data_4DII
# 
_entry.id   4DII 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.397 
_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   4DII         pdb_00004dii 10.2210/pdb4dii/pdb 
NDB   NA1567       ?            ?                   
RCSB  RCSB070371   ?            ?                   
WWPDB D_1000070371 ?            ?                   
# 
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 
1 'Structure model' 1 0 2012-07-18 
2 'Structure model' 1 1 2012-09-26 
3 'Structure model' 1 2 2013-02-27 
4 'Structure model' 1 3 2020-07-29 
5 'Structure model' 1 4 2023-09-13 
6 'Structure model' 1 5 2024-10-30 
# 
loop_
_pdbx_audit_revision_details.ordinal 
_pdbx_audit_revision_details.revision_ordinal 
_pdbx_audit_revision_details.data_content_type 
_pdbx_audit_revision_details.provider 
_pdbx_audit_revision_details.type 
_pdbx_audit_revision_details.description 
_pdbx_audit_revision_details.details 
1 1 'Structure model' repository 'Initial release' ?                          ? 
2 4 'Structure model' repository Remediation       'Carbohydrate remediation' ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1  2 'Structure model' 'Database references'    
2  3 'Structure model' Other                    
3  4 'Structure model' 'Data collection'        
4  4 'Structure model' 'Derived calculations'   
5  4 'Structure model' 'Structure summary'      
6  5 'Structure model' 'Data collection'        
7  5 'Structure model' 'Database references'    
8  5 'Structure model' 'Refinement description' 
9  5 'Structure model' 'Structure summary'      
10 6 'Structure model' 'Structure summary'      
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1  4 'Structure model' chem_comp                     
2  4 'Structure model' entity                        
3  4 'Structure model' pdbx_chem_comp_identifier     
4  4 'Structure model' pdbx_entity_nonpoly           
5  4 'Structure model' pdbx_struct_conn_angle        
6  4 'Structure model' struct_conn                   
7  4 'Structure model' struct_site                   
8  4 'Structure model' struct_site_gen               
9  5 'Structure model' chem_comp                     
10 5 'Structure model' chem_comp_atom                
11 5 'Structure model' chem_comp_bond                
12 5 'Structure model' database_2                    
13 5 'Structure model' pdbx_initial_refinement_model 
14 6 'Structure model' pdbx_entry_details            
15 6 'Structure model' pdbx_modification_feature     
# 
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  4 'Structure model' '_chem_comp.name'                              
2  4 'Structure model' '_chem_comp.type'                              
3  4 'Structure model' '_entity.pdbx_description'                     
4  4 'Structure model' '_pdbx_entity_nonpoly.name'                    
5  4 'Structure model' '_pdbx_struct_conn_angle.ptnr1_auth_comp_id'   
6  4 'Structure model' '_pdbx_struct_conn_angle.ptnr1_auth_seq_id'    
7  4 'Structure model' '_pdbx_struct_conn_angle.ptnr1_label_asym_id'  
8  4 'Structure model' '_pdbx_struct_conn_angle.ptnr1_label_comp_id'  
9  4 'Structure model' '_pdbx_struct_conn_angle.ptnr1_label_seq_id'   
10 4 'Structure model' '_pdbx_struct_conn_angle.ptnr3_auth_comp_id'   
11 4 'Structure model' '_pdbx_struct_conn_angle.ptnr3_auth_seq_id'    
12 4 'Structure model' '_pdbx_struct_conn_angle.ptnr3_label_asym_id'  
13 4 'Structure model' '_pdbx_struct_conn_angle.ptnr3_label_comp_id'  
14 4 'Structure model' '_pdbx_struct_conn_angle.ptnr3_label_seq_id'   
15 4 'Structure model' '_pdbx_struct_conn_angle.value'                
16 4 'Structure model' '_struct_conn.pdbx_dist_value'                 
17 4 'Structure model' '_struct_conn.pdbx_leaving_atom_flag'          
18 4 'Structure model' '_struct_conn.pdbx_ptnr1_PDB_ins_code'         
19 4 'Structure model' '_struct_conn.pdbx_role'                       
20 4 'Structure model' '_struct_conn.ptnr1_auth_asym_id'              
21 4 'Structure model' '_struct_conn.ptnr1_auth_comp_id'              
22 4 'Structure model' '_struct_conn.ptnr1_auth_seq_id'               
23 4 'Structure model' '_struct_conn.ptnr1_label_asym_id'             
24 4 'Structure model' '_struct_conn.ptnr1_label_atom_id'             
25 4 'Structure model' '_struct_conn.ptnr1_label_comp_id'             
26 4 'Structure model' '_struct_conn.ptnr1_label_seq_id'              
27 4 'Structure model' '_struct_conn.ptnr2_auth_asym_id'              
28 4 'Structure model' '_struct_conn.ptnr2_auth_comp_id'              
29 4 'Structure model' '_struct_conn.ptnr2_auth_seq_id'               
30 4 'Structure model' '_struct_conn.ptnr2_label_asym_id'             
31 4 'Structure model' '_struct_conn.ptnr2_label_atom_id'             
32 4 'Structure model' '_struct_conn.ptnr2_label_comp_id'             
33 4 'Structure model' '_struct_conn.ptnr2_label_seq_id'              
34 5 'Structure model' '_chem_comp.pdbx_synonyms'                     
35 5 'Structure model' '_database_2.pdbx_DOI'                         
36 5 'Structure model' '_database_2.pdbx_database_accession'          
37 6 'Structure model' '_pdbx_entry_details.has_protein_modification' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.entry_id                        4DII 
_pdbx_database_status.recvd_initial_deposition_date   2012-01-31 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.SG_entry                        ? 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
_pdbx_database_status.status_code_nmr_data            ? 
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.db_id          4DIH 
_pdbx_database_related.details        'The same complex in the presence of Na+ ion' 
_pdbx_database_related.content_type   unspecified 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Russo Krauss, I.' 1 
'Merlino, A.'      2 
'Mazzarella, L.'   3 
'Sica, F.'         4 
# 
loop_
_citation.id 
_citation.title 
_citation.journal_abbrev 
_citation.journal_volume 
_citation.page_first 
_citation.page_last 
_citation.year 
_citation.journal_id_ASTM 
_citation.country 
_citation.journal_id_ISSN 
_citation.journal_id_CSD 
_citation.book_publisher 
_citation.pdbx_database_id_PubMed 
_citation.pdbx_database_id_DOI 
primary 
;High-resolution structures of two complexes between thrombin and thrombin-binding aptamer shed light on the role of cations in the aptamer inhibitory activity.
;
'Nucleic Acids Res.'       40  8119  8128  2012 NARHAD UK 0305-1048 0389 ? 22669903 10.1093/nar/gks512        
1       'Thrombin-aptamer recognition: a revealed ambiguity.' 'Nucleic Acids Res.'       39  7858  7867  2011 NARHAD UK 0305-1048 
0389 ? 21715374 10.1093/nar/gkr522        
2       'The structure of alpha-thrombin inhibited by a 15-mer single-stranded DNA aptamer.' J.Biol.Chem.               268 17651 
17654 1993 JBCHA3 US 0021-9258 0071 ? 8102368  ?                         
3       'An ambiguous structure of a DNA 15-mer thrombin complex.' 'Acta Crystallogr.,Sect.D' 52  272   282   1996 ABCRE6 DK 
0907-4449 0766 ? 15299700 10.1107/S0907444995013977 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Russo Krauss, I.'  1  ? 
primary 'Merlino, A.'       2  ? 
primary 'Randazzo, A.'      3  ? 
primary 'Novellino, E.'     4  ? 
primary 'Mazzarella, L.'    5  ? 
primary 'Sica, F.'          6  ? 
1       'Russo Krauss, I.'  7  ? 
1       'Merlino, A.'       8  ? 
1       'Giancola, C.'      9  ? 
1       'Randazzo, A.'      10 ? 
1       'Mazzarella, L.'    11 ? 
1       'Sica, F.'          12 ? 
2       'Padmanabhan, K.'   13 ? 
2       'Padmanabhan, K.P.' 14 ? 
2       'Ferrara, J.D.'     15 ? 
2       'Sadler, J.E.'      16 ? 
2       'Tulinsky, A.'      17 ? 
3       'Padmanabhan, K.'   18 ? 
3       'Tulinsky, A.'      19 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1  polymer     nat Prothrombin                                                                                            4096.534 
1   3.4.21.5 ? 'Light chain (UNP Residues 328-363)' ? 
2  polymer     nat Prothrombin                                                                                            
29780.219 1   3.4.21.5 ? 'Heavy chain (UNP Residues 364-622)' ? 
3  polymer     syn 'Thrombin binding aptamer'                                                                             4743.051 
1   ?        ? ?                                    ? 
4  non-polymer syn 'ZINC ION'                                                                                             65.409 2 
?        ? ?                                    ? 
5  non-polymer syn 'D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide' 453.986 
1   ?        ? ?                                    ? 
6  non-polymer man 2-acetamido-2-deoxy-beta-D-glucopyranose                                                               221.208 
1   ?        ? ?                                    ? 
7  non-polymer syn 'SODIUM ION'                                                                                           22.990 1 
?        ? ?                                    ? 
8  non-polymer syn 'CHLORIDE ION'                                                                                         35.453 2 
?        ? ?                                    ? 
9  non-polymer syn 'POTASSIUM ION'                                                                                        39.098 1 
?        ? ?                                    ? 
10 water       nat water                                                                                                  18.015 
183 ?        ? ?                                    ? 
# 
loop_
_entity_name_com.entity_id 
_entity_name_com.name 
1 'Coagulation factor II, Thrombin light chain' 
2 'Coagulation factor II, Thrombin heavy chain' 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)'        no no TFGSGEADCGLRPLFEKKSLEDKTERELLESYIDGR TFGSGEADCGLRPLFEKKSLEDKTERELLESYIDGR L ? 
2 'polypeptide(L)'        no no 
;IVEGSDAEIGMSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTENDLLVRIGKHSRTRYERNIEKISM
LEKIYIHPRYNWRENLDRDIALMKLKKPVAFSDYIHPVCLPDRETAASLLQAGYKGRVTGWGNLKETWTANVGKGQPSVL
QVVNLPIVERPVCKDSTRIRITDNMFCAGYKPDEGKRGDACEGDSGGPFVMKSPFNNRWYQMGIVSWGEGCDRDGKYGFY
THVFRLKKWIQKVIDQFGE
;
;IVEGSDAEIGMSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTENDLLVRIGKHSRTRYERNIEKISM
LEKIYIHPRYNWRENLDRDIALMKLKKPVAFSDYIHPVCLPDRETAASLLQAGYKGRVTGWGNLKETWTANVGKGQPSVL
QVVNLPIVERPVCKDSTRIRITDNMFCAGYKPDEGKRGDACEGDSGGPFVMKSPFNNRWYQMGIVSWGEGCDRDGKYGFY
THVFRLKKWIQKVIDQFGE
;
H ? 
3 polydeoxyribonucleotide no no '(DG)(DG)(DT)(DT)(DG)(DG)(DT)(DG)(DT)(DG)(DG)(DT)(DT)(DG)(DG)' GGTTGGTGTGGTTGG D ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
4  'ZINC ION'                                                                                             ZN  
5  'D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide' 0G6 
6  2-acetamido-2-deoxy-beta-D-glucopyranose                                                               NAG 
7  'SODIUM ION'                                                                                           NA  
8  'CHLORIDE ION'                                                                                         CL  
9  'POTASSIUM ION'                                                                                        K   
10 water                                                                                                  HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   THR n 
1 2   PHE n 
1 3   GLY n 
1 4   SER n 
1 5   GLY n 
1 6   GLU n 
1 7   ALA n 
1 8   ASP n 
1 9   CYS n 
1 10  GLY n 
1 11  LEU n 
1 12  ARG n 
1 13  PRO n 
1 14  LEU n 
1 15  PHE n 
1 16  GLU n 
1 17  LYS n 
1 18  LYS n 
1 19  SER n 
1 20  LEU n 
1 21  GLU n 
1 22  ASP n 
1 23  LYS n 
1 24  THR n 
1 25  GLU n 
1 26  ARG n 
1 27  GLU n 
1 28  LEU n 
1 29  LEU n 
1 30  GLU n 
1 31  SER n 
1 32  TYR n 
1 33  ILE n 
1 34  ASP n 
1 35  GLY n 
1 36  ARG n 
2 1   ILE n 
2 2   VAL n 
2 3   GLU n 
2 4   GLY n 
2 5   SER n 
2 6   ASP n 
2 7   ALA n 
2 8   GLU n 
2 9   ILE n 
2 10  GLY n 
2 11  MET n 
2 12  SER n 
2 13  PRO n 
2 14  TRP n 
2 15  GLN n 
2 16  VAL n 
2 17  MET n 
2 18  LEU n 
2 19  PHE n 
2 20  ARG n 
2 21  LYS n 
2 22  SER n 
2 23  PRO n 
2 24  GLN n 
2 25  GLU n 
2 26  LEU n 
2 27  LEU n 
2 28  CYS n 
2 29  GLY n 
2 30  ALA n 
2 31  SER n 
2 32  LEU n 
2 33  ILE n 
2 34  SER n 
2 35  ASP n 
2 36  ARG n 
2 37  TRP n 
2 38  VAL n 
2 39  LEU n 
2 40  THR n 
2 41  ALA n 
2 42  ALA n 
2 43  HIS n 
2 44  CYS n 
2 45  LEU n 
2 46  LEU n 
2 47  TYR n 
2 48  PRO n 
2 49  PRO n 
2 50  TRP n 
2 51  ASP n 
2 52  LYS n 
2 53  ASN n 
2 54  PHE n 
2 55  THR n 
2 56  GLU n 
2 57  ASN n 
2 58  ASP n 
2 59  LEU n 
2 60  LEU n 
2 61  VAL n 
2 62  ARG n 
2 63  ILE n 
2 64  GLY n 
2 65  LYS n 
2 66  HIS n 
2 67  SER n 
2 68  ARG n 
2 69  THR n 
2 70  ARG n 
2 71  TYR n 
2 72  GLU n 
2 73  ARG n 
2 74  ASN n 
2 75  ILE n 
2 76  GLU n 
2 77  LYS n 
2 78  ILE n 
2 79  SER n 
2 80  MET n 
2 81  LEU n 
2 82  GLU n 
2 83  LYS n 
2 84  ILE n 
2 85  TYR n 
2 86  ILE n 
2 87  HIS n 
2 88  PRO n 
2 89  ARG n 
2 90  TYR n 
2 91  ASN n 
2 92  TRP n 
2 93  ARG n 
2 94  GLU n 
2 95  ASN n 
2 96  LEU n 
2 97  ASP n 
2 98  ARG n 
2 99  ASP n 
2 100 ILE n 
2 101 ALA n 
2 102 LEU n 
2 103 MET n 
2 104 LYS n 
2 105 LEU n 
2 106 LYS n 
2 107 LYS n 
2 108 PRO n 
2 109 VAL n 
2 110 ALA n 
2 111 PHE n 
2 112 SER n 
2 113 ASP n 
2 114 TYR n 
2 115 ILE n 
2 116 HIS n 
2 117 PRO n 
2 118 VAL n 
2 119 CYS n 
2 120 LEU n 
2 121 PRO n 
2 122 ASP n 
2 123 ARG n 
2 124 GLU n 
2 125 THR n 
2 126 ALA n 
2 127 ALA n 
2 128 SER n 
2 129 LEU n 
2 130 LEU n 
2 131 GLN n 
2 132 ALA n 
2 133 GLY n 
2 134 TYR n 
2 135 LYS n 
2 136 GLY n 
2 137 ARG n 
2 138 VAL n 
2 139 THR n 
2 140 GLY n 
2 141 TRP n 
2 142 GLY n 
2 143 ASN n 
2 144 LEU n 
2 145 LYS n 
2 146 GLU n 
2 147 THR n 
2 148 TRP n 
2 149 THR n 
2 150 ALA n 
2 151 ASN n 
2 152 VAL n 
2 153 GLY n 
2 154 LYS n 
2 155 GLY n 
2 156 GLN n 
2 157 PRO n 
2 158 SER n 
2 159 VAL n 
2 160 LEU n 
2 161 GLN n 
2 162 VAL n 
2 163 VAL n 
2 164 ASN n 
2 165 LEU n 
2 166 PRO n 
2 167 ILE n 
2 168 VAL n 
2 169 GLU n 
2 170 ARG n 
2 171 PRO n 
2 172 VAL n 
2 173 CYS n 
2 174 LYS n 
2 175 ASP n 
2 176 SER n 
2 177 THR n 
2 178 ARG n 
2 179 ILE n 
2 180 ARG n 
2 181 ILE n 
2 182 THR n 
2 183 ASP n 
2 184 ASN n 
2 185 MET n 
2 186 PHE n 
2 187 CYS n 
2 188 ALA n 
2 189 GLY n 
2 190 TYR n 
2 191 LYS n 
2 192 PRO n 
2 193 ASP n 
2 194 GLU n 
2 195 GLY n 
2 196 LYS n 
2 197 ARG n 
2 198 GLY n 
2 199 ASP n 
2 200 ALA n 
2 201 CYS n 
2 202 GLU n 
2 203 GLY n 
2 204 ASP n 
2 205 SER n 
2 206 GLY n 
2 207 GLY n 
2 208 PRO n 
2 209 PHE n 
2 210 VAL n 
2 211 MET n 
2 212 LYS n 
2 213 SER n 
2 214 PRO n 
2 215 PHE n 
2 216 ASN n 
2 217 ASN n 
2 218 ARG n 
2 219 TRP n 
2 220 TYR n 
2 221 GLN n 
2 222 MET n 
2 223 GLY n 
2 224 ILE n 
2 225 VAL n 
2 226 SER n 
2 227 TRP n 
2 228 GLY n 
2 229 GLU n 
2 230 GLY n 
2 231 CYS n 
2 232 ASP n 
2 233 ARG n 
2 234 ASP n 
2 235 GLY n 
2 236 LYS n 
2 237 TYR n 
2 238 GLY n 
2 239 PHE n 
2 240 TYR n 
2 241 THR n 
2 242 HIS n 
2 243 VAL n 
2 244 PHE n 
2 245 ARG n 
2 246 LEU n 
2 247 LYS n 
2 248 LYS n 
2 249 TRP n 
2 250 ILE n 
2 251 GLN n 
2 252 LYS n 
2 253 VAL n 
2 254 ILE n 
2 255 ASP n 
2 256 GLN n 
2 257 PHE n 
2 258 GLY n 
2 259 GLU n 
3 1   DG  n 
3 2   DG  n 
3 3   DT  n 
3 4   DT  n 
3 5   DG  n 
3 6   DG  n 
3 7   DT  n 
3 8   DG  n 
3 9   DT  n 
3 10  DG  n 
3 11  DG  n 
3 12  DT  n 
3 13  DT  n 
3 14  DG  n 
3 15  DG  n 
# 
loop_
_entity_src_nat.entity_id 
_entity_src_nat.pdbx_src_id 
_entity_src_nat.pdbx_alt_source_flag 
_entity_src_nat.pdbx_beg_seq_num 
_entity_src_nat.pdbx_end_seq_num 
_entity_src_nat.common_name 
_entity_src_nat.pdbx_organism_scientific 
_entity_src_nat.pdbx_ncbi_taxonomy_id 
_entity_src_nat.genus 
_entity_src_nat.species 
_entity_src_nat.strain 
_entity_src_nat.tissue 
_entity_src_nat.tissue_fraction 
_entity_src_nat.pdbx_secretion 
_entity_src_nat.pdbx_fragment 
_entity_src_nat.pdbx_variant 
_entity_src_nat.pdbx_cell_line 
_entity_src_nat.pdbx_atcc 
_entity_src_nat.pdbx_cellular_location 
_entity_src_nat.pdbx_organ 
_entity_src_nat.pdbx_organelle 
_entity_src_nat.pdbx_cell 
_entity_src_nat.pdbx_plasmid_name 
_entity_src_nat.pdbx_plasmid_details 
_entity_src_nat.details 
1 1 sample ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
_pdbx_entity_src_syn.entity_id              3 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       ? 
_pdbx_entity_src_syn.pdbx_end_seq_num       ? 
_pdbx_entity_src_syn.organism_scientific    'Synthetic DNA' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       32630 
_pdbx_entity_src_syn.details                ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
0G6 peptide-like                 . 
'D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide' PPACK 'C21 H34 Cl N6 O3 1' 
453.986 
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 
CL  non-polymer                  . 'CHLORIDE ION' ? 'Cl -1'              35.453  
CYS 'L-peptide linking'          y CYSTEINE ? 'C3 H7 N O2 S'       121.158 
DG  'DNA linking'                y "2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P'    347.221 
DT  'DNA linking'                y "THYMIDINE-5'-MONOPHOSPHATE" ? 'C10 H15 N2 O8 P'    322.208 
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 
K   non-polymer                  . 'POTASSIUM ION' ? 'K 1'                39.098  
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 
NA  non-polymer                  . 'SODIUM ION' ? 'Na 1'               22.990  
NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose 
;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE
;
'C8 H15 N O6'        221.208 
PHE 'L-peptide linking'          y PHENYLALANINE ? 'C9 H11 N O2'        165.189 
PRO 'L-peptide linking'          y PROLINE ? 'C5 H9 N O2'         115.130 
SER 'L-peptide linking'          y SERINE ? 'C3 H7 N O3'         105.093 
THR 'L-peptide linking'          y THREONINE ? 'C4 H9 N O3'         119.119 
TRP 'L-peptide linking'          y TRYPTOPHAN ? 'C11 H12 N2 O2'      204.225 
TYR 'L-peptide linking'          y TYROSINE ? 'C9 H11 N O3'        181.189 
VAL 'L-peptide linking'          y VALINE ? 'C5 H11 N O2'        117.146 
ZN  non-polymer                  . 'ZINC ION' ? 'Zn 2'               65.409  
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DGlcpNAcb                      
NAG 'COMMON NAME'                         GMML     1.0 N-acetyl-b-D-glucopyranosamine 
NAG 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-GlcpNAc                    
NAG 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 GlcNAc                         
# 
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   THR 1   -5  ?   ?   ?   L . n 
A 1 2   PHE 2   -4  ?   ?   ?   L . n 
A 1 3   GLY 3   -3  ?   ?   ?   L . n 
A 1 4   SER 4   -2  ?   ?   ?   L . n 
A 1 5   GLY 5   -1  ?   ?   ?   L . n 
A 1 6   GLU 6   0   ?   ?   ?   L . n 
A 1 7   ALA 7   1   1   ALA ALA L B n 
A 1 8   ASP 8   1   1   ASP ASP L A n 
A 1 9   CYS 9   1   1   CYS CYS L . n 
A 1 10  GLY 10  2   2   GLY GLY L . n 
A 1 11  LEU 11  3   3   LEU LEU L . n 
A 1 12  ARG 12  4   4   ARG ARG L . n 
A 1 13  PRO 13  5   5   PRO PRO L . n 
A 1 14  LEU 14  6   6   LEU LEU L . n 
A 1 15  PHE 15  7   7   PHE PHE L . n 
A 1 16  GLU 16  8   8   GLU GLU L . n 
A 1 17  LYS 17  9   9   LYS LYS L . n 
A 1 18  LYS 18  10  10  LYS LYS L . n 
A 1 19  SER 19  11  11  SER SER L . n 
A 1 20  LEU 20  12  12  LEU LEU L . n 
A 1 21  GLU 21  13  13  GLU GLU L . n 
A 1 22  ASP 22  14  14  ASP ASP L . n 
A 1 23  LYS 23  14  14  LYS LYS L A n 
A 1 24  THR 24  14  14  THR THR L B n 
A 1 25  GLU 25  14  14  GLU GLU L C n 
A 1 26  ARG 26  14  14  ARG ARG L D n 
A 1 27  GLU 27  14  14  GLU GLU L E n 
A 1 28  LEU 28  14  14  LEU LEU L F n 
A 1 29  LEU 29  14  14  LEU LEU L G n 
A 1 30  GLU 30  14  14  GLU GLU L H n 
A 1 31  SER 31  14  14  SER SER L I n 
A 1 32  TYR 32  14  14  TYR TYR L J n 
A 1 33  ILE 33  14  14  ILE ILE L K n 
A 1 34  ASP 34  15  ?   ?   ?   L . n 
A 1 35  GLY 35  16  ?   ?   ?   L . n 
A 1 36  ARG 36  17  ?   ?   ?   L . n 
B 2 1   ILE 1   16  16  ILE ILE H . n 
B 2 2   VAL 2   17  17  VAL VAL H . n 
B 2 3   GLU 3   18  18  GLU GLU H . n 
B 2 4   GLY 4   19  19  GLY GLY H . n 
B 2 5   SER 5   20  20  SER SER H . n 
B 2 6   ASP 6   21  21  ASP ASP H . n 
B 2 7   ALA 7   22  22  ALA ALA H . n 
B 2 8   GLU 8   23  23  GLU GLU H . n 
B 2 9   ILE 9   24  24  ILE ILE H . n 
B 2 10  GLY 10  25  25  GLY GLY H . n 
B 2 11  MET 11  26  26  MET MET H . n 
B 2 12  SER 12  27  27  SER SER H . n 
B 2 13  PRO 13  28  28  PRO PRO H . n 
B 2 14  TRP 14  29  29  TRP TRP H . n 
B 2 15  GLN 15  30  30  GLN GLN H . n 
B 2 16  VAL 16  31  31  VAL VAL H . n 
B 2 17  MET 17  32  32  MET MET H . n 
B 2 18  LEU 18  33  33  LEU LEU H . n 
B 2 19  PHE 19  34  34  PHE PHE H . n 
B 2 20  ARG 20  35  35  ARG ARG H . n 
B 2 21  LYS 21  36  36  LYS LYS H . n 
B 2 22  SER 22  36  36  SER SER H A n 
B 2 23  PRO 23  37  37  PRO PRO H . n 
B 2 24  GLN 24  38  38  GLN GLN H . n 
B 2 25  GLU 25  39  39  GLU GLU H . n 
B 2 26  LEU 26  40  40  LEU LEU H . n 
B 2 27  LEU 27  41  41  LEU LEU H . n 
B 2 28  CYS 28  42  42  CYS CYS H . n 
B 2 29  GLY 29  43  43  GLY GLY H . n 
B 2 30  ALA 30  44  44  ALA ALA H . n 
B 2 31  SER 31  45  45  SER SER H . n 
B 2 32  LEU 32  46  46  LEU LEU H . n 
B 2 33  ILE 33  47  47  ILE ILE H . n 
B 2 34  SER 34  48  48  SER SER H . n 
B 2 35  ASP 35  49  49  ASP ASP H . n 
B 2 36  ARG 36  50  50  ARG ARG H . n 
B 2 37  TRP 37  51  51  TRP TRP H . n 
B 2 38  VAL 38  52  52  VAL VAL H . n 
B 2 39  LEU 39  53  53  LEU LEU H . n 
B 2 40  THR 40  54  54  THR THR H . n 
B 2 41  ALA 41  55  55  ALA ALA H . n 
B 2 42  ALA 42  56  56  ALA ALA H . n 
B 2 43  HIS 43  57  57  HIS HIS H . n 
B 2 44  CYS 44  58  58  CYS CYS H . n 
B 2 45  LEU 45  59  59  LEU LEU H . n 
B 2 46  LEU 46  60  60  LEU LEU H . n 
B 2 47  TYR 47  60  60  TYR TYR H A n 
B 2 48  PRO 48  60  60  PRO PRO H B n 
B 2 49  PRO 49  60  60  PRO PRO H C n 
B 2 50  TRP 50  60  60  TRP TRP H D n 
B 2 51  ASP 51  60  60  ASP ASP H E n 
B 2 52  LYS 52  60  60  LYS LYS H F n 
B 2 53  ASN 53  60  60  ASN ASN H G n 
B 2 54  PHE 54  60  60  PHE PHE H H n 
B 2 55  THR 55  60  60  THR THR H I n 
B 2 56  GLU 56  61  61  GLU GLU H . n 
B 2 57  ASN 57  62  62  ASN ASN H . n 
B 2 58  ASP 58  63  63  ASP ASP H . n 
B 2 59  LEU 59  64  64  LEU LEU H . n 
B 2 60  LEU 60  65  65  LEU LEU H . n 
B 2 61  VAL 61  66  66  VAL VAL H . n 
B 2 62  ARG 62  67  67  ARG ARG H . n 
B 2 63  ILE 63  68  68  ILE ILE H . n 
B 2 64  GLY 64  69  69  GLY GLY H . n 
B 2 65  LYS 65  70  70  LYS LYS H . n 
B 2 66  HIS 66  71  71  HIS HIS H . n 
B 2 67  SER 67  72  72  SER SER H . n 
B 2 68  ARG 68  73  73  ARG ARG H . n 
B 2 69  THR 69  74  74  THR THR H . n 
B 2 70  ARG 70  75  75  ARG ARG H . n 
B 2 71  TYR 71  76  76  TYR TYR H . n 
B 2 72  GLU 72  77  77  GLU GLU H . n 
B 2 73  ARG 73  77  77  ARG ARG H A n 
B 2 74  ASN 74  78  78  ASN ASN H . n 
B 2 75  ILE 75  79  79  ILE ILE H . n 
B 2 76  GLU 76  80  80  GLU GLU H . n 
B 2 77  LYS 77  81  81  LYS LYS H . n 
B 2 78  ILE 78  82  82  ILE ILE H . n 
B 2 79  SER 79  83  83  SER SER H . n 
B 2 80  MET 80  84  84  MET MET H . n 
B 2 81  LEU 81  85  85  LEU LEU H . n 
B 2 82  GLU 82  86  86  GLU GLU H . n 
B 2 83  LYS 83  87  87  LYS LYS H . n 
B 2 84  ILE 84  88  88  ILE ILE H . n 
B 2 85  TYR 85  89  89  TYR TYR H . n 
B 2 86  ILE 86  90  90  ILE ILE H . n 
B 2 87  HIS 87  91  91  HIS HIS H . n 
B 2 88  PRO 88  92  92  PRO PRO H . n 
B 2 89  ARG 89  93  93  ARG ARG H . n 
B 2 90  TYR 90  94  94  TYR TYR H . n 
B 2 91  ASN 91  95  95  ASN ASN H . n 
B 2 92  TRP 92  96  96  TRP TRP H . n 
B 2 93  ARG 93  97  97  ARG ARG H . n 
B 2 94  GLU 94  97  97  GLU GLU H A n 
B 2 95  ASN 95  98  98  ASN ASN H . n 
B 2 96  LEU 96  99  99  LEU LEU H . n 
B 2 97  ASP 97  100 100 ASP ASP H . n 
B 2 98  ARG 98  101 101 ARG ARG H . n 
B 2 99  ASP 99  102 102 ASP ASP H . n 
B 2 100 ILE 100 103 103 ILE ILE H . n 
B 2 101 ALA 101 104 104 ALA ALA H . n 
B 2 102 LEU 102 105 105 LEU LEU H . n 
B 2 103 MET 103 106 106 MET MET H . n 
B 2 104 LYS 104 107 107 LYS LYS H . n 
B 2 105 LEU 105 108 108 LEU LEU H . n 
B 2 106 LYS 106 109 109 LYS LYS H . n 
B 2 107 LYS 107 110 110 LYS LYS H . n 
B 2 108 PRO 108 111 111 PRO PRO H . n 
B 2 109 VAL 109 112 112 VAL VAL H . n 
B 2 110 ALA 110 113 113 ALA ALA H . n 
B 2 111 PHE 111 114 114 PHE PHE H . n 
B 2 112 SER 112 115 115 SER SER H . n 
B 2 113 ASP 113 116 116 ASP ASP H . n 
B 2 114 TYR 114 117 117 TYR TYR H . n 
B 2 115 ILE 115 118 118 ILE ILE H . n 
B 2 116 HIS 116 119 119 HIS HIS H . n 
B 2 117 PRO 117 120 120 PRO PRO H . n 
B 2 118 VAL 118 121 121 VAL VAL H . n 
B 2 119 CYS 119 122 122 CYS CYS H . n 
B 2 120 LEU 120 123 123 LEU LEU H . n 
B 2 121 PRO 121 124 124 PRO PRO H . n 
B 2 122 ASP 122 125 125 ASP ASP H . n 
B 2 123 ARG 123 126 126 ARG ARG H . n 
B 2 124 GLU 124 127 127 GLU GLU H . n 
B 2 125 THR 125 128 128 THR THR H . n 
B 2 126 ALA 126 129 129 ALA ALA H . n 
B 2 127 ALA 127 129 129 ALA ALA H A n 
B 2 128 SER 128 129 129 SER SER H B n 
B 2 129 LEU 129 129 129 LEU LEU H C n 
B 2 130 LEU 130 130 130 LEU LEU H . n 
B 2 131 GLN 131 131 131 GLN GLN H . n 
B 2 132 ALA 132 132 132 ALA ALA H . n 
B 2 133 GLY 133 133 133 GLY GLY H . n 
B 2 134 TYR 134 134 134 TYR TYR H . n 
B 2 135 LYS 135 135 135 LYS LYS H . n 
B 2 136 GLY 136 136 136 GLY GLY H . n 
B 2 137 ARG 137 137 137 ARG ARG H . n 
B 2 138 VAL 138 138 138 VAL VAL H . n 
B 2 139 THR 139 139 139 THR THR H . n 
B 2 140 GLY 140 140 140 GLY GLY H . n 
B 2 141 TRP 141 141 141 TRP TRP H . n 
B 2 142 GLY 142 142 142 GLY GLY H . n 
B 2 143 ASN 143 143 143 ASN ASN H . n 
B 2 144 LEU 144 144 144 LEU LEU H . n 
B 2 145 LYS 145 145 145 LYS LYS H . n 
B 2 146 GLU 146 146 146 GLU GLU H . n 
B 2 147 THR 147 147 147 THR THR H . n 
B 2 148 TRP 148 147 ?   ?   ?   H A n 
B 2 149 THR 149 147 ?   ?   ?   H B n 
B 2 150 ALA 150 147 ?   ?   ?   H C n 
B 2 151 ASN 151 147 ?   ?   ?   H D n 
B 2 152 VAL 152 147 ?   ?   ?   H E n 
B 2 153 GLY 153 147 ?   ?   ?   H F n 
B 2 154 LYS 154 147 ?   ?   ?   H G n 
B 2 155 GLY 155 147 ?   ?   ?   H H n 
B 2 156 GLN 156 151 151 GLN GLN H . n 
B 2 157 PRO 157 152 152 PRO PRO H . n 
B 2 158 SER 158 153 153 SER SER H . n 
B 2 159 VAL 159 154 154 VAL VAL H . n 
B 2 160 LEU 160 155 155 LEU LEU H . n 
B 2 161 GLN 161 156 156 GLN GLN H . n 
B 2 162 VAL 162 157 157 VAL VAL H . n 
B 2 163 VAL 163 158 158 VAL VAL H . n 
B 2 164 ASN 164 159 159 ASN ASN H . n 
B 2 165 LEU 165 160 160 LEU LEU H . n 
B 2 166 PRO 166 161 161 PRO PRO H . n 
B 2 167 ILE 167 162 162 ILE ILE H . n 
B 2 168 VAL 168 163 163 VAL VAL H . n 
B 2 169 GLU 169 164 164 GLU GLU H . n 
B 2 170 ARG 170 165 165 ARG ARG H . n 
B 2 171 PRO 171 166 166 PRO PRO H . n 
B 2 172 VAL 172 167 167 VAL VAL H . n 
B 2 173 CYS 173 168 168 CYS CYS H . n 
B 2 174 LYS 174 169 169 LYS LYS H . n 
B 2 175 ASP 175 170 170 ASP ASP H . n 
B 2 176 SER 176 171 171 SER SER H . n 
B 2 177 THR 177 172 172 THR THR H . n 
B 2 178 ARG 178 173 173 ARG ARG H . n 
B 2 179 ILE 179 174 174 ILE ILE H . n 
B 2 180 ARG 180 175 175 ARG ARG H . n 
B 2 181 ILE 181 176 176 ILE ILE H . n 
B 2 182 THR 182 177 177 THR THR H . n 
B 2 183 ASP 183 178 178 ASP ASP H . n 
B 2 184 ASN 184 179 179 ASN ASN H . n 
B 2 185 MET 185 180 180 MET MET H . n 
B 2 186 PHE 186 181 181 PHE PHE H . n 
B 2 187 CYS 187 182 182 CYS CYS H . n 
B 2 188 ALA 188 183 183 ALA ALA H . n 
B 2 189 GLY 189 184 184 GLY GLY H . n 
B 2 190 TYR 190 184 184 TYR TYR H A n 
B 2 191 LYS 191 185 185 LYS LYS H . n 
B 2 192 PRO 192 186 186 PRO PRO H . n 
B 2 193 ASP 193 186 186 ASP ASP H A n 
B 2 194 GLU 194 186 186 GLU GLU H B n 
B 2 195 GLY 195 186 186 GLY GLY H C n 
B 2 196 LYS 196 186 186 LYS LYS H D n 
B 2 197 ARG 197 187 187 ARG ARG H . n 
B 2 198 GLY 198 188 188 GLY GLY H . n 
B 2 199 ASP 199 189 189 ASP ASP H . n 
B 2 200 ALA 200 190 190 ALA ALA H . n 
B 2 201 CYS 201 191 191 CYS CYS H . n 
B 2 202 GLU 202 192 192 GLU GLU H . n 
B 2 203 GLY 203 193 193 GLY GLY H . n 
B 2 204 ASP 204 194 194 ASP ASP H . n 
B 2 205 SER 205 195 195 SER SER H . n 
B 2 206 GLY 206 196 196 GLY GLY H . n 
B 2 207 GLY 207 197 197 GLY GLY H . n 
B 2 208 PRO 208 198 198 PRO PRO H . n 
B 2 209 PHE 209 199 199 PHE PHE H . n 
B 2 210 VAL 210 200 200 VAL VAL H . n 
B 2 211 MET 211 201 201 MET MET H . n 
B 2 212 LYS 212 202 202 LYS LYS H . n 
B 2 213 SER 213 203 203 SER SER H . n 
B 2 214 PRO 214 204 204 PRO PRO H . n 
B 2 215 PHE 215 204 204 PHE PHE H A n 
B 2 216 ASN 216 204 204 ASN ASN H B n 
B 2 217 ASN 217 205 205 ASN ASN H . n 
B 2 218 ARG 218 206 206 ARG ARG H . n 
B 2 219 TRP 219 207 207 TRP TRP H . n 
B 2 220 TYR 220 208 208 TYR TYR H . n 
B 2 221 GLN 221 209 209 GLN GLN H . n 
B 2 222 MET 222 210 210 MET MET H . n 
B 2 223 GLY 223 211 211 GLY GLY H . n 
B 2 224 ILE 224 212 212 ILE ILE H . n 
B 2 225 VAL 225 213 213 VAL VAL H . n 
B 2 226 SER 226 214 214 SER SER H . n 
B 2 227 TRP 227 215 215 TRP TRP H . n 
B 2 228 GLY 228 216 216 GLY GLY H . n 
B 2 229 GLU 229 217 217 GLU GLU H . n 
B 2 230 GLY 230 219 219 GLY GLY H . n 
B 2 231 CYS 231 220 220 CYS CYS H . n 
B 2 232 ASP 232 221 221 ASP ASP H A n 
B 2 233 ARG 233 221 221 ARG ARG H . n 
B 2 234 ASP 234 222 222 ASP ASP H . n 
B 2 235 GLY 235 223 223 GLY GLY H . n 
B 2 236 LYS 236 224 224 LYS LYS H . n 
B 2 237 TYR 237 225 225 TYR TYR H . n 
B 2 238 GLY 238 226 226 GLY GLY H . n 
B 2 239 PHE 239 227 227 PHE PHE H . n 
B 2 240 TYR 240 228 228 TYR TYR H . n 
B 2 241 THR 241 229 229 THR THR H . n 
B 2 242 HIS 242 230 230 HIS HIS H . n 
B 2 243 VAL 243 231 231 VAL VAL H . n 
B 2 244 PHE 244 232 232 PHE PHE H . n 
B 2 245 ARG 245 233 233 ARG ARG H . n 
B 2 246 LEU 246 234 234 LEU LEU H . n 
B 2 247 LYS 247 235 235 LYS LYS H . n 
B 2 248 LYS 248 236 236 LYS LYS H . n 
B 2 249 TRP 249 237 237 TRP TRP H . n 
B 2 250 ILE 250 238 238 ILE ILE H . n 
B 2 251 GLN 251 239 239 GLN GLN H . n 
B 2 252 LYS 252 240 240 LYS LYS H . n 
B 2 253 VAL 253 241 241 VAL VAL H . n 
B 2 254 ILE 254 242 242 ILE ILE H . n 
B 2 255 ASP 255 243 243 ASP ASP H . n 
B 2 256 GLN 256 244 244 GLN GLN H . n 
B 2 257 PHE 257 245 245 PHE PHE H . n 
B 2 258 GLY 258 246 246 GLY GLY H . n 
B 2 259 GLU 259 247 ?   ?   ?   H . n 
C 3 1   DG  1   1   1   DG  DG  D . n 
C 3 2   DG  2   2   2   DG  DG  D . n 
C 3 3   DT  3   3   3   DT  DT  D . n 
C 3 4   DT  4   4   4   DT  DT  D . n 
C 3 5   DG  5   5   5   DG  DG  D . n 
C 3 6   DG  6   6   6   DG  DG  D . n 
C 3 7   DT  7   7   7   DT  DT  D . n 
C 3 8   DG  8   8   8   DG  DG  D . n 
C 3 9   DT  9   9   9   DT  DT  D . n 
C 3 10  DG  10  10  10  DG  DG  D . n 
C 3 11  DG  11  11  11  DG  DG  D . n 
C 3 12  DT  12  12  12  DT  DT  D . n 
C 3 13  DT  13  13  13  DT  DT  D . n 
C 3 14  DG  14  14  14  DG  DG  D . n 
C 3 15  DG  15  15  15  DG  DG  D . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
D 4  ZN  1   101 1031 ZN  ZN  L . 
E 5  0G6 1   301 1    0G6 0G6 H . 
F 6  NAG 1   302 2    NAG NAG H . 
G 7  NA  1   303 417  NA  NA  H . 
H 4  ZN  1   304 1032 ZN  ZN  H . 
I 8  CL  1   305 418  CL  CL  H . 
J 8  CL  1   306 419  CL  CL  H . 
K 9  K   1   101 416  K   K   D . 
L 10 HOH 1   201 1047 HOH HOH L . 
L 10 HOH 2   202 1057 HOH HOH L . 
L 10 HOH 3   203 1072 HOH HOH L . 
L 10 HOH 4   204 1118 HOH HOH L . 
L 10 HOH 5   205 1141 HOH HOH L . 
L 10 HOH 6   206 1151 HOH HOH L . 
L 10 HOH 7   207 1154 HOH HOH L . 
L 10 HOH 8   208 1191 HOH HOH L . 
L 10 HOH 9   209 1206 HOH HOH L . 
L 10 HOH 10  210 1185 HOH HOH L . 
M 10 HOH 1   401 1033 HOH HOH H . 
M 10 HOH 2   402 1034 HOH HOH H . 
M 10 HOH 3   403 1035 HOH HOH H . 
M 10 HOH 4   404 1036 HOH HOH H . 
M 10 HOH 5   405 1037 HOH HOH H . 
M 10 HOH 6   406 1038 HOH HOH H . 
M 10 HOH 7   407 1039 HOH HOH H . 
M 10 HOH 8   408 1041 HOH HOH H . 
M 10 HOH 9   409 1042 HOH HOH H . 
M 10 HOH 10  410 1043 HOH HOH H . 
M 10 HOH 11  411 1045 HOH HOH H . 
M 10 HOH 12  412 1046 HOH HOH H . 
M 10 HOH 13  413 1048 HOH HOH H . 
M 10 HOH 14  414 1049 HOH HOH H . 
M 10 HOH 15  415 1050 HOH HOH H . 
M 10 HOH 16  416 1051 HOH HOH H . 
M 10 HOH 17  417 1052 HOH HOH H . 
M 10 HOH 18  418 1053 HOH HOH H . 
M 10 HOH 19  419 1054 HOH HOH H . 
M 10 HOH 20  420 1055 HOH HOH H . 
M 10 HOH 21  421 1056 HOH HOH H . 
M 10 HOH 22  422 1059 HOH HOH H . 
M 10 HOH 23  423 1060 HOH HOH H . 
M 10 HOH 24  424 1061 HOH HOH H . 
M 10 HOH 25  425 1062 HOH HOH H . 
M 10 HOH 26  426 1063 HOH HOH H . 
M 10 HOH 27  427 1064 HOH HOH H . 
M 10 HOH 28  428 1065 HOH HOH H . 
M 10 HOH 29  429 1066 HOH HOH H . 
M 10 HOH 30  430 1067 HOH HOH H . 
M 10 HOH 31  431 1068 HOH HOH H . 
M 10 HOH 32  432 1069 HOH HOH H . 
M 10 HOH 33  433 1070 HOH HOH H . 
M 10 HOH 34  434 1073 HOH HOH H . 
M 10 HOH 35  435 1074 HOH HOH H . 
M 10 HOH 36  436 1075 HOH HOH H . 
M 10 HOH 37  437 1076 HOH HOH H . 
M 10 HOH 38  438 1077 HOH HOH H . 
M 10 HOH 39  439 1078 HOH HOH H . 
M 10 HOH 40  440 1079 HOH HOH H . 
M 10 HOH 41  441 1080 HOH HOH H . 
M 10 HOH 42  442 1081 HOH HOH H . 
M 10 HOH 43  443 1082 HOH HOH H . 
M 10 HOH 44  444 1083 HOH HOH H . 
M 10 HOH 45  445 1084 HOH HOH H . 
M 10 HOH 46  446 1085 HOH HOH H . 
M 10 HOH 47  447 1086 HOH HOH H . 
M 10 HOH 48  448 1087 HOH HOH H . 
M 10 HOH 49  449 1088 HOH HOH H . 
M 10 HOH 50  450 1089 HOH HOH H . 
M 10 HOH 51  451 1091 HOH HOH H . 
M 10 HOH 52  452 1092 HOH HOH H . 
M 10 HOH 53  453 1093 HOH HOH H . 
M 10 HOH 54  454 1094 HOH HOH H . 
M 10 HOH 55  455 1095 HOH HOH H . 
M 10 HOH 56  456 1096 HOH HOH H . 
M 10 HOH 57  457 1097 HOH HOH H . 
M 10 HOH 58  458 1098 HOH HOH H . 
M 10 HOH 59  459 1099 HOH HOH H . 
M 10 HOH 60  460 1100 HOH HOH H . 
M 10 HOH 61  461 1102 HOH HOH H . 
M 10 HOH 62  462 1103 HOH HOH H . 
M 10 HOH 63  463 1104 HOH HOH H . 
M 10 HOH 64  464 1105 HOH HOH H . 
M 10 HOH 65  465 1106 HOH HOH H . 
M 10 HOH 66  466 1108 HOH HOH H . 
M 10 HOH 67  467 1110 HOH HOH H . 
M 10 HOH 68  468 1111 HOH HOH H . 
M 10 HOH 69  469 1112 HOH HOH H . 
M 10 HOH 70  470 1114 HOH HOH H . 
M 10 HOH 71  471 1115 HOH HOH H . 
M 10 HOH 72  472 1116 HOH HOH H . 
M 10 HOH 73  473 1117 HOH HOH H . 
M 10 HOH 74  474 1119 HOH HOH H . 
M 10 HOH 75  475 1120 HOH HOH H . 
M 10 HOH 76  476 1121 HOH HOH H . 
M 10 HOH 77  477 1122 HOH HOH H . 
M 10 HOH 78  478 1123 HOH HOH H . 
M 10 HOH 79  479 1124 HOH HOH H . 
M 10 HOH 80  480 1126 HOH HOH H . 
M 10 HOH 81  481 1127 HOH HOH H . 
M 10 HOH 82  482 1128 HOH HOH H . 
M 10 HOH 83  483 1129 HOH HOH H . 
M 10 HOH 84  484 1130 HOH HOH H . 
M 10 HOH 85  485 1132 HOH HOH H . 
M 10 HOH 86  486 1133 HOH HOH H . 
M 10 HOH 87  487 1134 HOH HOH H . 
M 10 HOH 88  488 1135 HOH HOH H . 
M 10 HOH 89  489 1136 HOH HOH H . 
M 10 HOH 90  490 1140 HOH HOH H . 
M 10 HOH 91  491 1142 HOH HOH H . 
M 10 HOH 92  492 1143 HOH HOH H . 
M 10 HOH 93  493 1144 HOH HOH H . 
M 10 HOH 94  494 1145 HOH HOH H . 
M 10 HOH 95  495 1147 HOH HOH H . 
M 10 HOH 96  496 1148 HOH HOH H . 
M 10 HOH 97  497 1152 HOH HOH H . 
M 10 HOH 98  498 1153 HOH HOH H . 
M 10 HOH 99  499 1155 HOH HOH H . 
M 10 HOH 100 500 1157 HOH HOH H . 
M 10 HOH 101 501 1158 HOH HOH H . 
M 10 HOH 102 502 1159 HOH HOH H . 
M 10 HOH 103 503 1160 HOH HOH H . 
M 10 HOH 104 504 1161 HOH HOH H . 
M 10 HOH 105 505 1162 HOH HOH H . 
M 10 HOH 106 506 1163 HOH HOH H . 
M 10 HOH 107 507 1166 HOH HOH H . 
M 10 HOH 108 508 1167 HOH HOH H . 
M 10 HOH 109 509 1168 HOH HOH H . 
M 10 HOH 110 510 1169 HOH HOH H . 
M 10 HOH 111 511 1170 HOH HOH H . 
M 10 HOH 112 512 1171 HOH HOH H . 
M 10 HOH 113 513 1172 HOH HOH H . 
M 10 HOH 114 514 1174 HOH HOH H . 
M 10 HOH 115 515 1175 HOH HOH H . 
M 10 HOH 116 516 1176 HOH HOH H . 
M 10 HOH 117 517 1178 HOH HOH H . 
M 10 HOH 118 518 1179 HOH HOH H . 
M 10 HOH 119 519 1180 HOH HOH H . 
M 10 HOH 120 520 1181 HOH HOH H . 
M 10 HOH 121 521 1182 HOH HOH H . 
M 10 HOH 122 522 1183 HOH HOH H . 
M 10 HOH 123 523 1184 HOH HOH H . 
M 10 HOH 124 524 1186 HOH HOH H . 
M 10 HOH 125 525 1187 HOH HOH H . 
M 10 HOH 126 526 1188 HOH HOH H . 
M 10 HOH 127 527 1190 HOH HOH H . 
M 10 HOH 128 528 1194 HOH HOH H . 
M 10 HOH 129 529 1195 HOH HOH H . 
M 10 HOH 130 530 1196 HOH HOH H . 
M 10 HOH 131 531 1197 HOH HOH H . 
M 10 HOH 132 532 1198 HOH HOH H . 
M 10 HOH 133 533 1199 HOH HOH H . 
M 10 HOH 134 534 1200 HOH HOH H . 
M 10 HOH 135 535 1201 HOH HOH H . 
M 10 HOH 136 536 1202 HOH HOH H . 
M 10 HOH 137 537 1203 HOH HOH H . 
M 10 HOH 138 538 1204 HOH HOH H . 
M 10 HOH 139 539 1205 HOH HOH H . 
M 10 HOH 140 540 1208 HOH HOH H . 
M 10 HOH 141 541 1209 HOH HOH H . 
M 10 HOH 142 542 1210 HOH HOH H . 
M 10 HOH 143 543 1211 HOH HOH H . 
M 10 HOH 144 544 1212 HOH HOH H . 
M 10 HOH 145 545 1214 HOH HOH H . 
M 10 HOH 146 546 1215 HOH HOH H . 
M 10 HOH 147 547 1231 HOH HOH H . 
N 10 HOH 1   201 1058 HOH HOH D . 
N 10 HOH 2   202 1101 HOH HOH D . 
N 10 HOH 3   203 1107 HOH HOH D . 
N 10 HOH 4   204 1137 HOH HOH D . 
N 10 HOH 5   205 1138 HOH HOH D . 
N 10 HOH 6   206 1139 HOH HOH D . 
N 10 HOH 7   207 1173 HOH HOH D . 
N 10 HOH 8   208 1177 HOH HOH D . 
N 10 HOH 9   209 1189 HOH HOH D . 
N 10 HOH 10  210 1192 HOH HOH D . 
N 10 HOH 11  211 1193 HOH HOH D . 
N 10 HOH 12  212 1207 HOH HOH D . 
N 10 HOH 13  213 1213 HOH HOH D . 
N 10 HOH 14  214 1216 HOH HOH D . 
N 10 HOH 15  215 1217 HOH HOH D . 
N 10 HOH 16  216 1218 HOH HOH D . 
N 10 HOH 17  217 1219 HOH HOH D . 
N 10 HOH 18  218 1220 HOH HOH D . 
N 10 HOH 19  219 1221 HOH HOH D . 
N 10 HOH 20  220 1222 HOH HOH D . 
N 10 HOH 21  221 1223 HOH HOH D . 
N 10 HOH 22  222 1224 HOH HOH D . 
N 10 HOH 23  223 1225 HOH HOH D . 
N 10 HOH 24  224 1226 HOH HOH D . 
N 10 HOH 25  225 1228 HOH HOH D . 
N 10 HOH 26  226 1230 HOH HOH D . 
# 
loop_
_software.name 
_software.classification 
_software.version 
_software.citation_id 
_software.pdbx_ordinal 
CrystalClear 'data collection' . ? 1 
PHASES       phasing           . ? 2 
CNS          refinement        . ? 3 
HKL-2000     'data reduction'  . ? 4 
HKL-2000     'data scaling'    . ? 5 
# 
_cell.entry_id           4DII 
_cell.length_a           43.369 
_cell.length_b           45.299 
_cell.length_c           51.519 
_cell.angle_alpha        68.97 
_cell.angle_beta         86.11 
_cell.angle_gamma        69.66 
_cell.Z_PDB              1 
_cell.pdbx_unique_axis   ? 
_cell.length_a_esd       ? 
_cell.length_b_esd       ? 
_cell.length_c_esd       ? 
_cell.angle_alpha_esd    ? 
_cell.angle_beta_esd     ? 
_cell.angle_gamma_esd    ? 
# 
_symmetry.entry_id                         4DII 
_symmetry.space_group_name_H-M             'P 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                1 
_symmetry.space_group_name_Hall            ? 
# 
_exptl.entry_id          4DII 
_exptl.method            'X-RAY DIFFRACTION' 
_exptl.crystals_number   1 
# 
_exptl_crystal.id                    1 
_exptl_crystal.density_meas          ? 
_exptl_crystal.density_Matthews      2.29 
_exptl_crystal.density_percent_sol   46.26 
_exptl_crystal.description           ? 
_exptl_crystal.F_000                 ? 
_exptl_crystal.preparation           ? 
# 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.temp            293 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.pH              7.4 
_exptl_crystal_grow.pdbx_details    
;10-15% w/v polyethylene glycol 8000, 0.05 M zinc acetate, 0.1 M sodium cacodylate , pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 293K
;
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
_diffrn.id                     1 
_diffrn.ambient_temp           100.0 
_diffrn.ambient_temp_details   ? 
_diffrn.crystal_id             1 
# 
_diffrn_detector.diffrn_id              1 
_diffrn_detector.detector               CCD 
_diffrn_detector.type                   'RIGAKU SATURN 944' 
_diffrn_detector.pdbx_collection_date   2009-12-10 
_diffrn_detector.details                mirrors 
# 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.monochromator                    GRAPHITE 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.5418 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.diffrn_id                   1 
_diffrn_source.source                      'ROTATING ANODE' 
_diffrn_source.type                        RIGAKU 
_diffrn_source.pdbx_synchrotron_site       ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_wavelength_list        1.5418 
# 
_reflns.entry_id                     4DII 
_reflns.observed_criterion_sigma_I   0.000 
_reflns.observed_criterion_sigma_F   0.000 
_reflns.d_resolution_low             50.00 
_reflns.d_resolution_high            2.05 
_reflns.number_obs                   20850 
_reflns.number_all                   20850 
_reflns.percent_possible_obs         94.5 
_reflns.pdbx_Rmerge_I_obs            ? 
_reflns.pdbx_Rsym_value              ? 
_reflns.pdbx_netI_over_sigmaI        ? 
_reflns.B_iso_Wilson_estimate        ? 
_reflns.pdbx_redundancy              ? 
_reflns.R_free_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.observed_criterion_F_max     ? 
_reflns.observed_criterion_F_min     ? 
_reflns.pdbx_chi_squared             ? 
_reflns.pdbx_scaling_rejects         ? 
_reflns.pdbx_ordinal                 1 
_reflns.pdbx_diffrn_id               1 
# 
_reflns_shell.d_res_high             2.05 
_reflns_shell.d_res_low              2.12 
_reflns_shell.percent_possible_all   84.5 
_reflns_shell.Rmerge_I_obs           ? 
_reflns_shell.pdbx_Rsym_value        ? 
_reflns_shell.meanI_over_sigI_obs    ? 
_reflns_shell.pdbx_redundancy        ? 
_reflns_shell.percent_possible_obs   ? 
_reflns_shell.number_unique_all      ? 
_reflns_shell.number_measured_all    ? 
_reflns_shell.number_measured_obs    ? 
_reflns_shell.number_unique_obs      ? 
_reflns_shell.pdbx_chi_squared       ? 
_reflns_shell.pdbx_ordinal           1 
_reflns_shell.pdbx_diffrn_id         1 
# 
_refine.entry_id                                 4DII 
_refine.ls_number_reflns_obs                     19447 
_refine.ls_number_reflns_all                     21478 
_refine.pdbx_ls_sigma_I                          0.00 
_refine.pdbx_ls_sigma_F                          0.00 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.ls_d_res_low                             50.00 
_refine.ls_d_res_high                            2.05 
_refine.ls_percent_reflns_obs                    ? 
_refine.ls_R_factor_obs                          0.195 
_refine.ls_R_factor_all                          0.195 
_refine.ls_R_factor_R_work                       0.174 
_refine.ls_R_factor_R_free                       0.226 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_number_reflns_R_free                  18499 
_refine.ls_number_parameters                     ? 
_refine.ls_number_restraints                     ? 
_refine.occupancy_min                            ? 
_refine.occupancy_max                            ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.B_iso_mean                               ? 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_ksol                 ? 
_refine.solvent_model_param_bsol                 ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_refine.pdbx_ls_cross_valid_method               ? 
_refine.details                                  ? 
_refine.pdbx_starting_model                      'PDB ENTRY 3QLP AND 1HAO' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_stereochemistry_target_values       'Engh & Huber' 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.overall_SU_ML                            ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.overall_SU_B                             ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.B_iso_min                                ? 
_refine.B_iso_max                                ? 
_refine.overall_SU_R_free                        ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_diffrn_id                           1 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        2247 
_refine_hist.pdbx_number_atoms_nucleic_acid   315 
_refine_hist.pdbx_number_atoms_ligand         50 
_refine_hist.number_atoms_solvent             183 
_refine_hist.number_atoms_total               2795 
_refine_hist.d_res_high                       2.05 
_refine_hist.d_res_low                        50.00 
# 
_database_PDB_matrix.entry_id          4DII 
_database_PDB_matrix.origx[1][1]       1.000000 
_database_PDB_matrix.origx[1][2]       0.000000 
_database_PDB_matrix.origx[1][3]       0.000000 
_database_PDB_matrix.origx[2][1]       0.000000 
_database_PDB_matrix.origx[2][2]       1.000000 
_database_PDB_matrix.origx[2][3]       0.000000 
_database_PDB_matrix.origx[3][1]       0.000000 
_database_PDB_matrix.origx[3][2]       0.000000 
_database_PDB_matrix.origx[3][3]       1.000000 
_database_PDB_matrix.origx_vector[1]   0.00000 
_database_PDB_matrix.origx_vector[2]   0.00000 
_database_PDB_matrix.origx_vector[3]   0.00000 
# 
_struct.entry_id                  4DII 
_struct.title                     
'X-ray structure of the complex between human alpha thrombin and thrombin binding aptamer in the presence of potassium ions' 
_struct.pdbx_model_details        ? 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        4DII 
_struct_keywords.pdbx_keywords   'HYDROLASE/HYDROLASE INHIBITOR/DNA' 
_struct_keywords.text            
;protein-DNA complex, serine protease, blood coagulation, aptamer, hydrolase-hydrolase inhibitor-DNA complex, serine protease fold, DNA aptamer, blood, G-quadruplex
;
# 
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 5  ? 
F N N 6  ? 
G N N 7  ? 
H N N 4  ? 
I N N 8  ? 
J N N 8  ? 
K N N 9  ? 
L N N 10 ? 
M N N 10 ? 
N N N 10 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
_struct_ref.pdbx_db_isoform 
1 UNP THRB_HUMAN P00734 1 TFGSGEADCGLRPLFEKKSLEDKTERELLESYIDGR 328 ? 
2 UNP THRB_HUMAN P00734 2 
;IVEGSDAEIGMSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTENDLLVRIGKHSRTRYERNIEKISM
LEKIYIHPRYNWRENLDRDIALMKLKKPVAFSDYIHPVCLPDRETAASLLQAGYKGRVTGWGNLKETWTANVGKGQPSVL
QVVNLPIVERPVCKDSTRIRITDNMFCAGYKPDEGKRGDACEGDSGGPFVMKSPFNNRWYQMGIVSWGEGCDRDGKYGFY
THVFRLKKWIQKVIDQFGE
;
364 ? 
3 PDB 4DII       4DII   3 GGTTGGTGTGGTTGG 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 4DII L 1 ? 36  ? P00734 328 ? 363 ? -5 17  
2 2 4DII H 1 ? 259 ? P00734 364 ? 622 ? 16 247 
3 3 4DII D 1 ? 15  ? 4DII   1   ? 15  ? 1  15  
# 
_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   trimeric 
_pdbx_struct_assembly.oligomeric_count     3 
# 
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)' 3280  ? 
1 MORE         -14   ? 
1 'SSA (A^2)'  14870 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K,L,M,N 
# 
_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 
# 
_struct_biol.id        1 
_struct_biol.details   '1:1 protein-DNA aptamer complex' 
# 
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 1 PHE A 15  ? SER A 19  ? PHE L 7   SER L 11  5 ? 5  
HELX_P HELX_P2 2 THR A 24  B TYR A 32  J THR L 14  TYR L 14  1 ? 9  
HELX_P HELX_P3 3 ALA B 41  ? LEU B 45  ? ALA H 55  LEU H 59  1 ? 5  
HELX_P HELX_P4 4 PRO B 48  B ASP B 51  E PRO H 60  ASP H 60  5 ? 4  
HELX_P HELX_P5 5 THR B 55  I ASN B 57  ? THR H 60  ASN H 62  5 ? 3  
HELX_P HELX_P6 6 ASP B 122 ? LEU B 130 ? ASP H 125 LEU H 130 1 ? 9  
HELX_P HELX_P7 7 GLU B 169 ? SER B 176 ? GLU H 164 SER H 171 1 ? 8  
HELX_P HELX_P8 8 LEU B 246 ? GLY B 258 ? LEU H 234 GLY H 246 1 ? 13 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ?    ? A CYS 9   SG  ? ? ? 1_555 B CYS 119 SG  ? ? L CYS 1   H CYS 122 1_555 ? ? ? ? ? ? ?               2.073 ? ? 
disulf2  disulf ?    ? B CYS 28  SG  ? ? ? 1_555 B CYS 44  SG  ? ? H CYS 42  H CYS 58  1_555 ? ? ? ? ? ? ?               2.044 ? ? 
disulf3  disulf ?    ? B CYS 173 SG  ? ? ? 1_555 B CYS 187 SG  ? ? H CYS 168 H CYS 182 1_555 ? ? ? ? ? ? ?               2.031 ? ? 
disulf4  disulf ?    ? B CYS 201 SG  ? ? ? 1_555 B CYS 231 SG  ? ? H CYS 191 H CYS 220 1_555 ? ? ? ? ? ? ?               2.038 ? ? 
covale1  covale one  ? B HIS 43  NE2 ? ? ? 1_555 E 0G6 .   C3  ? ? H HIS 57  H 0G6 301 1_555 ? ? ? ? ? ? ?               1.395 ? ? 
covale2  covale one  ? B ASN 53  ND2 ? G ? 1_555 F NAG .   C1  ? ? H ASN 60  H NAG 302 1_555 ? ? ? ? ? ? ?               1.447 ? 
N-Glycosylation 
covale3  covale none ? B SER 205 OG  ? ? ? 1_555 E 0G6 .   C2  ? ? H SER 195 H 0G6 301 1_555 ? ? ? ? ? ? ?               1.360 ? ? 
metalc1  metalc ?    ? A ASP 8   OD1 ? A ? 1_555 D ZN  .   ZN  ? ? L ASP 1   L ZN  101 1_555 ? ? ? ? ? ? ?               1.920 ? ? 
metalc2  metalc ?    ? D ZN  .   ZN  ? ? ? 1_555 B HIS 116 NE2 ? ? L ZN  101 H HIS 119 1_555 ? ? ? ? ? ? ?               2.179 ? ? 
metalc3  metalc ?    ? B ASP 51  OD1 ? E ? 1_555 H ZN  .   ZN  ? ? H ASP 60  H ZN  304 1_555 ? ? ? ? ? ? ?               2.208 ? ? 
metalc4  metalc ?    ? B ASP 51  OD2 ? E ? 1_555 H ZN  .   ZN  ? ? H ASP 60  H ZN  304 1_555 ? ? ? ? ? ? ?               2.587 ? ? 
metalc5  metalc ?    ? B ARG 233 O   ? ? ? 1_555 G NA  .   NA  ? ? H ARG 221 H NA  303 1_555 ? ? ? ? ? ? ?               2.541 ? ? 
metalc6  metalc ?    ? B LYS 236 O   ? ? ? 1_555 G NA  .   NA  ? ? H LYS 224 H NA  303 1_555 ? ? ? ? ? ? ?               2.676 ? ? 
metalc7  metalc ?    ? G NA  .   NA  ? ? ? 1_555 M HOH .   O   ? ? H NA  303 H HOH 418 1_555 ? ? ? ? ? ? ?               2.542 ? ? 
metalc8  metalc ?    ? G NA  .   NA  ? ? ? 1_555 M HOH .   O   ? ? H NA  303 H HOH 464 1_555 ? ? ? ? ? ? ?               2.599 ? ? 
metalc9  metalc ?    ? C DG  1   O6  ? ? ? 1_555 K K   .   K   ? ? D DG  1   D K   101 1_555 ? ? ? ? ? ? ?               2.689 ? ? 
metalc10 metalc ?    ? C DG  2   O6  ? ? ? 1_555 K K   .   K   ? ? D DG  2   D K   101 1_555 ? ? ? ? ? ? ?               2.951 ? ? 
metalc11 metalc ?    ? C DG  5   O6  ? ? ? 1_555 K K   .   K   ? ? D DG  5   D K   101 1_555 ? ? ? ? ? ? ?               2.726 ? ? 
metalc12 metalc ?    ? C DG  6   O6  ? ? ? 1_555 K K   .   K   ? ? D DG  6   D K   101 1_555 ? ? ? ? ? ? ?               2.924 ? ? 
metalc13 metalc ?    ? C DG  10  O6  ? ? ? 1_555 K K   .   K   ? ? D DG  10  D K   101 1_555 ? ? ? ? ? ? ?               2.901 ? ? 
metalc14 metalc ?    ? C DG  11  O6  ? ? ? 1_555 K K   .   K   ? ? D DG  11  D K   101 1_555 ? ? ? ? ? ? ?               2.820 ? ? 
metalc15 metalc ?    ? C DG  14  O6  ? ? ? 1_555 K K   .   K   ? ? D DG  14  D K   101 1_555 ? ? ? ? ? ? ?               2.714 ? ? 
metalc16 metalc ?    ? C DG  15  O6  ? ? ? 1_555 K K   .   K   ? ? D DG  15  D K   101 1_555 ? ? ? ? ? ? ?               2.807 ? ? 
hydrog1  hydrog ?    ? C DG  1   N1  ? ? ? 1_555 C DG  6   O6  ? ? D DG  1   D DG  6   1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog2  hydrog ?    ? C DG  1   N2  ? ? ? 1_555 C DG  6   N7  ? ? D DG  1   D DG  6   1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog3  hydrog ?    ? C DG  1   N7  ? ? ? 1_555 C DG  15  N2  ? ? D DG  1   D DG  15  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog4  hydrog ?    ? C DG  1   O6  ? ? ? 1_555 C DG  15  N1  ? ? D DG  1   D DG  15  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog5  hydrog ?    ? C DG  2   N7  ? ? ? 1_555 C DG  5   N2  ? ? D DG  2   D DG  5   1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog6  hydrog ?    ? C DG  2   O6  ? ? ? 1_555 C DG  5   N1  ? ? D DG  2   D DG  5   1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog7  hydrog ?    ? C DG  2   N1  ? ? ? 1_555 C DG  14  O6  ? ? D DG  2   D DG  14  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog8  hydrog ?    ? C DG  2   N2  ? ? ? 1_555 C DG  14  N7  ? ? D DG  2   D DG  14  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog9  hydrog ?    ? C DG  5   N7  ? ? ? 1_555 C DG  11  N2  ? ? D DG  5   D DG  11  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog10 hydrog ?    ? C DG  5   O6  ? ? ? 1_555 C DG  11  N1  ? ? D DG  5   D DG  11  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog11 hydrog ?    ? C DG  6   N1  ? ? ? 1_555 C DG  10  O6  ? ? D DG  6   D DG  10  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog12 hydrog ?    ? C DG  6   N2  ? ? ? 1_555 C DG  10  N7  ? ? D DG  6   D DG  10  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog13 hydrog ?    ? C DG  10  N1  ? ? ? 1_555 C DG  15  O6  ? ? D DG  10  D DG  15  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog14 hydrog ?    ? C DG  10  N2  ? ? ? 1_555 C DG  15  N7  ? ? D DG  10  D DG  15  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog15 hydrog ?    ? C DG  11  N7  ? ? ? 1_555 C DG  14  N2  ? ? D DG  11  D DG  14  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog16 hydrog ?    ? C DG  11  O6  ? ? ? 1_555 C DG  14  N1  ? ? D DG  11  D DG  14  1_555 ? ? ? ? ? ? TYPE_6_PAIR     ?     ? ? 
hydrog17 hydrog ?    ? C DT  13  O2  ? ? ? 1_555 C DG  14  N1  ? ? D DT  13  D DG  14  1_555 ? ? ? ? ? ? 'DT-DG MISPAIR' ?     ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
metalc ? ? 
hydrog ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  OD1 ? A ASP 8   ? L ASP 1   A 1_555 ZN ? D ZN . ? L ZN 101 ? 1_555 NE2 ? B HIS 116 ? H HIS 119 ? 1_555 112.0 ? 
2  OD1 ? B ASP 51  ? H ASP 60  E 1_555 ZN ? H ZN . ? H ZN 304 ? 1_555 OD2 ? B ASP 51  ? H ASP 60  E 1_555 55.0  ? 
3  O   ? B ARG 233 ? H ARG 221 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? B LYS 236 ? H LYS 224 ? 1_555 84.6  ? 
4  O   ? B ARG 233 ? H ARG 221 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? M HOH .   ? H HOH 418 ? 1_555 107.2 ? 
5  O   ? B LYS 236 ? H LYS 224 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? M HOH .   ? H HOH 418 ? 1_555 145.8 ? 
6  O   ? B ARG 233 ? H ARG 221 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? M HOH .   ? H HOH 464 ? 1_555 135.0 ? 
7  O   ? B LYS 236 ? H LYS 224 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? M HOH .   ? H HOH 464 ? 1_555 65.0  ? 
8  O   ? M HOH .   ? H HOH 418 ? 1_555 NA ? G NA . ? H NA 303 ? 1_555 O   ? M HOH .   ? H HOH 464 ? 1_555 85.6  ? 
9  O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  2   ? D DG  2   ? 1_555 68.2  ? 
10 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  5   ? D DG  5   ? 1_555 116.6 ? 
11 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  5   ? D DG  5   ? 1_555 65.3  ? 
12 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  6   ? D DG  6   ? 1_555 76.1  ? 
13 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  6   ? D DG  6   ? 1_555 100.3 ? 
14 O6  ? C DG  5   ? D DG  5   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  6   ? D DG  6   ? 1_555 72.6  ? 
15 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  10  ? D DG  10  ? 1_555 118.7 ? 
16 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  10  ? D DG  10  ? 1_555 164.5 ? 
17 O6  ? C DG  5   ? D DG  5   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  10  ? D DG  10  ? 1_555 99.8  ? 
18 O6  ? C DG  6   ? D DG  6   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  10  ? D DG  10  ? 1_555 69.8  ? 
19 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  11  ? D DG  11  ? 1_555 165.9 ? 
20 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  11  ? D DG  11  ? 1_555 108.9 ? 
21 O6  ? C DG  5   ? D DG  5   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  11  ? D DG  11  ? 1_555 72.2  ? 
22 O6  ? C DG  6   ? D DG  6   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  11  ? D DG  11  ? 1_555 117.8 ? 
23 O6  ? C DG  10  ? D DG  10  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  11  ? D DG  11  ? 1_555 67.9  ? 
24 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 100.6 ? 
25 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 66.7  ? 
26 O6  ? C DG  5   ? D DG  5   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 98.1  ? 
27 O6  ? C DG  6   ? D DG  6   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 166.7 ? 
28 O6  ? C DG  10  ? D DG  10  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 122.1 ? 
29 O6  ? C DG  11  ? D DG  11  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  14  ? D DG  14  ? 1_555 66.3  ? 
30 O6  ? C DG  1   ? D DG  1   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 75.3  ? 
31 O6  ? C DG  2   ? D DG  2   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 123.1 ? 
32 O6  ? C DG  5   ? D DG  5   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 168.1 ? 
33 O6  ? C DG  6   ? D DG  6   ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 111.5 ? 
34 O6  ? C DG  10  ? D DG  10  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 72.3  ? 
35 O6  ? C DG  11  ? D DG  11  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 96.4  ? 
36 O6  ? C DG  14  ? D DG  14  ? 1_555 K  ? K K  . ? D K  101 ? 1_555 O6  ? C DG  15  ? D DG  15  ? 1_555 79.5  ? 
# 
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 NAG F .   ? ASN B 53  ? NAG H 302 ? 1_555 ASN H 60  G 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate                     
2 0G6 E .   ? HIS B 43  ? 0G6 H 301 ? 1_555 HIS H 57  ? 1_555 C3 NE2 HIS 2 0G6 None            'Covalent chemical modification' 
3 0G6 E .   ? SER B 205 ? 0G6 H 301 ? 1_555 SER H 195 ? 1_555 C2 OG  SER 3 0G6 None            'Covalent chemical modification' 
4 CYS A 9   ? CYS B 119 ? CYS L 1   ? 1_555 CYS H 122 ? 1_555 SG SG  .   . .   None            'Disulfide bridge'               
5 CYS B 28  ? CYS B 44  ? CYS H 42  ? 1_555 CYS H 58  ? 1_555 SG SG  .   . .   None            'Disulfide bridge'               
6 CYS B 173 ? CYS B 187 ? CYS H 168 ? 1_555 CYS H 182 ? 1_555 SG SG  .   . .   None            'Disulfide bridge'               
7 CYS B 201 ? CYS B 231 ? CYS H 191 ? 1_555 CYS H 220 ? 1_555 SG SG  .   . .   None            'Disulfide bridge'               
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          SER 
_struct_mon_prot_cis.label_seq_id           22 
_struct_mon_prot_cis.label_asym_id          B 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      A 
_struct_mon_prot_cis.auth_comp_id           SER 
_struct_mon_prot_cis.auth_seq_id            36 
_struct_mon_prot_cis.auth_asym_id           H 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    23 
_struct_mon_prot_cis.pdbx_label_asym_id_2   B 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    ? 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     37 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    H 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       0.10 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
A ? 7 ? 
B ? 7 ? 
C ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
A 1 2 ? anti-parallel 
A 2 3 ? anti-parallel 
A 3 4 ? anti-parallel 
A 4 5 ? anti-parallel 
A 5 6 ? anti-parallel 
A 6 7 ? anti-parallel 
B 1 2 ? anti-parallel 
B 2 3 ? anti-parallel 
B 3 4 ? anti-parallel 
B 4 5 ? anti-parallel 
B 5 6 ? anti-parallel 
B 6 7 ? anti-parallel 
C 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
A 1 SER B 5   ? ASP B 6   ? SER H 20  ASP H 21  
A 2 GLN B 161 ? PRO B 166 ? GLN H 156 PRO H 161 
A 3 LYS B 135 ? GLY B 140 ? LYS H 135 GLY H 140 
A 4 PRO B 208 ? LYS B 212 ? PRO H 198 LYS H 202 
A 5 TRP B 219 ? TRP B 227 ? TRP H 207 TRP H 215 
A 6 GLY B 238 ? HIS B 242 ? GLY H 226 HIS H 230 
A 7 MET B 185 ? ALA B 188 ? MET H 180 ALA H 183 
B 1 GLN B 15  ? ARG B 20  ? GLN H 30  ARG H 35  
B 2 GLU B 25  ? LEU B 32  ? GLU H 39  LEU H 46  
B 3 TRP B 37  ? THR B 40  ? TRP H 51  THR H 54  
B 4 ALA B 101 ? LEU B 105 ? ALA H 104 LEU H 108 
B 5 LYS B 77  ? ILE B 86  ? LYS H 81  ILE H 90  
B 6 LEU B 59  ? ILE B 63  ? LEU H 64  ILE H 68  
B 7 GLN B 15  ? ARG B 20  ? GLN H 30  ARG H 35  
C 1 LEU B 46  ? TYR B 47  A LEU H 60  TYR H 60  
C 2 LYS B 52  F ASN B 53  G LYS H 60  ASN H 60  
# 
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 
A 1 2 N SER B 5   ? N SER H 20  O VAL B 162 ? O VAL H 157 
A 2 3 O LEU B 165 ? O LEU H 160 N GLY B 136 ? N GLY H 136 
A 3 4 N ARG B 137 ? N ARG H 137 O VAL B 210 ? O VAL H 200 
A 4 5 N MET B 211 ? N MET H 201 O TYR B 220 ? O TYR H 208 
A 5 6 N TRP B 227 ? N TRP H 215 O PHE B 239 ? O PHE H 227 
A 6 7 O TYR B 240 ? O TYR H 228 N PHE B 186 ? N PHE H 181 
B 1 2 N ARG B 20  ? N ARG H 35  O GLU B 25  ? O GLU H 39  
B 2 3 N SER B 31  ? N SER H 45  O LEU B 39  ? O LEU H 53  
B 3 4 N VAL B 38  ? N VAL H 52  O MET B 103 ? O MET H 106 
B 4 5 O LEU B 102 ? O LEU H 105 N TYR B 85  ? N TYR H 89  
B 5 6 O SER B 79  ? O SER H 83  N VAL B 61  ? N VAL H 66  
B 6 7 O LEU B 60  ? O LEU H 65  N PHE B 19  ? N PHE H 34  
C 1 2 N TYR B 47  A N TYR H 60  O LYS B 52  F O LYS H 60  
# 
_pdbx_entry_details.entry_id                   4DII 
_pdbx_entry_details.nonpolymer_details         
;THE INHIBITOR IS COVALENTLY CONNECTED TO ACTIVE_SITE RESIDUES:  
  
1) VIA A HEMIKETAL GROUP TO OG SER 195 IN CHAIN H  
2) VIA A METHYLENE GROUP TO NE2 HIS 57 IN CHAIN H
;
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 O  D HOH 207 ? ? O  D HOH 217 ? ? 2.17 
2 1 OG H SER 195 ? ? O2 H 0G6 301 ? ? 2.19 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 NE H ARG 75  ? ? CZ H ARG 75  ? ? NH1 H ARG 75  ? ? 123.70 120.30 3.40  0.50 N 
2 1 NE H ARG 126 ? ? CZ H ARG 126 ? ? NH2 H ARG 126 ? ? 117.02 120.30 -3.28 0.50 N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 PHE L 7   ? ? -126.09 -82.04 
2 1 TYR H 60  A ? -159.37 85.01  
3 1 ASN H 60  G ? -162.50 83.36  
4 1 ASN H 98  ? ? -143.12 17.85  
5 1 PRO H 186 ? ? -26.44  -22.44 
6 1 ASP H 186 A ? -163.68 34.42  
7 1 GLU H 186 B ? -66.04  17.62  
# 
_pdbx_molecule_features.prd_id    PRD_000020 
_pdbx_molecule_features.name      D-Phe-Pro-Arg-CH2Cl 
_pdbx_molecule_features.type      Peptide-like 
_pdbx_molecule_features.class     Inhibitor 
_pdbx_molecule_features.details   ? 
# 
_pdbx_molecule.instance_id   1 
_pdbx_molecule.prd_id        PRD_000020 
_pdbx_molecule.asym_id       E 
# 
_pdbx_struct_mod_residue.id               1 
_pdbx_struct_mod_residue.label_asym_id    B 
_pdbx_struct_mod_residue.label_comp_id    ASN 
_pdbx_struct_mod_residue.label_seq_id     53 
_pdbx_struct_mod_residue.auth_asym_id     H 
_pdbx_struct_mod_residue.auth_comp_id     ASN 
_pdbx_struct_mod_residue.auth_seq_id      60 
_pdbx_struct_mod_residue.PDB_ins_code     G 
_pdbx_struct_mod_residue.parent_comp_id   ASN 
_pdbx_struct_mod_residue.details          'GLYCOSYLATION SITE' 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 L THR -5  ? A THR 1   
2  1 Y 1 L PHE -4  ? A PHE 2   
3  1 Y 1 L GLY -3  ? A GLY 3   
4  1 Y 1 L SER -2  ? A SER 4   
5  1 Y 1 L GLY -1  ? A GLY 5   
6  1 Y 1 L GLU 0   ? A GLU 6   
7  1 Y 1 L ASP 15  ? A ASP 34  
8  1 Y 1 L GLY 16  ? A GLY 35  
9  1 Y 1 L ARG 17  ? A ARG 36  
10 1 Y 1 H TRP 147 A B TRP 148 
11 1 Y 1 H THR 147 B B THR 149 
12 1 Y 1 H ALA 147 C B ALA 150 
13 1 Y 1 H ASN 147 D B ASN 151 
14 1 Y 1 H VAL 147 E B VAL 152 
15 1 Y 1 H GLY 147 F B GLY 153 
16 1 Y 1 H LYS 147 G B LYS 154 
17 1 Y 1 H GLY 147 H B GLY 155 
18 1 Y 1 H GLU 247 ? B GLU 259 
# 
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 
0G6 N      N  N N 1   
0G6 CA     C  N R 2   
0G6 C      C  N N 3   
0G6 O      O  N N 4   
0G6 CB     C  N N 5   
0G6 CG     C  Y N 6   
0G6 CD1    C  Y N 7   
0G6 CD2    C  Y N 8   
0G6 CE1    C  Y N 9   
0G6 CE2    C  Y N 10  
0G6 CZ     C  Y N 11  
0G6 N1     N  N N 12  
0G6 CA1    C  N S 13  
0G6 C1     C  N N 14  
0G6 O1     O  N N 15  
0G6 CB1    C  N N 16  
0G6 CG1    C  N N 17  
0G6 CD     C  N N 18  
0G6 N2     N  N N 19  
0G6 CA2    C  N S 20  
0G6 C2     C  N S 21  
0G6 O2     O  N N 22  
0G6 CB2    C  N N 23  
0G6 CG2    C  N N 24  
0G6 CD3    C  N N 25  
0G6 NE     N  N N 26  
0G6 CZ1    C  N N 27  
0G6 NH1    N  N N 28  
0G6 NH2    N  N N 29  
0G6 C3     C  N N 30  
0G6 CL     CL N N 31  
0G6 H      H  N N 32  
0G6 H2     H  N N 33  
0G6 HA     H  N N 34  
0G6 HB2    H  N N 35  
0G6 HB3    H  N N 36  
0G6 HD1    H  N N 37  
0G6 HD2    H  N N 38  
0G6 HE1    H  N N 39  
0G6 HE2    H  N N 40  
0G6 HZ     H  N N 41  
0G6 HA1    H  N N 42  
0G6 HB21   H  N N 43  
0G6 HB31   H  N N 44  
0G6 HG2    H  N N 45  
0G6 HG3    H  N N 46  
0G6 HD21   H  N N 47  
0G6 HD3    H  N N 48  
0G6 H1     H  N N 49  
0G6 HA2    H  N N 50  
0G6 HB22   H  N N 51  
0G6 HB32   H  N N 52  
0G6 HG21   H  N N 53  
0G6 HG31   H  N N 54  
0G6 HD22   H  N N 55  
0G6 HD31   H  N N 56  
0G6 HE     H  N N 57  
0G6 HH11   H  N N 58  
0G6 HH12   H  N N 59  
0G6 HH21   H  N N 60  
0G6 HH22   H  N N 61  
0G6 H11    H  N N 62  
0G6 H21    H  N N 63  
0G6 H33    H  N N 64  
0G6 H34    H  N N 65  
ALA N      N  N N 66  
ALA CA     C  N S 67  
ALA C      C  N N 68  
ALA O      O  N N 69  
ALA CB     C  N N 70  
ALA OXT    O  N N 71  
ALA H      H  N N 72  
ALA H2     H  N N 73  
ALA HA     H  N N 74  
ALA HB1    H  N N 75  
ALA HB2    H  N N 76  
ALA HB3    H  N N 77  
ALA HXT    H  N N 78  
ARG N      N  N N 79  
ARG CA     C  N S 80  
ARG C      C  N N 81  
ARG O      O  N N 82  
ARG CB     C  N N 83  
ARG CG     C  N N 84  
ARG CD     C  N N 85  
ARG NE     N  N N 86  
ARG CZ     C  N N 87  
ARG NH1    N  N N 88  
ARG NH2    N  N N 89  
ARG OXT    O  N N 90  
ARG H      H  N N 91  
ARG H2     H  N N 92  
ARG HA     H  N N 93  
ARG HB2    H  N N 94  
ARG HB3    H  N N 95  
ARG HG2    H  N N 96  
ARG HG3    H  N N 97  
ARG HD2    H  N N 98  
ARG HD3    H  N N 99  
ARG HE     H  N N 100 
ARG HH11   H  N N 101 
ARG HH12   H  N N 102 
ARG HH21   H  N N 103 
ARG HH22   H  N N 104 
ARG HXT    H  N N 105 
ASN N      N  N N 106 
ASN CA     C  N S 107 
ASN C      C  N N 108 
ASN O      O  N N 109 
ASN CB     C  N N 110 
ASN CG     C  N N 111 
ASN OD1    O  N N 112 
ASN ND2    N  N N 113 
ASN OXT    O  N N 114 
ASN H      H  N N 115 
ASN H2     H  N N 116 
ASN HA     H  N N 117 
ASN HB2    H  N N 118 
ASN HB3    H  N N 119 
ASN HD21   H  N N 120 
ASN HD22   H  N N 121 
ASN HXT    H  N N 122 
ASP N      N  N N 123 
ASP CA     C  N S 124 
ASP C      C  N N 125 
ASP O      O  N N 126 
ASP CB     C  N N 127 
ASP CG     C  N N 128 
ASP OD1    O  N N 129 
ASP OD2    O  N N 130 
ASP OXT    O  N N 131 
ASP H      H  N N 132 
ASP H2     H  N N 133 
ASP HA     H  N N 134 
ASP HB2    H  N N 135 
ASP HB3    H  N N 136 
ASP HD2    H  N N 137 
ASP HXT    H  N N 138 
CL  CL     CL N N 139 
CYS N      N  N N 140 
CYS CA     C  N R 141 
CYS C      C  N N 142 
CYS O      O  N N 143 
CYS CB     C  N N 144 
CYS SG     S  N N 145 
CYS OXT    O  N N 146 
CYS H      H  N N 147 
CYS H2     H  N N 148 
CYS HA     H  N N 149 
CYS HB2    H  N N 150 
CYS HB3    H  N N 151 
CYS HG     H  N N 152 
CYS HXT    H  N N 153 
DG  OP3    O  N N 154 
DG  P      P  N N 155 
DG  OP1    O  N N 156 
DG  OP2    O  N N 157 
DG  "O5'"  O  N N 158 
DG  "C5'"  C  N N 159 
DG  "C4'"  C  N R 160 
DG  "O4'"  O  N N 161 
DG  "C3'"  C  N S 162 
DG  "O3'"  O  N N 163 
DG  "C2'"  C  N N 164 
DG  "C1'"  C  N R 165 
DG  N9     N  Y N 166 
DG  C8     C  Y N 167 
DG  N7     N  Y N 168 
DG  C5     C  Y N 169 
DG  C6     C  N N 170 
DG  O6     O  N N 171 
DG  N1     N  N N 172 
DG  C2     C  N N 173 
DG  N2     N  N N 174 
DG  N3     N  N N 175 
DG  C4     C  Y N 176 
DG  HOP3   H  N N 177 
DG  HOP2   H  N N 178 
DG  "H5'"  H  N N 179 
DG  "H5''" H  N N 180 
DG  "H4'"  H  N N 181 
DG  "H3'"  H  N N 182 
DG  "HO3'" H  N N 183 
DG  "H2'"  H  N N 184 
DG  "H2''" H  N N 185 
DG  "H1'"  H  N N 186 
DG  H8     H  N N 187 
DG  H1     H  N N 188 
DG  H21    H  N N 189 
DG  H22    H  N N 190 
DT  OP3    O  N N 191 
DT  P      P  N N 192 
DT  OP1    O  N N 193 
DT  OP2    O  N N 194 
DT  "O5'"  O  N N 195 
DT  "C5'"  C  N N 196 
DT  "C4'"  C  N R 197 
DT  "O4'"  O  N N 198 
DT  "C3'"  C  N S 199 
DT  "O3'"  O  N N 200 
DT  "C2'"  C  N N 201 
DT  "C1'"  C  N R 202 
DT  N1     N  N N 203 
DT  C2     C  N N 204 
DT  O2     O  N N 205 
DT  N3     N  N N 206 
DT  C4     C  N N 207 
DT  O4     O  N N 208 
DT  C5     C  N N 209 
DT  C7     C  N N 210 
DT  C6     C  N N 211 
DT  HOP3   H  N N 212 
DT  HOP2   H  N N 213 
DT  "H5'"  H  N N 214 
DT  "H5''" H  N N 215 
DT  "H4'"  H  N N 216 
DT  "H3'"  H  N N 217 
DT  "HO3'" H  N N 218 
DT  "H2'"  H  N N 219 
DT  "H2''" H  N N 220 
DT  "H1'"  H  N N 221 
DT  H3     H  N N 222 
DT  H71    H  N N 223 
DT  H72    H  N N 224 
DT  H73    H  N N 225 
DT  H6     H  N N 226 
GLN N      N  N N 227 
GLN CA     C  N S 228 
GLN C      C  N N 229 
GLN O      O  N N 230 
GLN CB     C  N N 231 
GLN CG     C  N N 232 
GLN CD     C  N N 233 
GLN OE1    O  N N 234 
GLN NE2    N  N N 235 
GLN OXT    O  N N 236 
GLN H      H  N N 237 
GLN H2     H  N N 238 
GLN HA     H  N N 239 
GLN HB2    H  N N 240 
GLN HB3    H  N N 241 
GLN HG2    H  N N 242 
GLN HG3    H  N N 243 
GLN HE21   H  N N 244 
GLN HE22   H  N N 245 
GLN HXT    H  N N 246 
GLU N      N  N N 247 
GLU CA     C  N S 248 
GLU C      C  N N 249 
GLU O      O  N N 250 
GLU CB     C  N N 251 
GLU CG     C  N N 252 
GLU CD     C  N N 253 
GLU OE1    O  N N 254 
GLU OE2    O  N N 255 
GLU OXT    O  N N 256 
GLU H      H  N N 257 
GLU H2     H  N N 258 
GLU HA     H  N N 259 
GLU HB2    H  N N 260 
GLU HB3    H  N N 261 
GLU HG2    H  N N 262 
GLU HG3    H  N N 263 
GLU HE2    H  N N 264 
GLU HXT    H  N N 265 
GLY N      N  N N 266 
GLY CA     C  N N 267 
GLY C      C  N N 268 
GLY O      O  N N 269 
GLY OXT    O  N N 270 
GLY H      H  N N 271 
GLY H2     H  N N 272 
GLY HA2    H  N N 273 
GLY HA3    H  N N 274 
GLY HXT    H  N N 275 
HIS N      N  N N 276 
HIS CA     C  N S 277 
HIS C      C  N N 278 
HIS O      O  N N 279 
HIS CB     C  N N 280 
HIS CG     C  Y N 281 
HIS ND1    N  Y N 282 
HIS CD2    C  Y N 283 
HIS CE1    C  Y N 284 
HIS NE2    N  Y N 285 
HIS OXT    O  N N 286 
HIS H      H  N N 287 
HIS H2     H  N N 288 
HIS HA     H  N N 289 
HIS HB2    H  N N 290 
HIS HB3    H  N N 291 
HIS HD1    H  N N 292 
HIS HD2    H  N N 293 
HIS HE1    H  N N 294 
HIS HE2    H  N N 295 
HIS HXT    H  N N 296 
HOH O      O  N N 297 
HOH H1     H  N N 298 
HOH H2     H  N N 299 
ILE N      N  N N 300 
ILE CA     C  N S 301 
ILE C      C  N N 302 
ILE O      O  N N 303 
ILE CB     C  N S 304 
ILE CG1    C  N N 305 
ILE CG2    C  N N 306 
ILE CD1    C  N N 307 
ILE OXT    O  N N 308 
ILE H      H  N N 309 
ILE H2     H  N N 310 
ILE HA     H  N N 311 
ILE HB     H  N N 312 
ILE HG12   H  N N 313 
ILE HG13   H  N N 314 
ILE HG21   H  N N 315 
ILE HG22   H  N N 316 
ILE HG23   H  N N 317 
ILE HD11   H  N N 318 
ILE HD12   H  N N 319 
ILE HD13   H  N N 320 
ILE HXT    H  N N 321 
K   K      K  N N 322 
LEU N      N  N N 323 
LEU CA     C  N S 324 
LEU C      C  N N 325 
LEU O      O  N N 326 
LEU CB     C  N N 327 
LEU CG     C  N N 328 
LEU CD1    C  N N 329 
LEU CD2    C  N N 330 
LEU OXT    O  N N 331 
LEU H      H  N N 332 
LEU H2     H  N N 333 
LEU HA     H  N N 334 
LEU HB2    H  N N 335 
LEU HB3    H  N N 336 
LEU HG     H  N N 337 
LEU HD11   H  N N 338 
LEU HD12   H  N N 339 
LEU HD13   H  N N 340 
LEU HD21   H  N N 341 
LEU HD22   H  N N 342 
LEU HD23   H  N N 343 
LEU HXT    H  N N 344 
LYS N      N  N N 345 
LYS CA     C  N S 346 
LYS C      C  N N 347 
LYS O      O  N N 348 
LYS CB     C  N N 349 
LYS CG     C  N N 350 
LYS CD     C  N N 351 
LYS CE     C  N N 352 
LYS NZ     N  N N 353 
LYS OXT    O  N N 354 
LYS H      H  N N 355 
LYS H2     H  N N 356 
LYS HA     H  N N 357 
LYS HB2    H  N N 358 
LYS HB3    H  N N 359 
LYS HG2    H  N N 360 
LYS HG3    H  N N 361 
LYS HD2    H  N N 362 
LYS HD3    H  N N 363 
LYS HE2    H  N N 364 
LYS HE3    H  N N 365 
LYS HZ1    H  N N 366 
LYS HZ2    H  N N 367 
LYS HZ3    H  N N 368 
LYS HXT    H  N N 369 
MET N      N  N N 370 
MET CA     C  N S 371 
MET C      C  N N 372 
MET O      O  N N 373 
MET CB     C  N N 374 
MET CG     C  N N 375 
MET SD     S  N N 376 
MET CE     C  N N 377 
MET OXT    O  N N 378 
MET H      H  N N 379 
MET H2     H  N N 380 
MET HA     H  N N 381 
MET HB2    H  N N 382 
MET HB3    H  N N 383 
MET HG2    H  N N 384 
MET HG3    H  N N 385 
MET HE1    H  N N 386 
MET HE2    H  N N 387 
MET HE3    H  N N 388 
MET HXT    H  N N 389 
NA  NA     NA N N 390 
NAG C1     C  N R 391 
NAG C2     C  N R 392 
NAG C3     C  N R 393 
NAG C4     C  N S 394 
NAG C5     C  N R 395 
NAG C6     C  N N 396 
NAG C7     C  N N 397 
NAG C8     C  N N 398 
NAG N2     N  N N 399 
NAG O1     O  N N 400 
NAG O3     O  N N 401 
NAG O4     O  N N 402 
NAG O5     O  N N 403 
NAG O6     O  N N 404 
NAG O7     O  N N 405 
NAG H1     H  N N 406 
NAG H2     H  N N 407 
NAG H3     H  N N 408 
NAG H4     H  N N 409 
NAG H5     H  N N 410 
NAG H61    H  N N 411 
NAG H62    H  N N 412 
NAG H81    H  N N 413 
NAG H82    H  N N 414 
NAG H83    H  N N 415 
NAG HN2    H  N N 416 
NAG HO1    H  N N 417 
NAG HO3    H  N N 418 
NAG HO4    H  N N 419 
NAG HO6    H  N N 420 
PHE N      N  N N 421 
PHE CA     C  N S 422 
PHE C      C  N N 423 
PHE O      O  N N 424 
PHE CB     C  N N 425 
PHE CG     C  Y N 426 
PHE CD1    C  Y N 427 
PHE CD2    C  Y N 428 
PHE CE1    C  Y N 429 
PHE CE2    C  Y N 430 
PHE CZ     C  Y N 431 
PHE OXT    O  N N 432 
PHE H      H  N N 433 
PHE H2     H  N N 434 
PHE HA     H  N N 435 
PHE HB2    H  N N 436 
PHE HB3    H  N N 437 
PHE HD1    H  N N 438 
PHE HD2    H  N N 439 
PHE HE1    H  N N 440 
PHE HE2    H  N N 441 
PHE HZ     H  N N 442 
PHE HXT    H  N N 443 
PRO N      N  N N 444 
PRO CA     C  N S 445 
PRO C      C  N N 446 
PRO O      O  N N 447 
PRO CB     C  N N 448 
PRO CG     C  N N 449 
PRO CD     C  N N 450 
PRO OXT    O  N N 451 
PRO H      H  N N 452 
PRO HA     H  N N 453 
PRO HB2    H  N N 454 
PRO HB3    H  N N 455 
PRO HG2    H  N N 456 
PRO HG3    H  N N 457 
PRO HD2    H  N N 458 
PRO HD3    H  N N 459 
PRO HXT    H  N N 460 
SER N      N  N N 461 
SER CA     C  N S 462 
SER C      C  N N 463 
SER O      O  N N 464 
SER CB     C  N N 465 
SER OG     O  N N 466 
SER OXT    O  N N 467 
SER H      H  N N 468 
SER H2     H  N N 469 
SER HA     H  N N 470 
SER HB2    H  N N 471 
SER HB3    H  N N 472 
SER HG     H  N N 473 
SER HXT    H  N N 474 
THR N      N  N N 475 
THR CA     C  N S 476 
THR C      C  N N 477 
THR O      O  N N 478 
THR CB     C  N R 479 
THR OG1    O  N N 480 
THR CG2    C  N N 481 
THR OXT    O  N N 482 
THR H      H  N N 483 
THR H2     H  N N 484 
THR HA     H  N N 485 
THR HB     H  N N 486 
THR HG1    H  N N 487 
THR HG21   H  N N 488 
THR HG22   H  N N 489 
THR HG23   H  N N 490 
THR HXT    H  N N 491 
TRP N      N  N N 492 
TRP CA     C  N S 493 
TRP C      C  N N 494 
TRP O      O  N N 495 
TRP CB     C  N N 496 
TRP CG     C  Y N 497 
TRP CD1    C  Y N 498 
TRP CD2    C  Y N 499 
TRP NE1    N  Y N 500 
TRP CE2    C  Y N 501 
TRP CE3    C  Y N 502 
TRP CZ2    C  Y N 503 
TRP CZ3    C  Y N 504 
TRP CH2    C  Y N 505 
TRP OXT    O  N N 506 
TRP H      H  N N 507 
TRP H2     H  N N 508 
TRP HA     H  N N 509 
TRP HB2    H  N N 510 
TRP HB3    H  N N 511 
TRP HD1    H  N N 512 
TRP HE1    H  N N 513 
TRP HE3    H  N N 514 
TRP HZ2    H  N N 515 
TRP HZ3    H  N N 516 
TRP HH2    H  N N 517 
TRP HXT    H  N N 518 
TYR N      N  N N 519 
TYR CA     C  N S 520 
TYR C      C  N N 521 
TYR O      O  N N 522 
TYR CB     C  N N 523 
TYR CG     C  Y N 524 
TYR CD1    C  Y N 525 
TYR CD2    C  Y N 526 
TYR CE1    C  Y N 527 
TYR CE2    C  Y N 528 
TYR CZ     C  Y N 529 
TYR OH     O  N N 530 
TYR OXT    O  N N 531 
TYR H      H  N N 532 
TYR H2     H  N N 533 
TYR HA     H  N N 534 
TYR HB2    H  N N 535 
TYR HB3    H  N N 536 
TYR HD1    H  N N 537 
TYR HD2    H  N N 538 
TYR HE1    H  N N 539 
TYR HE2    H  N N 540 
TYR HH     H  N N 541 
TYR HXT    H  N N 542 
VAL N      N  N N 543 
VAL CA     C  N S 544 
VAL C      C  N N 545 
VAL O      O  N N 546 
VAL CB     C  N N 547 
VAL CG1    C  N N 548 
VAL CG2    C  N N 549 
VAL OXT    O  N N 550 
VAL H      H  N N 551 
VAL H2     H  N N 552 
VAL HA     H  N N 553 
VAL HB     H  N N 554 
VAL HG11   H  N N 555 
VAL HG12   H  N N 556 
VAL HG13   H  N N 557 
VAL HG21   H  N N 558 
VAL HG22   H  N N 559 
VAL HG23   H  N N 560 
VAL HXT    H  N N 561 
ZN  ZN     ZN N N 562 
# 
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 
0G6 N     CA     sing N N 1   
0G6 N     H      sing N N 2   
0G6 N     H2     sing N N 3   
0G6 CA    C      sing N N 4   
0G6 CA    CB     sing N N 5   
0G6 CA    HA     sing N N 6   
0G6 C     O      doub N N 7   
0G6 C     N1     sing N N 8   
0G6 CB    CG     sing N N 9   
0G6 CB    HB2    sing N N 10  
0G6 CB    HB3    sing N N 11  
0G6 CG    CD1    doub Y N 12  
0G6 CG    CD2    sing Y N 13  
0G6 CD1   CE1    sing Y N 14  
0G6 CD1   HD1    sing N N 15  
0G6 CD2   CE2    doub Y N 16  
0G6 CD2   HD2    sing N N 17  
0G6 CE1   CZ     doub Y N 18  
0G6 CE1   HE1    sing N N 19  
0G6 CE2   CZ     sing Y N 20  
0G6 CE2   HE2    sing N N 21  
0G6 CZ    HZ     sing N N 22  
0G6 N1    CA1    sing N N 23  
0G6 N1    CD     sing N N 24  
0G6 CA1   C1     sing N N 25  
0G6 CA1   CB1    sing N N 26  
0G6 CA1   HA1    sing N N 27  
0G6 C1    O1     doub N N 28  
0G6 C1    N2     sing N N 29  
0G6 CB1   CG1    sing N N 30  
0G6 CB1   HB21   sing N N 31  
0G6 CB1   HB31   sing N N 32  
0G6 CG1   CD     sing N N 33  
0G6 CG1   HG2    sing N N 34  
0G6 CG1   HG3    sing N N 35  
0G6 CD    HD21   sing N N 36  
0G6 CD    HD3    sing N N 37  
0G6 N2    CA2    sing N N 38  
0G6 N2    H1     sing N N 39  
0G6 CA2   C2     sing N N 40  
0G6 CA2   CB2    sing N N 41  
0G6 CA2   HA2    sing N N 42  
0G6 C2    O2     sing N N 43  
0G6 C2    C3     sing N N 44  
0G6 CB2   CG2    sing N N 45  
0G6 CB2   HB22   sing N N 46  
0G6 CB2   HB32   sing N N 47  
0G6 CG2   CD3    sing N N 48  
0G6 CG2   HG21   sing N N 49  
0G6 CG2   HG31   sing N N 50  
0G6 CD3   NE     sing N N 51  
0G6 CD3   HD22   sing N N 52  
0G6 CD3   HD31   sing N N 53  
0G6 NE    CZ1    sing N N 54  
0G6 NE    HE     sing N N 55  
0G6 CZ1   NH1    sing N N 56  
0G6 CZ1   NH2    doub N N 57  
0G6 NH1   HH11   sing N N 58  
0G6 NH1   HH12   sing N N 59  
0G6 NH2   HH21   sing N N 60  
0G6 NH2   HH22   sing N N 61  
0G6 C3    H11    sing N N 62  
0G6 C3    H21    sing N N 63  
0G6 CL    C3     sing N N 64  
0G6 C2    H33    sing N N 65  
0G6 O2    H34    sing N N 66  
ALA N     CA     sing N N 67  
ALA N     H      sing N N 68  
ALA N     H2     sing N N 69  
ALA CA    C      sing N N 70  
ALA CA    CB     sing N N 71  
ALA CA    HA     sing N N 72  
ALA C     O      doub N N 73  
ALA C     OXT    sing N N 74  
ALA CB    HB1    sing N N 75  
ALA CB    HB2    sing N N 76  
ALA CB    HB3    sing N N 77  
ALA OXT   HXT    sing N N 78  
ARG N     CA     sing N N 79  
ARG N     H      sing N N 80  
ARG N     H2     sing N N 81  
ARG CA    C      sing N N 82  
ARG CA    CB     sing N N 83  
ARG CA    HA     sing N N 84  
ARG C     O      doub N N 85  
ARG C     OXT    sing N N 86  
ARG CB    CG     sing N N 87  
ARG CB    HB2    sing N N 88  
ARG CB    HB3    sing N N 89  
ARG CG    CD     sing N N 90  
ARG CG    HG2    sing N N 91  
ARG CG    HG3    sing N N 92  
ARG CD    NE     sing N N 93  
ARG CD    HD2    sing N N 94  
ARG CD    HD3    sing N N 95  
ARG NE    CZ     sing N N 96  
ARG NE    HE     sing N N 97  
ARG CZ    NH1    sing N N 98  
ARG CZ    NH2    doub N N 99  
ARG NH1   HH11   sing N N 100 
ARG NH1   HH12   sing N N 101 
ARG NH2   HH21   sing N N 102 
ARG NH2   HH22   sing N N 103 
ARG OXT   HXT    sing N N 104 
ASN N     CA     sing N N 105 
ASN N     H      sing N N 106 
ASN N     H2     sing N N 107 
ASN CA    C      sing N N 108 
ASN CA    CB     sing N N 109 
ASN CA    HA     sing N N 110 
ASN C     O      doub N N 111 
ASN C     OXT    sing N N 112 
ASN CB    CG     sing N N 113 
ASN CB    HB2    sing N N 114 
ASN CB    HB3    sing N N 115 
ASN CG    OD1    doub N N 116 
ASN CG    ND2    sing N N 117 
ASN ND2   HD21   sing N N 118 
ASN ND2   HD22   sing N N 119 
ASN OXT   HXT    sing N N 120 
ASP N     CA     sing N N 121 
ASP N     H      sing N N 122 
ASP N     H2     sing N N 123 
ASP CA    C      sing N N 124 
ASP CA    CB     sing N N 125 
ASP CA    HA     sing N N 126 
ASP C     O      doub N N 127 
ASP C     OXT    sing N N 128 
ASP CB    CG     sing N N 129 
ASP CB    HB2    sing N N 130 
ASP CB    HB3    sing N N 131 
ASP CG    OD1    doub N N 132 
ASP CG    OD2    sing N N 133 
ASP OD2   HD2    sing N N 134 
ASP OXT   HXT    sing N N 135 
CYS N     CA     sing N N 136 
CYS N     H      sing N N 137 
CYS N     H2     sing N N 138 
CYS CA    C      sing N N 139 
CYS CA    CB     sing N N 140 
CYS CA    HA     sing N N 141 
CYS C     O      doub N N 142 
CYS C     OXT    sing N N 143 
CYS CB    SG     sing N N 144 
CYS CB    HB2    sing N N 145 
CYS CB    HB3    sing N N 146 
CYS SG    HG     sing N N 147 
CYS OXT   HXT    sing N N 148 
DG  OP3   P      sing N N 149 
DG  OP3   HOP3   sing N N 150 
DG  P     OP1    doub N N 151 
DG  P     OP2    sing N N 152 
DG  P     "O5'"  sing N N 153 
DG  OP2   HOP2   sing N N 154 
DG  "O5'" "C5'"  sing N N 155 
DG  "C5'" "C4'"  sing N N 156 
DG  "C5'" "H5'"  sing N N 157 
DG  "C5'" "H5''" sing N N 158 
DG  "C4'" "O4'"  sing N N 159 
DG  "C4'" "C3'"  sing N N 160 
DG  "C4'" "H4'"  sing N N 161 
DG  "O4'" "C1'"  sing N N 162 
DG  "C3'" "O3'"  sing N N 163 
DG  "C3'" "C2'"  sing N N 164 
DG  "C3'" "H3'"  sing N N 165 
DG  "O3'" "HO3'" sing N N 166 
DG  "C2'" "C1'"  sing N N 167 
DG  "C2'" "H2'"  sing N N 168 
DG  "C2'" "H2''" sing N N 169 
DG  "C1'" N9     sing N N 170 
DG  "C1'" "H1'"  sing N N 171 
DG  N9    C8     sing Y N 172 
DG  N9    C4     sing Y N 173 
DG  C8    N7     doub Y N 174 
DG  C8    H8     sing N N 175 
DG  N7    C5     sing Y N 176 
DG  C5    C6     sing N N 177 
DG  C5    C4     doub Y N 178 
DG  C6    O6     doub N N 179 
DG  C6    N1     sing N N 180 
DG  N1    C2     sing N N 181 
DG  N1    H1     sing N N 182 
DG  C2    N2     sing N N 183 
DG  C2    N3     doub N N 184 
DG  N2    H21    sing N N 185 
DG  N2    H22    sing N N 186 
DG  N3    C4     sing N N 187 
DT  OP3   P      sing N N 188 
DT  OP3   HOP3   sing N N 189 
DT  P     OP1    doub N N 190 
DT  P     OP2    sing N N 191 
DT  P     "O5'"  sing N N 192 
DT  OP2   HOP2   sing N N 193 
DT  "O5'" "C5'"  sing N N 194 
DT  "C5'" "C4'"  sing N N 195 
DT  "C5'" "H5'"  sing N N 196 
DT  "C5'" "H5''" sing N N 197 
DT  "C4'" "O4'"  sing N N 198 
DT  "C4'" "C3'"  sing N N 199 
DT  "C4'" "H4'"  sing N N 200 
DT  "O4'" "C1'"  sing N N 201 
DT  "C3'" "O3'"  sing N N 202 
DT  "C3'" "C2'"  sing N N 203 
DT  "C3'" "H3'"  sing N N 204 
DT  "O3'" "HO3'" sing N N 205 
DT  "C2'" "C1'"  sing N N 206 
DT  "C2'" "H2'"  sing N N 207 
DT  "C2'" "H2''" sing N N 208 
DT  "C1'" N1     sing N N 209 
DT  "C1'" "H1'"  sing N N 210 
DT  N1    C2     sing N N 211 
DT  N1    C6     sing N N 212 
DT  C2    O2     doub N N 213 
DT  C2    N3     sing N N 214 
DT  N3    C4     sing N N 215 
DT  N3    H3     sing N N 216 
DT  C4    O4     doub N N 217 
DT  C4    C5     sing N N 218 
DT  C5    C7     sing N N 219 
DT  C5    C6     doub N N 220 
DT  C7    H71    sing N N 221 
DT  C7    H72    sing N N 222 
DT  C7    H73    sing N N 223 
DT  C6    H6     sing N N 224 
GLN N     CA     sing N N 225 
GLN N     H      sing N N 226 
GLN N     H2     sing N N 227 
GLN CA    C      sing N N 228 
GLN CA    CB     sing N N 229 
GLN CA    HA     sing N N 230 
GLN C     O      doub N N 231 
GLN C     OXT    sing N N 232 
GLN CB    CG     sing N N 233 
GLN CB    HB2    sing N N 234 
GLN CB    HB3    sing N N 235 
GLN CG    CD     sing N N 236 
GLN CG    HG2    sing N N 237 
GLN CG    HG3    sing N N 238 
GLN CD    OE1    doub N N 239 
GLN CD    NE2    sing N N 240 
GLN NE2   HE21   sing N N 241 
GLN NE2   HE22   sing N N 242 
GLN OXT   HXT    sing N N 243 
GLU N     CA     sing N N 244 
GLU N     H      sing N N 245 
GLU N     H2     sing N N 246 
GLU CA    C      sing N N 247 
GLU CA    CB     sing N N 248 
GLU CA    HA     sing N N 249 
GLU C     O      doub N N 250 
GLU C     OXT    sing N N 251 
GLU CB    CG     sing N N 252 
GLU CB    HB2    sing N N 253 
GLU CB    HB3    sing N N 254 
GLU CG    CD     sing N N 255 
GLU CG    HG2    sing N N 256 
GLU CG    HG3    sing N N 257 
GLU CD    OE1    doub N N 258 
GLU CD    OE2    sing N N 259 
GLU OE2   HE2    sing N N 260 
GLU OXT   HXT    sing N N 261 
GLY N     CA     sing N N 262 
GLY N     H      sing N N 263 
GLY N     H2     sing N N 264 
GLY CA    C      sing N N 265 
GLY CA    HA2    sing N N 266 
GLY CA    HA3    sing N N 267 
GLY C     O      doub N N 268 
GLY C     OXT    sing N N 269 
GLY OXT   HXT    sing N N 270 
HIS N     CA     sing N N 271 
HIS N     H      sing N N 272 
HIS N     H2     sing N N 273 
HIS CA    C      sing N N 274 
HIS CA    CB     sing N N 275 
HIS CA    HA     sing N N 276 
HIS C     O      doub N N 277 
HIS C     OXT    sing N N 278 
HIS CB    CG     sing N N 279 
HIS CB    HB2    sing N N 280 
HIS CB    HB3    sing N N 281 
HIS CG    ND1    sing Y N 282 
HIS CG    CD2    doub Y N 283 
HIS ND1   CE1    doub Y N 284 
HIS ND1   HD1    sing N N 285 
HIS CD2   NE2    sing Y N 286 
HIS CD2   HD2    sing N N 287 
HIS CE1   NE2    sing Y N 288 
HIS CE1   HE1    sing N N 289 
HIS NE2   HE2    sing N N 290 
HIS OXT   HXT    sing N N 291 
HOH O     H1     sing N N 292 
HOH O     H2     sing N N 293 
ILE N     CA     sing N N 294 
ILE N     H      sing N N 295 
ILE N     H2     sing N N 296 
ILE CA    C      sing N N 297 
ILE CA    CB     sing N N 298 
ILE CA    HA     sing N N 299 
ILE C     O      doub N N 300 
ILE C     OXT    sing N N 301 
ILE CB    CG1    sing N N 302 
ILE CB    CG2    sing N N 303 
ILE CB    HB     sing N N 304 
ILE CG1   CD1    sing N N 305 
ILE CG1   HG12   sing N N 306 
ILE CG1   HG13   sing N N 307 
ILE CG2   HG21   sing N N 308 
ILE CG2   HG22   sing N N 309 
ILE CG2   HG23   sing N N 310 
ILE CD1   HD11   sing N N 311 
ILE CD1   HD12   sing N N 312 
ILE CD1   HD13   sing N N 313 
ILE OXT   HXT    sing N N 314 
LEU N     CA     sing N N 315 
LEU N     H      sing N N 316 
LEU N     H2     sing N N 317 
LEU CA    C      sing N N 318 
LEU CA    CB     sing N N 319 
LEU CA    HA     sing N N 320 
LEU C     O      doub N N 321 
LEU C     OXT    sing N N 322 
LEU CB    CG     sing N N 323 
LEU CB    HB2    sing N N 324 
LEU CB    HB3    sing N N 325 
LEU CG    CD1    sing N N 326 
LEU CG    CD2    sing N N 327 
LEU CG    HG     sing N N 328 
LEU CD1   HD11   sing N N 329 
LEU CD1   HD12   sing N N 330 
LEU CD1   HD13   sing N N 331 
LEU CD2   HD21   sing N N 332 
LEU CD2   HD22   sing N N 333 
LEU CD2   HD23   sing N N 334 
LEU OXT   HXT    sing N N 335 
LYS N     CA     sing N N 336 
LYS N     H      sing N N 337 
LYS N     H2     sing N N 338 
LYS CA    C      sing N N 339 
LYS CA    CB     sing N N 340 
LYS CA    HA     sing N N 341 
LYS C     O      doub N N 342 
LYS C     OXT    sing N N 343 
LYS CB    CG     sing N N 344 
LYS CB    HB2    sing N N 345 
LYS CB    HB3    sing N N 346 
LYS CG    CD     sing N N 347 
LYS CG    HG2    sing N N 348 
LYS CG    HG3    sing N N 349 
LYS CD    CE     sing N N 350 
LYS CD    HD2    sing N N 351 
LYS CD    HD3    sing N N 352 
LYS CE    NZ     sing N N 353 
LYS CE    HE2    sing N N 354 
LYS CE    HE3    sing N N 355 
LYS NZ    HZ1    sing N N 356 
LYS NZ    HZ2    sing N N 357 
LYS NZ    HZ3    sing N N 358 
LYS OXT   HXT    sing N N 359 
MET N     CA     sing N N 360 
MET N     H      sing N N 361 
MET N     H2     sing N N 362 
MET CA    C      sing N N 363 
MET CA    CB     sing N N 364 
MET CA    HA     sing N N 365 
MET C     O      doub N N 366 
MET C     OXT    sing N N 367 
MET CB    CG     sing N N 368 
MET CB    HB2    sing N N 369 
MET CB    HB3    sing N N 370 
MET CG    SD     sing N N 371 
MET CG    HG2    sing N N 372 
MET CG    HG3    sing N N 373 
MET SD    CE     sing N N 374 
MET CE    HE1    sing N N 375 
MET CE    HE2    sing N N 376 
MET CE    HE3    sing N N 377 
MET OXT   HXT    sing N N 378 
NAG C1    C2     sing N N 379 
NAG C1    O1     sing N N 380 
NAG C1    O5     sing N N 381 
NAG C1    H1     sing N N 382 
NAG C2    C3     sing N N 383 
NAG C2    N2     sing N N 384 
NAG C2    H2     sing N N 385 
NAG C3    C4     sing N N 386 
NAG C3    O3     sing N N 387 
NAG C3    H3     sing N N 388 
NAG C4    C5     sing N N 389 
NAG C4    O4     sing N N 390 
NAG C4    H4     sing N N 391 
NAG C5    C6     sing N N 392 
NAG C5    O5     sing N N 393 
NAG C5    H5     sing N N 394 
NAG C6    O6     sing N N 395 
NAG C6    H61    sing N N 396 
NAG C6    H62    sing N N 397 
NAG C7    C8     sing N N 398 
NAG C7    N2     sing N N 399 
NAG C7    O7     doub N N 400 
NAG C8    H81    sing N N 401 
NAG C8    H82    sing N N 402 
NAG C8    H83    sing N N 403 
NAG N2    HN2    sing N N 404 
NAG O1    HO1    sing N N 405 
NAG O3    HO3    sing N N 406 
NAG O4    HO4    sing N N 407 
NAG O6    HO6    sing N N 408 
PHE N     CA     sing N N 409 
PHE N     H      sing N N 410 
PHE N     H2     sing N N 411 
PHE CA    C      sing N N 412 
PHE CA    CB     sing N N 413 
PHE CA    HA     sing N N 414 
PHE C     O      doub N N 415 
PHE C     OXT    sing N N 416 
PHE CB    CG     sing N N 417 
PHE CB    HB2    sing N N 418 
PHE CB    HB3    sing N N 419 
PHE CG    CD1    doub Y N 420 
PHE CG    CD2    sing Y N 421 
PHE CD1   CE1    sing Y N 422 
PHE CD1   HD1    sing N N 423 
PHE CD2   CE2    doub Y N 424 
PHE CD2   HD2    sing N N 425 
PHE CE1   CZ     doub Y N 426 
PHE CE1   HE1    sing N N 427 
PHE CE2   CZ     sing Y N 428 
PHE CE2   HE2    sing N N 429 
PHE CZ    HZ     sing N N 430 
PHE OXT   HXT    sing N N 431 
PRO N     CA     sing N N 432 
PRO N     CD     sing N N 433 
PRO N     H      sing N N 434 
PRO CA    C      sing N N 435 
PRO CA    CB     sing N N 436 
PRO CA    HA     sing N N 437 
PRO C     O      doub N N 438 
PRO C     OXT    sing N N 439 
PRO CB    CG     sing N N 440 
PRO CB    HB2    sing N N 441 
PRO CB    HB3    sing N N 442 
PRO CG    CD     sing N N 443 
PRO CG    HG2    sing N N 444 
PRO CG    HG3    sing N N 445 
PRO CD    HD2    sing N N 446 
PRO CD    HD3    sing N N 447 
PRO OXT   HXT    sing N N 448 
SER N     CA     sing N N 449 
SER N     H      sing N N 450 
SER N     H2     sing N N 451 
SER CA    C      sing N N 452 
SER CA    CB     sing N N 453 
SER CA    HA     sing N N 454 
SER C     O      doub N N 455 
SER C     OXT    sing N N 456 
SER CB    OG     sing N N 457 
SER CB    HB2    sing N N 458 
SER CB    HB3    sing N N 459 
SER OG    HG     sing N N 460 
SER OXT   HXT    sing N N 461 
THR N     CA     sing N N 462 
THR N     H      sing N N 463 
THR N     H2     sing N N 464 
THR CA    C      sing N N 465 
THR CA    CB     sing N N 466 
THR CA    HA     sing N N 467 
THR C     O      doub N N 468 
THR C     OXT    sing N N 469 
THR CB    OG1    sing N N 470 
THR CB    CG2    sing N N 471 
THR CB    HB     sing N N 472 
THR OG1   HG1    sing N N 473 
THR CG2   HG21   sing N N 474 
THR CG2   HG22   sing N N 475 
THR CG2   HG23   sing N N 476 
THR OXT   HXT    sing N N 477 
TRP N     CA     sing N N 478 
TRP N     H      sing N N 479 
TRP N     H2     sing N N 480 
TRP CA    C      sing N N 481 
TRP CA    CB     sing N N 482 
TRP CA    HA     sing N N 483 
TRP C     O      doub N N 484 
TRP C     OXT    sing N N 485 
TRP CB    CG     sing N N 486 
TRP CB    HB2    sing N N 487 
TRP CB    HB3    sing N N 488 
TRP CG    CD1    doub Y N 489 
TRP CG    CD2    sing Y N 490 
TRP CD1   NE1    sing Y N 491 
TRP CD1   HD1    sing N N 492 
TRP CD2   CE2    doub Y N 493 
TRP CD2   CE3    sing Y N 494 
TRP NE1   CE2    sing Y N 495 
TRP NE1   HE1    sing N N 496 
TRP CE2   CZ2    sing Y N 497 
TRP CE3   CZ3    doub Y N 498 
TRP CE3   HE3    sing N N 499 
TRP CZ2   CH2    doub Y N 500 
TRP CZ2   HZ2    sing N N 501 
TRP CZ3   CH2    sing Y N 502 
TRP CZ3   HZ3    sing N N 503 
TRP CH2   HH2    sing N N 504 
TRP OXT   HXT    sing N N 505 
TYR N     CA     sing N N 506 
TYR N     H      sing N N 507 
TYR N     H2     sing N N 508 
TYR CA    C      sing N N 509 
TYR CA    CB     sing N N 510 
TYR CA    HA     sing N N 511 
TYR C     O      doub N N 512 
TYR C     OXT    sing N N 513 
TYR CB    CG     sing N N 514 
TYR CB    HB2    sing N N 515 
TYR CB    HB3    sing N N 516 
TYR CG    CD1    doub Y N 517 
TYR CG    CD2    sing Y N 518 
TYR CD1   CE1    sing Y N 519 
TYR CD1   HD1    sing N N 520 
TYR CD2   CE2    doub Y N 521 
TYR CD2   HD2    sing N N 522 
TYR CE1   CZ     doub Y N 523 
TYR CE1   HE1    sing N N 524 
TYR CE2   CZ     sing Y N 525 
TYR CE2   HE2    sing N N 526 
TYR CZ    OH     sing N N 527 
TYR OH    HH     sing N N 528 
TYR OXT   HXT    sing N N 529 
VAL N     CA     sing N N 530 
VAL N     H      sing N N 531 
VAL N     H2     sing N N 532 
VAL CA    C      sing N N 533 
VAL CA    CB     sing N N 534 
VAL CA    HA     sing N N 535 
VAL C     O      doub N N 536 
VAL C     OXT    sing N N 537 
VAL CB    CG1    sing N N 538 
VAL CB    CG2    sing N N 539 
VAL CB    HB     sing N N 540 
VAL CG1   HG11   sing N N 541 
VAL CG1   HG12   sing N N 542 
VAL CG1   HG13   sing N N 543 
VAL CG2   HG21   sing N N 544 
VAL CG2   HG22   sing N N 545 
VAL CG2   HG23   sing N N 546 
VAL OXT   HXT    sing N N 547 
# 
loop_
_pdbx_initial_refinement_model.id 
_pdbx_initial_refinement_model.entity_id_list 
_pdbx_initial_refinement_model.type 
_pdbx_initial_refinement_model.source_name 
_pdbx_initial_refinement_model.accession_code 
_pdbx_initial_refinement_model.details 
1 ? 'experimental model' PDB 3QLP 'PDB ENTRY 3QLP AND 1HAO' 
2 ? 'experimental model' PDB 1HAO 'PDB ENTRY 3QLP AND 1HAO' 
# 
_atom_sites.entry_id                    4DII 
_atom_sites.fract_transf_matrix[1][1]   0.023058 
_atom_sites.fract_transf_matrix[1][2]   -0.008548 
_atom_sites.fract_transf_matrix[1][3]   0.001602 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.023544 
_atom_sites.fract_transf_matrix[2][3]   -0.009038 
_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]   0.020840 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
# 
loop_
_atom_type.symbol 
C  
CL 
K  
N  
NA 
O  
P  
S  
ZN 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N  N     . ALA A 1  7   B -15.695 -1.554  6.372   1.00 41.21 ? 1   ALA L N     1 
ATOM   2    C  CA    . ALA A 1  7   B -14.479 -2.253  6.916   1.00 39.77 ? 1   ALA L CA    1 
ATOM   3    C  C     . ALA A 1  7   B -14.293 -2.001  8.428   1.00 38.32 ? 1   ALA L C     1 
ATOM   4    O  O     . ALA A 1  7   B -14.948 -1.130  9.026   1.00 36.69 ? 1   ALA L O     1 
ATOM   5    C  CB    . ALA A 1  7   B -13.215 -1.804  6.154   1.00 41.52 ? 1   ALA L CB    1 
ATOM   6    N  N     . ASP A 1  8   A -13.424 -2.797  9.046   1.00 35.73 ? 1   ASP L N     1 
ATOM   7    C  CA    . ASP A 1  8   A -13.177 -2.618  10.485  1.00 33.81 ? 1   ASP L CA    1 
ATOM   8    C  C     . ASP A 1  8   A -12.001 -1.620  10.618  1.00 32.24 ? 1   ASP L C     1 
ATOM   9    O  O     . ASP A 1  8   A -10.833 -2.022  10.689  1.00 34.25 ? 1   ASP L O     1 
ATOM   10   C  CB    . ASP A 1  8   A -12.875 -3.996  11.151  1.00 31.58 ? 1   ASP L CB    1 
ATOM   11   C  CG    . ASP A 1  8   A -12.568 -3.887  12.648  1.00 31.54 ? 1   ASP L CG    1 
ATOM   12   O  OD1   . ASP A 1  8   A -12.055 -4.864  13.277  1.00 26.38 ? 1   ASP L OD1   1 
ATOM   13   O  OD2   . ASP A 1  8   A -12.849 -2.810  13.206  1.00 29.72 ? 1   ASP L OD2   1 
ATOM   14   N  N     . CYS A 1  9   ? -12.316 -0.326  10.618  1.00 28.93 ? 1   CYS L N     1 
ATOM   15   C  CA    . CYS A 1  9   ? -11.289 0.726   10.742  1.00 27.36 ? 1   CYS L CA    1 
ATOM   16   C  C     . CYS A 1  9   ? -11.878 1.927   11.422  1.00 26.64 ? 1   CYS L C     1 
ATOM   17   O  O     . CYS A 1  9   ? -13.090 2.140   11.365  1.00 23.54 ? 1   CYS L O     1 
ATOM   18   C  CB    . CYS A 1  9   ? -10.776 1.232   9.356   1.00 25.67 ? 1   CYS L CB    1 
ATOM   19   S  SG    . CYS A 1  9   ? -12.048 2.041   8.281   1.00 27.05 ? 1   CYS L SG    1 
ATOM   20   N  N     . GLY A 1  10  ? -11.001 2.730   12.025  1.00 25.86 ? 2   GLY L N     1 
ATOM   21   C  CA    . GLY A 1  10  ? -11.452 3.973   12.611  1.00 26.78 ? 2   GLY L CA    1 
ATOM   22   C  C     . GLY A 1  10  ? -12.288 3.940   13.868  1.00 26.67 ? 2   GLY L C     1 
ATOM   23   O  O     . GLY A 1  10  ? -12.681 5.016   14.337  1.00 27.19 ? 2   GLY L O     1 
ATOM   24   N  N     . LEU A 1  11  ? -12.565 2.742   14.404  1.00 26.03 ? 3   LEU L N     1 
ATOM   25   C  CA    . LEU A 1  11  ? -13.308 2.631   15.650  1.00 27.17 ? 3   LEU L CA    1 
ATOM   26   C  C     . LEU A 1  11  ? -12.398 2.015   16.698  1.00 26.12 ? 3   LEU L C     1 
ATOM   27   O  O     . LEU A 1  11  ? -11.951 0.885   16.552  1.00 25.20 ? 3   LEU L O     1 
ATOM   28   C  CB    . LEU A 1  11  ? -14.534 1.729   15.482  1.00 28.90 ? 3   LEU L CB    1 
ATOM   29   C  CG    . LEU A 1  11  ? -15.518 2.278   14.455  1.00 31.73 ? 3   LEU L CG    1 
ATOM   30   C  CD1   . LEU A 1  11  ? -16.715 1.299   14.350  1.00 30.62 ? 3   LEU L CD1   1 
ATOM   31   C  CD2   . LEU A 1  11  ? -15.948 3.722   14.819  1.00 30.96 ? 3   LEU L CD2   1 
ATOM   32   N  N     . ARG A 1  12  ? -12.156 2.733   17.773  1.00 24.58 ? 4   ARG L N     1 
ATOM   33   C  CA    . ARG A 1  12  ? -11.264 2.229   18.810  1.00 24.32 ? 4   ARG L CA    1 
ATOM   34   C  C     . ARG A 1  12  ? -11.969 1.408   19.866  1.00 26.08 ? 4   ARG L C     1 
ATOM   35   O  O     . ARG A 1  12  ? -12.983 1.850   20.424  1.00 27.24 ? 4   ARG L O     1 
ATOM   36   C  CB    . ARG A 1  12  ? -10.589 3.429   19.459  1.00 23.82 ? 4   ARG L CB    1 
ATOM   37   C  CG    . ARG A 1  12  ? -9.969  4.360   18.458  1.00 21.99 ? 4   ARG L CG    1 
ATOM   38   C  CD    . ARG A 1  12  ? -9.535  5.735   19.128  1.00 24.21 ? 4   ARG L CD    1 
ATOM   39   N  NE    . ARG A 1  12  ? -10.691 6.499   19.573  1.00 23.73 ? 4   ARG L NE    1 
ATOM   40   C  CZ    . ARG A 1  12  ? -10.632 7.705   20.148  1.00 26.88 ? 4   ARG L CZ    1 
ATOM   41   N  NH1   . ARG A 1  12  ? -9.439  8.306   20.356  1.00 23.78 ? 4   ARG L NH1   1 
ATOM   42   N  NH2   . ARG A 1  12  ? -11.765 8.328   20.498  1.00 25.11 ? 4   ARG L NH2   1 
ATOM   43   N  N     . PRO A 1  13  ? -11.470 0.194   20.152  1.00 27.34 ? 5   PRO L N     1 
ATOM   44   C  CA    . PRO A 1  13  ? -12.045 -0.707  21.155  1.00 28.52 ? 5   PRO L CA    1 
ATOM   45   C  C     . PRO A 1  13  ? -12.243 -0.068  22.552  1.00 29.29 ? 5   PRO L C     1 
ATOM   46   O  O     . PRO A 1  13  ? -13.260 -0.284  23.215  1.00 28.51 ? 5   PRO L O     1 
ATOM   47   C  CB    . PRO A 1  13  ? -11.033 -1.852  21.196  1.00 28.50 ? 5   PRO L CB    1 
ATOM   48   C  CG    . PRO A 1  13  ? -10.704 -2.019  19.769  1.00 28.00 ? 5   PRO L CG    1 
ATOM   49   C  CD    . PRO A 1  13  ? -10.449 -0.532  19.366  1.00 30.80 ? 5   PRO L CD    1 
ATOM   50   N  N     . LEU A 1  14  ? -11.280 0.743   22.966  1.00 27.79 ? 6   LEU L N     1 
ATOM   51   C  CA    . LEU A 1  14  ? -11.365 1.355   24.268  1.00 28.16 ? 6   LEU L CA    1 
ATOM   52   C  C     . LEU A 1  14  ? -12.125 2.663   24.265  1.00 27.46 ? 6   LEU L C     1 
ATOM   53   O  O     . LEU A 1  14  ? -12.335 3.219   25.310  1.00 28.11 ? 6   LEU L O     1 
ATOM   54   C  CB    . LEU A 1  14  ? -9.967  1.513   24.863  1.00 26.56 ? 6   LEU L CB    1 
ATOM   55   C  CG    . LEU A 1  14  ? -9.323  0.387   25.733  1.00 31.45 ? 6   LEU L CG    1 
ATOM   56   C  CD1   . LEU A 1  14  ? -10.011 -1.004  25.581  1.00 32.07 ? 6   LEU L CD1   1 
ATOM   57   C  CD2   . LEU A 1  14  ? -7.830  0.295   25.414  1.00 29.99 ? 6   LEU L CD2   1 
ATOM   58   N  N     . PHE A 1  15  ? -12.574 3.155   23.113  1.00 28.19 ? 7   PHE L N     1 
ATOM   59   C  CA    . PHE A 1  15  ? -13.338 4.396   23.132  1.00 28.01 ? 7   PHE L CA    1 
ATOM   60   C  C     . PHE A 1  15  ? -14.695 4.275   22.437  1.00 29.15 ? 7   PHE L C     1 
ATOM   61   O  O     . PHE A 1  15  ? -15.730 4.056   23.109  1.00 29.18 ? 7   PHE L O     1 
ATOM   62   C  CB    . PHE A 1  15  ? -12.483 5.564   22.583  1.00 26.13 ? 7   PHE L CB    1 
ATOM   63   C  CG    . PHE A 1  15  ? -11.323 5.909   23.478  1.00 26.43 ? 7   PHE L CG    1 
ATOM   64   C  CD1   . PHE A 1  15  ? -11.507 6.727   24.585  1.00 26.86 ? 7   PHE L CD1   1 
ATOM   65   C  CD2   . PHE A 1  15  ? -10.078 5.280   23.316  1.00 25.56 ? 7   PHE L CD2   1 
ATOM   66   C  CE1   . PHE A 1  15  ? -10.488 6.914   25.544  1.00 25.91 ? 7   PHE L CE1   1 
ATOM   67   C  CE2   . PHE A 1  15  ? -9.050  5.466   24.269  1.00 27.72 ? 7   PHE L CE2   1 
ATOM   68   C  CZ    . PHE A 1  15  ? -9.266  6.285   25.384  1.00 25.01 ? 7   PHE L CZ    1 
ATOM   69   N  N     . GLU A 1  16  ? -14.717 4.387   21.113  1.00 28.77 ? 8   GLU L N     1 
ATOM   70   C  CA    . GLU A 1  16  ? -15.977 4.316   20.413  1.00 29.37 ? 8   GLU L CA    1 
ATOM   71   C  C     . GLU A 1  16  ? -16.751 3.039   20.735  1.00 31.22 ? 8   GLU L C     1 
ATOM   72   O  O     . GLU A 1  16  ? -17.960 3.077   20.904  1.00 29.55 ? 8   GLU L O     1 
ATOM   73   C  CB    . GLU A 1  16  ? -15.784 4.439   18.886  1.00 27.95 ? 8   GLU L CB    1 
ATOM   74   C  CG    . GLU A 1  16  ? -15.402 5.838   18.414  1.00 27.44 ? 8   GLU L CG    1 
ATOM   75   C  CD    . GLU A 1  16  ? -13.935 6.185   18.723  1.00 25.38 ? 8   GLU L CD    1 
ATOM   76   O  OE1   . GLU A 1  16  ? -13.108 5.244   18.917  1.00 28.05 ? 8   GLU L OE1   1 
ATOM   77   O  OE2   . GLU A 1  16  ? -13.597 7.393   18.755  1.00 24.81 ? 8   GLU L OE2   1 
ATOM   78   N  N     . LYS A 1  17  ? -16.081 1.902   20.813  1.00 33.30 ? 9   LYS L N     1 
ATOM   79   C  CA    . LYS A 1  17  ? -16.850 0.683   21.119  1.00 36.17 ? 9   LYS L CA    1 
ATOM   80   C  C     . LYS A 1  17  ? -17.439 0.608   22.518  1.00 36.55 ? 9   LYS L C     1 
ATOM   81   O  O     . LYS A 1  17  ? -18.297 -0.215  22.766  1.00 35.95 ? 9   LYS L O     1 
ATOM   82   C  CB    . LYS A 1  17  ? -16.009 -0.561  20.890  1.00 37.37 ? 9   LYS L CB    1 
ATOM   83   C  CG    . LYS A 1  17  ? -16.338 -1.198  19.551  1.00 41.04 ? 9   LYS L CG    1 
ATOM   84   C  CD    . LYS A 1  17  ? -15.982 -0.267  18.419  1.00 41.72 ? 9   LYS L CD    1 
ATOM   85   C  CE    . LYS A 1  17  ? -15.071 -0.974  17.395  1.00 42.47 ? 9   LYS L CE    1 
ATOM   86   N  NZ    . LYS A 1  17  ? -13.757 -1.374  17.965  1.00 38.71 ? 9   LYS L NZ    1 
ATOM   87   N  N     . LYS A 1  18  ? -16.961 1.453   23.427  1.00 37.08 ? 10  LYS L N     1 
ATOM   88   C  CA    . LYS A 1  18  ? -17.456 1.454   24.812  1.00 38.75 ? 10  LYS L CA    1 
ATOM   89   C  C     . LYS A 1  18  ? -18.257 2.707   25.109  1.00 38.59 ? 10  LYS L C     1 
ATOM   90   O  O     . LYS A 1  18  ? -18.646 2.946   26.248  1.00 39.48 ? 10  LYS L O     1 
ATOM   91   C  CB    . LYS A 1  18  ? -16.280 1.365   25.794  1.00 39.79 ? 10  LYS L CB    1 
ATOM   92   C  CG    . LYS A 1  18  ? -15.500 0.038   25.714  1.00 41.86 ? 10  LYS L CG    1 
ATOM   93   C  CD    . LYS A 1  18  ? -14.327 -0.017  26.663  1.00 43.77 ? 10  LYS L CD    1 
ATOM   94   C  CE    . LYS A 1  18  ? -14.733 -0.394  28.088  1.00 45.34 ? 10  LYS L CE    1 
ATOM   95   N  NZ    . LYS A 1  18  ? -13.501 -0.375  28.974  1.00 45.62 ? 10  LYS L NZ    1 
ATOM   96   N  N     . SER A 1  19  ? -18.494 3.488   24.064  1.00 38.07 ? 11  SER L N     1 
ATOM   97   C  CA    . SER A 1  19  ? -19.192 4.747   24.147  1.00 39.28 ? 11  SER L CA    1 
ATOM   98   C  C     . SER A 1  19  ? -18.496 5.753   25.053  1.00 39.88 ? 11  SER L C     1 
ATOM   99   O  O     . SER A 1  19  ? -19.156 6.520   25.791  1.00 38.92 ? 11  SER L O     1 
ATOM   100  C  CB    . SER A 1  19  ? -20.643 4.543   24.597  1.00 41.10 ? 11  SER L CB    1 
ATOM   101  O  OG    . SER A 1  19  ? -21.317 3.730   23.644  1.00 42.62 ? 11  SER L OG    1 
ATOM   102  N  N     . LEU A 1  20  ? -17.165 5.784   24.977  1.00 38.53 ? 12  LEU L N     1 
ATOM   103  C  CA    . LEU A 1  20  ? -16.389 6.738   25.775  1.00 37.87 ? 12  LEU L CA    1 
ATOM   104  C  C     . LEU A 1  20  ? -15.627 7.701   24.870  1.00 36.87 ? 12  LEU L C     1 
ATOM   105  O  O     . LEU A 1  20  ? -15.106 7.297   23.821  1.00 37.01 ? 12  LEU L O     1 
ATOM   106  C  CB    . LEU A 1  20  ? -15.431 5.975   26.694  1.00 38.00 ? 12  LEU L CB    1 
ATOM   107  C  CG    . LEU A 1  20  ? -16.301 4.994   27.488  1.00 40.98 ? 12  LEU L CG    1 
ATOM   108  C  CD1   . LEU A 1  20  ? -15.511 3.795   27.870  1.00 41.63 ? 12  LEU L CD1   1 
ATOM   109  C  CD2   . LEU A 1  20  ? -16.920 5.713   28.734  1.00 41.32 ? 12  LEU L CD2   1 
ATOM   110  N  N     . GLU A 1  21  ? -15.588 8.971   25.269  1.00 35.29 ? 13  GLU L N     1 
ATOM   111  C  CA    . GLU A 1  21  ? -14.874 10.025  24.535  1.00 34.78 ? 13  GLU L CA    1 
ATOM   112  C  C     . GLU A 1  21  ? -13.471 10.110  25.067  1.00 32.95 ? 13  GLU L C     1 
ATOM   113  O  O     . GLU A 1  21  ? -13.292 9.840   26.232  1.00 32.52 ? 13  GLU L O     1 
ATOM   114  C  CB    . GLU A 1  21  ? -15.534 11.385  24.754  1.00 35.45 ? 13  GLU L CB    1 
ATOM   115  C  CG    . GLU A 1  21  ? -16.819 11.543  24.005  1.00 41.66 ? 13  GLU L CG    1 
ATOM   116  C  CD    . GLU A 1  21  ? -17.389 12.968  24.027  1.00 46.03 ? 13  GLU L CD    1 
ATOM   117  O  OE1   . GLU A 1  21  ? -18.481 13.145  23.439  1.00 47.71 ? 13  GLU L OE1   1 
ATOM   118  O  OE2   . GLU A 1  21  ? -16.762 13.911  24.612  1.00 49.63 ? 13  GLU L OE2   1 
ATOM   119  N  N     . ASP A 1  22  ? -12.466 10.431  24.240  1.00 31.95 ? 14  ASP L N     1 
ATOM   120  C  CA    . ASP A 1  22  ? -11.127 10.600  24.807  1.00 31.40 ? 14  ASP L CA    1 
ATOM   121  C  C     . ASP A 1  22  ? -11.126 12.054  25.348  1.00 31.93 ? 14  ASP L C     1 
ATOM   122  O  O     . ASP A 1  22  ? -12.113 12.773  25.233  1.00 30.50 ? 14  ASP L O     1 
ATOM   123  C  CB    . ASP A 1  22  ? -9.990  10.305  23.782  1.00 31.37 ? 14  ASP L CB    1 
ATOM   124  C  CG    . ASP A 1  22  ? -9.981  11.266  22.554  1.00 32.09 ? 14  ASP L CG    1 
ATOM   125  O  OD1   . ASP A 1  22  ? -9.866  10.759  21.432  1.00 30.45 ? 14  ASP L OD1   1 
ATOM   126  O  OD2   . ASP A 1  22  ? -10.050 12.520  22.689  1.00 32.74 ? 14  ASP L OD2   1 
ATOM   127  N  N     . LYS A 1  23  A -10.055 12.495  25.968  1.00 33.87 ? 14  LYS L N     1 
ATOM   128  C  CA    . LYS A 1  23  A -10.065 13.832  26.540  1.00 35.45 ? 14  LYS L CA    1 
ATOM   129  C  C     . LYS A 1  23  A -10.152 15.037  25.639  1.00 35.30 ? 14  LYS L C     1 
ATOM   130  O  O     . LYS A 1  23  A -10.413 16.112  26.123  1.00 36.68 ? 14  LYS L O     1 
ATOM   131  C  CB    . LYS A 1  23  A -8.838  14.019  27.441  1.00 37.75 ? 14  LYS L CB    1 
ATOM   132  C  CG    . LYS A 1  23  A -9.038  13.377  28.794  1.00 42.11 ? 14  LYS L CG    1 
ATOM   133  C  CD    . LYS A 1  23  A -7.925  13.751  29.747  1.00 46.11 ? 14  LYS L CD    1 
ATOM   134  C  CE    . LYS A 1  23  A -6.647  13.008  29.471  1.00 47.76 ? 14  LYS L CE    1 
ATOM   135  N  NZ    . LYS A 1  23  A -5.499  13.686  30.211  1.00 51.17 ? 14  LYS L NZ    1 
ATOM   136  N  N     . THR A 1  24  B -9.927  14.920  24.342  1.00 34.17 ? 14  THR L N     1 
ATOM   137  C  CA    . THR A 1  24  B -9.948  16.157  23.568  1.00 31.49 ? 14  THR L CA    1 
ATOM   138  C  C     . THR A 1  24  B -10.679 16.113  22.245  1.00 31.30 ? 14  THR L C     1 
ATOM   139  O  O     . THR A 1  24  B -10.651 17.110  21.487  1.00 29.01 ? 14  THR L O     1 
ATOM   140  C  CB    . THR A 1  24  B -8.498  16.643  23.305  1.00 31.34 ? 14  THR L CB    1 
ATOM   141  O  OG1   . THR A 1  24  B -7.803  15.694  22.496  1.00 31.59 ? 14  THR L OG1   1 
ATOM   142  C  CG2   . THR A 1  24  B -7.739  16.755  24.595  1.00 32.07 ? 14  THR L CG2   1 
ATOM   143  N  N     . GLU A 1  25  C -11.331 14.980  21.954  1.00 29.11 ? 14  GLU L N     1 
ATOM   144  C  CA    . GLU A 1  25  C -12.025 14.876  20.675  1.00 30.61 ? 14  GLU L CA    1 
ATOM   145  C  C     . GLU A 1  25  C -13.158 15.893  20.495  1.00 30.72 ? 14  GLU L C     1 
ATOM   146  O  O     . GLU A 1  25  C -13.512 16.302  19.365  1.00 28.74 ? 14  GLU L O     1 
ATOM   147  C  CB    . GLU A 1  25  C -12.537 13.432  20.459  1.00 28.25 ? 14  GLU L CB    1 
ATOM   148  C  CG    . GLU A 1  25  C -13.457 12.855  21.539  1.00 28.21 ? 14  GLU L CG    1 
ATOM   149  C  CD    . GLU A 1  25  C -13.984 11.470  21.128  1.00 27.30 ? 14  GLU L CD    1 
ATOM   150  O  OE1   . GLU A 1  25  C -13.458 10.455  21.588  1.00 29.76 ? 14  GLU L OE1   1 
ATOM   151  O  OE2   . GLU A 1  25  C -14.871 11.416  20.283  1.00 27.29 ? 14  GLU L OE2   1 
ATOM   152  N  N     . ARG A 1  26  D -13.732 16.301  21.626  1.00 33.60 ? 14  ARG L N     1 
ATOM   153  C  CA    . ARG A 1  26  D -14.834 17.291  21.646  1.00 34.81 ? 14  ARG L CA    1 
ATOM   154  C  C     . ARG A 1  26  D -14.410 18.583  20.924  1.00 32.61 ? 14  ARG L C     1 
ATOM   155  O  O     . ARG A 1  26  D -15.199 19.234  20.192  1.00 31.52 ? 14  ARG L O     1 
ATOM   156  C  CB    . ARG A 1  26  D -15.214 17.579  23.110  1.00 37.92 ? 14  ARG L CB    1 
ATOM   157  C  CG    . ARG A 1  26  D -16.109 18.773  23.348  1.00 44.32 ? 14  ARG L CG    1 
ATOM   158  C  CD    . ARG A 1  26  D -16.913 18.586  24.630  1.00 49.08 ? 14  ARG L CD    1 
ATOM   159  N  NE    . ARG A 1  26  D -17.615 17.286  24.610  1.00 53.46 ? 14  ARG L NE    1 
ATOM   160  C  CZ    . ARG A 1  26  D -18.170 16.704  25.676  1.00 54.71 ? 14  ARG L CZ    1 
ATOM   161  N  NH1   . ARG A 1  26  D -18.115 17.296  26.877  1.00 55.31 ? 14  ARG L NH1   1 
ATOM   162  N  NH2   . ARG A 1  26  D -18.788 15.528  25.536  1.00 54.75 ? 14  ARG L NH2   1 
ATOM   163  N  N     . GLU A 1  27  E -13.154 18.936  21.141  1.00 30.51 ? 14  GLU L N     1 
ATOM   164  C  CA    . GLU A 1  27  E -12.549 20.104  20.528  1.00 30.85 ? 14  GLU L CA    1 
ATOM   165  C  C     . GLU A 1  27  E -12.613 20.001  18.978  1.00 31.16 ? 14  GLU L C     1 
ATOM   166  O  O     . GLU A 1  27  E -12.812 20.996  18.240  1.00 28.49 ? 14  GLU L O     1 
ATOM   167  C  CB    . GLU A 1  27  E -11.080 20.170  20.975  1.00 31.65 ? 14  GLU L CB    1 
ATOM   168  C  CG    . GLU A 1  27  E -10.386 21.460  20.631  1.00 35.91 ? 14  GLU L CG    1 
ATOM   169  C  CD    . GLU A 1  27  E -8.865  21.418  20.879  1.00 37.82 ? 14  GLU L CD    1 
ATOM   170  O  OE1   . GLU A 1  27  E -8.386  20.509  21.628  1.00 38.15 ? 14  GLU L OE1   1 
ATOM   171  O  OE2   . GLU A 1  27  E -8.159  22.307  20.302  1.00 37.77 ? 14  GLU L OE2   1 
ATOM   172  N  N     . LEU A 1  28  F -12.413 18.784  18.478  1.00 29.92 ? 14  LEU L N     1 
ATOM   173  C  CA    . LEU A 1  28  F -12.429 18.570  17.025  1.00 30.46 ? 14  LEU L CA    1 
ATOM   174  C  C     . LEU A 1  28  F -13.856 18.742  16.524  1.00 29.41 ? 14  LEU L C     1 
ATOM   175  O  O     . LEU A 1  28  F -14.123 19.429  15.557  1.00 29.41 ? 14  LEU L O     1 
ATOM   176  C  CB    . LEU A 1  28  F -11.927 17.139  16.701  1.00 28.17 ? 14  LEU L CB    1 
ATOM   177  C  CG    . LEU A 1  28  F -10.545 16.772  17.239  1.00 28.83 ? 14  LEU L CG    1 
ATOM   178  C  CD1   . LEU A 1  28  F -10.114 15.387  16.680  1.00 27.05 ? 14  LEU L CD1   1 
ATOM   179  C  CD2   . LEU A 1  28  F -9.542  17.874  16.828  1.00 23.11 ? 14  LEU L CD2   1 
ATOM   180  N  N     . LEU A 1  29  G -14.764 18.048  17.190  1.00 32.81 ? 14  LEU L N     1 
ATOM   181  C  CA    . LEU A 1  29  G -16.188 18.082  16.856  1.00 34.57 ? 14  LEU L CA    1 
ATOM   182  C  C     . LEU A 1  29  G -16.729 19.539  16.825  1.00 35.56 ? 14  LEU L C     1 
ATOM   183  O  O     . LEU A 1  29  G -17.400 19.935  15.867  1.00 35.88 ? 14  LEU L O     1 
ATOM   184  C  CB    . LEU A 1  29  G -16.932 17.161  17.850  1.00 36.12 ? 14  LEU L CB    1 
ATOM   185  C  CG    . LEU A 1  29  G -16.700 15.598  17.754  1.00 41.50 ? 14  LEU L CG    1 
ATOM   186  C  CD1   . LEU A 1  29  G -15.284 15.205  17.173  1.00 39.68 ? 14  LEU L CD1   1 
ATOM   187  C  CD2   . LEU A 1  29  G -16.855 14.901  19.152  1.00 42.59 ? 14  LEU L CD2   1 
ATOM   188  N  N     . GLU A 1  30  H -16.374 20.351  17.819  1.00 35.94 ? 14  GLU L N     1 
ATOM   189  C  CA    . GLU A 1  30  H -16.812 21.751  17.863  1.00 36.42 ? 14  GLU L CA    1 
ATOM   190  C  C     . GLU A 1  30  H -16.251 22.609  16.712  1.00 35.38 ? 14  GLU L C     1 
ATOM   191  O  O     . GLU A 1  30  H -16.899 23.530  16.246  1.00 34.83 ? 14  GLU L O     1 
ATOM   192  C  CB    . GLU A 1  30  H -16.413 22.370  19.198  1.00 38.72 ? 14  GLU L CB    1 
ATOM   193  C  CG    . GLU A 1  30  H -17.156 21.802  20.409  1.00 44.86 ? 14  GLU L CG    1 
ATOM   194  C  CD    . GLU A 1  30  H -16.624 22.353  21.761  1.00 49.27 ? 14  GLU L CD    1 
ATOM   195  O  OE1   . GLU A 1  30  H -16.068 23.482  21.786  1.00 52.49 ? 14  GLU L OE1   1 
ATOM   196  O  OE2   . GLU A 1  30  H -16.764 21.676  22.818  1.00 50.86 ? 14  GLU L OE2   1 
ATOM   197  N  N     . SER A 1  31  I -15.043 22.332  16.247  1.00 33.60 ? 14  SER L N     1 
ATOM   198  C  CA    . SER A 1  31  I -14.507 23.112  15.157  1.00 33.53 ? 14  SER L CA    1 
ATOM   199  C  C     . SER A 1  31  I -15.370 22.933  13.898  1.00 35.14 ? 14  SER L C     1 
ATOM   200  O  O     . SER A 1  31  I -15.313 23.753  13.005  1.00 35.01 ? 14  SER L O     1 
ATOM   201  C  CB    . SER A 1  31  I -13.048 22.704  14.844  1.00 32.71 ? 14  SER L CB    1 
ATOM   202  O  OG    . SER A 1  31  I -13.005 21.516  14.088  1.00 30.31 ? 14  SER L OG    1 
ATOM   203  N  N     . TYR A 1  32  J -16.154 21.869  13.793  1.00 37.86 ? 14  TYR L N     1 
ATOM   204  C  CA    . TYR A 1  32  J -16.981 21.725  12.592  1.00 42.72 ? 14  TYR L CA    1 
ATOM   205  C  C     . TYR A 1  32  J -18.160 22.736  12.567  1.00 46.01 ? 14  TYR L C     1 
ATOM   206  O  O     . TYR A 1  32  J -18.680 23.100  11.496  1.00 46.99 ? 14  TYR L O     1 
ATOM   207  C  CB    . TYR A 1  32  J -17.560 20.325  12.491  1.00 44.43 ? 14  TYR L CB    1 
ATOM   208  C  CG    . TYR A 1  32  J -16.552 19.223  12.311  1.00 45.10 ? 14  TYR L CG    1 
ATOM   209  C  CD1   . TYR A 1  32  J -15.541 19.331  11.374  1.00 46.36 ? 14  TYR L CD1   1 
ATOM   210  C  CD2   . TYR A 1  32  J -16.603 18.070  13.092  1.00 46.25 ? 14  TYR L CD2   1 
ATOM   211  C  CE1   . TYR A 1  32  J -14.592 18.329  11.227  1.00 46.48 ? 14  TYR L CE1   1 
ATOM   212  C  CE2   . TYR A 1  32  J -15.667 17.059  12.937  1.00 45.19 ? 14  TYR L CE2   1 
ATOM   213  C  CZ    . TYR A 1  32  J -14.670 17.210  12.014  1.00 45.31 ? 14  TYR L CZ    1 
ATOM   214  O  OH    . TYR A 1  32  J -13.703 16.292  11.908  1.00 45.51 ? 14  TYR L OH    1 
ATOM   215  N  N     . ILE A 1  33  K -18.543 23.214  13.750  1.00 48.03 ? 14  ILE L N     1 
ATOM   216  C  CA    . ILE A 1  33  K -19.663 24.141  13.893  1.00 50.44 ? 14  ILE L CA    1 
ATOM   217  C  C     . ILE A 1  33  K -19.308 25.467  14.579  1.00 50.42 ? 14  ILE L C     1 
ATOM   218  O  O     . ILE A 1  33  K -18.629 26.332  13.994  1.00 51.39 ? 14  ILE L O     1 
ATOM   219  C  CB    . ILE A 1  33  K -20.772 23.423  14.673  1.00 52.05 ? 14  ILE L CB    1 
ATOM   220  C  CG1   . ILE A 1  33  K -20.244 23.012  16.059  1.00 52.44 ? 14  ILE L CG1   1 
ATOM   221  C  CG2   . ILE A 1  33  K -21.223 22.201  13.882  1.00 52.31 ? 14  ILE L CG2   1 
ATOM   222  C  CD1   . ILE A 1  33  K -20.925 21.770  16.676  1.00 54.70 ? 14  ILE L CD1   1 
ATOM   223  N  N     . ILE B 2  1   ? 6.536   16.278  18.665  1.00 24.55 ? 16  ILE H N     1 
ATOM   224  C  CA    . ILE B 2  1   ? 5.292   17.053  18.862  1.00 23.94 ? 16  ILE H CA    1 
ATOM   225  C  C     . ILE B 2  1   ? 5.555   18.199  19.891  1.00 25.62 ? 16  ILE H C     1 
ATOM   226  O  O     . ILE B 2  1   ? 5.910   17.941  21.064  1.00 26.82 ? 16  ILE H O     1 
ATOM   227  C  CB    . ILE B 2  1   ? 4.179   16.173  19.413  1.00 21.46 ? 16  ILE H CB    1 
ATOM   228  C  CG1   . ILE B 2  1   ? 3.893   14.985  18.429  1.00 22.29 ? 16  ILE H CG1   1 
ATOM   229  C  CG2   . ILE B 2  1   ? 2.961   17.058  19.806  1.00 21.01 ? 16  ILE H CG2   1 
ATOM   230  C  CD1   . ILE B 2  1   ? 3.179   15.366  17.099  1.00 25.28 ? 16  ILE H CD1   1 
ATOM   231  N  N     . VAL B 2  2   ? 5.386   19.433  19.442  1.00 25.49 ? 17  VAL H N     1 
ATOM   232  C  CA    . VAL B 2  2   ? 5.640   20.609  20.298  1.00 28.70 ? 17  VAL H CA    1 
ATOM   233  C  C     . VAL B 2  2   ? 4.318   21.059  20.911  1.00 29.10 ? 17  VAL H C     1 
ATOM   234  O  O     . VAL B 2  2   ? 3.333   21.210  20.191  1.00 29.24 ? 17  VAL H O     1 
ATOM   235  C  CB    . VAL B 2  2   ? 6.283   21.771  19.467  1.00 27.58 ? 17  VAL H CB    1 
ATOM   236  C  CG1   . VAL B 2  2   ? 6.668   22.968  20.392  1.00 29.27 ? 17  VAL H CG1   1 
ATOM   237  C  CG2   . VAL B 2  2   ? 7.518   21.246  18.745  1.00 27.12 ? 17  VAL H CG2   1 
ATOM   238  N  N     . GLU B 2  3   ? 4.289   21.211  22.233  1.00 29.70 ? 18  GLU H N     1 
ATOM   239  C  CA    . GLU B 2  3   ? 3.102   21.642  22.941  1.00 32.46 ? 18  GLU H CA    1 
ATOM   240  C  C     . GLU B 2  3   ? 1.865   20.745  22.842  1.00 33.78 ? 18  GLU H C     1 
ATOM   241  O  O     . GLU B 2  3   ? 0.727   21.224  22.774  1.00 34.69 ? 18  GLU H O     1 
ATOM   242  C  CB    . GLU B 2  3   ? 2.743   23.070  22.536  1.00 35.52 ? 18  GLU H CB    1 
ATOM   243  C  CG    . GLU B 2  3   ? 3.782   24.123  22.975  1.00 39.93 ? 18  GLU H CG    1 
ATOM   244  C  CD    . GLU B 2  3   ? 3.745   24.402  24.488  1.00 42.05 ? 18  GLU H CD    1 
ATOM   245  O  OE1   . GLU B 2  3   ? 2.689   24.839  25.003  1.00 42.41 ? 18  GLU H OE1   1 
ATOM   246  O  OE2   . GLU B 2  3   ? 4.789   24.184  25.152  1.00 43.51 ? 18  GLU H OE2   1 
ATOM   247  N  N     . GLY B 2  4   ? 2.082   19.437  22.823  1.00 34.74 ? 19  GLY H N     1 
ATOM   248  C  CA    . GLY B 2  4   ? 0.961   18.507  22.817  1.00 33.90 ? 19  GLY H CA    1 
ATOM   249  C  C     . GLY B 2  4   ? 0.831   17.975  24.242  1.00 34.23 ? 19  GLY H C     1 
ATOM   250  O  O     . GLY B 2  4   ? 1.287   18.605  25.210  1.00 34.21 ? 19  GLY H O     1 
ATOM   251  N  N     . SER B 2  5   ? 0.220   16.824  24.386  1.00 33.63 ? 20  SER H N     1 
ATOM   252  C  CA    . SER B 2  5   ? 0.059   16.232  25.689  1.00 34.31 ? 20  SER H CA    1 
ATOM   253  C  C     . SER B 2  5   ? 0.171   14.708  25.548  1.00 34.50 ? 20  SER H C     1 
ATOM   254  O  O     . SER B 2  5   ? 0.174   14.159  24.421  1.00 32.75 ? 20  SER H O     1 
ATOM   255  C  CB    . SER B 2  5   ? -1.307  16.587  26.262  1.00 34.68 ? 20  SER H CB    1 
ATOM   256  O  OG    . SER B 2  5   ? -2.331  16.025  25.463  1.00 38.79 ? 20  SER H OG    1 
ATOM   257  N  N     . ASP B 2  6   ? 0.257   14.043  26.693  1.00 32.36 ? 21  ASP H N     1 
ATOM   258  C  CA    . ASP B 2  6   ? 0.381   12.597  26.734  1.00 32.08 ? 21  ASP H CA    1 
ATOM   259  C  C     . ASP B 2  6   ? -0.879  11.925  26.225  1.00 31.12 ? 21  ASP H C     1 
ATOM   260  O  O     . ASP B 2  6   ? -1.979  12.307  26.564  1.00 29.58 ? 21  ASP H O     1 
ATOM   261  C  CB    . ASP B 2  6   ? 0.658   12.141  28.171  1.00 34.98 ? 21  ASP H CB    1 
ATOM   262  C  CG    . ASP B 2  6   ? 2.050   12.549  28.674  1.00 36.41 ? 21  ASP H CG    1 
ATOM   263  O  OD1   . ASP B 2  6   ? 2.834   13.267  27.989  1.00 35.38 ? 21  ASP H OD1   1 
ATOM   264  O  OD2   . ASP B 2  6   ? 2.361   12.114  29.794  1.00 39.23 ? 21  ASP H OD2   1 
ATOM   265  N  N     . ALA B 2  7   ? -0.703  10.913  25.395  1.00 31.75 ? 22  ALA H N     1 
ATOM   266  C  CA    . ALA B 2  7   ? -1.843  10.169  24.839  1.00 32.13 ? 22  ALA H CA    1 
ATOM   267  C  C     . ALA B 2  7   ? -2.351  9.113   25.824  1.00 31.56 ? 22  ALA H C     1 
ATOM   268  O  O     . ALA B 2  7   ? -1.555  8.378   26.378  1.00 31.09 ? 22  ALA H O     1 
ATOM   269  C  CB    . ALA B 2  7   ? -1.422  9.490   23.550  1.00 30.98 ? 22  ALA H CB    1 
ATOM   270  N  N     . GLU B 2  8   ? -3.665  9.029   26.040  1.00 31.80 ? 23  GLU H N     1 
ATOM   271  C  CA    . GLU B 2  8   ? -4.215  7.992   26.932  1.00 33.06 ? 23  GLU H CA    1 
ATOM   272  C  C     . GLU B 2  8   ? -3.991  6.641   26.223  1.00 31.95 ? 23  GLU H C     1 
ATOM   273  O  O     . GLU B 2  8   ? -3.825  6.621   24.998  1.00 30.87 ? 23  GLU H O     1 
ATOM   274  C  CB    . GLU B 2  8   ? -5.722  8.185   27.110  1.00 36.19 ? 23  GLU H CB    1 
ATOM   275  C  CG    . GLU B 2  8   ? -6.156  9.554   27.588  1.00 38.67 ? 23  GLU H CG    1 
ATOM   276  C  CD    . GLU B 2  8   ? -7.629  9.815   27.238  1.00 41.61 ? 23  GLU H CD    1 
ATOM   277  O  OE1   . GLU B 2  8   ? -8.507  9.144   27.835  1.00 42.29 ? 23  GLU H OE1   1 
ATOM   278  O  OE2   . GLU B 2  8   ? -7.893  10.681  26.355  1.00 40.87 ? 23  GLU H OE2   1 
ATOM   279  N  N     . ILE B 2  9   ? -3.992  5.543   26.973  1.00 30.88 ? 24  ILE H N     1 
ATOM   280  C  CA    . ILE B 2  9   ? -3.821  4.184   26.406  1.00 32.62 ? 24  ILE H CA    1 
ATOM   281  C  C     . ILE B 2  9   ? -4.972  3.823   25.448  1.00 30.79 ? 24  ILE H C     1 
ATOM   282  O  O     . ILE B 2  9   ? -6.127  4.089   25.743  1.00 30.43 ? 24  ILE H O     1 
ATOM   283  C  CB    . ILE B 2  9   ? -3.757  3.071   27.550  1.00 34.72 ? 24  ILE H CB    1 
ATOM   284  C  CG1   . ILE B 2  9   ? -2.476  3.231   28.394  1.00 37.93 ? 24  ILE H CG1   1 
ATOM   285  C  CG2   . ILE B 2  9   ? -3.680  1.646   26.945  1.00 36.94 ? 24  ILE H CG2   1 
ATOM   286  C  CD1   . ILE B 2  9   ? -2.601  2.744   29.861  1.00 37.68 ? 24  ILE H CD1   1 
ATOM   287  N  N     . GLY B 2  10  ? -4.652  3.209   24.309  1.00 28.92 ? 25  GLY H N     1 
ATOM   288  C  CA    . GLY B 2  10  ? -5.679  2.839   23.324  1.00 26.55 ? 25  GLY H CA    1 
ATOM   289  C  C     . GLY B 2  10  ? -6.294  3.962   22.500  1.00 24.81 ? 25  GLY H C     1 
ATOM   290  O  O     . GLY B 2  10  ? -7.153  3.708   21.637  1.00 24.33 ? 25  GLY H O     1 
ATOM   291  N  N     . MET B 2  11  ? -5.845  5.214   22.710  1.00 22.54 ? 26  MET H N     1 
ATOM   292  C  CA    . MET B 2  11  ? -6.440  6.330   21.979  1.00 22.51 ? 26  MET H CA    1 
ATOM   293  C  C     . MET B 2  11  ? -6.019  6.527   20.498  1.00 19.23 ? 26  MET H C     1 
ATOM   294  O  O     . MET B 2  11  ? -6.711  7.216   19.768  1.00 20.14 ? 26  MET H O     1 
ATOM   295  C  CB    . MET B 2  11  ? -6.232  7.634   22.792  1.00 25.15 ? 26  MET H CB    1 
ATOM   296  C  CG    . MET B 2  11  ? -5.396  8.670   22.119  1.00 28.71 ? 26  MET H CG    1 
ATOM   297  S  SD    . MET B 2  11  ? -5.190  10.307  23.092  1.00 33.48 ? 26  MET H SD    1 
ATOM   298  C  CE    . MET B 2  11  ? -6.645  11.098  22.802  1.00 33.13 ? 26  MET H CE    1 
ATOM   299  N  N     . SER B 2  12  ? -4.907  5.911   20.065  1.00 19.46 ? 27  SER H N     1 
ATOM   300  C  CA    . SER B 2  12  ? -4.360  5.982   18.689  1.00 20.28 ? 27  SER H CA    1 
ATOM   301  C  C     . SER B 2  12  ? -3.835  4.530   18.389  1.00 21.64 ? 27  SER H C     1 
ATOM   302  O  O     . SER B 2  12  ? -2.626  4.296   18.203  1.00 20.90 ? 27  SER H O     1 
ATOM   303  C  CB    A SER B 2  12  ? -3.194  7.019   18.649  0.64 19.17 ? 27  SER H CB    1 
ATOM   304  C  CB    B SER B 2  12  ? -3.169  6.952   18.643  0.36 21.14 ? 27  SER H CB    1 
ATOM   305  O  OG    A SER B 2  12  ? -2.749  7.321   17.323  0.64 17.78 ? 27  SER H OG    1 
ATOM   306  O  OG    B SER B 2  12  ? -3.568  8.244   18.248  0.36 23.97 ? 27  SER H OG    1 
ATOM   307  N  N     . PRO B 2  13  ? -4.756  3.526   18.327  1.00 21.87 ? 28  PRO H N     1 
ATOM   308  C  CA    . PRO B 2  13  ? -4.311  2.137   18.082  1.00 19.82 ? 28  PRO H CA    1 
ATOM   309  C  C     . PRO B 2  13  ? -3.700  1.796   16.716  1.00 19.94 ? 28  PRO H C     1 
ATOM   310  O  O     . PRO B 2  13  ? -3.111  0.715   16.534  1.00 19.81 ? 28  PRO H O     1 
ATOM   311  C  CB    . PRO B 2  13  ? -5.546  1.303   18.442  1.00 21.70 ? 28  PRO H CB    1 
ATOM   312  C  CG    . PRO B 2  13  ? -6.719  2.230   18.002  1.00 21.35 ? 28  PRO H CG    1 
ATOM   313  C  CD    . PRO B 2  13  ? -6.219  3.635   18.497  1.00 21.69 ? 28  PRO H CD    1 
ATOM   314  N  N     . TRP B 2  14  ? -3.841  2.710   15.781  1.00 16.92 ? 29  TRP H N     1 
ATOM   315  C  CA    . TRP B 2  14  ? -3.257  2.602   14.458  1.00 19.15 ? 29  TRP H CA    1 
ATOM   316  C  C     . TRP B 2  14  ? -1.830  3.214   14.433  1.00 19.03 ? 29  TRP H C     1 
ATOM   317  O  O     . TRP B 2  14  ? -1.178  3.209   13.375  1.00 17.95 ? 29  TRP H O     1 
ATOM   318  C  CB    . TRP B 2  14  ? -4.156  3.310   13.420  1.00 19.49 ? 29  TRP H CB    1 
ATOM   319  C  CG    . TRP B 2  14  ? -4.787  4.575   13.954  1.00 21.02 ? 29  TRP H CG    1 
ATOM   320  C  CD1   . TRP B 2  14  ? -4.160  5.844   14.132  1.00 21.29 ? 29  TRP H CD1   1 
ATOM   321  C  CD2   . TRP B 2  14  ? -6.119  4.714   14.492  1.00 19.91 ? 29  TRP H CD2   1 
ATOM   322  N  NE1   . TRP B 2  14  ? -5.051  6.711   14.734  1.00 20.56 ? 29  TRP H NE1   1 
ATOM   323  C  CE2   . TRP B 2  14  ? -6.244  6.058   14.970  1.00 21.84 ? 29  TRP H CE2   1 
ATOM   324  C  CE3   . TRP B 2  14  ? -7.216  3.840   14.612  1.00 21.56 ? 29  TRP H CE3   1 
ATOM   325  C  CZ2   . TRP B 2  14  ? -7.426  6.543   15.557  1.00 21.12 ? 29  TRP H CZ2   1 
ATOM   326  C  CZ3   . TRP B 2  14  ? -8.405  4.317   15.184  1.00 20.46 ? 29  TRP H CZ3   1 
ATOM   327  C  CH2   . TRP B 2  14  ? -8.492  5.679   15.656  1.00 21.21 ? 29  TRP H CH2   1 
ATOM   328  N  N     . GLN B 2  15  ? -1.336  3.740   15.586  1.00 20.15 ? 30  GLN H N     1 
ATOM   329  C  CA    . GLN B 2  15  ? 0.031   4.318   15.596  1.00 20.21 ? 30  GLN H CA    1 
ATOM   330  C  C     . GLN B 2  15  ? 1.101   3.220   15.347  1.00 19.77 ? 30  GLN H C     1 
ATOM   331  O  O     . GLN B 2  15  ? 1.036   2.150   15.942  1.00 20.76 ? 30  GLN H O     1 
ATOM   332  C  CB    . GLN B 2  15  ? 0.371   4.954   16.947  1.00 21.95 ? 30  GLN H CB    1 
ATOM   333  C  CG    . GLN B 2  15  ? 1.488   5.995   16.831  1.00 21.29 ? 30  GLN H CG    1 
ATOM   334  C  CD    . GLN B 2  15  ? 1.012   7.349   16.288  1.00 21.44 ? 30  GLN H CD    1 
ATOM   335  O  OE1   . GLN B 2  15  ? 1.831   8.156   15.805  1.00 25.15 ? 30  GLN H OE1   1 
ATOM   336  N  NE2   . GLN B 2  15  ? -0.278  7.628   16.393  1.00 15.57 ? 30  GLN H NE2   1 
ATOM   337  N  N     . VAL B 2  16  ? 2.093   3.496   14.500  1.00 19.46 ? 31  VAL H N     1 
ATOM   338  C  CA    . VAL B 2  16  ? 3.150   2.542   14.208  1.00 19.43 ? 31  VAL H CA    1 
ATOM   339  C  C     . VAL B 2  16  ? 4.481   3.271   14.389  1.00 21.46 ? 31  VAL H C     1 
ATOM   340  O  O     . VAL B 2  16  ? 4.572   4.468   14.055  1.00 21.73 ? 31  VAL H O     1 
ATOM   341  C  CB    . VAL B 2  16  ? 3.034   2.028   12.763  1.00 20.55 ? 31  VAL H CB    1 
ATOM   342  C  CG1   . VAL B 2  16  ? 4.229   1.088   12.422  1.00 19.18 ? 31  VAL H CG1   1 
ATOM   343  C  CG2   . VAL B 2  16  ? 1.753   1.230   12.608  1.00 17.58 ? 31  VAL H CG2   1 
ATOM   344  N  N     . MET B 2  17  ? 5.494   2.586   14.936  1.00 19.61 ? 32  MET H N     1 
ATOM   345  C  CA    . MET B 2  17  ? 6.813   3.237   15.123  1.00 22.90 ? 32  MET H CA    1 
ATOM   346  C  C     . MET B 2  17  ? 7.782   2.571   14.139  1.00 22.98 ? 32  MET H C     1 
ATOM   347  O  O     . MET B 2  17  ? 7.816   1.343   14.018  1.00 23.70 ? 32  MET H O     1 
ATOM   348  C  CB    . MET B 2  17  ? 7.340   3.043   16.554  1.00 22.92 ? 32  MET H CB    1 
ATOM   349  C  CG    . MET B 2  17  ? 6.439   3.611   17.625  1.00 25.19 ? 32  MET H CG    1 
ATOM   350  S  SD    . MET B 2  17  ? 6.902   2.956   19.312  1.00 30.85 ? 32  MET H SD    1 
ATOM   351  C  CE    . MET B 2  17  ? 8.412   4.098   19.698  1.00 26.22 ? 32  MET H CE    1 
ATOM   352  N  N     . LEU B 2  18  ? 8.518   3.370   13.386  1.00 23.00 ? 33  LEU H N     1 
ATOM   353  C  CA    . LEU B 2  18  ? 9.451   2.796   12.427  1.00 24.70 ? 33  LEU H CA    1 
ATOM   354  C  C     . LEU B 2  18  ? 10.872  2.821   12.982  1.00 25.87 ? 33  LEU H C     1 
ATOM   355  O  O     . LEU B 2  18  ? 11.396  3.896   13.283  1.00 25.38 ? 33  LEU H O     1 
ATOM   356  C  CB    . LEU B 2  18  ? 9.394   3.559   11.098  1.00 23.61 ? 33  LEU H CB    1 
ATOM   357  C  CG    . LEU B 2  18  ? 10.407  3.045   10.050  1.00 27.55 ? 33  LEU H CG    1 
ATOM   358  C  CD1   . LEU B 2  18  ? 10.020  1.673   9.485   1.00 24.23 ? 33  LEU H CD1   1 
ATOM   359  C  CD2   . LEU B 2  18  ? 10.461  4.062   8.877   1.00 26.41 ? 33  LEU H CD2   1 
ATOM   360  N  N     . PHE B 2  19  ? 11.471  1.628   13.077  1.00 28.32 ? 34  PHE H N     1 
ATOM   361  C  CA    . PHE B 2  19  ? 12.838  1.394   13.603  1.00 30.89 ? 34  PHE H CA    1 
ATOM   362  C  C     . PHE B 2  19  ? 13.903  0.878   12.630  1.00 31.61 ? 34  PHE H C     1 
ATOM   363  O  O     . PHE B 2  19  ? 13.640  0.030   11.757  1.00 31.35 ? 34  PHE H O     1 
ATOM   364  C  CB    . PHE B 2  19  ? 12.826  0.362   14.755  1.00 28.89 ? 34  PHE H CB    1 
ATOM   365  C  CG    . PHE B 2  19  ? 12.254  0.893   16.033  1.00 31.01 ? 34  PHE H CG    1 
ATOM   366  C  CD1   . PHE B 2  19  ? 10.870  0.824   16.280  1.00 28.92 ? 34  PHE H CD1   1 
ATOM   367  C  CD2   . PHE B 2  19  ? 13.112  1.437   17.016  1.00 30.93 ? 34  PHE H CD2   1 
ATOM   368  C  CE1   . PHE B 2  19  ? 10.337  1.275   17.492  1.00 29.58 ? 34  PHE H CE1   1 
ATOM   369  C  CE2   . PHE B 2  19  ? 12.607  1.898   18.244  1.00 31.27 ? 34  PHE H CE2   1 
ATOM   370  C  CZ    . PHE B 2  19  ? 11.188  1.815   18.490  1.00 31.26 ? 34  PHE H CZ    1 
ATOM   371  N  N     . ARG B 2  20  ? 15.100  1.436   12.787  1.00 33.74 ? 35  ARG H N     1 
ATOM   372  C  CA    . ARG B 2  20  ? 16.268  0.981   12.046  1.00 36.24 ? 35  ARG H CA    1 
ATOM   373  C  C     . ARG B 2  20  ? 16.585  -0.322  12.844  1.00 37.71 ? 35  ARG H C     1 
ATOM   374  O  O     . ARG B 2  20  ? 16.722  -0.279  14.090  1.00 36.64 ? 35  ARG H O     1 
ATOM   375  C  CB    . ARG B 2  20  ? 17.436  1.973   12.190  1.00 36.87 ? 35  ARG H CB    1 
ATOM   376  C  CG    . ARG B 2  20  ? 18.803  1.311   12.172  1.00 40.48 ? 35  ARG H CG    1 
ATOM   377  C  CD    . ARG B 2  20  ? 19.636  1.434   10.891  1.00 43.91 ? 35  ARG H CD    1 
ATOM   378  N  NE    . ARG B 2  20  ? 19.880  2.816   10.394  1.00 46.10 ? 35  ARG H NE    1 
ATOM   379  C  CZ    . ARG B 2  20  ? 20.012  3.907   11.159  1.00 46.25 ? 35  ARG H CZ    1 
ATOM   380  N  NH1   . ARG B 2  20  ? 20.219  5.107   10.581  1.00 44.12 ? 35  ARG H NH1   1 
ATOM   381  N  NH2   . ARG B 2  20  ? 19.926  3.806   12.487  1.00 43.30 ? 35  ARG H NH2   1 
ATOM   382  N  N     . LYS B 2  21  ? 16.668  -1.448  12.124  1.00 38.54 ? 36  LYS H N     1 
ATOM   383  C  CA    . LYS B 2  21  ? 16.936  -2.767  12.708  1.00 40.85 ? 36  LYS H CA    1 
ATOM   384  C  C     . LYS B 2  21  ? 18.277  -2.860  13.417  1.00 41.33 ? 36  LYS H C     1 
ATOM   385  O  O     . LYS B 2  21  ? 18.332  -3.264  14.561  1.00 42.29 ? 36  LYS H O     1 
ATOM   386  C  CB    . LYS B 2  21  ? 16.818  -3.854  11.634  1.00 41.09 ? 36  LYS H CB    1 
ATOM   387  C  CG    . LYS B 2  21  ? 17.072  -5.251  12.130  1.00 44.20 ? 36  LYS H CG    1 
ATOM   388  C  CD    . LYS B 2  21  ? 16.962  -6.303  10.989  1.00 47.26 ? 36  LYS H CD    1 
ATOM   389  C  CE    . LYS B 2  21  ? 15.552  -6.390  10.400  1.00 49.63 ? 36  LYS H CE    1 
ATOM   390  N  NZ    . LYS B 2  21  ? 15.460  -7.377  9.249   1.00 50.87 ? 36  LYS H NZ    1 
ATOM   391  N  N     . SER B 2  22  A 19.374  -2.481  12.776  1.00 42.97 ? 36  SER H N     1 
ATOM   392  C  CA    . SER B 2  22  A 20.664  -2.538  13.507  1.00 44.34 ? 36  SER H CA    1 
ATOM   393  C  C     . SER B 2  22  A 21.589  -1.362  13.241  1.00 43.18 ? 36  SER H C     1 
ATOM   394  O  O     . SER B 2  22  A 22.047  -1.171  12.131  1.00 43.19 ? 36  SER H O     1 
ATOM   395  C  CB    . SER B 2  22  A 21.424  -3.851  13.210  1.00 45.30 ? 36  SER H CB    1 
ATOM   396  O  OG    . SER B 2  22  A 21.261  -4.818  14.244  1.00 48.52 ? 36  SER H OG    1 
ATOM   397  N  N     . PRO B 2  23  ? 21.894  -0.571  14.270  1.00 43.42 ? 37  PRO H N     1 
ATOM   398  C  CA    . PRO B 2  23  ? 21.414  -0.738  15.646  1.00 44.59 ? 37  PRO H CA    1 
ATOM   399  C  C     . PRO B 2  23  ? 19.967  -0.270  15.753  1.00 45.24 ? 37  PRO H C     1 
ATOM   400  O  O     . PRO B 2  23  ? 19.490  0.473   14.878  1.00 44.57 ? 37  PRO H O     1 
ATOM   401  C  CB    . PRO B 2  23  ? 22.358  0.163   16.450  1.00 44.79 ? 37  PRO H CB    1 
ATOM   402  C  CG    . PRO B 2  23  ? 22.573  1.353   15.498  1.00 44.06 ? 37  PRO H CG    1 
ATOM   403  C  CD    . PRO B 2  23  ? 22.621  0.705   14.101  1.00 43.87 ? 37  PRO H CD    1 
ATOM   404  N  N     . GLN B 2  24  ? 19.287  -0.709  16.814  1.00 45.42 ? 38  GLN H N     1 
ATOM   405  C  CA    . GLN B 2  24  ? 17.912  -0.317  17.061  1.00 45.75 ? 38  GLN H CA    1 
ATOM   406  C  C     . GLN B 2  24  ? 17.956  1.183   17.275  1.00 44.12 ? 38  GLN H C     1 
ATOM   407  O  O     . GLN B 2  24  ? 18.745  1.666   18.115  1.00 43.45 ? 38  GLN H O     1 
ATOM   408  C  CB    . GLN B 2  24  ? 17.349  -0.984  18.326  1.00 48.73 ? 38  GLN H CB    1 
ATOM   409  C  CG    . GLN B 2  24  ? 16.294  -2.127  18.063  1.00 54.43 ? 38  GLN H CG    1 
ATOM   410  C  CD    . GLN B 2  24  ? 16.916  -3.399  17.438  1.00 57.35 ? 38  GLN H CD    1 
ATOM   411  O  OE1   . GLN B 2  24  ? 18.039  -3.353  16.918  1.00 59.75 ? 38  GLN H OE1   1 
ATOM   412  N  NE2   . GLN B 2  24  ? 16.188  -4.522  17.482  1.00 57.63 ? 38  GLN H NE2   1 
ATOM   413  N  N     . GLU B 2  25  ? 17.126  1.892   16.500  1.00 40.02 ? 39  GLU H N     1 
ATOM   414  C  CA    . GLU B 2  25  ? 16.988  3.343   16.558  1.00 37.64 ? 39  GLU H CA    1 
ATOM   415  C  C     . GLU B 2  25  ? 15.588  3.734   16.025  1.00 35.48 ? 39  GLU H C     1 
ATOM   416  O  O     . GLU B 2  25  ? 15.172  3.271   14.952  1.00 35.92 ? 39  GLU H O     1 
ATOM   417  C  CB    . GLU B 2  25  ? 18.035  4.031   15.678  1.00 39.81 ? 39  GLU H CB    1 
ATOM   418  C  CG    . GLU B 2  25  ? 18.001  5.583   15.754  1.00 43.66 ? 39  GLU H CG    1 
ATOM   419  C  CD    . GLU B 2  25  ? 18.758  6.276   14.571  1.00 46.92 ? 39  GLU H CD    1 
ATOM   420  O  OE1   . GLU B 2  25  ? 19.678  5.634   13.984  1.00 49.13 ? 39  GLU H OE1   1 
ATOM   421  O  OE2   . GLU B 2  25  ? 18.450  7.458   14.237  1.00 45.37 ? 39  GLU H OE2   1 
ATOM   422  N  N     . LEU B 2  26  ? 14.883  4.582   16.772  1.00 33.09 ? 40  LEU H N     1 
ATOM   423  C  CA    . LEU B 2  26  ? 13.555  5.069   16.399  1.00 32.19 ? 40  LEU H CA    1 
ATOM   424  C  C     . LEU B 2  26  ? 13.675  6.148   15.294  1.00 31.29 ? 40  LEU H C     1 
ATOM   425  O  O     . LEU B 2  26  ? 14.178  7.246   15.537  1.00 31.14 ? 40  LEU H O     1 
ATOM   426  C  CB    . LEU B 2  26  ? 12.878  5.692   17.619  1.00 32.03 ? 40  LEU H CB    1 
ATOM   427  C  CG    . LEU B 2  26  ? 11.354  5.683   17.628  1.00 33.28 ? 40  LEU H CG    1 
ATOM   428  C  CD1   . LEU B 2  26  ? 10.876  6.985   18.242  1.00 31.23 ? 40  LEU H CD1   1 
ATOM   429  C  CD2   . LEU B 2  26  ? 10.771  5.500   16.235  1.00 33.92 ? 40  LEU H CD2   1 
ATOM   430  N  N     . LEU B 2  27  ? 13.220  5.842   14.096  1.00 27.46 ? 41  LEU H N     1 
ATOM   431  C  CA    . LEU B 2  27  ? 13.315  6.810   12.995  1.00 27.72 ? 41  LEU H CA    1 
ATOM   432  C  C     . LEU B 2  27  ? 12.126  7.758   12.740  1.00 27.98 ? 41  LEU H C     1 
ATOM   433  O  O     . LEU B 2  27  ? 12.272  8.992   12.575  1.00 28.04 ? 41  LEU H O     1 
ATOM   434  C  CB    . LEU B 2  27  ? 13.544  6.058   11.688  1.00 26.82 ? 41  LEU H CB    1 
ATOM   435  C  CG    . LEU B 2  27  ? 14.738  5.128   11.706  1.00 27.98 ? 41  LEU H CG    1 
ATOM   436  C  CD1   . LEU B 2  27  ? 14.639  4.080   10.551  1.00 27.17 ? 41  LEU H CD1   1 
ATOM   437  C  CD2   . LEU B 2  27  ? 16.009  5.990   11.601  1.00 26.49 ? 41  LEU H CD2   1 
ATOM   438  N  N     . CYS B 2  28  ? 10.940  7.177   12.689  1.00 24.45 ? 42  CYS H N     1 
ATOM   439  C  CA    . CYS B 2  28  ? 9.782   7.971   12.287  1.00 24.35 ? 42  CYS H CA    1 
ATOM   440  C  C     . CYS B 2  28  ? 8.516   7.355   12.843  1.00 20.64 ? 42  CYS H C     1 
ATOM   441  O  O     . CYS B 2  28  ? 8.546   6.326   13.500  1.00 20.62 ? 42  CYS H O     1 
ATOM   442  C  CB    . CYS B 2  28  ? 9.650   7.912   10.732  1.00 23.09 ? 42  CYS H CB    1 
ATOM   443  S  SG    . CYS B 2  28  ? 10.536  9.154   9.734   1.00 30.72 ? 42  CYS H SG    1 
ATOM   444  N  N     . GLY B 2  29  ? 7.415   8.011   12.518  1.00 21.51 ? 43  GLY H N     1 
ATOM   445  C  CA    . GLY B 2  29  ? 6.096   7.508   12.863  1.00 20.33 ? 43  GLY H CA    1 
ATOM   446  C  C     . GLY B 2  29  ? 5.584   6.889   11.556  1.00 19.81 ? 43  GLY H C     1 
ATOM   447  O  O     . GLY B 2  29  ? 6.269   6.956   10.511  1.00 19.04 ? 43  GLY H O     1 
ATOM   448  N  N     . ALA B 2  30  ? 4.402   6.285   11.645  1.00 19.70 ? 44  ALA H N     1 
ATOM   449  C  CA    . ALA B 2  30  ? 3.718   5.597   10.556  1.00 20.53 ? 44  ALA H CA    1 
ATOM   450  C  C     . ALA B 2  30  ? 2.280   5.260   11.030  1.00 20.29 ? 44  ALA H C     1 
ATOM   451  O  O     . ALA B 2  30  ? 1.924   5.480   12.198  1.00 21.15 ? 44  ALA H O     1 
ATOM   452  C  CB    . ALA B 2  30  ? 4.462   4.270   10.212  1.00 18.13 ? 44  ALA H CB    1 
ATOM   453  N  N     . SER B 2  31  ? 1.466   4.722   10.141  1.00 19.05 ? 45  SER H N     1 
ATOM   454  C  CA    . SER B 2  31  ? 0.137   4.362   10.529  1.00 21.90 ? 45  SER H CA    1 
ATOM   455  C  C     . SER B 2  31  ? -0.273  3.012   9.896   1.00 22.03 ? 45  SER H C     1 
ATOM   456  O  O     . SER B 2  31  ? 0.151   2.663   8.792   1.00 23.07 ? 45  SER H O     1 
ATOM   457  C  CB    . SER B 2  31  ? -0.860  5.437   10.101  1.00 19.83 ? 45  SER H CB    1 
ATOM   458  O  OG    . SER B 2  31  ? -0.731  5.617   8.716   1.00 21.87 ? 45  SER H OG    1 
ATOM   459  N  N     . LEU B 2  32  ? -1.150  2.317   10.592  1.00 21.55 ? 46  LEU H N     1 
ATOM   460  C  CA    . LEU B 2  32  ? -1.640  0.979   10.187  1.00 21.46 ? 46  LEU H CA    1 
ATOM   461  C  C     . LEU B 2  32  ? -2.920  1.162   9.394   1.00 20.28 ? 46  LEU H C     1 
ATOM   462  O  O     . LEU B 2  32  ? -3.893  1.666   9.947   1.00 20.00 ? 46  LEU H O     1 
ATOM   463  C  CB    . LEU B 2  32  ? -1.945  0.196   11.451  1.00 21.79 ? 46  LEU H CB    1 
ATOM   464  C  CG    . LEU B 2  32  ? -1.787  -1.327  11.677  1.00 26.42 ? 46  LEU H CG    1 
ATOM   465  C  CD1   . LEU B 2  32  ? -3.049  -1.838  12.256  1.00 22.83 ? 46  LEU H CD1   1 
ATOM   466  C  CD2   . LEU B 2  32  ? -1.215  -2.101  10.429  1.00 24.42 ? 46  LEU H CD2   1 
ATOM   467  N  N     . ILE B 2  33  ? -2.956  0.756   8.130   1.00 21.04 ? 47  ILE H N     1 
ATOM   468  C  CA    . ILE B 2  33  ? -4.169  0.928   7.376   1.00 22.18 ? 47  ILE H CA    1 
ATOM   469  C  C     . ILE B 2  33  ? -4.897  -0.399  7.100   1.00 24.71 ? 47  ILE H C     1 
ATOM   470  O  O     . ILE B 2  33  ? -6.041  -0.402  6.651   1.00 22.44 ? 47  ILE H O     1 
ATOM   471  C  CB    . ILE B 2  33  ? -3.907  1.716   6.104   1.00 24.47 ? 47  ILE H CB    1 
ATOM   472  C  CG1   . ILE B 2  33  ? -2.860  0.984   5.279   1.00 22.89 ? 47  ILE H CG1   1 
ATOM   473  C  CG2   . ILE B 2  33  ? -3.405  3.221   6.473   1.00 23.26 ? 47  ILE H CG2   1 
ATOM   474  C  CD1   . ILE B 2  33  ? -2.827  1.473   3.924   1.00 24.78 ? 47  ILE H CD1   1 
ATOM   475  N  N     . SER B 2  34  ? -4.243  -1.520  7.406   1.00 25.80 ? 48  SER H N     1 
ATOM   476  C  CA    . SER B 2  34  ? -4.864  -2.857  7.322   1.00 25.41 ? 48  SER H CA    1 
ATOM   477  C  C     . SER B 2  34  ? -3.931  -3.825  8.117   1.00 26.59 ? 48  SER H C     1 
ATOM   478  O  O     . SER B 2  34  ? -2.866  -3.401  8.642   1.00 24.99 ? 48  SER H O     1 
ATOM   479  C  CB    . SER B 2  34  ? -5.073  -3.314  5.864   1.00 24.58 ? 48  SER H CB    1 
ATOM   480  O  OG    . SER B 2  34  ? -3.876  -3.827  5.333   1.00 26.18 ? 48  SER H OG    1 
ATOM   481  N  N     . ASP B 2  35  ? -4.299  -5.104  8.229   1.00 25.42 ? 49  ASP H N     1 
ATOM   482  C  CA    . ASP B 2  35  ? -3.475  -5.957  9.008   1.00 26.31 ? 49  ASP H CA    1 
ATOM   483  C  C     . ASP B 2  35  ? -2.134  -6.259  8.352   1.00 26.94 ? 49  ASP H C     1 
ATOM   484  O  O     . ASP B 2  35  ? -1.245  -6.779  9.014   1.00 26.94 ? 49  ASP H O     1 
ATOM   485  C  CB    . ASP B 2  35  ? -4.222  -7.224  9.427   1.00 29.24 ? 49  ASP H CB    1 
ATOM   486  C  CG    . ASP B 2  35  ? -4.337  -8.264  8.308   1.00 33.03 ? 49  ASP H CG    1 
ATOM   487  O  OD1   . ASP B 2  35  ? -3.859  -8.025  7.158   1.00 33.24 ? 49  ASP H OD1   1 
ATOM   488  O  OD2   . ASP B 2  35  ? -4.912  -9.355  8.611   1.00 33.87 ? 49  ASP H OD2   1 
ATOM   489  N  N     . ARG B 2  36  ? -1.941  -5.844  7.101   1.00 26.62 ? 50  ARG H N     1 
ATOM   490  C  CA    . ARG B 2  36  ? -0.667  -6.127  6.474   1.00 28.70 ? 50  ARG H CA    1 
ATOM   491  C  C     . ARG B 2  36  ? 0.023   -4.927  5.811   1.00 27.55 ? 50  ARG H C     1 
ATOM   492  O  O     . ARG B 2  36  ? 1.158   -5.047  5.283   1.00 28.87 ? 50  ARG H O     1 
ATOM   493  C  CB    . ARG B 2  36  ? -0.828  -7.299  5.461   1.00 31.45 ? 50  ARG H CB    1 
ATOM   494  C  CG    . ARG B 2  36  ? 0.419   -8.131  5.468   1.00 38.14 ? 50  ARG H CG    1 
ATOM   495  C  CD    . ARG B 2  36  ? 0.290   -9.558  5.014   1.00 43.53 ? 50  ARG H CD    1 
ATOM   496  N  NE    . ARG B 2  36  ? 1.623   -10.019 4.602   1.00 46.68 ? 50  ARG H NE    1 
ATOM   497  C  CZ    . ARG B 2  36  ? 1.871   -11.167 3.975   1.00 49.25 ? 50  ARG H CZ    1 
ATOM   498  N  NH1   . ARG B 2  36  ? 0.866   -11.990 3.684   1.00 49.31 ? 50  ARG H NH1   1 
ATOM   499  N  NH2   . ARG B 2  36  ? 3.122   -11.487 3.625   1.00 50.40 ? 50  ARG H NH2   1 
ATOM   500  N  N     . TRP B 2  37  ? -0.639  -3.772  5.838   1.00 25.14 ? 51  TRP H N     1 
ATOM   501  C  CA    . TRP B 2  37  ? -0.065  -2.572  5.226   1.00 23.24 ? 51  TRP H CA    1 
ATOM   502  C  C     . TRP B 2  37  ? 0.068   -1.407  6.202   1.00 22.85 ? 51  TRP H C     1 
ATOM   503  O  O     . TRP B 2  37  ? -0.893  -1.113  6.966   1.00 21.05 ? 51  TRP H O     1 
ATOM   504  C  CB    . TRP B 2  37  ? -0.924  -2.097  4.053   1.00 23.47 ? 51  TRP H CB    1 
ATOM   505  C  CG    . TRP B 2  37  ? -0.884  -2.957  2.810   1.00 26.27 ? 51  TRP H CG    1 
ATOM   506  C  CD1   . TRP B 2  37  ? -1.795  -3.939  2.457   1.00 29.02 ? 51  TRP H CD1   1 
ATOM   507  C  CD2   . TRP B 2  37  ? 0.088   -2.925  1.766   1.00 27.04 ? 51  TRP H CD2   1 
ATOM   508  N  NE1   . TRP B 2  37  ? -1.445  -4.493  1.268   1.00 30.22 ? 51  TRP H NE1   1 
ATOM   509  C  CE2   . TRP B 2  37  ? -0.298  -3.904  0.809   1.00 28.69 ? 51  TRP H CE2   1 
ATOM   510  C  CE3   . TRP B 2  37  ? 1.258   -2.166  1.537   1.00 27.79 ? 51  TRP H CE3   1 
ATOM   511  C  CZ2   . TRP B 2  37  ? 0.431   -4.145  -0.363  1.00 27.79 ? 51  TRP H CZ2   1 
ATOM   512  C  CZ3   . TRP B 2  37  ? 1.990   -2.402  0.373   1.00 26.80 ? 51  TRP H CZ3   1 
ATOM   513  C  CH2   . TRP B 2  37  ? 1.567   -3.392  -0.570  1.00 29.94 ? 51  TRP H CH2   1 
ATOM   514  N  N     . VAL B 2  38  ? 1.216   -0.728  6.113   1.00 20.75 ? 52  VAL H N     1 
ATOM   515  C  CA    . VAL B 2  38  ? 1.550   0.445   6.955   1.00 21.70 ? 52  VAL H CA    1 
ATOM   516  C  C     . VAL B 2  38  ? 1.894   1.656   6.049   1.00 22.74 ? 52  VAL H C     1 
ATOM   517  O  O     . VAL B 2  38  ? 2.584   1.519   5.024   1.00 25.19 ? 52  VAL H O     1 
ATOM   518  C  CB    . VAL B 2  38  ? 2.776   0.140   7.896   1.00 20.85 ? 52  VAL H CB    1 
ATOM   519  C  CG1   . VAL B 2  38  ? 3.234   1.426   8.692   1.00 19.39 ? 52  VAL H CG1   1 
ATOM   520  C  CG2   . VAL B 2  38  ? 2.390   -1.006  8.858   1.00 18.01 ? 52  VAL H CG2   1 
ATOM   521  N  N     . LEU B 2  39  ? 1.358   2.814   6.390   1.00 21.14 ? 53  LEU H N     1 
ATOM   522  C  CA    . LEU B 2  39  ? 1.585   4.040   5.628   1.00 22.44 ? 53  LEU H CA    1 
ATOM   523  C  C     . LEU B 2  39  ? 2.633   4.905   6.322   1.00 21.83 ? 53  LEU H C     1 
ATOM   524  O  O     . LEU B 2  39  ? 2.657   4.948   7.554   1.00 18.03 ? 53  LEU H O     1 
ATOM   525  C  CB    . LEU B 2  39  ? 0.277   4.834   5.578   1.00 24.53 ? 53  LEU H CB    1 
ATOM   526  C  CG    . LEU B 2  39  ? 0.029   5.983   4.584   1.00 27.38 ? 53  LEU H CG    1 
ATOM   527  C  CD1   . LEU B 2  39  ? 0.142   5.456   3.099   1.00 25.01 ? 53  LEU H CD1   1 
ATOM   528  C  CD2   . LEU B 2  39  ? -1.403  6.593   4.825   1.00 26.52 ? 53  LEU H CD2   1 
ATOM   529  N  N     . THR B 2  40  ? 3.508   5.563   5.548   1.00 21.83 ? 54  THR H N     1 
ATOM   530  C  CA    . THR B 2  40  ? 4.460   6.464   6.171   1.00 22.13 ? 54  THR H CA    1 
ATOM   531  C  C     . THR B 2  40  ? 4.881   7.548   5.176   1.00 22.78 ? 54  THR H C     1 
ATOM   532  O  O     . THR B 2  40  ? 4.313   7.669   4.080   1.00 21.47 ? 54  THR H O     1 
ATOM   533  C  CB    . THR B 2  40  ? 5.708   5.702   6.717   1.00 22.40 ? 54  THR H CB    1 
ATOM   534  O  OG1   . THR B 2  40  ? 6.439   6.580   7.600   1.00 21.77 ? 54  THR H OG1   1 
ATOM   535  C  CG2   . THR B 2  40  ? 6.622   5.264   5.576   1.00 21.38 ? 54  THR H CG2   1 
ATOM   536  N  N     . ALA B 2  41  ? 5.823   8.400   5.561   1.00 22.51 ? 55  ALA H N     1 
ATOM   537  C  CA    . ALA B 2  41  ? 6.247   9.398   4.609   1.00 22.73 ? 55  ALA H CA    1 
ATOM   538  C  C     . ALA B 2  41  ? 7.473   8.882   3.774   1.00 21.98 ? 55  ALA H C     1 
ATOM   539  O  O     . ALA B 2  41  ? 8.409   8.250   4.323   1.00 20.89 ? 55  ALA H O     1 
ATOM   540  C  CB    . ALA B 2  41  ? 6.604   10.691  5.352   1.00 23.92 ? 55  ALA H CB    1 
ATOM   541  N  N     . ALA B 2  42  ? 7.486   9.160   2.472   1.00 21.75 ? 56  ALA H N     1 
ATOM   542  C  CA    . ALA B 2  42  ? 8.649   8.736   1.648   1.00 22.12 ? 56  ALA H CA    1 
ATOM   543  C  C     . ALA B 2  42  ? 10.023  9.197   2.221   1.00 23.89 ? 56  ALA H C     1 
ATOM   544  O  O     . ALA B 2  42  ? 10.971  8.392   2.205   1.00 23.37 ? 56  ALA H O     1 
ATOM   545  C  CB    . ALA B 2  42  ? 8.531   9.266   0.252   1.00 20.22 ? 56  ALA H CB    1 
ATOM   546  N  N     . HIS B 2  43  ? 10.148  10.450  2.712   1.00 23.40 ? 57  HIS H N     1 
ATOM   547  C  CA    . HIS B 2  43  ? 11.463  10.925  3.239   1.00 23.33 ? 57  HIS H CA    1 
ATOM   548  C  C     . HIS B 2  43  ? 11.964  10.142  4.437   1.00 24.47 ? 57  HIS H C     1 
ATOM   549  O  O     . HIS B 2  43  ? 13.138  10.289  4.838   1.00 24.92 ? 57  HIS H O     1 
ATOM   550  C  CB    . HIS B 2  43  ? 11.506  12.473  3.554   1.00 23.49 ? 57  HIS H CB    1 
ATOM   551  C  CG    . HIS B 2  43  ? 10.988  12.892  4.913   1.00 23.99 ? 57  HIS H CG    1 
ATOM   552  N  ND1   . HIS B 2  43  ? 9.736   13.447  5.071   1.00 22.73 ? 57  HIS H ND1   1 
ATOM   553  C  CD2   . HIS B 2  43  ? 11.552  12.893  6.163   1.00 23.37 ? 57  HIS H CD2   1 
ATOM   554  C  CE1   . HIS B 2  43  ? 9.598   13.757  6.353   1.00 22.20 ? 57  HIS H CE1   1 
ATOM   555  N  NE2   . HIS B 2  43  ? 10.692  13.421  7.035   1.00 20.98 ? 57  HIS H NE2   1 
ATOM   556  N  N     . CYS B 2  44  ? 11.103  9.326   5.037   1.00 23.95 ? 58  CYS H N     1 
ATOM   557  C  CA    . CYS B 2  44  ? 11.563  8.510   6.160   1.00 24.96 ? 58  CYS H CA    1 
ATOM   558  C  C     . CYS B 2  44  ? 12.391  7.338   5.609   1.00 24.80 ? 58  CYS H C     1 
ATOM   559  O  O     . CYS B 2  44  ? 13.198  6.787   6.330   1.00 25.25 ? 58  CYS H O     1 
ATOM   560  C  CB    . CYS B 2  44  ? 10.379  7.941   6.974   1.00 24.76 ? 58  CYS H CB    1 
ATOM   561  S  SG    . CYS B 2  44  ? 9.524   9.244   7.960   1.00 26.54 ? 58  CYS H SG    1 
ATOM   562  N  N     . LEU B 2  45  ? 12.174  6.971   4.352   1.00 23.01 ? 59  LEU H N     1 
ATOM   563  C  CA    . LEU B 2  45  ? 12.872  5.825   3.741   1.00 24.71 ? 59  LEU H CA    1 
ATOM   564  C  C     . LEU B 2  45  ? 13.933  6.229   2.741   1.00 26.08 ? 59  LEU H C     1 
ATOM   565  O  O     . LEU B 2  45  ? 14.966  5.569   2.620   1.00 26.86 ? 59  LEU H O     1 
ATOM   566  C  CB    . LEU B 2  45  ? 11.853  4.922   3.015   1.00 25.19 ? 59  LEU H CB    1 
ATOM   567  C  CG    . LEU B 2  45  ? 10.622  4.472   3.817   1.00 26.64 ? 59  LEU H CG    1 
ATOM   568  C  CD1   . LEU B 2  45  ? 9.657   3.702   2.927   1.00 28.85 ? 59  LEU H CD1   1 
ATOM   569  C  CD2   . LEU B 2  45  ? 11.057  3.611   4.991   1.00 29.76 ? 59  LEU H CD2   1 
ATOM   570  N  N     . LEU B 2  46  ? 13.644  7.293   1.993   1.00 26.06 ? 60  LEU H N     1 
ATOM   571  C  CA    . LEU B 2  46  ? 14.531  7.830   0.978   1.00 26.31 ? 60  LEU H CA    1 
ATOM   572  C  C     . LEU B 2  46  ? 14.727  9.346   1.034   1.00 26.79 ? 60  LEU H C     1 
ATOM   573  O  O     . LEU B 2  46  ? 13.769  10.131  0.863   1.00 27.14 ? 60  LEU H O     1 
ATOM   574  C  CB    . LEU B 2  46  ? 13.992  7.474   -0.400  1.00 27.95 ? 60  LEU H CB    1 
ATOM   575  C  CG    . LEU B 2  46  ? 14.782  7.977   -1.613  1.00 28.31 ? 60  LEU H CG    1 
ATOM   576  C  CD1   . LEU B 2  46  ? 16.203  7.312   -1.570  1.00 27.79 ? 60  LEU H CD1   1 
ATOM   577  C  CD2   . LEU B 2  46  ? 14.004  7.615   -2.933  1.00 25.68 ? 60  LEU H CD2   1 
ATOM   578  N  N     . TYR B 2  47  A 15.955  9.767   1.316   1.00 25.90 ? 60  TYR H N     1 
ATOM   579  C  CA    . TYR B 2  47  A 16.282  11.182  1.302   1.00 25.05 ? 60  TYR H CA    1 
ATOM   580  C  C     . TYR B 2  47  A 17.807  11.344  1.146   1.00 25.02 ? 60  TYR H C     1 
ATOM   581  O  O     . TYR B 2  47  A 18.543  11.471  2.120   1.00 26.14 ? 60  TYR H O     1 
ATOM   582  C  CB    . TYR B 2  47  A 15.775  11.883  2.559   1.00 21.52 ? 60  TYR H CB    1 
ATOM   583  C  CG    . TYR B 2  47  A 15.810  13.387  2.396   1.00 21.61 ? 60  TYR H CG    1 
ATOM   584  C  CD1   . TYR B 2  47  A 15.039  14.005  1.419   1.00 18.99 ? 60  TYR H CD1   1 
ATOM   585  C  CD2   . TYR B 2  47  A 16.645  14.191  3.213   1.00 23.21 ? 60  TYR H CD2   1 
ATOM   586  C  CE1   . TYR B 2  47  A 15.086  15.387  1.220   1.00 21.56 ? 60  TYR H CE1   1 
ATOM   587  C  CE2   . TYR B 2  47  A 16.723  15.593  3.051   1.00 24.00 ? 60  TYR H CE2   1 
ATOM   588  C  CZ    . TYR B 2  47  A 15.927  16.194  2.026   1.00 24.20 ? 60  TYR H CZ    1 
ATOM   589  O  OH    . TYR B 2  47  A 15.982  17.555  1.797   1.00 25.22 ? 60  TYR H OH    1 
ATOM   590  N  N     . PRO B 2  48  B 18.303  11.322  -0.101  1.00 26.82 ? 60  PRO H N     1 
ATOM   591  C  CA    . PRO B 2  48  B 19.746  11.459  -0.381  1.00 27.24 ? 60  PRO H CA    1 
ATOM   592  C  C     . PRO B 2  48  B 20.516  12.599  0.293   1.00 27.98 ? 60  PRO H C     1 
ATOM   593  O  O     . PRO B 2  48  B 21.695  12.434  0.637   1.00 30.03 ? 60  PRO H O     1 
ATOM   594  C  CB    . PRO B 2  48  B 19.792  11.595  -1.893  1.00 26.80 ? 60  PRO H CB    1 
ATOM   595  C  CG    . PRO B 2  48  B 18.635  10.771  -2.337  1.00 26.10 ? 60  PRO H CG    1 
ATOM   596  C  CD    . PRO B 2  48  B 17.546  11.206  -1.350  1.00 24.61 ? 60  PRO H CD    1 
ATOM   597  N  N     . PRO B 2  49  C 19.892  13.777  0.464   1.00 27.50 ? 60  PRO H N     1 
ATOM   598  C  CA    . PRO B 2  49  C 20.638  14.886  1.114   1.00 27.62 ? 60  PRO H CA    1 
ATOM   599  C  C     . PRO B 2  49  C 21.124  14.541  2.522   1.00 28.67 ? 60  PRO H C     1 
ATOM   600  O  O     . PRO B 2  49  C 22.071  15.136  3.022   1.00 30.30 ? 60  PRO H O     1 
ATOM   601  C  CB    . PRO B 2  49  C 19.629  16.056  1.075   1.00 25.43 ? 60  PRO H CB    1 
ATOM   602  C  CG    . PRO B 2  49  C 18.850  15.740  -0.198  1.00 24.25 ? 60  PRO H CG    1 
ATOM   603  C  CD    . PRO B 2  49  C 18.595  14.252  -0.062  1.00 23.89 ? 60  PRO H CD    1 
ATOM   604  N  N     . TRP B 2  50  D 20.456  13.588  3.159   1.00 29.10 ? 60  TRP H N     1 
ATOM   605  C  CA    . TRP B 2  50  D 20.852  13.110  4.482   1.00 29.19 ? 60  TRP H CA    1 
ATOM   606  C  C     . TRP B 2  50  D 21.424  11.658  4.357   1.00 30.12 ? 60  TRP H C     1 
ATOM   607  O  O     . TRP B 2  50  D 21.478  10.907  5.329   1.00 29.47 ? 60  TRP H O     1 
ATOM   608  C  CB    . TRP B 2  50  D 19.650  13.113  5.444   1.00 30.06 ? 60  TRP H CB    1 
ATOM   609  C  CG    . TRP B 2  50  D 19.107  14.504  5.823   1.00 30.58 ? 60  TRP H CG    1 
ATOM   610  C  CD1   . TRP B 2  50  D 19.714  15.722  5.632   1.00 29.77 ? 60  TRP H CD1   1 
ATOM   611  C  CD2   . TRP B 2  50  D 17.869  14.781  6.506   1.00 31.40 ? 60  TRP H CD2   1 
ATOM   612  N  NE1   . TRP B 2  50  D 18.934  16.730  6.148   1.00 30.18 ? 60  TRP H NE1   1 
ATOM   613  C  CE2   . TRP B 2  50  D 17.801  16.179  6.700   1.00 32.06 ? 60  TRP H CE2   1 
ATOM   614  C  CE3   . TRP B 2  50  D 16.829  13.987  6.978   1.00 31.80 ? 60  TRP H CE3   1 
ATOM   615  C  CZ2   . TRP B 2  50  D 16.723  16.798  7.360   1.00 33.10 ? 60  TRP H CZ2   1 
ATOM   616  C  CZ3   . TRP B 2  50  D 15.738  14.611  7.637   1.00 32.74 ? 60  TRP H CZ3   1 
ATOM   617  C  CH2   . TRP B 2  50  D 15.707  16.001  7.818   1.00 32.16 ? 60  TRP H CH2   1 
ATOM   618  N  N     . ASP B 2  51  E 21.838  11.272  3.155   1.00 30.45 ? 60  ASP H N     1 
ATOM   619  C  CA    . ASP B 2  51  E 22.438  9.945   2.943   1.00 32.54 ? 60  ASP H CA    1 
ATOM   620  C  C     . ASP B 2  51  E 21.479  8.822   3.368   1.00 32.94 ? 60  ASP H C     1 
ATOM   621  O  O     . ASP B 2  51  E 21.911  7.781   3.878   1.00 32.63 ? 60  ASP H O     1 
ATOM   622  C  CB    . ASP B 2  51  E 23.755  9.829   3.740   1.00 33.52 ? 60  ASP H CB    1 
ATOM   623  C  CG    . ASP B 2  51  E 24.580  8.591   3.340   1.00 35.99 ? 60  ASP H CG    1 
ATOM   624  O  OD1   . ASP B 2  51  E 25.343  8.055   4.211   1.00 34.21 ? 60  ASP H OD1   1 
ATOM   625  O  OD2   . ASP B 2  51  E 24.462  8.166   2.154   1.00 36.61 ? 60  ASP H OD2   1 
ATOM   626  N  N     . LYS B 2  52  F 20.188  9.033   3.128   1.00 30.86 ? 60  LYS H N     1 
ATOM   627  C  CA    . LYS B 2  52  F 19.173  8.060   3.526   1.00 30.57 ? 60  LYS H CA    1 
ATOM   628  C  C     . LYS B 2  52  F 18.575  7.265   2.317   1.00 29.74 ? 60  LYS H C     1 
ATOM   629  O  O     . LYS B 2  52  F 18.026  7.865   1.358   1.00 26.35 ? 60  LYS H O     1 
ATOM   630  C  CB    . LYS B 2  52  F 18.081  8.856   4.289   1.00 30.34 ? 60  LYS H CB    1 
ATOM   631  C  CG    . LYS B 2  52  F 17.044  8.097   5.051   1.00 34.38 ? 60  LYS H CG    1 
ATOM   632  C  CD    . LYS B 2  52  F 16.071  9.108   5.795   1.00 35.61 ? 60  LYS H CD    1 
ATOM   633  C  CE    . LYS B 2  52  F 16.648  9.770   7.056   1.00 36.50 ? 60  LYS H CE    1 
ATOM   634  N  NZ    . LYS B 2  52  F 16.958  8.850   8.255   1.00 36.15 ? 60  LYS H NZ    1 
ATOM   635  N  N     . ASN B 2  53  G 18.650  5.937   2.374   1.00 28.56 ? 60  ASN H N     1 
ATOM   636  C  CA    . ASN B 2  53  G 18.083  5.102   1.293   1.00 34.03 ? 60  ASN H CA    1 
ATOM   637  C  C     . ASN B 2  53  G 17.935  3.688   1.851   1.00 34.18 ? 60  ASN H C     1 
ATOM   638  O  O     . ASN B 2  53  G 18.803  2.858   1.646   1.00 35.48 ? 60  ASN H O     1 
ATOM   639  C  CB    . ASN B 2  53  G 19.007  5.084   0.031   1.00 34.37 ? 60  ASN H CB    1 
ATOM   640  C  CG    . ASN B 2  53  G 18.360  4.342   -1.173  1.00 40.18 ? 60  ASN H CG    1 
ATOM   641  O  OD1   . ASN B 2  53  G 17.288  3.757   -1.048  1.00 37.34 ? 60  ASN H OD1   1 
ATOM   642  N  ND2   . ASN B 2  53  G 19.002  4.375   -2.337  1.00 46.07 ? 60  ASN H ND2   1 
ATOM   643  N  N     . PHE B 2  54  H 16.849  3.411   2.563   1.00 35.23 ? 60  PHE H N     1 
ATOM   644  C  CA    . PHE B 2  54  H 16.662  2.096   3.203   1.00 35.22 ? 60  PHE H CA    1 
ATOM   645  C  C     . PHE B 2  54  H 15.994  1.028   2.358   1.00 36.61 ? 60  PHE H C     1 
ATOM   646  O  O     . PHE B 2  54  H 15.204  1.325   1.449   1.00 35.06 ? 60  PHE H O     1 
ATOM   647  C  CB    . PHE B 2  54  H 15.822  2.229   4.466   1.00 33.97 ? 60  PHE H CB    1 
ATOM   648  C  CG    . PHE B 2  54  H 16.471  3.000   5.579   1.00 34.16 ? 60  PHE H CG    1 
ATOM   649  C  CD1   . PHE B 2  54  H 17.505  2.448   6.321   1.00 34.25 ? 60  PHE H CD1   1 
ATOM   650  C  CD2   . PHE B 2  54  H 15.988  4.249   5.946   1.00 35.35 ? 60  PHE H CD2   1 
ATOM   651  C  CE1   . PHE B 2  54  H 18.051  3.115   7.414   1.00 35.49 ? 60  PHE H CE1   1 
ATOM   652  C  CE2   . PHE B 2  54  H 16.519  4.936   7.035   1.00 34.57 ? 60  PHE H CE2   1 
ATOM   653  C  CZ    . PHE B 2  54  H 17.553  4.376   7.779   1.00 35.88 ? 60  PHE H CZ    1 
ATOM   654  N  N     . THR B 2  55  I 16.312  -0.228  2.654   1.00 38.67 ? 60  THR H N     1 
ATOM   655  C  CA    . THR B 2  55  I 15.663  -1.335  1.941   1.00 41.37 ? 60  THR H CA    1 
ATOM   656  C  C     . THR B 2  55  I 14.893  -2.057  3.054   1.00 41.30 ? 60  THR H C     1 
ATOM   657  O  O     . THR B 2  55  I 15.123  -1.769  4.219   1.00 40.26 ? 60  THR H O     1 
ATOM   658  C  CB    . THR B 2  55  I 16.690  -2.334  1.293   1.00 42.39 ? 60  THR H CB    1 
ATOM   659  O  OG1   . THR B 2  55  I 17.462  -2.968  2.326   1.00 43.91 ? 60  THR H OG1   1 
ATOM   660  C  CG2   . THR B 2  55  I 17.653  -1.593  0.317   1.00 43.47 ? 60  THR H CG2   1 
ATOM   661  N  N     . GLU B 2  56  ? 14.015  -2.993  2.683   1.00 42.09 ? 61  GLU H N     1 
ATOM   662  C  CA    . GLU B 2  56  ? 13.197  -3.774  3.614   1.00 41.78 ? 61  GLU H CA    1 
ATOM   663  C  C     . GLU B 2  56  ? 13.963  -4.389  4.781   1.00 41.73 ? 61  GLU H C     1 
ATOM   664  O  O     . GLU B 2  56  ? 13.605  -4.221  5.960   1.00 40.01 ? 61  GLU H O     1 
ATOM   665  C  CB    . GLU B 2  56  ? 12.481  -4.887  2.843   1.00 44.70 ? 61  GLU H CB    1 
ATOM   666  C  CG    . GLU B 2  56  ? 11.831  -4.457  1.548   1.00 48.06 ? 61  GLU H CG    1 
ATOM   667  C  CD    . GLU B 2  56  ? 12.804  -4.432  0.379   1.00 50.96 ? 61  GLU H CD    1 
ATOM   668  O  OE1   . GLU B 2  56  ? 13.658  -3.517  0.328   1.00 52.41 ? 61  GLU H OE1   1 
ATOM   669  O  OE2   . GLU B 2  56  ? 12.727  -5.338  -0.486  1.00 53.48 ? 61  GLU H OE2   1 
ATOM   670  N  N     . ASN B 2  57  ? 15.041  -5.094  4.443   1.00 42.54 ? 62  ASN H N     1 
ATOM   671  C  CA    . ASN B 2  57  ? 15.888  -5.740  5.426   1.00 42.97 ? 62  ASN H CA    1 
ATOM   672  C  C     . ASN B 2  57  ? 16.468  -4.842  6.486   1.00 41.61 ? 62  ASN H C     1 
ATOM   673  O  O     . ASN B 2  57  ? 16.830  -5.339  7.560   1.00 41.61 ? 62  ASN H O     1 
ATOM   674  C  CB    . ASN B 2  57  ? 17.048  -6.433  4.728   1.00 47.57 ? 62  ASN H CB    1 
ATOM   675  C  CG    . ASN B 2  57  ? 16.596  -7.591  3.875   1.00 52.14 ? 62  ASN H CG    1 
ATOM   676  O  OD1   . ASN B 2  57  ? 16.275  -8.672  4.397   1.00 54.75 ? 62  ASN H OD1   1 
ATOM   677  N  ND2   . ASN B 2  57  ? 16.531  -7.371  2.553   1.00 54.75 ? 62  ASN H ND2   1 
ATOM   678  N  N     . ASP B 2  58  ? 16.568  -3.532  6.222   1.00 39.09 ? 63  ASP H N     1 
ATOM   679  C  CA    . ASP B 2  58  ? 17.197  -2.638  7.211   1.00 37.20 ? 63  ASP H CA    1 
ATOM   680  C  C     . ASP B 2  58  ? 16.266  -2.123  8.308   1.00 35.80 ? 63  ASP H C     1 
ATOM   681  O  O     . ASP B 2  58  ? 16.705  -1.444  9.221   1.00 35.59 ? 63  ASP H O     1 
ATOM   682  C  CB    . ASP B 2  58  ? 17.818  -1.403  6.517   1.00 40.71 ? 63  ASP H CB    1 
ATOM   683  C  CG    . ASP B 2  58  ? 18.681  -1.758  5.288   1.00 42.75 ? 63  ASP H CG    1 
ATOM   684  O  OD1   . ASP B 2  58  ? 18.432  -1.198  4.178   1.00 43.85 ? 63  ASP H OD1   1 
ATOM   685  O  OD2   . ASP B 2  58  ? 19.600  -2.593  5.427   1.00 43.69 ? 63  ASP H OD2   1 
ATOM   686  N  N     . LEU B 2  59  ? 14.992  -2.479  8.259   1.00 34.65 ? 64  LEU H N     1 
ATOM   687  C  CA    . LEU B 2  59  ? 14.055  -1.893  9.204   1.00 35.05 ? 64  LEU H CA    1 
ATOM   688  C  C     . LEU B 2  59  ? 13.096  -2.859  9.823   1.00 34.20 ? 64  LEU H C     1 
ATOM   689  O  O     . LEU B 2  59  ? 13.035  -4.010  9.468   1.00 34.43 ? 64  LEU H O     1 
ATOM   690  C  CB    . LEU B 2  59  ? 13.192  -0.836  8.471   1.00 32.51 ? 64  LEU H CB    1 
ATOM   691  C  CG    . LEU B 2  59  ? 13.854  0.260   7.613   1.00 32.25 ? 64  LEU H CG    1 
ATOM   692  C  CD1   . LEU B 2  59  ? 12.910  0.661   6.503   1.00 31.98 ? 64  LEU H CD1   1 
ATOM   693  C  CD2   . LEU B 2  59  ? 14.274  1.472   8.460   1.00 31.00 ? 64  LEU H CD2   1 
ATOM   694  N  N     . LEU B 2  60  ? 12.323  -2.349  10.755  1.00 34.74 ? 65  LEU H N     1 
ATOM   695  C  CA    . LEU B 2  60  ? 11.282  -3.108  11.372  1.00 34.35 ? 65  LEU H CA    1 
ATOM   696  C  C     . LEU B 2  60  ? 10.286  -2.138  11.978  1.00 33.38 ? 65  LEU H C     1 
ATOM   697  O  O     . LEU B 2  60  ? 10.588  -0.959  12.204  1.00 32.63 ? 65  LEU H O     1 
ATOM   698  C  CB    . LEU B 2  60  ? 11.830  -4.226  12.345  1.00 35.71 ? 65  LEU H CB    1 
ATOM   699  C  CG    . LEU B 2  60  ? 12.273  -3.955  13.811  1.00 38.19 ? 65  LEU H CG    1 
ATOM   700  C  CD1   . LEU B 2  60  ? 13.799  -4.036  13.895  1.00 38.66 ? 65  LEU H CD1   1 
ATOM   701  C  CD2   . LEU B 2  60  ? 11.758  -2.605  14.278  1.00 38.69 ? 65  LEU H CD2   1 
ATOM   702  N  N     . VAL B 2  61  ? 9.101   -2.646  12.243  1.00 31.70 ? 66  VAL H N     1 
ATOM   703  C  CA    . VAL B 2  61  ? 8.120   -1.789  12.825  1.00 31.18 ? 66  VAL H CA    1 
ATOM   704  C  C     . VAL B 2  61  ? 7.542   -2.294  14.174  1.00 30.12 ? 66  VAL H C     1 
ATOM   705  O  O     . VAL B 2  61  ? 7.468   -3.519  14.415  1.00 28.80 ? 66  VAL H O     1 
ATOM   706  C  CB    . VAL B 2  61  ? 7.063   -1.609  11.757  1.00 32.72 ? 66  VAL H CB    1 
ATOM   707  C  CG1   . VAL B 2  61  ? 6.126   -2.852  11.652  1.00 30.56 ? 66  VAL H CG1   1 
ATOM   708  C  CG2   . VAL B 2  61  ? 6.427   -0.367  11.967  1.00 36.03 ? 66  VAL H CG2   1 
ATOM   709  N  N     . ARG B 2  62  ? 7.182   -1.365  15.056  1.00 26.72 ? 67  ARG H N     1 
ATOM   710  C  CA    . ARG B 2  62  ? 6.549   -1.762  16.303  1.00 28.08 ? 67  ARG H CA    1 
ATOM   711  C  C     . ARG B 2  62  ? 5.108   -1.190  16.386  1.00 26.67 ? 67  ARG H C     1 
ATOM   712  O  O     . ARG B 2  62  ? 4.870   -0.027  16.110  1.00 23.58 ? 67  ARG H O     1 
ATOM   713  C  CB    . ARG B 2  62  ? 7.396   -1.360  17.516  1.00 29.32 ? 67  ARG H CB    1 
ATOM   714  C  CG    . ARG B 2  62  ? 8.732   -2.138  17.539  1.00 31.76 ? 67  ARG H CG    1 
ATOM   715  C  CD    . ARG B 2  62  ? 9.510   -1.936  18.841  1.00 33.59 ? 67  ARG H CD    1 
ATOM   716  N  NE    . ARG B 2  62  ? 10.801  -2.604  18.753  1.00 37.54 ? 67  ARG H NE    1 
ATOM   717  C  CZ    . ARG B 2  62  ? 11.025  -3.899  18.988  1.00 38.91 ? 67  ARG H CZ    1 
ATOM   718  N  NH1   . ARG B 2  62  ? 10.039  -4.716  19.334  1.00 39.43 ? 67  ARG H NH1   1 
ATOM   719  N  NH2   . ARG B 2  62  ? 12.267  -4.382  18.896  1.00 40.94 ? 67  ARG H NH2   1 
ATOM   720  N  N     . ILE B 2  63  ? 4.167   -2.031  16.814  1.00 24.46 ? 68  ILE H N     1 
ATOM   721  C  CA    . ILE B 2  63  ? 2.773   -1.635  16.818  1.00 24.42 ? 68  ILE H CA    1 
ATOM   722  C  C     . ILE B 2  63  ? 2.171   -1.877  18.187  1.00 24.64 ? 68  ILE H C     1 
ATOM   723  O  O     . ILE B 2  63  ? 2.573   -2.801  18.878  1.00 23.86 ? 68  ILE H O     1 
ATOM   724  C  CB    . ILE B 2  63  ? 2.042   -2.498  15.779  1.00 23.39 ? 68  ILE H CB    1 
ATOM   725  C  CG1   . ILE B 2  63  ? 2.903   -2.600  14.498  1.00 23.33 ? 68  ILE H CG1   1 
ATOM   726  C  CG2   . ILE B 2  63  ? 0.635   -1.953  15.494  1.00 19.20 ? 68  ILE H CG2   1 
ATOM   727  C  CD1   . ILE B 2  63  ? 2.230   -3.628  13.397  1.00 21.96 ? 68  ILE H CD1   1 
ATOM   728  N  N     . GLY B 2  64  ? 1.169   -1.086  18.556  1.00 26.59 ? 69  GLY H N     1 
ATOM   729  C  CA    . GLY B 2  64  ? 0.562   -1.227  19.883  1.00 27.07 ? 69  GLY H CA    1 
ATOM   730  C  C     . GLY B 2  64  ? 1.571   -0.950  20.991  1.00 29.29 ? 69  GLY H C     1 
ATOM   731  O  O     . GLY B 2  64  ? 1.480   -1.592  22.047  1.00 28.12 ? 69  GLY H O     1 
ATOM   732  N  N     . LYS B 2  65  ? 2.533   -0.027  20.780  1.00 31.12 ? 70  LYS H N     1 
ATOM   733  C  CA    . LYS B 2  65  ? 3.596   0.252   21.795  1.00 31.59 ? 70  LYS H CA    1 
ATOM   734  C  C     . LYS B 2  65  ? 3.378   1.537   22.580  1.00 33.93 ? 70  LYS H C     1 
ATOM   735  O  O     . LYS B 2  65  ? 3.398   2.617   22.012  1.00 35.53 ? 70  LYS H O     1 
ATOM   736  C  CB    . LYS B 2  65  ? 5.008   0.242   21.143  1.00 31.92 ? 70  LYS H CB    1 
ATOM   737  C  CG    . LYS B 2  65  ? 6.212   0.575   22.095  1.00 31.61 ? 70  LYS H CG    1 
ATOM   738  C  CD    . LYS B 2  65  ? 7.534   0.224   21.451  1.00 35.33 ? 70  LYS H CD    1 
ATOM   739  C  CE    . LYS B 2  65  ? 8.731   0.173   22.439  1.00 37.08 ? 70  LYS H CE    1 
ATOM   740  N  NZ    . LYS B 2  65  ? 8.483   -0.705  23.622  1.00 34.07 ? 70  LYS H NZ    1 
ATOM   741  N  N     . HIS B 2  66  ? 3.250   1.439   23.900  1.00 33.83 ? 71  HIS H N     1 
ATOM   742  C  CA    . HIS B 2  66  ? 2.923   2.622   24.694  1.00 34.41 ? 71  HIS H CA    1 
ATOM   743  C  C     . HIS B 2  66  ? 4.110   3.302   25.380  1.00 35.55 ? 71  HIS H C     1 
ATOM   744  O  O     . HIS B 2  66  ? 4.062   4.500   25.648  1.00 35.60 ? 71  HIS H O     1 
ATOM   745  C  CB    A HIS B 2  66  ? 1.897   2.211   25.761  0.60 32.25 ? 71  HIS H CB    1 
ATOM   746  C  CB    B HIS B 2  66  ? 1.831   2.302   25.738  0.40 34.50 ? 71  HIS H CB    1 
ATOM   747  C  CG    A HIS B 2  66  ? 0.721   1.460   25.215  0.60 29.88 ? 71  HIS H CG    1 
ATOM   748  C  CG    B HIS B 2  66  ? 1.186   3.519   26.346  0.40 34.40 ? 71  HIS H CG    1 
ATOM   749  N  ND1   A HIS B 2  66  ? 0.006   0.556   25.963  0.60 26.67 ? 71  HIS H ND1   1 
ATOM   750  N  ND1   B HIS B 2  66  ? 0.273   4.303   25.670  0.40 34.15 ? 71  HIS H ND1   1 
ATOM   751  C  CD2   A HIS B 2  66  ? 0.118   1.503   24.004  0.60 29.66 ? 71  HIS H CD2   1 
ATOM   752  C  CD2   B HIS B 2  66  ? 1.327   4.083   27.571  0.40 33.75 ? 71  HIS H CD2   1 
ATOM   753  C  CE1   A HIS B 2  66  ? -0.984  0.077   25.239  0.60 28.58 ? 71  HIS H CE1   1 
ATOM   754  C  CE1   B HIS B 2  66  ? -0.120  5.294   26.449  0.40 33.52 ? 71  HIS H CE1   1 
ATOM   755  N  NE2   A HIS B 2  66  ? -0.940  0.636   24.046  0.60 28.10 ? 71  HIS H NE2   1 
ATOM   756  N  NE2   B HIS B 2  66  ? 0.505   5.183   27.610  0.40 33.44 ? 71  HIS H NE2   1 
ATOM   757  N  N     . SER B 2  67  ? 5.174   2.550   25.649  1.00 38.56 ? 72  SER H N     1 
ATOM   758  C  CA    . SER B 2  67  ? 6.342   3.101   26.329  1.00 39.75 ? 72  SER H CA    1 
ATOM   759  C  C     . SER B 2  67  ? 7.574   3.028   25.456  1.00 41.13 ? 72  SER H C     1 
ATOM   760  O  O     . SER B 2  67  ? 7.853   1.995   24.848  1.00 40.45 ? 72  SER H O     1 
ATOM   761  C  CB    . SER B 2  67  ? 6.613   2.330   27.635  1.00 39.77 ? 72  SER H CB    1 
ATOM   762  O  OG    . SER B 2  67  ? 8.018   2.272   27.926  1.00 40.95 ? 72  SER H OG    1 
ATOM   763  N  N     . ARG B 2  68  ? 8.326   4.123   25.409  1.00 43.04 ? 73  ARG H N     1 
ATOM   764  C  CA    . ARG B 2  68  ? 9.568   4.176   24.617  1.00 45.02 ? 73  ARG H CA    1 
ATOM   765  C  C     . ARG B 2  68  ? 10.618  3.160   25.065  1.00 44.38 ? 73  ARG H C     1 
ATOM   766  O  O     . ARG B 2  68  ? 11.330  2.580   24.249  1.00 45.32 ? 73  ARG H O     1 
ATOM   767  C  CB    . ARG B 2  68  ? 10.187  5.582   24.711  1.00 47.51 ? 73  ARG H CB    1 
ATOM   768  C  CG    . ARG B 2  68  ? 9.664   6.552   23.681  1.00 50.91 ? 73  ARG H CG    1 
ATOM   769  C  CD    . ARG B 2  68  ? 10.706  6.744   22.565  1.00 51.71 ? 73  ARG H CD    1 
ATOM   770  N  NE    . ARG B 2  68  ? 11.327  5.482   22.159  1.00 52.44 ? 73  ARG H NE    1 
ATOM   771  C  CZ    . ARG B 2  68  ? 12.482  5.401   21.491  1.00 52.08 ? 73  ARG H CZ    1 
ATOM   772  N  NH1   . ARG B 2  68  ? 13.123  6.522   21.164  1.00 50.31 ? 73  ARG H NH1   1 
ATOM   773  N  NH2   . ARG B 2  68  ? 12.988  4.206   21.153  1.00 50.78 ? 73  ARG H NH2   1 
ATOM   774  N  N     . THR B 2  69  ? 10.710  2.943   26.371  1.00 44.17 ? 74  THR H N     1 
ATOM   775  C  CA    . THR B 2  69  ? 11.693  2.027   26.903  1.00 44.99 ? 74  THR H CA    1 
ATOM   776  C  C     . THR B 2  69  ? 11.292  0.581   27.195  1.00 44.85 ? 74  THR H C     1 
ATOM   777  O  O     . THR B 2  69  ? 11.998  -0.331  26.760  1.00 45.48 ? 74  THR H O     1 
ATOM   778  C  CB    . THR B 2  69  ? 12.312  2.597   28.170  1.00 46.50 ? 74  THR H CB    1 
ATOM   779  O  OG1   . THR B 2  69  ? 11.274  2.902   29.117  1.00 47.51 ? 74  THR H OG1   1 
ATOM   780  C  CG2   . THR B 2  69  ? 13.098  3.863   27.830  1.00 46.96 ? 74  THR H CG2   1 
ATOM   781  N  N     . ARG B 2  70  ? 10.213  0.329   27.938  1.00 42.31 ? 75  ARG H N     1 
ATOM   782  C  CA    . ARG B 2  70  ? 9.942   -1.079  28.157  1.00 40.55 ? 75  ARG H CA    1 
ATOM   783  C  C     . ARG B 2  70  ? 9.043   -1.748  27.139  1.00 38.22 ? 75  ARG H C     1 
ATOM   784  O  O     . ARG B 2  70  ? 8.153   -1.137  26.527  1.00 35.15 ? 75  ARG H O     1 
ATOM   785  C  CB    . ARG B 2  70  ? 9.498   -1.429  29.611  1.00 41.69 ? 75  ARG H CB    1 
ATOM   786  C  CG    . ARG B 2  70  ? 8.400   -0.606  30.282  1.00 44.10 ? 75  ARG H CG    1 
ATOM   787  C  CD    . ARG B 2  70  ? 7.911   -1.286  31.620  1.00 42.71 ? 75  ARG H CD    1 
ATOM   788  N  NE    . ARG B 2  70  ? 7.450   -2.645  31.354  1.00 44.61 ? 75  ARG H NE    1 
ATOM   789  C  CZ    . ARG B 2  70  ? 6.193   -3.112  31.408  1.00 42.16 ? 75  ARG H CZ    1 
ATOM   790  N  NH1   . ARG B 2  70  ? 5.149   -2.371  31.735  1.00 40.65 ? 75  ARG H NH1   1 
ATOM   791  N  NH2   . ARG B 2  70  ? 5.989   -4.381  31.107  1.00 43.81 ? 75  ARG H NH2   1 
ATOM   792  N  N     . TYR B 2  71  ? 9.378   -3.013  26.944  1.00 35.51 ? 76  TYR H N     1 
ATOM   793  C  CA    . TYR B 2  71  ? 8.684   -3.909  26.048  1.00 35.60 ? 76  TYR H CA    1 
ATOM   794  C  C     . TYR B 2  71  ? 7.470   -4.422  26.850  1.00 35.39 ? 76  TYR H C     1 
ATOM   795  O  O     . TYR B 2  71  ? 7.638   -5.090  27.893  1.00 33.99 ? 76  TYR H O     1 
ATOM   796  C  CB    . TYR B 2  71  ? 9.623   -5.056  25.718  1.00 34.84 ? 76  TYR H CB    1 
ATOM   797  C  CG    . TYR B 2  71  ? 9.014   -6.151  24.905  1.00 36.86 ? 76  TYR H CG    1 
ATOM   798  C  CD1   . TYR B 2  71  ? 8.803   -5.977  23.548  1.00 36.75 ? 76  TYR H CD1   1 
ATOM   799  C  CD2   . TYR B 2  71  ? 8.593   -7.370  25.503  1.00 36.91 ? 76  TYR H CD2   1 
ATOM   800  C  CE1   . TYR B 2  71  ? 8.167   -6.981  22.772  1.00 36.99 ? 76  TYR H CE1   1 
ATOM   801  C  CE2   . TYR B 2  71  ? 7.970   -8.384  24.735  1.00 36.51 ? 76  TYR H CE2   1 
ATOM   802  C  CZ    . TYR B 2  71  ? 7.761   -8.163  23.363  1.00 37.60 ? 76  TYR H CZ    1 
ATOM   803  O  OH    . TYR B 2  71  ? 7.154   -9.105  22.549  1.00 39.75 ? 76  TYR H OH    1 
ATOM   804  N  N     . GLU B 2  72  ? 6.271   -4.088  26.385  1.00 34.78 ? 77  GLU H N     1 
ATOM   805  C  CA    . GLU B 2  72  ? 5.025   -4.518  27.031  1.00 33.72 ? 77  GLU H CA    1 
ATOM   806  C  C     . GLU B 2  72  ? 4.628   -5.842  26.418  1.00 32.43 ? 77  GLU H C     1 
ATOM   807  O  O     . GLU B 2  72  ? 3.894   -5.894  25.407  1.00 29.02 ? 77  GLU H O     1 
ATOM   808  C  CB    . GLU B 2  72  ? 3.867   -3.525  26.824  1.00 37.20 ? 77  GLU H CB    1 
ATOM   809  C  CG    . GLU B 2  72  ? 4.168   -2.036  27.127  1.00 42.37 ? 77  GLU H CG    1 
ATOM   810  C  CD    . GLU B 2  72  ? 4.181   -1.159  25.808  1.00 46.87 ? 77  GLU H CD    1 
ATOM   811  O  OE1   . GLU B 2  72  ? 5.223   -0.422  25.619  1.00 43.46 ? 77  GLU H OE1   1 
ATOM   812  O  OE2   . GLU B 2  72  ? 3.150   -1.235  24.993  1.00 43.23 ? 77  GLU H OE2   1 
ATOM   813  N  N     . ARG B 2  73  A 5.112   -6.897  27.073  1.00 31.10 ? 77  ARG H N     1 
ATOM   814  C  CA    . ARG B 2  73  A 4.907   -8.271  26.658  1.00 30.82 ? 77  ARG H CA    1 
ATOM   815  C  C     . ARG B 2  73  A 3.435   -8.523  26.405  1.00 30.44 ? 77  ARG H C     1 
ATOM   816  O  O     . ARG B 2  73  A 2.573   -8.137  27.219  1.00 27.41 ? 77  ARG H O     1 
ATOM   817  C  CB    . ARG B 2  73  A 5.445   -9.232  27.732  1.00 29.40 ? 77  ARG H CB    1 
ATOM   818  C  CG    . ARG B 2  73  A 5.371   -10.710 27.359  1.00 31.12 ? 77  ARG H CG    1 
ATOM   819  C  CD    . ARG B 2  73  A 5.880   -11.640 28.500  1.00 32.55 ? 77  ARG H CD    1 
ATOM   820  N  NE    . ARG B 2  73  A 5.280   -12.998 28.441  1.00 37.50 ? 77  ARG H NE    1 
ATOM   821  C  CZ    . ARG B 2  73  A 4.043   -13.307 28.852  1.00 37.54 ? 77  ARG H CZ    1 
ATOM   822  N  NH1   . ARG B 2  73  A 3.210   -12.376 29.378  1.00 37.95 ? 77  ARG H NH1   1 
ATOM   823  N  NH2   . ARG B 2  73  A 3.632   -14.555 28.730  1.00 39.39 ? 77  ARG H NH2   1 
ATOM   824  N  N     . ASN B 2  74  ? 3.172   -9.125  25.243  1.00 30.73 ? 78  ASN H N     1 
ATOM   825  C  CA    . ASN B 2  74  ? 1.812   -9.474  24.822  1.00 32.86 ? 78  ASN H CA    1 
ATOM   826  C  C     . ASN B 2  74  ? 0.884   -8.292  24.501  1.00 32.13 ? 78  ASN H C     1 
ATOM   827  O  O     . ASN B 2  74  ? -0.325  -8.462  24.299  1.00 31.85 ? 78  ASN H O     1 
ATOM   828  C  CB    . ASN B 2  74  ? 1.169   -10.418 25.855  1.00 35.72 ? 78  ASN H CB    1 
ATOM   829  C  CG    . ASN B 2  74  ? 1.777   -11.824 25.793  1.00 37.35 ? 78  ASN H CG    1 
ATOM   830  O  OD1   . ASN B 2  74  ? 2.546   -12.101 24.900  1.00 39.81 ? 78  ASN H OD1   1 
ATOM   831  N  ND2   . ASN B 2  74  ? 1.425   -12.698 26.723  1.00 38.26 ? 78  ASN H ND2   1 
ATOM   832  N  N     . ILE B 2  75  ? 1.448   -7.091  24.464  1.00 31.51 ? 79  ILE H N     1 
ATOM   833  C  CA    . ILE B 2  75  ? 0.652   -5.942  24.093  1.00 30.59 ? 79  ILE H CA    1 
ATOM   834  C  C     . ILE B 2  75  ? 1.199   -5.386  22.779  1.00 31.02 ? 79  ILE H C     1 
ATOM   835  O  O     . ILE B 2  75  ? 0.470   -5.360  21.749  1.00 30.74 ? 79  ILE H O     1 
ATOM   836  C  CB    . ILE B 2  75  ? 0.602   -4.919  25.248  1.00 30.86 ? 79  ILE H CB    1 
ATOM   837  C  CG1   . ILE B 2  75  ? -0.176  -5.583  26.417  1.00 30.33 ? 79  ILE H CG1   1 
ATOM   838  C  CG2   . ILE B 2  75  ? -0.115  -3.615  24.788  1.00 29.58 ? 79  ILE H CG2   1 
ATOM   839  C  CD1   . ILE B 2  75  ? -0.169  -4.843  27.694  1.00 34.66 ? 79  ILE H CD1   1 
ATOM   840  N  N     . GLU B 2  76  ? 2.449   -4.921  22.774  1.00 31.17 ? 80  GLU H N     1 
ATOM   841  C  CA    . GLU B 2  76  ? 3.038   -4.442  21.499  1.00 30.73 ? 80  GLU H CA    1 
ATOM   842  C  C     . GLU B 2  76  ? 3.359   -5.706  20.675  1.00 30.63 ? 80  GLU H C     1 
ATOM   843  O  O     . GLU B 2  76  ? 3.454   -6.829  21.238  1.00 29.58 ? 80  GLU H O     1 
ATOM   844  C  CB    . GLU B 2  76  ? 4.327   -3.650  21.707  1.00 29.76 ? 80  GLU H CB    1 
ATOM   845  C  CG    . GLU B 2  76  ? 5.391   -4.358  22.547  1.00 32.49 ? 80  GLU H CG    1 
ATOM   846  C  CD    . GLU B 2  76  ? 6.669   -3.509  22.668  1.00 31.90 ? 80  GLU H CD    1 
ATOM   847  O  OE1   . GLU B 2  76  ? 7.523   -3.555  21.762  1.00 31.09 ? 80  GLU H OE1   1 
ATOM   848  O  OE2   . GLU B 2  76  ? 6.782   -2.767  23.646  1.00 31.73 ? 80  GLU H OE2   1 
ATOM   849  N  N     . LYS B 2  77  ? 3.494   -5.507  19.367  1.00 29.71 ? 81  LYS H N     1 
ATOM   850  C  CA    . LYS B 2  77  ? 3.812   -6.554  18.394  1.00 30.20 ? 81  LYS H CA    1 
ATOM   851  C  C     . LYS B 2  77  ? 4.934   -6.014  17.457  1.00 31.73 ? 81  LYS H C     1 
ATOM   852  O  O     . LYS B 2  77  ? 5.197   -4.796  17.364  1.00 28.48 ? 81  LYS H O     1 
ATOM   853  C  CB    . LYS B 2  77  ? 2.588   -6.894  17.530  1.00 30.48 ? 81  LYS H CB    1 
ATOM   854  C  CG    . LYS B 2  77  ? 1.420   -7.563  18.236  1.00 28.73 ? 81  LYS H CG    1 
ATOM   855  C  CD    . LYS B 2  77  ? 1.871   -8.845  18.959  1.00 30.21 ? 81  LYS H CD    1 
ATOM   856  C  CE    . LYS B 2  77  ? 0.696   -9.600  19.599  1.00 28.18 ? 81  LYS H CE    1 
ATOM   857  N  NZ    . LYS B 2  77  ? 1.160   -10.641 20.588  1.00 29.16 ? 81  LYS H NZ    1 
ATOM   858  N  N     . ILE B 2  78  ? 5.560   -6.922  16.733  1.00 31.79 ? 82  ILE H N     1 
ATOM   859  C  CA    . ILE B 2  78  ? 6.626   -6.518  15.845  1.00 33.42 ? 82  ILE H CA    1 
ATOM   860  C  C     . ILE B 2  78  ? 6.514   -7.225  14.507  1.00 35.02 ? 82  ILE H C     1 
ATOM   861  O  O     . ILE B 2  78  ? 6.050   -8.368  14.424  1.00 35.67 ? 82  ILE H O     1 
ATOM   862  C  CB    . ILE B 2  78  ? 7.966   -6.907  16.405  1.00 34.48 ? 82  ILE H CB    1 
ATOM   863  C  CG1   . ILE B 2  78  ? 9.096   -6.333  15.533  1.00 36.26 ? 82  ILE H CG1   1 
ATOM   864  C  CG2   . ILE B 2  78  ? 8.083   -8.379  16.369  1.00 35.11 ? 82  ILE H CG2   1 
ATOM   865  C  CD1   . ILE B 2  78  ? 10.375  -6.086  16.254  1.00 36.66 ? 82  ILE H CD1   1 
ATOM   866  N  N     . SER B 2  79  ? 6.923   -6.536  13.454  1.00 34.16 ? 83  SER H N     1 
ATOM   867  C  CA    . SER B 2  79  ? 6.946   -7.146  12.156  1.00 34.19 ? 83  SER H CA    1 
ATOM   868  C  C     . SER B 2  79  ? 8.120   -6.615  11.403  1.00 33.66 ? 83  SER H C     1 
ATOM   869  O  O     . SER B 2  79  ? 8.590   -5.485  11.634  1.00 32.24 ? 83  SER H O     1 
ATOM   870  C  CB    . SER B 2  79  ? 5.662   -6.859  11.380  1.00 36.06 ? 83  SER H CB    1 
ATOM   871  O  OG    . SER B 2  79  ? 5.008   -5.733  11.942  1.00 40.24 ? 83  SER H OG    1 
ATOM   872  N  N     . MET B 2  80  ? 8.604   -7.482  10.531  1.00 33.85 ? 84  MET H N     1 
ATOM   873  C  CA    . MET B 2  80  ? 9.686   -7.197  9.640   1.00 34.84 ? 84  MET H CA    1 
ATOM   874  C  C     . MET B 2  80  ? 8.924   -6.818  8.340   1.00 34.45 ? 84  MET H C     1 
ATOM   875  O  O     . MET B 2  80  ? 7.725   -7.128  8.149   1.00 33.10 ? 84  MET H O     1 
ATOM   876  C  CB    . MET B 2  80  ? 10.522  -8.467  9.376   1.00 36.95 ? 84  MET H CB    1 
ATOM   877  C  CG    . MET B 2  80  ? 11.214  -9.043  10.562  1.00 37.69 ? 84  MET H CG    1 
ATOM   878  S  SD    . MET B 2  80  ? 12.484  -7.931  11.090  1.00 41.98 ? 84  MET H SD    1 
ATOM   879  C  CE    . MET B 2  80  ? 12.274  -7.947  12.875  1.00 39.45 ? 84  MET H CE    1 
ATOM   880  N  N     . LEU B 2  81  ? 9.639   -6.187  7.427   1.00 33.18 ? 85  LEU H N     1 
ATOM   881  C  CA    . LEU B 2  81  ? 9.050   -5.786  6.181   1.00 31.94 ? 85  LEU H CA    1 
ATOM   882  C  C     . LEU B 2  81  ? 9.334   -6.734  5.003   1.00 32.93 ? 85  LEU H C     1 
ATOM   883  O  O     . LEU B 2  81  ? 10.468  -7.127  4.754   1.00 31.74 ? 85  LEU H O     1 
ATOM   884  C  CB    . LEU B 2  81  ? 9.549   -4.394  5.839   1.00 30.87 ? 85  LEU H CB    1 
ATOM   885  C  CG    . LEU B 2  81  ? 9.510   -3.347  6.962   1.00 32.09 ? 85  LEU H CG    1 
ATOM   886  C  CD1   . LEU B 2  81  ? 9.782   -1.988  6.328   1.00 31.01 ? 85  LEU H CD1   1 
ATOM   887  C  CD2   . LEU B 2  81  ? 8.134   -3.342  7.696   1.00 31.01 ? 85  LEU H CD2   1 
ATOM   888  N  N     . GLU B 2  82  ? 8.285   -7.064  4.269   1.00 34.34 ? 86  GLU H N     1 
ATOM   889  C  CA    . GLU B 2  82  ? 8.401   -7.899  3.095   1.00 35.94 ? 86  GLU H CA    1 
ATOM   890  C  C     . GLU B 2  82  ? 8.803   -6.997  1.918   1.00 35.67 ? 86  GLU H C     1 
ATOM   891  O  O     . GLU B 2  82  ? 9.735   -7.334  1.166   1.00 35.86 ? 86  GLU H O     1 
ATOM   892  C  CB    . GLU B 2  82  ? 7.077   -8.576  2.772   1.00 37.45 ? 86  GLU H CB    1 
ATOM   893  C  CG    . GLU B 2  82  ? 7.158   -9.470  1.525   1.00 42.49 ? 86  GLU H CG    1 
ATOM   894  C  CD    . GLU B 2  82  ? 5.942   -10.360 1.358   1.00 44.15 ? 86  GLU H CD    1 
ATOM   895  O  OE1   . GLU B 2  82  ? 5.507   -10.967 2.352   1.00 46.73 ? 86  GLU H OE1   1 
ATOM   896  O  OE2   . GLU B 2  82  ? 5.414   -10.468 0.236   1.00 47.98 ? 86  GLU H OE2   1 
ATOM   897  N  N     . LYS B 2  83  ? 8.142   -5.842  1.791   1.00 33.59 ? 87  LYS H N     1 
ATOM   898  C  CA    . LYS B 2  83  ? 8.414   -4.927  0.684   1.00 33.68 ? 87  LYS H CA    1 
ATOM   899  C  C     . LYS B 2  83  ? 8.045   -3.475  0.949   1.00 32.71 ? 87  LYS H C     1 
ATOM   900  O  O     . LYS B 2  83  ? 7.079   -3.189  1.646   1.00 32.19 ? 87  LYS H O     1 
ATOM   901  C  CB    . LYS B 2  83  ? 7.648   -5.405  -0.557  1.00 34.55 ? 87  LYS H CB    1 
ATOM   902  C  CG    . LYS B 2  83  ? 8.068   -4.760  -1.873  1.00 38.52 ? 87  LYS H CG    1 
ATOM   903  C  CD    . LYS B 2  83  ? 9.528   -5.154  -2.277  1.00 42.56 ? 87  LYS H CD    1 
ATOM   904  C  CE    . LYS B 2  83  ? 9.840   -4.887  -3.784  1.00 44.81 ? 87  LYS H CE    1 
ATOM   905  N  NZ    . LYS B 2  83  ? 9.299   -3.554  -4.311  1.00 46.61 ? 87  LYS H NZ    1 
ATOM   906  N  N     . ILE B 2  84  ? 8.774   -2.566  0.319   1.00 31.60 ? 88  ILE H N     1 
ATOM   907  C  CA    . ILE B 2  84  ? 8.552   -1.132  0.464   1.00 31.47 ? 88  ILE H CA    1 
ATOM   908  C  C     . ILE B 2  84  ? 8.190   -0.535  -0.871  1.00 30.30 ? 88  ILE H C     1 
ATOM   909  O  O     . ILE B 2  84  ? 8.821   -0.882  -1.844  1.00 29.59 ? 88  ILE H O     1 
ATOM   910  C  CB    . ILE B 2  84  ? 9.850   -0.405  0.904   1.00 33.43 ? 88  ILE H CB    1 
ATOM   911  C  CG1   . ILE B 2  84  ? 10.085  -0.573  2.389   1.00 35.20 ? 88  ILE H CG1   1 
ATOM   912  C  CG2   . ILE B 2  84  ? 9.768   1.091   0.549   1.00 36.26 ? 88  ILE H CG2   1 
ATOM   913  C  CD1   . ILE B 2  84  ? 11.537  -0.182  2.780   1.00 36.70 ? 88  ILE H CD1   1 
ATOM   914  N  N     . TYR B 2  85  ? 7.199   0.367   -0.925  1.00 28.34 ? 89  TYR H N     1 
ATOM   915  C  CA    . TYR B 2  85  ? 6.822   1.037   -2.182  1.00 27.01 ? 89  TYR H CA    1 
ATOM   916  C  C     . TYR B 2  85  ? 6.738   2.574   -1.999  1.00 27.88 ? 89  TYR H C     1 
ATOM   917  O  O     . TYR B 2  85  ? 5.871   3.081   -1.265  1.00 26.83 ? 89  TYR H O     1 
ATOM   918  C  CB    . TYR B 2  85  ? 5.455   0.559   -2.674  1.00 28.41 ? 89  TYR H CB    1 
ATOM   919  C  CG    . TYR B 2  85  ? 5.309   -0.947  -2.760  1.00 30.30 ? 89  TYR H CG    1 
ATOM   920  C  CD1   . TYR B 2  85  ? 5.461   -1.638  -3.979  1.00 32.09 ? 89  TYR H CD1   1 
ATOM   921  C  CD2   . TYR B 2  85  ? 4.980   -1.673  -1.643  1.00 30.80 ? 89  TYR H CD2   1 
ATOM   922  C  CE1   . TYR B 2  85  ? 5.273   -3.049  -4.049  1.00 31.95 ? 89  TYR H CE1   1 
ATOM   923  C  CE2   . TYR B 2  85  ? 4.786   -3.044  -1.706  1.00 34.96 ? 89  TYR H CE2   1 
ATOM   924  C  CZ    . TYR B 2  85  ? 4.929   -3.719  -2.907  1.00 33.64 ? 89  TYR H CZ    1 
ATOM   925  O  OH    . TYR B 2  85  ? 4.673   -5.066  -2.880  1.00 37.56 ? 89  TYR H OH    1 
ATOM   926  N  N     . ILE B 2  86  ? 7.610   3.316   -2.676  1.00 27.20 ? 90  ILE H N     1 
ATOM   927  C  CA    . ILE B 2  86  ? 7.634   4.793   -2.612  1.00 26.08 ? 90  ILE H CA    1 
ATOM   928  C  C     . ILE B 2  86  ? 6.941   5.343   -3.808  1.00 26.58 ? 90  ILE H C     1 
ATOM   929  O  O     . ILE B 2  86  ? 7.031   4.751   -4.888  1.00 26.84 ? 90  ILE H O     1 
ATOM   930  C  CB    . ILE B 2  86  ? 9.049   5.277   -2.630  1.00 25.59 ? 90  ILE H CB    1 
ATOM   931  C  CG1   . ILE B 2  86  ? 9.769   4.606   -1.457  1.00 26.31 ? 90  ILE H CG1   1 
ATOM   932  C  CG2   . ILE B 2  86  ? 9.100   6.866   -2.617  1.00 26.07 ? 90  ILE H CG2   1 
ATOM   933  C  CD1   . ILE B 2  86  ? 11.313  4.943   -1.293  1.00 25.15 ? 90  ILE H CD1   1 
ATOM   934  N  N     . HIS B 2  87  ? 6.203   6.445   -3.654  1.00 26.24 ? 91  HIS H N     1 
ATOM   935  C  CA    . HIS B 2  87  ? 5.511   7.031   -4.821  1.00 26.29 ? 91  HIS H CA    1 
ATOM   936  C  C     . HIS B 2  87  ? 6.542   7.312   -5.936  1.00 27.17 ? 91  HIS H C     1 
ATOM   937  O  O     . HIS B 2  87  ? 7.587   7.948   -5.716  1.00 25.95 ? 91  HIS H O     1 
ATOM   938  C  CB    . HIS B 2  87  ? 4.770   8.340   -4.465  1.00 24.40 ? 91  HIS H CB    1 
ATOM   939  C  CG    . HIS B 2  87  ? 3.718   8.725   -5.468  1.00 23.14 ? 91  HIS H CG    1 
ATOM   940  N  ND1   . HIS B 2  87  ? 4.020   9.180   -6.740  1.00 20.57 ? 91  HIS H ND1   1 
ATOM   941  C  CD2   . HIS B 2  87  ? 2.363   8.733   -5.382  1.00 23.04 ? 91  HIS H CD2   1 
ATOM   942  C  CE1   . HIS B 2  87  ? 2.897   9.449   -7.386  1.00 22.73 ? 91  HIS H CE1   1 
ATOM   943  N  NE2   . HIS B 2  87  ? 1.877   9.194   -6.586  1.00 22.01 ? 91  HIS H NE2   1 
ATOM   944  N  N     . PRO B 2  88  ? 6.250   6.845   -7.150  1.00 28.48 ? 92  PRO H N     1 
ATOM   945  C  CA    . PRO B 2  88  ? 7.185   7.065   -8.259  1.00 30.22 ? 92  PRO H CA    1 
ATOM   946  C  C     . PRO B 2  88  ? 7.503   8.520   -8.559  1.00 30.30 ? 92  PRO H C     1 
ATOM   947  O  O     . PRO B 2  88  ? 8.601   8.831   -9.047  1.00 31.93 ? 92  PRO H O     1 
ATOM   948  C  CB    . PRO B 2  88  ? 6.509   6.344   -9.430  1.00 29.40 ? 92  PRO H CB    1 
ATOM   949  C  CG    . PRO B 2  88  ? 5.030   6.501   -9.064  1.00 30.86 ? 92  PRO H CG    1 
ATOM   950  C  CD    . PRO B 2  88  ? 5.074   6.096   -7.609  1.00 28.99 ? 92  PRO H CD    1 
ATOM   951  N  N     . ARG B 2  89  ? 6.575   9.428   -8.296  1.00 28.87 ? 93  ARG H N     1 
ATOM   952  C  CA    . ARG B 2  89  ? 6.925   10.799  -8.570  1.00 29.80 ? 93  ARG H CA    1 
ATOM   953  C  C     . ARG B 2  89  ? 7.257   11.648  -7.344  1.00 26.92 ? 93  ARG H C     1 
ATOM   954  O  O     . ARG B 2  89  ? 7.071   12.850  -7.381  1.00 26.50 ? 93  ARG H O     1 
ATOM   955  C  CB    . ARG B 2  89  ? 5.847   11.473  -9.417  1.00 32.53 ? 93  ARG H CB    1 
ATOM   956  C  CG    . ARG B 2  89  ? 5.694   10.852  -10.820 1.00 35.21 ? 93  ARG H CG    1 
ATOM   957  C  CD    . ARG B 2  89  ? 5.530   12.002  -11.860 1.00 40.19 ? 93  ARG H CD    1 
ATOM   958  N  NE    . ARG B 2  89  ? 4.159   12.480  -11.935 1.00 40.55 ? 93  ARG H NE    1 
ATOM   959  C  CZ    . ARG B 2  89  ? 3.773   13.697  -12.328 1.00 43.02 ? 93  ARG H CZ    1 
ATOM   960  N  NH1   . ARG B 2  89  ? 4.643   14.656  -12.693 1.00 42.93 ? 93  ARG H NH1   1 
ATOM   961  N  NH2   . ARG B 2  89  ? 2.470   13.942  -12.391 1.00 43.78 ? 93  ARG H NH2   1 
ATOM   962  N  N     . TYR B 2  90  ? 7.729   11.004  -6.278  1.00 26.16 ? 94  TYR H N     1 
ATOM   963  C  CA    . TYR B 2  90  ? 8.128   11.664  -5.025  1.00 25.82 ? 94  TYR H CA    1 
ATOM   964  C  C     . TYR B 2  90  ? 9.298   12.591  -5.362  1.00 26.43 ? 94  TYR H C     1 
ATOM   965  O  O     . TYR B 2  90  ? 10.294  12.162  -5.930  1.00 26.47 ? 94  TYR H O     1 
ATOM   966  C  CB    . TYR B 2  90  ? 8.514   10.591  -3.991  1.00 24.74 ? 94  TYR H CB    1 
ATOM   967  C  CG    . TYR B 2  90  ? 9.427   11.054  -2.851  1.00 25.64 ? 94  TYR H CG    1 
ATOM   968  C  CD1   . TYR B 2  90  ? 9.061   12.094  -2.010  1.00 23.58 ? 94  TYR H CD1   1 
ATOM   969  C  CD2   . TYR B 2  90  ? 10.662  10.407  -2.622  1.00 22.69 ? 94  TYR H CD2   1 
ATOM   970  C  CE1   . TYR B 2  90  ? 9.914   12.486  -0.934  1.00 28.34 ? 94  TYR H CE1   1 
ATOM   971  C  CE2   . TYR B 2  90  ? 11.537  10.778  -1.552  1.00 26.03 ? 94  TYR H CE2   1 
ATOM   972  C  CZ    . TYR B 2  90  ? 11.147  11.815  -0.713  1.00 26.77 ? 94  TYR H CZ    1 
ATOM   973  O  OH    . TYR B 2  90  ? 11.950  12.149  0.334   1.00 28.14 ? 94  TYR H OH    1 
ATOM   974  N  N     . ASN B 2  91  ? 9.142   13.877  -5.074  1.00 24.80 ? 95  ASN H N     1 
ATOM   975  C  CA    . ASN B 2  91  ? 10.146  14.872  -5.409  1.00 25.21 ? 95  ASN H CA    1 
ATOM   976  C  C     . ASN B 2  91  ? 10.993  15.307  -4.189  1.00 27.55 ? 95  ASN H C     1 
ATOM   977  O  O     . ASN B 2  91  ? 10.671  16.310  -3.498  1.00 28.31 ? 95  ASN H O     1 
ATOM   978  C  CB    . ASN B 2  91  ? 9.420   16.078  -5.986  1.00 26.10 ? 95  ASN H CB    1 
ATOM   979  C  CG    . ASN B 2  91  ? 10.350  17.092  -6.635  1.00 27.38 ? 95  ASN H CG    1 
ATOM   980  O  OD1   . ASN B 2  91  ? 11.551  17.165  -6.325  1.00 27.67 ? 95  ASN H OD1   1 
ATOM   981  N  ND2   . ASN B 2  91  ? 9.776   17.915  -7.539  1.00 24.67 ? 95  ASN H ND2   1 
ATOM   982  N  N     . TRP B 2  92  ? 12.049  14.566  -3.891  1.00 26.53 ? 96  TRP H N     1 
ATOM   983  C  CA    . TRP B 2  92  ? 12.906  14.948  -2.761  1.00 28.29 ? 96  TRP H CA    1 
ATOM   984  C  C     . TRP B 2  92  ? 13.863  16.078  -3.096  1.00 30.38 ? 96  TRP H C     1 
ATOM   985  O  O     . TRP B 2  92  ? 14.388  16.716  -2.159  1.00 30.23 ? 96  TRP H O     1 
ATOM   986  C  CB    . TRP B 2  92  ? 13.722  13.790  -2.247  1.00 26.47 ? 96  TRP H CB    1 
ATOM   987  C  CG    . TRP B 2  92  ? 14.508  13.142  -3.301  1.00 27.23 ? 96  TRP H CG    1 
ATOM   988  C  CD1   . TRP B 2  92  ? 14.152  12.024  -4.016  1.00 29.97 ? 96  TRP H CD1   1 
ATOM   989  C  CD2   . TRP B 2  92  ? 15.825  13.488  -3.716  1.00 27.57 ? 96  TRP H CD2   1 
ATOM   990  N  NE1   . TRP B 2  92  ? 15.195  11.648  -4.846  1.00 30.53 ? 96  TRP H NE1   1 
ATOM   991  C  CE2   . TRP B 2  92  ? 16.231  12.531  -4.676  1.00 29.34 ? 96  TRP H CE2   1 
ATOM   992  C  CE3   . TRP B 2  92  ? 16.710  14.502  -3.365  1.00 28.60 ? 96  TRP H CE3   1 
ATOM   993  C  CZ2   . TRP B 2  92  ? 17.483  12.564  -5.279  1.00 27.58 ? 96  TRP H CZ2   1 
ATOM   994  C  CZ3   . TRP B 2  92  ? 17.965  14.532  -3.960  1.00 28.59 ? 96  TRP H CZ3   1 
ATOM   995  C  CH2   . TRP B 2  92  ? 18.336  13.568  -4.908  1.00 28.44 ? 96  TRP H CH2   1 
ATOM   996  N  N     . ARG B 2  93  ? 14.078  16.356  -4.401  1.00 30.92 ? 97  ARG H N     1 
ATOM   997  C  CA    . ARG B 2  93  ? 14.996  17.462  -4.780  1.00 31.63 ? 97  ARG H CA    1 
ATOM   998  C  C     . ARG B 2  93  ? 14.453  18.835  -4.487  1.00 32.66 ? 97  ARG H C     1 
ATOM   999  O  O     . ARG B 2  93  ? 15.196  19.749  -4.131  1.00 33.12 ? 97  ARG H O     1 
ATOM   1000 C  CB    A ARG B 2  93  ? 15.391  17.350  -6.256  0.42 31.36 ? 97  ARG H CB    1 
ATOM   1001 C  CB    B ARG B 2  93  ? 15.298  17.460  -6.280  0.58 32.19 ? 97  ARG H CB    1 
ATOM   1002 C  CG    A ARG B 2  93  ? 16.035  16.020  -6.574  0.42 30.23 ? 97  ARG H CG    1 
ATOM   1003 C  CG    B ARG B 2  93  ? 15.329  16.123  -6.913  0.58 32.58 ? 97  ARG H CG    1 
ATOM   1004 C  CD    A ARG B 2  93  ? 17.208  16.164  -7.493  0.42 29.92 ? 97  ARG H CD    1 
ATOM   1005 C  CD    B ARG B 2  93  ? 16.692  15.799  -7.396  0.58 32.04 ? 97  ARG H CD    1 
ATOM   1006 N  NE    A ARG B 2  93  ? 18.203  17.065  -6.949  0.42 28.85 ? 97  ARG H NE    1 
ATOM   1007 N  NE    B ARG B 2  93  ? 16.747  14.422  -7.887  0.58 30.66 ? 97  ARG H NE    1 
ATOM   1008 C  CZ    A ARG B 2  93  ? 19.511  16.937  -7.135  0.42 27.99 ? 97  ARG H CZ    1 
ATOM   1009 C  CZ    B ARG B 2  93  ? 17.848  13.851  -8.358  0.58 28.75 ? 97  ARG H CZ    1 
ATOM   1010 N  NH1   A ARG B 2  93  ? 19.992  15.928  -7.852  0.42 27.08 ? 97  ARG H NH1   1 
ATOM   1011 N  NH1   B ARG B 2  93  ? 18.985  14.554  -8.411  0.58 27.24 ? 97  ARG H NH1   1 
ATOM   1012 N  NH2   A ARG B 2  93  ? 20.336  17.834  -6.612  0.42 28.14 ? 97  ARG H NH2   1 
ATOM   1013 N  NH2   B ARG B 2  93  ? 17.820  12.581  -8.725  0.58 23.60 ? 97  ARG H NH2   1 
ATOM   1014 N  N     . GLU B 2  94  A 13.154  19.014  -4.617  1.00 33.22 ? 97  GLU H N     1 
ATOM   1015 C  CA    . GLU B 2  94  A 12.667  20.357  -4.396  1.00 34.11 ? 97  GLU H CA    1 
ATOM   1016 C  C     . GLU B 2  94  A 11.786  20.676  -3.201  1.00 33.45 ? 97  GLU H C     1 
ATOM   1017 O  O     . GLU B 2  94  A 12.117  21.549  -2.373  1.00 34.14 ? 97  GLU H O     1 
ATOM   1018 C  CB    . GLU B 2  94  A 11.945  20.855  -5.656  1.00 33.80 ? 97  GLU H CB    1 
ATOM   1019 C  CG    . GLU B 2  94  A 11.562  22.328  -5.548  1.00 34.86 ? 97  GLU H CG    1 
ATOM   1020 C  CD    . GLU B 2  94  A 10.462  22.722  -6.559  1.00 38.67 ? 97  GLU H CD    1 
ATOM   1021 O  OE1   . GLU B 2  94  A 10.285  21.969  -7.548  1.00 39.03 ? 97  GLU H OE1   1 
ATOM   1022 O  OE2   . GLU B 2  94  A 9.768   23.765  -6.367  1.00 39.44 ? 97  GLU H OE2   1 
ATOM   1023 N  N     . ASN B 2  95  ? 10.670  19.977  -3.083  1.00 29.72 ? 98  ASN H N     1 
ATOM   1024 C  CA    . ASN B 2  95  ? 9.741   20.352  -2.034  1.00 27.38 ? 98  ASN H CA    1 
ATOM   1025 C  C     . ASN B 2  95  ? 9.016   19.189  -1.344  1.00 27.07 ? 98  ASN H C     1 
ATOM   1026 O  O     . ASN B 2  95  ? 7.963   19.399  -0.726  1.00 25.50 ? 98  ASN H O     1 
ATOM   1027 C  CB    . ASN B 2  95  ? 8.710   21.276  -2.716  1.00 25.45 ? 98  ASN H CB    1 
ATOM   1028 C  CG    . ASN B 2  95  ? 8.053   20.605  -3.913  1.00 26.86 ? 98  ASN H CG    1 
ATOM   1029 O  OD1   . ASN B 2  95  ? 8.322   19.410  -4.197  1.00 28.79 ? 98  ASN H OD1   1 
ATOM   1030 N  ND2   . ASN B 2  95  ? 7.177   21.332  -4.618  1.00 27.46 ? 98  ASN H ND2   1 
ATOM   1031 N  N     . LEU B 2  96  ? 9.540   17.968  -1.485  1.00 26.13 ? 99  LEU H N     1 
ATOM   1032 C  CA    . LEU B 2  96  ? 8.906   16.764  -0.922  1.00 25.52 ? 99  LEU H CA    1 
ATOM   1033 C  C     . LEU B 2  96  ? 7.496   16.531  -1.504  1.00 24.56 ? 99  LEU H C     1 
ATOM   1034 O  O     . LEU B 2  96  ? 6.593   15.996  -0.842  1.00 24.26 ? 99  LEU H O     1 
ATOM   1035 C  CB    . LEU B 2  96  ? 8.832   16.824  0.613   1.00 26.50 ? 99  LEU H CB    1 
ATOM   1036 C  CG    . LEU B 2  96  ? 10.226  16.923  1.269   1.00 30.08 ? 99  LEU H CG    1 
ATOM   1037 C  CD1   . LEU B 2  96  ? 10.059  17.215  2.805   1.00 31.18 ? 99  LEU H CD1   1 
ATOM   1038 C  CD2   . LEU B 2  96  ? 11.044  15.650  1.023   1.00 28.22 ? 99  LEU H CD2   1 
ATOM   1039 N  N     . ASP B 2  97  ? 7.279   16.981  -2.732  1.00 24.58 ? 100 ASP H N     1 
ATOM   1040 C  CA    . ASP B 2  97  ? 5.974   16.735  -3.355  1.00 23.92 ? 100 ASP H CA    1 
ATOM   1041 C  C     . ASP B 2  97  ? 5.747   15.195  -3.307  1.00 22.82 ? 100 ASP H C     1 
ATOM   1042 O  O     . ASP B 2  97  ? 6.717   14.409  -3.479  1.00 20.14 ? 100 ASP H O     1 
ATOM   1043 C  CB    . ASP B 2  97  ? 5.977   17.266  -4.788  1.00 25.34 ? 100 ASP H CB    1 
ATOM   1044 C  CG    . ASP B 2  97  ? 4.555   17.341  -5.396  1.00 28.54 ? 100 ASP H CG    1 
ATOM   1045 O  OD1   . ASP B 2  97  ? 3.530   17.343  -4.647  1.00 26.20 ? 100 ASP H OD1   1 
ATOM   1046 O  OD2   . ASP B 2  97  ? 4.497   17.406  -6.638  1.00 29.18 ? 100 ASP H OD2   1 
ATOM   1047 N  N     . ARG B 2  98  ? 4.510   14.793  -3.009  1.00 19.95 ? 101 ARG H N     1 
ATOM   1048 C  CA    . ARG B 2  98  ? 4.115   13.373  -2.851  1.00 22.65 ? 101 ARG H CA    1 
ATOM   1049 C  C     . ARG B 2  98  ? 5.016   12.614  -1.842  1.00 22.50 ? 101 ARG H C     1 
ATOM   1050 O  O     . ARG B 2  98  ? 5.625   11.566  -2.161  1.00 23.04 ? 101 ARG H O     1 
ATOM   1051 C  CB    . ARG B 2  98  ? 4.091   12.634  -4.215  1.00 21.47 ? 101 ARG H CB    1 
ATOM   1052 C  CG    . ARG B 2  98  ? 3.508   13.512  -5.355  1.00 23.98 ? 101 ARG H CG    1 
ATOM   1053 C  CD    . ARG B 2  98  ? 3.557   12.806  -6.692  1.00 27.57 ? 101 ARG H CD    1 
ATOM   1054 N  NE    . ARG B 2  98  ? 2.923   13.563  -7.782  1.00 29.33 ? 101 ARG H NE    1 
ATOM   1055 C  CZ    . ARG B 2  98  ? 3.541   14.501  -8.501  1.00 28.89 ? 101 ARG H CZ    1 
ATOM   1056 N  NH1   . ARG B 2  98  ? 4.811   14.790  -8.244  1.00 28.35 ? 101 ARG H NH1   1 
ATOM   1057 N  NH2   . ARG B 2  98  ? 2.889   15.152  -9.461  1.00 28.87 ? 101 ARG H NH2   1 
ATOM   1058 N  N     . ASP B 2  99  ? 5.077   13.121  -0.608  1.00 22.55 ? 102 ASP H N     1 
ATOM   1059 C  CA    . ASP B 2  99  ? 5.923   12.513  0.441   1.00 23.16 ? 102 ASP H CA    1 
ATOM   1060 C  C     . ASP B 2  99  ? 5.110   11.361  1.043   1.00 23.00 ? 102 ASP H C     1 
ATOM   1061 O  O     . ASP B 2  99  ? 4.506   11.501  2.118   1.00 20.81 ? 102 ASP H O     1 
ATOM   1062 C  CB    . ASP B 2  99  ? 6.265   13.625  1.494   1.00 23.09 ? 102 ASP H CB    1 
ATOM   1063 C  CG    . ASP B 2  99  ? 7.348   13.196  2.467   1.00 25.03 ? 102 ASP H CG    1 
ATOM   1064 O  OD1   . ASP B 2  99  ? 7.933   12.093  2.233   1.00 23.49 ? 102 ASP H OD1   1 
ATOM   1065 O  OD2   . ASP B 2  99  ? 7.583   13.940  3.486   1.00 25.04 ? 102 ASP H OD2   1 
ATOM   1066 N  N     . ILE B 2  100 ? 5.129   10.195  0.373   1.00 21.50 ? 103 ILE H N     1 
ATOM   1067 C  CA    . ILE B 2  100 ? 4.310   9.077   0.811   1.00 20.07 ? 103 ILE H CA    1 
ATOM   1068 C  C     . ILE B 2  100 ? 4.932   7.751   0.365   1.00 21.23 ? 103 ILE H C     1 
ATOM   1069 O  O     . ILE B 2  100 ? 5.545   7.724   -0.731  1.00 21.67 ? 103 ILE H O     1 
ATOM   1070 C  CB    . ILE B 2  100 ? 2.861   9.193   0.212   1.00 20.48 ? 103 ILE H CB    1 
ATOM   1071 C  CG1   . ILE B 2  100 ? 1.931   8.167   0.882   1.00 21.16 ? 103 ILE H CG1   1 
ATOM   1072 C  CG2   . ILE B 2  100 ? 2.848   8.956   -1.355  1.00 20.78 ? 103 ILE H CG2   1 
ATOM   1073 C  CD1   . ILE B 2  100 ? 0.351   8.383   0.558   1.00 19.68 ? 103 ILE H CD1   1 
ATOM   1074 N  N     . ALA B 2  101 ? 4.814   6.725   1.227   1.00 20.05 ? 104 ALA H N     1 
ATOM   1075 C  CA    . ALA B 2  101 ? 5.297   5.346   0.991   1.00 22.14 ? 104 ALA H CA    1 
ATOM   1076 C  C     . ALA B 2  101 ? 4.406   4.352   1.685   1.00 23.97 ? 104 ALA H C     1 
ATOM   1077 O  O     . ALA B 2  101 ? 3.844   4.695   2.738   1.00 23.48 ? 104 ALA H O     1 
ATOM   1078 C  CB    . ALA B 2  101 ? 6.710   5.136   1.565   1.00 18.46 ? 104 ALA H CB    1 
ATOM   1079 N  N     . LEU B 2  102 ? 4.277   3.141   1.098   1.00 22.11 ? 105 LEU H N     1 
ATOM   1080 C  CA    . LEU B 2  102 ? 3.564   2.032   1.716   1.00 23.44 ? 105 LEU H CA    1 
ATOM   1081 C  C     . LEU B 2  102 ? 4.609   0.958   2.075   1.00 25.07 ? 105 LEU H C     1 
ATOM   1082 O  O     . LEU B 2  102 ? 5.586   0.759   1.320   1.00 25.80 ? 105 LEU H O     1 
ATOM   1083 C  CB    . LEU B 2  102 ? 2.550   1.398   0.771   1.00 21.57 ? 105 LEU H CB    1 
ATOM   1084 C  CG    . LEU B 2  102 ? 1.276   2.234   0.703   1.00 24.23 ? 105 LEU H CG    1 
ATOM   1085 C  CD1   . LEU B 2  102 ? 0.544   2.029   -0.645  1.00 22.86 ? 105 LEU H CD1   1 
ATOM   1086 C  CD2   . LEU B 2  102 ? 0.426   1.840   1.894   1.00 22.85 ? 105 LEU H CD2   1 
ATOM   1087 N  N     . MET B 2  103 ? 4.386   0.272   3.203   1.00 25.23 ? 106 MET H N     1 
ATOM   1088 C  CA    . MET B 2  103 ? 5.245   -0.827  3.672   1.00 25.72 ? 106 MET H CA    1 
ATOM   1089 C  C     . MET B 2  103 ? 4.375   -2.068  3.914   1.00 25.64 ? 106 MET H C     1 
ATOM   1090 O  O     . MET B 2  103 ? 3.429   -2.000  4.692   1.00 23.94 ? 106 MET H O     1 
ATOM   1091 C  CB    . MET B 2  103 ? 5.961   -0.432  4.963   1.00 24.93 ? 106 MET H CB    1 
ATOM   1092 C  CG    . MET B 2  103 ? 6.844   0.832   4.734   1.00 25.38 ? 106 MET H CG    1 
ATOM   1093 S  SD    . MET B 2  103 ? 7.795   1.237   6.182   1.00 28.38 ? 106 MET H SD    1 
ATOM   1094 C  CE    . MET B 2  103 ? 6.382   1.809   7.353   1.00 21.95 ? 106 MET H CE    1 
ATOM   1095 N  N     . LYS B 2  104 ? 4.684   -3.178  3.220   1.00 26.79 ? 107 LYS H N     1 
ATOM   1096 C  CA    . LYS B 2  104 ? 3.941   -4.443  3.385   1.00 25.72 ? 107 LYS H CA    1 
ATOM   1097 C  C     . LYS B 2  104 ? 4.633   -5.332  4.429   1.00 24.43 ? 107 LYS H C     1 
ATOM   1098 O  O     . LYS B 2  104 ? 5.832   -5.632  4.334   1.00 25.18 ? 107 LYS H O     1 
ATOM   1099 C  CB    . LYS B 2  104 ? 3.824   -5.205  2.067   1.00 27.38 ? 107 LYS H CB    1 
ATOM   1100 C  CG    . LYS B 2  104 ? 3.307   -6.663  2.307   1.00 31.80 ? 107 LYS H CG    1 
ATOM   1101 C  CD    . LYS B 2  104 ? 2.747   -7.388  1.057   1.00 35.63 ? 107 LYS H CD    1 
ATOM   1102 C  CE    . LYS B 2  104 ? 3.836   -7.665  0.023   1.00 37.97 ? 107 LYS H CE    1 
ATOM   1103 N  NZ    . LYS B 2  104 ? 3.371   -8.770  -0.933  1.00 41.98 ? 107 LYS H NZ    1 
ATOM   1104 N  N     . LEU B 2  105 ? 3.893   -5.747  5.445   1.00 23.45 ? 108 LEU H N     1 
ATOM   1105 C  CA    . LEU B 2  105 ? 4.474   -6.566  6.529   1.00 25.20 ? 108 LEU H CA    1 
ATOM   1106 C  C     . LEU B 2  105 ? 4.581   -8.042  6.133   1.00 26.46 ? 108 LEU H C     1 
ATOM   1107 O  O     . LEU B 2  105 ? 3.747   -8.530  5.387   1.00 24.71 ? 108 LEU H O     1 
ATOM   1108 C  CB    . LEU B 2  105 ? 3.595   -6.513  7.761   1.00 24.89 ? 108 LEU H CB    1 
ATOM   1109 C  CG    . LEU B 2  105 ? 3.234   -5.111  8.281   1.00 27.50 ? 108 LEU H CG    1 
ATOM   1110 C  CD1   . LEU B 2  105 ? 2.605   -5.254  9.670   1.00 26.42 ? 108 LEU H CD1   1 
ATOM   1111 C  CD2   . LEU B 2  105 ? 4.498   -4.235  8.384   1.00 26.48 ? 108 LEU H CD2   1 
ATOM   1112 N  N     . LYS B 2  106 ? 5.623   -8.696  6.636   1.00 29.97 ? 109 LYS H N     1 
ATOM   1113 C  CA    . LYS B 2  106 ? 5.903   -10.102 6.417   1.00 33.80 ? 109 LYS H CA    1 
ATOM   1114 C  C     . LYS B 2  106 ? 4.787   -10.943 7.004   1.00 35.90 ? 109 LYS H C     1 
ATOM   1115 O  O     . LYS B 2  106 ? 4.397   -11.937 6.405   1.00 36.60 ? 109 LYS H O     1 
ATOM   1116 C  CB    . LYS B 2  106 ? 7.231   -10.486 7.064   1.00 35.39 ? 109 LYS H CB    1 
ATOM   1117 C  CG    . LYS B 2  106 ? 8.439   -10.131 6.188   1.00 39.65 ? 109 LYS H CG    1 
ATOM   1118 C  CD    . LYS B 2  106 ? 9.779   -10.741 6.671   1.00 42.13 ? 109 LYS H CD    1 
ATOM   1119 C  CE    . LYS B 2  106 ? 9.617   -12.220 7.023   1.00 42.97 ? 109 LYS H CE    1 
ATOM   1120 N  NZ    . LYS B 2  106 ? 8.417   -12.806 6.355   1.00 46.33 ? 109 LYS H NZ    1 
ATOM   1121 N  N     . LYS B 2  107 ? 4.283   -10.547 8.172   1.00 36.37 ? 110 LYS H N     1 
ATOM   1122 C  CA    . LYS B 2  107 ? 3.181   -11.281 8.808   1.00 38.28 ? 110 LYS H CA    1 
ATOM   1123 C  C     . LYS B 2  107 ? 2.099   -10.341 9.295   1.00 36.65 ? 110 LYS H C     1 
ATOM   1124 O  O     . LYS B 2  107 ? 2.369   -9.401  10.068  1.00 37.99 ? 110 LYS H O     1 
ATOM   1125 C  CB    . LYS B 2  107 ? 3.641   -12.064 10.038  1.00 41.08 ? 110 LYS H CB    1 
ATOM   1126 C  CG    . LYS B 2  107 ? 4.638   -13.231 9.813   1.00 44.71 ? 110 LYS H CG    1 
ATOM   1127 C  CD    . LYS B 2  107 ? 4.138   -14.187 8.740   1.00 48.43 ? 110 LYS H CD    1 
ATOM   1128 C  CE    . LYS B 2  107 ? 2.743   -14.715 9.034   1.00 50.92 ? 110 LYS H CE    1 
ATOM   1129 N  NZ    . LYS B 2  107 ? 2.138   -15.422 7.829   1.00 52.46 ? 110 LYS H NZ    1 
ATOM   1130 N  N     . PRO B 2  108 ? 0.853   -10.605 8.905   1.00 35.09 ? 111 PRO H N     1 
ATOM   1131 C  CA    . PRO B 2  108 ? -0.256  -9.739  9.348   1.00 33.64 ? 111 PRO H CA    1 
ATOM   1132 C  C     . PRO B 2  108 ? -0.318  -9.659  10.872  1.00 30.41 ? 111 PRO H C     1 
ATOM   1133 O  O     . PRO B 2  108 ? -0.066  -10.655 11.581  1.00 29.10 ? 111 PRO H O     1 
ATOM   1134 C  CB    . PRO B 2  108 ? -1.492  -10.416 8.764   1.00 33.58 ? 111 PRO H CB    1 
ATOM   1135 C  CG    . PRO B 2  108 ? -1.056  -11.928 8.759   1.00 37.30 ? 111 PRO H CG    1 
ATOM   1136 C  CD    . PRO B 2  108 ? 0.363   -11.815 8.218   1.00 35.48 ? 111 PRO H CD    1 
ATOM   1137 N  N     . VAL B 2  109 ? -0.662  -8.473  11.378  1.00 28.19 ? 112 VAL H N     1 
ATOM   1138 C  CA    . VAL B 2  109 ? -0.763  -8.288  12.826  1.00 25.87 ? 112 VAL H CA    1 
ATOM   1139 C  C     . VAL B 2  109 ? -2.215  -8.555  13.230  1.00 25.67 ? 112 VAL H C     1 
ATOM   1140 O  O     . VAL B 2  109 ? -3.136  -8.192  12.526  1.00 25.22 ? 112 VAL H O     1 
ATOM   1141 C  CB    . VAL B 2  109 ? -0.344  -6.835  13.237  1.00 26.69 ? 112 VAL H CB    1 
ATOM   1142 C  CG1   . VAL B 2  109 ? -1.470  -5.795  12.867  1.00 23.22 ? 112 VAL H CG1   1 
ATOM   1143 C  CG2   . VAL B 2  109 ? 0.007   -6.792  14.715  1.00 21.60 ? 112 VAL H CG2   1 
ATOM   1144 N  N     . ALA B 2  110 ? -2.430  -9.205  14.351  1.00 25.19 ? 113 ALA H N     1 
ATOM   1145 C  CA    . ALA B 2  110 ? -3.810  -9.456  14.783  1.00 26.03 ? 113 ALA H CA    1 
ATOM   1146 C  C     . ALA B 2  110 ? -4.319  -8.152  15.490  1.00 25.38 ? 113 ALA H C     1 
ATOM   1147 O  O     . ALA B 2  110 ? -3.544  -7.538  16.216  1.00 26.66 ? 113 ALA H O     1 
ATOM   1148 C  CB    . ALA B 2  110 ? -3.812  -10.660 15.768  1.00 23.50 ? 113 ALA H CB    1 
ATOM   1149 N  N     . PHE B 2  111 ? -5.566  -7.736  15.277  1.00 24.47 ? 114 PHE H N     1 
ATOM   1150 C  CA    . PHE B 2  111 ? -6.101  -6.542  15.939  1.00 25.34 ? 114 PHE H CA    1 
ATOM   1151 C  C     . PHE B 2  111 ? -6.477  -6.898  17.389  1.00 26.55 ? 114 PHE H C     1 
ATOM   1152 O  O     . PHE B 2  111 ? -6.795  -8.061  17.707  1.00 27.35 ? 114 PHE H O     1 
ATOM   1153 C  CB    . PHE B 2  111 ? -7.335  -5.983  15.203  1.00 25.27 ? 114 PHE H CB    1 
ATOM   1154 C  CG    . PHE B 2  111 ? -7.097  -5.727  13.707  1.00 25.49 ? 114 PHE H CG    1 
ATOM   1155 C  CD1   . PHE B 2  111 ? -5.805  -5.449  13.223  1.00 25.63 ? 114 PHE H CD1   1 
ATOM   1156 C  CD2   . PHE B 2  111 ? -8.159  -5.727  12.806  1.00 23.57 ? 114 PHE H CD2   1 
ATOM   1157 C  CE1   . PHE B 2  111 ? -5.588  -5.174  11.860  1.00 25.22 ? 114 PHE H CE1   1 
ATOM   1158 C  CE2   . PHE B 2  111 ? -7.960  -5.439  11.443  1.00 24.16 ? 114 PHE H CE2   1 
ATOM   1159 C  CZ    . PHE B 2  111 ? -6.686  -5.164  10.964  1.00 22.83 ? 114 PHE H CZ    1 
ATOM   1160 N  N     . SER B 2  112 ? -6.413  -5.899  18.261  1.00 23.61 ? 115 SER H N     1 
ATOM   1161 C  CA    . SER B 2  112 ? -6.705  -6.039  19.660  1.00 22.93 ? 115 SER H CA    1 
ATOM   1162 C  C     . SER B 2  112 ? -7.254  -4.663  20.222  1.00 23.74 ? 115 SER H C     1 
ATOM   1163 O  O     . SER B 2  112 ? -7.601  -3.753  19.458  1.00 23.17 ? 115 SER H O     1 
ATOM   1164 C  CB    . SER B 2  112 ? -5.422  -6.409  20.372  1.00 22.42 ? 115 SER H CB    1 
ATOM   1165 O  OG    . SER B 2  112 ? -4.558  -5.275  20.451  1.00 20.78 ? 115 SER H OG    1 
ATOM   1166 N  N     . ASP B 2  113 ? -7.347  -4.547  21.538  1.00 24.09 ? 116 ASP H N     1 
ATOM   1167 C  CA    . ASP B 2  113 ? -7.782  -3.286  22.152  1.00 25.97 ? 116 ASP H CA    1 
ATOM   1168 C  C     . ASP B 2  113 ? -6.701  -2.186  21.932  1.00 26.26 ? 116 ASP H C     1 
ATOM   1169 O  O     . ASP B 2  113 ? -6.979  -0.994  22.029  1.00 25.68 ? 116 ASP H O     1 
ATOM   1170 C  CB    . ASP B 2  113 ? -7.972  -3.487  23.644  1.00 28.28 ? 116 ASP H CB    1 
ATOM   1171 C  CG    . ASP B 2  113 ? -9.207  -4.306  23.975  1.00 29.41 ? 116 ASP H CG    1 
ATOM   1172 O  OD1   . ASP B 2  113 ? -9.347  -4.727  25.132  1.00 32.28 ? 116 ASP H OD1   1 
ATOM   1173 O  OD2   . ASP B 2  113 ? -10.038 -4.533  23.090  1.00 31.08 ? 116 ASP H OD2   1 
ATOM   1174 N  N     . TYR B 2  114 ? -5.477  -2.599  21.621  1.00 25.05 ? 117 TYR H N     1 
ATOM   1175 C  CA    . TYR B 2  114 ? -4.399  -1.641  21.443  1.00 24.87 ? 117 TYR H CA    1 
ATOM   1176 C  C     . TYR B 2  114 ? -3.928  -1.499  20.030  1.00 23.62 ? 117 TYR H C     1 
ATOM   1177 O  O     . TYR B 2  114 ? -3.055  -0.682  19.767  1.00 23.11 ? 117 TYR H O     1 
ATOM   1178 C  CB    . TYR B 2  114 ? -3.204  -2.054  22.367  1.00 26.03 ? 117 TYR H CB    1 
ATOM   1179 C  CG    . TYR B 2  114 ? -3.820  -2.444  23.666  1.00 30.74 ? 117 TYR H CG    1 
ATOM   1180 C  CD1   . TYR B 2  114 ? -4.221  -1.426  24.525  1.00 29.74 ? 117 TYR H CD1   1 
ATOM   1181 C  CD2   . TYR B 2  114 ? -4.038  -3.761  24.032  1.00 29.16 ? 117 TYR H CD2   1 
ATOM   1182 C  CE1   . TYR B 2  114 ? -4.874  -1.700  25.698  1.00 32.34 ? 117 TYR H CE1   1 
ATOM   1183 C  CE2   . TYR B 2  114 ? -4.699  -4.052  25.214  1.00 32.07 ? 117 TYR H CE2   1 
ATOM   1184 C  CZ    . TYR B 2  114 ? -5.142  -3.037  26.044  1.00 34.50 ? 117 TYR H CZ    1 
ATOM   1185 O  OH    . TYR B 2  114 ? -5.832  -3.322  27.207  1.00 36.84 ? 117 TYR H OH    1 
ATOM   1186 N  N     . ILE B 2  115 ? -4.482  -2.307  19.128  1.00 22.89 ? 118 ILE H N     1 
ATOM   1187 C  CA    . ILE B 2  115 ? -4.043  -2.314  17.730  1.00 23.34 ? 118 ILE H CA    1 
ATOM   1188 C  C     . ILE B 2  115 ? -5.240  -2.445  16.813  1.00 22.63 ? 118 ILE H C     1 
ATOM   1189 O  O     . ILE B 2  115 ? -5.979  -3.423  16.897  1.00 22.38 ? 118 ILE H O     1 
ATOM   1190 C  CB    . ILE B 2  115 ? -3.067  -3.520  17.468  1.00 22.89 ? 118 ILE H CB    1 
ATOM   1191 C  CG1   . ILE B 2  115 ? -1.812  -3.377  18.358  1.00 23.28 ? 118 ILE H CG1   1 
ATOM   1192 C  CG2   . ILE B 2  115 ? -2.696  -3.617  15.962  1.00 20.75 ? 118 ILE H CG2   1 
ATOM   1193 C  CD1   . ILE B 2  115 ? -0.756  -4.500  18.132  1.00 21.27 ? 118 ILE H CD1   1 
ATOM   1194 N  N     . HIS B 2  116 ? -5.412  -1.449  15.948  1.00 23.26 ? 119 HIS H N     1 
ATOM   1195 C  CA    . HIS B 2  116 ? -6.522  -1.416  14.988  1.00 22.44 ? 119 HIS H CA    1 
ATOM   1196 C  C     . HIS B 2  116 ? -6.166  -0.410  13.906  1.00 21.64 ? 119 HIS H C     1 
ATOM   1197 O  O     . HIS B 2  116 ? -5.469  0.605   14.174  1.00 23.82 ? 119 HIS H O     1 
ATOM   1198 C  CB    . HIS B 2  116 ? -7.841  -0.981  15.666  1.00 21.48 ? 119 HIS H CB    1 
ATOM   1199 C  CG    . HIS B 2  116 ? -8.794  -2.104  15.939  1.00 23.71 ? 119 HIS H CG    1 
ATOM   1200 N  ND1   . HIS B 2  116 ? -8.680  -2.924  17.045  1.00 22.79 ? 119 HIS H ND1   1 
ATOM   1201 C  CD2   . HIS B 2  116 ? -9.896  -2.533  15.256  1.00 21.04 ? 119 HIS H CD2   1 
ATOM   1202 C  CE1   . HIS B 2  116 ? -9.680  -3.796  17.038  1.00 22.42 ? 119 HIS H CE1   1 
ATOM   1203 N  NE2   . HIS B 2  116 ? -10.428 -3.569  15.968  1.00 22.29 ? 119 HIS H NE2   1 
ATOM   1204 N  N     . PRO B 2  117 ? -6.686  -0.621  12.679  1.00 22.27 ? 120 PRO H N     1 
ATOM   1205 C  CA    . PRO B 2  117 ? -6.409  0.302   11.563  1.00 21.12 ? 120 PRO H CA    1 
ATOM   1206 C  C     . PRO B 2  117 ? -7.269  1.541   11.515  1.00 20.38 ? 120 PRO H C     1 
ATOM   1207 O  O     . PRO B 2  117 ? -8.437  1.563   11.935  1.00 18.86 ? 120 PRO H O     1 
ATOM   1208 C  CB    . PRO B 2  117 ? -6.621  -0.580  10.311  1.00 22.50 ? 120 PRO H CB    1 
ATOM   1209 C  CG    . PRO B 2  117 ? -7.730  -1.489  10.748  1.00 24.37 ? 120 PRO H CG    1 
ATOM   1210 C  CD    . PRO B 2  117 ? -7.340  -1.860  12.184  1.00 22.94 ? 120 PRO H CD    1 
ATOM   1211 N  N     . VAL B 2  118 ? -6.681  2.596   10.996  1.00 20.75 ? 121 VAL H N     1 
ATOM   1212 C  CA    . VAL B 2  118 ? -7.429  3.851   10.823  1.00 21.05 ? 121 VAL H CA    1 
ATOM   1213 C  C     . VAL B 2  118 ? -8.038  3.801   9.375   1.00 21.44 ? 121 VAL H C     1 
ATOM   1214 O  O     . VAL B 2  118 ? -7.496  3.095   8.487   1.00 19.01 ? 121 VAL H O     1 
ATOM   1215 C  CB    . VAL B 2  118 ? -6.442  5.089   10.964  1.00 20.08 ? 121 VAL H CB    1 
ATOM   1216 C  CG1   . VAL B 2  118 ? -5.453  5.080   9.841   1.00 19.25 ? 121 VAL H CG1   1 
ATOM   1217 C  CG2   . VAL B 2  118 ? -7.218  6.392   10.897  1.00 20.47 ? 121 VAL H CG2   1 
ATOM   1218 N  N     . CYS B 2  119 ? -9.134  4.543   9.118   1.00 20.78 ? 122 CYS H N     1 
ATOM   1219 C  CA    . CYS B 2  119 ? -9.699  4.559   7.780   1.00 20.23 ? 122 CYS H CA    1 
ATOM   1220 C  C     . CYS B 2  119 ? -9.025  5.537   6.822   1.00 22.08 ? 122 CYS H C     1 
ATOM   1221 O  O     . CYS B 2  119 ? -8.448  6.608   7.209   1.00 21.78 ? 122 CYS H O     1 
ATOM   1222 C  CB    . CYS B 2  119 ? -11.223 4.890   7.787   1.00 21.17 ? 122 CYS H CB    1 
ATOM   1223 S  SG    . CYS B 2  119 ? -12.248 3.984   8.974   1.00 24.38 ? 122 CYS H SG    1 
ATOM   1224 N  N     . LEU B 2  120 ? -9.083  5.197   5.538   1.00 20.91 ? 123 LEU H N     1 
ATOM   1225 C  CA    . LEU B 2  120 ? -8.596  6.126   4.530   1.00 22.41 ? 123 LEU H CA    1 
ATOM   1226 C  C     . LEU B 2  120 ? -9.856  6.842   3.951   1.00 24.55 ? 123 LEU H C     1 
ATOM   1227 O  O     . LEU B 2  120 ? -10.938 6.196   3.738   1.00 19.84 ? 123 LEU H O     1 
ATOM   1228 C  CB    . LEU B 2  120 ? -7.819  5.399   3.420   1.00 24.47 ? 123 LEU H CB    1 
ATOM   1229 C  CG    . LEU B 2  120 ? -6.519  4.746   3.939   1.00 25.94 ? 123 LEU H CG    1 
ATOM   1230 C  CD1   . LEU B 2  120 ? -5.741  4.240   2.766   1.00 25.78 ? 123 LEU H CD1   1 
ATOM   1231 C  CD2   . LEU B 2  120 ? -5.646  5.783   4.696   1.00 23.69 ? 123 LEU H CD2   1 
ATOM   1232 N  N     . PRO B 2  121 ? -9.749  8.187   3.717   1.00 23.93 ? 124 PRO H N     1 
ATOM   1233 C  CA    . PRO B 2  121 ? -10.893 8.949   3.176   1.00 24.43 ? 124 PRO H CA    1 
ATOM   1234 C  C     . PRO B 2  121 ? -11.272 8.628   1.720   1.00 25.56 ? 124 PRO H C     1 
ATOM   1235 O  O     . PRO B 2  121 ? -10.431 8.214   0.929   1.00 24.20 ? 124 PRO H O     1 
ATOM   1236 C  CB    . PRO B 2  121 ? -10.442 10.422  3.310   1.00 24.59 ? 124 PRO H CB    1 
ATOM   1237 C  CG    . PRO B 2  121 ? -8.868  10.293  3.063   1.00 24.02 ? 124 PRO H CG    1 
ATOM   1238 C  CD    . PRO B 2  121 ? -8.587  9.066   3.974   1.00 24.01 ? 124 PRO H CD    1 
ATOM   1239 N  N     . ASP B 2  122 ? -12.557 8.775   1.412   1.00 25.92 ? 125 ASP H N     1 
ATOM   1240 C  CA    . ASP B 2  122 ? -13.052 8.630   0.057   1.00 27.82 ? 125 ASP H CA    1 
ATOM   1241 C  C     . ASP B 2  122 ? -13.445 10.076  -0.249  1.00 28.83 ? 125 ASP H C     1 
ATOM   1242 O  O     . ASP B 2  122 ? -13.326 10.976  0.641   1.00 27.57 ? 125 ASP H O     1 
ATOM   1243 C  CB    . ASP B 2  122 ? -14.250 7.672   -0.080  1.00 27.56 ? 125 ASP H CB    1 
ATOM   1244 C  CG    . ASP B 2  122 ? -15.283 7.823   1.022   1.00 32.13 ? 125 ASP H CG    1 
ATOM   1245 O  OD1   . ASP B 2  122 ? -15.439 8.931   1.643   1.00 29.93 ? 125 ASP H OD1   1 
ATOM   1246 O  OD2   . ASP B 2  122 ? -15.964 6.779   1.259   1.00 32.15 ? 125 ASP H OD2   1 
ATOM   1247 N  N     . ARG B 2  123 ? -13.907 10.292  -1.477  1.00 28.23 ? 126 ARG H N     1 
ATOM   1248 C  CA    . ARG B 2  123 ? -14.258 11.608  -1.955  1.00 30.42 ? 126 ARG H CA    1 
ATOM   1249 C  C     . ARG B 2  123 ? -15.281 12.436  -1.179  1.00 30.86 ? 126 ARG H C     1 
ATOM   1250 O  O     . ARG B 2  123 ? -15.091 13.655  -1.017  1.00 30.49 ? 126 ARG H O     1 
ATOM   1251 C  CB    . ARG B 2  123 ? -14.719 11.530  -3.389  1.00 31.03 ? 126 ARG H CB    1 
ATOM   1252 C  CG    . ARG B 2  123 ? -14.436 12.804  -4.133  1.00 34.59 ? 126 ARG H CG    1 
ATOM   1253 C  CD    . ARG B 2  123 ? -15.106 12.784  -5.481  1.00 38.40 ? 126 ARG H CD    1 
ATOM   1254 N  NE    . ARG B 2  123 ? -16.364 13.449  -5.300  1.00 40.46 ? 126 ARG H NE    1 
ATOM   1255 C  CZ    . ARG B 2  123 ? -17.555 12.885  -5.408  1.00 42.01 ? 126 ARG H CZ    1 
ATOM   1256 N  NH1   . ARG B 2  123 ? -17.700 11.596  -5.738  1.00 40.89 ? 126 ARG H NH1   1 
ATOM   1257 N  NH2   . ARG B 2  123 ? -18.603 13.630  -5.098  1.00 43.90 ? 126 ARG H NH2   1 
ATOM   1258 N  N     . GLU B 2  124 ? -16.355 11.811  -0.694  1.00 30.42 ? 127 GLU H N     1 
ATOM   1259 C  CA    . GLU B 2  124 ? -17.359 12.611  0.032   1.00 32.05 ? 127 GLU H CA    1 
ATOM   1260 C  C     . GLU B 2  124 ? -16.771 12.910  1.387   1.00 31.02 ? 127 GLU H C     1 
ATOM   1261 O  O     . GLU B 2  124 ? -16.996 14.005  1.959   1.00 28.81 ? 127 GLU H O     1 
ATOM   1262 C  CB    . GLU B 2  124 ? -18.689 11.864  0.171   1.00 33.43 ? 127 GLU H CB    1 
ATOM   1263 C  CG    . GLU B 2  124 ? -19.198 11.407  -1.134  1.00 38.80 ? 127 GLU H CG    1 
ATOM   1264 C  CD    . GLU B 2  124 ? -18.320 10.280  -1.747  1.00 46.52 ? 127 GLU H CD    1 
ATOM   1265 O  OE1   . GLU B 2  124 ? -18.610 9.913   -2.917  1.00 48.18 ? 127 GLU H OE1   1 
ATOM   1266 O  OE2   . GLU B 2  124 ? -17.367 9.745   -1.073  1.00 47.58 ? 127 GLU H OE2   1 
ATOM   1267 N  N     . THR B 2  125 ? -15.992 11.955  1.893   1.00 29.02 ? 128 THR H N     1 
ATOM   1268 C  CA    . THR B 2  125 ? -15.380 12.215  3.184   1.00 30.45 ? 128 THR H CA    1 
ATOM   1269 C  C     . THR B 2  125 ? -14.356 13.367  3.081   1.00 29.18 ? 128 THR H C     1 
ATOM   1270 O  O     . THR B 2  125 ? -14.359 14.271  3.923   1.00 29.19 ? 128 THR H O     1 
ATOM   1271 C  CB    . THR B 2  125 ? -14.750 10.920  3.823   1.00 31.50 ? 128 THR H CB    1 
ATOM   1272 O  OG1   . THR B 2  125 ? -15.791 9.944   4.030   1.00 31.74 ? 128 THR H OG1   1 
ATOM   1273 C  CG2   . THR B 2  125 ? -14.109 11.246  5.210   1.00 29.09 ? 128 THR H CG2   1 
ATOM   1274 N  N     . ALA B 2  126 ? -13.510 13.361  2.056   1.00 27.07 ? 129 ALA H N     1 
ATOM   1275 C  CA    . ALA B 2  126 ? -12.509 14.432  1.901   1.00 27.02 ? 129 ALA H CA    1 
ATOM   1276 C  C     . ALA B 2  126 ? -13.116 15.817  1.681   1.00 27.42 ? 129 ALA H C     1 
ATOM   1277 O  O     . ALA B 2  126 ? -12.594 16.826  2.220   1.00 25.80 ? 129 ALA H O     1 
ATOM   1278 C  CB    . ALA B 2  126 ? -11.549 14.128  0.719   1.00 26.83 ? 129 ALA H CB    1 
ATOM   1279 N  N     . ALA B 2  127 A -14.198 15.849  0.878   1.00 26.76 ? 129 ALA H N     1 
ATOM   1280 C  CA    . ALA B 2  127 A -14.898 17.069  0.522   1.00 28.36 ? 129 ALA H CA    1 
ATOM   1281 C  C     . ALA B 2  127 A -15.543 17.726  1.735   1.00 29.31 ? 129 ALA H C     1 
ATOM   1282 O  O     . ALA B 2  127 A -15.424 18.938  1.929   1.00 30.23 ? 129 ALA H O     1 
ATOM   1283 C  CB    . ALA B 2  127 A -15.928 16.787  -0.574  1.00 28.65 ? 129 ALA H CB    1 
ATOM   1284 N  N     . SER B 2  128 B -16.167 16.970  2.611   1.00 30.08 ? 129 SER H N     1 
ATOM   1285 C  CA    . SER B 2  128 B -16.736 17.683  3.730   1.00 33.46 ? 129 SER H CA    1 
ATOM   1286 C  C     . SER B 2  128 B -15.763 17.958  4.919   1.00 34.01 ? 129 SER H C     1 
ATOM   1287 O  O     . SER B 2  128 B -15.941 18.951  5.626   1.00 34.58 ? 129 SER H O     1 
ATOM   1288 C  CB    . SER B 2  128 B -18.025 16.994  4.213   1.00 34.34 ? 129 SER H CB    1 
ATOM   1289 O  OG    . SER B 2  128 B -17.784 15.801  4.938   1.00 42.09 ? 129 SER H OG    1 
ATOM   1290 N  N     . LEU B 2  129 C -14.706 17.153  5.107   1.00 31.51 ? 129 LEU H N     1 
ATOM   1291 C  CA    . LEU B 2  129 C -13.822 17.377  6.259   1.00 30.63 ? 129 LEU H CA    1 
ATOM   1292 C  C     . LEU B 2  129 C -12.598 18.265  6.042   1.00 30.60 ? 129 LEU H C     1 
ATOM   1293 O  O     . LEU B 2  129 C -12.203 18.982  6.935   1.00 28.36 ? 129 LEU H O     1 
ATOM   1294 C  CB    . LEU B 2  129 C -13.383 16.027  6.849   1.00 30.54 ? 129 LEU H CB    1 
ATOM   1295 C  CG    . LEU B 2  129 C -14.531 15.096  7.320   1.00 31.97 ? 129 LEU H CG    1 
ATOM   1296 C  CD1   . LEU B 2  129 C -13.962 13.916  8.137   1.00 31.67 ? 129 LEU H CD1   1 
ATOM   1297 C  CD2   . LEU B 2  129 C -15.539 15.906  8.199   1.00 31.93 ? 129 LEU H CD2   1 
ATOM   1298 N  N     . LEU B 2  130 ? -12.005 18.210  4.856   1.00 31.45 ? 130 LEU H N     1 
ATOM   1299 C  CA    . LEU B 2  130 ? -10.810 18.999  4.556   1.00 33.23 ? 130 LEU H CA    1 
ATOM   1300 C  C     . LEU B 2  130 ? -11.190 20.454  4.227   1.00 33.50 ? 130 LEU H C     1 
ATOM   1301 O  O     . LEU B 2  130 ? -11.286 20.811  3.054   1.00 34.30 ? 130 LEU H O     1 
ATOM   1302 C  CB    . LEU B 2  130 ? -10.098 18.354  3.384   1.00 32.82 ? 130 LEU H CB    1 
ATOM   1303 C  CG    . LEU B 2  130 ? -8.562  18.301  3.316   1.00 36.15 ? 130 LEU H CG    1 
ATOM   1304 C  CD1   . LEU B 2  130 ? -7.931  17.856  4.619   1.00 35.53 ? 130 LEU H CD1   1 
ATOM   1305 C  CD2   . LEU B 2  130 ? -8.220  17.311  2.239   1.00 36.58 ? 130 LEU H CD2   1 
ATOM   1306 N  N     . GLN B 2  131 ? -11.391 21.273  5.271   1.00 31.83 ? 131 GLN H N     1 
ATOM   1307 C  CA    . GLN B 2  131 ? -11.808 22.670  5.138   1.00 30.86 ? 131 GLN H CA    1 
ATOM   1308 C  C     . GLN B 2  131 ? -11.091 23.557  6.149   1.00 28.69 ? 131 GLN H C     1 
ATOM   1309 O  O     . GLN B 2  131 ? -10.956 23.187  7.302   1.00 25.55 ? 131 GLN H O     1 
ATOM   1310 C  CB    . GLN B 2  131 ? -13.293 22.775  5.390   1.00 33.48 ? 131 GLN H CB    1 
ATOM   1311 C  CG    . GLN B 2  131 ? -14.040 21.792  4.566   1.00 40.12 ? 131 GLN H CG    1 
ATOM   1312 C  CD    . GLN B 2  131 ? -15.470 22.175  4.364   1.00 42.91 ? 131 GLN H CD    1 
ATOM   1313 O  OE1   . GLN B 2  131 ? -16.284 21.329  4.013   1.00 46.61 ? 131 GLN H OE1   1 
ATOM   1314 N  NE2   . GLN B 2  131 ? -15.797 23.460  4.570   1.00 44.93 ? 131 GLN H NE2   1 
ATOM   1315 N  N     . ALA B 2  132 ? -10.651 24.729  5.691   1.00 27.12 ? 132 ALA H N     1 
ATOM   1316 C  CA    . ALA B 2  132 ? -9.930  25.655  6.528   1.00 27.85 ? 132 ALA H CA    1 
ATOM   1317 C  C     . ALA B 2  132 ? -10.774 25.870  7.778   1.00 29.69 ? 132 ALA H C     1 
ATOM   1318 O  O     . ALA B 2  132 ? -11.981 26.074  7.673   1.00 27.87 ? 132 ALA H O     1 
ATOM   1319 C  CB    . ALA B 2  132 ? -9.722  26.978  5.800   1.00 27.01 ? 132 ALA H CB    1 
ATOM   1320 N  N     . GLY B 2  133 ? -10.143 25.789  8.957   1.00 30.56 ? 133 GLY H N     1 
ATOM   1321 C  CA    . GLY B 2  133 ? -10.874 26.005  10.184  1.00 31.21 ? 133 GLY H CA    1 
ATOM   1322 C  C     . GLY B 2  133 ? -11.171 24.741  10.947  1.00 31.21 ? 133 GLY H C     1 
ATOM   1323 O  O     . GLY B 2  133 ? -11.130 24.771  12.169  1.00 33.53 ? 133 GLY H O     1 
ATOM   1324 N  N     . TYR B 2  134 ? -11.484 23.645  10.250  1.00 30.64 ? 134 TYR H N     1 
ATOM   1325 C  CA    . TYR B 2  134 ? -11.780 22.341  10.895  1.00 27.47 ? 134 TYR H CA    1 
ATOM   1326 C  C     . TYR B 2  134 ? -10.488 21.839  11.551  1.00 27.09 ? 134 TYR H C     1 
ATOM   1327 O  O     . TYR B 2  134 ? -9.402  22.037  10.984  1.00 27.22 ? 134 TYR H O     1 
ATOM   1328 C  CB    . TYR B 2  134 ? -12.257 21.343  9.806   1.00 29.69 ? 134 TYR H CB    1 
ATOM   1329 C  CG    . TYR B 2  134 ? -13.662 21.619  9.266   1.00 32.02 ? 134 TYR H CG    1 
ATOM   1330 C  CD1   . TYR B 2  134 ? -14.393 22.723  9.692   1.00 34.25 ? 134 TYR H CD1   1 
ATOM   1331 C  CD2   . TYR B 2  134 ? -14.296 20.723  8.413   1.00 33.77 ? 134 TYR H CD2   1 
ATOM   1332 C  CE1   . TYR B 2  134 ? -15.728 22.931  9.283   1.00 34.17 ? 134 TYR H CE1   1 
ATOM   1333 C  CE2   . TYR B 2  134 ? -15.631 20.914  8.000   1.00 34.03 ? 134 TYR H CE2   1 
ATOM   1334 C  CZ    . TYR B 2  134 ? -16.326 22.018  8.436   1.00 34.57 ? 134 TYR H CZ    1 
ATOM   1335 O  OH    . TYR B 2  134 ? -17.607 22.246  8.006   1.00 34.23 ? 134 TYR H OH    1 
ATOM   1336 N  N     . LYS B 2  135 ? -10.558 21.198  12.718  1.00 23.62 ? 135 LYS H N     1 
ATOM   1337 C  CA    . LYS B 2  135 ? -9.327  20.738  13.332  1.00 24.89 ? 135 LYS H CA    1 
ATOM   1338 C  C     . LYS B 2  135 ? -9.091  19.232  13.153  1.00 25.94 ? 135 LYS H C     1 
ATOM   1339 O  O     . LYS B 2  135 ? -10.042 18.425  13.132  1.00 25.37 ? 135 LYS H O     1 
ATOM   1340 C  CB    . LYS B 2  135 ? -9.303  21.034  14.836  1.00 26.09 ? 135 LYS H CB    1 
ATOM   1341 C  CG    . LYS B 2  135 ? -9.305  22.539  15.232  1.00 28.14 ? 135 LYS H CG    1 
ATOM   1342 C  CD    . LYS B 2  135 ? -9.343  22.705  16.754  1.00 27.84 ? 135 LYS H CD    1 
ATOM   1343 C  CE    . LYS B 2  135 ? -9.176  24.219  17.174  1.00 28.87 ? 135 LYS H CE    1 
ATOM   1344 N  NZ    . LYS B 2  135 ? -9.694  24.485  18.595  1.00 29.67 ? 135 LYS H NZ    1 
ATOM   1345 N  N     . GLY B 2  136 ? -7.819  18.868  13.066  1.00 25.05 ? 136 GLY H N     1 
ATOM   1346 C  CA    . GLY B 2  136 ? -7.435  17.465  12.952  1.00 25.12 ? 136 GLY H CA    1 
ATOM   1347 C  C     . GLY B 2  136 ? -6.498  17.159  14.133  1.00 26.41 ? 136 GLY H C     1 
ATOM   1348 O  O     . GLY B 2  136 ? -6.190  18.039  14.971  1.00 24.91 ? 136 GLY H O     1 
ATOM   1349 N  N     . ARG B 2  137 ? -5.958  15.945  14.173  1.00 23.53 ? 137 ARG H N     1 
ATOM   1350 C  CA    . ARG B 2  137 ? -5.108  15.575  15.279  1.00 23.22 ? 137 ARG H CA    1 
ATOM   1351 C  C     . ARG B 2  137 ? -3.834  14.901  14.791  1.00 24.26 ? 137 ARG H C     1 
ATOM   1352 O  O     . ARG B 2  137 ? -3.895  14.035  13.891  1.00 21.89 ? 137 ARG H O     1 
ATOM   1353 C  CB    . ARG B 2  137 ? -5.883  14.618  16.205  1.00 23.56 ? 137 ARG H CB    1 
ATOM   1354 C  CG    . ARG B 2  137 ? -5.055  13.910  17.277  1.00 21.15 ? 137 ARG H CG    1 
ATOM   1355 C  CD    . ARG B 2  137 ? -5.899  12.933  18.082  1.00 21.17 ? 137 ARG H CD    1 
ATOM   1356 N  NE    . ARG B 2  137 ? -6.906  13.627  18.876  1.00 22.12 ? 137 ARG H NE    1 
ATOM   1357 C  CZ    . ARG B 2  137 ? -7.798  13.030  19.646  1.00 24.21 ? 137 ARG H CZ    1 
ATOM   1358 N  NH1   . ARG B 2  137 ? -7.802  11.669  19.734  1.00 24.45 ? 137 ARG H NH1   1 
ATOM   1359 N  NH2   . ARG B 2  137 ? -8.695  13.793  20.298  1.00 21.70 ? 137 ARG H NH2   1 
ATOM   1360 N  N     . VAL B 2  138 ? -2.699  15.280  15.388  1.00 23.58 ? 138 VAL H N     1 
ATOM   1361 C  CA    . VAL B 2  138 ? -1.399  14.693  15.009  1.00 25.48 ? 138 VAL H CA    1 
ATOM   1362 C  C     . VAL B 2  138 ? -0.762  14.037  16.245  1.00 24.55 ? 138 VAL H C     1 
ATOM   1363 O  O     . VAL B 2  138 ? -0.789  14.607  17.337  1.00 24.29 ? 138 VAL H O     1 
ATOM   1364 C  CB    . VAL B 2  138 ? -0.396  15.787  14.453  1.00 28.17 ? 138 VAL H CB    1 
ATOM   1365 C  CG1   . VAL B 2  138 ? 0.795   15.120  13.750  1.00 30.25 ? 138 VAL H CG1   1 
ATOM   1366 C  CG2   . VAL B 2  138 ? -1.084  16.707  13.485  1.00 28.76 ? 138 VAL H CG2   1 
ATOM   1367 N  N     . THR B 2  139 ? -0.165  12.865  16.062  1.00 22.84 ? 139 THR H N     1 
ATOM   1368 C  CA    . THR B 2  139 ? 0.492   12.131  17.140  1.00 22.66 ? 139 THR H CA    1 
ATOM   1369 C  C     . THR B 2  139 ? 1.928   11.703  16.823  1.00 22.82 ? 139 THR H C     1 
ATOM   1370 O  O     . THR B 2  139 ? 2.223   11.365  15.690  1.00 22.02 ? 139 THR H O     1 
ATOM   1371 C  CB    . THR B 2  139 ? -0.260  10.834  17.416  1.00 22.80 ? 139 THR H CB    1 
ATOM   1372 O  OG1   . THR B 2  139 ? -0.551  10.196  16.148  1.00 20.85 ? 139 THR H OG1   1 
ATOM   1373 C  CG2   . THR B 2  139 ? -1.534  11.144  18.216  1.00 22.70 ? 139 THR H CG2   1 
ATOM   1374 N  N     . GLY B 2  140 ? 2.792   11.586  17.829  1.00 23.16 ? 140 GLY H N     1 
ATOM   1375 C  CA    . GLY B 2  140 ? 4.151   11.157  17.505  1.00 22.63 ? 140 GLY H CA    1 
ATOM   1376 C  C     . GLY B 2  140 ? 5.148   11.139  18.658  1.00 25.17 ? 140 GLY H C     1 
ATOM   1377 O  O     . GLY B 2  140 ? 4.882   11.644  19.757  1.00 22.71 ? 140 GLY H O     1 
ATOM   1378 N  N     . TRP B 2  141 ? 6.302   10.534  18.389  1.00 24.96 ? 141 TRP H N     1 
ATOM   1379 C  CA    . TRP B 2  141 ? 7.342   10.365  19.350  1.00 26.03 ? 141 TRP H CA    1 
ATOM   1380 C  C     . TRP B 2  141 ? 8.526   11.306  19.049  1.00 25.97 ? 141 TRP H C     1 
ATOM   1381 O  O     . TRP B 2  141 ? 9.589   11.137  19.589  1.00 26.78 ? 141 TRP H O     1 
ATOM   1382 C  CB    . TRP B 2  141 ? 7.790   8.889   19.327  1.00 28.57 ? 141 TRP H CB    1 
ATOM   1383 C  CG    . TRP B 2  141 ? 7.097   7.999   20.409  1.00 31.20 ? 141 TRP H CG    1 
ATOM   1384 C  CD1   . TRP B 2  141 ? 7.316   8.000   21.797  1.00 33.66 ? 141 TRP H CD1   1 
ATOM   1385 C  CD2   . TRP B 2  141 ? 6.148   6.994   20.170  1.00 33.23 ? 141 TRP H CD2   1 
ATOM   1386 N  NE1   . TRP B 2  141 ? 6.545   7.030   22.406  1.00 35.83 ? 141 TRP H NE1   1 
ATOM   1387 C  CE2   . TRP B 2  141 ? 5.816   6.403   21.426  1.00 33.46 ? 141 TRP H CE2   1 
ATOM   1388 C  CE3   . TRP B 2  141 ? 5.540   6.519   19.013  1.00 34.57 ? 141 TRP H CE3   1 
ATOM   1389 C  CZ2   . TRP B 2  141 ? 4.912   5.373   21.541  1.00 37.25 ? 141 TRP H CZ2   1 
ATOM   1390 C  CZ3   . TRP B 2  141 ? 4.632   5.480   19.124  1.00 39.30 ? 141 TRP H CZ3   1 
ATOM   1391 C  CH2   . TRP B 2  141 ? 4.321   4.911   20.374  1.00 39.71 ? 141 TRP H CH2   1 
ATOM   1392 N  N     . GLY B 2  142 ? 8.307   12.286  18.189  1.00 25.81 ? 142 GLY H N     1 
ATOM   1393 C  CA    . GLY B 2  142 ? 9.325   13.250  17.808  1.00 26.13 ? 142 GLY H CA    1 
ATOM   1394 C  C     . GLY B 2  142 ? 9.729   14.298  18.837  1.00 25.87 ? 142 GLY H C     1 
ATOM   1395 O  O     . GLY B 2  142 ? 9.210   14.327  19.967  1.00 23.06 ? 142 GLY H O     1 
ATOM   1396 N  N     . ASN B 2  143 ? 10.640  15.191  18.422  1.00 26.75 ? 143 ASN H N     1 
ATOM   1397 C  CA    . ASN B 2  143 ? 11.156  16.227  19.314  1.00 28.25 ? 143 ASN H CA    1 
ATOM   1398 C  C     . ASN B 2  143 ? 10.084  17.034  19.931  1.00 28.75 ? 143 ASN H C     1 
ATOM   1399 O  O     . ASN B 2  143 ? 9.076   17.375  19.296  1.00 27.89 ? 143 ASN H O     1 
ATOM   1400 C  CB    . ASN B 2  143 ? 12.107  17.161  18.592  1.00 29.72 ? 143 ASN H CB    1 
ATOM   1401 C  CG    . ASN B 2  143 ? 13.393  16.484  18.230  1.00 31.54 ? 143 ASN H CG    1 
ATOM   1402 O  OD1   . ASN B 2  143 ? 13.685  15.389  18.726  1.00 32.86 ? 143 ASN H OD1   1 
ATOM   1403 N  ND2   . ASN B 2  143 ? 14.188  17.124  17.368  1.00 33.86 ? 143 ASN H ND2   1 
ATOM   1404 N  N     . LEU B 2  144 ? 10.287  17.328  21.195  1.00 28.97 ? 144 LEU H N     1 
ATOM   1405 C  CA    . LEU B 2  144 ? 9.341   18.143  21.961  1.00 29.97 ? 144 LEU H CA    1 
ATOM   1406 C  C     . LEU B 2  144 ? 9.541   19.634  21.711  1.00 31.13 ? 144 LEU H C     1 
ATOM   1407 O  O     . LEU B 2  144 ? 8.723   20.464  22.124  1.00 32.44 ? 144 LEU H O     1 
ATOM   1408 C  CB    . LEU B 2  144 ? 9.518   17.868  23.433  1.00 29.19 ? 144 LEU H CB    1 
ATOM   1409 C  CG    . LEU B 2  144 ? 9.070   16.480  23.855  1.00 30.07 ? 144 LEU H CG    1 
ATOM   1410 C  CD1   . LEU B 2  144 ? 9.714   16.166  25.246  1.00 29.52 ? 144 LEU H CD1   1 
ATOM   1411 C  CD2   . LEU B 2  144 ? 7.522   16.450  23.867  1.00 26.49 ? 144 LEU H CD2   1 
ATOM   1412 N  N     . LYS B 2  145 ? 10.648  19.975  21.073  1.00 32.00 ? 145 LYS H N     1 
ATOM   1413 C  CA    . LYS B 2  145 ? 10.874  21.368  20.740  1.00 34.53 ? 145 LYS H CA    1 
ATOM   1414 C  C     . LYS B 2  145 ? 11.879  21.444  19.589  1.00 34.34 ? 145 LYS H C     1 
ATOM   1415 O  O     . LYS B 2  145 ? 12.550  20.485  19.255  1.00 32.38 ? 145 LYS H O     1 
ATOM   1416 C  CB    . LYS B 2  145 ? 11.347  22.181  21.962  1.00 37.36 ? 145 LYS H CB    1 
ATOM   1417 C  CG    . LYS B 2  145 ? 12.801  21.979  22.294  1.00 40.39 ? 145 LYS H CG    1 
ATOM   1418 C  CD    . LYS B 2  145 ? 13.034  20.671  23.027  1.00 45.01 ? 145 LYS H CD    1 
ATOM   1419 C  CE    . LYS B 2  145 ? 13.479  20.931  24.491  1.00 47.62 ? 145 LYS H CE    1 
ATOM   1420 N  NZ    . LYS B 2  145 ? 12.472  21.774  25.229  1.00 48.75 ? 145 LYS H NZ    1 
ATOM   1421 N  N     . GLU B 2  146 ? 11.915  22.590  18.943  1.00 36.24 ? 146 GLU H N     1 
ATOM   1422 C  CA    . GLU B 2  146 ? 12.802  22.847  17.807  1.00 38.90 ? 146 GLU H CA    1 
ATOM   1423 C  C     . GLU B 2  146 ? 14.260  22.624  18.205  1.00 40.51 ? 146 GLU H C     1 
ATOM   1424 O  O     . GLU B 2  146 ? 14.660  22.997  19.300  1.00 40.31 ? 146 GLU H O     1 
ATOM   1425 C  CB    . GLU B 2  146 ? 12.586  24.308  17.364  1.00 36.31 ? 146 GLU H CB    1 
ATOM   1426 C  CG    . GLU B 2  146 ? 13.314  24.726  16.143  1.00 34.69 ? 146 GLU H CG    1 
ATOM   1427 C  CD    . GLU B 2  146 ? 13.052  26.195  15.791  1.00 35.10 ? 146 GLU H CD    1 
ATOM   1428 O  OE1   . GLU B 2  146 ? 13.975  27.035  15.995  1.00 36.84 ? 146 GLU H OE1   1 
ATOM   1429 O  OE2   . GLU B 2  146 ? 11.924  26.520  15.321  1.00 29.34 ? 146 GLU H OE2   1 
ATOM   1430 N  N     . THR B 2  147 ? 15.052  22.018  17.322  1.00 44.32 ? 147 THR H N     1 
ATOM   1431 C  CA    . THR B 2  147 ? 16.491  21.809  17.601  1.00 47.77 ? 147 THR H CA    1 
ATOM   1432 C  C     . THR B 2  147 ? 17.376  22.483  16.538  1.00 49.58 ? 147 THR H C     1 
ATOM   1433 O  O     . THR B 2  147 ? 17.270  22.216  15.314  1.00 52.17 ? 147 THR H O     1 
ATOM   1434 C  CB    . THR B 2  147 ? 16.893  20.301  17.654  1.00 49.05 ? 147 THR H CB    1 
ATOM   1435 O  OG1   . THR B 2  147 ? 16.589  19.669  16.396  1.00 49.05 ? 147 THR H OG1   1 
ATOM   1436 C  CG2   . THR B 2  147 ? 16.183  19.597  18.834  1.00 49.82 ? 147 THR H CG2   1 
ATOM   1437 N  N     . GLN B 2  156 ? 12.803  14.202  23.528  1.00 45.41 ? 151 GLN H N     1 
ATOM   1438 C  CA    . GLN B 2  156 ? 12.345  12.819  23.315  1.00 44.16 ? 151 GLN H CA    1 
ATOM   1439 C  C     . GLN B 2  156 ? 11.304  12.413  24.412  1.00 42.44 ? 151 GLN H C     1 
ATOM   1440 O  O     . GLN B 2  156 ? 11.658  12.214  25.587  1.00 42.91 ? 151 GLN H O     1 
ATOM   1441 C  CB    . GLN B 2  156 ? 13.564  11.892  23.353  1.00 47.02 ? 151 GLN H CB    1 
ATOM   1442 C  CG    . GLN B 2  156 ? 14.198  11.813  24.774  1.00 52.66 ? 151 GLN H CG    1 
ATOM   1443 C  CD    . GLN B 2  156 ? 15.741  11.742  24.808  1.00 54.26 ? 151 GLN H CD    1 
ATOM   1444 O  OE1   . GLN B 2  156 ? 16.355  10.696  24.487  1.00 54.62 ? 151 GLN H OE1   1 
ATOM   1445 N  NE2   . GLN B 2  156 ? 16.371  12.867  25.207  1.00 54.54 ? 151 GLN H NE2   1 
ATOM   1446 N  N     . PRO B 2  157 ? 10.005  12.289  24.047  1.00 39.60 ? 152 PRO H N     1 
ATOM   1447 C  CA    . PRO B 2  157 ? 9.041   11.915  25.094  1.00 37.02 ? 152 PRO H CA    1 
ATOM   1448 C  C     . PRO B 2  157 ? 9.068   10.435  25.463  1.00 35.93 ? 152 PRO H C     1 
ATOM   1449 O  O     . PRO B 2  157 ? 9.582   9.602   24.701  1.00 33.03 ? 152 PRO H O     1 
ATOM   1450 C  CB    . PRO B 2  157 ? 7.700   12.330  24.483  1.00 38.10 ? 152 PRO H CB    1 
ATOM   1451 C  CG    . PRO B 2  157 ? 7.914   12.027  22.995  1.00 36.75 ? 152 PRO H CG    1 
ATOM   1452 C  CD    . PRO B 2  157 ? 9.321   12.556  22.755  1.00 36.88 ? 152 PRO H CD    1 
ATOM   1453 N  N     . SER B 2  158 ? 8.518   10.111  26.636  1.00 34.31 ? 153 SER H N     1 
ATOM   1454 C  CA    . SER B 2  158 ? 8.470   8.725   27.068  1.00 35.21 ? 153 SER H CA    1 
ATOM   1455 C  C     . SER B 2  158 ? 7.118   8.077   26.720  1.00 35.14 ? 153 SER H C     1 
ATOM   1456 O  O     . SER B 2  158 ? 7.000   6.838   26.676  1.00 35.91 ? 153 SER H O     1 
ATOM   1457 C  CB    . SER B 2  158 ? 8.715   8.609   28.579  1.00 35.79 ? 153 SER H CB    1 
ATOM   1458 O  OG    . SER B 2  158 ? 7.823   9.448   29.309  1.00 39.49 ? 153 SER H OG    1 
ATOM   1459 N  N     . VAL B 2  159 ? 6.119   8.930   26.505  1.00 33.52 ? 154 VAL H N     1 
ATOM   1460 C  CA    . VAL B 2  159 ? 4.762   8.536   26.171  1.00 32.03 ? 154 VAL H CA    1 
ATOM   1461 C  C     . VAL B 2  159 ? 4.375   9.199   24.858  1.00 29.02 ? 154 VAL H C     1 
ATOM   1462 O  O     . VAL B 2  159 ? 4.711   10.368  24.670  1.00 27.19 ? 154 VAL H O     1 
ATOM   1463 C  CB    . VAL B 2  159 ? 3.830   9.017   27.290  1.00 34.33 ? 154 VAL H CB    1 
ATOM   1464 C  CG1   . VAL B 2  159 ? 2.387   8.854   26.911  1.00 36.43 ? 154 VAL H CG1   1 
ATOM   1465 C  CG2   . VAL B 2  159 ? 4.138   8.254   28.540  1.00 36.31 ? 154 VAL H CG2   1 
ATOM   1466 N  N     . LEU B 2  160 ? 3.715   8.468   23.937  1.00 26.11 ? 155 LEU H N     1 
ATOM   1467 C  CA    . LEU B 2  160 ? 3.237   9.068   22.657  1.00 23.68 ? 155 LEU H CA    1 
ATOM   1468 C  C     . LEU B 2  160 ? 2.597   10.462  22.962  1.00 23.86 ? 155 LEU H C     1 
ATOM   1469 O  O     . LEU B 2  160 ? 1.853   10.579  23.915  1.00 24.12 ? 155 LEU H O     1 
ATOM   1470 C  CB    . LEU B 2  160 ? 2.128   8.197   22.014  1.00 20.95 ? 155 LEU H CB    1 
ATOM   1471 C  CG    . LEU B 2  160 ? 1.646   8.666   20.629  1.00 19.50 ? 155 LEU H CG    1 
ATOM   1472 C  CD1   . LEU B 2  160 ? 2.876   8.586   19.661  1.00 17.44 ? 155 LEU H CD1   1 
ATOM   1473 C  CD2   . LEU B 2  160 ? 0.427   7.746   20.136  1.00 17.49 ? 155 LEU H CD2   1 
ATOM   1474 N  N     . GLN B 2  161 ? 2.860   11.482  22.143  1.00 24.98 ? 156 GLN H N     1 
ATOM   1475 C  CA    . GLN B 2  161 ? 2.316   12.837  22.346  1.00 25.17 ? 156 GLN H CA    1 
ATOM   1476 C  C     . GLN B 2  161 ? 1.233   13.125  21.290  1.00 26.82 ? 156 GLN H C     1 
ATOM   1477 O  O     . GLN B 2  161 ? 1.336   12.622  20.152  1.00 25.96 ? 156 GLN H O     1 
ATOM   1478 C  CB    . GLN B 2  161 ? 3.419   13.853  22.178  1.00 26.67 ? 156 GLN H CB    1 
ATOM   1479 C  CG    . GLN B 2  161 ? 4.504   13.674  23.175  1.00 28.51 ? 156 GLN H CG    1 
ATOM   1480 C  CD    . GLN B 2  161 ? 4.020   14.140  24.498  1.00 27.37 ? 156 GLN H CD    1 
ATOM   1481 O  OE1   . GLN B 2  161 ? 3.579   15.268  24.620  1.00 27.92 ? 156 GLN H OE1   1 
ATOM   1482 N  NE2   . GLN B 2  161 ? 4.070   13.281  25.492  1.00 27.68 ? 156 GLN H NE2   1 
ATOM   1483 N  N     . VAL B 2  162 ? 0.247   13.961  21.669  1.00 26.80 ? 157 VAL H N     1 
ATOM   1484 C  CA    . VAL B 2  162 ? -0.902  14.325  20.839  1.00 27.20 ? 157 VAL H CA    1 
ATOM   1485 C  C     . VAL B 2  162 ? -1.166  15.840  20.798  1.00 26.38 ? 157 VAL H C     1 
ATOM   1486 O  O     . VAL B 2  162 ? -1.022  16.517  21.793  1.00 27.52 ? 157 VAL H O     1 
ATOM   1487 C  CB    . VAL B 2  162 ? -2.209  13.631  21.405  1.00 28.41 ? 157 VAL H CB    1 
ATOM   1488 C  CG1   . VAL B 2  162 ? -3.356  13.588  20.350  1.00 29.32 ? 157 VAL H CG1   1 
ATOM   1489 C  CG2   . VAL B 2  162 ? -1.888  12.268  21.840  1.00 30.97 ? 157 VAL H CG2   1 
ATOM   1490 N  N     . VAL B 2  163 ? -1.539  16.360  19.638  1.00 25.11 ? 158 VAL H N     1 
ATOM   1491 C  CA    . VAL B 2  163 ? -1.863  17.760  19.491  1.00 26.57 ? 158 VAL H CA    1 
ATOM   1492 C  C     . VAL B 2  163 ? -2.989  17.936  18.466  1.00 26.98 ? 158 VAL H C     1 
ATOM   1493 O  O     . VAL B 2  163 ? -3.024  17.203  17.462  1.00 26.53 ? 158 VAL H O     1 
ATOM   1494 C  CB    . VAL B 2  163 ? -0.586  18.655  19.119  1.00 26.05 ? 158 VAL H CB    1 
ATOM   1495 C  CG1   . VAL B 2  163 ? -0.096  18.422  17.701  1.00 22.13 ? 158 VAL H CG1   1 
ATOM   1496 C  CG2   . VAL B 2  163 ? -0.932  20.116  19.343  1.00 25.88 ? 158 VAL H CG2   1 
ATOM   1497 N  N     . ASN B 2  164 ? -3.970  18.810  18.779  1.00 25.59 ? 159 ASN H N     1 
ATOM   1498 C  CA    . ASN B 2  164 ? -5.070  19.100  17.881  1.00 25.62 ? 159 ASN H CA    1 
ATOM   1499 C  C     . ASN B 2  164 ? -4.785  20.453  17.203  1.00 26.56 ? 159 ASN H C     1 
ATOM   1500 O  O     . ASN B 2  164 ? -4.430  21.418  17.878  1.00 25.02 ? 159 ASN H O     1 
ATOM   1501 C  CB    . ASN B 2  164 ? -6.423  19.099  18.634  1.00 26.74 ? 159 ASN H CB    1 
ATOM   1502 C  CG    . ASN B 2  164 ? -6.747  17.727  19.249  1.00 26.98 ? 159 ASN H CG    1 
ATOM   1503 O  OD1   . ASN B 2  164 ? -6.255  16.681  18.772  1.00 25.71 ? 159 ASN H OD1   1 
ATOM   1504 N  ND2   . ASN B 2  164 ? -7.590  17.722  20.304  1.00 27.74 ? 159 ASN H ND2   1 
ATOM   1505 N  N     . LEU B 2  165 ? -4.945  20.507  15.863  1.00 24.85 ? 160 LEU H N     1 
ATOM   1506 C  CA    . LEU B 2  165 ? -4.618  21.692  15.054  1.00 24.15 ? 160 LEU H CA    1 
ATOM   1507 C  C     . LEU B 2  165 ? -5.591  21.942  13.912  1.00 25.41 ? 160 LEU H C     1 
ATOM   1508 O  O     . LEU B 2  165 ? -6.092  20.987  13.245  1.00 22.95 ? 160 LEU H O     1 
ATOM   1509 C  CB    . LEU B 2  165 ? -3.196  21.589  14.440  1.00 24.87 ? 160 LEU H CB    1 
ATOM   1510 C  CG    . LEU B 2  165 ? -2.025  21.370  15.429  1.00 26.81 ? 160 LEU H CG    1 
ATOM   1511 C  CD1   . LEU B 2  165 ? -0.740  21.164  14.613  1.00 28.64 ? 160 LEU H CD1   1 
ATOM   1512 C  CD2   . LEU B 2  165 ? -1.866  22.541  16.363  1.00 23.35 ? 160 LEU H CD2   1 
ATOM   1513 N  N     . PRO B 2  166 ? -5.834  23.244  13.625  1.00 23.80 ? 161 PRO H N     1 
ATOM   1514 C  CA    . PRO B 2  166 ? -6.757  23.597  12.555  1.00 23.76 ? 161 PRO H CA    1 
ATOM   1515 C  C     . PRO B 2  166 ? -6.079  23.695  11.191  1.00 23.68 ? 161 PRO H C     1 
ATOM   1516 O  O     . PRO B 2  166 ? -4.936  24.194  11.083  1.00 23.58 ? 161 PRO H O     1 
ATOM   1517 C  CB    . PRO B 2  166 ? -7.321  24.957  13.016  1.00 23.06 ? 161 PRO H CB    1 
ATOM   1518 C  CG    . PRO B 2  166 ? -6.126  25.626  13.604  1.00 24.36 ? 161 PRO H CG    1 
ATOM   1519 C  CD    . PRO B 2  166 ? -5.333  24.448  14.312  1.00 24.89 ? 161 PRO H CD    1 
ATOM   1520 N  N     . ILE B 2  167 ? -6.784  23.178  10.170  1.00 22.32 ? 162 ILE H N     1 
ATOM   1521 C  CA    . ILE B 2  167 ? -6.373  23.266  8.783   1.00 22.12 ? 162 ILE H CA    1 
ATOM   1522 C  C     . ILE B 2  167 ? -6.420  24.768  8.379   1.00 24.23 ? 162 ILE H C     1 
ATOM   1523 O  O     . ILE B 2  167 ? -7.354  25.507  8.726   1.00 22.64 ? 162 ILE H O     1 
ATOM   1524 C  CB    . ILE B 2  167 ? -7.352  22.487  7.918   1.00 23.70 ? 162 ILE H CB    1 
ATOM   1525 C  CG1   . ILE B 2  167 ? -7.184  20.965  8.187   1.00 23.70 ? 162 ILE H CG1   1 
ATOM   1526 C  CG2   . ILE B 2  167 ? -7.148  22.846  6.441   1.00 24.89 ? 162 ILE H CG2   1 
ATOM   1527 C  CD1   . ILE B 2  167 ? -8.431  20.141  7.746   1.00 24.90 ? 162 ILE H CD1   1 
ATOM   1528 N  N     . VAL B 2  168 ? -5.437  25.195  7.605   1.00 23.58 ? 163 VAL H N     1 
ATOM   1529 C  CA    . VAL B 2  168 ? -5.311  26.601  7.191   1.00 25.54 ? 163 VAL H CA    1 
ATOM   1530 C  C     . VAL B 2  168 ? -5.631  26.841  5.701   1.00 25.59 ? 163 VAL H C     1 
ATOM   1531 O  O     . VAL B 2  168 ? -5.431  25.928  4.880   1.00 26.57 ? 163 VAL H O     1 
ATOM   1532 C  CB    . VAL B 2  168 ? -3.889  27.011  7.544   1.00 25.26 ? 163 VAL H CB    1 
ATOM   1533 C  CG1   . VAL B 2  168 ? -3.430  28.237  6.729   1.00 26.65 ? 163 VAL H CG1   1 
ATOM   1534 C  CG2   . VAL B 2  168 ? -3.833  27.227  9.079   1.00 26.59 ? 163 VAL H CG2   1 
ATOM   1535 N  N     . GLU B 2  169 ? -6.140  28.024  5.315   1.00 28.24 ? 164 GLU H N     1 
ATOM   1536 C  CA    . GLU B 2  169 ? -6.438  28.251  3.881   1.00 28.05 ? 164 GLU H CA    1 
ATOM   1537 C  C     . GLU B 2  169 ? -5.170  28.247  3.077   1.00 28.97 ? 164 GLU H C     1 
ATOM   1538 O  O     . GLU B 2  169 ? -4.113  28.706  3.547   1.00 28.01 ? 164 GLU H O     1 
ATOM   1539 C  CB    . GLU B 2  169 ? -7.152  29.542  3.566   1.00 32.54 ? 164 GLU H CB    1 
ATOM   1540 C  CG    . GLU B 2  169 ? -6.812  30.643  4.426   1.00 37.51 ? 164 GLU H CG    1 
ATOM   1541 C  CD    . GLU B 2  169 ? -7.534  30.425  5.708   1.00 41.89 ? 164 GLU H CD    1 
ATOM   1542 O  OE1   . GLU B 2  169 ? -8.784  30.382  5.617   1.00 42.99 ? 164 GLU H OE1   1 
ATOM   1543 O  OE2   . GLU B 2  169 ? -6.873  30.240  6.766   1.00 40.87 ? 164 GLU H OE2   1 
ATOM   1544 N  N     . ARG B 2  170 ? -5.292  27.690  1.866   1.00 28.04 ? 165 ARG H N     1 
ATOM   1545 C  CA    . ARG B 2  170 ? -4.173  27.558  0.938   1.00 29.55 ? 165 ARG H CA    1 
ATOM   1546 C  C     . ARG B 2  170 ? -3.419  28.837  0.630   1.00 28.87 ? 165 ARG H C     1 
ATOM   1547 O  O     . ARG B 2  170 ? -2.220  28.795  0.479   1.00 28.32 ? 165 ARG H O     1 
ATOM   1548 C  CB    . ARG B 2  170 ? -4.616  26.889  -0.345  1.00 29.38 ? 165 ARG H CB    1 
ATOM   1549 C  CG    . ARG B 2  170 ? -3.439  26.354  -1.155  1.00 31.58 ? 165 ARG H CG    1 
ATOM   1550 C  CD    . ARG B 2  170 ? -3.915  25.361  -2.294  1.00 34.00 ? 165 ARG H CD    1 
ATOM   1551 N  NE    . ARG B 2  170 ? -4.336  24.073  -1.716  1.00 32.83 ? 165 ARG H NE    1 
ATOM   1552 C  CZ    . ARG B 2  170 ? -3.528  23.036  -1.448  1.00 32.18 ? 165 ARG H CZ    1 
ATOM   1553 N  NH1   . ARG B 2  170 ? -2.220  23.097  -1.713  1.00 28.84 ? 165 ARG H NH1   1 
ATOM   1554 N  NH2   . ARG B 2  170 ? -4.037  21.928  -0.864  1.00 31.42 ? 165 ARG H NH2   1 
ATOM   1555 N  N     . PRO B 2  171 ? -4.118  29.989  0.501   1.00 29.21 ? 166 PRO H N     1 
ATOM   1556 C  CA    . PRO B 2  171 ? -3.335  31.189  0.225   1.00 29.58 ? 166 PRO H CA    1 
ATOM   1557 C  C     . PRO B 2  171 ? -2.419  31.558  1.378   1.00 27.72 ? 166 PRO H C     1 
ATOM   1558 O  O     . PRO B 2  171 ? -1.319  32.084  1.183   1.00 29.54 ? 166 PRO H O     1 
ATOM   1559 C  CB    . PRO B 2  171 ? -4.406  32.266  -0.011  1.00 30.57 ? 166 PRO H CB    1 
ATOM   1560 C  CG    . PRO B 2  171 ? -5.451  31.539  -0.657  1.00 31.44 ? 166 PRO H CG    1 
ATOM   1561 C  CD    . PRO B 2  171 ? -5.538  30.230  0.196   1.00 29.98 ? 166 PRO H CD    1 
ATOM   1562 N  N     . VAL B 2  172 ? -2.898  31.334  2.590   1.00 28.28 ? 167 VAL H N     1 
ATOM   1563 C  CA    . VAL B 2  172 ? -2.093  31.639  3.773   1.00 27.24 ? 167 VAL H CA    1 
ATOM   1564 C  C     . VAL B 2  172 ? -0.891  30.672  3.828   1.00 27.62 ? 167 VAL H C     1 
ATOM   1565 O  O     . VAL B 2  172 ? 0.272   31.093  4.064   1.00 28.62 ? 167 VAL H O     1 
ATOM   1566 C  CB    . VAL B 2  172 ? -2.940  31.468  5.065   1.00 26.24 ? 167 VAL H CB    1 
ATOM   1567 C  CG1   . VAL B 2  172 ? -2.047  31.564  6.336   1.00 25.17 ? 167 VAL H CG1   1 
ATOM   1568 C  CG2   . VAL B 2  172 ? -3.997  32.520  5.125   1.00 26.13 ? 167 VAL H CG2   1 
ATOM   1569 N  N     . CYS B 2  173 ? -1.181  29.380  3.627   1.00 26.62 ? 168 CYS H N     1 
ATOM   1570 C  CA    . CYS B 2  173 ? -0.148  28.348  3.634   1.00 25.79 ? 168 CYS H CA    1 
ATOM   1571 C  C     . CYS B 2  173 ? 0.907   28.772  2.645   1.00 27.48 ? 168 CYS H C     1 
ATOM   1572 O  O     . CYS B 2  173 ? 2.084   28.783  2.974   1.00 28.71 ? 168 CYS H O     1 
ATOM   1573 C  CB    . CYS B 2  173 ? -0.718  26.962  3.196   1.00 24.68 ? 168 CYS H CB    1 
ATOM   1574 S  SG    . CYS B 2  173 ? -1.872  26.192  4.394   1.00 24.18 ? 168 CYS H SG    1 
ATOM   1575 N  N     . LYS B 2  174 ? 0.483   29.155  1.440   1.00 29.30 ? 169 LYS H N     1 
ATOM   1576 C  CA    . LYS B 2  174 ? 1.440   29.528  0.382   1.00 32.03 ? 169 LYS H CA    1 
ATOM   1577 C  C     . LYS B 2  174 ? 2.253   30.794  0.671   1.00 31.36 ? 169 LYS H C     1 
ATOM   1578 O  O     . LYS B 2  174 ? 3.466   30.823  0.414   1.00 33.77 ? 169 LYS H O     1 
ATOM   1579 C  CB    . LYS B 2  174 ? 0.732   29.650  -0.979  1.00 33.56 ? 169 LYS H CB    1 
ATOM   1580 C  CG    . LYS B 2  174 ? 1.496   30.492  -1.998  1.00 38.39 ? 169 LYS H CG    1 
ATOM   1581 C  CD    . LYS B 2  174 ? 1.370   29.948  -3.417  1.00 41.68 ? 169 LYS H CD    1 
ATOM   1582 C  CE    . LYS B 2  174 ? 0.058   30.317  -4.039  1.00 43.53 ? 169 LYS H CE    1 
ATOM   1583 N  NZ    . LYS B 2  174 ? -0.349  29.258  -5.023  1.00 48.06 ? 169 LYS H NZ    1 
ATOM   1584 N  N     . ASP B 2  175 ? 1.633   31.793  1.257   1.00 30.15 ? 170 ASP H N     1 
ATOM   1585 C  CA    . ASP B 2  175 ? 2.362   33.036  1.548   1.00 32.14 ? 170 ASP H CA    1 
ATOM   1586 C  C     . ASP B 2  175 ? 3.284   32.876  2.731   1.00 32.59 ? 170 ASP H C     1 
ATOM   1587 O  O     . ASP B 2  175 ? 4.179   33.698  2.912   1.00 34.56 ? 170 ASP H O     1 
ATOM   1588 C  CB    . ASP B 2  175 ? 1.405   34.193  1.866   1.00 34.18 ? 170 ASP H CB    1 
ATOM   1589 C  CG    . ASP B 2  175 ? 0.734   34.801  0.615   1.00 39.10 ? 170 ASP H CG    1 
ATOM   1590 O  OD1   . ASP B 2  175 ? -0.160  35.670  0.826   1.00 41.82 ? 170 ASP H OD1   1 
ATOM   1591 O  OD2   . ASP B 2  175 ? 1.081   34.443  -0.553  1.00 38.27 ? 170 ASP H OD2   1 
ATOM   1592 N  N     . SER B 2  176 ? 3.089   31.845  3.553   1.00 30.47 ? 171 SER H N     1 
ATOM   1593 C  CA    . SER B 2  176 ? 3.947   31.673  4.738   1.00 28.69 ? 171 SER H CA    1 
ATOM   1594 C  C     . SER B 2  176 ? 5.302   31.084  4.432   1.00 26.60 ? 171 SER H C     1 
ATOM   1595 O  O     . SER B 2  176 ? 6.101   30.952  5.348   1.00 27.31 ? 171 SER H O     1 
ATOM   1596 C  CB    . SER B 2  176 ? 3.297   30.741  5.758   1.00 30.02 ? 171 SER H CB    1 
ATOM   1597 O  OG    . SER B 2  176 ? 3.222   29.429  5.211   1.00 30.55 ? 171 SER H OG    1 
ATOM   1598 N  N     . THR B 2  177 ? 5.602   30.766  3.175   1.00 24.94 ? 172 THR H N     1 
ATOM   1599 C  CA    . THR B 2  177 ? 6.896   30.086  2.888   1.00 23.93 ? 172 THR H CA    1 
ATOM   1600 C  C     . THR B 2  177 ? 7.387   30.348  1.462   1.00 25.54 ? 172 THR H C     1 
ATOM   1601 O  O     . THR B 2  177 ? 6.597   30.682  0.563   1.00 28.29 ? 172 THR H O     1 
ATOM   1602 C  CB    . THR B 2  177 ? 6.698   28.489  3.097   1.00 23.02 ? 172 THR H CB    1 
ATOM   1603 O  OG1   . THR B 2  177 ? 7.929   27.749  2.801   1.00 20.65 ? 172 THR H OG1   1 
ATOM   1604 C  CG2   . THR B 2  177 ? 5.523   27.958  2.162   1.00 21.65 ? 172 THR H CG2   1 
ATOM   1605 N  N     . ARG B 2  178 ? 8.677   30.174  1.202   1.00 27.00 ? 173 ARG H N     1 
ATOM   1606 C  CA    . ARG B 2  178 ? 9.107   30.353  -0.177  1.00 27.82 ? 173 ARG H CA    1 
ATOM   1607 C  C     . ARG B 2  178 ? 9.262   29.010  -0.895  1.00 29.21 ? 173 ARG H C     1 
ATOM   1608 O  O     . ARG B 2  178 ? 9.636   28.973  -2.055  1.00 30.17 ? 173 ARG H O     1 
ATOM   1609 C  CB    . ARG B 2  178 ? 10.401  31.148  -0.230  1.00 29.69 ? 173 ARG H CB    1 
ATOM   1610 C  CG    . ARG B 2  178 ? 10.181  32.681  0.209   1.00 31.06 ? 173 ARG H CG    1 
ATOM   1611 C  CD    . ARG B 2  178 ? 9.228   33.467  -0.717  1.00 30.30 ? 173 ARG H CD    1 
ATOM   1612 N  NE    . ARG B 2  178 ? 9.724   33.493  -2.098  1.00 33.96 ? 173 ARG H NE    1 
ATOM   1613 C  CZ    . ARG B 2  178 ? 10.440  34.473  -2.665  1.00 34.85 ? 173 ARG H CZ    1 
ATOM   1614 N  NH1   . ARG B 2  178 ? 10.815  34.317  -3.928  1.00 35.35 ? 173 ARG H NH1   1 
ATOM   1615 N  NH2   . ARG B 2  178 ? 10.769  35.605  -1.998  1.00 32.13 ? 173 ARG H NH2   1 
ATOM   1616 N  N     . ILE B 2  179 ? 8.991   27.903  -0.199  1.00 28.70 ? 174 ILE H N     1 
ATOM   1617 C  CA    . ILE B 2  179 ? 9.062   26.570  -0.812  1.00 29.02 ? 174 ILE H CA    1 
ATOM   1618 C  C     . ILE B 2  179 ? 7.745   26.483  -1.671  1.00 29.18 ? 174 ILE H C     1 
ATOM   1619 O  O     . ILE B 2  179 ? 6.669   26.903  -1.208  1.00 27.27 ? 174 ILE H O     1 
ATOM   1620 C  CB    A ILE B 2  179 ? 9.076   25.445  0.277   0.42 29.07 ? 174 ILE H CB    1 
ATOM   1621 C  CB    B ILE B 2  179 ? 8.992   25.408  0.278   0.58 28.62 ? 174 ILE H CB    1 
ATOM   1622 C  CG1   A ILE B 2  179 ? 10.395  25.473  1.043   0.42 29.21 ? 174 ILE H CG1   1 
ATOM   1623 C  CG1   B ILE B 2  179 ? 10.188  25.424  1.234   0.58 28.19 ? 174 ILE H CG1   1 
ATOM   1624 C  CG2   A ILE B 2  179 ? 8.859   24.083  -0.368  0.42 29.86 ? 174 ILE H CG2   1 
ATOM   1625 C  CG2   B ILE B 2  179 ? 8.855   24.059  -0.421  0.58 29.67 ? 174 ILE H CG2   1 
ATOM   1626 C  CD1   A ILE B 2  179 ? 10.713  26.847  1.630   0.42 29.30 ? 174 ILE H CD1   1 
ATOM   1627 C  CD1   B ILE B 2  179 ? 11.456  24.872  0.685   0.58 26.70 ? 174 ILE H CD1   1 
ATOM   1628 N  N     . ARG B 2  180 ? 7.856   25.974  -2.895  1.00 29.45 ? 175 ARG H N     1 
ATOM   1629 C  CA    . ARG B 2  180 ? 6.716   25.773  -3.816  1.00 32.29 ? 175 ARG H CA    1 
ATOM   1630 C  C     . ARG B 2  180 ? 5.712   24.744  -3.232  1.00 31.29 ? 175 ARG H C     1 
ATOM   1631 O  O     . ARG B 2  180 ? 6.004   23.535  -3.165  1.00 31.76 ? 175 ARG H O     1 
ATOM   1632 C  CB    . ARG B 2  180 ? 7.223   25.217  -5.157  1.00 34.08 ? 175 ARG H CB    1 
ATOM   1633 C  CG    . ARG B 2  180 ? 6.340   25.489  -6.381  1.00 38.21 ? 175 ARG H CG    1 
ATOM   1634 C  CD    . ARG B 2  180 ? 6.778   24.606  -7.559  1.00 42.82 ? 175 ARG H CD    1 
ATOM   1635 N  NE    . ARG B 2  180 ? 5.953   23.399  -7.569  1.00 47.86 ? 175 ARG H NE    1 
ATOM   1636 C  CZ    . ARG B 2  180 ? 6.387   22.138  -7.626  1.00 49.82 ? 175 ARG H CZ    1 
ATOM   1637 N  NH1   . ARG B 2  180 ? 7.687   21.857  -7.699  1.00 50.52 ? 175 ARG H NH1   1 
ATOM   1638 N  NH2   . ARG B 2  180 ? 5.500   21.150  -7.543  1.00 51.26 ? 175 ARG H NH2   1 
ATOM   1639 N  N     . ILE B 2  181 ? 4.542   25.212  -2.808  1.00 29.84 ? 176 ILE H N     1 
ATOM   1640 C  CA    . ILE B 2  181 ? 3.506   24.315  -2.252  1.00 28.78 ? 176 ILE H CA    1 
ATOM   1641 C  C     . ILE B 2  181 ? 2.783   23.663  -3.451  1.00 27.84 ? 176 ILE H C     1 
ATOM   1642 O  O     . ILE B 2  181 ? 2.801   24.256  -4.521  1.00 27.43 ? 176 ILE H O     1 
ATOM   1643 C  CB    . ILE B 2  181 ? 2.422   25.127  -1.469  1.00 27.87 ? 176 ILE H CB    1 
ATOM   1644 C  CG1   . ILE B 2  181 ? 3.042   25.905  -0.308  1.00 27.32 ? 176 ILE H CG1   1 
ATOM   1645 C  CG2   . ILE B 2  181 ? 1.400   24.206  -0.908  1.00 32.24 ? 176 ILE H CG2   1 
ATOM   1646 C  CD1   . ILE B 2  181 ? 4.111   25.197  0.405   1.00 24.70 ? 176 ILE H CD1   1 
ATOM   1647 N  N     . THR B 2  182 ? 2.141   22.501  -3.285  1.00 24.76 ? 177 THR H N     1 
ATOM   1648 C  CA    . THR B 2  182 ? 1.375   21.895  -4.406  1.00 25.10 ? 177 THR H CA    1 
ATOM   1649 C  C     . THR B 2  182 ? 0.028   21.380  -3.891  1.00 25.42 ? 177 THR H C     1 
ATOM   1650 O  O     . THR B 2  182 ? -0.191  21.282  -2.675  1.00 26.85 ? 177 THR H O     1 
ATOM   1651 C  CB    . THR B 2  182 ? 2.010   20.624  -4.969  1.00 24.32 ? 177 THR H CB    1 
ATOM   1652 O  OG1   . THR B 2  182 ? 1.945   19.591  -3.940  1.00 23.69 ? 177 THR H OG1   1 
ATOM   1653 C  CG2   . THR B 2  182 ? 3.496   20.893  -5.491  1.00 23.81 ? 177 THR H CG2   1 
ATOM   1654 N  N     . ASP B 2  183 ? -0.838  20.987  -4.813  1.00 24.76 ? 178 ASP H N     1 
ATOM   1655 C  CA    . ASP B 2  183 ? -2.120  20.401  -4.450  1.00 25.55 ? 178 ASP H CA    1 
ATOM   1656 C  C     . ASP B 2  183 ? -1.956  19.058  -3.671  1.00 25.32 ? 178 ASP H C     1 
ATOM   1657 O  O     . ASP B 2  183 ? -2.926  18.581  -3.065  1.00 24.99 ? 178 ASP H O     1 
ATOM   1658 C  CB    . ASP B 2  183 ? -2.998  20.238  -5.723  1.00 28.56 ? 178 ASP H CB    1 
ATOM   1659 C  CG    . ASP B 2  183 ? -3.417  21.624  -6.332  1.00 33.18 ? 178 ASP H CG    1 
ATOM   1660 O  OD1   . ASP B 2  183 ? -3.153  22.689  -5.699  1.00 34.17 ? 178 ASP H OD1   1 
ATOM   1661 O  OD2   . ASP B 2  183 ? -4.015  21.664  -7.426  1.00 34.58 ? 178 ASP H OD2   1 
ATOM   1662 N  N     . ASN B 2  184 ? -0.752  18.463  -3.642  1.00 21.64 ? 179 ASN H N     1 
ATOM   1663 C  CA    . ASN B 2  184 ? -0.550  17.221  -2.878  1.00 21.93 ? 179 ASN H CA    1 
ATOM   1664 C  C     . ASN B 2  184 ? -0.169  17.480  -1.408  1.00 23.14 ? 179 ASN H C     1 
ATOM   1665 O  O     . ASN B 2  184 ? 0.211   16.593  -0.694  1.00 22.76 ? 179 ASN H O     1 
ATOM   1666 C  CB    . ASN B 2  184 ? 0.509   16.370  -3.556  1.00 21.06 ? 179 ASN H CB    1 
ATOM   1667 C  CG    . ASN B 2  184 ? 0.094   16.029  -4.992  1.00 24.83 ? 179 ASN H CG    1 
ATOM   1668 O  OD1   . ASN B 2  184 ? -1.021  15.554  -5.216  1.00 23.45 ? 179 ASN H OD1   1 
ATOM   1669 N  ND2   . ASN B 2  184 ? 0.972   16.310  -5.966  1.00 22.63 ? 179 ASN H ND2   1 
ATOM   1670 N  N     . MET B 2  185 ? -0.319  18.727  -0.975  1.00 24.44 ? 180 MET H N     1 
ATOM   1671 C  CA    . MET B 2  185 ? 0.028   19.154  0.359   1.00 23.94 ? 180 MET H CA    1 
ATOM   1672 C  C     . MET B 2  185 ? -1.094  19.986  0.980   1.00 22.90 ? 180 MET H C     1 
ATOM   1673 O  O     . MET B 2  185 ? -1.872  20.565  0.263   1.00 25.30 ? 180 MET H O     1 
ATOM   1674 C  CB    . MET B 2  185 ? 1.234   20.090  0.269   1.00 23.33 ? 180 MET H CB    1 
ATOM   1675 C  CG    . MET B 2  185 ? 2.517   19.450  -0.167  1.00 23.95 ? 180 MET H CG    1 
ATOM   1676 S  SD    . MET B 2  185 ? 3.730   20.771  -0.404  1.00 24.08 ? 180 MET H SD    1 
ATOM   1677 C  CE    . MET B 2  185 ? 4.857   20.041  -1.634  1.00 24.01 ? 180 MET H CE    1 
ATOM   1678 N  N     . PHE B 2  186 ? -1.186  19.998  2.305   1.00 21.74 ? 181 PHE H N     1 
ATOM   1679 C  CA    . PHE B 2  186 ? -2.083  20.944  2.980   1.00 22.86 ? 181 PHE H CA    1 
ATOM   1680 C  C     . PHE B 2  186 ? -1.294  21.371  4.272   1.00 20.98 ? 181 PHE H C     1 
ATOM   1681 O  O     . PHE B 2  186 ? -0.330  20.671  4.695   1.00 19.48 ? 181 PHE H O     1 
ATOM   1682 C  CB    . PHE B 2  186 ? -3.497  20.359  3.236   1.00 19.54 ? 181 PHE H CB    1 
ATOM   1683 C  CG    . PHE B 2  186 ? -3.561  19.347  4.365   1.00 22.46 ? 181 PHE H CG    1 
ATOM   1684 C  CD1   . PHE B 2  186 ? -3.553  19.770  5.708   1.00 19.77 ? 181 PHE H CD1   1 
ATOM   1685 C  CD2   . PHE B 2  186 ? -3.651  17.973  4.086   1.00 21.28 ? 181 PHE H CD2   1 
ATOM   1686 C  CE1   . PHE B 2  186 ? -3.635  18.854  6.736   1.00 19.17 ? 181 PHE H CE1   1 
ATOM   1687 C  CE2   . PHE B 2  186 ? -3.723  17.022  5.111   1.00 20.91 ? 181 PHE H CE2   1 
ATOM   1688 C  CZ    . PHE B 2  186 ? -3.716  17.468  6.439   1.00 22.33 ? 181 PHE H CZ    1 
ATOM   1689 N  N     . CYS B 2  187 ? -1.596  22.550  4.835   1.00 21.37 ? 182 CYS H N     1 
ATOM   1690 C  CA    . CYS B 2  187 ? -0.844  22.938  6.042   1.00 22.68 ? 182 CYS H CA    1 
ATOM   1691 C  C     . CYS B 2  187 ? -1.843  23.123  7.179   1.00 22.47 ? 182 CYS H C     1 
ATOM   1692 O  O     . CYS B 2  187 ? -3.035  23.313  6.954   1.00 21.90 ? 182 CYS H O     1 
ATOM   1693 C  CB    . CYS B 2  187 ? 0.048   24.198  5.794   1.00 24.04 ? 182 CYS H CB    1 
ATOM   1694 S  SG    . CYS B 2  187 ? -0.692  25.902  6.021   1.00 26.48 ? 182 CYS H SG    1 
ATOM   1695 N  N     . ALA B 2  188 ? -1.346  23.045  8.406   1.00 22.20 ? 183 ALA H N     1 
ATOM   1696 C  CA    . ALA B 2  188 ? -2.184  23.170  9.577   1.00 23.84 ? 183 ALA H CA    1 
ATOM   1697 C  C     . ALA B 2  188 ? -1.442  23.856  10.714  1.00 23.54 ? 183 ALA H C     1 
ATOM   1698 O  O     . ALA B 2  188 ? -0.210  23.734  10.823  1.00 25.41 ? 183 ALA H O     1 
ATOM   1699 C  CB    . ALA B 2  188 ? -2.659  21.762  10.057  1.00 21.42 ? 183 ALA H CB    1 
ATOM   1700 N  N     . GLY B 2  189 ? -2.216  24.485  11.599  1.00 24.66 ? 184 GLY H N     1 
ATOM   1701 C  CA    . GLY B 2  189 ? -1.647  25.193  12.751  1.00 25.11 ? 184 GLY H CA    1 
ATOM   1702 C  C     . GLY B 2  189 ? -2.368  26.536  13.050  1.00 25.62 ? 184 GLY H C     1 
ATOM   1703 O  O     . GLY B 2  189 ? -3.159  27.012  12.232  1.00 23.31 ? 184 GLY H O     1 
ATOM   1704 N  N     . TYR B 2  190 A -2.103  27.123  14.223  1.00 23.82 ? 184 TYR H N     1 
ATOM   1705 C  CA    . TYR B 2  190 A -2.729  28.381  14.593  1.00 26.93 ? 184 TYR H CA    1 
ATOM   1706 C  C     . TYR B 2  190 A -2.027  29.595  13.990  1.00 27.50 ? 184 TYR H C     1 
ATOM   1707 O  O     . TYR B 2  190 A -0.856  29.533  13.655  1.00 29.29 ? 184 TYR H O     1 
ATOM   1708 C  CB    . TYR B 2  190 A -2.784  28.513  16.110  1.00 28.30 ? 184 TYR H CB    1 
ATOM   1709 C  CG    . TYR B 2  190 A -3.710  27.515  16.777  1.00 26.38 ? 184 TYR H CG    1 
ATOM   1710 C  CD1   . TYR B 2  190 A -5.089  27.704  16.779  1.00 27.75 ? 184 TYR H CD1   1 
ATOM   1711 C  CD2   . TYR B 2  190 A -3.205  26.381  17.376  1.00 28.91 ? 184 TYR H CD2   1 
ATOM   1712 C  CE1   . TYR B 2  190 A -5.947  26.792  17.369  1.00 27.94 ? 184 TYR H CE1   1 
ATOM   1713 C  CE2   . TYR B 2  190 A -4.051  25.437  17.954  1.00 28.05 ? 184 TYR H CE2   1 
ATOM   1714 C  CZ    . TYR B 2  190 A -5.417  25.654  17.950  1.00 29.08 ? 184 TYR H CZ    1 
ATOM   1715 O  OH    . TYR B 2  190 A -6.245  24.722  18.520  1.00 28.69 ? 184 TYR H OH    1 
ATOM   1716 N  N     . LYS B 2  191 ? -2.788  30.655  13.780  1.00 29.77 ? 185 LYS H N     1 
ATOM   1717 C  CA    . LYS B 2  191 ? -2.308  31.918  13.222  1.00 32.94 ? 185 LYS H CA    1 
ATOM   1718 C  C     . LYS B 2  191 ? -1.566  32.721  14.283  1.00 33.71 ? 185 LYS H C     1 
ATOM   1719 O  O     . LYS B 2  191 ? -1.789  32.522  15.461  1.00 32.60 ? 185 LYS H O     1 
ATOM   1720 C  CB    . LYS B 2  191 ? -3.484  32.758  12.736  1.00 31.45 ? 185 LYS H CB    1 
ATOM   1721 C  CG    . LYS B 2  191 ? -3.697  32.640  11.279  1.00 35.00 ? 185 LYS H CG    1 
ATOM   1722 C  CD    . LYS B 2  191 ? -4.873  31.805  10.985  1.00 35.94 ? 185 LYS H CD    1 
ATOM   1723 C  CE    . LYS B 2  191 ? -4.990  31.671  9.501   1.00 36.71 ? 185 LYS H CE    1 
ATOM   1724 N  NZ    . LYS B 2  191 ? -6.358  31.235  9.226   1.00 36.94 ? 185 LYS H NZ    1 
ATOM   1725 N  N     . PRO B 2  192 ? -0.690  33.646  13.862  1.00 37.80 ? 186 PRO H N     1 
ATOM   1726 C  CA    . PRO B 2  192 ? 0.139   34.544  14.678  1.00 41.37 ? 186 PRO H CA    1 
ATOM   1727 C  C     . PRO B 2  192 ? -0.307  34.950  16.079  1.00 45.82 ? 186 PRO H C     1 
ATOM   1728 O  O     . PRO B 2  192 ? 0.514   35.391  16.888  1.00 47.98 ? 186 PRO H O     1 
ATOM   1729 C  CB    . PRO B 2  192 ? 0.352   35.705  13.756  1.00 41.88 ? 186 PRO H CB    1 
ATOM   1730 C  CG    . PRO B 2  192 ? 0.665   34.941  12.452  1.00 40.96 ? 186 PRO H CG    1 
ATOM   1731 C  CD    . PRO B 2  192 ? -0.389  33.837  12.431  1.00 38.15 ? 186 PRO H CD    1 
ATOM   1732 N  N     . ASP B 2  193 A -1.587  34.880  16.391  1.00 50.43 ? 186 ASP H N     1 
ATOM   1733 C  CA    . ASP B 2  193 A -1.979  35.102  17.800  1.00 53.67 ? 186 ASP H CA    1 
ATOM   1734 C  C     . ASP B 2  193 A -3.408  34.614  18.131  1.00 55.08 ? 186 ASP H C     1 
ATOM   1735 O  O     . ASP B 2  193 A -4.112  35.197  18.951  1.00 55.03 ? 186 ASP H O     1 
ATOM   1736 C  CB    . ASP B 2  193 A -1.740  36.551  18.269  1.00 55.15 ? 186 ASP H CB    1 
ATOM   1737 C  CG    . ASP B 2  193 A -2.453  37.558  17.420  1.00 59.70 ? 186 ASP H CG    1 
ATOM   1738 O  OD1   . ASP B 2  193 A -3.027  37.106  16.385  1.00 61.28 ? 186 ASP H OD1   1 
ATOM   1739 O  OD2   . ASP B 2  193 A -2.434  38.784  17.770  1.00 60.57 ? 186 ASP H OD2   1 
ATOM   1740 N  N     . GLU B 2  194 B -3.821  33.522  17.488  1.00 56.26 ? 186 GLU H N     1 
ATOM   1741 C  CA    . GLU B 2  194 B -5.125  32.925  17.779  1.00 58.16 ? 186 GLU H CA    1 
ATOM   1742 C  C     . GLU B 2  194 B -4.989  32.422  19.227  1.00 58.61 ? 186 GLU H C     1 
ATOM   1743 O  O     . GLU B 2  194 B -5.782  31.557  19.669  1.00 60.88 ? 186 GLU H O     1 
ATOM   1744 C  CB    . GLU B 2  194 B -5.416  31.703  16.878  1.00 58.47 ? 186 GLU H CB    1 
ATOM   1745 C  CG    . GLU B 2  194 B -5.631  31.988  15.384  1.00 59.85 ? 186 GLU H CG    1 
ATOM   1746 C  CD    . GLU B 2  194 B -5.938  30.709  14.540  1.00 59.69 ? 186 GLU H CD    1 
ATOM   1747 O  OE1   . GLU B 2  194 B -5.059  30.244  13.795  1.00 59.87 ? 186 GLU H OE1   1 
ATOM   1748 O  OE2   . GLU B 2  194 B -7.065  30.168  14.600  1.00 59.86 ? 186 GLU H OE2   1 
ATOM   1749 N  N     . GLY B 2  195 C -3.978  32.939  19.940  1.00 56.46 ? 186 GLY H N     1 
ATOM   1750 C  CA    . GLY B 2  195 C -3.723  32.520  21.308  1.00 53.98 ? 186 GLY H CA    1 
ATOM   1751 C  C     . GLY B 2  195 C -3.040  31.153  21.509  1.00 52.18 ? 186 GLY H C     1 
ATOM   1752 O  O     . GLY B 2  195 C -2.111  31.030  22.325  1.00 51.40 ? 186 GLY H O     1 
ATOM   1753 N  N     . LYS B 2  196 D -3.467  30.122  20.775  1.00 49.82 ? 186 LYS H N     1 
ATOM   1754 C  CA    . LYS B 2  196 D -2.889  28.785  20.968  1.00 46.58 ? 186 LYS H CA    1 
ATOM   1755 C  C     . LYS B 2  196 D -1.681  28.496  20.090  1.00 44.16 ? 186 LYS H C     1 
ATOM   1756 O  O     . LYS B 2  196 D -1.383  29.259  19.154  1.00 43.90 ? 186 LYS H O     1 
ATOM   1757 C  CB    . LYS B 2  196 D -3.961  27.726  20.733  1.00 48.93 ? 186 LYS H CB    1 
ATOM   1758 C  CG    . LYS B 2  196 D -5.350  28.178  21.148  1.00 51.54 ? 186 LYS H CG    1 
ATOM   1759 C  CD    . LYS B 2  196 D -6.288  27.006  21.412  1.00 53.34 ? 186 LYS H CD    1 
ATOM   1760 C  CE    . LYS B 2  196 D -5.912  26.232  22.677  1.00 55.74 ? 186 LYS H CE    1 
ATOM   1761 N  NZ    . LYS B 2  196 D -6.872  25.059  22.905  1.00 55.86 ? 186 LYS H NZ    1 
ATOM   1762 N  N     . ARG B 2  197 ? -0.964  27.421  20.420  1.00 39.39 ? 187 ARG H N     1 
ATOM   1763 C  CA    . ARG B 2  197 ? 0.199   26.996  19.643  1.00 35.71 ? 187 ARG H CA    1 
ATOM   1764 C  C     . ARG B 2  197 ? 0.168   25.473  19.457  1.00 31.85 ? 187 ARG H C     1 
ATOM   1765 O  O     . ARG B 2  197 ? -0.759  24.797  19.888  1.00 29.62 ? 187 ARG H O     1 
ATOM   1766 C  CB    . ARG B 2  197 ? 1.522   27.343  20.329  1.00 38.44 ? 187 ARG H CB    1 
ATOM   1767 C  CG    . ARG B 2  197 ? 1.419   27.962  21.696  1.00 44.25 ? 187 ARG H CG    1 
ATOM   1768 C  CD    . ARG B 2  197 ? 2.805   28.015  22.372  1.00 46.09 ? 187 ARG H CD    1 
ATOM   1769 N  NE    . ARG B 2  197 ? 3.867   28.168  21.373  1.00 49.61 ? 187 ARG H NE    1 
ATOM   1770 C  CZ    . ARG B 2  197 ? 4.187   29.309  20.771  1.00 50.03 ? 187 ARG H CZ    1 
ATOM   1771 N  NH1   . ARG B 2  197 ? 3.536   30.423  21.073  1.00 51.79 ? 187 ARG H NH1   1 
ATOM   1772 N  NH2   . ARG B 2  197 ? 5.139   29.329  19.844  1.00 51.64 ? 187 ARG H NH2   1 
ATOM   1773 N  N     . GLY B 2  198 ? 1.226   24.934  18.870  1.00 27.50 ? 188 GLY H N     1 
ATOM   1774 C  CA    . GLY B 2  198 ? 1.286   23.505  18.651  1.00 26.57 ? 188 GLY H CA    1 
ATOM   1775 C  C     . GLY B 2  198 ? 1.774   23.196  17.249  1.00 24.77 ? 188 GLY H C     1 
ATOM   1776 O  O     . GLY B 2  198 ? 1.475   23.920  16.285  1.00 24.13 ? 188 GLY H O     1 
ATOM   1777 N  N     . ASP B 2  199 ? 2.486   22.083  17.131  1.00 24.10 ? 189 ASP H N     1 
ATOM   1778 C  CA    . ASP B 2  199 ? 3.040   21.680  15.842  1.00 23.78 ? 189 ASP H CA    1 
ATOM   1779 C  C     . ASP B 2  199 ? 3.652   20.268  15.951  1.00 23.44 ? 189 ASP H C     1 
ATOM   1780 O  O     . ASP B 2  199 ? 3.878   19.731  17.047  1.00 22.43 ? 189 ASP H O     1 
ATOM   1781 C  CB    . ASP B 2  199 ? 4.178   22.677  15.468  1.00 24.05 ? 189 ASP H CB    1 
ATOM   1782 C  CG    . ASP B 2  199 ? 4.543   22.654  13.999  1.00 25.44 ? 189 ASP H CG    1 
ATOM   1783 O  OD1   . ASP B 2  199 ? 3.913   21.904  13.201  1.00 27.50 ? 189 ASP H OD1   1 
ATOM   1784 O  OD2   . ASP B 2  199 ? 5.473   23.399  13.618  1.00 25.03 ? 189 ASP H OD2   1 
ATOM   1785 N  N     . ALA B 2  200 ? 3.919   19.679  14.800  1.00 23.27 ? 190 ALA H N     1 
ATOM   1786 C  CA    . ALA B 2  200 ? 4.647   18.404  14.745  1.00 24.94 ? 190 ALA H CA    1 
ATOM   1787 C  C     . ALA B 2  200 ? 6.091   18.940  14.683  1.00 25.33 ? 190 ALA H C     1 
ATOM   1788 O  O     . ALA B 2  200 ? 6.285   20.175  14.598  1.00 25.32 ? 190 ALA H O     1 
ATOM   1789 C  CB    . ALA B 2  200 ? 4.294   17.635  13.469  1.00 23.68 ? 190 ALA H CB    1 
ATOM   1790 N  N     . CYS B 2  201 ? 7.098   18.055  14.745  1.00 25.43 ? 191 CYS H N     1 
ATOM   1791 C  CA    . CYS B 2  201 ? 8.493   18.499  14.693  1.00 25.41 ? 191 CYS H CA    1 
ATOM   1792 C  C     . CYS B 2  201 ? 9.347   17.356  14.095  1.00 26.17 ? 191 CYS H C     1 
ATOM   1793 O  O     . CYS B 2  201 ? 8.784   16.332  13.723  1.00 24.43 ? 191 CYS H O     1 
ATOM   1794 C  CB    . CYS B 2  201 ? 8.932   18.835  16.140  1.00 27.85 ? 191 CYS H CB    1 
ATOM   1795 S  SG    . CYS B 2  201 ? 10.437  19.894  16.291  1.00 27.47 ? 191 CYS H SG    1 
ATOM   1796 N  N     . GLU B 2  202 ? 10.682  17.498  14.009  1.00 25.72 ? 192 GLU H N     1 
ATOM   1797 C  CA    . GLU B 2  202 ? 11.510  16.415  13.435  1.00 24.95 ? 192 GLU H CA    1 
ATOM   1798 C  C     . GLU B 2  202 ? 11.359  15.110  14.206  1.00 24.47 ? 192 GLU H C     1 
ATOM   1799 O  O     . GLU B 2  202 ? 11.293  15.124  15.439  1.00 23.04 ? 192 GLU H O     1 
ATOM   1800 C  CB    . GLU B 2  202 ? 13.003  16.798  13.378  1.00 27.34 ? 192 GLU H CB    1 
ATOM   1801 C  CG    . GLU B 2  202 ? 13.369  17.747  12.239  1.00 28.96 ? 192 GLU H CG    1 
ATOM   1802 C  CD    . GLU B 2  202 ? 12.929  19.199  12.470  1.00 31.69 ? 192 GLU H CD    1 
ATOM   1803 O  OE1   . GLU B 2  202 ? 12.708  19.911  11.443  1.00 31.62 ? 192 GLU H OE1   1 
ATOM   1804 O  OE2   . GLU B 2  202 ? 12.792  19.627  13.649  1.00 30.47 ? 192 GLU H OE2   1 
ATOM   1805 N  N     . GLY B 2  203 ? 11.308  13.974  13.488  1.00 23.33 ? 193 GLY H N     1 
ATOM   1806 C  CA    . GLY B 2  203 ? 11.093  12.700  14.164  1.00 23.00 ? 193 GLY H CA    1 
ATOM   1807 C  C     . GLY B 2  203 ? 9.591   12.357  14.099  1.00 23.54 ? 193 GLY H C     1 
ATOM   1808 O  O     . GLY B 2  203 ? 9.243   11.206  14.225  1.00 25.42 ? 193 GLY H O     1 
ATOM   1809 N  N     . ASP B 2  204 ? 8.706   13.323  13.883  1.00 20.97 ? 194 ASP H N     1 
ATOM   1810 C  CA    . ASP B 2  204 ? 7.279   12.991  13.764  1.00 24.21 ? 194 ASP H CA    1 
ATOM   1811 C  C     . ASP B 2  204 ? 6.864   12.635  12.329  1.00 23.84 ? 194 ASP H C     1 
ATOM   1812 O  O     . ASP B 2  204 ? 5.709   12.208  12.106  1.00 24.52 ? 194 ASP H O     1 
ATOM   1813 C  CB    . ASP B 2  204 ? 6.361   14.130  14.232  1.00 23.62 ? 194 ASP H CB    1 
ATOM   1814 C  CG    . ASP B 2  204 ? 6.447   14.383  15.741  1.00 26.12 ? 194 ASP H CG    1 
ATOM   1815 O  OD1   . ASP B 2  204 ? 6.525   13.418  16.532  1.00 25.85 ? 194 ASP H OD1   1 
ATOM   1816 O  OD2   . ASP B 2  204 ? 6.412   15.558  16.134  1.00 22.29 ? 194 ASP H OD2   1 
ATOM   1817 N  N     . SER B 2  205 ? 7.743   12.849  11.347  1.00 21.13 ? 195 SER H N     1 
ATOM   1818 C  CA    . SER B 2  205 ? 7.351   12.478  9.970   1.00 23.50 ? 195 SER H CA    1 
ATOM   1819 C  C     . SER B 2  205 ? 6.791   11.008  9.869   1.00 22.08 ? 195 SER H C     1 
ATOM   1820 O  O     . SER B 2  205 ? 7.298   10.075  10.523  1.00 20.28 ? 195 SER H O     1 
ATOM   1821 C  CB    . SER B 2  205 ? 8.559   12.605  9.014   1.00 21.41 ? 195 SER H CB    1 
ATOM   1822 O  OG    . SER B 2  205 ? 8.996   13.970  8.920   1.00 21.19 ? 195 SER H OG    1 
ATOM   1823 N  N     . GLY B 2  206 ? 5.762   10.827  9.051   1.00 24.25 ? 196 GLY H N     1 
ATOM   1824 C  CA    . GLY B 2  206 ? 5.175   9.504   8.845   1.00 23.04 ? 196 GLY H CA    1 
ATOM   1825 C  C     . GLY B 2  206 ? 3.941   9.314   9.692   1.00 26.03 ? 196 GLY H C     1 
ATOM   1826 O  O     . GLY B 2  206 ? 3.016   8.522   9.360   1.00 25.93 ? 196 GLY H O     1 
ATOM   1827 N  N     . GLY B 2  207 ? 3.883   10.089  10.774  1.00 26.38 ? 197 GLY H N     1 
ATOM   1828 C  CA    . GLY B 2  207 ? 2.742   9.959   11.645  1.00 24.60 ? 197 GLY H CA    1 
ATOM   1829 C  C     . GLY B 2  207 ? 1.499   10.502  10.972  1.00 21.91 ? 197 GLY H C     1 
ATOM   1830 O  O     . GLY B 2  207 ? 1.555   11.273  10.012  1.00 20.64 ? 197 GLY H O     1 
ATOM   1831 N  N     . PRO B 2  208 ? 0.329   10.083  11.480  1.00 20.61 ? 198 PRO H N     1 
ATOM   1832 C  CA    . PRO B 2  208 ? -0.968  10.531  10.915  1.00 18.00 ? 198 PRO H CA    1 
ATOM   1833 C  C     . PRO B 2  208 ? -1.562  11.819  11.444  1.00 18.85 ? 198 PRO H C     1 
ATOM   1834 O  O     . PRO B 2  208 ? -1.404  12.148  12.628  1.00 20.30 ? 198 PRO H O     1 
ATOM   1835 C  CB    . PRO B 2  208 ? -1.904  9.372   11.236  1.00 17.51 ? 198 PRO H CB    1 
ATOM   1836 C  CG    . PRO B 2  208 ? -1.390  8.960   12.686  1.00 17.24 ? 198 PRO H CG    1 
ATOM   1837 C  CD    . PRO B 2  208 ? 0.166   9.114   12.584  1.00 14.86 ? 198 PRO H CD    1 
ATOM   1838 N  N     . PHE B 2  209 ? -2.223  12.526  10.530  1.00 19.15 ? 199 PHE H N     1 
ATOM   1839 C  CA    . PHE B 2  209 ? -3.018  13.711  10.792  1.00 20.66 ? 199 PHE H CA    1 
ATOM   1840 C  C     . PHE B 2  209 ? -4.428  13.122  10.574  1.00 19.55 ? 199 PHE H C     1 
ATOM   1841 O  O     . PHE B 2  209 ? -4.845  12.850  9.440   1.00 17.09 ? 199 PHE H O     1 
ATOM   1842 C  CB    . PHE B 2  209 ? -2.759  14.867  9.773   1.00 21.39 ? 199 PHE H CB    1 
ATOM   1843 C  CG    . PHE B 2  209 ? -3.694  16.054  9.939   1.00 22.87 ? 199 PHE H CG    1 
ATOM   1844 C  CD1   . PHE B 2  209 ? -5.029  15.987  9.531   1.00 23.03 ? 199 PHE H CD1   1 
ATOM   1845 C  CD2   . PHE B 2  209 ? -3.221  17.260  10.520  1.00 23.80 ? 199 PHE H CD2   1 
ATOM   1846 C  CE1   . PHE B 2  209 ? -5.908  17.117  9.682   1.00 21.94 ? 199 PHE H CE1   1 
ATOM   1847 C  CE2   . PHE B 2  209 ? -4.056  18.358  10.687  1.00 23.21 ? 199 PHE H CE2   1 
ATOM   1848 C  CZ    . PHE B 2  209 ? -5.417  18.288  10.258  1.00 23.15 ? 199 PHE H CZ    1 
ATOM   1849 N  N     . VAL B 2  210 ? -5.129  12.894  11.669  1.00 19.17 ? 200 VAL H N     1 
ATOM   1850 C  CA    . VAL B 2  210 ? -6.476  12.305  11.571  1.00 21.14 ? 200 VAL H CA    1 
ATOM   1851 C  C     . VAL B 2  210 ? -7.616  13.247  11.949  1.00 21.45 ? 200 VAL H C     1 
ATOM   1852 O  O     . VAL B 2  210 ? -7.389  14.237  12.664  1.00 20.91 ? 200 VAL H O     1 
ATOM   1853 C  CB    . VAL B 2  210 ? -6.610  11.047  12.492  1.00 22.29 ? 200 VAL H CB    1 
ATOM   1854 C  CG1   . VAL B 2  210 ? -5.658  9.917   11.997  1.00 22.86 ? 200 VAL H CG1   1 
ATOM   1855 C  CG2   . VAL B 2  210 ? -6.320  11.442  14.008  1.00 21.52 ? 200 VAL H CG2   1 
ATOM   1856 N  N     . MET B 2  211 ? -8.826  12.886  11.516  1.00 20.80 ? 201 MET H N     1 
ATOM   1857 C  CA    . MET B 2  211 ? -10.057 13.660  11.765  1.00 22.28 ? 201 MET H CA    1 
ATOM   1858 C  C     . MET B 2  211 ? -11.192 12.692  12.113  1.00 23.94 ? 201 MET H C     1 
ATOM   1859 O  O     . MET B 2  211 ? -11.326 11.595  11.505  1.00 24.77 ? 201 MET H O     1 
ATOM   1860 C  CB    . MET B 2  211 ? -10.483 14.490  10.521  1.00 21.42 ? 201 MET H CB    1 
ATOM   1861 C  CG    . MET B 2  211 ? -9.486  15.555  10.151  1.00 23.24 ? 201 MET H CG    1 
ATOM   1862 S  SD    . MET B 2  211 ? -9.856  16.648  8.804   1.00 25.62 ? 201 MET H SD    1 
ATOM   1863 C  CE    . MET B 2  211 ? -10.944 17.880  9.695   1.00 26.75 ? 201 MET H CE    1 
ATOM   1864 N  N     . LYS B 2  212 ? -12.037 13.066  13.063  1.00 23.95 ? 202 LYS H N     1 
ATOM   1865 C  CA    . LYS B 2  212 ? -13.099 12.133  13.393  1.00 25.88 ? 202 LYS H CA    1 
ATOM   1866 C  C     . LYS B 2  212 ? -14.316 12.573  12.573  1.00 27.56 ? 202 LYS H C     1 
ATOM   1867 O  O     . LYS B 2  212 ? -14.670 13.785  12.550  1.00 28.12 ? 202 LYS H O     1 
ATOM   1868 C  CB    . LYS B 2  212 ? -13.361 12.145  14.905  1.00 27.71 ? 202 LYS H CB    1 
ATOM   1869 C  CG    . LYS B 2  212 ? -14.561 11.297  15.306  1.00 30.12 ? 202 LYS H CG    1 
ATOM   1870 C  CD    . LYS B 2  212 ? -14.459 10.845  16.753  1.00 32.26 ? 202 LYS H CD    1 
ATOM   1871 C  CE    . LYS B 2  212 ? -15.728 10.058  17.141  1.00 31.07 ? 202 LYS H CE    1 
ATOM   1872 N  NZ    . LYS B 2  212 ? -15.618 9.391   18.476  1.00 30.65 ? 202 LYS H NZ    1 
ATOM   1873 N  N     . SER B 2  213 ? -14.929 11.628  11.863  1.00 27.86 ? 203 SER H N     1 
ATOM   1874 C  CA    . SER B 2  213 ? -16.081 11.980  11.024  1.00 29.58 ? 203 SER H CA    1 
ATOM   1875 C  C     . SER B 2  213 ? -17.331 12.200  11.830  1.00 29.58 ? 203 SER H C     1 
ATOM   1876 O  O     . SER B 2  213 ? -17.730 11.328  12.568  1.00 29.10 ? 203 SER H O     1 
ATOM   1877 C  CB    . SER B 2  213 ? -16.417 10.886  10.000  1.00 29.18 ? 203 SER H CB    1 
ATOM   1878 O  OG    . SER B 2  213 ? -17.684 11.207  9.412   1.00 29.56 ? 203 SER H OG    1 
ATOM   1879 N  N     . PRO B 2  214 ? -17.992 13.343  11.650  1.00 30.40 ? 204 PRO H N     1 
ATOM   1880 C  CA    . PRO B 2  214 ? -19.215 13.555  12.434  1.00 31.94 ? 204 PRO H CA    1 
ATOM   1881 C  C     . PRO B 2  214 ? -20.411 12.810  11.819  1.00 33.70 ? 204 PRO H C     1 
ATOM   1882 O  O     . PRO B 2  214 ? -21.500 12.901  12.346  1.00 34.73 ? 204 PRO H O     1 
ATOM   1883 C  CB    . PRO B 2  214 ? -19.387 15.072  12.392  1.00 30.10 ? 204 PRO H CB    1 
ATOM   1884 C  CG    . PRO B 2  214 ? -18.991 15.376  10.954  1.00 30.56 ? 204 PRO H CG    1 
ATOM   1885 C  CD    . PRO B 2  214 ? -17.737 14.484  10.746  1.00 30.83 ? 204 PRO H CD    1 
ATOM   1886 N  N     . PHE B 2  215 A -20.211 12.045  10.743  1.00 33.87 ? 204 PHE H N     1 
ATOM   1887 C  CA    . PHE B 2  215 A -21.348 11.344  10.130  1.00 34.34 ? 204 PHE H CA    1 
ATOM   1888 C  C     . PHE B 2  215 A -21.417 9.866   10.469  1.00 34.19 ? 204 PHE H C     1 
ATOM   1889 O  O     . PHE B 2  215 A -22.498 9.303   10.478  1.00 35.67 ? 204 PHE H O     1 
ATOM   1890 C  CB    . PHE B 2  215 A -21.316 11.512  8.611   1.00 34.68 ? 204 PHE H CB    1 
ATOM   1891 C  CG    . PHE B 2  215 A -21.144 12.926  8.187   1.00 37.20 ? 204 PHE H CG    1 
ATOM   1892 C  CD1   . PHE B 2  215 A -22.048 13.905  8.627   1.00 36.71 ? 204 PHE H CD1   1 
ATOM   1893 C  CD2   . PHE B 2  215 A -20.080 13.298  7.368   1.00 37.19 ? 204 PHE H CD2   1 
ATOM   1894 C  CE1   . PHE B 2  215 A -21.896 15.228  8.267   1.00 37.49 ? 204 PHE H CE1   1 
ATOM   1895 C  CE2   . PHE B 2  215 A -19.918 14.640  6.993   1.00 38.92 ? 204 PHE H CE2   1 
ATOM   1896 C  CZ    . PHE B 2  215 A -20.834 15.610  7.452   1.00 38.41 ? 204 PHE H CZ    1 
ATOM   1897 N  N     . ASN B 2  216 B -20.273 9.221   10.700  1.00 31.92 ? 204 ASN H N     1 
ATOM   1898 C  CA    . ASN B 2  216 B -20.270 7.798   11.072  1.00 30.76 ? 204 ASN H CA    1 
ATOM   1899 C  C     . ASN B 2  216 B -19.348 7.501   12.312  1.00 29.81 ? 204 ASN H C     1 
ATOM   1900 O  O     . ASN B 2  216 B -19.123 6.349   12.666  1.00 29.21 ? 204 ASN H O     1 
ATOM   1901 C  CB    . ASN B 2  216 B -19.936 6.907   9.858   1.00 27.53 ? 204 ASN H CB    1 
ATOM   1902 C  CG    . ASN B 2  216 B -18.498 7.147   9.292   1.00 29.65 ? 204 ASN H CG    1 
ATOM   1903 O  OD1   . ASN B 2  216 B -18.180 6.619   8.242   1.00 30.71 ? 204 ASN H OD1   1 
ATOM   1904 N  ND2   . ASN B 2  216 B -17.662 7.932   9.982   1.00 23.54 ? 204 ASN H ND2   1 
ATOM   1905 N  N     . ASN B 2  217 ? -18.830 8.563   12.952  1.00 29.01 ? 205 ASN H N     1 
ATOM   1906 C  CA    . ASN B 2  217 ? -18.023 8.429   14.171  1.00 29.28 ? 205 ASN H CA    1 
ATOM   1907 C  C     . ASN B 2  217 ? -16.659 7.709   14.014  1.00 27.68 ? 205 ASN H C     1 
ATOM   1908 O  O     . ASN B 2  217 ? -16.045 7.298   15.023  1.00 26.97 ? 205 ASN H O     1 
ATOM   1909 C  CB    . ASN B 2  217 ? -18.846 7.705   15.261  1.00 31.65 ? 205 ASN H CB    1 
ATOM   1910 C  CG    . ASN B 2  217 ? -18.488 8.173   16.687  1.00 36.78 ? 205 ASN H CG    1 
ATOM   1911 O  OD1   . ASN B 2  217 ? -18.517 7.398   17.667  1.00 40.77 ? 205 ASN H OD1   1 
ATOM   1912 N  ND2   . ASN B 2  217 ? -18.189 9.444   16.816  1.00 39.02 ? 205 ASN H ND2   1 
ATOM   1913 N  N     . ARG B 2  218 ? -16.192 7.557   12.776  1.00 25.74 ? 206 ARG H N     1 
ATOM   1914 C  CA    . ARG B 2  218 ? -14.899 6.886   12.542  1.00 25.04 ? 206 ARG H CA    1 
ATOM   1915 C  C     . ARG B 2  218 ? -13.794 7.893   12.301  1.00 24.44 ? 206 ARG H C     1 
ATOM   1916 O  O     . ARG B 2  218 ? -14.026 9.039   11.864  1.00 23.28 ? 206 ARG H O     1 
ATOM   1917 C  CB    . ARG B 2  218 ? -14.965 5.933   11.334  1.00 26.15 ? 206 ARG H CB    1 
ATOM   1918 C  CG    . ARG B 2  218 ? -15.935 4.804   11.538  1.00 26.66 ? 206 ARG H CG    1 
ATOM   1919 C  CD    . ARG B 2  218 ? -16.054 3.918   10.324  1.00 31.72 ? 206 ARG H CD    1 
ATOM   1920 N  NE    . ARG B 2  218 ? -17.109 2.894   10.502  1.00 32.86 ? 206 ARG H NE    1 
ATOM   1921 C  CZ    . ARG B 2  218 ? -16.899 1.628   10.876  1.00 36.73 ? 206 ARG H CZ    1 
ATOM   1922 N  NH1   . ARG B 2  218 ? -15.679 1.191   11.114  1.00 37.63 ? 206 ARG H NH1   1 
ATOM   1923 N  NH2   . ARG B 2  218 ? -17.915 0.779   11.022  1.00 38.30 ? 206 ARG H NH2   1 
ATOM   1924 N  N     . TRP B 2  219 ? -12.586 7.451   12.624  1.00 23.43 ? 207 TRP H N     1 
ATOM   1925 C  CA    . TRP B 2  219 ? -11.386 8.248   12.418  1.00 23.47 ? 207 TRP H CA    1 
ATOM   1926 C  C     . TRP B 2  219 ? -10.787 7.980   11.031  1.00 22.30 ? 207 TRP H C     1 
ATOM   1927 O  O     . TRP B 2  219 ? -10.672 6.822   10.588  1.00 23.06 ? 207 TRP H O     1 
ATOM   1928 C  CB    . TRP B 2  219 ? -10.388 7.948   13.541  1.00 22.73 ? 207 TRP H CB    1 
ATOM   1929 C  CG    . TRP B 2  219 ? -10.857 8.394   14.882  1.00 21.04 ? 207 TRP H CG    1 
ATOM   1930 C  CD1   . TRP B 2  219 ? -11.523 7.655   15.811  1.00 21.77 ? 207 TRP H CD1   1 
ATOM   1931 C  CD2   . TRP B 2  219 ? -10.601 9.657   15.490  1.00 22.03 ? 207 TRP H CD2   1 
ATOM   1932 N  NE1   . TRP B 2  219 ? -11.683 8.374   16.979  1.00 23.43 ? 207 TRP H NE1   1 
ATOM   1933 C  CE2   . TRP B 2  219 ? -11.130 9.610   16.801  1.00 21.17 ? 207 TRP H CE2   1 
ATOM   1934 C  CE3   . TRP B 2  219 ? -9.977  10.831  15.057  1.00 21.51 ? 207 TRP H CE3   1 
ATOM   1935 C  CZ2   . TRP B 2  219 ? -11.056 10.686  17.673  1.00 22.29 ? 207 TRP H CZ2   1 
ATOM   1936 C  CZ3   . TRP B 2  219 ? -9.906  11.913  15.948  1.00 22.31 ? 207 TRP H CZ3   1 
ATOM   1937 C  CH2   . TRP B 2  219 ? -10.444 11.817  17.231  1.00 19.14 ? 207 TRP H CH2   1 
ATOM   1938 N  N     . TYR B 2  220 ? -10.454 9.060   10.344  1.00 20.85 ? 208 TYR H N     1 
ATOM   1939 C  CA    . TYR B 2  220 ? -9.911  8.993   9.015   1.00 21.03 ? 208 TYR H CA    1 
ATOM   1940 C  C     . TYR B 2  220 ? -8.567  9.708   8.924   1.00 22.27 ? 208 TYR H C     1 
ATOM   1941 O  O     . TYR B 2  220 ? -8.408  10.861  9.433   1.00 20.15 ? 208 TYR H O     1 
ATOM   1942 C  CB    . TYR B 2  220 ? -10.848 9.678   8.018   1.00 21.55 ? 208 TYR H CB    1 
ATOM   1943 C  CG    . TYR B 2  220 ? -12.119 8.926   7.700   1.00 26.64 ? 208 TYR H CG    1 
ATOM   1944 C  CD1   . TYR B 2  220 ? -13.262 9.045   8.542   1.00 22.98 ? 208 TYR H CD1   1 
ATOM   1945 C  CD2   . TYR B 2  220 ? -12.195 8.113   6.530   1.00 26.51 ? 208 TYR H CD2   1 
ATOM   1946 C  CE1   . TYR B 2  220 ? -14.439 8.384   8.224   1.00 27.58 ? 208 TYR H CE1   1 
ATOM   1947 C  CE2   . TYR B 2  220 ? -13.371 7.431   6.194   1.00 27.40 ? 208 TYR H CE2   1 
ATOM   1948 C  CZ    . TYR B 2  220 ? -14.485 7.575   7.051   1.00 28.37 ? 208 TYR H CZ    1 
ATOM   1949 O  OH    . TYR B 2  220 ? -15.610 6.909   6.739   1.00 28.53 ? 208 TYR H OH    1 
ATOM   1950 N  N     . GLN B 2  221 ? -7.622  9.078   8.226   1.00 20.75 ? 209 GLN H N     1 
ATOM   1951 C  CA    . GLN B 2  221 ? -6.337  9.725   8.041   1.00 21.06 ? 209 GLN H CA    1 
ATOM   1952 C  C     . GLN B 2  221 ? -6.380  10.632  6.805   1.00 22.16 ? 209 GLN H C     1 
ATOM   1953 O  O     . GLN B 2  221 ? -6.441  10.152  5.672   1.00 21.50 ? 209 GLN H O     1 
ATOM   1954 C  CB    . GLN B 2  221 ? -5.177  8.703   7.932   1.00 21.42 ? 209 GLN H CB    1 
ATOM   1955 C  CG    . GLN B 2  221 ? -3.809  9.451   7.819   1.00 20.02 ? 209 GLN H CG    1 
ATOM   1956 C  CD    . GLN B 2  221 ? -2.593  8.530   7.864   1.00 21.39 ? 209 GLN H CD    1 
ATOM   1957 O  OE1   . GLN B 2  221 ? -2.692  7.362   8.276   1.00 22.31 ? 209 GLN H OE1   1 
ATOM   1958 N  NE2   . GLN B 2  221 ? -1.444  9.050   7.447   1.00 17.27 ? 209 GLN H NE2   1 
ATOM   1959 N  N     . MET B 2  222 ? -6.376  11.959  7.035   1.00 21.28 ? 210 MET H N     1 
ATOM   1960 C  CA    . MET B 2  222 ? -6.405  12.930  5.970   1.00 20.10 ? 210 MET H CA    1 
ATOM   1961 C  C     . MET B 2  222 ? -4.978  13.321  5.542   1.00 19.31 ? 210 MET H C     1 
ATOM   1962 O  O     . MET B 2  222 ? -4.749  13.753  4.421   1.00 19.65 ? 210 MET H O     1 
ATOM   1963 C  CB    . MET B 2  222 ? -7.163  14.171  6.446   1.00 23.50 ? 210 MET H CB    1 
ATOM   1964 C  CG    . MET B 2  222 ? -8.534  13.813  7.083   1.00 24.58 ? 210 MET H CG    1 
ATOM   1965 S  SD    . MET B 2  222 ? -9.485  12.756  5.857   1.00 27.75 ? 210 MET H SD    1 
ATOM   1966 C  CE    . MET B 2  222 ? -9.691  13.936  4.423   1.00 25.76 ? 210 MET H CE    1 
ATOM   1967 N  N     . GLY B 2  223 ? -4.020  13.202  6.452   1.00 19.39 ? 211 GLY H N     1 
ATOM   1968 C  CA    . GLY B 2  223 ? -2.664  13.584  6.105   1.00 18.63 ? 211 GLY H CA    1 
ATOM   1969 C  C     . GLY B 2  223 ? -1.542  12.761  6.763   1.00 17.93 ? 211 GLY H C     1 
ATOM   1970 O  O     . GLY B 2  223 ? -1.783  11.982  7.678   1.00 16.95 ? 211 GLY H O     1 
ATOM   1971 N  N     . ILE B 2  224 ? -0.326  12.961  6.246   1.00 17.50 ? 212 ILE H N     1 
ATOM   1972 C  CA    . ILE B 2  224 ? 0.902   12.381  6.787   1.00 17.17 ? 212 ILE H CA    1 
ATOM   1973 C  C     . ILE B 2  224 ? 1.895   13.550  7.147   1.00 17.65 ? 212 ILE H C     1 
ATOM   1974 O  O     . ILE B 2  224 ? 2.180   14.418  6.308   1.00 18.04 ? 212 ILE H O     1 
ATOM   1975 C  CB    . ILE B 2  224 ? 1.618   11.498  5.730   1.00 17.83 ? 212 ILE H CB    1 
ATOM   1976 C  CG1   . ILE B 2  224 ? 0.699   10.340  5.283   1.00 17.11 ? 212 ILE H CG1   1 
ATOM   1977 C  CG2   . ILE B 2  224 ? 2.955   10.950  6.317   1.00 16.50 ? 212 ILE H CG2   1 
ATOM   1978 C  CD1   . ILE B 2  224 ? 1.229   9.672   3.849   1.00 18.77 ? 212 ILE H CD1   1 
ATOM   1979 N  N     . VAL B 2  225 ? 2.427   13.567  8.362   1.00 17.79 ? 213 VAL H N     1 
ATOM   1980 C  CA    . VAL B 2  225 ? 3.399   14.638  8.774   1.00 17.88 ? 213 VAL H CA    1 
ATOM   1981 C  C     . VAL B 2  225 ? 4.556   14.624  7.750   1.00 19.24 ? 213 VAL H C     1 
ATOM   1982 O  O     . VAL B 2  225 ? 5.225   13.627  7.580   1.00 17.35 ? 213 VAL H O     1 
ATOM   1983 C  CB    . VAL B 2  225 ? 3.991   14.347  10.172  1.00 18.30 ? 213 VAL H CB    1 
ATOM   1984 C  CG1   . VAL B 2  225 ? 5.135   15.366  10.487  1.00 16.70 ? 213 VAL H CG1   1 
ATOM   1985 C  CG2   . VAL B 2  225 ? 2.870   14.366  11.241  1.00 15.15 ? 213 VAL H CG2   1 
ATOM   1986 N  N     . SER B 2  226 ? 4.798   15.748  7.104   1.00 19.19 ? 214 SER H N     1 
ATOM   1987 C  CA    . SER B 2  226 ? 5.763   15.775  6.042   1.00 21.06 ? 214 SER H CA    1 
ATOM   1988 C  C     . SER B 2  226 ? 6.941   16.723  6.276   1.00 20.58 ? 214 SER H C     1 
ATOM   1989 O  O     . SER B 2  226 ? 8.101   16.287  6.228   1.00 20.63 ? 214 SER H O     1 
ATOM   1990 C  CB    . SER B 2  226 ? 5.038   16.101  4.688   1.00 19.15 ? 214 SER H CB    1 
ATOM   1991 O  OG    . SER B 2  226 ? 5.927   16.128  3.561   1.00 21.55 ? 214 SER H OG    1 
ATOM   1992 N  N     . TRP B 2  227 ? 6.666   17.995  6.504   1.00 20.55 ? 215 TRP H N     1 
ATOM   1993 C  CA    . TRP B 2  227 ? 7.780   18.953  6.719   1.00 20.78 ? 215 TRP H CA    1 
ATOM   1994 C  C     . TRP B 2  227 ? 7.361   20.281  7.374   1.00 20.80 ? 215 TRP H C     1 
ATOM   1995 O  O     . TRP B 2  227 ? 6.182   20.545  7.574   1.00 18.49 ? 215 TRP H O     1 
ATOM   1996 C  CB    . TRP B 2  227 ? 8.391   19.316  5.366   1.00 20.84 ? 215 TRP H CB    1 
ATOM   1997 C  CG    . TRP B 2  227 ? 7.414   19.952  4.366   1.00 21.98 ? 215 TRP H CG    1 
ATOM   1998 C  CD1   . TRP B 2  227 ? 6.611   19.283  3.474   1.00 23.99 ? 215 TRP H CD1   1 
ATOM   1999 C  CD2   . TRP B 2  227 ? 7.302   21.346  4.022   1.00 23.83 ? 215 TRP H CD2   1 
ATOM   2000 N  NE1   . TRP B 2  227 ? 6.041   20.162  2.575   1.00 24.37 ? 215 TRP H NE1   1 
ATOM   2001 C  CE2   . TRP B 2  227 ? 6.435   21.435  2.892   1.00 24.85 ? 215 TRP H CE2   1 
ATOM   2002 C  CE3   . TRP B 2  227 ? 7.859   22.536  4.556   1.00 23.44 ? 215 TRP H CE3   1 
ATOM   2003 C  CZ2   . TRP B 2  227 ? 6.112   22.663  2.275   1.00 24.91 ? 215 TRP H CZ2   1 
ATOM   2004 C  CZ3   . TRP B 2  227 ? 7.558   23.757  3.943   1.00 24.45 ? 215 TRP H CZ3   1 
ATOM   2005 C  CH2   . TRP B 2  227 ? 6.689   23.814  2.805   1.00 24.23 ? 215 TRP H CH2   1 
ATOM   2006 N  N     . GLY B 2  228 ? 8.358   21.133  7.635   1.00 22.31 ? 216 GLY H N     1 
ATOM   2007 C  CA    . GLY B 2  228 ? 8.091   22.459  8.196   1.00 23.75 ? 216 GLY H CA    1 
ATOM   2008 C  C     . GLY B 2  228 ? 9.408   23.236  8.181   1.00 25.45 ? 216 GLY H C     1 
ATOM   2009 O  O     . GLY B 2  228 ? 10.401  22.751  7.659   1.00 25.64 ? 216 GLY H O     1 
ATOM   2010 N  N     . GLU B 2  229 ? 9.416   24.437  8.747   1.00 25.86 ? 217 GLU H N     1 
ATOM   2011 C  CA    . GLU B 2  229 ? 10.638  25.242  8.855   1.00 26.25 ? 217 GLU H CA    1 
ATOM   2012 C  C     . GLU B 2  229 ? 10.713  25.627  10.366  1.00 24.57 ? 217 GLU H C     1 
ATOM   2013 O  O     . GLU B 2  229 ? 9.973   26.485  10.869  1.00 25.03 ? 217 GLU H O     1 
ATOM   2014 C  CB    . GLU B 2  229 ? 10.519  26.440  7.914   1.00 26.90 ? 217 GLU H CB    1 
ATOM   2015 C  CG    . GLU B 2  229 ? 10.423  25.952  6.428   1.00 31.22 ? 217 GLU H CG    1 
ATOM   2016 C  CD    . GLU B 2  229 ? 10.209  27.067  5.430   1.00 31.03 ? 217 GLU H CD    1 
ATOM   2017 O  OE1   . GLU B 2  229 ? 9.091   27.648  5.387   1.00 33.00 ? 217 GLU H OE1   1 
ATOM   2018 O  OE2   . GLU B 2  229 ? 11.182  27.366  4.690   1.00 33.12 ? 217 GLU H OE2   1 
ATOM   2019 N  N     . GLY B 2  230 ? 11.584  24.948  11.085  1.00 23.58 ? 219 GLY H N     1 
ATOM   2020 C  CA    . GLY B 2  230 ? 11.662  25.147  12.534  1.00 23.83 ? 219 GLY H CA    1 
ATOM   2021 C  C     . GLY B 2  230 ? 10.444  24.381  13.046  1.00 26.17 ? 219 GLY H C     1 
ATOM   2022 O  O     . GLY B 2  230 ? 9.800   23.637  12.246  1.00 24.36 ? 219 GLY H O     1 
ATOM   2023 N  N     . CYS B 2  231 ? 10.113  24.493  14.326  1.00 25.50 ? 220 CYS H N     1 
ATOM   2024 C  CA    . CYS B 2  231 ? 8.886   23.802  14.807  1.00 26.91 ? 220 CYS H CA    1 
ATOM   2025 C  C     . CYS B 2  231 ? 8.130   24.815  15.666  1.00 26.25 ? 220 CYS H C     1 
ATOM   2026 O  O     . CYS B 2  231 ? 8.769   25.540  16.454  1.00 27.67 ? 220 CYS H O     1 
ATOM   2027 C  CB    . CYS B 2  231 ? 9.201   22.555  15.662  1.00 26.55 ? 220 CYS H CB    1 
ATOM   2028 S  SG    . CYS B 2  231 ? 10.239  21.310  14.839  1.00 27.76 ? 220 CYS H SG    1 
ATOM   2029 N  N     . ASP B 2  232 A 6.821   24.895  15.473  1.00 23.77 ? 221 ASP H N     1 
ATOM   2030 C  CA    . ASP B 2  232 A 5.957   25.800  16.230  1.00 25.48 ? 221 ASP H CA    1 
ATOM   2031 C  C     . ASP B 2  232 A 6.349   27.309  16.161  1.00 25.23 ? 221 ASP H C     1 
ATOM   2032 O  O     . ASP B 2  232 A 6.123   28.022  17.130  1.00 24.19 ? 221 ASP H O     1 
ATOM   2033 C  CB    . ASP B 2  232 A 5.921   25.370  17.707  1.00 26.74 ? 221 ASP H CB    1 
ATOM   2034 C  CG    . ASP B 2  232 A 4.713   25.934  18.469  1.00 30.81 ? 221 ASP H CG    1 
ATOM   2035 O  OD1   . ASP B 2  232 A 3.615   26.001  17.861  1.00 31.33 ? 221 ASP H OD1   1 
ATOM   2036 O  OD2   . ASP B 2  232 A 4.849   26.286  19.696  1.00 29.42 ? 221 ASP H OD2   1 
ATOM   2037 N  N     . ARG B 2  233 ? 6.867   27.792  15.030  1.00 24.69 ? 221 ARG H N     1 
ATOM   2038 C  CA    . ARG B 2  233 ? 7.203   29.232  14.908  1.00 26.69 ? 221 ARG H CA    1 
ATOM   2039 C  C     . ARG B 2  233 ? 6.002   30.116  14.588  1.00 27.03 ? 221 ARG H C     1 
ATOM   2040 O  O     . ARG B 2  233 ? 5.074   29.712  13.872  1.00 25.43 ? 221 ARG H O     1 
ATOM   2041 C  CB    . ARG B 2  233 ? 8.272   29.481  13.833  1.00 26.48 ? 221 ARG H CB    1 
ATOM   2042 C  CG    . ARG B 2  233 ? 9.641   28.970  14.309  1.00 28.56 ? 221 ARG H CG    1 
ATOM   2043 C  CD    . ARG B 2  233 ? 10.741  29.425  13.425  1.00 29.55 ? 221 ARG H CD    1 
ATOM   2044 N  NE    . ARG B 2  233 ? 12.033  28.903  13.890  1.00 29.93 ? 221 ARG H NE    1 
ATOM   2045 C  CZ    . ARG B 2  233 ? 13.209  29.360  13.471  1.00 28.20 ? 221 ARG H CZ    1 
ATOM   2046 N  NH1   . ARG B 2  233 ? 14.341  28.815  13.938  1.00 27.71 ? 221 ARG H NH1   1 
ATOM   2047 N  NH2   . ARG B 2  233 ? 13.255  30.367  12.593  1.00 27.52 ? 221 ARG H NH2   1 
ATOM   2048 N  N     . ASP B 2  234 ? 6.035   31.327  15.129  1.00 26.85 ? 222 ASP H N     1 
ATOM   2049 C  CA    . ASP B 2  234 ? 4.984   32.329  14.910  1.00 27.50 ? 222 ASP H CA    1 
ATOM   2050 C  C     . ASP B 2  234 ? 4.831   32.651  13.421  1.00 27.62 ? 222 ASP H C     1 
ATOM   2051 O  O     . ASP B 2  234 ? 5.773   33.116  12.809  1.00 28.55 ? 222 ASP H O     1 
ATOM   2052 C  CB    . ASP B 2  234 ? 5.348   33.605  15.667  1.00 29.40 ? 222 ASP H CB    1 
ATOM   2053 C  CG    . ASP B 2  234 ? 4.336   34.739  15.434  1.00 31.38 ? 222 ASP H CG    1 
ATOM   2054 O  OD1   . ASP B 2  234 ? 4.755   35.906  15.238  1.00 34.50 ? 222 ASP H OD1   1 
ATOM   2055 O  OD2   . ASP B 2  234 ? 3.132   34.473  15.465  1.00 30.79 ? 222 ASP H OD2   1 
ATOM   2056 N  N     . GLY B 2  235 ? 3.645   32.425  12.842  1.00 26.95 ? 223 GLY H N     1 
ATOM   2057 C  CA    . GLY B 2  235 ? 3.467   32.690  11.425  1.00 26.02 ? 223 GLY H CA    1 
ATOM   2058 C  C     . GLY B 2  235 ? 3.958   31.580  10.485  1.00 27.84 ? 223 GLY H C     1 
ATOM   2059 O  O     . GLY B 2  235 ? 3.956   31.774  9.245   1.00 28.12 ? 223 GLY H O     1 
ATOM   2060 N  N     . LYS B 2  236 ? 4.388   30.426  11.029  1.00 28.13 ? 224 LYS H N     1 
ATOM   2061 C  CA    . LYS B 2  236 ? 4.808   29.298  10.181  1.00 27.29 ? 224 LYS H CA    1 
ATOM   2062 C  C     . LYS B 2  236 ? 3.726   28.253  10.409  1.00 27.00 ? 224 LYS H C     1 
ATOM   2063 O  O     . LYS B 2  236 ? 3.016   28.348  11.375  1.00 27.01 ? 224 LYS H O     1 
ATOM   2064 C  CB    . LYS B 2  236 ? 6.152   28.691  10.586  1.00 28.16 ? 224 LYS H CB    1 
ATOM   2065 C  CG    . LYS B 2  236 ? 7.353   29.618  10.432  1.00 31.47 ? 224 LYS H CG    1 
ATOM   2066 C  CD    . LYS B 2  236 ? 7.500   30.136  8.989   1.00 35.19 ? 224 LYS H CD    1 
ATOM   2067 C  CE    . LYS B 2  236 ? 8.289   29.203  8.038   1.00 35.93 ? 224 LYS H CE    1 
ATOM   2068 N  NZ    . LYS B 2  236 ? 8.383   29.802  6.635   1.00 36.56 ? 224 LYS H NZ    1 
ATOM   2069 N  N     . TYR B 2  237 ? 3.631   27.261  9.523   1.00 25.62 ? 225 TYR H N     1 
ATOM   2070 C  CA    . TYR B 2  237 ? 2.632   26.195  9.634   1.00 24.74 ? 225 TYR H CA    1 
ATOM   2071 C  C     . TYR B 2  237 ? 3.244   24.840  9.304   1.00 22.92 ? 225 TYR H C     1 
ATOM   2072 O  O     . TYR B 2  237 ? 4.138   24.735  8.455   1.00 24.36 ? 225 TYR H O     1 
ATOM   2073 C  CB    . TYR B 2  237 ? 1.476   26.468  8.652   1.00 25.61 ? 225 TYR H CB    1 
ATOM   2074 C  CG    . TYR B 2  237 ? 0.782   27.786  8.884   1.00 27.76 ? 225 TYR H CG    1 
ATOM   2075 C  CD1   . TYR B 2  237 ? -0.205  27.907  9.880   1.00 28.24 ? 225 TYR H CD1   1 
ATOM   2076 C  CD2   . TYR B 2  237 ? 1.209   28.941  8.234   1.00 29.10 ? 225 TYR H CD2   1 
ATOM   2077 C  CE1   . TYR B 2  237 ? -0.737  29.147  10.243  1.00 27.07 ? 225 TYR H CE1   1 
ATOM   2078 C  CE2   . TYR B 2  237 ? 0.687   30.204  8.578   1.00 29.65 ? 225 TYR H CE2   1 
ATOM   2079 C  CZ    . TYR B 2  237 ? -0.286  30.298  9.589   1.00 29.31 ? 225 TYR H CZ    1 
ATOM   2080 O  OH    . TYR B 2  237 ? -0.821  31.535  9.945   1.00 31.97 ? 225 TYR H OH    1 
ATOM   2081 N  N     . GLY B 2  238 ? 2.773   23.799  9.957   1.00 22.25 ? 226 GLY H N     1 
ATOM   2082 C  CA    . GLY B 2  238 ? 3.279   22.466  9.624   1.00 22.70 ? 226 GLY H CA    1 
ATOM   2083 C  C     . GLY B 2  238 ? 2.660   22.018  8.292   1.00 22.84 ? 226 GLY H C     1 
ATOM   2084 O  O     . GLY B 2  238 ? 1.510   22.416  8.014   1.00 23.14 ? 226 GLY H O     1 
ATOM   2085 N  N     . PHE B 2  239 ? 3.424   21.310  7.440   1.00 22.50 ? 227 PHE H N     1 
ATOM   2086 C  CA    . PHE B 2  239 ? 2.889   20.761  6.153   1.00 21.78 ? 227 PHE H CA    1 
ATOM   2087 C  C     . PHE B 2  239 ? 2.683   19.231  6.175   1.00 21.57 ? 227 PHE H C     1 
ATOM   2088 O  O     . PHE B 2  239 ? 3.431   18.486  6.790   1.00 21.24 ? 227 PHE H O     1 
ATOM   2089 C  CB    . PHE B 2  239 ? 3.744   21.155  4.958   1.00 21.78 ? 227 PHE H CB    1 
ATOM   2090 C  CG    . PHE B 2  239 ? 3.551   22.594  4.556   1.00 24.46 ? 227 PHE H CG    1 
ATOM   2091 C  CD1   . PHE B 2  239 ? 3.982   23.620  5.395   1.00 25.07 ? 227 PHE H CD1   1 
ATOM   2092 C  CD2   . PHE B 2  239 ? 2.853   22.916  3.403   1.00 24.33 ? 227 PHE H CD2   1 
ATOM   2093 C  CE1   . PHE B 2  239 ? 3.693   24.958  5.083   1.00 26.40 ? 227 PHE H CE1   1 
ATOM   2094 C  CE2   . PHE B 2  239 ? 2.559   24.258  3.067   1.00 25.04 ? 227 PHE H CE2   1 
ATOM   2095 C  CZ    . PHE B 2  239 ? 2.971   25.273  3.903   1.00 25.83 ? 227 PHE H CZ    1 
ATOM   2096 N  N     . TYR B 2  240 ? 1.648   18.791  5.485   1.00 19.46 ? 228 TYR H N     1 
ATOM   2097 C  CA    . TYR B 2  240 ? 1.244   17.409  5.511   1.00 19.95 ? 228 TYR H CA    1 
ATOM   2098 C  C     . TYR B 2  240 ? 0.921   16.865  4.115   1.00 20.07 ? 228 TYR H C     1 
ATOM   2099 O  O     . TYR B 2  240 ? 0.321   17.559  3.307   1.00 20.05 ? 228 TYR H O     1 
ATOM   2100 C  CB    . TYR B 2  240 ? -0.038  17.249  6.379   1.00 18.51 ? 228 TYR H CB    1 
ATOM   2101 C  CG    . TYR B 2  240 ? 0.097   17.740  7.824   1.00 19.36 ? 228 TYR H CG    1 
ATOM   2102 C  CD1   . TYR B 2  240 ? 0.160   19.136  8.138   1.00 18.54 ? 228 TYR H CD1   1 
ATOM   2103 C  CD2   . TYR B 2  240 ? 0.313   16.830  8.850   1.00 18.05 ? 228 TYR H CD2   1 
ATOM   2104 C  CE1   . TYR B 2  240 ? 0.445   19.579  9.443   1.00 19.98 ? 228 TYR H CE1   1 
ATOM   2105 C  CE2   . TYR B 2  240 ? 0.607   17.259  10.151  1.00 20.25 ? 228 TYR H CE2   1 
ATOM   2106 C  CZ    . TYR B 2  240 ? 0.669   18.644  10.437  1.00 21.63 ? 228 TYR H CZ    1 
ATOM   2107 O  OH    . TYR B 2  240 ? 0.960   18.995  11.736  1.00 24.30 ? 228 TYR H OH    1 
ATOM   2108 N  N     . THR B 2  241 ? 1.313   15.618  3.848   1.00 21.29 ? 229 THR H N     1 
ATOM   2109 C  CA    . THR B 2  241 ? 0.954   14.996  2.576   1.00 21.53 ? 229 THR H CA    1 
ATOM   2110 C  C     . THR B 2  241 ? -0.571  14.811  2.533   1.00 21.06 ? 229 THR H C     1 
ATOM   2111 O  O     . THR B 2  241 ? -1.158  14.375  3.514   1.00 20.81 ? 229 THR H O     1 
ATOM   2112 C  CB    . THR B 2  241 ? 1.559   13.641  2.438   1.00 21.89 ? 229 THR H CB    1 
ATOM   2113 O  OG1   . THR B 2  241 ? 2.978   13.724  2.671   1.00 24.10 ? 229 THR H OG1   1 
ATOM   2114 C  CG2   . THR B 2  241 ? 1.283   13.127  1.023   1.00 20.90 ? 229 THR H CG2   1 
ATOM   2115 N  N     . HIS B 2  242 ? -1.181  15.139  1.394   1.00 21.34 ? 230 HIS H N     1 
ATOM   2116 C  CA    . HIS B 2  242 ? -2.644  15.065  1.184   1.00 21.99 ? 230 HIS H CA    1 
ATOM   2117 C  C     . HIS B 2  242 ? -3.015  13.611  0.806   1.00 22.97 ? 230 HIS H C     1 
ATOM   2118 O  O     . HIS B 2  242 ? -2.990  13.258  -0.379  1.00 22.53 ? 230 HIS H O     1 
ATOM   2119 C  CB    . HIS B 2  242 ? -3.010  16.013  0.020   1.00 22.78 ? 230 HIS H CB    1 
ATOM   2120 C  CG    . HIS B 2  242 ? -4.461  16.407  -0.048  1.00 24.60 ? 230 HIS H CG    1 
ATOM   2121 N  ND1   . HIS B 2  242 ? -5.491  15.480  -0.119  1.00 24.54 ? 230 HIS H ND1   1 
ATOM   2122 C  CD2   . HIS B 2  242 ? -5.050  17.635  -0.118  1.00 25.59 ? 230 HIS H CD2   1 
ATOM   2123 C  CE1   . HIS B 2  242 ? -6.645  16.120  -0.234  1.00 26.22 ? 230 HIS H CE1   1 
ATOM   2124 N  NE2   . HIS B 2  242 ? -6.410  17.429  -0.240  1.00 24.03 ? 230 HIS H NE2   1 
ATOM   2125 N  N     . VAL B 2  243 ? -3.407  12.811  1.792   1.00 22.32 ? 231 VAL H N     1 
ATOM   2126 C  CA    . VAL B 2  243 ? -3.726  11.422  1.521   1.00 23.14 ? 231 VAL H CA    1 
ATOM   2127 C  C     . VAL B 2  243 ? -4.767  11.218  0.407   1.00 23.95 ? 231 VAL H C     1 
ATOM   2128 O  O     . VAL B 2  243 ? -4.469  10.506  -0.574  1.00 23.89 ? 231 VAL H O     1 
ATOM   2129 C  CB    . VAL B 2  243 ? -4.177  10.697  2.803   1.00 22.64 ? 231 VAL H CB    1 
ATOM   2130 C  CG1   . VAL B 2  243 ? -4.567  9.217   2.491   1.00 21.25 ? 231 VAL H CG1   1 
ATOM   2131 C  CG2   . VAL B 2  243 ? -3.005  10.726  3.841   1.00 22.78 ? 231 VAL H CG2   1 
ATOM   2132 N  N     . PHE B 2  244 ? -5.955  11.832  0.527   1.00 23.60 ? 232 PHE H N     1 
ATOM   2133 C  CA    . PHE B 2  244 ? -6.975  11.604  -0.518  1.00 24.80 ? 232 PHE H CA    1 
ATOM   2134 C  C     . PHE B 2  244 ? -6.432  11.888  -1.924  1.00 25.49 ? 232 PHE H C     1 
ATOM   2135 O  O     . PHE B 2  244 ? -6.621  11.051  -2.838  1.00 24.21 ? 232 PHE H O     1 
ATOM   2136 C  CB    . PHE B 2  244 ? -8.279  12.391  -0.288  1.00 23.41 ? 232 PHE H CB    1 
ATOM   2137 C  CG    . PHE B 2  244 ? -9.336  12.111  -1.348  1.00 26.53 ? 232 PHE H CG    1 
ATOM   2138 C  CD1   . PHE B 2  244 ? -9.873  10.820  -1.488  1.00 27.12 ? 232 PHE H CD1   1 
ATOM   2139 C  CD2   . PHE B 2  244 ? -9.719  13.118  -2.276  1.00 26.24 ? 232 PHE H CD2   1 
ATOM   2140 C  CE1   . PHE B 2  244 ? -10.764 10.520  -2.539  1.00 28.34 ? 232 PHE H CE1   1 
ATOM   2141 C  CE2   . PHE B 2  244 ? -10.599 12.819  -3.312  1.00 28.03 ? 232 PHE H CE2   1 
ATOM   2142 C  CZ    . PHE B 2  244 ? -11.120 11.518  -3.450  1.00 27.50 ? 232 PHE H CZ    1 
ATOM   2143 N  N     . ARG B 2  245 ? -5.746  13.025  -2.103  1.00 24.85 ? 233 ARG H N     1 
ATOM   2144 C  CA    . ARG B 2  245 ? -5.171  13.344  -3.418  1.00 26.85 ? 233 ARG H CA    1 
ATOM   2145 C  C     . ARG B 2  245 ? -4.301  12.233  -4.042  1.00 25.62 ? 233 ARG H C     1 
ATOM   2146 O  O     . ARG B 2  245 ? -4.163  12.147  -5.283  1.00 26.02 ? 233 ARG H O     1 
ATOM   2147 C  CB    . ARG B 2  245 ? -4.323  14.603  -3.356  1.00 31.34 ? 233 ARG H CB    1 
ATOM   2148 C  CG    . ARG B 2  245 ? -5.081  15.860  -3.264  1.00 37.97 ? 233 ARG H CG    1 
ATOM   2149 C  CD    . ARG B 2  245 ? -4.874  16.644  -4.520  1.00 42.22 ? 233 ARG H CD    1 
ATOM   2150 N  NE    . ARG B 2  245 ? -6.035  16.519  -5.382  1.00 45.78 ? 233 ARG H NE    1 
ATOM   2151 C  CZ    . ARG B 2  245 ? -6.060  16.928  -6.653  1.00 48.48 ? 233 ARG H CZ    1 
ATOM   2152 N  NH1   . ARG B 2  245 ? -4.961  17.495  -7.190  1.00 45.92 ? 233 ARG H NH1   1 
ATOM   2153 N  NH2   . ARG B 2  245 ? -7.178  16.743  -7.383  1.00 48.20 ? 233 ARG H NH2   1 
ATOM   2154 N  N     . LEU B 2  246 ? -3.715  11.389  -3.199  1.00 23.03 ? 234 LEU H N     1 
ATOM   2155 C  CA    . LEU B 2  246 ? -2.873  10.307  -3.680  1.00 23.22 ? 234 LEU H CA    1 
ATOM   2156 C  C     . LEU B 2  246 ? -3.501  8.921   -3.464  1.00 23.12 ? 234 LEU H C     1 
ATOM   2157 O  O     . LEU B 2  246 ? -2.802  7.902   -3.516  1.00 23.87 ? 234 LEU H O     1 
ATOM   2158 C  CB    . LEU B 2  246 ? -1.527  10.368  -2.948  1.00 21.41 ? 234 LEU H CB    1 
ATOM   2159 C  CG    . LEU B 2  246 ? -0.912  11.764  -3.136  1.00 25.66 ? 234 LEU H CG    1 
ATOM   2160 C  CD1   . LEU B 2  246 ? 0.363   11.927  -2.278  1.00 25.90 ? 234 LEU H CD1   1 
ATOM   2161 C  CD2   . LEU B 2  246 ? -0.604  11.957  -4.623  1.00 28.06 ? 234 LEU H CD2   1 
ATOM   2162 N  N     . LYS B 2  247 ? -4.795  8.896   -3.205  1.00 24.48 ? 235 LYS H N     1 
ATOM   2163 C  CA    . LYS B 2  247 ? -5.513  7.649   -2.912  1.00 26.71 ? 235 LYS H CA    1 
ATOM   2164 C  C     . LYS B 2  247 ? -5.504  6.615   -4.081  1.00 25.60 ? 235 LYS H C     1 
ATOM   2165 O  O     . LYS B 2  247 ? -5.396  5.419   -3.867  1.00 23.48 ? 235 LYS H O     1 
ATOM   2166 C  CB    . LYS B 2  247 ? -6.950  8.015   -2.494  1.00 29.15 ? 235 LYS H CB    1 
ATOM   2167 C  CG    . LYS B 2  247 ? -7.935  6.829   -2.241  1.00 34.53 ? 235 LYS H CG    1 
ATOM   2168 C  CD    . LYS B 2  247 ? -7.760  6.215   -0.869  1.00 35.08 ? 235 LYS H CD    1 
ATOM   2169 C  CE    . LYS B 2  247 ? -8.849  5.158   -0.552  1.00 37.12 ? 235 LYS H CE    1 
ATOM   2170 N  NZ    . LYS B 2  247 ? -10.141 5.724   -0.009  1.00 38.52 ? 235 LYS H NZ    1 
ATOM   2171 N  N     . LYS B 2  248 ? -5.580  7.088   -5.310  1.00 25.83 ? 236 LYS H N     1 
ATOM   2172 C  CA    . LYS B 2  248 ? -5.577  6.147   -6.420  1.00 28.34 ? 236 LYS H CA    1 
ATOM   2173 C  C     . LYS B 2  248 ? -4.261  5.350   -6.422  1.00 26.87 ? 236 LYS H C     1 
ATOM   2174 O  O     . LYS B 2  248 ? -4.246  4.133   -6.621  1.00 24.17 ? 236 LYS H O     1 
ATOM   2175 C  CB    . LYS B 2  248 ? -5.754  6.897   -7.749  1.00 29.07 ? 236 LYS H CB    1 
ATOM   2176 C  CG    . LYS B 2  248 ? -7.125  7.487   -7.949  1.00 33.84 ? 236 LYS H CG    1 
ATOM   2177 C  CD    . LYS B 2  248 ? -7.486  7.582   -9.464  1.00 36.90 ? 236 LYS H CD    1 
ATOM   2178 C  CE    . LYS B 2  248 ? -8.568  8.667   -9.781  1.00 39.45 ? 236 LYS H CE    1 
ATOM   2179 N  NZ    . LYS B 2  248 ? -9.939  8.191   -9.435  1.00 39.93 ? 236 LYS H NZ    1 
ATOM   2180 N  N     . TRP B 2  249 ? -3.148  6.043   -6.173  1.00 26.41 ? 237 TRP H N     1 
ATOM   2181 C  CA    . TRP B 2  249 ? -1.850  5.356   -6.151  1.00 25.72 ? 237 TRP H CA    1 
ATOM   2182 C  C     . TRP B 2  249 ? -1.825  4.327   -4.998  1.00 26.59 ? 237 TRP H C     1 
ATOM   2183 O  O     . TRP B 2  249 ? -1.352  3.186   -5.156  1.00 27.19 ? 237 TRP H O     1 
ATOM   2184 C  CB    . TRP B 2  249 ? -0.711  6.359   -5.967  1.00 25.70 ? 237 TRP H CB    1 
ATOM   2185 C  CG    . TRP B 2  249 ? 0.591   5.650   -5.747  1.00 26.22 ? 237 TRP H CG    1 
ATOM   2186 C  CD1   . TRP B 2  249 ? 1.344   5.057   -6.702  1.00 26.06 ? 237 TRP H CD1   1 
ATOM   2187 C  CD2   . TRP B 2  249 ? 1.257   5.383   -4.494  1.00 26.43 ? 237 TRP H CD2   1 
ATOM   2188 N  NE1   . TRP B 2  249 ? 2.430   4.437   -6.136  1.00 25.86 ? 237 TRP H NE1   1 
ATOM   2189 C  CE2   . TRP B 2  249 ? 2.412   4.623   -4.789  1.00 25.34 ? 237 TRP H CE2   1 
ATOM   2190 C  CE3   . TRP B 2  249 ? 0.992   5.710   -3.159  1.00 24.46 ? 237 TRP H CE3   1 
ATOM   2191 C  CZ2   . TRP B 2  249 ? 3.329   4.182   -3.791  1.00 25.95 ? 237 TRP H CZ2   1 
ATOM   2192 C  CZ3   . TRP B 2  249 ? 1.898   5.282   -2.165  1.00 23.68 ? 237 TRP H CZ3   1 
ATOM   2193 C  CH2   . TRP B 2  249 ? 3.057   4.523   -2.498  1.00 26.12 ? 237 TRP H CH2   1 
ATOM   2194 N  N     . ILE B 2  250 ? -2.328  4.732   -3.831  1.00 25.10 ? 238 ILE H N     1 
ATOM   2195 C  CA    . ILE B 2  250 ? -2.379  3.837   -2.679  1.00 26.13 ? 238 ILE H CA    1 
ATOM   2196 C  C     . ILE B 2  250 ? -3.167  2.528   -3.009  1.00 26.54 ? 238 ILE H C     1 
ATOM   2197 O  O     . ILE B 2  250 ? -2.682  1.383   -2.832  1.00 26.01 ? 238 ILE H O     1 
ATOM   2198 C  CB    . ILE B 2  250 ? -3.058  4.578   -1.456  1.00 23.94 ? 238 ILE H CB    1 
ATOM   2199 C  CG1   . ILE B 2  250 ? -2.160  5.777   -1.031  1.00 25.41 ? 238 ILE H CG1   1 
ATOM   2200 C  CG2   . ILE B 2  250 ? -3.228  3.620   -0.292  1.00 22.09 ? 238 ILE H CG2   1 
ATOM   2201 C  CD1   . ILE B 2  250 ? -2.668  6.529   0.167   1.00 23.10 ? 238 ILE H CD1   1 
ATOM   2202 N  N     . GLN B 2  251 ? -4.370  2.731   -3.522  1.00 27.68 ? 239 GLN H N     1 
ATOM   2203 C  CA    . GLN B 2  251 ? -5.245  1.611   -3.837  1.00 29.73 ? 239 GLN H CA    1 
ATOM   2204 C  C     . GLN B 2  251 ? -4.673  0.663   -4.879  1.00 29.77 ? 239 GLN H C     1 
ATOM   2205 O  O     . GLN B 2  251 ? -4.844  -0.522  -4.779  1.00 30.03 ? 239 GLN H O     1 
ATOM   2206 C  CB    . GLN B 2  251 ? -6.594  2.131   -4.313  1.00 31.42 ? 239 GLN H CB    1 
ATOM   2207 C  CG    . GLN B 2  251 ? -7.633  1.011   -4.278  1.00 37.92 ? 239 GLN H CG    1 
ATOM   2208 C  CD    . GLN B 2  251 ? -7.817  0.481   -2.850  1.00 41.87 ? 239 GLN H CD    1 
ATOM   2209 O  OE1   . GLN B 2  251 ? -7.613  -0.717  -2.571  1.00 45.08 ? 239 GLN H OE1   1 
ATOM   2210 N  NE2   . GLN B 2  251 ? -8.187  1.381   -1.937  1.00 42.40 ? 239 GLN H NE2   1 
ATOM   2211 N  N     . LYS B 2  252 ? -4.020  1.199   -5.901  1.00 31.38 ? 240 LYS H N     1 
ATOM   2212 C  CA    . LYS B 2  252 ? -3.440  0.368   -6.945  1.00 33.03 ? 240 LYS H CA    1 
ATOM   2213 C  C     . LYS B 2  252 ? -2.290  -0.512  -6.395  1.00 32.27 ? 240 LYS H C     1 
ATOM   2214 O  O     . LYS B 2  252 ? -2.117  -1.677  -6.796  1.00 31.07 ? 240 LYS H O     1 
ATOM   2215 C  CB    . LYS B 2  252 ? -2.960  1.279   -8.108  1.00 35.27 ? 240 LYS H CB    1 
ATOM   2216 C  CG    . LYS B 2  252 ? -2.358  0.561   -9.333  1.00 40.56 ? 240 LYS H CG    1 
ATOM   2217 C  CD    . LYS B 2  252 ? -3.423  -0.177  -10.199 1.00 45.76 ? 240 LYS H CD    1 
ATOM   2218 C  CE    . LYS B 2  252 ? -4.177  0.772   -11.221 1.00 48.22 ? 240 LYS H CE    1 
ATOM   2219 N  NZ    . LYS B 2  252 ? -4.776  2.060   -10.631 1.00 50.72 ? 240 LYS H NZ    1 
ATOM   2220 N  N     . VAL B 2  253 ? -1.498  0.036   -5.484  1.00 30.51 ? 241 VAL H N     1 
ATOM   2221 C  CA    . VAL B 2  253 ? -0.386  -0.723  -4.917  1.00 30.73 ? 241 VAL H CA    1 
ATOM   2222 C  C     . VAL B 2  253 ? -0.904  -1.911  -4.096  1.00 31.41 ? 241 VAL H C     1 
ATOM   2223 O  O     . VAL B 2  253 ? -0.445  -3.044  -4.275  1.00 30.66 ? 241 VAL H O     1 
ATOM   2224 C  CB    . VAL B 2  253 ? 0.517   0.175   -3.983  1.00 30.13 ? 241 VAL H CB    1 
ATOM   2225 C  CG1   . VAL B 2  253 ? 1.511   -0.712  -3.178  1.00 28.85 ? 241 VAL H CG1   1 
ATOM   2226 C  CG2   . VAL B 2  253 ? 1.269   1.186   -4.816  1.00 29.20 ? 241 VAL H CG2   1 
ATOM   2227 N  N     . ILE B 2  254 ? -1.877  -1.621  -3.223  1.00 30.90 ? 242 ILE H N     1 
ATOM   2228 C  CA    . ILE B 2  254 ? -2.500  -2.605  -2.316  1.00 29.93 ? 242 ILE H CA    1 
ATOM   2229 C  C     . ILE B 2  254 ? -3.158  -3.707  -3.141  1.00 32.03 ? 242 ILE H C     1 
ATOM   2230 O  O     . ILE B 2  254 ? -2.997  -4.904  -2.860  1.00 31.04 ? 242 ILE H O     1 
ATOM   2231 C  CB    . ILE B 2  254 ? -3.594  -1.890  -1.391  1.00 28.85 ? 242 ILE H CB    1 
ATOM   2232 C  CG1   . ILE B 2  254 ? -2.914  -1.042  -0.286  1.00 27.55 ? 242 ILE H CG1   1 
ATOM   2233 C  CG2   . ILE B 2  254 ? -4.535  -2.911  -0.677  1.00 24.71 ? 242 ILE H CG2   1 
ATOM   2234 C  CD1   . ILE B 2  254 ? -3.962  -0.245  0.491   1.00 24.75 ? 242 ILE H CD1   1 
ATOM   2235 N  N     . ASP B 2  255 ? -3.908  -3.264  -4.153  1.00 33.18 ? 243 ASP H N     1 
ATOM   2236 C  CA    . ASP B 2  255 ? -4.650  -4.137  -5.060  1.00 36.21 ? 243 ASP H CA    1 
ATOM   2237 C  C     . ASP B 2  255 ? -3.716  -5.066  -5.839  1.00 37.93 ? 243 ASP H C     1 
ATOM   2238 O  O     . ASP B 2  255 ? -3.954  -6.282  -5.924  1.00 39.23 ? 243 ASP H O     1 
ATOM   2239 C  CB    . ASP B 2  255 ? -5.470  -3.295  -6.046  1.00 36.13 ? 243 ASP H CB    1 
ATOM   2240 C  CG    . ASP B 2  255 ? -6.767  -2.756  -5.428  1.00 36.97 ? 243 ASP H CG    1 
ATOM   2241 O  OD1   . ASP B 2  255 ? -7.109  -3.119  -4.283  1.00 34.49 ? 243 ASP H OD1   1 
ATOM   2242 O  OD2   . ASP B 2  255 ? -7.451  -1.960  -6.121  1.00 39.03 ? 243 ASP H OD2   1 
ATOM   2243 N  N     . GLN B 2  256 ? -2.662  -4.497  -6.403  1.00 38.00 ? 244 GLN H N     1 
ATOM   2244 C  CA    . GLN B 2  256 ? -1.701  -5.292  -7.145  1.00 41.18 ? 244 GLN H CA    1 
ATOM   2245 C  C     . GLN B 2  256 ? -0.701  -6.110  -6.325  1.00 41.80 ? 244 GLN H C     1 
ATOM   2246 O  O     . GLN B 2  256 ? -0.390  -7.243  -6.685  1.00 42.92 ? 244 GLN H O     1 
ATOM   2247 C  CB    . GLN B 2  256 ? -0.927  -4.414  -8.121  1.00 42.54 ? 244 GLN H CB    1 
ATOM   2248 C  CG    . GLN B 2  256 ? 0.282   -5.107  -8.691  1.00 47.22 ? 244 GLN H CG    1 
ATOM   2249 C  CD    . GLN B 2  256 ? 0.896   -4.344  -9.856  1.00 49.48 ? 244 GLN H CD    1 
ATOM   2250 O  OE1   . GLN B 2  256 ? 1.934   -4.745  -10.385 1.00 51.36 ? 244 GLN H OE1   1 
ATOM   2251 N  NE2   . GLN B 2  256 ? 0.252   -3.234  -10.265 1.00 50.82 ? 244 GLN H NE2   1 
ATOM   2252 N  N     . PHE B 2  257 ? -0.191  -5.575  -5.226  1.00 41.61 ? 245 PHE H N     1 
ATOM   2253 C  CA    . PHE B 2  257 ? 0.793   -6.341  -4.462  1.00 41.72 ? 245 PHE H CA    1 
ATOM   2254 C  C     . PHE B 2  257 ? 0.296   -6.861  -3.130  1.00 40.80 ? 245 PHE H C     1 
ATOM   2255 O  O     . PHE B 2  257 ? 1.069   -7.391  -2.339  1.00 40.66 ? 245 PHE H O     1 
ATOM   2256 C  CB    . PHE B 2  257 ? 2.056   -5.496  -4.257  1.00 43.54 ? 245 PHE H CB    1 
ATOM   2257 C  CG    . PHE B 2  257 ? 2.668   -5.024  -5.554  1.00 45.98 ? 245 PHE H CG    1 
ATOM   2258 C  CD1   . PHE B 2  257 ? 3.190   -5.940  -6.463  1.00 46.25 ? 245 PHE H CD1   1 
ATOM   2259 C  CD2   . PHE B 2  257 ? 2.680   -3.678  -5.887  1.00 47.30 ? 245 PHE H CD2   1 
ATOM   2260 C  CE1   . PHE B 2  257 ? 3.714   -5.524  -7.689  1.00 47.42 ? 245 PHE H CE1   1 
ATOM   2261 C  CE2   . PHE B 2  257 ? 3.202   -3.238  -7.113  1.00 48.37 ? 245 PHE H CE2   1 
ATOM   2262 C  CZ    . PHE B 2  257 ? 3.723   -4.166  -8.021  1.00 48.03 ? 245 PHE H CZ    1 
ATOM   2263 N  N     . GLY B 2  258 ? -0.993  -6.720  -2.883  1.00 40.04 ? 246 GLY H N     1 
ATOM   2264 C  CA    . GLY B 2  258 ? -1.526  -7.174  -1.614  1.00 40.51 ? 246 GLY H CA    1 
ATOM   2265 C  C     . GLY B 2  258 ? -1.823  -8.670  -1.555  1.00 39.77 ? 246 GLY H C     1 
ATOM   2266 O  O     . GLY B 2  258 ? -1.574  -9.278  -0.516  1.00 40.83 ? 246 GLY H O     1 
ATOM   2267 O  "O5'" . DG  C 3  1   ? -0.696  -12.020 37.575  1.00 28.42 ? 1   DG  D "O5'" 1 
ATOM   2268 C  "C5'" . DG  C 3  1   ? -1.485  -11.709 38.777  1.00 28.58 ? 1   DG  D "C5'" 1 
ATOM   2269 C  "C4'" . DG  C 3  1   ? -1.932  -10.268 38.940  1.00 27.31 ? 1   DG  D "C4'" 1 
ATOM   2270 O  "O4'" . DG  C 3  1   ? -0.806  -9.382  39.179  1.00 22.33 ? 1   DG  D "O4'" 1 
ATOM   2271 C  "C3'" . DG  C 3  1   ? -2.614  -9.722  37.688  1.00 28.76 ? 1   DG  D "C3'" 1 
ATOM   2272 O  "O3'" . DG  C 3  1   ? -3.618  -8.761  38.086  1.00 30.52 ? 1   DG  D "O3'" 1 
ATOM   2273 C  "C2'" . DG  C 3  1   ? -1.480  -9.023  36.948  1.00 24.50 ? 1   DG  D "C2'" 1 
ATOM   2274 C  "C1'" . DG  C 3  1   ? -0.691  -8.445  38.110  1.00 24.40 ? 1   DG  D "C1'" 1 
ATOM   2275 N  N9    . DG  C 3  1   ? 0.722   -8.222  37.814  1.00 24.82 ? 1   DG  D N9    1 
ATOM   2276 C  C8    . DG  C 3  1   ? 1.379   -7.005  37.883  1.00 26.24 ? 1   DG  D C8    1 
ATOM   2277 N  N7    . DG  C 3  1   ? 2.653   -7.092  37.570  1.00 27.31 ? 1   DG  D N7    1 
ATOM   2278 C  C5    . DG  C 3  1   ? 2.855   -8.444  37.284  1.00 25.70 ? 1   DG  D C5    1 
ATOM   2279 C  C6    . DG  C 3  1   ? 4.061   -9.151  36.914  1.00 25.34 ? 1   DG  D C6    1 
ATOM   2280 O  O6    . DG  C 3  1   ? 5.192   -8.706  36.821  1.00 25.20 ? 1   DG  D O6    1 
ATOM   2281 N  N1    . DG  C 3  1   ? 3.828   -10.500 36.672  1.00 24.60 ? 1   DG  D N1    1 
ATOM   2282 C  C2    . DG  C 3  1   ? 2.601   -11.117 36.788  1.00 25.67 ? 1   DG  D C2    1 
ATOM   2283 N  N2    . DG  C 3  1   ? 2.573   -12.454 36.479  1.00 25.06 ? 1   DG  D N2    1 
ATOM   2284 N  N3    . DG  C 3  1   ? 1.475   -10.478 37.165  1.00 26.09 ? 1   DG  D N3    1 
ATOM   2285 C  C4    . DG  C 3  1   ? 1.675   -9.156  37.398  1.00 24.08 ? 1   DG  D C4    1 
ATOM   2286 P  P     . DG  C 3  2   ? -4.686  -8.243  37.018  1.00 29.94 ? 2   DG  D P     1 
ATOM   2287 O  OP1   . DG  C 3  2   ? -5.809  -7.595  37.780  1.00 32.02 ? 2   DG  D OP1   1 
ATOM   2288 O  OP2   . DG  C 3  2   ? -4.997  -9.314  35.997  1.00 32.34 ? 2   DG  D OP2   1 
ATOM   2289 O  "O5'" . DG  C 3  2   ? -3.913  -7.060  36.323  1.00 28.51 ? 2   DG  D "O5'" 1 
ATOM   2290 C  "C5'" . DG  C 3  2   ? -3.442  -5.975  37.129  1.00 28.29 ? 2   DG  D "C5'" 1 
ATOM   2291 C  "C4'" . DG  C 3  2   ? -2.583  -5.053  36.304  1.00 29.72 ? 2   DG  D "C4'" 1 
ATOM   2292 O  "O4'" . DG  C 3  2   ? -1.220  -5.568  36.130  1.00 28.49 ? 2   DG  D "O4'" 1 
ATOM   2293 C  "C3'" . DG  C 3  2   ? -3.140  -4.822  34.895  1.00 31.49 ? 2   DG  D "C3'" 1 
ATOM   2294 O  "O3'" . DG  C 3  2   ? -3.456  -3.436  34.687  1.00 34.21 ? 2   DG  D "O3'" 1 
ATOM   2295 C  "C2'" . DG  C 3  2   ? -2.030  -5.325  33.973  1.00 29.12 ? 2   DG  D "C2'" 1 
ATOM   2296 C  "C1'" . DG  C 3  2   ? -0.766  -5.231  34.846  1.00 28.69 ? 2   DG  D "C1'" 1 
ATOM   2297 N  N9    . DG  C 3  2   ? 0.317   -6.156  34.495  1.00 27.15 ? 2   DG  D N9    1 
ATOM   2298 C  C8    . DG  C 3  2   ? 0.176   -7.464  34.089  1.00 26.48 ? 2   DG  D C8    1 
ATOM   2299 N  N7    . DG  C 3  2   ? 1.328   -8.067  33.869  1.00 26.37 ? 2   DG  D N7    1 
ATOM   2300 C  C5    . DG  C 3  2   ? 2.279   -7.106  34.136  1.00 25.19 ? 2   DG  D C5    1 
ATOM   2301 C  C6    . DG  C 3  2   ? 3.717   -7.190  34.085  1.00 25.75 ? 2   DG  D C6    1 
ATOM   2302 O  O6    . DG  C 3  2   ? 4.435   -8.191  33.787  1.00 24.74 ? 2   DG  D O6    1 
ATOM   2303 N  N1    . DG  C 3  2   ? 4.307   -5.970  34.411  1.00 24.01 ? 2   DG  D N1    1 
ATOM   2304 C  C2    . DG  C 3  2   ? 3.614   -4.815  34.721  1.00 26.39 ? 2   DG  D C2    1 
ATOM   2305 N  N2    . DG  C 3  2   ? 4.366   -3.719  34.905  1.00 26.95 ? 2   DG  D N2    1 
ATOM   2306 N  N3    . DG  C 3  2   ? 2.276   -4.731  34.813  1.00 26.74 ? 2   DG  D N3    1 
ATOM   2307 C  C4    . DG  C 3  2   ? 1.677   -5.904  34.503  1.00 26.82 ? 2   DG  D C4    1 
ATOM   2308 P  P     . DT  C 3  3   ? -4.845  -2.998  33.974  1.00 38.94 ? 3   DT  D P     1 
ATOM   2309 O  OP1   . DT  C 3  3   ? -4.917  -1.513  34.072  1.00 37.92 ? 3   DT  D OP1   1 
ATOM   2310 O  OP2   . DT  C 3  3   ? -5.976  -3.829  34.446  1.00 36.54 ? 3   DT  D OP2   1 
ATOM   2311 O  "O5'" . DT  C 3  3   ? -4.688  -3.424  32.457  1.00 37.27 ? 3   DT  D "O5'" 1 
ATOM   2312 C  "C5'" . DT  C 3  3   ? -5.814  -3.435  31.586  1.00 38.40 ? 3   DT  D "C5'" 1 
ATOM   2313 C  "C4'" . DT  C 3  3   ? -5.364  -3.906  30.231  1.00 37.63 ? 3   DT  D "C4'" 1 
ATOM   2314 O  "O4'" . DT  C 3  3   ? -4.548  -2.854  29.635  1.00 39.43 ? 3   DT  D "O4'" 1 
ATOM   2315 C  "C3'" . DT  C 3  3   ? -4.410  -5.074  30.474  1.00 38.62 ? 3   DT  D "C3'" 1 
ATOM   2316 O  "O3'" . DT  C 3  3   ? -4.637  -6.211  29.711  1.00 38.56 ? 3   DT  D "O3'" 1 
ATOM   2317 C  "C2'" . DT  C 3  3   ? -3.037  -4.542  30.167  1.00 39.57 ? 3   DT  D "C2'" 1 
ATOM   2318 C  "C1'" . DT  C 3  3   ? -3.361  -3.470  29.181  1.00 39.00 ? 3   DT  D "C1'" 1 
ATOM   2319 N  N1    . DT  C 3  3   ? -2.415  -2.418  29.008  1.00 40.45 ? 3   DT  D N1    1 
ATOM   2320 C  C2    . DT  C 3  3   ? -1.971  -2.357  27.706  1.00 42.67 ? 3   DT  D C2    1 
ATOM   2321 O  O2    . DT  C 3  3   ? -2.461  -3.018  26.800  1.00 49.25 ? 3   DT  D O2    1 
ATOM   2322 N  N3    . DT  C 3  3   ? -0.929  -1.501  27.495  1.00 39.33 ? 3   DT  D N3    1 
ATOM   2323 C  C4    . DT  C 3  3   ? -0.300  -0.706  28.420  1.00 34.69 ? 3   DT  D C4    1 
ATOM   2324 O  O4    . DT  C 3  3   ? 0.619   0.013   28.058  1.00 10.35 ? 3   DT  D O4    1 
ATOM   2325 C  C5    . DT  C 3  3   ? -0.822  -0.808  29.778  1.00 34.77 ? 3   DT  D C5    1 
ATOM   2326 C  C7    . DT  C 3  3   ? -0.199  0.012   30.863  1.00 33.20 ? 3   DT  D C7    1 
ATOM   2327 C  C6    . DT  C 3  3   ? -1.846  -1.646  29.997  1.00 38.40 ? 3   DT  D C6    1 
ATOM   2328 P  P     . DT  C 3  4   ? -4.200  -7.583  30.428  1.00 42.94 ? 4   DT  D P     1 
ATOM   2329 O  OP1   . DT  C 3  4   ? -5.179  -8.614  29.989  1.00 45.31 ? 4   DT  D OP1   1 
ATOM   2330 O  OP2   . DT  C 3  4   ? -3.939  -7.349  31.880  1.00 43.98 ? 4   DT  D OP2   1 
ATOM   2331 O  "O5'" . DT  C 3  4   ? -2.766  -7.938  29.814  1.00 41.59 ? 4   DT  D "O5'" 1 
ATOM   2332 C  "C5'" . DT  C 3  4   ? -2.655  -8.516  28.541  1.00 38.66 ? 4   DT  D "C5'" 1 
ATOM   2333 C  "C4'" . DT  C 3  4   ? -1.539  -9.534  28.521  1.00 37.44 ? 4   DT  D "C4'" 1 
ATOM   2334 O  "O4'" . DT  C 3  4   ? -0.253  -8.885  28.541  1.00 35.64 ? 4   DT  D "O4'" 1 
ATOM   2335 C  "C3'" . DT  C 3  4   ? -1.495  -10.591 29.625  1.00 38.48 ? 4   DT  D "C3'" 1 
ATOM   2336 O  "O3'" . DT  C 3  4   ? -0.980  -11.775 29.010  1.00 41.14 ? 4   DT  D "O3'" 1 
ATOM   2337 C  "C2'" . DT  C 3  4   ? -0.452  -10.037 30.587  1.00 35.44 ? 4   DT  D "C2'" 1 
ATOM   2338 C  "C1'" . DT  C 3  4   ? 0.523   -9.408  29.612  1.00 33.64 ? 4   DT  D "C1'" 1 
ATOM   2339 N  N1    . DT  C 3  4   ? 1.337   -8.312  30.131  1.00 31.73 ? 4   DT  D N1    1 
ATOM   2340 C  C2    . DT  C 3  4   ? 2.668   -8.564  30.326  1.00 28.85 ? 4   DT  D C2    1 
ATOM   2341 O  O2    . DT  C 3  4   ? 3.178   -9.674  30.163  1.00 30.86 ? 4   DT  D O2    1 
ATOM   2342 N  N3    . DT  C 3  4   ? 3.382   -7.492  30.729  1.00 27.09 ? 4   DT  D N3    1 
ATOM   2343 C  C4    . DT  C 3  4   ? 2.915   -6.223  30.987  1.00 27.62 ? 4   DT  D C4    1 
ATOM   2344 O  O4    . DT  C 3  4   ? 3.702   -5.340  31.317  1.00 27.60 ? 4   DT  D O4    1 
ATOM   2345 C  C5    . DT  C 3  4   ? 1.499   -6.037  30.828  1.00 27.78 ? 4   DT  D C5    1 
ATOM   2346 C  C7    . DT  C 3  4   ? 0.904   -4.701  31.168  1.00 28.37 ? 4   DT  D C7    1 
ATOM   2347 C  C6    . DT  C 3  4   ? 0.783   -7.072  30.394  1.00 28.92 ? 4   DT  D C6    1 
ATOM   2348 P  P     . DG  C 3  5   ? -1.230  -13.217 29.673  1.00 47.38 ? 5   DG  D P     1 
ATOM   2349 O  OP1   . DG  C 3  5   ? -1.176  -14.236 28.585  1.00 43.42 ? 5   DG  D OP1   1 
ATOM   2350 O  OP2   . DG  C 3  5   ? -2.399  -13.176 30.636  1.00 44.14 ? 5   DG  D OP2   1 
ATOM   2351 O  "O5'" . DG  C 3  5   ? 0.088   -13.489 30.516  1.00 42.49 ? 5   DG  D "O5'" 1 
ATOM   2352 C  "C5'" . DG  C 3  5   ? 0.081   -14.456 31.550  1.00 42.51 ? 5   DG  D "C5'" 1 
ATOM   2353 C  "C4'" . DG  C 3  5   ? 0.954   -15.630 31.169  1.00 41.20 ? 5   DG  D "C4'" 1 
ATOM   2354 O  "O4'" . DG  C 3  5   ? 2.259   -15.156 30.762  1.00 38.23 ? 5   DG  D "O4'" 1 
ATOM   2355 C  "C3'" . DG  C 3  5   ? 1.189   -16.575 32.345  1.00 41.65 ? 5   DG  D "C3'" 1 
ATOM   2356 O  "O3'" . DG  C 3  5   ? 1.305   -17.939 31.868  1.00 44.22 ? 5   DG  D "O3'" 1 
ATOM   2357 C  "C2'" . DG  C 3  5   ? 2.470   -16.043 32.960  1.00 39.58 ? 5   DG  D "C2'" 1 
ATOM   2358 C  "C1'" . DG  C 3  5   ? 3.232   -15.565 31.726  1.00 37.99 ? 5   DG  D "C1'" 1 
ATOM   2359 N  N9    . DG  C 3  5   ? 4.182   -14.463 31.919  1.00 34.70 ? 5   DG  D N9    1 
ATOM   2360 C  C8    . DG  C 3  5   ? 5.525   -14.486 31.610  1.00 31.71 ? 5   DG  D C8    1 
ATOM   2361 N  N7    . DG  C 3  5   ? 6.123   -13.342 31.818  1.00 32.80 ? 5   DG  D N7    1 
ATOM   2362 C  C5    . DG  C 3  5   ? 5.127   -12.514 32.309  1.00 30.05 ? 5   DG  D C5    1 
ATOM   2363 C  C6    . DG  C 3  5   ? 5.196   -11.191 32.691  1.00 28.59 ? 5   DG  D C6    1 
ATOM   2364 O  O6    . DG  C 3  5   ? 6.173   -10.463 32.678  1.00 27.57 ? 5   DG  D O6    1 
ATOM   2365 N  N1    . DG  C 3  5   ? 3.959   -10.705 33.137  1.00 27.56 ? 5   DG  D N1    1 
ATOM   2366 C  C2    . DG  C 3  5   ? 2.798   -11.439 33.178  1.00 30.53 ? 5   DG  D C2    1 
ATOM   2367 N  N2    . DG  C 3  5   ? 1.672   -10.768 33.593  1.00 27.36 ? 5   DG  D N2    1 
ATOM   2368 N  N3    . DG  C 3  5   ? 2.729   -12.732 32.825  1.00 30.32 ? 5   DG  D N3    1 
ATOM   2369 C  C4    . DG  C 3  5   ? 3.922   -13.193 32.405  1.00 31.78 ? 5   DG  D C4    1 
ATOM   2370 P  P     . DG  C 3  6   ? 1.256   -19.148 32.920  1.00 44.91 ? 6   DG  D P     1 
ATOM   2371 O  OP1   . DG  C 3  6   ? 0.871   -20.407 32.194  1.00 46.79 ? 6   DG  D OP1   1 
ATOM   2372 O  OP2   . DG  C 3  6   ? 0.461   -18.680 34.079  1.00 43.66 ? 6   DG  D OP2   1 
ATOM   2373 O  "O5'" . DG  C 3  6   ? 2.777   -19.314 33.361  1.00 43.63 ? 6   DG  D "O5'" 1 
ATOM   2374 C  "C5'" . DG  C 3  6   ? 3.776   -19.543 32.375  1.00 42.48 ? 6   DG  D "C5'" 1 
ATOM   2375 C  "C4'" . DG  C 3  6   ? 5.145   -19.270 32.947  1.00 43.04 ? 6   DG  D "C4'" 1 
ATOM   2376 O  "O4'" . DG  C 3  6   ? 5.344   -17.850 33.128  1.00 40.75 ? 6   DG  D "O4'" 1 
ATOM   2377 C  "C3'" . DG  C 3  6   ? 5.458   -19.915 34.307  1.00 44.21 ? 6   DG  D "C3'" 1 
ATOM   2378 O  "O3'" . DG  C 3  6   ? 6.796   -20.422 34.248  1.00 46.63 ? 6   DG  D "O3'" 1 
ATOM   2379 C  "C2'" . DG  C 3  6   ? 5.422   -18.735 35.271  1.00 42.28 ? 6   DG  D "C2'" 1 
ATOM   2380 C  "C1'" . DG  C 3  6   ? 5.994   -17.648 34.374  1.00 41.68 ? 6   DG  D "C1'" 1 
ATOM   2381 N  N9    . DG  C 3  6   ? 5.769   -16.267 34.788  1.00 40.77 ? 6   DG  D N9    1 
ATOM   2382 C  C8    . DG  C 3  6   ? 4.618   -15.746 35.324  1.00 40.95 ? 6   DG  D C8    1 
ATOM   2383 N  N7    . DG  C 3  6   ? 4.712   -14.470 35.594  1.00 40.82 ? 6   DG  D N7    1 
ATOM   2384 C  C5    . DG  C 3  6   ? 6.008   -14.132 35.222  1.00 38.67 ? 6   DG  D C5    1 
ATOM   2385 C  C6    . DG  C 3  6   ? 6.694   -12.886 35.293  1.00 37.37 ? 6   DG  D C6    1 
ATOM   2386 O  O6    . DG  C 3  6   ? 6.292   -11.808 35.742  1.00 34.79 ? 6   DG  D O6    1 
ATOM   2387 N  N1    . DG  C 3  6   ? 7.982   -12.983 34.773  1.00 36.84 ? 6   DG  D N1    1 
ATOM   2388 C  C2    . DG  C 3  6   ? 8.535   -14.128 34.250  1.00 36.60 ? 6   DG  D C2    1 
ATOM   2389 N  N2    . DG  C 3  6   ? 9.792   -14.018 33.755  1.00 34.91 ? 6   DG  D N2    1 
ATOM   2390 N  N3    . DG  C 3  6   ? 7.912   -15.289 34.205  1.00 37.81 ? 6   DG  D N3    1 
ATOM   2391 C  C4    . DG  C 3  6   ? 6.668   -15.224 34.707  1.00 38.91 ? 6   DG  D C4    1 
ATOM   2392 P  P     . DT  C 3  7   ? 7.316   -21.452 35.364  1.00 50.33 ? 7   DT  D P     1 
ATOM   2393 O  OP1   . DT  C 3  7   ? 8.578   -22.028 34.816  1.00 49.28 ? 7   DT  D OP1   1 
ATOM   2394 O  OP2   . DT  C 3  7   ? 6.172   -22.325 35.718  1.00 48.60 ? 7   DT  D OP2   1 
ATOM   2395 O  "O5'" . DT  C 3  7   ? 7.665   -20.562 36.650  1.00 49.65 ? 7   DT  D "O5'" 1 
ATOM   2396 C  "C5'" . DT  C 3  7   ? 9.019   -20.386 37.046  1.00 49.43 ? 7   DT  D "C5'" 1 
ATOM   2397 C  "C4'" . DT  C 3  7   ? 9.658   -19.334 36.174  1.00 49.86 ? 7   DT  D "C4'" 1 
ATOM   2398 O  "O4'" . DT  C 3  7   ? 8.797   -18.170 36.152  1.00 48.78 ? 7   DT  D "O4'" 1 
ATOM   2399 C  "C3'" . DT  C 3  7   ? 11.035  -18.823 36.607  1.00 50.59 ? 7   DT  D "C3'" 1 
ATOM   2400 O  "O3'" . DT  C 3  7   ? 11.803  -18.516 35.424  1.00 53.46 ? 7   DT  D "O3'" 1 
ATOM   2401 C  "C2'" . DT  C 3  7   ? 10.699  -17.586 37.421  1.00 48.20 ? 7   DT  D "C2'" 1 
ATOM   2402 C  "C1'" . DT  C 3  7   ? 9.492   -17.043 36.663  1.00 47.03 ? 7   DT  D "C1'" 1 
ATOM   2403 N  N1    . DT  C 3  7   ? 8.517   -16.252 37.418  1.00 43.57 ? 7   DT  D N1    1 
ATOM   2404 C  C2    . DT  C 3  7   ? 8.793   -14.921 37.681  1.00 42.00 ? 7   DT  D C2    1 
ATOM   2405 O  O2    . DT  C 3  7   ? 9.842   -14.383 37.396  1.00 35.92 ? 7   DT  D O2    1 
ATOM   2406 N  N3    . DT  C 3  7   ? 7.775   -14.237 38.288  1.00 43.16 ? 7   DT  D N3    1 
ATOM   2407 C  C4    . DT  C 3  7   ? 6.540   -14.733 38.658  1.00 45.57 ? 7   DT  D C4    1 
ATOM   2408 O  O4    . DT  C 3  7   ? 5.690   -13.981 39.143  1.00 45.43 ? 7   DT  D O4    1 
ATOM   2409 C  C5    . DT  C 3  7   ? 6.346   -16.147 38.410  1.00 46.09 ? 7   DT  D C5    1 
ATOM   2410 C  C7    . DT  C 3  7   ? 5.053   -16.771 38.831  1.00 46.38 ? 7   DT  D C7    1 
ATOM   2411 C  C6    . DT  C 3  7   ? 7.334   -16.829 37.811  1.00 44.38 ? 7   DT  D C6    1 
ATOM   2412 P  P     . DG  C 3  8   ? 13.195  -17.732 35.564  1.00 56.79 ? 8   DG  D P     1 
ATOM   2413 O  OP1   . DG  C 3  8   ? 13.829  -17.534 34.236  1.00 56.02 ? 8   DG  D OP1   1 
ATOM   2414 O  OP2   . DG  C 3  8   ? 13.969  -18.350 36.658  1.00 57.33 ? 8   DG  D OP2   1 
ATOM   2415 O  "O5'" . DG  C 3  8   ? 12.696  -16.304 36.046  1.00 56.71 ? 8   DG  D "O5'" 1 
ATOM   2416 C  "C5'" . DG  C 3  8   ? 13.193  -15.750 37.220  1.00 51.85 ? 8   DG  D "C5'" 1 
ATOM   2417 C  "C4'" . DG  C 3  8   ? 14.326  -14.835 36.870  1.00 49.19 ? 8   DG  D "C4'" 1 
ATOM   2418 O  "O4'" . DG  C 3  8   ? 13.826  -13.495 36.650  1.00 46.69 ? 8   DG  D "O4'" 1 
ATOM   2419 C  "C3'" . DG  C 3  8   ? 15.266  -14.751 38.055  1.00 48.63 ? 8   DG  D "C3'" 1 
ATOM   2420 O  "O3'" . DG  C 3  8   ? 16.581  -14.570 37.568  1.00 49.23 ? 8   DG  D "O3'" 1 
ATOM   2421 C  "C2'" . DG  C 3  8   ? 14.780  -13.532 38.804  1.00 46.86 ? 8   DG  D "C2'" 1 
ATOM   2422 C  "C1'" . DG  C 3  8   ? 14.278  -12.630 37.693  1.00 44.99 ? 8   DG  D "C1'" 1 
ATOM   2423 N  N9    . DG  C 3  8   ? 13.145  -11.847 38.157  1.00 42.30 ? 8   DG  D N9    1 
ATOM   2424 C  C8    . DG  C 3  8   ? 11.821  -12.204 38.095  1.00 42.27 ? 8   DG  D C8    1 
ATOM   2425 N  N7    . DG  C 3  8   ? 11.028  -11.305 38.612  1.00 41.20 ? 8   DG  D N7    1 
ATOM   2426 C  C5    . DG  C 3  8   ? 11.881  -10.301 39.029  1.00 40.44 ? 8   DG  D C5    1 
ATOM   2427 C  C6    . DG  C 3  8   ? 11.600  -9.078  39.674  1.00 41.90 ? 8   DG  D C6    1 
ATOM   2428 O  O6    . DG  C 3  8   ? 10.517  -8.602  39.976  1.00 44.01 ? 8   DG  D O6    1 
ATOM   2429 N  N1    . DG  C 3  8   ? 12.758  -8.381  39.970  1.00 43.15 ? 8   DG  D N1    1 
ATOM   2430 C  C2    . DG  C 3  8   ? 14.020  -8.811  39.676  1.00 42.21 ? 8   DG  D C2    1 
ATOM   2431 N  N2    . DG  C 3  8   ? 15.012  -8.032  40.098  1.00 46.12 ? 8   DG  D N2    1 
ATOM   2432 N  N3    . DG  C 3  8   ? 14.291  -9.929  39.039  1.00 42.23 ? 8   DG  D N3    1 
ATOM   2433 C  C4    . DG  C 3  8   ? 13.187  -10.626 38.759  1.00 40.39 ? 8   DG  D C4    1 
ATOM   2434 P  P     . DT  C 3  9   ? 17.797  -14.646 38.581  1.00 48.56 ? 9   DT  D P     1 
ATOM   2435 O  OP1   . DT  C 3  9   ? 18.992  -14.846 37.720  1.00 50.19 ? 9   DT  D OP1   1 
ATOM   2436 O  OP2   . DT  C 3  9   ? 17.506  -15.617 39.669  1.00 48.99 ? 9   DT  D OP2   1 
ATOM   2437 O  "O5'" . DT  C 3  9   ? 17.801  -13.184 39.190  1.00 46.16 ? 9   DT  D "O5'" 1 
ATOM   2438 C  "C5'" . DT  C 3  9   ? 18.401  -12.144 38.483  1.00 48.25 ? 9   DT  D "C5'" 1 
ATOM   2439 C  "C4'" . DT  C 3  9   ? 18.379  -10.900 39.320  1.00 50.78 ? 9   DT  D "C4'" 1 
ATOM   2440 O  "O4'" . DT  C 3  9   ? 18.856  -11.243 40.635  1.00 52.36 ? 9   DT  D "O4'" 1 
ATOM   2441 C  "C3'" . DT  C 3  9   ? 19.326  -9.837  38.794  1.00 51.53 ? 9   DT  D "C3'" 1 
ATOM   2442 O  "O3'" . DT  C 3  9   ? 18.838  -8.567  39.207  1.00 50.48 ? 9   DT  D "O3'" 1 
ATOM   2443 C  "C2'" . DT  C 3  9   ? 20.641  -10.201 39.466  1.00 53.74 ? 9   DT  D "C2'" 1 
ATOM   2444 C  "C1'" . DT  C 3  9   ? 20.189  -10.768 40.803  1.00 54.42 ? 9   DT  D "C1'" 1 
ATOM   2445 N  N1    . DT  C 3  9   ? 21.002  -11.892 41.296  1.00 57.32 ? 9   DT  D N1    1 
ATOM   2446 C  C2    . DT  C 3  9   ? 20.515  -13.181 41.172  1.00 58.22 ? 9   DT  D C2    1 
ATOM   2447 O  O2    . DT  C 3  9   ? 19.497  -13.457 40.589  1.00 61.81 ? 9   DT  D O2    1 
ATOM   2448 N  N3    . DT  C 3  9   ? 21.272  -14.145 41.752  1.00 58.71 ? 9   DT  D N3    1 
ATOM   2449 C  C4    . DT  C 3  9   ? 22.461  -13.979 42.395  1.00 59.11 ? 9   DT  D C4    1 
ATOM   2450 O  O4    . DT  C 3  9   ? 23.008  -14.952 42.912  1.00 58.40 ? 9   DT  D O4    1 
ATOM   2451 C  C5    . DT  C 3  9   ? 22.965  -12.620 42.406  1.00 59.63 ? 9   DT  D C5    1 
ATOM   2452 C  C7    . DT  C 3  9   ? 24.321  -12.364 42.944  1.00 60.74 ? 9   DT  D C7    1 
ATOM   2453 C  C6    . DT  C 3  9   ? 22.208  -11.649 41.892  1.00 57.61 ? 9   DT  D C6    1 
ATOM   2454 P  P     . DG  C 3  10  ? 18.493  -7.458  38.109  1.00 49.46 ? 10  DG  D P     1 
ATOM   2455 O  OP1   . DG  C 3  10  ? 19.787  -6.775  37.797  1.00 50.18 ? 10  DG  D OP1   1 
ATOM   2456 O  OP2   . DG  C 3  10  ? 17.339  -6.674  38.620  1.00 47.08 ? 10  DG  D OP2   1 
ATOM   2457 O  "O5'" . DG  C 3  10  ? 18.101  -8.301  36.814  1.00 46.37 ? 10  DG  D "O5'" 1 
ATOM   2458 C  "C5'" . DG  C 3  10  ? 16.838  -8.929  36.654  1.00 42.27 ? 10  DG  D "C5'" 1 
ATOM   2459 C  "C4'" . DG  C 3  10  ? 16.943  -9.906  35.509  1.00 40.34 ? 10  DG  D "C4'" 1 
ATOM   2460 O  "O4'" . DG  C 3  10  ? 15.830  -10.813 35.424  1.00 39.85 ? 10  DG  D "O4'" 1 
ATOM   2461 C  "C3'" . DG  C 3  10  ? 17.069  -9.288  34.125  1.00 41.60 ? 10  DG  D "C3'" 1 
ATOM   2462 O  "O3'" . DG  C 3  10  ? 17.962  -10.126 33.379  1.00 42.63 ? 10  DG  D "O3'" 1 
ATOM   2463 C  "C2'" . DG  C 3  10  ? 15.650  -9.391  33.570  1.00 39.12 ? 10  DG  D "C2'" 1 
ATOM   2464 C  "C1'" . DG  C 3  10  ? 15.242  -10.741 34.117  1.00 37.68 ? 10  DG  D "C1'" 1 
ATOM   2465 N  N9    . DG  C 3  10  ? 13.808  -10.956 34.270  1.00 35.77 ? 10  DG  D N9    1 
ATOM   2466 C  C8    . DG  C 3  10  ? 13.083  -12.042 33.838  1.00 33.38 ? 10  DG  D C8    1 
ATOM   2467 N  N7    . DG  C 3  10  ? 11.812  -11.968 34.163  1.00 34.18 ? 10  DG  D N7    1 
ATOM   2468 C  C5    . DG  C 3  10  ? 11.696  -10.772 34.851  1.00 32.63 ? 10  DG  D C5    1 
ATOM   2469 C  C6    . DG  C 3  10  ? 10.565  -10.182 35.453  1.00 34.75 ? 10  DG  D C6    1 
ATOM   2470 O  O6    . DG  C 3  10  ? 9.403   -10.629 35.519  1.00 34.59 ? 10  DG  D O6    1 
ATOM   2471 N  N1    . DG  C 3  10  ? 10.876  -8.956  36.035  1.00 34.14 ? 10  DG  D N1    1 
ATOM   2472 C  C2    . DG  C 3  10  ? 12.129  -8.389  36.054  1.00 34.27 ? 10  DG  D C2    1 
ATOM   2473 N  N2    . DG  C 3  10  ? 12.218  -7.206  36.726  1.00 33.28 ? 10  DG  D N2    1 
ATOM   2474 N  N3    . DG  C 3  10  ? 13.201  -8.933  35.481  1.00 32.21 ? 10  DG  D N3    1 
ATOM   2475 C  C4    . DG  C 3  10  ? 12.911  -10.117 34.909  1.00 33.83 ? 10  DG  D C4    1 
ATOM   2476 P  P     . DG  C 3  11  ? 18.398  -9.698  31.901  1.00 46.12 ? 11  DG  D P     1 
ATOM   2477 O  OP1   . DG  C 3  11  ? 19.629  -10.425 31.486  1.00 46.12 ? 11  DG  D OP1   1 
ATOM   2478 O  OP2   . DG  C 3  11  ? 18.384  -8.217  31.928  1.00 43.60 ? 11  DG  D OP2   1 
ATOM   2479 O  "O5'" . DG  C 3  11  ? 17.235  -10.269 30.979  1.00 44.12 ? 11  DG  D "O5'" 1 
ATOM   2480 C  "C5'" . DG  C 3  11  ? 17.036  -11.657 30.850  1.00 43.20 ? 11  DG  D "C5'" 1 
ATOM   2481 C  "C4'" . DG  C 3  11  ? 15.850  -11.911 29.952  1.00 45.61 ? 11  DG  D "C4'" 1 
ATOM   2482 O  "O4'" . DG  C 3  11  ? 14.586  -11.672 30.649  1.00 43.14 ? 11  DG  D "O4'" 1 
ATOM   2483 C  "C3'" . DG  C 3  11  ? 15.829  -11.007 28.710  1.00 46.64 ? 11  DG  D "C3'" 1 
ATOM   2484 O  "O3'" . DG  C 3  11  ? 15.424  -11.788 27.575  1.00 51.55 ? 11  DG  D "O3'" 1 
ATOM   2485 C  "C2'" . DG  C 3  11  ? 14.754  -9.982  29.058  1.00 43.95 ? 11  DG  D "C2'" 1 
ATOM   2486 C  "C1'" . DG  C 3  11  ? 13.763  -10.855 29.819  1.00 40.75 ? 11  DG  D "C1'" 1 
ATOM   2487 N  N9    . DG  C 3  11  ? 12.781  -10.149 30.652  1.00 35.60 ? 11  DG  D N9    1 
ATOM   2488 C  C8    . DG  C 3  11  ? 12.950  -8.921  31.242  1.00 33.07 ? 11  DG  D C8    1 
ATOM   2489 N  N7    . DG  C 3  11  ? 11.893  -8.513  31.896  1.00 32.18 ? 11  DG  D N7    1 
ATOM   2490 C  C5    . DG  C 3  11  ? 10.970  -9.537  31.742  1.00 29.42 ? 11  DG  D C5    1 
ATOM   2491 C  C6    . DG  C 3  11  ? 9.629   -9.644  32.229  1.00 27.99 ? 11  DG  D C6    1 
ATOM   2492 O  O6    . DG  C 3  11  ? 9.001   -8.842  32.901  1.00 28.51 ? 11  DG  D O6    1 
ATOM   2493 N  N1    . DG  C 3  11  ? 9.030   -10.828 31.834  1.00 26.78 ? 11  DG  D N1    1 
ATOM   2494 C  C2    . DG  C 3  11  ? 9.642   -11.797 31.060  1.00 28.35 ? 11  DG  D C2    1 
ATOM   2495 N  N2    . DG  C 3  11  ? 8.855   -12.828 30.726  1.00 29.09 ? 11  DG  D N2    1 
ATOM   2496 N  N3    . DG  C 3  11  ? 10.910  -11.735 30.628  1.00 28.32 ? 11  DG  D N3    1 
ATOM   2497 C  C4    . DG  C 3  11  ? 11.503  -10.569 30.988  1.00 31.31 ? 11  DG  D C4    1 
ATOM   2498 P  P     . DT  C 3  12  ? 16.218  -11.652 26.175  1.00 55.32 ? 12  DT  D P     1 
ATOM   2499 O  OP1   . DT  C 3  12  ? 15.730  -12.761 25.314  1.00 54.77 ? 12  DT  D OP1   1 
ATOM   2500 O  OP2   . DT  C 3  12  ? 17.662  -11.529 26.479  1.00 53.35 ? 12  DT  D OP2   1 
ATOM   2501 O  "O5'" . DT  C 3  12  ? 15.723  -10.272 25.559  1.00 56.52 ? 12  DT  D "O5'" 1 
ATOM   2502 C  "C5'" . DT  C 3  12  ? 16.610  -9.474  24.768  1.00 58.11 ? 12  DT  D "C5'" 1 
ATOM   2503 C  "C4'" . DT  C 3  12  ? 15.984  -8.131  24.482  1.00 58.39 ? 12  DT  D "C4'" 1 
ATOM   2504 O  "O4'" . DT  C 3  12  ? 14.935  -8.300  23.497  1.00 59.57 ? 12  DT  D "O4'" 1 
ATOM   2505 C  "C3'" . DT  C 3  12  ? 15.323  -7.549  25.723  1.00 57.69 ? 12  DT  D "C3'" 1 
ATOM   2506 O  "O3'" . DT  C 3  12  ? 15.639  -6.200  25.953  1.00 55.04 ? 12  DT  D "O3'" 1 
ATOM   2507 C  "C2'" . DT  C 3  12  ? 13.840  -7.681  25.482  1.00 58.92 ? 12  DT  D "C2'" 1 
ATOM   2508 C  "C1'" . DT  C 3  12  ? 13.691  -7.850  23.987  1.00 59.71 ? 12  DT  D "C1'" 1 
ATOM   2509 N  N1    . DT  C 3  12  ? 12.735  -8.914  23.736  1.00 61.10 ? 12  DT  D N1    1 
ATOM   2510 C  C2    . DT  C 3  12  ? 11.735  -8.724  22.811  1.00 62.72 ? 12  DT  D C2    1 
ATOM   2511 O  O2    . DT  C 3  12  ? 11.632  -7.703  22.143  1.00 64.23 ? 12  DT  D O2    1 
ATOM   2512 N  N3    . DT  C 3  12  ? 10.851  -9.778  22.697  1.00 62.09 ? 12  DT  D N3    1 
ATOM   2513 C  C4    . DT  C 3  12  ? 10.892  -10.969 23.406  1.00 62.72 ? 12  DT  D C4    1 
ATOM   2514 O  O4    . DT  C 3  12  ? 10.050  -11.828 23.210  1.00 64.25 ? 12  DT  D O4    1 
ATOM   2515 C  C5    . DT  C 3  12  ? 11.981  -11.097 24.351  1.00 62.69 ? 12  DT  D C5    1 
ATOM   2516 C  C7    . DT  C 3  12  ? 12.096  -12.344 25.163  1.00 62.36 ? 12  DT  D C7    1 
ATOM   2517 C  C6    . DT  C 3  12  ? 12.841  -10.082 24.457  1.00 61.81 ? 12  DT  D C6    1 
ATOM   2518 P  P     . DT  C 3  13  ? 15.492  -5.646  27.433  1.00 55.00 ? 13  DT  D P     1 
ATOM   2519 O  OP1   . DT  C 3  13  ? 16.354  -4.437  27.616  1.00 54.60 ? 13  DT  D OP1   1 
ATOM   2520 O  OP2   . DT  C 3  13  ? 15.685  -6.834  28.317  1.00 55.43 ? 13  DT  D OP2   1 
ATOM   2521 O  "O5'" . DT  C 3  13  ? 13.950  -5.231  27.528  1.00 51.26 ? 13  DT  D "O5'" 1 
ATOM   2522 C  "C5'" . DT  C 3  13  ? 13.558  -3.871  27.434  1.00 46.36 ? 13  DT  D "C5'" 1 
ATOM   2523 C  "C4'" . DT  C 3  13  ? 12.786  -3.486  28.668  1.00 45.22 ? 13  DT  D "C4'" 1 
ATOM   2524 O  "O4'" . DT  C 3  13  ? 11.576  -4.276  28.693  1.00 41.38 ? 13  DT  D "O4'" 1 
ATOM   2525 C  "C3'" . DT  C 3  13  ? 13.509  -3.800  29.983  1.00 44.35 ? 13  DT  D "C3'" 1 
ATOM   2526 O  "O3'" . DT  C 3  13  ? 13.106  -2.859  30.946  1.00 48.02 ? 13  DT  D "O3'" 1 
ATOM   2527 C  "C2'" . DT  C 3  13  ? 12.925  -5.136  30.395  1.00 41.14 ? 13  DT  D "C2'" 1 
ATOM   2528 C  "C1'" . DT  C 3  13  ? 11.498  -4.955  29.926  1.00 38.20 ? 13  DT  D "C1'" 1 
ATOM   2529 N  N1    . DT  C 3  13  ? 10.759  -6.181  29.680  1.00 34.41 ? 13  DT  D N1    1 
ATOM   2530 C  C2    . DT  C 3  13  ? 9.525   -6.280  30.297  1.00 31.94 ? 13  DT  D C2    1 
ATOM   2531 O  O2    . DT  C 3  13  ? 9.079   -5.385  31.007  1.00 29.35 ? 13  DT  D O2    1 
ATOM   2532 N  N3    . DT  C 3  13  ? 8.844   -7.437  30.023  1.00 28.92 ? 13  DT  D N3    1 
ATOM   2533 C  C4    . DT  C 3  13  ? 9.281   -8.473  29.179  1.00 30.50 ? 13  DT  D C4    1 
ATOM   2534 O  O4    . DT  C 3  13  ? 8.560   -9.448  28.977  1.00 27.18 ? 13  DT  D O4    1 
ATOM   2535 C  C5    . DT  C 3  13  ? 10.600  -8.284  28.579  1.00 30.37 ? 13  DT  D C5    1 
ATOM   2536 C  C7    . DT  C 3  13  ? 11.150  -9.337  27.677  1.00 30.63 ? 13  DT  D C7    1 
ATOM   2537 C  C6    . DT  C 3  13  ? 11.259  -7.164  28.861  1.00 31.63 ? 13  DT  D C6    1 
ATOM   2538 P  P     . DG  C 3  14  ? 14.166  -1.830  31.541  1.00 51.95 ? 14  DG  D P     1 
ATOM   2539 O  OP1   . DG  C 3  14  ? 14.232  -0.721  30.558  1.00 54.04 ? 14  DG  D OP1   1 
ATOM   2540 O  OP2   . DG  C 3  14  ? 15.395  -2.580  31.891  1.00 52.81 ? 14  DG  D OP2   1 
ATOM   2541 O  "O5'" . DG  C 3  14  ? 13.473  -1.286  32.857  1.00 49.97 ? 14  DG  D "O5'" 1 
ATOM   2542 C  "C5'" . DG  C 3  14  ? 12.119  -1.583  33.131  1.00 47.73 ? 14  DG  D "C5'" 1 
ATOM   2543 C  "C4'" . DG  C 3  14  ? 11.622  -0.715  34.260  1.00 45.69 ? 14  DG  D "C4'" 1 
ATOM   2544 O  "O4'" . DG  C 3  14  ? 10.220  -0.974  34.471  1.00 43.62 ? 14  DG  D "O4'" 1 
ATOM   2545 C  "C3'" . DG  C 3  14  ? 12.280  -0.947  35.616  1.00 46.18 ? 14  DG  D "C3'" 1 
ATOM   2546 O  "O3'" . DG  C 3  14  ? 12.221  0.305   36.305  1.00 48.18 ? 14  DG  D "O3'" 1 
ATOM   2547 C  "C2'" . DG  C 3  14  ? 11.400  -2.018  36.251  1.00 44.86 ? 14  DG  D "C2'" 1 
ATOM   2548 C  "C1'" . DG  C 3  14  ? 10.019  -1.706  35.676  1.00 42.47 ? 14  DG  D "C1'" 1 
ATOM   2549 N  N9    . DG  C 3  14  ? 9.114   -2.811  35.356  1.00 39.87 ? 14  DG  D N9    1 
ATOM   2550 C  C8    . DG  C 3  14  ? 7.741   -2.771  35.486  1.00 37.65 ? 14  DG  D C8    1 
ATOM   2551 N  N7    . DG  C 3  14  ? 7.149   -3.845  35.036  1.00 34.48 ? 14  DG  D N7    1 
ATOM   2552 C  C5    . DG  C 3  14  ? 8.180   -4.663  34.612  1.00 33.38 ? 14  DG  D C5    1 
ATOM   2553 C  C6    . DG  C 3  14  ? 8.125   -5.954  34.041  1.00 34.07 ? 14  DG  D C6    1 
ATOM   2554 O  O6    . DG  C 3  14  ? 7.136   -6.627  33.791  1.00 31.18 ? 14  DG  D O6    1 
ATOM   2555 N  N1    . DG  C 3  14  ? 9.404   -6.446  33.750  1.00 33.46 ? 14  DG  D N1    1 
ATOM   2556 C  C2    . DG  C 3  14  ? 10.577  -5.749  33.982  1.00 33.16 ? 14  DG  D C2    1 
ATOM   2557 N  N2    . DG  C 3  14  ? 11.687  -6.369  33.625  1.00 30.82 ? 14  DG  D N2    1 
ATOM   2558 N  N3    . DG  C 3  14  ? 10.634  -4.533  34.524  1.00 33.88 ? 14  DG  D N3    1 
ATOM   2559 C  C4    . DG  C 3  14  ? 9.410   -4.056  34.811  1.00 36.01 ? 14  DG  D C4    1 
ATOM   2560 P  P     . DG  C 3  15  ? 12.798  0.448   37.799  1.00 51.20 ? 15  DG  D P     1 
ATOM   2561 O  OP1   . DG  C 3  15  ? 12.835  1.934   38.019  1.00 49.85 ? 15  DG  D OP1   1 
ATOM   2562 O  OP2   . DG  C 3  15  ? 14.012  -0.376  38.006  1.00 48.71 ? 15  DG  D OP2   1 
ATOM   2563 O  "O5'" . DG  C 3  15  ? 11.644  -0.123  38.736  1.00 50.72 ? 15  DG  D "O5'" 1 
ATOM   2564 C  "C5'" . DG  C 3  15  ? 10.412  0.583   38.891  1.00 49.68 ? 15  DG  D "C5'" 1 
ATOM   2565 C  "C4'" . DG  C 3  15  ? 9.419   -0.258  39.660  1.00 47.75 ? 15  DG  D "C4'" 1 
ATOM   2566 O  "O4'" . DG  C 3  15  ? 9.106   -1.435  38.879  1.00 46.58 ? 15  DG  D "O4'" 1 
ATOM   2567 C  "C3'" . DG  C 3  15  ? 9.903   -0.774  41.017  1.00 47.31 ? 15  DG  D "C3'" 1 
ATOM   2568 O  "O3'" . DG  C 3  15  ? 8.906   -0.592  41.998  1.00 49.69 ? 15  DG  D "O3'" 1 
ATOM   2569 C  "C2'" . DG  C 3  15  ? 10.015  -2.273  40.829  1.00 46.21 ? 15  DG  D "C2'" 1 
ATOM   2570 C  "C1'" . DG  C 3  15  ? 8.966   -2.518  39.769  1.00 44.86 ? 15  DG  D "C1'" 1 
ATOM   2571 N  N9    . DG  C 3  15  ? 9.125   -3.759  39.015  1.00 43.31 ? 15  DG  D N9    1 
ATOM   2572 C  C8    . DG  C 3  15  ? 10.306  -4.385  38.702  1.00 41.97 ? 15  DG  D C8    1 
ATOM   2573 N  N7    . DG  C 3  15  ? 10.137  -5.521  38.083  1.00 41.06 ? 15  DG  D N7    1 
ATOM   2574 C  C5    . DG  C 3  15  ? 8.761   -5.646  37.964  1.00 39.50 ? 15  DG  D C5    1 
ATOM   2575 C  C6    . DG  C 3  15  ? 7.999   -6.688  37.416  1.00 36.88 ? 15  DG  D C6    1 
ATOM   2576 O  O6    . DG  C 3  15  ? 8.403   -7.726  36.899  1.00 33.08 ? 15  DG  D O6    1 
ATOM   2577 N  N1    . DG  C 3  15  ? 6.632   -6.431  37.516  1.00 35.37 ? 15  DG  D N1    1 
ATOM   2578 C  C2    . DG  C 3  15  ? 6.076   -5.301  38.054  1.00 36.27 ? 15  DG  D C2    1 
ATOM   2579 N  N2    . DG  C 3  15  ? 4.710   -5.221  38.014  1.00 32.43 ? 15  DG  D N2    1 
ATOM   2580 N  N3    . DG  C 3  15  ? 6.793   -4.314  38.583  1.00 37.09 ? 15  DG  D N3    1 
ATOM   2581 C  C4    . DG  C 3  15  ? 8.117   -4.558  38.510  1.00 40.68 ? 15  DG  D C4    1 
HETATM 2582 ZN ZN    . ZN  D 4  .   ? -11.914 -4.960  15.189  1.00 27.81 ? 101 ZN  L ZN    1 
HETATM 2583 N  N     . 0G6 E 5  .   ? 12.891  21.542  7.656   1.00 18.65 ? 301 0G6 H N     1 
HETATM 2584 C  CA    . 0G6 E 5  .   ? 13.171  20.983  6.353   1.00 18.13 ? 301 0G6 H CA    1 
HETATM 2585 C  C     . 0G6 E 5  .   ? 12.110  19.808  6.571   1.00 17.97 ? 301 0G6 H C     1 
HETATM 2586 O  O     . 0G6 E 5  .   ? 10.963  19.653  6.990   1.00 15.94 ? 301 0G6 H O     1 
HETATM 2587 C  CB    . 0G6 E 5  .   ? 12.514  21.846  5.267   1.00 20.87 ? 301 0G6 H CB    1 
HETATM 2588 C  CG    . 0G6 E 5  .   ? 12.639  21.268  3.873   1.00 18.79 ? 301 0G6 H CG    1 
HETATM 2589 C  CD1   . 0G6 E 5  .   ? 11.496  20.923  3.190   1.00 17.00 ? 301 0G6 H CD1   1 
HETATM 2590 C  CD2   . 0G6 E 5  .   ? 13.888  21.117  3.295   1.00 17.40 ? 301 0G6 H CD2   1 
HETATM 2591 C  CE1   . 0G6 E 5  .   ? 11.594  20.433  1.901   1.00 17.90 ? 301 0G6 H CE1   1 
HETATM 2592 C  CE2   . 0G6 E 5  .   ? 13.980  20.620  2.004   1.00 17.53 ? 301 0G6 H CE2   1 
HETATM 2593 C  CZ    . 0G6 E 5  .   ? 12.832  20.281  1.301   1.00 15.86 ? 301 0G6 H CZ    1 
HETATM 2594 N  N1    . 0G6 E 5  .   ? 12.446  18.710  6.075   1.00 26.51 ? 301 0G6 H N1    1 
HETATM 2595 C  CA1   . 0G6 E 5  .   ? 11.748  17.415  6.179   1.00 26.22 ? 301 0G6 H CA1   1 
HETATM 2596 C  C1    . 0G6 E 5  .   ? 11.628  16.977  7.639   1.00 26.01 ? 301 0G6 H C1    1 
HETATM 2597 O  O1    . 0G6 E 5  .   ? 12.510  17.274  8.447   1.00 22.03 ? 301 0G6 H O1    1 
HETATM 2598 C  CB1   . 0G6 E 5  .   ? 12.667  16.407  5.478   1.00 27.84 ? 301 0G6 H CB1   1 
HETATM 2599 C  CG1   . 0G6 E 5  .   ? 13.603  17.289  4.646   1.00 25.22 ? 301 0G6 H CG1   1 
HETATM 2600 C  CD    . 0G6 E 5  .   ? 13.810  18.495  5.567   1.00 26.14 ? 301 0G6 H CD    1 
HETATM 2601 N  N2    . 0G6 E 5  .   ? 10.528  16.298  7.948   1.00 22.75 ? 301 0G6 H N2    1 
HETATM 2602 C  CA2   . 0G6 E 5  .   ? 10.310  15.761  9.299   1.00 22.82 ? 301 0G6 H CA2   1 
HETATM 2603 C  C2    . 0G6 E 5  .   ? 10.261  14.229  9.348   1.00 24.10 ? 301 0G6 H C2    1 
HETATM 2604 O  O2    . 0G6 E 5  .   ? 10.299  13.676  10.661  1.00 22.97 ? 301 0G6 H O2    1 
HETATM 2605 C  CB2   . 0G6 E 5  .   ? 9.000   16.338  9.894   1.00 24.00 ? 301 0G6 H CB2   1 
HETATM 2606 C  CG2   . 0G6 E 5  .   ? 9.112   17.828  10.234  1.00 21.54 ? 301 0G6 H CG2   1 
HETATM 2607 C  CD3   . 0G6 E 5  .   ? 7.756   18.431  10.627  1.00 21.42 ? 301 0G6 H CD3   1 
HETATM 2608 N  NE    . 0G6 E 5  .   ? 7.961   19.810  11.100  1.00 19.30 ? 301 0G6 H NE    1 
HETATM 2609 C  CZ1   . 0G6 E 5  .   ? 6.988   20.661  11.427  1.00 21.71 ? 301 0G6 H CZ1   1 
HETATM 2610 N  NH1   . 0G6 E 5  .   ? 7.289   21.862  11.921  1.00 21.52 ? 301 0G6 H NH1   1 
HETATM 2611 N  NH2   . 0G6 E 5  .   ? 5.708   20.315  11.330  1.00 20.39 ? 301 0G6 H NH2   1 
HETATM 2612 C  C3    . 0G6 E 5  .   ? 11.203  13.592  8.322   1.00 21.77 ? 301 0G6 H C3    1 
HETATM 2613 C  C1    . NAG F 6  .   ? 18.607  3.463   -3.389  1.00 52.56 ? 302 NAG H C1    1 
HETATM 2614 C  C2    . NAG F 6  .   ? 18.712  4.116   -4.775  1.00 55.62 ? 302 NAG H C2    1 
HETATM 2615 C  C3    . NAG F 6  .   ? 18.205  3.079   -5.818  1.00 58.27 ? 302 NAG H C3    1 
HETATM 2616 C  C4    . NAG F 6  .   ? 19.121  1.852   -5.748  1.00 58.33 ? 302 NAG H C4    1 
HETATM 2617 C  C5    . NAG F 6  .   ? 18.989  1.277   -4.318  1.00 58.30 ? 302 NAG H C5    1 
HETATM 2618 C  C6    . NAG F 6  .   ? 19.826  0.039   -4.053  1.00 57.77 ? 302 NAG H C6    1 
HETATM 2619 C  C7    . NAG F 6  .   ? 18.516  6.546   -4.961  1.00 56.74 ? 302 NAG H C7    1 
HETATM 2620 C  C8    . NAG F 6  .   ? 19.806  6.848   -4.183  1.00 56.76 ? 302 NAG H C8    1 
HETATM 2621 N  N2    . NAG F 6  .   ? 17.935  5.348   -4.805  1.00 56.17 ? 302 NAG H N2    1 
HETATM 2622 O  O3    . NAG F 6  .   ? 18.195  3.609   -7.146  1.00 59.76 ? 302 NAG H O3    1 
HETATM 2623 O  O4    . NAG F 6  .   ? 18.743  0.894   -6.738  1.00 59.67 ? 302 NAG H O4    1 
HETATM 2624 O  O5    . NAG F 6  .   ? 19.402  2.275   -3.340  1.00 55.68 ? 302 NAG H O5    1 
HETATM 2625 O  O6    . NAG F 6  .   ? 19.851  -0.253  -2.659  1.00 58.84 ? 302 NAG H O6    1 
HETATM 2626 O  O7    . NAG F 6  .   ? 18.031  7.434   -5.686  1.00 56.42 ? 302 NAG H O7    1 
HETATM 2627 NA NA    . NA  G 7  .   ? 3.434   27.773  13.955  1.00 49.36 ? 303 NA  H NA    1 
HETATM 2628 ZN ZN    . ZN  H 4  .   ? 26.261  6.488   2.955   1.00 40.25 ? 304 ZN  H ZN    1 
HETATM 2629 CL CL    . CL  I 8  .   ? 28.111  4.261   4.229   1.00 22.52 ? 305 CL  H CL    1 
HETATM 2630 CL CL    . CL  J 8  .   ? 24.164  4.581   2.919   1.00 40.63 ? 306 CL  H CL    1 
HETATM 2631 K  K     . K   K 9  .   ? 7.016   -9.107  34.887  1.00 31.63 ? 101 K   D K     1 
HETATM 2632 O  O     . HOH L 10 .   ? -15.048 7.954   21.418  1.00 25.53 ? 201 HOH L O     1 
HETATM 2633 O  O     . HOH L 10 .   ? -11.859 0.030   13.892  1.00 28.94 ? 202 HOH L O     1 
HETATM 2634 O  O     . HOH L 10 .   ? -11.699 16.046  13.232  1.00 30.10 ? 203 HOH L O     1 
HETATM 2635 O  O     . HOH L 10 .   ? -11.342 10.028  28.181  1.00 43.19 ? 204 HOH L O     1 
HETATM 2636 O  O     . HOH L 10 .   ? -16.552 26.605  15.519  1.00 58.22 ? 205 HOH L O     1 
HETATM 2637 O  O     . HOH L 10 .   ? -14.042 22.699  22.602  1.00 65.81 ? 206 HOH L O     1 
HETATM 2638 O  O     . HOH L 10 .   ? -19.358 25.274  9.737   1.00 37.80 ? 207 HOH L O     1 
HETATM 2639 O  O     . HOH L 10 .   ? -12.335 23.588  18.586  1.00 40.64 ? 208 HOH L O     1 
HETATM 2640 O  O     . HOH L 10 .   ? -8.970  -3.767  8.346   1.00 48.19 ? 209 HOH L O     1 
HETATM 2641 O  O     . HOH L 10 .   ? -11.607 -6.906  11.697  1.00 36.90 ? 210 HOH L O     1 
HETATM 2642 O  O     . HOH M 10 .   ? -5.500  19.682  -3.437  1.00 34.45 ? 401 HOH H O     1 
HETATM 2643 O  O     . HOH M 10 .   ? -8.660  1.336   21.615  1.00 19.97 ? 402 HOH H O     1 
HETATM 2644 O  O     . HOH M 10 .   ? -1.997  -6.141  21.206  1.00 25.29 ? 403 HOH H O     1 
HETATM 2645 O  O     . HOH M 10 .   ? -3.063  11.443  15.147  1.00 23.89 ? 404 HOH H O     1 
HETATM 2646 O  O     . HOH M 10 .   ? 13.827  19.599  9.038   1.00 22.22 ? 405 HOH H O     1 
HETATM 2647 O  O     . HOH M 10 .   ? -4.618  9.228   16.102  1.00 18.86 ? 406 HOH H O     1 
HETATM 2648 O  O     . HOH M 10 .   ? 3.224   15.711  -0.761  1.00 20.55 ? 407 HOH H O     1 
HETATM 2649 O  O     . HOH M 10 .   ? 6.847   17.930  -8.104  1.00 23.66 ? 408 HOH H O     1 
HETATM 2650 O  O     . HOH M 10 .   ? 10.477  21.121  10.764  1.00 27.49 ? 409 HOH H O     1 
HETATM 2651 O  O     . HOH M 10 .   ? 4.870   27.931  7.001   1.00 23.86 ? 410 HOH H O     1 
HETATM 2652 O  O     . HOH M 10 .   ? -10.199 2.898   4.641   1.00 28.29 ? 411 HOH H O     1 
HETATM 2653 O  O     . HOH M 10 .   ? 14.443  7.900   8.542   1.00 26.05 ? 412 HOH H O     1 
HETATM 2654 O  O     . HOH M 10 .   ? 7.951   26.387  12.634  1.00 26.93 ? 413 HOH H O     1 
HETATM 2655 O  O     . HOH M 10 .   ? 4.723   10.450  14.307  1.00 29.80 ? 414 HOH H O     1 
HETATM 2656 O  O     . HOH M 10 .   ? 3.236   1.438   18.074  1.00 19.17 ? 415 HOH H O     1 
HETATM 2657 O  O     . HOH M 10 .   ? 10.930  20.424  -9.184  1.00 35.18 ? 416 HOH H O     1 
HETATM 2658 O  O     . HOH M 10 .   ? 15.534  18.643  -0.668  1.00 28.09 ? 417 HOH H O     1 
HETATM 2659 O  O     . HOH M 10 .   ? 2.430   27.738  16.290  1.00 35.33 ? 418 HOH H O     1 
HETATM 2660 O  O     . HOH M 10 .   ? -2.788  1.175   21.883  1.00 25.99 ? 419 HOH H O     1 
HETATM 2661 O  O     . HOH M 10 .   ? 11.384  9.715   -6.394  1.00 37.87 ? 420 HOH H O     1 
HETATM 2662 O  O     . HOH M 10 .   ? -6.499  13.985  2.235   1.00 27.31 ? 421 HOH H O     1 
HETATM 2663 O  O     . HOH M 10 .   ? 21.234  0.704   8.738   1.00 46.57 ? 422 HOH H O     1 
HETATM 2664 O  O     . HOH M 10 .   ? -7.367  -10.476 16.763  1.00 19.06 ? 423 HOH H O     1 
HETATM 2665 O  O     . HOH M 10 .   ? -19.061 15.482  0.901   1.00 33.79 ? 424 HOH H O     1 
HETATM 2666 O  O     . HOH M 10 .   ? -7.381  27.825  10.242  1.00 26.68 ? 425 HOH H O     1 
HETATM 2667 O  O     . HOH M 10 .   ? 2.824   6.195   24.748  1.00 33.92 ? 426 HOH H O     1 
HETATM 2668 O  O     . HOH M 10 .   ? -5.508  28.565  11.819  1.00 27.07 ? 427 HOH H O     1 
HETATM 2669 O  O     . HOH M 10 .   ? -6.527  9.568   18.323  1.00 34.77 ? 428 HOH H O     1 
HETATM 2670 O  O     . HOH M 10 .   ? 0.967   33.379  5.349   1.00 34.24 ? 429 HOH H O     1 
HETATM 2671 O  O     . HOH M 10 .   ? 14.397  3.584   -0.843  1.00 44.71 ? 430 HOH H O     1 
HETATM 2672 O  O     . HOH M 10 .   ? -0.039  26.511  16.368  1.00 24.78 ? 431 HOH H O     1 
HETATM 2673 O  O     . HOH M 10 .   ? 6.966   26.091  6.357   1.00 34.62 ? 432 HOH H O     1 
HETATM 2674 O  O     . HOH M 10 .   ? 14.186  25.620  4.102   1.00 60.44 ? 433 HOH H O     1 
HETATM 2675 O  O     . HOH M 10 .   ? 5.795   -8.311  9.502   1.00 54.14 ? 434 HOH H O     1 
HETATM 2676 O  O     . HOH M 10 .   ? -14.889 27.009  9.185   1.00 46.15 ? 435 HOH H O     1 
HETATM 2677 O  O     . HOH M 10 .   ? -8.428  19.527  -0.553  1.00 48.90 ? 436 HOH H O     1 
HETATM 2678 O  O     . HOH M 10 .   ? 4.936   17.103  1.162   1.00 16.27 ? 437 HOH H O     1 
HETATM 2679 O  O     . HOH M 10 .   ? -7.274  -6.936  23.633  1.00 27.78 ? 438 HOH H O     1 
HETATM 2680 O  O     . HOH M 10 .   ? 10.221  24.868  -3.560  1.00 34.95 ? 439 HOH H O     1 
HETATM 2681 O  O     . HOH M 10 .   ? -1.303  31.855  17.938  1.00 37.61 ? 440 HOH H O     1 
HETATM 2682 O  O     . HOH M 10 .   ? -6.295  2.878   -7.884  1.00 31.95 ? 441 HOH H O     1 
HETATM 2683 O  O     . HOH M 10 .   ? -0.789  1.054   17.784  1.00 24.04 ? 442 HOH H O     1 
HETATM 2684 O  O     . HOH M 10 .   ? 13.170  -8.181  4.873   1.00 51.36 ? 443 HOH H O     1 
HETATM 2685 O  O     . HOH M 10 .   ? -0.118  21.777  -7.599  1.00 34.56 ? 444 HOH H O     1 
HETATM 2686 O  O     . HOH M 10 .   ? 3.955   18.801  9.504   1.00 22.61 ? 445 HOH H O     1 
HETATM 2687 O  O     . HOH M 10 .   ? -3.502  -6.633  1.241   1.00 54.67 ? 446 HOH H O     1 
HETATM 2688 O  O     . HOH M 10 .   ? -2.951  4.260   21.752  1.00 28.10 ? 447 HOH H O     1 
HETATM 2689 O  O     . HOH M 10 .   ? 1.670   30.657  14.449  1.00 32.75 ? 448 HOH H O     1 
HETATM 2690 O  O     . HOH M 10 .   ? 5.744   35.761  17.501  1.00 51.80 ? 449 HOH H O     1 
HETATM 2691 O  O     . HOH M 10 .   ? 10.796  29.640  2.747   1.00 33.32 ? 450 HOH H O     1 
HETATM 2692 O  O     . HOH M 10 .   ? 12.285  -5.857  8.202   1.00 25.37 ? 451 HOH H O     1 
HETATM 2693 O  O     . HOH M 10 .   ? 13.581  -1.975  18.257  1.00 50.09 ? 452 HOH H O     1 
HETATM 2694 O  O     . HOH M 10 .   ? 1.858   24.769  13.641  1.00 33.65 ? 453 HOH H O     1 
HETATM 2695 O  O     . HOH M 10 .   ? -1.724  23.320  21.763  1.00 58.51 ? 454 HOH H O     1 
HETATM 2696 O  O     . HOH M 10 .   ? 4.591   6.798   15.631  1.00 20.44 ? 455 HOH H O     1 
HETATM 2697 O  O     . HOH M 10 .   ? 1.004   7.561   7.745   1.00 17.84 ? 456 HOH H O     1 
HETATM 2698 O  O     . HOH M 10 .   ? -17.308 9.232   -5.673  1.00 58.84 ? 457 HOH H O     1 
HETATM 2699 O  O     . HOH M 10 .   ? 3.784   28.078  -3.479  1.00 35.83 ? 458 HOH H O     1 
HETATM 2700 O  O     . HOH M 10 .   ? 13.770  16.268  24.634  1.00 55.56 ? 459 HOH H O     1 
HETATM 2701 O  O     . HOH M 10 .   ? 13.044  29.179  18.268  1.00 59.54 ? 460 HOH H O     1 
HETATM 2702 O  O     . HOH M 10 .   ? 18.740  19.350  -4.367  1.00 55.11 ? 461 HOH H O     1 
HETATM 2703 O  O     . HOH M 10 .   ? 25.788  2.696   3.269   1.00 20.13 ? 462 HOH H O     1 
HETATM 2704 O  O     . HOH M 10 .   ? 6.480   13.758  20.355  1.00 23.92 ? 463 HOH H O     1 
HETATM 2705 O  O     . HOH M 10 .   ? 1.003   27.385  13.122  1.00 24.98 ? 464 HOH H O     1 
HETATM 2706 O  O     . HOH M 10 .   ? 4.124   17.724  23.313  1.00 27.90 ? 465 HOH H O     1 
HETATM 2707 O  O     . HOH M 10 .   ? 13.543  22.044  13.598  1.00 40.81 ? 466 HOH H O     1 
HETATM 2708 O  O     . HOH M 10 .   ? 8.033   -10.160 11.173  1.00 38.45 ? 467 HOH H O     1 
HETATM 2709 O  O     . HOH M 10 .   ? 5.263   25.455  12.282  1.00 43.03 ? 468 HOH H O     1 
HETATM 2710 O  O     . HOH M 10 .   ? 20.353  -7.059  12.973  1.00 49.18 ? 469 HOH H O     1 
HETATM 2711 O  O     . HOH M 10 .   ? 12.931  14.496  11.086  1.00 49.16 ? 470 HOH H O     1 
HETATM 2712 O  O     . HOH M 10 .   ? 6.879   20.570  23.941  1.00 37.49 ? 471 HOH H O     1 
HETATM 2713 O  O     . HOH M 10 .   ? -8.341  6.945   29.073  1.00 46.49 ? 472 HOH H O     1 
HETATM 2714 O  O     . HOH M 10 .   ? -17.815 8.485   20.462  1.00 44.57 ? 473 HOH H O     1 
HETATM 2715 O  O     . HOH M 10 .   ? 6.283   9.234   15.915  1.00 29.75 ? 474 HOH H O     1 
HETATM 2716 O  O     . HOH M 10 .   ? -7.608  1.442   6.253   1.00 24.35 ? 475 HOH H O     1 
HETATM 2717 O  O     . HOH M 10 .   ? 17.547  19.618  3.065   1.00 38.59 ? 476 HOH H O     1 
HETATM 2718 O  O     . HOH M 10 .   ? 9.394   2.089   -4.624  1.00 35.29 ? 477 HOH H O     1 
HETATM 2719 O  O     . HOH M 10 .   ? 9.781   24.534  19.137  1.00 52.28 ? 478 HOH H O     1 
HETATM 2720 O  O     . HOH M 10 .   ? -1.261  24.244  -4.147  1.00 32.41 ? 479 HOH H O     1 
HETATM 2721 O  O     . HOH M 10 .   ? 13.342  22.632  10.420  1.00 38.22 ? 480 HOH H O     1 
HETATM 2722 O  O     . HOH M 10 .   ? 1.354   21.655  12.078  1.00 26.70 ? 481 HOH H O     1 
HETATM 2723 O  O     . HOH M 10 .   ? -4.238  23.855  3.347   1.00 26.87 ? 482 HOH H O     1 
HETATM 2724 O  O     . HOH M 10 .   ? -6.546  22.432  2.067   1.00 34.32 ? 483 HOH H O     1 
HETATM 2725 O  O     . HOH M 10 .   ? -3.364  9.412   -6.992  1.00 37.74 ? 484 HOH H O     1 
HETATM 2726 O  O     . HOH M 10 .   ? -0.750  3.055   20.444  1.00 36.41 ? 485 HOH H O     1 
HETATM 2727 O  O     . HOH M 10 .   ? -7.172  -6.144  7.626   1.00 31.13 ? 486 HOH H O     1 
HETATM 2728 O  O     . HOH M 10 .   ? -8.568  -8.566  6.707   1.00 63.98 ? 487 HOH H O     1 
HETATM 2729 O  O     . HOH M 10 .   ? -10.210 7.765   -6.769  1.00 58.09 ? 488 HOH H O     1 
HETATM 2730 O  O     . HOH M 10 .   ? 11.659  9.991   16.901  1.00 47.02 ? 489 HOH H O     1 
HETATM 2731 O  O     . HOH M 10 .   ? 16.180  20.982  5.715   1.00 32.93 ? 490 HOH H O     1 
HETATM 2732 O  O     . HOH M 10 .   ? -7.950  3.948   27.827  1.00 27.24 ? 491 HOH H O     1 
HETATM 2733 O  O     . HOH M 10 .   ? 4.335   2.692   -7.252  1.00 36.59 ? 492 HOH H O     1 
HETATM 2734 O  O     . HOH M 10 .   ? 19.431  -1.395  10.031  1.00 43.26 ? 493 HOH H O     1 
HETATM 2735 O  O     . HOH M 10 .   ? 0.468   -12.343 18.161  1.00 46.13 ? 494 HOH H O     1 
HETATM 2736 O  O     . HOH M 10 .   ? 4.795   8.221   -12.747 1.00 48.40 ? 495 HOH H O     1 
HETATM 2737 O  O     . HOH M 10 .   ? 2.403   8.244   -10.997 1.00 40.59 ? 496 HOH H O     1 
HETATM 2738 O  O     . HOH M 10 .   ? -10.729 25.966  14.286  1.00 38.38 ? 497 HOH H O     1 
HETATM 2739 O  O     . HOH M 10 .   ? -13.222 27.266  14.598  1.00 44.92 ? 498 HOH H O     1 
HETATM 2740 O  O     . HOH M 10 .   ? -14.497 16.733  -4.755  1.00 42.26 ? 499 HOH H O     1 
HETATM 2741 O  O     . HOH M 10 .   ? -0.886  13.367  -8.286  1.00 50.19 ? 500 HOH H O     1 
HETATM 2742 O  O     . HOH M 10 .   ? -10.483 3.092   1.797   1.00 41.89 ? 501 HOH H O     1 
HETATM 2743 O  O     . HOH M 10 .   ? 5.943   -12.874 4.226   1.00 48.40 ? 502 HOH H O     1 
HETATM 2744 O  O     . HOH M 10 .   ? 4.661   -13.890 2.149   1.00 49.15 ? 503 HOH H O     1 
HETATM 2745 O  O     . HOH M 10 .   ? 4.602   -12.585 0.042   1.00 27.62 ? 504 HOH H O     1 
HETATM 2746 O  O     . HOH M 10 .   ? -2.580  -7.677  23.085  1.00 35.93 ? 505 HOH H O     1 
HETATM 2747 O  O     . HOH M 10 .   ? -7.897  -4.595  27.235  1.00 37.18 ? 506 HOH H O     1 
HETATM 2748 O  O     . HOH M 10 .   ? 4.914   28.868  -1.308  1.00 29.35 ? 507 HOH H O     1 
HETATM 2749 O  O     . HOH M 10 .   ? 5.437   32.772  -1.028  1.00 42.04 ? 508 HOH H O     1 
HETATM 2750 O  O     . HOH M 10 .   ? 15.156  12.786  -8.076  1.00 31.61 ? 509 HOH H O     1 
HETATM 2751 O  O     . HOH M 10 .   ? 6.986   25.523  9.385   1.00 32.85 ? 510 HOH H O     1 
HETATM 2752 O  O     . HOH M 10 .   ? 8.510   33.098  13.453  1.00 30.73 ? 511 HOH H O     1 
HETATM 2753 O  O     . HOH M 10 .   ? -2.200  -8.120  18.649  1.00 38.89 ? 512 HOH H O     1 
HETATM 2754 O  O     . HOH M 10 .   ? 7.377   -5.196  19.448  1.00 36.56 ? 513 HOH H O     1 
HETATM 2755 O  O     . HOH M 10 .   ? 4.459   -9.664  17.054  1.00 38.28 ? 514 HOH H O     1 
HETATM 2756 O  O     . HOH M 10 .   ? 6.845   -8.133  20.190  1.00 37.74 ? 515 HOH H O     1 
HETATM 2757 O  O     . HOH M 10 .   ? 25.223  1.597   5.204   1.00 38.10 ? 516 HOH H O     1 
HETATM 2758 O  O     . HOH M 10 .   ? 1.246   -13.301 11.651  1.00 50.13 ? 517 HOH H O     1 
HETATM 2759 O  O     . HOH M 10 .   ? -1.971  3.843   23.754  1.00 37.04 ? 518 HOH H O     1 
HETATM 2760 O  O     . HOH M 10 .   ? 23.126  17.773  -6.149  1.00 54.67 ? 519 HOH H O     1 
HETATM 2761 O  O     . HOH M 10 .   ? 7.217   31.636  -3.486  1.00 44.91 ? 520 HOH H O     1 
HETATM 2762 O  O     . HOH M 10 .   ? -3.760  6.276   29.804  1.00 49.33 ? 521 HOH H O     1 
HETATM 2763 O  O     . HOH M 10 .   ? 18.021  18.956  -2.128  1.00 53.32 ? 522 HOH H O     1 
HETATM 2764 O  O     . HOH M 10 .   ? -8.485  31.863  10.790  1.00 60.19 ? 523 HOH H O     1 
HETATM 2765 O  O     . HOH M 10 .   ? -9.438  27.242  18.740  1.00 38.93 ? 524 HOH H O     1 
HETATM 2766 O  O     . HOH M 10 .   ? 2.650   18.418  -8.371  1.00 38.23 ? 525 HOH H O     1 
HETATM 2767 O  O     . HOH M 10 .   ? 15.330  21.648  -1.384  1.00 44.34 ? 526 HOH H O     1 
HETATM 2768 O  O     . HOH M 10 .   ? -0.599  9.997   -7.751  1.00 46.64 ? 527 HOH H O     1 
HETATM 2769 O  O     . HOH M 10 .   ? 10.102  -2.506  22.456  1.00 33.21 ? 528 HOH H O     1 
HETATM 2770 O  O     . HOH M 10 .   ? 19.540  19.620  4.795   1.00 53.41 ? 529 HOH H O     1 
HETATM 2771 O  O     . HOH M 10 .   ? 9.343   8.752   15.559  1.00 42.69 ? 530 HOH H O     1 
HETATM 2772 O  O     . HOH M 10 .   ? 0.128   15.491  29.152  1.00 39.66 ? 531 HOH H O     1 
HETATM 2773 O  O     . HOH M 10 .   ? 15.201  10.321  -8.153  1.00 57.80 ? 532 HOH H O     1 
HETATM 2774 O  O     . HOH M 10 .   ? 2.926   33.982  7.929   1.00 50.24 ? 533 HOH H O     1 
HETATM 2775 O  O     . HOH M 10 .   ? 14.150  24.109  7.217   1.00 38.99 ? 534 HOH H O     1 
HETATM 2776 O  O     . HOH M 10 .   ? 4.479   -14.221 18.288  1.00 58.60 ? 535 HOH H O     1 
HETATM 2777 O  O     . HOH M 10 .   ? 11.828  11.915  10.929  1.00 40.61 ? 536 HOH H O     1 
HETATM 2778 O  O     . HOH M 10 .   ? 3.637   -9.845  21.757  1.00 43.65 ? 537 HOH H O     1 
HETATM 2779 O  O     . HOH M 10 .   ? 11.063  -1.162  24.612  1.00 41.85 ? 538 HOH H O     1 
HETATM 2780 O  O     . HOH M 10 .   ? 19.594  4.565   4.818   1.00 50.58 ? 539 HOH H O     1 
HETATM 2781 O  O     . HOH M 10 .   ? -10.212 -6.896  25.477  1.00 51.36 ? 540 HOH H O     1 
HETATM 2782 O  O     . HOH M 10 .   ? 12.827  24.338  -2.760  1.00 53.07 ? 541 HOH H O     1 
HETATM 2783 O  O     . HOH M 10 .   ? -2.022  26.528  22.865  1.00 46.46 ? 542 HOH H O     1 
HETATM 2784 O  O     . HOH M 10 .   ? -6.287  -0.006  -7.810  1.00 41.15 ? 543 HOH H O     1 
HETATM 2785 O  O     . HOH M 10 .   ? 13.631  28.508  6.098   1.00 51.88 ? 544 HOH H O     1 
HETATM 2786 O  O     . HOH M 10 .   ? -3.196  -8.902  20.661  1.00 46.36 ? 545 HOH H O     1 
HETATM 2787 O  O     . HOH M 10 .   ? 9.213   -0.776  -4.830  1.00 40.49 ? 546 HOH H O     1 
HETATM 2788 O  O     . HOH M 10 .   ? 2.921   -0.293  32.083  1.00 43.03 ? 547 HOH H O     1 
HETATM 2789 O  O     . HOH N 10 .   ? 6.268   -7.755  31.431  1.00 24.01 ? 201 HOH D O     1 
HETATM 2790 O  O     . HOH N 10 .   ? -8.064  -6.243  37.142  1.00 40.40 ? 202 HOH D O     1 
HETATM 2791 O  O     . HOH N 10 .   ? -5.515  -0.586  36.973  1.00 59.39 ? 203 HOH D O     1 
HETATM 2792 O  O     . HOH N 10 .   ? 15.754  -7.152  30.793  1.00 51.45 ? 204 HOH D O     1 
HETATM 2793 O  O     . HOH N 10 .   ? 14.992  -5.844  37.239  1.00 37.09 ? 205 HOH D O     1 
HETATM 2794 O  O     . HOH N 10 .   ? 0.519   -20.291 29.142  1.00 64.90 ? 206 HOH D O     1 
HETATM 2795 O  O     . HOH N 10 .   ? -5.429  -11.450 30.850  1.00 43.11 ? 207 HOH D O     1 
HETATM 2796 O  O     . HOH N 10 .   ? -6.202  -6.879  33.517  1.00 32.98 ? 208 HOH D O     1 
HETATM 2797 O  O     . HOH N 10 .   ? 2.003   -17.390 36.171  1.00 35.79 ? 209 HOH D O     1 
HETATM 2798 O  O     . HOH N 10 .   ? 1.372   -15.087 36.817  1.00 43.16 ? 210 HOH D O     1 
HETATM 2799 O  O     . HOH N 10 .   ? 5.630   -1.536  38.771  1.00 44.09 ? 211 HOH D O     1 
HETATM 2800 O  O     . HOH N 10 .   ? -3.047  -9.213  33.949  1.00 40.87 ? 212 HOH D O     1 
HETATM 2801 O  O     . HOH N 10 .   ? 22.498  -8.654  42.841  1.00 42.74 ? 213 HOH D O     1 
HETATM 2802 O  O     . HOH N 10 .   ? 8.267   -11.386 37.992  1.00 33.39 ? 214 HOH D O     1 
HETATM 2803 O  O     . HOH N 10 .   ? 1.154   -9.747  41.174  1.00 38.77 ? 215 HOH D O     1 
HETATM 2804 O  O     . HOH N 10 .   ? 10.697  -17.082 32.795  1.00 45.59 ? 216 HOH D O     1 
HETATM 2805 O  O     . HOH N 10 .   ? -7.518  -10.934 30.541  1.00 47.96 ? 217 HOH D O     1 
HETATM 2806 O  O     . HOH N 10 .   ? -9.887  -6.559  34.903  1.00 48.47 ? 218 HOH D O     1 
HETATM 2807 O  O     . HOH N 10 .   ? 3.902   -21.492 35.976  1.00 62.67 ? 219 HOH D O     1 
HETATM 2808 O  O     . HOH N 10 .   ? 8.969   -14.597 41.478  1.00 41.86 ? 220 HOH D O     1 
HETATM 2809 O  O     . HOH N 10 .   ? 14.138  -8.495  43.156  1.00 50.42 ? 221 HOH D O     1 
HETATM 2810 O  O     . HOH N 10 .   ? 20.777  -10.850 35.870  1.00 45.51 ? 222 HOH D O     1 
HETATM 2811 O  O     . HOH N 10 .   ? 15.010  -5.953  33.238  1.00 54.59 ? 223 HOH D O     1 
HETATM 2812 O  O     . HOH N 10 .   ? -1.593  -11.666 33.025  1.00 59.34 ? 224 HOH D O     1 
HETATM 2813 O  O     . HOH N 10 .   ? 3.664   -3.297  40.825  1.00 69.48 ? 225 HOH D O     1 
HETATM 2814 O  O     . HOH N 10 .   ? 1.135   -22.671 33.586  1.00 56.31 ? 226 HOH D O     1 
# 
