS L N   1 
ATOM   3325 C CA  . LYS B 2 212 ? -15.228 17.067  117.536 1.00 61.72  ? 207 LYS L CA  1 
ATOM   3326 C C   . LYS B 2 212 ? -16.749 17.150  117.574 1.00 55.34  ? 207 LYS L C   1 
ATOM   3327 O O   . LYS B 2 212 ? -17.428 16.152  117.359 1.00 49.77  ? 207 LYS L O   1 
ATOM   3328 C CB  . LYS B 2 212 ? -14.643 17.151  116.119 1.00 69.31  ? 207 LYS L CB  1 
ATOM   3329 C CG  . LYS B 2 212 ? -13.130 17.381  116.042 1.00 80.86  ? 207 LYS L CG  1 
ATOM   3330 C CD  . LYS B 2 212 ? -12.611 18.698  116.617 1.00 87.11  ? 207 LYS L CD  1 
ATOM   3331 C CE  . LYS B 2 212 ? -13.191 19.925  115.957 1.00 95.85  ? 207 LYS L CE  1 
ATOM   3332 N NZ  . LYS B 2 212 ? -12.741 20.099  114.572 1.00 96.51  ? 207 LYS L NZ  1 
ATOM   3333 N N   . SER B 2 213 ? -17.289 18.325  117.910 1.00 57.71  ? 208 SER L N   1 
ATOM   3334 C CA  . SER B 2 213 ? -18.732 18.399  118.057 1.00 58.10  ? 208 SER L CA  1 
ATOM   3335 C C   . SER B 2 213 ? -19.256 19.786  117.737 1.00 48.52  ? 208 SER L C   1 
ATOM   3336 O O   . SER B 2 213 ? -18.510 20.743  117.596 1.00 55.87  ? 208 SER L O   1 
ATOM   3337 C CB  . SER B 2 213 ? -19.185 17.942  119.431 1.00 65.40  ? 208 SER L CB  1 
ATOM   3338 O OG  . SER B 2 213 ? -18.590 18.736  120.440 1.00 62.50  ? 208 SER L OG  1 
ATOM   3339 N N   . PHE B 2 214 ? -20.573 19.836  117.567 1.00 54.03  ? 209 PHE L N   1 
ATOM   3340 C CA  . PHE B 2 214 ? -21.290 21.082  117.412 1.00 54.35  ? 209 PHE L CA  1 
ATOM   3341 C C   . PHE B 2 214 ? -22.647 20.949  118.097 1.00 54.77  ? 209 PHE L C   1 
ATOM   3342 O O   . PHE B 2 214 ? -23.139 19.836  118.345 1.00 49.66  ? 209 PHE L O   1 
ATOM   3343 C CB  . PHE B 2 214 ? -21.447 21.404  115.921 1.00 56.68  ? 209 PHE L CB  1 
ATOM   3344 C CG  . PHE B 2 214 ? -22.275 20.386  115.147 1.00 53.16  ? 209 PHE L CG  1 
ATOM   3345 C CD1 . PHE B 2 214 ? -23.660 20.524  115.028 1.00 55.15  ? 209 PHE L CD1 1 
ATOM   3346 C CD2 . PHE B 2 214 ? -21.661 19.295  114.524 1.00 52.71  ? 209 PHE L CD2 1 
ATOM   3347 C CE1 . PHE B 2 214 ? -24.412 19.586  114.326 1.00 50.82  ? 209 PHE L CE1 1 
ATOM   3348 C CE2 . PHE B 2 214 ? -22.415 18.375  113.807 1.00 51.20  ? 209 PHE L CE2 1 
ATOM   3349 C CZ  . PHE B 2 214 ? -23.786 18.511  113.723 1.00 52.23  ? 209 PHE L CZ  1 
ATOM   3350 N N   . ASN B 2 215 ? -23.261 22.111  118.358 1.00 54.59  ? 210 ASN L N   1 
ATOM   3351 C CA  . ASN B 2 215 ? -24.643 22.157  118.795 1.00 59.37  ? 210 ASN L CA  1 
ATOM   3352 C C   . ASN B 2 215 ? -25.531 22.519  117.611 1.00 53.79  ? 210 ASN L C   1 
ATOM   3353 O O   . ASN B 2 215 ? -25.256 23.471  116.894 1.00 52.48  ? 210 ASN L O   1 
ATOM   3354 C CB  . ASN B 2 215 ? -24.848 23.141  119.943 1.00 62.78  ? 210 ASN L CB  1 
ATOM   3355 C CG  . ASN B 2 215 ? -23.957 22.824  121.126 1.00 66.79  ? 210 ASN L CG  1 
ATOM   3356 O OD1 . ASN B 2 215 ? -23.773 21.653  121.484 1.00 66.47  ? 210 ASN L OD1 1 
ATOM   3357 N ND2 . ASN B 2 215 ? -23.382 23.849  121.731 1.00 67.90  ? 210 ASN L ND2 1 
ATOM   3358 N N   . ARG B 2 216 ? -26.624 21.784  117.437 1.00 54.82  ? 211 ARG L N   1 
ATOM   3359 C CA  . ARG B 2 216 ? -27.512 22.075  116.329 1.00 60.25  ? 211 ARG L CA  1 
ATOM   3360 C C   . ARG B 2 216 ? -27.914 23.546  116.403 1.00 68.43  ? 211 ARG L C   1 
ATOM   3361 O O   . ARG B 2 216 ? -28.348 24.035  117.449 1.00 62.61  ? 211 ARG L O   1 
ATOM   3362 C CB  . ARG B 2 216 ? -28.728 21.152  116.352 1.00 61.72  ? 211 ARG L CB  1 
ATOM   3363 C CG  . ARG B 2 216 ? -29.836 21.583  115.403 1.00 63.02  ? 211 ARG L CG  1 
ATOM   3364 C CD  . ARG B 2 216 ? -30.904 20.526  115.391 1.00 64.68  ? 211 ARG L CD  1 
ATOM   3365 N NE  . ARG B 2 216 ? -31.435 20.343  116.744 1.00 69.34  ? 211 ARG L NE  1 
ATOM   3366 C CZ  . ARG B 2 216 ? -32.215 21.207  117.372 1.00 71.78  ? 211 ARG L CZ  1 
ATOM   3367 N NH1 . ARG B 2 216 ? -32.404 21.075  118.672 1.00 73.39  ? 211 ARG L NH1 1 
ATOM   3368 N NH2 . ARG B 2 216 ? -32.743 22.229  116.723 1.00 71.74  ? 211 ARG L NH2 1 
ATOM   3369 N N   . GLY B 2 217 ? -27.705 24.258  115.295 1.00 63.23  ? 212 GLY L N   1 
ATOM   3370 C CA  . GLY B 2 217 ? -28.227 25.601  115.146 1.00 62.98  ? 212 GLY L CA  1 
ATOM   3371 C C   . GLY B 2 217 ? -27.196 26.627  115.575 1.00 63.46  ? 212 GLY L C   1 
ATOM   3372 O O   . GLY B 2 217 ? -27.437 27.824  115.479 1.00 73.35  ? 212 GLY L O   1 
ATOM   3373 N N   . GLU B 2 218 ? -26.043 26.143  116.035 1.00 66.92  ? 213 GLU L N   1 
ATOM   3374 C CA  . GLU B 2 218 ? -24.931 27.027  116.320 1.00 81.47  ? 213 GLU L CA  1 
ATOM   3375 C C   . GLU B 2 218 ? -24.079 27.104  115.041 1.00 74.14  ? 213 GLU L C   1 
ATOM   3376 O O   . GLU B 2 218 ? -22.968 27.663  115.145 1.00 88.96  ? 213 GLU L O   1 
ATOM   3377 C CB  . GLU B 2 218 ? -24.221 26.532  117.584 1.00 89.25  ? 213 GLU L CB  1 
ATOM   3378 C CG  . GLU B 2 218 ? -23.661 27.651  118.463 1.00 96.07  ? 213 GLU L CG  1 
ATOM   3379 C CD  . GLU B 2 218 ? -23.583 27.329  119.949 1.00 96.43  ? 213 GLU L CD  1 
ATOM   3380 O OE1 . GLU B 2 218 ? -24.198 28.049  120.770 1.00 82.70  ? 213 GLU L OE1 1 
ATOM   3381 O OE2 . GLU B 2 218 ? -22.891 26.348  120.287 1.00 97.71  ? 213 GLU L OE2 1 
HETATM 3382 C C1  . RBR C 3 .   ? 3.974   -9.951  66.903  1.00 37.03  ? 301 RBR H C1  1 
HETATM 3383 C C10 . RBR C 3 .   ? 1.823   -11.224 66.263  1.00 37.90  ? 301 RBR H C10 1 
HETATM 3384 C C11 . RBR C 3 .   ? 1.810   -9.104  67.727  1.00 34.26  ? 301 RBR H C11 1 
HETATM 3385 C C12 . RBR C 3 .   ? 1.761   -8.141  66.550  1.00 34.04  ? 301 RBR H C12 1 
HETATM 3386 C C13 . RBR C 3 .   ? 3.158   -7.828  65.951  1.00 35.07  ? 301 RBR H C13 1 
HETATM 3387 C C14 . RBR C 3 .   ? 3.936   -9.118  65.638  1.00 34.59  ? 301 RBR H C14 1 
HETATM 3388 C C15 . RBR C 3 .   ? 5.338   -8.706  65.204  1.00 38.54  ? 301 RBR H C15 1 
HETATM 3389 C C16 . RBR C 3 .   ? 5.357   -7.687  64.023  1.00 36.66  ? 301 RBR H C16 1 
HETATM 3390 C C17 . RBR C 3 .   ? 4.435   -6.481  64.203  1.00 35.01  ? 301 RBR H C17 1 
HETATM 3391 C C18 . RBR C 3 .   ? 4.350   -5.557  62.990  1.00 38.08  ? 301 RBR H C18 1 
HETATM 3392 C C19 . RBR C 3 .   ? 3.228   -4.520  63.048  1.00 38.17  ? 301 RBR H C19 1 
HETATM 3393 C C2  . RBR C 3 .   ? 4.835   -11.221 66.849  1.00 38.81  ? 301 RBR H C2  1 
HETATM 3394 C C21 . RBR C 3 .   ? 2.903   -4.236  64.510  1.00 34.85  ? 301 RBR H C21 1 
HETATM 3395 C C22 . RBR C 3 .   ? 2.354   -5.517  65.162  1.00 36.40  ? 301 RBR H C22 1 
HETATM 3396 C C23 . RBR C 3 .   ? 3.016   -6.871  64.693  1.00 36.99  ? 301 RBR H C23 1 
HETATM 3397 C C24 . RBR C 3 .   ? 2.193   -7.458  63.569  1.00 39.24  ? 301 RBR H C24 1 
HETATM 3398 C C26 . RBR C 3 .   ? 0.726   -3.144  63.870  1.00 35.12  ? 301 RBR H C26 1 
HETATM 3399 C C27 . RBR C 3 .   ? -0.124  -1.884  64.068  1.00 30.94  ? 301 RBR H C27 1 
HETATM 3400 C C29 . RBR C 3 .   ? 0.748   -1.509  66.240  1.00 34.95  ? 301 RBR H C29 1 
HETATM 3401 C C3  . RBR C 3 .   ? 4.441   -11.917 68.140  1.00 36.14  ? 301 RBR H C3  1 
HETATM 3402 C C30 . RBR C 3 .   ? 1.681   -2.732  66.154  1.00 33.47  ? 301 RBR H C30 1 
HETATM 3403 C C32 . RBR C 3 .   ? 3.780   -14.217 67.165  1.00 39.88  ? 301 RBR H C32 1 
HETATM 3404 C C33 . RBR C 3 .   ? 3.885   -15.718 67.184  1.00 51.71  ? 301 RBR H C33 1 
HETATM 3405 C C34 . RBR C 3 .   ? 3.139   -16.457 67.953  1.00 56.85  ? 301 RBR H C34 1 
HETATM 3406 C C35 . RBR C 3 .   ? 4.426   -13.779 69.690  1.00 36.80  ? 301 RBR H C35 1 
HETATM 3407 C C36 . RBR C 3 .   ? 5.830   -13.984 70.255  1.00 40.93  ? 301 RBR H C36 1 
HETATM 3408 C C37 . RBR C 3 .   ? 6.748   -13.432 69.315  1.00 37.11  ? 301 RBR H C37 1 
HETATM 3409 C C38 . RBR C 3 .   ? 6.130   -13.728 67.985  1.00 38.89  ? 301 RBR H C38 1 
HETATM 3410 C C4  . RBR C 3 .   ? 3.048   -11.332 68.511  1.00 33.03  ? 301 RBR H C4  1 
HETATM 3411 C C6  . RBR C 3 .   ? 1.112   -12.108 69.782  1.00 36.93  ? 301 RBR H C6  1 
HETATM 3412 C C7  . RBR C 3 .   ? 0.373   -13.318 70.190  1.00 33.38  ? 301 RBR H C7  1 
HETATM 3413 C C9  . RBR C 3 .   ? 2.592   -10.439 67.339  1.00 36.14  ? 301 RBR H C9  1 
HETATM 3414 N N25 . RBR C 3 .   ? 1.954   -3.036  64.685  1.00 35.12  ? 301 RBR H N25 1 
HETATM 3415 N N31 . RBR C 3 .   ? 4.634   -13.446 68.188  1.00 38.52  ? 301 RBR H N31 1 
HETATM 3416 O O20 . RBR C 3 .   ? 3.624   -3.298  62.505  1.00 37.61  ? 301 RBR H O20 1 
HETATM 3417 O O28 . RBR C 3 .   ? -0.447  -1.683  65.456  1.00 33.59  ? 301 RBR H O28 1 
HETATM 3418 O O5  . RBR C 3 .   ? 2.080   -12.373 68.819  1.00 37.06  ? 301 RBR H O5  1 
HETATM 3419 O O8  . RBR C 3 .   ? 0.930   -11.031 70.219  1.00 36.82  ? 301 RBR H O8  1 
HETATM 3420 O O   . HOH D 4 .   ? -18.627 25.224  86.883  1.00 58.44  ? 401 HOH H O   1 
HETATM 3421 O O   . HOH D 4 .   ? -35.120 -5.429  82.974  1.00 57.81  ? 402 HOH H O   1 
HETATM 3422 O O   . HOH D 4 .   ? -11.210 -0.798  87.436  1.00 56.85  ? 403 HOH H O   1 
HETATM 3423 O O   . HOH D 4 .   ? -13.688 -9.854  84.592  1.00 60.68  ? 404 HOH H O   1 
HETATM 3424 O O   . HOH D 4 .   ? -21.813 -11.963 80.170  1.00 58.97  ? 405 HOH H O   1 
HETATM 3425 O O   . HOH D 4 .   ? -21.567 26.737  87.824  1.00 53.61  ? 406 HOH H O   1 
HETATM 3426 O O   . HOH D 4 .   ? -20.419 21.256  85.733  1.00 55.07  ? 407 HOH H O   1 
HETATM 3427 O O   . HOH D 4 .   ? -19.280 -17.743 74.157  1.00 43.40  ? 408 HOH H O   1 
HETATM 3428 O O   . HOH D 4 .   ? -15.297 4.534   85.302  1.00 52.99  ? 409 HOH H O   1 
HETATM 3429 O O   . HOH D 4 .   ? -10.435 -14.946 81.693  1.00 41.02  ? 410 HOH H O   1 
HETATM 3430 O O   . HOH D 4 .   ? -30.858 6.449   100.696 1.00 53.87  ? 411 HOH H O   1 
HETATM 3431 O O   . HOH D 4 .   ? -7.904  9.488   78.799  1.00 47.07  ? 412 HOH H O   1 
HETATM 3432 O O   . HOH D 4 .   ? -1.829  10.696  77.318  1.00 53.46  ? 413 HOH H O   1 
HETATM 3433 O O   . HOH D 4 .   ? -7.004  17.102  102.081 1.00 55.43  ? 414 HOH H O   1 
HETATM 3434 O O   . HOH D 4 .   ? -34.371 -6.947  80.883  1.00 55.77  ? 415 HOH H O   1 
HETATM 3435 O O   . HOH D 4 .   ? -19.955 -8.266  87.117  1.00 41.11  ? 416 HOH H O   1 
HETATM 3436 O O   . HOH D 4 .   ? -12.530 13.418  92.581  1.00 46.83  ? 417 HOH H O   1 
HETATM 3437 O O   . HOH D 4 .   ? 1.368   6.622   61.343  1.00 58.24  ? 418 HOH H O   1 
HETATM 3438 O O   . HOH D 4 .   ? -6.092  -7.131  59.103  1.00 44.80  ? 419 HOH H O   1 
HETATM 3439 O O   . HOH D 4 .   ? -4.076  20.441  89.013  1.00 79.26  ? 420 HOH H O   1 
HETATM 3440 O O   . HOH D 4 .   ? -17.331 29.175  97.755  1.00 62.83  ? 421 HOH H O   1 
HETATM 3441 O O   . HOH D 4 .   ? -16.450 -21.149 72.119  1.00 55.37  ? 422 HOH H O   1 
HETATM 3442 O O   . HOH D 4 .   ? -11.550 -8.613  85.262  1.00 49.64  ? 423 HOH H O   1 
HETATM 3443 O O   . HOH D 4 .   ? -10.052 -4.476  54.831  1.00 60.64  ? 424 HOH H O   1 
HETATM 3444 O O   . HOH D 4 .   ? -19.797 5.914   92.784  1.00 44.21  ? 425 HOH H O   1 
HETATM 3445 O O   . HOH D 4 .   ? 5.177   3.786   72.518  1.00 46.62  ? 426 HOH H O   1 
HETATM 3446 O O   . HOH D 4 .   ? -17.727 22.514  109.313 1.00 56.92  ? 427 HOH H O   1 
HETATM 3447 O O   . HOH D 4 .   ? -24.737 -6.051  87.850  1.00 56.31  ? 428 HOH H O   1 
HETATM 3448 O O   . HOH D 4 .   ? 0.649   1.333   79.476  1.00 35.64  ? 429 HOH H O   1 
HETATM 3449 O O   . HOH D 4 .   ? -30.869 12.792  99.109  1.00 61.04  ? 430 HOH H O   1 
HETATM 3450 O O   . HOH D 4 .   ? -14.185 -6.192  63.080  1.00 44.87  ? 431 HOH H O   1 
HETATM 3451 O O   . HOH D 4 .   ? -2.116  4.258   59.189  1.00 44.78  ? 432 HOH H O   1 
HETATM 3452 O O   . HOH D 4 .   ? -19.053 18.655  85.201  1.00 55.78  ? 433 HOH H O   1 
HETATM 3453 O O   . HOH D 4 .   ? -18.775 7.146   100.693 1.00 48.36  ? 434 HOH H O   1 
HETATM 3454 O O   . HOH D 4 .   ? -4.764  14.831  72.019  1.00 52.26  ? 435 HOH H O   1 
HETATM 3455 O O   . HOH D 4 .   ? -28.504 -7.803  72.931  1.00 48.80  ? 436 HOH H O   1 
HETATM 3456 O O   . HOH D 4 .   ? -5.892  22.663  98.211  1.00 65.56  ? 437 HOH H O   1 
HETATM 3457 O O   . HOH D 4 .   ? -11.523 0.134   60.297  1.00 56.70  ? 438 HOH H O   1 
HETATM 3458 O O   . HOH D 4 .   ? -2.948  11.212  60.417  1.00 69.65  ? 439 HOH H O   1 
HETATM 3459 O O   . HOH D 4 .   ? -6.283  9.639   65.792  1.00 58.31  ? 440 HOH H O   1 
HETATM 3460 O O   . HOH D 4 .   ? -26.066 -2.068  93.976  1.00 57.34  ? 441 HOH H O   1 
HETATM 3461 O O   . HOH D 4 .   ? 6.036   -7.897  73.777  1.00 35.43  ? 442 HOH H O   1 
HETATM 3462 O O   . HOH D 4 .   ? -5.392  6.943   58.180  1.00 55.36  ? 443 HOH H O   1 
HETATM 3463 O O   . HOH D 4 .   ? -20.277 4.462   77.322  1.00 37.94  ? 444 HOH H O   1 
HETATM 3464 O O   . HOH D 4 .   ? -15.160 7.655   94.549  1.00 48.05  ? 445 HOH H O   1 
HETATM 3465 O O   . HOH D 4 .   ? -27.236 1.971   78.151  1.00 50.97  ? 446 HOH H O   1 
HETATM 3466 O O   . HOH D 4 .   ? 2.345   1.826   64.392  1.00 50.29  ? 447 HOH H O   1 
HETATM 3467 O O   . HOH D 4 .   ? -36.667 0.182   85.587  1.00 61.95  ? 448 HOH H O   1 
HETATM 3468 O O   . HOH D 4 .   ? -15.834 6.743   81.334  1.00 35.12  ? 449 HOH H O   1 
HETATM 3469 O O   . HOH D 4 .   ? -29.356 -3.976  90.617  1.00 64.11  ? 450 HOH H O   1 
HETATM 3470 O O   . HOH D 4 .   ? 9.810   4.331   73.887  1.00 59.68  ? 451 HOH H O   1 
HETATM 3471 O O   . HOH D 4 .   ? 2.044   5.851   78.620  1.00 63.81  ? 452 HOH H O   1 
HETATM 3472 O O   . HOH D 4 .   ? -15.012 -4.072  61.469  1.00 51.40  ? 453 HOH H O   1 
HETATM 3473 O O   . HOH D 4 .   ? -13.784 -20.154 68.885  1.00 42.43  ? 454 HOH H O   1 
HETATM 3474 O O   . HOH D 4 .   ? -17.146 12.782  84.427  1.00 53.08  ? 455 HOH H O   1 
HETATM 3475 O O   . HOH D 4 .   ? -3.088  -0.754  62.132  1.00 38.25  ? 456 HOH H O   1 
HETATM 3476 O O   . HOH D 4 .   ? -5.433  3.207   67.038  1.00 33.95  ? 457 HOH H O   1 
HETATM 3477 O O   . HOH D 4 .   ? -16.245 25.180  88.289  1.00 43.27  ? 458 HOH H O   1 
HETATM 3478 O O   . HOH D 4 .   ? -32.343 -0.504  84.223  1.00 44.85  ? 459 HOH H O   1 
HETATM 3479 O O   . HOH D 4 .   ? -22.688 26.432  100.453 1.00 55.69  ? 460 HOH H O   1 
HETATM 3480 O O   . HOH D 4 .   ? -20.545 9.163   85.999  1.00 34.49  ? 461 HOH H O   1 
HETATM 3481 O O   . HOH D 4 .   ? -4.499  7.722   76.976  1.00 35.74  ? 462 HOH H O   1 
HETATM 3482 O O   . HOH D 4 .   ? -10.378 11.991  63.036  1.00 46.49  ? 463 HOH H O   1 
HETATM 3483 O O   . HOH D 4 .   ? -23.918 -12.056 73.757  1.00 54.17  ? 464 HOH H O   1 
HETATM 3484 O O   . HOH D 4 .   ? -28.493 -1.372  94.711  1.00 50.80  ? 465 HOH H O   1 
HETATM 3485 O O   . HOH D 4 .   ? -15.186 30.418  99.723  1.00 62.86  ? 466 HOH H O   1 
HETATM 3486 O O   . HOH D 4 .   ? -15.778 -12.069 82.366  1.00 41.28  ? 467 HOH H O   1 
HETATM 3487 O O   . HOH D 4 .   ? -20.152 10.886  103.064 1.00 44.55  ? 468 HOH H O   1 
HETATM 3488 O O   . HOH D 4 .   ? -22.337 2.056   85.565  1.00 35.68  ? 469 HOH H O   1 
HETATM 3489 O O   . HOH D 4 .   ? 1.467   5.567   65.696  1.00 37.91  ? 470 HOH H O   1 
HETATM 3490 O O   . HOH D 4 .   ? -36.374 2.211   83.755  1.00 70.37  ? 471 HOH H O   1 
HETATM 3491 O O   . HOH D 4 .   ? -8.152  7.729   61.215  1.00 47.24  ? 472 HOH H O   1 
HETATM 3492 O O   . HOH D 4 .   ? -10.634 18.668  90.534  1.00 43.58  ? 473 HOH H O   1 
HETATM 3493 O O   . HOH D 4 .   ? -18.312 -8.956  79.620  1.00 36.05  ? 474 HOH H O   1 
HETATM 3494 O O   . HOH D 4 .   ? -16.921 -18.820 73.948  1.00 46.39  ? 475 HOH H O   1 
HETATM 3495 O O   . HOH D 4 .   ? 8.415   -9.916  68.905  1.00 45.45  ? 476 HOH H O   1 
HETATM 3496 O O   . HOH D 4 .   ? -9.175  12.455  67.390  1.00 54.29  ? 477 HOH H O   1 
HETATM 3497 O O   . HOH D 4 .   ? -21.504 -7.692  70.431  1.00 39.62  ? 478 HOH H O   1 
HETATM 3498 O O   . HOH D 4 .   ? -19.443 1.068   64.724  1.00 43.47  ? 479 HOH H O   1 
HETATM 3499 O O   . HOH D 4 .   ? -13.382 12.561  66.056  1.00 48.80  ? 480 HOH H O   1 
HETATM 3500 O O   . HOH D 4 .   ? -15.812 9.876   68.920  1.00 42.86  ? 481 HOH H O   1 
HETATM 3501 O O   . HOH D 4 .   ? -18.829 -2.108  67.585  1.00 34.17  ? 482 HOH H O   1 
HETATM 3502 O O   . HOH D 4 .   ? -31.378 -6.262  88.006  1.00 53.02  ? 483 HOH H O   1 
HETATM 3503 O O   . HOH D 4 .   ? -16.868 4.092   94.556  1.00 49.53  ? 484 HOH H O   1 
HETATM 3504 O O   . HOH D 4 .   ? -5.922  6.671   80.817  1.00 55.34  ? 485 HOH H O   1 
HETATM 3505 O O   . HOH D 4 .   ? -22.716 22.597  104.689 1.00 56.61  ? 486 HOH H O   1 
HETATM 3506 O O   . HOH D 4 .   ? 8.903   -0.076  65.414  1.00 59.67  ? 487 HOH H O   1 
HETATM 3507 O O   . HOH D 4 .   ? -8.793  5.967   84.817  1.00 57.36  ? 488 HOH H O   1 
HETATM 3508 O O   . HOH D 4 .   ? -17.151 15.626  87.633  1.00 45.59  ? 489 HOH H O   1 
HETATM 3509 O O   . HOH D 4 .   ? -7.666  10.347  98.031  1.00 61.89  ? 490 HOH H O   1 
HETATM 3510 O O   . HOH D 4 .   ? -26.949 5.027   81.117  1.00 35.67  ? 491 HOH H O   1 
HETATM 3511 O O   . HOH D 4 .   ? 0.699   14.122  69.465  1.00 39.26  ? 492 HOH H O   1 
HETATM 3512 O O   . HOH D 4 .   ? -16.520 -14.519 83.744  1.00 58.65  ? 493 HOH H O   1 
HETATM 3513 O O   . HOH D 4 .   ? -24.696 2.249   74.293  1.00 42.76  ? 494 HOH H O   1 
HETATM 3514 O O   . HOH D 4 .   ? -18.660 -14.853 74.337  1.00 37.78  ? 495 HOH H O   1 
HETATM 3515 O O   . HOH D 4 .   ? -12.879 -1.430  68.621  1.00 31.08  ? 496 HOH H O   1 
HETATM 3516 O O   . HOH D 4 .   ? -15.510 2.937   76.236  1.00 32.05  ? 497 HOH H O   1 
HETATM 3517 O O   . HOH D 4 .   ? -9.078  -17.370 72.681  1.00 36.25  ? 498 HOH H O   1 
HETATM 3518 O O   . HOH D 4 .   ? -6.580  -12.611 82.070  1.00 35.42  ? 499 HOH H O   1 
HETATM 3519 O O   . HOH D 4 .   ? -32.835 10.949  88.913  1.00 52.34  ? 500 HOH H O   1 
HETATM 3520 O O   . HOH D 4 .   ? -36.602 -3.025  83.364  1.00 64.74  ? 501 HOH H O   1 
HETATM 3521 O O   . HOH D 4 .   ? -16.049 28.152  100.938 1.00 63.65  ? 502 HOH H O   1 
HETATM 3522 O O   . HOH D 4 .   ? -35.959 0.724   89.803  1.00 56.55  ? 503 HOH H O   1 
HETATM 3523 O O   . HOH D 4 .   ? -33.469 2.413   91.272  1.00 68.19  ? 504 HOH H O   1 
HETATM 3524 O O   . HOH D 4 .   ? -17.299 1.481   96.476  1.00 71.29  ? 505 HOH H O   1 
HETATM 3525 O O   . HOH D 4 .   ? -10.377 15.904  69.411  1.00 57.31  ? 506 HOH H O   1 
HETATM 3526 O O   . HOH D 4 .   ? -24.563 1.630   66.783  1.00 74.91  ? 507 HOH H O   1 
HETATM 3527 O O   . HOH D 4 .   ? -24.399 -13.514 77.896  1.00 38.44  ? 508 HOH H O   1 
HETATM 3528 O O   . HOH D 4 .   ? -4.628  -8.145  62.459  1.00 51.15  ? 509 HOH H O   1 
HETATM 3529 O O   . HOH D 4 .   ? 3.560   -0.729  64.372  1.00 40.17  ? 510 HOH H O   1 
HETATM 3530 O O   . HOH D 4 .   ? -15.111 -1.270  61.713  1.00 44.02  ? 511 HOH H O   1 
HETATM 3531 O O   . HOH D 4 .   ? 3.750   0.580   67.003  1.00 47.06  ? 512 HOH H O   1 
HETATM 3532 O O   . HOH D 4 .   ? -5.301  13.998  66.654  1.00 54.98  ? 513 HOH H O   1 
HETATM 3533 O O   . HOH D 4 .   ? -13.665 -17.827 82.487  1.00 62.12  ? 514 HOH H O   1 
HETATM 3534 O O   . HOH D 4 .   ? -16.300 17.470  86.156  1.00 51.24  ? 515 HOH H O   1 
HETATM 3535 O O   . HOH D 4 .   ? -8.724  11.389  72.346  1.00 37.11  ? 516 HOH H O   1 
HETATM 3536 O O   . HOH D 4 .   ? -24.611 26.352  94.005  1.00 49.32  ? 517 HOH H O   1 
HETATM 3537 O O   . HOH D 4 .   ? -20.912 -0.232  100.513 1.00 55.84  ? 518 HOH H O   1 
HETATM 3538 O O   . HOH D 4 .   ? 9.133   -9.441  66.398  1.00 51.68  ? 519 HOH H O   1 
HETATM 3539 O O   . HOH D 4 .   ? -1.467  -4.092  60.865  1.00 47.29  ? 520 HOH H O   1 
HETATM 3540 O O   . HOH D 4 .   ? -15.319 8.611   73.289  1.00 55.78  ? 521 HOH H O   1 
HETATM 3541 O O   . HOH D 4 .   ? -21.014 -3.172  66.442  1.00 47.32  ? 522 HOH H O   1 
HETATM 3542 O O   . HOH D 4 .   ? -9.484  10.701  96.090  1.00 58.06  ? 523 HOH H O   1 
HETATM 3543 O O   . HOH D 4 .   ? -17.217 10.410  82.754  1.00 40.42  ? 524 HOH H O   1 
HETATM 3544 O O   . HOH D 4 .   ? -23.185 0.333   90.440  1.00 42.30  ? 525 HOH H O   1 
HETATM 3545 O O   . HOH D 4 .   ? -9.093  -14.925 79.321  1.00 36.67  ? 526 HOH H O   1 
HETATM 3546 O O   . HOH D 4 .   ? -7.758  -15.500 71.251  1.00 39.90  ? 527 HOH H O   1 
HETATM 3547 O O   . HOH D 4 .   ? -14.974 9.126   82.235  1.00 48.20  ? 528 HOH H O   1 
HETATM 3548 O O   . HOH D 4 .   ? -33.515 -6.307  77.237  1.00 64.76  ? 529 HOH H O   1 
HETATM 3549 O O   . HOH D 4 .   ? -6.232  9.661   62.847  1.00 47.13  ? 530 HOH H O   1 
HETATM 3550 O O   . HOH D 4 .   ? -2.011  -7.760  69.479  1.00 33.17  ? 531 HOH H O   1 
HETATM 3551 O O   . HOH D 4 .   ? -28.898 -0.375  76.612  1.00 42.76  ? 532 HOH H O   1 
HETATM 3552 O O   . HOH D 4 .   ? -2.333  5.647   79.393  1.00 40.69  ? 533 HOH H O   1 
HETATM 3553 O O   . HOH D 4 .   ? -30.359 -2.741  73.513  1.00 45.23  ? 534 HOH H O   1 
HETATM 3554 O O   . HOH D 4 .   ? 2.094   7.386   67.917  1.00 40.09  ? 535 HOH H O   1 
HETATM 3555 O O   . HOH D 4 .   ? -2.820  -3.408  58.405  1.00 58.53  ? 536 HOH H O   1 
HETATM 3556 O O   . HOH D 4 .   ? -5.377  -2.141  55.744  1.00 72.70  ? 537 HOH H O   1 
HETATM 3557 O O   . HOH D 4 .   ? 3.355   3.095   67.602  1.00 43.45  ? 538 HOH H O   1 
HETATM 3558 O O   . HOH D 4 .   ? -33.183 3.865   84.025  1.00 46.43  ? 539 HOH H O   1 
HETATM 3559 O O   . HOH D 4 .   ? -17.541 14.859  80.558  1.00 50.81  ? 540 HOH H O   1 
HETATM 3560 O O   . HOH D 4 .   ? -29.634 3.852   80.511  1.00 61.13  ? 541 HOH H O   1 
HETATM 3561 O O   . HOH D 4 .   ? 0.832   8.101   64.146  1.00 40.60  ? 542 HOH H O   1 
HETATM 3562 O O   . HOH D 4 .   ? -14.085 3.546   58.885  1.00 53.20  ? 543 HOH H O   1 
HETATM 3563 O O   . HOH D 4 .   ? -14.256 11.516  90.911  1.00 42.35  ? 544 HOH H O   1 
HETATM 3564 O O   . HOH D 4 .   ? -27.868 2.882   105.066 1.00 62.05  ? 545 HOH H O   1 
HETATM 3565 O O   . HOH D 4 .   ? -28.108 6.555   104.423 1.00 66.51  ? 546 HOH H O   1 
HETATM 3566 O O   . HOH D 4 .   ? -16.987 5.477   83.617  1.00 37.04  ? 547 HOH H O   1 
HETATM 3567 O O   . HOH D 4 .   ? -14.835 6.556   58.209  1.00 62.04  ? 548 HOH H O   1 
HETATM 3568 O O   . HOH D 4 .   ? -5.940  2.835   56.497  1.00 65.50  ? 549 HOH H O   1 
HETATM 3569 O O   . HOH D 4 .   ? -9.077  26.600  92.153  1.00 59.15  ? 550 HOH H O   1 
HETATM 3570 O O   . HOH D 4 .   ? -23.875 17.871  103.566 1.00 45.80  ? 551 HOH H O   1 
HETATM 3571 O O   . HOH D 4 .   ? -20.865 -9.811  65.932  1.00 57.97  ? 552 HOH H O   1 
HETATM 3572 O O   . HOH D 4 .   ? -19.977 -2.042  87.380  1.00 57.70  ? 553 HOH H O   1 
HETATM 3573 O O   . HOH D 4 .   ? -21.890 9.083   102.110 1.00 62.04  ? 554 HOH H O   1 
HETATM 3574 O O   . HOH D 4 .   ? -24.913 8.563   103.113 1.00 58.97  ? 555 HOH H O   1 
HETATM 3575 O O   . HOH D 4 .   ? -4.611  22.123  93.345  1.00 54.59  ? 556 HOH H O   1 
HETATM 3576 O O   . HOH D 4 .   ? -9.085  -6.480  89.130  1.00 56.79  ? 557 HOH H O   1 
HETATM 3577 O O   . HOH D 4 .   ? -28.461 -10.439 84.390  1.00 45.69  ? 558 HOH H O   1 
HETATM 3578 O O   . HOH D 4 .   ? -13.144 -2.640  88.251  1.00 54.89  ? 559 HOH H O   1 
HETATM 3579 O O   . HOH D 4 .   ? -12.881 4.089   85.157  1.00 54.53  ? 560 HOH H O   1 
HETATM 3580 O O   . HOH D 4 .   ? -16.268 10.314  79.524  1.00 61.74  ? 561 HOH H O   1 
HETATM 3581 O O   . HOH D 4 .   ? -16.928 34.273  98.003  1.00 71.05  ? 562 HOH H O   1 
HETATM 3582 O O   . HOH D 4 .   ? -32.669 12.785  91.981  1.00 61.23  ? 563 HOH H O   1 
HETATM 3583 O O   . HOH D 4 .   ? -30.898 -0.966  78.335  1.00 39.56  ? 564 HOH H O   1 
HETATM 3584 O O   . HOH D 4 .   ? -30.663 -10.830 74.597  1.00 62.38  ? 565 HOH H O   1 
HETATM 3585 O O   . HOH D 4 .   ? 2.076   10.314  67.492  1.00 48.88  ? 566 HOH H O   1 
HETATM 3586 O O   . HOH D 4 .   ? 0.772   8.546   59.423  1.00 58.76  ? 567 HOH H O   1 
HETATM 3587 O O   . HOH D 4 .   ? 4.059   5.739   68.542  1.00 48.06  ? 568 HOH H O   1 
HETATM 3588 O O   . HOH D 4 .   ? -18.417 8.155   84.106  1.00 33.61  ? 569 HOH H O   1 
HETATM 3589 O O   . HOH D 4 .   ? -12.411 14.369  88.275  1.00 72.79  ? 570 HOH H O   1 
HETATM 3590 O O   . HOH D 4 .   ? -7.006  -9.128  62.828  1.00 58.47  ? 571 HOH H O   1 
HETATM 3591 O O   . HOH D 4 .   ? -18.210 -13.006 78.129  1.00 65.64  ? 572 HOH H O   1 
HETATM 3592 O O   . HOH D 4 .   ? -17.110 2.723   60.045  1.00 63.07  ? 573 HOH H O   1 
HETATM 3593 O O   . HOH D 4 .   ? -17.252 2.970   90.582  1.00 65.57  ? 574 HOH H O   1 
HETATM 3594 O O   . HOH D 4 .   ? -22.598 4.330   66.171  1.00 68.75  ? 575 HOH H O   1 
HETATM 3595 O O   . HOH D 4 .   ? 6.618   2.900   68.008  1.00 67.67  ? 576 HOH H O   1 
HETATM 3596 O O   . HOH D 4 .   ? 2.052   17.624  73.395  1.00 53.00  ? 577 HOH H O   1 
HETATM 3597 O O   . HOH D 4 .   ? -24.536 -9.462  67.954  1.00 68.16  ? 578 HOH H O   1 
HETATM 3598 O O   . HOH D 4 .   ? -12.799 -19.754 75.985  1.00 65.36  ? 579 HOH H O   1 
HETATM 3599 O O   . HOH D 4 .   ? -18.654 22.958  84.971  1.00 54.04  ? 580 HOH H O   1 
HETATM 3600 O O   . HOH D 4 .   ? 4.558   4.241   77.034  1.00 61.97  ? 581 HOH H O   1 
HETATM 3601 O O   . HOH D 4 .   ? -32.342 1.617   82.374  1.00 53.98  ? 582 HOH H O   1 
HETATM 3602 O O   . HOH D 4 .   ? -3.151  20.243  100.646 1.00 78.61  ? 583 HOH H O   1 
HETATM 3603 O O   . HOH D 4 .   ? -4.281  24.019  102.327 1.00 76.78  ? 584 HOH H O   1 
HETATM 3604 O O   . HOH D 4 .   ? -25.748 -1.294  71.025  1.00 52.95  ? 585 HOH H O   1 
HETATM 3605 O O   . HOH D 4 .   ? -12.747 18.252  84.928  1.00 71.75  ? 586 HOH H O   1 
HETATM 3606 O O   . HOH D 4 .   ? -7.988  13.150  62.388  1.00 67.73  ? 587 HOH H O   1 
HETATM 3607 O O   . HOH D 4 .   ? -24.024 -6.354  65.651  1.00 71.12  ? 588 HOH H O   1 
HETATM 3608 O O   . HOH D 4 .   ? -15.162 14.350  83.095  1.00 61.98  ? 589 HOH H O   1 
HETATM 3609 O O   . HOH D 4 .   ? 3.327   5.192   61.905  1.00 62.33  ? 590 HOH H O   1 
HETATM 3610 O O   . HOH D 4 .   ? -2.715  13.857  64.535  1.00 84.13  ? 591 HOH H O   1 
HETATM 3611 O O   . HOH D 4 .   ? -22.062 27.093  90.327  1.00 70.32  ? 592 HOH H O   1 
HETATM 3612 O O   . HOH D 4 .   ? -33.695 6.868   100.302 1.00 67.36  ? 593 HOH H O   1 
HETATM 3613 O O   . HOH D 4 .   ? -31.647 1.284   79.723  1.00 62.45  ? 594 HOH H O   1 
HETATM 3614 O O   . HOH D 4 .   ? 5.648   -13.788 64.256  1.00 67.75  ? 595 HOH H O   1 
HETATM 3615 O O   . HOH D 4 .   ? -27.300 2.380   73.711  1.00 63.79  ? 596 HOH H O   1 
HETATM 3616 O O   . HOH D 4 .   ? -23.638 -15.237 79.897  1.00 51.32  ? 597 HOH H O   1 
HETATM 3617 O O   . HOH D 4 .   ? -20.899 -14.490 76.015  1.00 57.58  ? 598 HOH H O   1 
HETATM 3618 O O   . HOH D 4 .   ? -8.071  -14.465 83.281  1.00 45.59  ? 599 HOH H O   1 
HETATM 3619 O O   . HOH D 4 .   ? -15.470 5.987   88.167  1.00 67.70  ? 600 HOH H O   1 
HETATM 3620 O O   . HOH D 4 .   ? -9.765  17.179  88.565  1.00 69.47  ? 601 HOH H O   1 
HETATM 3621 O O   . HOH D 4 .   ? 1.851   -0.093  60.131  1.00 72.25  ? 602 HOH H O   1 
HETATM 3622 O O   . HOH D 4 .   ? -30.176 -2.437  93.072  1.00 65.84  ? 603 HOH H O   1 
HETATM 3623 O O   . HOH D 4 .   ? -23.699 31.270  108.149 1.00 74.93  ? 604 HOH H O   1 
HETATM 3624 O O   . HOH D 4 .   ? -0.549  -15.447 66.791  1.00 64.66  ? 605 HOH H O   1 
HETATM 3625 O O   . HOH D 4 .   ? -13.997 8.299   84.694  1.00 57.26  ? 606 HOH H O   1 
HETATM 3626 O O   . HOH D 4 .   ? -15.664 -19.584 77.417  1.00 63.01  ? 607 HOH H O   1 
HETATM 3627 O O   . HOH D 4 .   ? -15.714 10.852  71.990  1.00 72.82  ? 608 HOH H O   1 
HETATM 3628 O O   . HOH D 4 .   ? -14.953 0.303   98.153  1.00 65.64  ? 609 HOH H O   1 
HETATM 3629 O O   . HOH D 4 .   ? -0.596  -10.964 63.271  1.00 53.99  ? 610 HOH H O   1 
HETATM 3630 O O   . HOH D 4 .   ? -19.155 -14.252 79.873  1.00 64.65  ? 611 HOH H O   1 
HETATM 3631 O O   . HOH D 4 .   ? -4.626  24.505  94.651  1.00 78.13  ? 612 HOH H O   1 
HETATM 3632 O O   . HOH D 4 .   ? 2.419   1.961   59.118  1.00 81.36  ? 613 HOH H O   1 
HETATM 3633 O O   . HOH D 4 .   ? -29.803 -9.467  86.585  1.00 78.91  ? 614 HOH H O   1 
HETATM 3634 O O   . HOH D 4 .   ? -33.115 -1.661  77.115  1.00 50.83  ? 615 HOH H O   1 
HETATM 3635 O O   . HOH D 4 .   ? -13.198 2.638   88.903  1.00 63.30  ? 616 HOH H O   1 
HETATM 3636 O O   . HOH D 4 .   ? -16.225 7.459   85.850  1.00 52.80  ? 617 HOH H O   1 
HETATM 3637 O O   . HOH D 4 .   ? 7.923   -11.620 64.428  1.00 69.65  ? 618 HOH H O   1 
HETATM 3638 O O   . HOH D 4 .   ? 3.675   -10.650 62.340  1.00 60.64  ? 619 HOH H O   1 
HETATM 3639 O O   . HOH D 4 .   ? -12.224 41.080  106.258 1.00 73.12  ? 620 HOH H O   1 
HETATM 3640 O O   . HOH E 4 .   ? 15.109  -3.643  90.662  1.00 52.34  ? 301 HOH L O   1 
HETATM 3641 O O   . HOH E 4 .   ? -23.914 6.250   104.604 1.00 54.62  ? 302 HOH L O   1 
HETATM 3642 O O   . HOH E 4 .   ? -4.442  -20.042 72.434  1.00 61.52  ? 303 HOH L O   1 
HETATM 3643 O O   . HOH E 4 .   ? -10.364 -18.021 76.503  1.00 45.11  ? 304 HOH L O   1 
HETATM 3644 O O   . HOH E 4 .   ? 9.118   -12.619 94.827  1.00 63.67  ? 305 HOH L O   1 
HETATM 3645 O O   . HOH E 4 .   ? -26.292 10.151  104.596 1.00 53.32  ? 306 HOH L O   1 
HETATM 3646 O O   . HOH E 4 .   ? 6.251   4.401   91.002  1.00 57.87  ? 307 HOH L O   1 
HETATM 3647 O O   . HOH E 4 .   ? 0.916   5.261   93.319  1.00 52.80  ? 308 HOH L O   1 
HETATM 3648 O O   . HOH E 4 .   ? 9.531   -2.455  106.789 1.00 62.69  ? 309 HOH L O   1 
HETATM 3649 O O   . HOH E 4 .   ? -10.138 2.214   109.631 1.00 69.16  ? 310 HOH L O   1 
HETATM 3650 O O   . HOH E 4 .   ? -28.572 20.348  95.545  1.00 44.89  ? 311 HOH L O   1 
HETATM 3651 O O   . HOH E 4 .   ? -12.433 12.881  123.672 1.00 65.40  ? 312 HOH L O   1 
HETATM 3652 O O   . HOH E 4 .   ? 3.204   -18.330 70.934  1.00 54.39  ? 313 HOH L O   1 
HETATM 3653 O O   . HOH E 4 .   ? 10.989  -22.552 78.470  1.00 48.11  ? 314 HOH L O   1 
HETATM 3654 O O   . HOH E 4 .   ? -3.440  -12.076 92.601  1.00 49.69  ? 315 HOH L O   1 
HETATM 3655 O O   . HOH E 4 .   ? -2.042  4.128   81.730  1.00 51.21  ? 316 HOH L O   1 
HETATM 3656 O O   . HOH E 4 .   ? 12.369  -17.025 79.908  1.00 44.59  ? 317 HOH L O   1 
HETATM 3657 O O   . HOH E 4 .   ? -32.412 19.826  97.490  1.00 74.79  ? 318 HOH L O   1 
HETATM 3658 O O   . HOH E 4 .   ? 10.812  -21.693 86.855  1.00 51.29  ? 319 HOH L O   1 
HETATM 3659 O O   . HOH E 4 .   ? 14.165  -7.743  78.181  1.00 54.60  ? 320 HOH L O   1 
HETATM 3660 O O   . HOH E 4 .   ? 0.215   -5.356  76.543  1.00 35.10  ? 321 HOH L O   1 
HETATM 3661 O O   . HOH E 4 .   ? 4.655   -12.719 95.038  1.00 62.47  ? 322 HOH L O   1 
HETATM 3662 O O   . HOH E 4 .   ? -38.210 13.169  107.261 1.00 71.21  ? 323 HOH L O   1 
HETATM 3663 O O   . HOH E 4 .   ? -28.685 22.498  108.640 1.00 65.11  ? 324 HOH L O   1 
HETATM 3664 O O   . HOH E 4 .   ? -3.399  -18.011 76.508  1.00 37.70  ? 325 HOH L O   1 
HETATM 3665 O O   . HOH E 4 .   ? -4.909  10.349  98.216  1.00 65.85  ? 326 HOH L O   1 
HETATM 3666 O O   . HOH E 4 .   ? 6.720   -20.232 74.845  1.00 57.77  ? 327 HOH L O   1 
HETATM 3667 O O   . HOH E 4 .   ? 12.576  -11.855 67.561  1.00 67.69  ? 328 HOH L O   1 
HETATM 3668 O O   . HOH E 4 .   ? -4.909  -16.184 87.834  1.00 59.98  ? 329 HOH L O   1 
HETATM 3669 O O   . HOH E 4 .   ? 16.236  -12.798 69.307  1.00 67.66  ? 330 HOH L O   1 
HETATM 3670 O O   . HOH E 4 .   ? -23.222 17.184  106.409 1.00 47.74  ? 331 HOH L O   1 
HETATM 3671 O O   . HOH E 4 .   ? -18.405 5.141   111.550 1.00 69.37  ? 332 HOH L O   1 
HETATM 3672 O O   . HOH E 4 .   ? 12.592  6.907   79.693  1.00 66.92  ? 333 HOH L O   1 
HETATM 3673 O O   . HOH E 4 .   ? 5.381   3.728   81.611  1.00 57.22  ? 334 HOH L O   1 
HETATM 3674 O O   . HOH E 4 .   ? -33.170 9.022   112.677 1.00 64.03  ? 335 HOH L O   1 
HETATM 3675 O O   . HOH E 4 .   ? -16.728 11.992  123.355 1.00 67.75  ? 336 HOH L O   1 
HETATM 3676 O O   . HOH E 4 .   ? -10.709 2.221   99.456  1.00 53.05  ? 337 HOH L O   1 
HETATM 3677 O O   . HOH E 4 .   ? -26.968 24.827  104.724 1.00 60.40  ? 338 HOH L O   1 
HETATM 3678 O O   . HOH E 4 .   ? -29.648 2.262   114.130 1.00 81.07  ? 339 HOH L O   1 
HETATM 3679 O O   . HOH E 4 .   ? 10.412  -13.391 67.052  1.00 61.46  ? 340 HOH L O   1 
HETATM 3680 O O   . HOH E 4 .   ? 1.587   -25.965 84.057  1.00 60.31  ? 341 HOH L O   1 
HETATM 3681 O O   . HOH E 4 .   ? -25.126 6.882   107.284 1.00 50.24  ? 342 HOH L O   1 
HETATM 3682 O O   . HOH E 4 .   ? -15.000 2.825   113.480 1.00 63.85  ? 343 HOH L O   1 
HETATM 3683 O O   . HOH E 4 .   ? 15.081  -5.381  84.282  1.00 50.33  ? 344 HOH L O   1 
HETATM 3684 O O   . HOH E 4 .   ? -1.542  3.543   86.803  1.00 47.58  ? 345 HOH L O   1 
HETATM 3685 O O   . HOH E 4 .   ? -6.267  -2.749  90.630  1.00 53.97  ? 346 HOH L O   1 
HETATM 3686 O O   . HOH E 4 .   ? -12.342 2.590   110.773 1.00 74.50  ? 347 HOH L O   1 
HETATM 3687 O O   . HOH E 4 .   ? 12.895  3.630   81.401  1.00 64.60  ? 348 HOH L O   1 
HETATM 3688 O O   . HOH E 4 .   ? -13.522 6.249   119.160 1.00 55.08  ? 349 HOH L O   1 
HETATM 3689 O O   . HOH E 4 .   ? -0.320  5.711   86.766  1.00 67.92  ? 350 HOH L O   1 
HETATM 3690 O O   . HOH E 4 .   ? -1.979  -10.850 65.425  1.00 40.02  ? 351 HOH L O   1 
HETATM 3691 O O   . HOH E 4 .   ? 2.254   5.726   99.265  1.00 53.40  ? 352 HOH L O   1 
HETATM 3692 O O   . HOH E 4 .   ? -19.045 7.986   105.217 1.00 49.94  ? 353 HOH L O   1 
HETATM 3693 O O   . HOH E 4 .   ? -23.675 4.690   114.391 1.00 59.89  ? 354 HOH L O   1 
HETATM 3694 O O   . HOH E 4 .   ? 14.280  -13.983 77.450  1.00 40.09  ? 355 HOH L O   1 
HETATM 3695 O O   . HOH E 4 .   ? 10.268  7.091   91.061  1.00 68.71  ? 356 HOH L O   1 
HETATM 3696 O O   . HOH E 4 .   ? -4.048  1.517   99.437  1.00 57.96  ? 357 HOH L O   1 
HETATM 3697 O O   . HOH E 4 .   ? -8.154  -17.484 79.521  1.00 44.69  ? 358 HOH L O   1 
HETATM 3698 O O   . HOH E 4 .   ? -6.050  -18.237 81.348  1.00 48.97  ? 359 HOH L O   1 
HETATM 3699 O O   . HOH E 4 .   ? -5.486  8.633   100.849 1.00 46.81  ? 360 HOH L O   1 
HETATM 3700 O O   . HOH E 4 .   ? 0.004   -19.962 86.717  1.00 47.64  ? 361 HOH L O   1 
HETATM 3701 O O   . HOH E 4 .   ? -26.352 18.113  103.926 1.00 50.36  ? 362 HOH L O   1 
HETATM 3702 O O   . HOH E 4 .   ? -7.753  1.623   102.005 1.00 55.93  ? 363 HOH L O   1 
HETATM 3703 O O   . HOH E 4 .   ? 6.682   -8.788  76.390  1.00 35.05  ? 364 HOH L O   1 
HETATM 3704 O O   . HOH E 4 .   ? -4.912  0.456   92.208  1.00 55.31  ? 365 HOH L O   1 
HETATM 3705 O O   . HOH E 4 .   ? -6.481  -11.206 85.924  1.00 62.14  ? 366 HOH L O   1 
HETATM 3706 O O   . HOH E 4 .   ? -17.924 9.456   101.928 1.00 47.70  ? 367 HOH L O   1 
HETATM 3707 O O   . HOH E 4 .   ? -7.523  -12.564 79.396  1.00 33.29  ? 368 HOH L O   1 
HETATM 3708 O O   . HOH E 4 .   ? 11.903  0.946   75.901  1.00 69.44  ? 369 HOH L O   1 
HETATM 3709 O O   . HOH E 4 .   ? 14.862  -0.030  78.730  1.00 69.31  ? 370 HOH L O   1 
HETATM 3710 O O   . HOH E 4 .   ? 11.029  7.233   76.405  1.00 59.67  ? 371 HOH L O   1 
HETATM 3711 O O   . HOH E 4 .   ? 7.823   -15.905 64.777  1.00 58.47  ? 372 HOH L O   1 
HETATM 3712 O O   . HOH E 4 .   ? -8.089  -9.822  91.152  1.00 63.31  ? 373 HOH L O   1 
HETATM 3713 O O   . HOH E 4 .   ? -3.262  -14.311 90.230  1.00 43.03  ? 374 HOH L O   1 
HETATM 3714 O O   . HOH E 4 .   ? -3.596  15.134  109.440 1.00 65.68  ? 375 HOH L O   1 
HETATM 3715 O O   . HOH E 4 .   ? -28.117 24.477  102.370 1.00 54.35  ? 376 HOH L O   1 
HETATM 3716 O O   . HOH E 4 .   ? -4.374  -15.733 83.955  1.00 42.32  ? 377 HOH L O   1 
HETATM 3717 O O   . HOH E 4 .   ? 8.570   4.971   87.144  1.00 51.88  ? 378 HOH L O   1 
HETATM 3718 O O   . HOH E 4 .   ? -6.514  6.640   83.520  1.00 58.40  ? 379 HOH L O   1 
HETATM 3719 O O   . HOH E 4 .   ? -8.779  5.973   97.030  1.00 56.82  ? 380 HOH L O   1 
HETATM 3720 O O   . HOH E 4 .   ? -11.871 0.091   114.477 1.00 76.44  ? 381 HOH L O   1 
HETATM 3721 O O   . HOH E 4 .   ? -4.868  10.344  102.919 1.00 50.19  ? 382 HOH L O   1 
HETATM 3722 O O   . HOH E 4 .   ? -31.452 17.940  123.879 1.00 62.52  ? 383 HOH L O   1 
HETATM 3723 O O   . HOH E 4 .   ? 17.086  -17.768 69.374  1.00 58.76  ? 384 HOH L O   1 
HETATM 3724 O O   . HOH E 4 .   ? 13.242  -11.311 76.866  1.00 38.65  ? 385 HOH L O   1 
HETATM 3725 O O   . HOH E 4 .   ? -15.386 20.350  118.683 1.00 64.88  ? 386 HOH L O   1 
HETATM 3726 O O   . HOH E 4 .   ? -6.537  7.368   97.435  1.00 65.43  ? 387 HOH L O   1 
HETATM 3727 O O   . HOH E 4 .   ? -4.592  3.278   114.928 1.00 56.00  ? 388 HOH L O   1 
HETATM 3728 O O   . HOH E 4 .   ? -21.706 24.515  117.947 1.00 58.04  ? 389 HOH L O   1 
HETATM 3729 O O   . HOH E 4 .   ? 0.688   12.854  114.076 1.00 70.01  ? 390 HOH L O   1 
HETATM 3730 O O   . HOH E 4 .   ? -14.173 2.260   102.019 1.00 55.69  ? 391 HOH L O   1 
HETATM 3731 O O   . HOH E 4 .   ? 15.685  -1.780  80.541  1.00 49.65  ? 392 HOH L O   1 
HETATM 3732 O O   . HOH E 4 .   ? -21.379 5.360   116.412 1.00 67.60  ? 393 HOH L O   1 
HETATM 3733 O O   . HOH E 4 .   ? -38.476 13.397  109.925 1.00 69.07  ? 394 HOH L O   1 
HETATM 3734 O O   . HOH E 4 .   ? -7.727  17.684  114.211 1.00 61.83  ? 395 HOH L O   1 
HETATM 3735 O O   . HOH E 4 .   ? -2.498  0.456   107.705 1.00 54.64  ? 396 HOH L O   1 
HETATM 3736 O O   . HOH E 4 .   ? -9.402  -20.723 79.692  1.00 72.02  ? 397 HOH L O   1 
HETATM 3737 O O   . HOH E 4 .   ? 9.837   -10.335 84.958  1.00 44.03  ? 398 HOH L O   1 
HETATM 3738 O O   . HOH E 4 .   ? 8.982   -17.393 62.921  1.00 68.92  ? 399 HOH L O   1 
HETATM 3739 O O   . HOH E 4 .   ? -6.793  7.383   120.507 1.00 67.47  ? 400 HOH L O   1 
HETATM 3740 O O   . HOH E 4 .   ? 14.401  6.747   88.937  1.00 72.67  ? 401 HOH L O   1 
HETATM 3741 O O   . HOH E 4 .   ? -23.859 1.674   111.762 1.00 67.44  ? 402 HOH L O   1 
HETATM 3742 O O   . HOH E 4 .   ? 8.995   7.792   99.283  1.00 69.46  ? 403 HOH L O   1 
HETATM 3743 O O   . HOH E 4 .   ? -1.262  -16.904 69.277  1.00 42.66  ? 404 HOH L O   1 
HETATM 3744 O O   . HOH E 4 .   ? 9.420   -8.773  98.894  1.00 71.40  ? 405 HOH L O   1 
HETATM 3745 O O   . HOH E 4 .   ? 11.155  -22.594 82.918  1.00 61.56  ? 406 HOH L O   1 
HETATM 3746 O O   . HOH E 4 .   ? -25.079 23.800  108.297 1.00 67.36  ? 407 HOH L O   1 
HETATM 3747 O O   . HOH E 4 .   ? -31.103 13.322  101.942 1.00 51.69  ? 408 HOH L O   1 
HETATM 3748 O O   . HOH E 4 .   ? 14.412  -4.929  101.912 1.00 65.30  ? 409 HOH L O   1 
HETATM 3749 O O   . HOH E 4 .   ? 5.626   5.128   114.336 1.00 63.09  ? 410 HOH L O   1 
HETATM 3750 O O   . HOH E 4 .   ? 11.368  -21.988 73.507  1.00 61.98  ? 411 HOH L O   1 
HETATM 3751 O O   . HOH E 4 .   ? -6.318  17.708  107.360 1.00 73.68  ? 412 HOH L O   1 
HETATM 3752 O O   . HOH E 4 .   ? 5.804   8.331   89.663  1.00 74.51  ? 413 HOH L O   1 
HETATM 3753 O O   . HOH E 4 .   ? -26.086 2.168   108.730 1.00 64.75  ? 414 HOH L O   1 
HETATM 3754 O O   . HOH E 4 .   ? -26.560 4.875   107.993 1.00 59.89  ? 415 HOH L O   1 
HETATM 3755 O O   . HOH E 4 .   ? -0.433  -26.161 80.869  1.00 65.84  ? 416 HOH L O   1 
HETATM 3756 O O   . HOH E 4 .   ? 16.249  -8.065  68.629  1.00 73.28  ? 417 HOH L O   1 
HETATM 3757 O O   . HOH E 4 .   ? -6.742  -23.085 80.648  1.00 68.56  ? 418 HOH L O   1 
HETATM 3758 O O   . HOH E 4 .   ? -25.614 24.027  112.593 1.00 74.57  ? 419 HOH L O   1 
HETATM 3759 O O   . HOH E 4 .   ? 13.296  -7.778  97.616  1.00 64.72  ? 420 HOH L O   1 
HETATM 3760 O O   . HOH E 4 .   ? 12.033  -22.902 64.147  1.00 64.38  ? 421 HOH L O   1 
HETATM 3761 O O   . HOH E 4 .   ? -7.425  6.106   122.942 1.00 65.82  ? 422 HOH L O   1 
HETATM 3762 O O   . HOH E 4 .   ? -10.935 -18.277 80.184  1.00 58.67  ? 423 HOH L O   1 
HETATM 3763 O O   . HOH E 4 .   ? -7.313  8.122   94.683  1.00 70.49  ? 424 HOH L O   1 
HETATM 3764 O O   . HOH E 4 .   ? -7.253  -20.587 81.570  1.00 62.26  ? 425 HOH L O   1 
HETATM 3765 O O   . HOH E 4 .   ? -2.658  -23.669 85.434  1.00 64.45  ? 426 HOH L O   1 
HETATM 3766 O O   . HOH E 4 .   ? 13.601  -23.248 84.187  1.00 54.32  ? 427 HOH L O   1 
HETATM 3767 O O   . HOH E 4 .   ? -1.898  16.251  113.866 1.00 77.31  ? 428 HOH L O   1 
HETATM 3768 O O   . HOH E 4 .   ? -6.590  -16.734 83.539  1.00 51.91  ? 429 HOH L O   1 
HETATM 3769 O O   . HOH E 4 .   ? -11.570 2.381   86.956  1.00 51.96  ? 430 HOH L O   1 
HETATM 3770 O O   . HOH E 4 .   ? -25.263 26.972  111.412 1.00 74.57  ? 431 HOH L O   1 
HETATM 3771 O O   . HOH E 4 .   ? 0.348   -19.029 69.310  1.00 60.53  ? 432 HOH L O   1 
HETATM 3772 O O   . HOH E 4 .   ? -0.023  15.127  115.258 1.00 64.88  ? 433 HOH L O   1 
HETATM 3773 O O   . HOH E 4 .   ? -7.558  1.069   117.129 1.00 70.64  ? 434 HOH L O   1 
# 
