data_9E3Z
# 
_entry.id   9E3Z 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_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   9E3Z         pdb_00009e3z 10.2210/pdb9e3z/pdb 
WWPDB D_1000289391 ?            ?                   
BMRB  31211        ?            10.13018/BMR31211   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-01-08 ? 
2 'Structure model' 2 0 2025-01-15 ? 
3 'Structure model' 2 1 2025-03-19 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Atomic model'        
2 2 'Structure model' 'Data collection'     
3 3 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' atom_site       
2 2 'Structure model' chem_comp_atom  
3 2 'Structure model' chem_comp_bond  
4 3 'Structure model' citation        
5 3 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1  2 'Structure model' '_atom_site.B_iso_or_equiv'         
2  2 'Structure model' '_atom_site.Cartn_x'                
3  2 'Structure model' '_atom_site.Cartn_y'                
4  2 'Structure model' '_atom_site.Cartn_z'                
5  2 'Structure model' '_atom_site.auth_atom_id'           
6  2 'Structure model' '_atom_site.label_atom_id'          
7  2 'Structure model' '_chem_comp_atom.atom_id'           
8  2 'Structure model' '_chem_comp_bond.atom_id_2'         
9  3 'Structure model' '_citation.journal_volume'          
10 3 'Structure model' '_citation.year'                    
11 3 'Structure model' '_citation_author.identifier_ORCID' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_mr                  . 
_pdbx_database_status.entry_id                        9E3Z 
_pdbx_database_status.recvd_initial_deposition_date   2024-10-24 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  . 
_pdbx_database_status.status_code_nmr_data            REL 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_database_related.db_name        BMRB 
_pdbx_database_related.details        
;Backbone Modification in the Fungal Defensin Plectasin: Calpha-methyl-residues in the helix, D- and Calpha-methyl-residues in the turns
;
_pdbx_database_related.db_id          31211 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              horne@pitt.edu 
_pdbx_contact_author.name_first         William 
_pdbx_contact_author.name_last          Horne 
_pdbx_contact_author.name_mi            Seth 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2927-1739 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Harmon, T.W.'   1 ? 
'Song, J.'       2 ? 
'Gulewicz, A.J.' 3 ? 
'Di, Y.P.'       4 ? 
'Horne, W.S.'    5 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   GE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Chembiochem 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1439-7633 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            26 
_citation.language                  ? 
_citation.page_first                e202400951 
_citation.page_last                 e202400951 
_citation.title                     
'Structural and Functional Mimicry of the Antimicrobial Defensin Plectasin by Analogues with Engineered Backbone Composition.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/cbic.202400951 
_citation.pdbx_database_id_PubMed   39714882 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Harmon, T.W.'   1 ?                   
primary 'Song, J.'       2 ?                   
primary 'Gulewicz, A.J.' 3 ?                   
primary 'Di, Y.P.'       4 ?                   
primary 'Horne, W.S.'    5 0000-0003-2927-1739 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 syn 
_entity.pdbx_description           'Fungal defensin plectasin variant NZ2114' 
_entity.formula_weight             4471.198 
_entity.pdbx_number_of_molecules   1 
_entity.pdbx_ec                    ? 
_entity.pdbx_mutation              ? 
_entity.pdbx_fragment              ? 
_entity.details                    ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       'GFGCNG(6ZS)WNEDD(2ML)RCH(AIB)HC(A1BEB)SIP(DPR)YKGGYCAK(DPR)GFVCKCY(NH2)' 
_entity_poly.pdbx_seq_one_letter_code_can   GFGCNGXWNEDDLRCHAHCXSIPPYKGGYCAKPGFVCKCYX 
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1  GLY   n 
1 2  PHE   n 
1 3  GLY   n 
1 4  CYS   n 
1 5  ASN   n 
1 6  GLY   n 
1 7  6ZS   n 
1 8  TRP   n 
1 9  ASN   n 
1 10 GLU   n 
1 11 ASP   n 
1 12 ASP   n 
1 13 2ML   n 
1 14 ARG   n 
1 15 CYS   n 
1 16 HIS   n 
1 17 AIB   n 
1 18 HIS   n 
1 19 CYS   n 
1 20 A1BEB n 
1 21 SER   n 
1 22 ILE   n 
1 23 PRO   n 
1 24 DPR   n 
1 25 TYR   n 
1 26 LYS   n 
1 27 GLY   n 
1 28 GLY   n 
1 29 TYR   n 
1 30 CYS   n 
1 31 ALA   n 
1 32 LYS   n 
1 33 DPR   n 
1 34 GLY   n 
1 35 PHE   n 
1 36 VAL   n 
1 37 CYS   n 
1 38 LYS   n 
1 39 CYS   n 
1 40 TYR   n 
1 41 NH2   n 
# 
_pdbx_entity_src_syn.entity_id              1 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       41 
_pdbx_entity_src_syn.organism_scientific    'Pseudoplectania nigrella' 
_pdbx_entity_src_syn.organism_common_name   'Ebony cup' 
_pdbx_entity_src_syn.ncbi_taxonomy_id       96584 
_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 
2ML   'L-peptide linking' n 2-METHYLLEUCINE              ? 'C7 H15 N O2'    145.199 
6ZS   'L-peptide linking' . L-isovaline                  ? 'C5 H11 N O2'    117.146 
A1BEB 'L-peptide linking' n 2-Methyllysine               ? 'C7 H16 N2 O2'   160.214 
AIB   'L-peptide linking' n 'ALPHA-AMINOISOBUTYRIC ACID' ? 'C4 H9 N O2'     103.120 
ALA   'L-peptide linking' y ALANINE                      ? 'C3 H7 N O2'     89.093  
ARG   'L-peptide linking' y ARGININE                     ? 'C6 H15 N4 O2 1' 175.209 
ASN   'L-peptide linking' y ASPARAGINE                   ? 'C4 H8 N2 O3'    132.118 
ASP   'L-peptide linking' y 'ASPARTIC ACID'              ? 'C4 H7 N O4'     133.103 
CYS   'L-peptide linking' y CYSTEINE                     ? 'C3 H7 N O2 S'   121.158 
DPR   'D-peptide linking' . D-PROLINE                    ? 'C5 H9 N O2'     115.130 
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 
ILE   'L-peptide linking' y ISOLEUCINE                   ? 'C6 H13 N O2'    131.173 
LYS   'L-peptide linking' y LYSINE                       ? 'C6 H15 N2 O2 1' 147.195 
MET   'L-peptide linking' y METHIONINE                   ? 'C5 H11 N O2 S'  149.211 
NH2   non-polymer         . 'AMINO GROUP'                ? 'H2 N'           16.023  
PHE   'L-peptide linking' y PHENYLALANINE                ? 'C9 H11 N O2'    165.189 
PRO   'L-peptide linking' y PROLINE                      ? 'C5 H9 N O2'     115.130 
SER   'L-peptide linking' y SERINE                       ? 'C3 H7 N O3'     105.093 
TRP   'L-peptide linking' y TRYPTOPHAN                   ? 'C11 H12 N2 O2'  204.225 
TYR   'L-peptide linking' y TYROSINE                     ? 'C9 H11 N O3'    181.189 
VAL   'L-peptide linking' y VALINE                       ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  GLY   1  1  1  GLY   GLY A . n 
A 1 2  PHE   2  2  2  PHE   PHE A . n 
A 1 3  GLY   3  3  3  GLY   GLY A . n 
A 1 4  CYS   4  4  4  CYS   CYS A . n 
A 1 5  ASN   5  5  5  ASN   ASN A . n 
A 1 6  GLY   6  6  6  GLY   GLY A . n 
A 1 7  6ZS   7  7  7  6ZS   IVA A . n 
A 1 8  TRP   8  8  8  TRP   TRP A . n 
A 1 9  ASN   9  9  9  ASN   ASN A . n 
A 1 10 GLU   10 10 10 GLU   GLU A . n 
A 1 11 ASP   11 11 11 ASP   ASP A . n 
A 1 12 ASP   12 12 12 ASP   ASP A . n 
A 1 13 2ML   13 13 13 2ML   AML A . n 
A 1 14 ARG   14 14 14 ARG   ARG A . n 
A 1 15 CYS   15 15 15 CYS   CYS A . n 
A 1 16 HIS   16 16 16 HIS   HIS A . n 
A 1 17 AIB   17 17 17 AIB   AIB A . n 
A 1 18 HIS   18 18 18 HIS   HIS A . n 
A 1 19 CYS   19 19 19 CYS   CYS A . n 
A 1 20 A1BEB 20 20 20 A1BEB AMK A . n 
A 1 21 SER   21 21 21 SER   SER A . n 
A 1 22 ILE   22 22 22 ILE   ILE A . n 
A 1 23 PRO   23 23 23 PRO   PRO A . n 
A 1 24 DPR   24 24 24 DPR   DPR A . n 
A 1 25 TYR   25 25 25 TYR   TYR A . n 
A 1 26 LYS   26 26 26 LYS   LYS A . n 
A 1 27 GLY   27 27 27 GLY   GLY A . n 
A 1 28 GLY   28 28 28 GLY   GLY A . n 
A 1 29 TYR   29 29 29 TYR   TYR A . n 
A 1 30 CYS   30 30 30 CYS   CYS A . n 
A 1 31 ALA   31 31 31 ALA   ALA A . n 
A 1 32 LYS   32 32 32 LYS   LYS A . n 
A 1 33 DPR   33 33 33 DPR   DPR A . n 
A 1 34 GLY   34 34 34 GLY   GLY A . n 
A 1 35 PHE   35 35 35 PHE   PHE A . n 
A 1 36 VAL   36 36 36 VAL   VAL A . n 
A 1 37 CYS   37 37 37 CYS   CYS A . n 
A 1 38 LYS   38 38 38 LYS   LYS A . n 
A 1 39 CYS   39 39 39 CYS   CYS A . n 
A 1 40 TYR   40 40 40 TYR   TYR A . n 
A 1 41 NH2   41 41 41 NH2   NH2 A . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 AIB   ? ? AIB   ? ? 'SUBJECT OF INVESTIGATION' ? 
2 A1BEB ? ? A1BEB ? ? 'SUBJECT OF INVESTIGATION' ? 
3 2ML   ? ? 2ML   ? ? 'SUBJECT OF INVESTIGATION' ? 
4 DPR   ? ? DPR   ? ? 'SUBJECT OF INVESTIGATION' ? 
5 6ZS   ? ? 6ZS   ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9E3Z 
_exptl.crystals_number            ? 
_exptl.details                    ? 
_exptl.method                     'SOLUTION NMR' 
_exptl.method_details             ? 
# 
_struct.entry_id                     9E3Z 
_struct.title                        
;Backbone Modification in the Fungal Defensin Plectasin: Calpha-methyl-residues in the helix, D- and Calpha-methyl-residues in the turns
;
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9E3Z 
_struct_keywords.text            'plectasin derivative, defensin, antibiotic, proteomimetic, ANTIMICROBIAL PROTEIN' 
_struct_keywords.pdbx_keywords   'ANTIMICROBIAL PROTEIN' 
# 
_struct_asym.id                            A 
_struct_asym.pdbx_blank_PDB_chainid_flag   N 
_struct_asym.pdbx_modified                 N 
_struct_asym.entity_id                     1 
_struct_asym.details                       ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    DEFPL_PSENR 
_struct_ref.pdbx_db_accession          Q53I06 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   GFGCNGPWDEDDMQCHNHCKSIKGYKGGYCAKGGFVCKCY 
_struct_ref.pdbx_align_begin           56 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9E3Z 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 40 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q53I06 
_struct_ref_seq.db_align_beg                  56 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  95 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       40 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9E3Z 6ZS A 7  ? UNP Q53I06 PRO 62 variant   7  1 
1 9E3Z ASN A 9  ? UNP Q53I06 ASP 64 variant   9  2 
1 9E3Z 2ML A 13 ? UNP Q53I06 MET 68 variant   13 3 
1 9E3Z ARG A 14 ? UNP Q53I06 GLN 69 variant   14 4 
1 9E3Z AIB A 17 ? UNP Q53I06 ASN 72 variant   17 5 
1 9E3Z PRO A 23 ? UNP Q53I06 LYS 78 variant   23 6 
1 9E3Z DPR A 24 ? UNP Q53I06 GLY 79 variant   24 7 
1 9E3Z DPR A 33 ? UNP Q53I06 GLY 88 variant   33 8 
1 9E3Z NH2 A 41 ? UNP Q53I06 ?   ?  amidation 41 9 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                'not applicable' 
# 
_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]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 GLY A 6  ? GLU A 10 ? GLY A 6  GLU A 10 5 ? 5  
HELX_P HELX_P2 AA2 ASP A 11 ? SER A 21 ? ASP A 11 SER A 21 1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ?    ? A CYS   4  SG ? ? ? 1_555 A CYS   30 SG ? ? A CYS   4  A CYS   30 1_555 ? ? ? ? ? ? ? 2.026 ? ? 
disulf2  disulf ?    ? A CYS   15 SG ? ? ? 1_555 A CYS   37 SG ? ? A CYS   15 A CYS   37 1_555 ? ? ? ? ? ? ? 2.029 ? ? 
disulf3  disulf ?    ? A CYS   19 SG ? ? ? 1_555 A CYS   39 SG ? ? A CYS   19 A CYS   39 1_555 ? ? ? ? ? ? ? 2.027 ? ? 
covale1  covale both ? A GLY   6  C  ? ? ? 1_555 A 6ZS   7  N  ? ? A GLY   6  A 6ZS   7  1_555 ? ? ? ? ? ? ? 1.332 ? ? 
covale2  covale both ? A 6ZS   7  C  ? ? ? 1_555 A TRP   8  N  ? ? A 6ZS   7  A TRP   8  1_555 ? ? ? ? ? ? ? 1.322 ? ? 
covale3  covale both ? A ASP   12 C  ? ? ? 1_555 A 2ML   13 N  ? ? A ASP   12 A 2ML   13 1_555 ? ? ? ? ? ? ? 1.332 ? ? 
covale4  covale both ? A 2ML   13 C  ? ? ? 1_555 A ARG   14 N  ? ? A 2ML   13 A ARG   14 1_555 ? ? ? ? ? ? ? 1.328 ? ? 
covale5  covale both ? A HIS   16 C  ? ? ? 1_555 A AIB   17 N  ? ? A HIS   16 A AIB   17 1_555 ? ? ? ? ? ? ? 1.336 ? ? 
covale6  covale both ? A AIB   17 C  ? ? ? 1_555 A HIS   18 N  ? ? A AIB   17 A HIS   18 1_555 ? ? ? ? ? ? ? 1.330 ? ? 
covale7  covale one  ? A CYS   19 C  ? ? ? 1_555 A A1BEB 20 N  ? ? A CYS   19 A A1BEB 20 1_555 ? ? ? ? ? ? ? 1.335 ? ? 
covale8  covale both ? A A1BEB 20 C  ? ? ? 1_555 A SER   21 N  ? ? A A1BEB 20 A SER   21 1_555 ? ? ? ? ? ? ? 1.331 ? ? 
covale9  covale both ? A PRO   23 C  ? ? ? 1_555 A DPR   24 N  ? ? A PRO   23 A DPR   24 1_555 ? ? ? ? ? ? ? 1.335 ? ? 
covale10 covale both ? A DPR   24 C  ? ? ? 1_555 A TYR   25 N  ? ? A DPR   24 A TYR   25 1_555 ? ? ? ? ? ? ? 1.323 ? ? 
covale11 covale both ? A LYS   32 C  ? ? ? 1_555 A DPR   33 N  ? ? A LYS   32 A DPR   33 1_555 ? ? ? ? ? ? ? 1.345 ? ? 
covale12 covale both ? A DPR   33 C  ? ? ? 1_555 A GLY   34 N  ? ? A DPR   33 A GLY   34 1_555 ? ? ? ? ? ? ? 1.328 ? ? 
covale13 covale both ? A TYR   40 C  ? ? ? 1_555 A NH2   41 N  ? ? A TYR   40 A NH2   41 1_555 ? ? ? ? ? ? ? 1.321 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 2ML   A 13 ? .   . .  . 2ML   A 13 ? 1_555 .   . .  . .     .  .  LEU 1 2ML   Methylation 'Named protein modification' 
2 AIB   A 17 ? .   . .  . AIB   A 17 ? 1_555 .   . .  . .     .  .  ALA 1 AIB   Methylation 'Named protein modification' 
3 A1BEB A 20 ? .   . .  . A1BEB A 20 ? 1_555 .   . .  . .     .  .  LYS 1 A1BEB Methylation 'Named protein modification' 
4 6ZS   A 7  ? .   . .  . 6ZS   A 7  ? 1_555 .   . .  . .     .  .  ?   1 6ZS   None        'Non-standard residue'       
5 NH2   A 41 ? TYR A 40 ? NH2   A 41 ? 1_555 TYR A 40 ? 1_555 .  .  TYR 5 NH2   None        'Terminal amidation'         
6 CYS   A 4  ? CYS A 30 ? CYS   A 4  ? 1_555 CYS A 30 ? 1_555 SG SG .   . .     None        'Disulfide bridge'           
7 CYS   A 15 ? CYS A 37 ? CYS   A 15 ? 1_555 CYS A 37 ? 1_555 SG SG .   . .     None        'Disulfide bridge'           
8 CYS   A 19 ? CYS A 39 ? CYS   A 19 ? 1_555 CYS A 39 ? 1_555 SG SG .   . .     None        'Disulfide bridge'           
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   2 
_struct_sheet.details          ? 
# 
_struct_sheet_order.sheet_id     AA1 
_struct_sheet_order.range_id_1   1 
_struct_sheet_order.range_id_2   2 
_struct_sheet_order.offset       ? 
_struct_sheet_order.sense        anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 GLY A 27 ? ALA A 31 ? GLY A 27 ALA A 31 
AA1 2 VAL A 36 ? TYR A 40 ? VAL A 36 TYR A 40 
# 
_pdbx_struct_sheet_hbond.sheet_id                AA1 
_pdbx_struct_sheet_hbond.range_id_1              1 
_pdbx_struct_sheet_hbond.range_id_2              2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id   N 
_pdbx_struct_sheet_hbond.range_1_label_comp_id   ALA 
_pdbx_struct_sheet_hbond.range_1_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_1_label_seq_id    31 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id    N 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id    ALA 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id     31 
_pdbx_struct_sheet_hbond.range_2_label_atom_id   O 
_pdbx_struct_sheet_hbond.range_2_label_comp_id   VAL 
_pdbx_struct_sheet_hbond.range_2_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_2_label_seq_id    36 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id    O 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id    VAL 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id     36 
# 
_pdbx_entry_details.entry_id                   9E3Z 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
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 2 HH A TYR 29 ? ? HD2 A LYS 38 ? ? 1.24 
2 3 HH A TYR 29 ? ? HZ1 A LYS 38 ? ? 1.25 
# 
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  ASN A 9  ? ? -145.47 54.01 
2  1  LYS A 32 ? ? 55.69   74.60 
3  2  LYS A 32 ? ? 54.38   74.01 
4  3  PHE A 2  ? ? -111.13 50.34 
5  3  LYS A 32 ? ? 51.85   76.49 
6  4  PHE A 2  ? ? -90.82  55.06 
7  4  ASN A 9  ? ? -143.72 49.68 
8  4  LYS A 32 ? ? 51.58   75.30 
9  5  LYS A 32 ? ? 56.48   75.80 
10 6  GLU A 10 ? ? -105.03 77.78 
11 7  LYS A 32 ? ? 57.17   74.58 
12 8  ASN A 9  ? ? -145.85 56.17 
13 8  LYS A 32 ? ? 53.23   75.25 
14 9  LYS A 32 ? ? 52.67   76.58 
15 10 LYS A 32 ? ? 53.85   73.66 
# 
_pdbx_struct_mod_residue.id               1 
_pdbx_struct_mod_residue.label_asym_id    A 
_pdbx_struct_mod_residue.label_comp_id    A1BEB 
_pdbx_struct_mod_residue.label_seq_id     20 
_pdbx_struct_mod_residue.auth_asym_id     A 
_pdbx_struct_mod_residue.auth_comp_id     A1BEB 
_pdbx_struct_mod_residue.auth_seq_id      20 
_pdbx_struct_mod_residue.PDB_ins_code     ? 
_pdbx_struct_mod_residue.parent_comp_id   LYS 
_pdbx_struct_mod_residue.details          'modified residue' 
# 
_pdbx_nmr_ensemble.entry_id                                      9E3Z 
_pdbx_nmr_ensemble.conformers_calculated_total_number            100 
_pdbx_nmr_ensemble.conformers_submitted_total_number             10 
_pdbx_nmr_ensemble.conformer_selection_criteria                  'structures with the lowest energy' 
_pdbx_nmr_ensemble.representative_conformer                      ? 
_pdbx_nmr_ensemble.average_constraints_per_residue               ? 
_pdbx_nmr_ensemble.average_constraint_violations_per_residue     ? 
_pdbx_nmr_ensemble.maximum_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.average_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.distance_constraint_violation_method          ? 
_pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.average_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.torsion_angle_constraint_violation_method     ? 
# 
_pdbx_nmr_representative.entry_id             9E3Z 
_pdbx_nmr_representative.conformer_id         1 
_pdbx_nmr_representative.selection_criteria   'lowest energy' 
# 
_pdbx_nmr_sample_details.solution_id      1 
_pdbx_nmr_sample_details.contents         
;0.31 mM Heterogeneous-backbone analogue of plectasin variant NZ2114: Iva7, alpha-Me-Leu13, Aib17, alpha-Me-Lys20, Pro23, D-Pro24, D-Pro33, 20 mM [U-2H] sodium acetate, 0.13 mM 4,4-dimethyl-4-silapentane-1-ammonium trifluoroacetate (DSA), 90% H2O/10% D2O
;
_pdbx_nmr_sample_details.solvent_system   '90% H2O/10% D2O' 
_pdbx_nmr_sample_details.label            sample_1 
_pdbx_nmr_sample_details.type             solution 
_pdbx_nmr_sample_details.details          ? 
# 
loop_
_pdbx_nmr_exptl_sample.solution_id 
_pdbx_nmr_exptl_sample.component 
_pdbx_nmr_exptl_sample.concentration 
_pdbx_nmr_exptl_sample.concentration_range 
_pdbx_nmr_exptl_sample.concentration_units 
_pdbx_nmr_exptl_sample.isotopic_labeling 
1 
'Heterogeneous-backbone analogue of plectasin variant NZ2114: Iva7, alpha-Me-Leu13, Aib17, alpha-Me-Lys20, Pro23, D-Pro24, D-Pro33' 
0.31 ? mM 'natural abundance' 
1 'sodium acetate' 20   ? mM '[U-2H]'            
1 '4,4-dimethyl-4-silapentane-1-ammonium trifluoroacetate (DSA)' 0.13 ? mM 'natural abundance' 
# 
_pdbx_nmr_exptl_sample_conditions.conditions_id          1 
_pdbx_nmr_exptl_sample_conditions.temperature            298 
_pdbx_nmr_exptl_sample_conditions.pressure_units         atm 
_pdbx_nmr_exptl_sample_conditions.pressure               1 
_pdbx_nmr_exptl_sample_conditions.pH                     3.8 
_pdbx_nmr_exptl_sample_conditions.ionic_strength         20 
_pdbx_nmr_exptl_sample_conditions.details                ? 
_pdbx_nmr_exptl_sample_conditions.ionic_strength_err     ? 
_pdbx_nmr_exptl_sample_conditions.ionic_strength_units   mM 
_pdbx_nmr_exptl_sample_conditions.label                  conditions_1 
_pdbx_nmr_exptl_sample_conditions.pH_err                 ? 
_pdbx_nmr_exptl_sample_conditions.pH_units               pH* 
_pdbx_nmr_exptl_sample_conditions.pressure_err           ? 
_pdbx_nmr_exptl_sample_conditions.temperature_err        ? 
_pdbx_nmr_exptl_sample_conditions.temperature_units      K 
# 
loop_
_pdbx_nmr_exptl.experiment_id 
_pdbx_nmr_exptl.conditions_id 
_pdbx_nmr_exptl.solution_id 
_pdbx_nmr_exptl.type 
_pdbx_nmr_exptl.spectrometer_id 
_pdbx_nmr_exptl.sample_state 
1 1 1 '2D 1H-1H TOCSY' 1 isotropic 
2 1 1 '2D 1H-1H COSY'  1 isotropic 
3 1 1 '2D DQF-COSY'    1 isotropic 
4 1 1 '2D 1H-1H NOESY' 1 isotropic 
# 
_pdbx_nmr_refine.entry_id           9E3Z 
_pdbx_nmr_refine.method             'simulated annealing' 
_pdbx_nmr_refine.details            ? 
_pdbx_nmr_refine.software_ordinal   4 
# 
loop_
_pdbx_nmr_software.ordinal 
_pdbx_nmr_software.classification 
_pdbx_nmr_software.name 
_pdbx_nmr_software.version 
_pdbx_nmr_software.authors 
1 processing              TopSpin ? 'Bruker Biospin'                                     
2 'data analysis'         Poky    ? 'Manthey, Tonelli, Clos II, Rahimi, Markley and Lee' 
3 'peak picking'          Poky    ? 'Manthey, Tonelli, Clos II, Rahimi, Markley and Lee' 
4 'structure calculation' ARIA    ? 
;Linge, O'Donoghue and Nilges
;
# 
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 
2ML   N    N N N 1   
2ML   CA   C N S 2   
2ML   CB1  C N N 3   
2ML   CB2  C N N 4   
2ML   CG   C N N 5   
2ML   CD1  C N N 6   
2ML   CD2  C N N 7   
2ML   C    C N N 8   
2ML   O    O N N 9   
2ML   OXT  O N N 10  
2ML   H2   H N N 11  
2ML   H    H N N 12  
2ML   HB11 H N N 13  
2ML   HB12 H N N 14  
2ML   HB21 H N N 15  
2ML   HB22 H N N 16  
2ML   HB23 H N N 17  
2ML   HG   H N N 18  
2ML   HD11 H N N 19  
2ML   HD12 H N N 20  
2ML   HD13 H N N 21  
2ML   HD21 H N N 22  
2ML   HD22 H N N 23  
2ML   HD23 H N N 24  
2ML   HXT  H N N 25  
6ZS   C2   C N N 26  
6ZS   N    N N N 27  
6ZS   CA   C N S 28  
6ZS   CB1  C N N 29  
6ZS   C    C N N 30  
6ZS   O    O N N 31  
6ZS   CB   C N N 32  
6ZS   OXT  O N N 33  
6ZS   H1   H N N 34  
6ZS   H4   H N N 35  
6ZS   H3   H N N 36  
6ZS   H    H N N 37  
6ZS   H2   H N N 38  
6ZS   H7   H N N 39  
6ZS   H8   H N N 40  
6ZS   H9   H N N 41  
6ZS   H10  H N N 42  
6ZS   H11  H N N 43  
6ZS   HXT  H N N 44  
A1BEB N    N N N 45  
A1BEB CA   C N S 46  
A1BEB C    C N N 47  
A1BEB O    O N N 48  
A1BEB CB   C N N 49  
A1BEB CB2  C N N 50  
A1BEB CG   C N N 51  
A1BEB CD   C N N 52  
A1BEB CE   C N N 53  
A1BEB NZ   N N N 54  
A1BEB OXT  O N N 55  
A1BEB H    H N N 56  
A1BEB H2   H N N 57  
A1BEB HB2  H N N 58  
A1BEB HB3  H N N 59  
A1BEB HB23 H N N 60  
A1BEB HB21 H N N 61  
A1BEB HB22 H N N 62  
A1BEB HG3  H N N 63  
A1BEB HG2  H N N 64  
A1BEB HD3  H N N 65  
A1BEB HD2  H N N 66  
A1BEB HE3  H N N 67  
A1BEB HE2  H N N 68  
A1BEB HZ1  H N N 69  
A1BEB HZ2  H N N 70  
A1BEB HXT  H N N 71  
AIB   N    N N N 72  
AIB   CA   C N N 73  
AIB   C    C N N 74  
AIB   O    O N N 75  
AIB   OXT  O N N 76  
AIB   CB1  C N N 77  
AIB   CB2  C N N 78  
AIB   H    H N N 79  
AIB   H2   H N N 80  
AIB   HXT  H N N 81  
AIB   HB11 H N N 82  
AIB   HB12 H N N 83  
AIB   HB13 H N N 84  
AIB   HB21 H N N 85  
AIB   HB22 H N N 86  
AIB   HB23 H N N 87  
ALA   N    N N N 88  
ALA   CA   C N S 89  
ALA   C    C N N 90  
ALA   O    O N N 91  
ALA   CB   C N N 92  
ALA   OXT  O N N 93  
ALA   H    H N N 94  
ALA   H2   H N N 95  
ALA   HA   H N N 96  
ALA   HB1  H N N 97  
ALA   HB2  H N N 98  
ALA   HB3  H N N 99  
ALA   HXT  H N N 100 
ARG   N    N N N 101 
ARG   CA   C N S 102 
ARG   C    C N N 103 
ARG   O    O N N 104 
ARG   CB   C N N 105 
ARG   CG   C N N 106 
ARG   CD   C N N 107 
ARG   NE   N N N 108 
ARG   CZ   C N N 109 
ARG   NH1  N N N 110 
ARG   NH2  N N N 111 
ARG   OXT  O N N 112 
ARG   H    H N N 113 
ARG   H2   H N N 114 
ARG   HA   H N N 115 
ARG   HB2  H N N 116 
ARG   HB3  H N N 117 
ARG   HG2  H N N 118 
ARG   HG3  H N N 119 
ARG   HD2  H N N 120 
ARG   HD3  H N N 121 
ARG   HE   H N N 122 
ARG   HH11 H N N 123 
ARG   HH12 H N N 124 
ARG   HH21 H N N 125 
ARG   HH22 H N N 126 
ARG   HXT  H N N 127 
ASN   N    N N N 128 
ASN   CA   C N S 129 
ASN   C    C N N 130 
ASN   O    O N N 131 
ASN   CB   C N N 132 
ASN   CG   C N N 133 
ASN   OD1  O N N 134 
ASN   ND2  N N N 135 
ASN   OXT  O N N 136 
ASN   H    H N N 137 
ASN   H2   H N N 138 
ASN   HA   H N N 139 
ASN   HB2  H N N 140 
ASN   HB3  H N N 141 
ASN   HD21 H N N 142 
ASN   HD22 H N N 143 
ASN   HXT  H N N 144 
ASP   N    N N N 145 
ASP   CA   C N S 146 
ASP   C    C N N 147 
ASP   O    O N N 148 
ASP   CB   C N N 149 
ASP   CG   C N N 150 
ASP   OD1  O N N 151 
ASP   OD2  O N N 152 
ASP   OXT  O N N 153 
ASP   H    H N N 154 
ASP   H2   H N N 155 
ASP   HA   H N N 156 
ASP   HB2  H N N 157 
ASP   HB3  H N N 158 
ASP   HD2  H N N 159 
ASP   HXT  H N N 160 
CYS   N    N N N 161 
CYS   CA   C N R 162 
CYS   C    C N N 163 
CYS   O    O N N 164 
CYS   CB   C N N 165 
CYS   SG   S N N 166 
CYS   OXT  O N N 167 
CYS   H    H N N 168 
CYS   H2   H N N 169 
CYS   HA   H N N 170 
CYS   HB2  H N N 171 
CYS   HB3  H N N 172 
CYS   HG   H N N 173 
CYS   HXT  H N N 174 
DPR   N    N N N 175 
DPR   CA   C N R 176 
DPR   CB   C N N 177 
DPR   CG   C N N 178 
DPR   CD   C N N 179 
DPR   C    C N N 180 
DPR   O    O N N 181 
DPR   OXT  O N N 182 
DPR   H    H N N 183 
DPR   HA   H N N 184 
DPR   HB2  H N N 185 
DPR   HB3  H N N 186 
DPR   HG2  H N N 187 
DPR   HG3  H N N 188 
DPR   HD2  H N N 189 
DPR   HD3  H N N 190 
DPR   HXT  H N N 191 
GLN   N    N N N 192 
GLN   CA   C N S 193 
GLN   C    C N N 194 
GLN   O    O N N 195 
GLN   CB   C N N 196 
GLN   CG   C N N 197 
GLN   CD   C N N 198 
GLN   OE1  O N N 199 
GLN   NE2  N N N 200 
GLN   OXT  O N N 201 
GLN   H    H N N 202 
GLN   H2   H N N 203 
GLN   HA   H N N 204 
GLN   HB2  H N N 205 
GLN   HB3  H N N 206 
GLN   HG2  H N N 207 
GLN   HG3  H N N 208 
GLN   HE21 H N N 209 
GLN   HE22 H N N 210 
GLN   HXT  H N N 211 
GLU   N    N N N 212 
GLU   CA   C N S 213 
GLU   C    C N N 214 
GLU   O    O N N 215 
GLU   CB   C N N 216 
GLU   CG   C N N 217 
GLU   CD   C N N 218 
GLU   OE1  O N N 219 
GLU   OE2  O N N 220 
GLU   OXT  O N N 221 
GLU   H    H N N 222 
GLU   H2   H N N 223 
GLU   HA   H N N 224 
GLU   HB2  H N N 225 
GLU   HB3  H N N 226 
GLU   HG2  H N N 227 
GLU   HG3  H N N 228 
GLU   HE2  H N N 229 
GLU   HXT  H N N 230 
GLY   N    N N N 231 
GLY   CA   C N N 232 
GLY   C    C N N 233 
GLY   O    O N N 234 
GLY   OXT  O N N 235 
GLY   H    H N N 236 
GLY   H2   H N N 237 
GLY   HA2  H N N 238 
GLY   HA3  H N N 239 
GLY   HXT  H N N 240 
HIS   N    N N N 241 
HIS   CA   C N S 242 
HIS   C    C N N 243 
HIS   O    O N N 244 
HIS   CB   C N N 245 
HIS   CG   C Y N 246 
HIS   ND1  N Y N 247 
HIS   CD2  C Y N 248 
HIS   CE1  C Y N 249 
HIS   NE2  N Y N 250 
HIS   OXT  O N N 251 
HIS   H    H N N 252 
HIS   H2   H N N 253 
HIS   HA   H N N 254 
HIS   HB2  H N N 255 
HIS   HB3  H N N 256 
HIS   HD1  H N N 257 
HIS   HD2  H N N 258 
HIS   HE1  H N N 259 
HIS   HE2  H N N 260 
HIS   HXT  H N N 261 
ILE   N    N N N 262 
ILE   CA   C N S 263 
ILE   C    C N N 264 
ILE   O    O N N 265 
ILE   CB   C N S 266 
ILE   CG1  C N N 267 
ILE   CG2  C N N 268 
ILE   CD1  C N N 269 
ILE   OXT  O N N 270 
ILE   H    H N N 271 
ILE   H2   H N N 272 
ILE   HA   H N N 273 
ILE   HB   H N N 274 
ILE   HG12 H N N 275 
ILE   HG13 H N N 276 
ILE   HG21 H N N 277 
ILE   HG22 H N N 278 
ILE   HG23 H N N 279 
ILE   HD11 H N N 280 
ILE   HD12 H N N 281 
ILE   HD13 H N N 282 
ILE   HXT  H N N 283 
LYS   N    N N N 284 
LYS   CA   C N S 285 
LYS   C    C N N 286 
LYS   O    O N N 287 
LYS   CB   C N N 288 
LYS   CG   C N N 289 
LYS   CD   C N N 290 
LYS   CE   C N N 291 
LYS   NZ   N N N 292 
LYS   OXT  O N N 293 
LYS   H    H N N 294 
LYS   H2   H N N 295 
LYS   HA   H N N 296 
LYS   HB2  H N N 297 
LYS   HB3  H N N 298 
LYS   HG2  H N N 299 
LYS   HG3  H N N 300 
LYS   HD2  H N N 301 
LYS   HD3  H N N 302 
LYS   HE2  H N N 303 
LYS   HE3  H N N 304 
LYS   HZ1  H N N 305 
LYS   HZ2  H N N 306 
LYS   HZ3  H N N 307 
LYS   HXT  H N N 308 
MET   N    N N N 309 
MET   CA   C N S 310 
MET   C    C N N 311 
MET   O    O N N 312 
MET   CB   C N N 313 
MET   CG   C N N 314 
MET   SD   S N N 315 
MET   CE   C N N 316 
MET   OXT  O N N 317 
MET   H    H N N 318 
MET   H2   H N N 319 
MET   HA   H N N 320 
MET   HB2  H N N 321 
MET   HB3  H N N 322 
MET   HG2  H N N 323 
MET   HG3  H N N 324 
MET   HE1  H N N 325 
MET   HE2  H N N 326 
MET   HE3  H N N 327 
MET   HXT  H N N 328 
NH2   N    N N N 329 
NH2   HN1  H N N 330 
NH2   HN2  H N N 331 
PHE   N    N N N 332 
PHE   CA   C N S 333 
PHE   C    C N N 334 
PHE   O    O N N 335 
PHE   CB   C N N 336 
PHE   CG   C Y N 337 
PHE   CD1  C Y N 338 
PHE   CD2  C Y N 339 
PHE   CE1  C Y N 340 
PHE   CE2  C Y N 341 
PHE   CZ   C Y N 342 
PHE   OXT  O N N 343 
PHE   H    H N N 344 
PHE   H2   H N N 345 
PHE   HA   H N N 346 
PHE   HB2  H N N 347 
PHE   HB3  H N N 348 
PHE   HD1  H N N 349 
PHE   HD2  H N N 350 
PHE   HE1  H N N 351 
PHE   HE2  H N N 352 
PHE   HZ   H N N 353 
PHE   HXT  H N N 354 
PRO   N    N N N 355 
PRO   CA   C N S 356 
PRO   C    C N N 357 
PRO   O    O N N 358 
PRO   CB   C N N 359 
PRO   CG   C N N 360 
PRO   CD   C N N 361 
PRO   OXT  O N N 362 
PRO   H    H N N 363 
PRO   HA   H N N 364 
PRO   HB2  H N N 365 
PRO   HB3  H N N 366 
PRO   HG2  H N N 367 
PRO   HG3  H N N 368 
PRO   HD2  H N N 369 
PRO   HD3  H N N 370 
PRO   HXT  H N N 371 
SER   N    N N N 372 
SER   CA   C N S 373 
SER   C    C N N 374 
SER   O    O N N 375 
SER   CB   C N N 376 
SER   OG   O N N 377 
SER   OXT  O N N 378 
SER   H    H N N 379 
SER   H2   H N N 380 
SER   HA   H N N 381 
SER   HB2  H N N 382 
SER   HB3  H N N 383 
SER   HG   H N N 384 
SER   HXT  H N N 385 
TRP   N    N N N 386 
TRP   CA   C N S 387 
TRP   C    C N N 388 
TRP   O    O N N 389 
TRP   CB   C N N 390 
TRP   CG   C Y N 391 
TRP   CD1  C Y N 392 
TRP   CD2  C Y N 393 
TRP   NE1  N Y N 394 
TRP   CE2  C Y N 395 
TRP   CE3  C Y N 396 
TRP   CZ2  C Y N 397 
TRP   CZ3  C Y N 398 
TRP   CH2  C Y N 399 
TRP   OXT  O N N 400 
TRP   H    H N N 401 
TRP   H2   H N N 402 
TRP   HA   H N N 403 
TRP   HB2  H N N 404 
TRP   HB3  H N N 405 
TRP   HD1  H N N 406 
TRP   HE1  H N N 407 
TRP   HE3  H N N 408 
TRP   HZ2  H N N 409 
TRP   HZ3  H N N 410 
TRP   HH2  H N N 411 
TRP   HXT  H N N 412 
TYR   N    N N N 413 
TYR   CA   C N S 414 
TYR   C    C N N 415 
TYR   O    O N N 416 
TYR   CB   C N N 417 
TYR   CG   C Y N 418 
TYR   CD1  C Y N 419 
TYR   CD2  C Y N 420 
TYR   CE1  C Y N 421 
TYR   CE2  C Y N 422 
TYR   CZ   C Y N 423 
TYR   OH   O N N 424 
TYR   OXT  O N N 425 
TYR   H    H N N 426 
TYR   H2   H N N 427 
TYR   HA   H N N 428 
TYR   HB2  H N N 429 
TYR   HB3  H N N 430 
TYR   HD1  H N N 431 
TYR   HD2  H N N 432 
TYR   HE1  H N N 433 
TYR   HE2  H N N 434 
TYR   HH   H N N 435 
TYR   HXT  H N N 436 
VAL   N    N N N 437 
VAL   CA   C N S 438 
VAL   C    C N N 439 
VAL   O    O N N 440 
VAL   CB   C N N 441 
VAL   CG1  C N N 442 
VAL   CG2  C N N 443 
VAL   OXT  O N N 444 
VAL   H    H N N 445 
VAL   H2   H N N 446 
VAL   HA   H N N 447 
VAL   HB   H N N 448 
VAL   HG11 H N N 449 
VAL   HG12 H N N 450 
VAL   HG13 H N N 451 
VAL   HG21 H N N 452 
VAL   HG22 H N N 453 
VAL   HG23 H N N 454 
VAL   HXT  H N N 455 
# 
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 
2ML   N   CA   sing N N 1   
2ML   N   H2   sing N N 2   
2ML   N   H    sing N N 3   
2ML   CA  CB1  sing N N 4   
2ML   CA  CB2  sing N N 5   
2ML   CA  C    sing N N 6   
2ML   CB1 CG   sing N N 7   
2ML   CB1 HB11 sing N N 8   
2ML   CB1 HB12 sing N N 9   
2ML   CB2 HB21 sing N N 10  
2ML   CB2 HB22 sing N N 11  
2ML   CB2 HB23 sing N N 12  
2ML   CG  CD1  sing N N 13  
2ML   CG  CD2  sing N N 14  
2ML   CG  HG   sing N N 15  
2ML   CD1 HD11 sing N N 16  
2ML   CD1 HD12 sing N N 17  
2ML   CD1 HD13 sing N N 18  
2ML   CD2 HD21 sing N N 19  
2ML   CD2 HD22 sing N N 20  
2ML   CD2 HD23 sing N N 21  
2ML   C   O    doub N N 22  
2ML   C   OXT  sing N N 23  
2ML   OXT HXT  sing N N 24  
6ZS   C2  CB   sing N N 25  
6ZS   CB  CA   sing N N 26  
6ZS   CA  CB1  sing N N 27  
6ZS   CA  C    sing N N 28  
6ZS   CA  N    sing N N 29  
6ZS   C   O    doub N N 30  
6ZS   C   OXT  sing N N 31  
6ZS   C2  H1   sing N N 32  
6ZS   C2  H4   sing N N 33  
6ZS   C2  H3   sing N N 34  
6ZS   N   H    sing N N 35  
6ZS   N   H2   sing N N 36  
6ZS   CB1 H7   sing N N 37  
6ZS   CB1 H8   sing N N 38  
6ZS   CB1 H9   sing N N 39  
6ZS   CB  H10  sing N N 40  
6ZS   CB  H11  sing N N 41  
6ZS   OXT HXT  sing N N 42  
A1BEB C   O    doub N N 43  
A1BEB C   CA   sing N N 44  
A1BEB N   CA   sing N N 45  
A1BEB CA  CB2  sing N N 46  
A1BEB CA  CB   sing N N 47  
A1BEB CB  CG   sing N N 48  
A1BEB CG  CD   sing N N 49  
A1BEB NZ  CE   sing N N 50  
A1BEB CD  CE   sing N N 51  
A1BEB C   OXT  sing N N 52  
A1BEB N   H    sing N N 53  
A1BEB N   H2   sing N N 54  
A1BEB CB  HB2  sing N N 55  
A1BEB CB  HB3  sing N N 56  
A1BEB CB2 HB23 sing N N 57  
A1BEB CB2 HB21 sing N N 58  
A1BEB CB2 HB22 sing N N 59  
A1BEB CG  HG3  sing N N 60  
A1BEB CG  HG2  sing N N 61  
A1BEB CD  HD3  sing N N 62  
A1BEB CD  HD2  sing N N 63  
A1BEB CE  HE3  sing N N 64  
A1BEB CE  HE2  sing N N 65  
A1BEB NZ  HZ1  sing N N 66  
A1BEB NZ  HZ2  sing N N 67  
A1BEB OXT HXT  sing N N 68  
AIB   N   CA   sing N N 69  
AIB   N   H    sing N N 70  
AIB   N   H2   sing N N 71  
AIB   CA  C    sing N N 72  
AIB   CA  CB1  sing N N 73  
AIB   CA  CB2  sing N N 74  
AIB   C   O    doub N N 75  
AIB   C   OXT  sing N N 76  
AIB   OXT HXT  sing N N 77  
AIB   CB1 HB11 sing N N 78  
AIB   CB1 HB12 sing N N 79  
AIB   CB1 HB13 sing N N 80  
AIB   CB2 HB21 sing N N 81  
AIB   CB2 HB22 sing N N 82  
AIB   CB2 HB23 sing N N 83  
ALA   N   CA   sing N N 84  
ALA   N   H    sing N N 85  
ALA   N   H2   sing N N 86  
ALA   CA  C    sing N N 87  
ALA   CA  CB   sing N N 88  
ALA   CA  HA   sing N N 89  
ALA   C   O    doub N N 90  
ALA   C   OXT  sing N N 91  
ALA   CB  HB1  sing N N 92  
ALA   CB  HB2  sing N N 93  
ALA   CB  HB3  sing N N 94  
ALA   OXT HXT  sing N N 95  
ARG   N   CA   sing N N 96  
ARG   N   H    sing N N 97  
ARG   N   H2   sing N N 98  
ARG   CA  C    sing N N 99  
ARG   CA  CB   sing N N 100 
ARG   CA  HA   sing N N 101 
ARG   C   O    doub N N 102 
ARG   C   OXT  sing N N 103 
ARG   CB  CG   sing N N 104 
ARG   CB  HB2  sing N N 105 
ARG   CB  HB3  sing N N 106 
ARG   CG  CD   sing N N 107 
ARG   CG  HG2  sing N N 108 
ARG   CG  HG3  sing N N 109 
ARG   CD  NE   sing N N 110 
ARG   CD  HD2  sing N N 111 
ARG   CD  HD3  sing N N 112 
ARG   NE  CZ   sing N N 113 
ARG   NE  HE   sing N N 114 
ARG   CZ  NH1  sing N N 115 
ARG   CZ  NH2  doub N N 116 
ARG   NH1 HH11 sing N N 117 
ARG   NH1 HH12 sing N N 118 
ARG   NH2 HH21 sing N N 119 
ARG   NH2 HH22 sing N N 120 
ARG   OXT HXT  sing N N 121 
ASN   N   CA   sing N N 122 
ASN   N   H    sing N N 123 
ASN   N   H2   sing N N 124 
ASN   CA  C    sing N N 125 
ASN   CA  CB   sing N N 126 
ASN   CA  HA   sing N N 127 
ASN   C   O    doub N N 128 
ASN   C   OXT  sing N N 129 
ASN   CB  CG   sing N N 130 
ASN   CB  HB2  sing N N 131 
ASN   CB  HB3  sing N N 132 
ASN   CG  OD1  doub N N 133 
ASN   CG  ND2  sing N N 134 
ASN   ND2 HD21 sing N N 135 
ASN   ND2 HD22 sing N N 136 
ASN   OXT HXT  sing N N 137 
ASP   N   CA   sing N N 138 
ASP   N   H    sing N N 139 
ASP   N   H2   sing N N 140 
ASP   CA  C    sing N N 141 
ASP   CA  CB   sing N N 142 
ASP   CA  HA   sing N N 143 
ASP   C   O    doub N N 144 
ASP   C   OXT  sing N N 145 
ASP   CB  CG   sing N N 146 
ASP   CB  HB2  sing N N 147 
ASP   CB  HB3  sing N N 148 
ASP   CG  OD1  doub N N 149 
ASP   CG  OD2  sing N N 150 
ASP   OD2 HD2  sing N N 151 
ASP   OXT HXT  sing N N 152 
CYS   N   CA   sing N N 153 
CYS   N   H    sing N N 154 
CYS   N   H2   sing N N 155 
CYS   CA  C    sing N N 156 
CYS   CA  CB   sing N N 157 
CYS   CA  HA   sing N N 158 
CYS   C   O    doub N N 159 
CYS   C   OXT  sing N N 160 
CYS   CB  SG   sing N N 161 
CYS   CB  HB2  sing N N 162 
CYS   CB  HB3  sing N N 163 
CYS   SG  HG   sing N N 164 
CYS   OXT HXT  sing N N 165 
DPR   N   CA   sing N N 166 
DPR   N   CD   sing N N 167 
DPR   N   H    sing N N 168 
DPR   CA  CB   sing N N 169 
DPR   CA  C    sing N N 170 
DPR   CA  HA   sing N N 171 
DPR   CB  CG   sing N N 172 
DPR   CB  HB2  sing N N 173 
DPR   CB  HB3  sing N N 174 
DPR   CG  CD   sing N N 175 
DPR   CG  HG2  sing N N 176 
DPR   CG  HG3  sing N N 177 
DPR   CD  HD2  sing N N 178 
DPR   CD  HD3  sing N N 179 
DPR   C   O    doub N N 180 
DPR   C   OXT  sing N N 181 
DPR   OXT HXT  sing N N 182 
GLN   N   CA   sing N N 183 
GLN   N   H    sing N N 184 
GLN   N   H2   sing N N 185 
GLN   CA  C    sing N N 186 
GLN   CA  CB   sing N N 187 
GLN   CA  HA   sing N N 188 
GLN   C   O    doub N N 189 
GLN   C   OXT  sing N N 190 
GLN   CB  CG   sing N N 191 
GLN   CB  HB2  sing N N 192 
GLN   CB  HB3  sing N N 193 
GLN   CG  CD   sing N N 194 
GLN   CG  HG2  sing N N 195 
GLN   CG  HG3  sing N N 196 
GLN   CD  OE1  doub N N 197 
GLN   CD  NE2  sing N N 198 
GLN   NE2 HE21 sing N N 199 
GLN   NE2 HE22 sing N N 200 
GLN   OXT HXT  sing N N 201 
GLU   N   CA   sing N N 202 
GLU   N   H    sing N N 203 
GLU   N   H2   sing N N 204 
GLU   CA  C    sing N N 205 
GLU   CA  CB   sing N N 206 
GLU   CA  HA   sing N N 207 
GLU   C   O    doub N N 208 
GLU   C   OXT  sing N N 209 
GLU   CB  CG   sing N N 210 
GLU   CB  HB2  sing N N 211 
GLU   CB  HB3  sing N N 212 
GLU   CG  CD   sing N N 213 
GLU   CG  HG2  sing N N 214 
GLU   CG  HG3  sing N N 215 
GLU   CD  OE1  doub N N 216 
GLU   CD  OE2  sing N N 217 
GLU   OE2 HE2  sing N N 218 
GLU   OXT HXT  sing N N 219 
GLY   N   CA   sing N N 220 
GLY   N   H    sing N N 221 
GLY   N   H2   sing N N 222 
GLY   CA  C    sing N N 223 
GLY   CA  HA2  sing N N 224 
GLY   CA  HA3  sing N N 225 
GLY   C   O    doub N N 226 
GLY   C   OXT  sing N N 227 
GLY   OXT HXT  sing N N 228 
HIS   N   CA   sing N N 229 
HIS   N   H    sing N N 230 
HIS   N   H2   sing N N 231 
HIS   CA  C    sing N N 232 
HIS   CA  CB   sing N N 233 
HIS   CA  HA   sing N N 234 
HIS   C   O    doub N N 235 
HIS   C   OXT  sing N N 236 
HIS   CB  CG   sing N N 237 
HIS   CB  HB2  sing N N 238 
HIS   CB  HB3  sing N N 239 
HIS   CG  ND1  sing Y N 240 
HIS   CG  CD2  doub Y N 241 
HIS   ND1 CE1  doub Y N 242 
HIS   ND1 HD1  sing N N 243 
HIS   CD2 NE2  sing Y N 244 
HIS   CD2 HD2  sing N N 245 
HIS   CE1 NE2  sing Y N 246 
HIS   CE1 HE1  sing N N 247 
HIS   NE2 HE2  sing N N 248 
HIS   OXT HXT  sing N N 249 
ILE   N   CA   sing N N 250 
ILE   N   H    sing N N 251 
ILE   N   H2   sing N N 252 
ILE   CA  C    sing N N 253 
ILE   CA  CB   sing N N 254 
ILE   CA  HA   sing N N 255 
ILE   C   O    doub N N 256 
ILE   C   OXT  sing N N 257 
ILE   CB  CG1  sing N N 258 
ILE   CB  CG2  sing N N 259 
ILE   CB  HB   sing N N 260 
ILE   CG1 CD1  sing N N 261 
ILE   CG1 HG12 sing N N 262 
ILE   CG1 HG13 sing N N 263 
ILE   CG2 HG21 sing N N 264 
ILE   CG2 HG22 sing N N 265 
ILE   CG2 HG23 sing N N 266 
ILE   CD1 HD11 sing N N 267 
ILE   CD1 HD12 sing N N 268 
ILE   CD1 HD13 sing N N 269 
ILE   OXT HXT  sing N N 270 
LYS   N   CA   sing N N 271 
LYS   N   H    sing N N 272 
LYS   N   H2   sing N N 273 
LYS   CA  C    sing N N 274 
LYS   CA  CB   sing N N 275 
LYS   CA  HA   sing N N 276 
LYS   C   O    doub N N 277 
LYS   C   OXT  sing N N 278 
LYS   CB  CG   sing N N 279 
LYS   CB  HB2  sing N N 280 
LYS   CB  HB3  sing N N 281 
LYS   CG  CD   sing N N 282 
LYS   CG  HG2  sing N N 283 
LYS   CG  HG3  sing N N 284 
LYS   CD  CE   sing N N 285 
LYS   CD  HD2  sing N N 286 
LYS   CD  HD3  sing N N 287 
LYS   CE  NZ   sing N N 288 
LYS   CE  HE2  sing N N 289 
LYS   CE  HE3  sing N N 290 
LYS   NZ  HZ1  sing N N 291 
LYS   NZ  HZ2  sing N N 292 
LYS   NZ  HZ3  sing N N 293 
LYS   OXT HXT  sing N N 294 
MET   N   CA   sing N N 295 
MET   N   H    sing N N 296 
MET   N   H2   sing N N 297 
MET   CA  C    sing N N 298 
MET   CA  CB   sing N N 299 
MET   CA  HA   sing N N 300 
MET   C   O    doub N N 301 
MET   C   OXT  sing N N 302 
MET   CB  CG   sing N N 303 
MET   CB  HB2  sing N N 304 
MET   CB  HB3  sing N N 305 
MET   CG  SD   sing N N 306 
MET   CG  HG2  sing N N 307 
MET   CG  HG3  sing N N 308 
MET   SD  CE   sing N N 309 
MET   CE  HE1  sing N N 310 
MET   CE  HE2  sing N N 311 
MET   CE  HE3  sing N N 312 
MET   OXT HXT  sing N N 313 
NH2   N   HN1  sing N N 314 
NH2   N   HN2  sing N N 315 
PHE   N   CA   sing N N 316 
PHE   N   H    sing N N 317 
PHE   N   H2   sing N N 318 
PHE   CA  C    sing N N 319 
PHE   CA  CB   sing N N 320 
PHE   CA  HA   sing N N 321 
PHE   C   O    doub N N 322 
PHE   C   OXT  sing N N 323 
PHE   CB  CG   sing N N 324 
PHE   CB  HB2  sing N N 325 
PHE   CB  HB3  sing N N 326 
PHE   CG  CD1  doub Y N 327 
PHE   CG  CD2  sing Y N 328 
PHE   CD1 CE1  sing Y N 329 
PHE   CD1 HD1  sing N N 330 
PHE   CD2 CE2  doub Y N 331 
PHE   CD2 HD2  sing N N 332 
PHE   CE1 CZ   doub Y N 333 
PHE   CE1 HE1  sing N N 334 
PHE   CE2 CZ   sing Y N 335 
PHE   CE2 HE2  sing N N 336 
PHE   CZ  HZ   sing N N 337 
PHE   OXT HXT  sing N N 338 
PRO   N   CA   sing N N 339 
PRO   N   CD   sing N N 340 
PRO   N   H    sing N N 341 
PRO   CA  C    sing N N 342 
PRO   CA  CB   sing N N 343 
PRO   CA  HA   sing N N 344 
PRO   C   O    doub N N 345 
PRO   C   OXT  sing N N 346 
PRO   CB  CG   sing N N 347 
PRO   CB  HB2  sing N N 348 
PRO   CB  HB3  sing N N 349 
PRO   CG  CD   sing N N 350 
PRO   CG  HG2  sing N N 351 
PRO   CG  HG3  sing N N 352 
PRO   CD  HD2  sing N N 353 
PRO   CD  HD3  sing N N 354 
PRO   OXT HXT  sing N N 355 
SER   N   CA   sing N N 356 
SER   N   H    sing N N 357 
SER   N   H2   sing N N 358 
SER   CA  C    sing N N 359 
SER   CA  CB   sing N N 360 
SER   CA  HA   sing N N 361 
SER   C   O    doub N N 362 
SER   C   OXT  sing N N 363 
SER   CB  OG   sing N N 364 
SER   CB  HB2  sing N N 365 
SER   CB  HB3  sing N N 366 
SER   OG  HG   sing N N 367 
SER   OXT HXT  sing N N 368 
TRP   N   CA   sing N N 369 
TRP   N   H    sing N N 370 
TRP   N   H2   sing N N 371 
TRP   CA  C    sing N N 372 
TRP   CA  CB   sing N N 373 
TRP   CA  HA   sing N N 374 
TRP   C   O    doub N N 375 
TRP   C   OXT  sing N N 376 
TRP   CB  CG   sing N N 377 
TRP   CB  HB2  sing N N 378 
TRP   CB  HB3  sing N N 379 
TRP   CG  CD1  doub Y N 380 
TRP   CG  CD2  sing Y N 381 
TRP   CD1 NE1  sing Y N 382 
TRP   CD1 HD1  sing N N 383 
TRP   CD2 CE2  doub Y N 384 
TRP   CD2 CE3  sing Y N 385 
TRP   NE1 CE2  sing Y N 386 
TRP   NE1 HE1  sing N N 387 
TRP   CE2 CZ2  sing Y N 388 
TRP   CE3 CZ3  doub Y N 389 
TRP   CE3 HE3  sing N N 390 
TRP   CZ2 CH2  doub Y N 391 
TRP   CZ2 HZ2  sing N N 392 
TRP   CZ3 CH2  sing Y N 393 
TRP   CZ3 HZ3  sing N N 394 
TRP   CH2 HH2  sing N N 395 
TRP   OXT HXT  sing N N 396 
TYR   N   CA   sing N N 397 
TYR   N   H    sing N N 398 
TYR   N   H2   sing N N 399 
TYR   CA  C    sing N N 400 
TYR   CA  CB   sing N N 401 
TYR   CA  HA   sing N N 402 
TYR   C   O    doub N N 403 
TYR   C   OXT  sing N N 404 
TYR   CB  CG   sing N N 405 
TYR   CB  HB2  sing N N 406 
TYR   CB  HB3  sing N N 407 
TYR   CG  CD1  doub Y N 408 
TYR   CG  CD2  sing Y N 409 
TYR   CD1 CE1  sing Y N 410 
TYR   CD1 HD1  sing N N 411 
TYR   CD2 CE2  doub Y N 412 
TYR   CD2 HD2  sing N N 413 
TYR   CE1 CZ   doub Y N 414 
TYR   CE1 HE1  sing N N 415 
TYR   CE2 CZ   sing Y N 416 
TYR   CE2 HE2  sing N N 417 
TYR   CZ  OH   sing N N 418 
TYR   OH  HH   sing N N 419 
TYR   OXT HXT  sing N N 420 
VAL   N   CA   sing N N 421 
VAL   N   H    sing N N 422 
VAL   N   H2   sing N N 423 
VAL   CA  C    sing N N 424 
VAL   CA  CB   sing N N 425 
VAL   CA  HA   sing N N 426 
VAL   C   O    doub N N 427 
VAL   C   OXT  sing N N 428 
VAL   CB  CG1  sing N N 429 
VAL   CB  CG2  sing N N 430 
VAL   CB  HB   sing N N 431 
VAL   CG1 HG11 sing N N 432 
VAL   CG1 HG12 sing N N 433 
VAL   CG1 HG13 sing N N 434 
VAL   CG2 HG21 sing N N 435 
VAL   CG2 HG22 sing N N 436 
VAL   CG2 HG23 sing N N 437 
VAL   OXT HXT  sing N N 438 
# 
_pdbx_audit_support.funding_organization   
'National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           R35GM149220 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_nmr_spectrometer.spectrometer_id   1 
_pdbx_nmr_spectrometer.model             'AVANCE III' 
_pdbx_nmr_spectrometer.type              ? 
_pdbx_nmr_spectrometer.manufacturer      Bruker 
_pdbx_nmr_spectrometer.field_strength    700 
_pdbx_nmr_spectrometer.details           ? 
# 
_atom_sites.entry_id                    9E3Z 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   1.000000 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   1.000000 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   1.000000 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
H 
N 
O 
S 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N    . GLY   A 1 1  ? 5.527   2.600   -7.727 1.00 1.74 ?  1  GLY   A N    1  
ATOM   2    C CA   . GLY   A 1 1  ? 4.473   1.780   -7.078 1.00 0.89 ?  1  GLY   A CA   1  
ATOM   3    C C    . GLY   A 1 1  ? 3.487   2.626   -6.297 1.00 0.90 ?  1  GLY   A C    1  
ATOM   4    O O    . GLY   A 1 1  ? 3.583   3.855   -6.296 1.00 1.76 ?  1  GLY   A O    1  
ATOM   5    H H1   . GLY   A 1 1  ? 6.158   1.994   -8.289 1.00 2.34 ?  1  GLY   A H1   1  
ATOM   6    H H2   . GLY   A 1 1  ? 6.091   3.093   -7.006 1.00 1.93 ?  1  GLY   A H2   1  
ATOM   7    H H3   . GLY   A 1 1  ? 5.095   3.309   -8.352 1.00 2.29 ?  1  GLY   A H3   1  
ATOM   8    H HA2  . GLY   A 1 1  ? 3.936   1.230   -7.837 1.00 0.93 ?  1  GLY   A HA2  1  
ATOM   9    H HA3  . GLY   A 1 1  ? 4.943   1.080   -6.404 1.00 1.19 ?  1  GLY   A HA3  1  
ATOM   10   N N    . PHE   A 1 2  ? 2.551   1.972   -5.620 1.00 0.43 ?  2  PHE   A N    1  
ATOM   11   C CA   . PHE   A 1 2  ? 1.524   2.663   -4.847 1.00 0.24 ?  2  PHE   A CA   1  
ATOM   12   C C    . PHE   A 1 2  ? 2.019   2.923   -3.434 1.00 0.22 ?  2  PHE   A C    1  
ATOM   13   O O    . PHE   A 1 2  ? 1.445   2.441   -2.459 1.00 0.35 ?  2  PHE   A O    1  
ATOM   14   C CB   . PHE   A 1 2  ? 0.231   1.840   -4.801 1.00 0.16 ?  2  PHE   A CB   1  
ATOM   15   C CG   . PHE   A 1 2  ? -0.337  1.548   -6.156 1.00 0.18 ?  2  PHE   A CG   1  
ATOM   16   C CD1  . PHE   A 1 2  ? -0.271  0.271   -6.693 1.00 0.25 ?  2  PHE   A CD1  1  
ATOM   17   C CD2  . PHE   A 1 2  ? -0.931  2.553   -6.897 1.00 0.22 ?  2  PHE   A CD2  1  
ATOM   18   C CE1  . PHE   A 1 2  ? -0.792  0.006   -7.944 1.00 0.30 ?  2  PHE   A CE1  1  
ATOM   19   C CE2  . PHE   A 1 2  ? -1.452  2.295   -8.148 1.00 0.28 ?  2  PHE   A CE2  1  
ATOM   20   C CZ   . PHE   A 1 2  ? -1.384  1.018   -8.673 1.00 0.29 ?  2  PHE   A CZ   1  
ATOM   21   H H    . PHE   A 1 2  ? 2.562   0.994   -5.627 1.00 1.00 ?  2  PHE   A H    1  
ATOM   22   H HA   . PHE   A 1 2  ? 1.325   3.606   -5.331 1.00 0.34 ?  2  PHE   A HA   1  
ATOM   23   H HB2  . PHE   A 1 2  ? 0.423   0.899   -4.307 1.00 0.26 ?  2  PHE   A HB2  1  
ATOM   24   H HB3  . PHE   A 1 2  ? -0.515  2.386   -4.240 1.00 0.20 ?  2  PHE   A HB3  1  
ATOM   25   H HD1  . PHE   A 1 2  ? 0.191   -0.520  -6.122 1.00 0.32 ?  2  PHE   A HD1  1  
ATOM   26   H HD2  . PHE   A 1 2  ? -0.984  3.551   -6.485 1.00 0.27 ?  2  PHE   A HD2  1  
ATOM   27   H HE1  . PHE   A 1 2  ? -0.734  -0.994  -8.352 1.00 0.37 ?  2  PHE   A HE1  1  
ATOM   28   H HE2  . PHE   A 1 2  ? -1.914  3.089   -8.716 1.00 0.36 ?  2  PHE   A HE2  1  
ATOM   29   H HZ   . PHE   A 1 2  ? -1.791  0.814   -9.652 1.00 0.34 ?  2  PHE   A HZ   1  
ATOM   30   N N    . GLY   A 1 3  ? 3.101   3.674   -3.331 1.00 0.18 ?  3  GLY   A N    1  
ATOM   31   C CA   . GLY   A 1 3  ? 3.705   3.933   -2.045 1.00 0.20 ?  3  GLY   A CA   1  
ATOM   32   C C    . GLY   A 1 3  ? 4.839   2.978   -1.773 1.00 0.19 ?  3  GLY   A C    1  
ATOM   33   O O    . GLY   A 1 3  ? 5.840   3.338   -1.155 1.00 0.21 ?  3  GLY   A O    1  
ATOM   34   H H    . GLY   A 1 3  ? 3.497   4.054   -4.143 1.00 0.21 ?  3  GLY   A H    1  
ATOM   35   H HA2  . GLY   A 1 3  ? 4.082   4.946   -2.027 1.00 0.23 ?  3  GLY   A HA2  1  
ATOM   36   H HA3  . GLY   A 1 3  ? 2.957   3.818   -1.277 1.00 0.24 ?  3  GLY   A HA3  1  
ATOM   37   N N    . CYS   A 1 4  ? 4.678   1.758   -2.248 1.00 0.25 ?  4  CYS   A N    1  
ATOM   38   C CA   . CYS   A 1 4  ? 5.702   0.743   -2.121 1.00 0.27 ?  4  CYS   A CA   1  
ATOM   39   C C    . CYS   A 1 4  ? 6.694   0.857   -3.268 1.00 0.29 ?  4  CYS   A C    1  
ATOM   40   O O    . CYS   A 1 4  ? 6.434   0.385   -4.377 1.00 0.30 ?  4  CYS   A O    1  
ATOM   41   C CB   . CYS   A 1 4  ? 5.065   -0.643  -2.110 1.00 0.28 ?  4  CYS   A CB   1  
ATOM   42   S SG   . CYS   A 1 4  ? 3.888   -0.901  -0.752 1.00 0.39 ?  4  CYS   A SG   1  
ATOM   43   H H    . CYS   A 1 4  ? 3.839   1.531   -2.700 1.00 0.30 ?  4  CYS   A H    1  
ATOM   44   H HA   . CYS   A 1 4  ? 6.223   0.905   -1.189 1.00 0.30 ?  4  CYS   A HA   1  
ATOM   45   H HB2  . CYS   A 1 4  ? 4.538   -0.799  -3.036 1.00 0.21 ?  4  CYS   A HB2  1  
ATOM   46   H HB3  . CYS   A 1 4  ? 5.842   -1.387  -2.015 1.00 0.42 ?  4  CYS   A HB3  1  
ATOM   47   N N    . ASN   A 1 5  ? 7.814   1.514   -3.011 1.00 0.34 ?  5  ASN   A N    1  
ATOM   48   C CA   . ASN   A 1 5  ? 8.838   1.687   -4.027 1.00 0.40 ?  5  ASN   A CA   1  
ATOM   49   C C    . ASN   A 1 5  ? 10.160  1.099   -3.553 1.00 0.40 ?  5  ASN   A C    1  
ATOM   50   O O    . ASN   A 1 5  ? 11.235  1.544   -3.957 1.00 0.47 ?  5  ASN   A O    1  
ATOM   51   C CB   . ASN   A 1 5  ? 9.021   3.169   -4.376 1.00 0.49 ?  5  ASN   A CB   1  
ATOM   52   C CG   . ASN   A 1 5  ? 7.737   3.838   -4.840 1.00 0.49 ?  5  ASN   A CG   1  
ATOM   53   O OD1  . ASN   A 1 5  ? 7.389   3.799   -6.021 1.00 0.65 ?  5  ASN   A OD1  1  
ATOM   54   N ND2  . ASN   A 1 5  ? 7.027   4.467   -3.914 1.00 0.56 ?  5  ASN   A ND2  1  
ATOM   55   H H    . ASN   A 1 5  ? 7.955   1.896   -2.114 1.00 0.36 ?  5  ASN   A H    1  
ATOM   56   H HA   . ASN   A 1 5  ? 8.519   1.152   -4.910 1.00 0.43 ?  5  ASN   A HA   1  
ATOM   57   H HB2  . ASN   A 1 5  ? 9.376   3.692   -3.504 1.00 0.51 ?  5  ASN   A HB2  1  
ATOM   58   H HB3  . ASN   A 1 5  ? 9.755   3.256   -5.163 1.00 0.57 ?  5  ASN   A HB3  1  
ATOM   59   H HD21 . ASN   A 1 5  ? 7.358   4.462   -2.991 1.00 0.70 ?  5  ASN   A HD21 1  
ATOM   60   H HD22 . ASN   A 1 5  ? 6.205   4.921   -4.191 1.00 0.61 ?  5  ASN   A HD22 1  
ATOM   61   N N    . GLY   A 1 6  ? 10.076  0.103   -2.685 1.00 0.36 ?  6  GLY   A N    1  
ATOM   62   C CA   . GLY   A 1 6  ? 11.262  -0.586  -2.230 1.00 0.38 ?  6  GLY   A CA   1  
ATOM   63   C C    . GLY   A 1 6  ? 11.494  -0.449  -0.742 1.00 0.37 ?  6  GLY   A C    1  
ATOM   64   O O    . GLY   A 1 6  ? 10.768  0.269   -0.057 1.00 0.36 ?  6  GLY   A O    1  
ATOM   65   H H    . GLY   A 1 6  ? 9.194   -0.175  -2.350 1.00 0.34 ?  6  GLY   A H    1  
ATOM   66   H HA2  . GLY   A 1 6  ? 11.161  -1.635  -2.468 1.00 0.48 ?  6  GLY   A HA2  1  
ATOM   67   H HA3  . GLY   A 1 6  ? 12.116  -0.191  -2.758 1.00 0.44 ?  6  GLY   A HA3  1  
HETATM 68   C C2   . 6ZS   A 1 7  ? 14.402  -2.971  0.285  1.00 1.49 ?  7  6ZS   A C2   1  
HETATM 69   N N    . 6ZS   A 1 7  ? 12.534  -1.129  -0.262 1.00 0.47 ?  7  6ZS   A N    1  
HETATM 70   C CA   . 6ZS   A 1 7  ? 12.879  -1.183  1.166  1.00 0.61 ?  7  6ZS   A CA   1  
HETATM 71   C CB1  . 6ZS   A 1 7  ? 11.822  -1.951  1.940  1.00 0.71 ?  7  6ZS   A CB1  1  
HETATM 72   C C    . 6ZS   A 1 7  ? 13.016  0.231   1.730  1.00 0.59 ?  7  6ZS   A C    1  
HETATM 73   O O    . 6ZS   A 1 7  ? 12.518  0.539   2.814  1.00 1.09 ?  7  6ZS   A O    1  
HETATM 74   C CB   . 6ZS   A 1 7  ? 14.204  -1.908  1.350  1.00 0.75 ?  7  6ZS   A CB   1  
HETATM 75   H H1   . 6ZS   A 1 7  ? 14.505  -2.500  -0.681 1.00 2.14 ?  7  6ZS   A H1   1  
HETATM 76   H H4   . 6ZS   A 1 7  ? 15.295  -3.538  0.503  1.00 1.94 ?  7  6ZS   A H4   1  
HETATM 77   H H3   . 6ZS   A 1 7  ? 13.550  -3.633  0.272  1.00 2.00 ?  7  6ZS   A H3   1  
HETATM 78   H H    . 6ZS   A 1 7  ? 13.098  -1.619  -0.894 1.00 0.49 ?  7  6ZS   A H    1  
HETATM 79   H H7   . 6ZS   A 1 7  ? 12.132  -2.053  2.969  1.00 1.10 ?  7  6ZS   A H7   1  
HETATM 80   H H8   . 6ZS   A 1 7  ? 11.692  -2.930  1.502  1.00 1.35 ?  7  6ZS   A H8   1  
HETATM 81   H H9   . 6ZS   A 1 7  ? 10.888  -1.412  1.899  1.00 1.26 ?  7  6ZS   A H9   1  
HETATM 82   H H10  . 6ZS   A 1 7  ? 15.017  -1.198  1.274  1.00 1.09 ?  7  6ZS   A H10  1  
HETATM 83   H H11  . 6ZS   A 1 7  ? 14.227  -2.386  2.317  1.00 1.38 ?  7  6ZS   A H11  1  
ATOM   84   N N    . TRP   A 1 8  ? 13.687  1.084   0.976  1.00 0.64 ?  8  TRP   A N    1  
ATOM   85   C CA   . TRP   A 1 8  ? 14.015  2.421   1.440  1.00 0.67 ?  8  TRP   A CA   1  
ATOM   86   C C    . TRP   A 1 8  ? 12.962  3.429   1.002  1.00 0.49 ?  8  TRP   A C    1  
ATOM   87   O O    . TRP   A 1 8  ? 13.131  4.637   1.172  1.00 0.58 ?  8  TRP   A O    1  
ATOM   88   C CB   . TRP   A 1 8  ? 15.393  2.813   0.917  1.00 0.87 ?  8  TRP   A CB   1  
ATOM   89   C CG   . TRP   A 1 8  ? 16.440  1.802   1.263  1.00 1.12 ?  8  TRP   A CG   1  
ATOM   90   C CD1  . TRP   A 1 8  ? 17.004  0.895   0.419  1.00 1.27 ?  8  TRP   A CD1  1  
ATOM   91   C CD2  . TRP   A 1 8  ? 17.025  1.572   2.552  1.00 1.31 ?  8  TRP   A CD2  1  
ATOM   92   N NE1  . TRP   A 1 8  ? 17.911  0.119   1.096  1.00 1.50 ?  8  TRP   A NE1  1  
ATOM   93   C CE2  . TRP   A 1 8  ? 17.942  0.515   2.408  1.00 1.52 ?  8  TRP   A CE2  1  
ATOM   94   C CE3  . TRP   A 1 8  ? 16.867  2.157   3.812  1.00 1.37 ?  8  TRP   A CE3  1  
ATOM   95   C CZ2  . TRP   A 1 8  ? 18.696  0.032   3.474  1.00 1.76 ?  8  TRP   A CZ2  1  
ATOM   96   C CZ3  . TRP   A 1 8  ? 17.616  1.677   4.867  1.00 1.63 ?  8  TRP   A CZ3  1  
ATOM   97   C CH2  . TRP   A 1 8  ? 18.519  0.623   4.692  1.00 1.80 ?  8  TRP   A CH2  1  
ATOM   98   H H    . TRP   A 1 8  ? 13.972  0.805   0.082  1.00 1.04 ?  8  TRP   A H    1  
ATOM   99   H HA   . TRP   A 1 8  ? 14.045  2.396   2.517  1.00 0.76 ?  8  TRP   A HA   1  
ATOM   100  H HB2  . TRP   A 1 8  ? 15.352  2.903   -0.158 1.00 0.85 ?  8  TRP   A HB2  1  
ATOM   101  H HB3  . TRP   A 1 8  ? 15.682  3.760   1.344  1.00 0.91 ?  8  TRP   A HB3  1  
ATOM   102  H HD1  . TRP   A 1 8  ? 16.763  0.812   -0.629 1.00 1.25 ?  8  TRP   A HD1  1  
ATOM   103  H HE1  . TRP   A 1 8  ? 18.449  -0.605  0.703  1.00 1.65 ?  8  TRP   A HE1  1  
ATOM   104  H HE3  . TRP   A 1 8  ? 16.175  2.971   3.967  1.00 1.26 ?  8  TRP   A HE3  1  
ATOM   105  H HZ2  . TRP   A 1 8  ? 19.398  -0.779  3.361  1.00 1.93 ?  8  TRP   A HZ2  1  
ATOM   106  H HZ3  . TRP   A 1 8  ? 17.505  2.116   5.846  1.00 1.73 ?  8  TRP   A HZ3  1  
ATOM   107  H HH2  . TRP   A 1 8  ? 19.082  0.278   5.544  1.00 2.00 ?  8  TRP   A HH2  1  
ATOM   108  N N    . ASN   A 1 9  ? 11.874  2.926   0.441  1.00 0.33 ?  9  ASN   A N    1  
ATOM   109  C CA   . ASN   A 1 9  ? 10.763  3.771   0.039  1.00 0.29 ?  9  ASN   A CA   1  
ATOM   110  C C    . ASN   A 1 9  ? 9.459   3.011   0.251  1.00 0.25 ?  9  ASN   A C    1  
ATOM   111  O O    . ASN   A 1 9  ? 8.651   2.856   -0.664 1.00 0.36 ?  9  ASN   A O    1  
ATOM   112  C CB   . ASN   A 1 9  ? 10.915  4.194   -1.430 1.00 0.46 ?  9  ASN   A CB   1  
ATOM   113  C CG   . ASN   A 1 9  ? 10.090  5.423   -1.807 1.00 1.31 ?  9  ASN   A CG   1  
ATOM   114  O OD1  . ASN   A 1 9  ? 10.501  6.210   -2.660 1.00 2.05 ?  9  ASN   A OD1  1  
ATOM   115  N ND2  . ASN   A 1 9  ? 8.922   5.597   -1.202 1.00 1.88 ?  9  ASN   A ND2  1  
ATOM   116  H H    . ASN   A 1 9  ? 11.812  1.955   0.301  1.00 0.35 ?  9  ASN   A H    1  
ATOM   117  H HA   . ASN   A 1 9  ? 10.767  4.647   0.667  1.00 0.37 ?  9  ASN   A HA   1  
ATOM   118  H HB2  . ASN   A 1 9  ? 11.954  4.416   -1.622 1.00 1.10 ?  9  ASN   A HB2  1  
ATOM   119  H HB3  . ASN   A 1 9  ? 10.609  3.373   -2.063 1.00 0.63 ?  9  ASN   A HB3  1  
ATOM   120  H HD21 . ASN   A 1 9  ? 8.635   4.929   -0.543 1.00 2.03 ?  9  ASN   A HD21 1  
ATOM   121  H HD22 . ASN   A 1 9  ? 8.395   6.395   -1.429 1.00 2.48 ?  9  ASN   A HD22 1  
ATOM   122  N N    . GLU   A 1 10 ? 9.275   2.526   1.467  1.00 0.23 ?  10 GLU   A N    1  
ATOM   123  C CA   . GLU   A 1 10 ? 8.102   1.746   1.812  1.00 0.26 ?  10 GLU   A CA   1  
ATOM   124  C C    . GLU   A 1 10 ? 7.063   2.630   2.487  1.00 0.28 ?  10 GLU   A C    1  
ATOM   125  O O    . GLU   A 1 10 ? 7.024   2.741   3.716  1.00 0.49 ?  10 GLU   A O    1  
ATOM   126  C CB   . GLU   A 1 10 ? 8.492   0.590   2.738  1.00 0.39 ?  10 GLU   A CB   1  
ATOM   127  C CG   . GLU   A 1 10 ? 7.327   -0.305  3.117  1.00 0.45 ?  10 GLU   A CG   1  
ATOM   128  C CD   . GLU   A 1 10 ? 7.663   -1.253  4.248  1.00 0.68 ?  10 GLU   A CD   1  
ATOM   129  O OE1  . GLU   A 1 10 ? 7.415   -0.894  5.423  1.00 0.95 ?  10 GLU   A OE1  1  
ATOM   130  O OE2  . GLU   A 1 10 ? 8.171   -2.358  3.977  1.00 0.78 -1 10 GLU   A OE2  1  
ATOM   131  H H    . GLU   A 1 10 ? 9.948   2.702   2.158  1.00 0.28 ?  10 GLU   A H    1  
ATOM   132  H HA   . GLU   A 1 10 ? 7.684   1.347   0.901  1.00 0.27 ?  10 GLU   A HA   1  
ATOM   133  H HB2  . GLU   A 1 10 ? 9.236   -0.015  2.245  1.00 0.43 ?  10 GLU   A HB2  1  
ATOM   134  H HB3  . GLU   A 1 10 ? 8.913   0.998   3.644  1.00 0.48 ?  10 GLU   A HB3  1  
ATOM   135  H HG2  . GLU   A 1 10 ? 6.500   0.315   3.420  1.00 0.47 ?  10 GLU   A HG2  1  
ATOM   136  H HG3  . GLU   A 1 10 ? 7.041   -0.885  2.255  1.00 0.40 ?  10 GLU   A HG3  1  
ATOM   137  N N    . ASP   A 1 11 ? 6.228   3.270   1.688  1.00 0.23 ?  11 ASP   A N    1  
ATOM   138  C CA   . ASP   A 1 11 ? 5.197   4.137   2.229  1.00 0.30 ?  11 ASP   A CA   1  
ATOM   139  C C    . ASP   A 1 11 ? 3.868   3.392   2.284  1.00 0.23 ?  11 ASP   A C    1  
ATOM   140  O O    . ASP   A 1 11 ? 2.973   3.601   1.453  1.00 0.20 ?  11 ASP   A O    1  
ATOM   141  C CB   . ASP   A 1 11 ? 5.066   5.417   1.403  1.00 0.38 ?  11 ASP   A CB   1  
ATOM   142  C CG   . ASP   A 1 11 ? 4.351   6.518   2.161  1.00 0.99 ?  11 ASP   A CG   1  
ATOM   143  O OD1  . ASP   A 1 11 ? 3.109   6.552   2.146  1.00 1.86 ?  11 ASP   A OD1  1  
ATOM   144  O OD2  . ASP   A 1 11 ? 5.040   7.360   2.781  1.00 1.32 -1 11 ASP   A OD2  1  
ATOM   145  H H    . ASP   A 1 11 ? 6.304   3.154   0.714  1.00 0.30 ?  11 ASP   A H    1  
ATOM   146  H HA   . ASP   A 1 11 ? 5.486   4.396   3.236  1.00 0.38 ?  11 ASP   A HA   1  
ATOM   147  H HB2  . ASP   A 1 11 ? 6.052   5.770   1.136  1.00 0.94 ?  11 ASP   A HB2  1  
ATOM   148  H HB3  . ASP   A 1 11 ? 4.508   5.202   0.504  1.00 0.78 ?  11 ASP   A HB3  1  
ATOM   149  N N    . ASP   A 1 12 ? 3.752   2.511   3.272  1.00 0.25 ?  12 ASP   A N    1  
ATOM   150  C CA   . ASP   A 1 12 ? 2.548   1.710   3.463  1.00 0.26 ?  12 ASP   A CA   1  
ATOM   151  C C    . ASP   A 1 12 ? 1.340   2.603   3.705  1.00 0.18 ?  12 ASP   A C    1  
ATOM   152  O O    . ASP   A 1 12 ? 0.202   2.201   3.458  1.00 0.18 ?  12 ASP   A O    1  
ATOM   153  C CB   . ASP   A 1 12 ? 2.716   0.737   4.634  1.00 0.39 ?  12 ASP   A CB   1  
ATOM   154  C CG   . ASP   A 1 12 ? 2.850   1.434   5.974  1.00 0.82 ?  12 ASP   A CG   1  
ATOM   155  O OD1  . ASP   A 1 12 ? 3.980   1.823   6.337  1.00 1.45 ?  12 ASP   A OD1  1  
ATOM   156  O OD2  . ASP   A 1 12 ? 1.825   1.586   6.673  1.00 1.50 -1 12 ASP   A OD2  1  
ATOM   157  H H    . ASP   A 1 12 ? 4.505   2.397   3.895  1.00 0.31 ?  12 ASP   A H    1  
ATOM   158  H HA   . ASP   A 1 12 ? 2.386   1.142   2.561  1.00 0.27 ?  12 ASP   A HA   1  
ATOM   159  H HB2  . ASP   A 1 12 ? 1.856   0.094   4.675  1.00 1.12 ?  12 ASP   A HB2  1  
ATOM   160  H HB3  . ASP   A 1 12 ? 3.596   0.138   4.470  1.00 1.15 ?  12 ASP   A HB3  1  
HETATM 161  N N    . 2ML   A 1 13 ? 1.608   3.816   4.187  1.00 0.18 ?  13 2ML   A N    1  
HETATM 162  C CA   . 2ML   A 1 13 ? 0.581   4.826   4.423  1.00 0.19 ?  13 2ML   A CA   1  
HETATM 163  C CB1  . 2ML   A 1 13 ? 1.271   6.093   4.934  1.00 0.24 ?  13 2ML   A CB1  1  
HETATM 164  C CB2  . 2ML   A 1 13 ? -0.391  4.342   5.486  1.00 0.25 ?  13 2ML   A CB2  1  
HETATM 165  C CG   . 2ML   A 1 13 ? 0.270   7.158   5.416  1.00 0.33 ?  13 2ML   A CG   1  
HETATM 166  C CD1  . 2ML   A 1 13 ? 0.949   8.099   6.396  1.00 0.57 ?  13 2ML   A CD1  1  
HETATM 167  C CD2  . 2ML   A 1 13 ? -0.292  7.962   4.250  1.00 0.54 ?  13 2ML   A CD2  1  
HETATM 168  C C    . 2ML   A 1 13 ? -0.152  5.088   3.098  1.00 0.16 ?  13 2ML   A C    1  
HETATM 169  O O    . 2ML   A 1 13 ? -1.386  5.104   3.044  1.00 0.17 ?  13 2ML   A O    1  
HETATM 170  H H    . 2ML   A 1 13 ? 2.540   4.041   4.392  1.00 0.20 ?  13 2ML   A H    1  
HETATM 171  H HB11 . 2ML   A 1 13 ? 1.862   6.515   4.137  1.00 0.28 ?  13 2ML   A HB11 1  
HETATM 172  H HB12 . 2ML   A 1 13 ? 1.926   5.829   5.753  1.00 0.32 ?  13 2ML   A HB12 1  
HETATM 173  H HB21 . 2ML   A 1 13 ? 0.080   4.390   6.456  1.00 0.92 ?  13 2ML   A HB21 1  
HETATM 174  H HB22 . 2ML   A 1 13 ? -0.668  3.320   5.272  1.00 0.95 ?  13 2ML   A HB22 1  
HETATM 175  H HB23 . 2ML   A 1 13 ? -1.273  4.962   5.479  1.00 1.02 ?  13 2ML   A HB23 1  
HETATM 176  H HG   . 2ML   A 1 13 ? -0.551  6.674   5.924  1.00 0.64 ?  13 2ML   A HG   1  
HETATM 177  H HD11 . 2ML   A 1 13 ? 1.829   8.525   5.936  1.00 1.31 ?  13 2ML   A HD11 1  
HETATM 178  H HD12 . 2ML   A 1 13 ? 1.234   7.555   7.285  1.00 0.88 ?  13 2ML   A HD12 1  
HETATM 179  H HD13 . 2ML   A 1 13 ? 0.266   8.892   6.664  1.00 1.28 ?  13 2ML   A HD13 1  
HETATM 180  H HD21 . 2ML   A 1 13 ? -1.004  8.685   4.621  1.00 1.20 ?  13 2ML   A HD21 1  
HETATM 181  H HD22 . 2ML   A 1 13 ? -0.785  7.296   3.557  1.00 1.15 ?  13 2ML   A HD22 1  
HETATM 182  H HD23 . 2ML   A 1 13 ? 0.512   8.475   3.745  1.00 1.05 ?  13 2ML   A HD23 1  
ATOM   183  N N    . ARG   A 1 14 ? 0.621   5.270   2.034  1.00 0.14 ?  14 ARG   A N    1  
ATOM   184  C CA   . ARG   A 1 14 ? 0.069   5.591   0.726  1.00 0.16 ?  14 ARG   A CA   1  
ATOM   185  C C    . ARG   A 1 14 ? -0.557  4.360   0.089  1.00 0.12 ?  14 ARG   A C    1  
ATOM   186  O O    . ARG   A 1 14 ? -1.521  4.466   -0.672 1.00 0.14 ?  14 ARG   A O    1  
ATOM   187  C CB   . ARG   A 1 14 ? 1.157   6.164   -0.174 1.00 0.21 ?  14 ARG   A CB   1  
ATOM   188  C CG   . ARG   A 1 14 ? 0.652   6.715   -1.492 1.00 1.03 ?  14 ARG   A CG   1  
ATOM   189  C CD   . ARG   A 1 14 ? 1.801   7.312   -2.288 1.00 1.04 ?  14 ARG   A CD   1  
ATOM   190  N NE   . ARG   A 1 14 ? 2.574   8.265   -1.488 1.00 1.37 ?  14 ARG   A NE   1  
ATOM   191  C CZ   . ARG   A 1 14 ? 3.762   8.747   -1.842 1.00 1.63 ?  14 ARG   A CZ   1  
ATOM   192  N NH1  . ARG   A 1 14 ? 4.330   8.372   -2.983 1.00 1.31 1  14 ARG   A NH1  1  
ATOM   193  N NH2  . ARG   A 1 14 ? 4.391   9.600   -1.047 1.00 2.60 ?  14 ARG   A NH2  1  
ATOM   194  H H    . ARG   A 1 14 ? 1.600   5.189   2.135  1.00 0.17 ?  14 ARG   A H    1  
ATOM   195  H HA   . ARG   A 1 14 ? -0.697  6.336   0.862  1.00 0.20 ?  14 ARG   A HA   1  
ATOM   196  H HB2  . ARG   A 1 14 ? 1.656   6.961   0.353  1.00 0.88 ?  14 ARG   A HB2  1  
ATOM   197  H HB3  . ARG   A 1 14 ? 1.871   5.392   -0.386 1.00 0.69 ?  14 ARG   A HB3  1  
ATOM   198  H HG2  . ARG   A 1 14 ? 0.203   5.912   -2.061 1.00 1.51 ?  14 ARG   A HG2  1  
ATOM   199  H HG3  . ARG   A 1 14 ? -0.085  7.481   -1.297 1.00 1.60 ?  14 ARG   A HG3  1  
ATOM   200  H HD2  . ARG   A 1 14 ? 2.454   6.512   -2.605 1.00 1.51 ?  14 ARG   A HD2  1  
ATOM   201  H HD3  . ARG   A 1 14 ? 1.403   7.819   -3.155 1.00 1.55 ?  14 ARG   A HD3  1  
ATOM   202  H HE   . ARG   A 1 14 ? 2.184   8.556   -0.630 1.00 1.89 ?  14 ARG   A HE   1  
ATOM   203  H HH11 . ARG   A 1 14 ? 5.227   8.742   -3.246 1.00 1.53 ?  14 ARG   A HH11 1  
ATOM   204  H HH12 . ARG   A 1 14 ? 3.871   7.713   -3.584 1.00 1.40 ?  14 ARG   A HH12 1  
ATOM   205  H HH21 . ARG   A 1 14 ? 5.288   9.967   -1.310 1.00 2.84 ?  14 ARG   A HH21 1  
ATOM   206  H HH22 . ARG   A 1 14 ? 3.972   9.885   -0.179 1.00 3.21 ?  14 ARG   A HH22 1  
ATOM   207  N N    . CYS   A 1 15 ? -0.007  3.195   0.400  1.00 0.11 ?  15 CYS   A N    1  
ATOM   208  C CA   . CYS   A 1 15 ? -0.609  1.935   -0.026 1.00 0.10 ?  15 CYS   A CA   1  
ATOM   209  C C    . CYS   A 1 15 ? -2.004  1.811   0.584  1.00 0.09 ?  15 CYS   A C    1  
ATOM   210  O O    . CYS   A 1 15 ? -2.969  1.474   -0.104 1.00 0.09 ?  15 CYS   A O    1  
ATOM   211  C CB   . CYS   A 1 15 ? 0.271   0.751   0.393  1.00 0.13 ?  15 CYS   A CB   1  
ATOM   212  S SG   . CYS   A 1 15 ? -0.442  -0.891  0.049  1.00 0.13 ?  15 CYS   A SG   1  
ATOM   213  H H    . CYS   A 1 15 ? 0.828   3.182   0.922  1.00 0.12 ?  15 CYS   A H    1  
ATOM   214  H HA   . CYS   A 1 15 ? -0.699  1.950   -1.106 1.00 0.11 ?  15 CYS   A HA   1  
ATOM   215  H HB2  . CYS   A 1 15 ? 1.215   0.811   -0.130 1.00 0.15 ?  15 CYS   A HB2  1  
ATOM   216  H HB3  . CYS   A 1 15 ? 0.450   0.813   1.457  1.00 0.15 ?  15 CYS   A HB3  1  
ATOM   217  N N    . HIS   A 1 16 ? -2.108  2.136   1.872  1.00 0.11 ?  16 HIS   A N    1  
ATOM   218  C CA   . HIS   A 1 16 ? -3.390  2.132   2.560  1.00 0.13 ?  16 HIS   A CA   1  
ATOM   219  C C    . HIS   A 1 16 ? -4.330  3.142   1.919  1.00 0.13 ?  16 HIS   A C    1  
ATOM   220  O O    . HIS   A 1 16 ? -5.489  2.828   1.667  1.00 0.15 ?  16 HIS   A O    1  
ATOM   221  C CB   . HIS   A 1 16 ? -3.206  2.440   4.056  1.00 0.17 ?  16 HIS   A CB   1  
ATOM   222  C CG   . HIS   A 1 16 ? -4.494  2.536   4.829  1.00 0.27 ?  16 HIS   A CG   1  
ATOM   223  N ND1  . HIS   A 1 16 ? -4.995  1.505   5.593  1.00 0.39 ?  16 HIS   A ND1  1  
ATOM   224  C CD2  . HIS   A 1 16 ? -5.384  3.550   4.947  1.00 0.34 ?  16 HIS   A CD2  1  
ATOM   225  C CE1  . HIS   A 1 16 ? -6.136  1.879   6.140  1.00 0.48 ?  16 HIS   A CE1  1  
ATOM   226  N NE2  . HIS   A 1 16 ? -6.393  3.115   5.766  1.00 0.45 ?  16 HIS   A NE2  1  
ATOM   227  H H    . HIS   A 1 16 ? -1.296  2.379   2.372  1.00 0.13 ?  16 HIS   A H    1  
ATOM   228  H HA   . HIS   A 1 16 ? -3.817  1.145   2.453  1.00 0.14 ?  16 HIS   A HA   1  
ATOM   229  H HB2  . HIS   A 1 16 ? -2.615  1.657   4.503  1.00 0.22 ?  16 HIS   A HB2  1  
ATOM   230  H HB3  . HIS   A 1 16 ? -2.685  3.380   4.159  1.00 0.15 ?  16 HIS   A HB3  1  
ATOM   231  H HD1  . HIS   A 1 16 ? -4.563  0.637   5.738  1.00 0.44 ?  16 HIS   A HD1  1  
ATOM   232  H HD2  . HIS   A 1 16 ? -5.308  4.523   4.485  1.00 0.35 ?  16 HIS   A HD2  1  
ATOM   233  H HE1  . HIS   A 1 16 ? -6.759  1.268   6.773  1.00 0.59 ?  16 HIS   A HE1  1  
ATOM   234  H HE2  . HIS   A 1 16 ? -7.084  3.691   6.169  1.00 0.54 ?  16 HIS   A HE2  1  
HETATM 235  N N    . AIB   A 1 17 ? -3.818  4.350   1.667  1.00 0.13 ?  17 AIB   A N    1  
HETATM 236  C CA   . AIB   A 1 17 ? -4.589  5.413   1.004  1.00 0.15 ?  17 AIB   A CA   1  
HETATM 237  C C    . AIB   A 1 17 ? -5.161  4.872   -0.312 1.00 0.13 ?  17 AIB   A C    1  
HETATM 238  O O    . AIB   A 1 17 ? -6.354  5.011   -0.598 1.00 0.15 ?  17 AIB   A O    1  
HETATM 239  C CB1  . AIB   A 1 17 ? -3.690  6.602   0.718  1.00 0.18 ?  17 AIB   A CB1  1  
HETATM 240  C CB2  . AIB   A 1 17 ? -5.701  5.896   1.915  1.00 0.19 ?  17 AIB   A CB2  1  
HETATM 241  H H    . AIB   A 1 17 ? -2.893  4.535   1.939  1.00 0.13 ?  17 AIB   A H    1  
HETATM 242  H HB11 . AIB   A 1 17 ? -4.261  7.372   0.221  1.00 0.99 ?  17 AIB   A HB11 1  
HETATM 243  H HB12 . AIB   A 1 17 ? -2.873  6.293   0.081  1.00 0.95 ?  17 AIB   A HB12 1  
HETATM 244  H HB13 . AIB   A 1 17 ? -3.295  6.990   1.646  1.00 1.05 ?  17 AIB   A HB13 1  
HETATM 245  H HB21 . AIB   A 1 17 ? -5.274  6.396   2.769  1.00 1.00 ?  17 AIB   A HB21 1  
HETATM 246  H HB22 . AIB   A 1 17 ? -6.281  5.050   2.249  1.00 1.02 ?  17 AIB   A HB22 1  
HETATM 247  H HB23 . AIB   A 1 17 ? -6.337  6.579   1.374  1.00 0.98 ?  17 AIB   A HB23 1  
ATOM   248  N N    . HIS   A 1 18 ? -4.293  4.233   -1.091 1.00 0.12 ?  18 HIS   A N    1  
ATOM   249  C CA   . HIS   A 1 18 ? -4.672  3.663   -2.376 1.00 0.12 ?  18 HIS   A CA   1  
ATOM   250  C C    . HIS   A 1 18 ? -5.795  2.646   -2.217 1.00 0.09 ?  18 HIS   A C    1  
ATOM   251  O O    . HIS   A 1 18 ? -6.856  2.780   -2.821 1.00 0.10 ?  18 HIS   A O    1  
ATOM   252  C CB   . HIS   A 1 18 ? -3.450  3.014   -3.044 1.00 0.15 ?  18 HIS   A CB   1  
ATOM   253  C CG   . HIS   A 1 18 ? -3.773  2.206   -4.264 1.00 0.19 ?  18 HIS   A CG   1  
ATOM   254  N ND1  . HIS   A 1 18 ? -4.233  2.756   -5.441 1.00 0.23 ?  18 HIS   A ND1  1  
ATOM   255  C CD2  . HIS   A 1 18 ? -3.702  0.872   -4.478 1.00 0.23 ?  18 HIS   A CD2  1  
ATOM   256  C CE1  . HIS   A 1 18 ? -4.434  1.798   -6.324 1.00 0.28 ?  18 HIS   A CE1  1  
ATOM   257  N NE2  . HIS   A 1 18 ? -4.119  0.646   -5.765 1.00 0.28 ?  18 HIS   A NE2  1  
ATOM   258  H H    . HIS   A 1 18 ? -3.361  4.141   -0.787 1.00 0.12 ?  18 HIS   A H    1  
ATOM   259  H HA   . HIS   A 1 18 ? -5.025  4.469   -3.000 1.00 0.14 ?  18 HIS   A HA   1  
ATOM   260  H HB2  . HIS   A 1 18 ? -2.756  3.786   -3.337 1.00 0.17 ?  18 HIS   A HB2  1  
ATOM   261  H HB3  . HIS   A 1 18 ? -2.965  2.361   -2.333 1.00 0.15 ?  18 HIS   A HB3  1  
ATOM   262  H HD1  . HIS   A 1 18 ? -4.395  3.714   -5.604 1.00 0.24 ?  18 HIS   A HD1  1  
ATOM   263  H HD2  . HIS   A 1 18 ? -3.374  0.128   -3.767 1.00 0.24 ?  18 HIS   A HD2  1  
ATOM   264  H HE1  . HIS   A 1 18 ? -4.788  1.934   -7.334 1.00 0.33 ?  18 HIS   A HE1  1  
ATOM   265  H HE2  . HIS   A 1 18 ? -4.085  -0.218  -6.234 1.00 0.36 ?  18 HIS   A HE2  1  
ATOM   266  N N    . CYS   A 1 19 ? -5.558  1.643   -1.389 1.00 0.09 ?  19 CYS   A N    1  
ATOM   267  C CA   . CYS   A 1 19 ? -6.510  0.555   -1.214 1.00 0.09 ?  19 CYS   A CA   1  
ATOM   268  C C    . CYS   A 1 19 ? -7.822  1.056   -0.623 1.00 0.09 ?  19 CYS   A C    1  
ATOM   269  O O    . CYS   A 1 19 ? -8.891  0.588   -1.008 1.00 0.09 ?  19 CYS   A O    1  
ATOM   270  C CB   . CYS   A 1 19 ? -5.901  -0.525  -0.330 1.00 0.11 ?  19 CYS   A CB   1  
ATOM   271  S SG   . CYS   A 1 19 ? -4.349  -1.208  -0.990 1.00 0.12 ?  19 CYS   A SG   1  
ATOM   272  H H    . CYS   A 1 19 ? -4.716  1.630   -0.877 1.00 0.11 ?  19 CYS   A H    1  
ATOM   273  H HA   . CYS   A 1 19 ? -6.711  0.135   -2.188 1.00 0.10 ?  19 CYS   A HA   1  
ATOM   274  H HB2  . CYS   A 1 19 ? -5.692  -0.110  0.645  1.00 0.13 ?  19 CYS   A HB2  1  
ATOM   275  H HB3  . CYS   A 1 19 ? -6.604  -1.340  -0.230 1.00 0.13 ?  19 CYS   A HB3  1  
HETATM 276  N N    . A1BEB A 1 20 ? -7.728  2.020   0.296  1.00 0.11 ?  20 A1BEB A N    1  
HETATM 277  C CA   . A1BEB A 1 20 ? -8.902  2.635   0.928  1.00 0.14 ?  20 A1BEB A CA   1  
HETATM 278  C C    . A1BEB A 1 20 ? -9.735  3.342   -0.151 1.00 0.16 ?  20 A1BEB A C    1  
HETATM 279  O O    . A1BEB A 1 20 ? -10.963 3.428   -0.050 1.00 0.18 ?  20 A1BEB A O    1  
HETATM 280  C CB   . A1BEB A 1 20 ? -8.430  3.640   1.966  1.00 0.21 ?  20 A1BEB A CB   1  
HETATM 281  C CB2  . A1BEB A 1 20 ? -9.731  1.577   1.636  1.00 0.15 ?  20 A1BEB A CB2  1  
HETATM 282  C CG   . A1BEB A 1 20 ? -9.580  4.199   2.786  1.00 0.36 ?  20 A1BEB A CG   1  
HETATM 283  C CD   . A1BEB A 1 20 ? -9.101  5.294   3.720  1.00 0.44 ?  20 A1BEB A CD   1  
HETATM 284  C CE   . A1BEB A 1 20 ? -10.239 5.862   4.554  1.00 0.72 ?  20 A1BEB A CE   1  
HETATM 285  N NZ   . A1BEB A 1 20 ? -11.319 6.436   3.706  1.00 1.38 ?  20 A1BEB A NZ   1  
HETATM 286  H H    . A1BEB A 1 20 ? -6.837  2.331   0.566  1.00 0.12 ?  20 A1BEB A H    1  
HETATM 287  H HB2  . A1BEB A 1 20 ? -7.936  4.462   1.466  1.00 0.19 ?  20 A1BEB A HB2  1  
HETATM 288  H HB3  . A1BEB A 1 20 ? -7.734  3.161   2.637  1.00 0.23 ?  20 A1BEB A HB3  1  
HETATM 289  H HB23 . A1BEB A 1 20 ? -9.952  0.775   0.947  1.00 0.84 ?  20 A1BEB A HB23 1  
HETATM 290  H HB21 . A1BEB A 1 20 ? -10.654 2.015   1.985  1.00 0.80 ?  20 A1BEB A HB21 1  
HETATM 291  H HB22 . A1BEB A 1 20 ? -9.176  1.187   2.476  1.00 0.82 ?  20 A1BEB A HB22 1  
HETATM 292  H HG3  . A1BEB A 1 20 ? -10.010 3.404   3.373  1.00 0.42 ?  20 A1BEB A HG3  1  
HETATM 293  H HG2  . A1BEB A 1 20 ? -10.323 4.605   2.119  1.00 0.40 ?  20 A1BEB A HG2  1  
HETATM 294  H HD3  . A1BEB A 1 20 ? -8.352  4.883   4.382  1.00 0.93 ?  20 A1BEB A HD3  1  
HETATM 295  H HD2  . A1BEB A 1 20 ? -8.665  6.086   3.130  1.00 0.84 ?  20 A1BEB A HD2  1  
HETATM 296  H HE3  . A1BEB A 1 20 ? -10.655 5.071   5.161  1.00 1.49 ?  20 A1BEB A HE3  1  
HETATM 297  H HE2  . A1BEB A 1 20 ? -9.847  6.637   5.195  1.00 1.41 ?  20 A1BEB A HE2  1  
HETATM 298  H HZ1  . A1BEB A 1 20 ? -11.759 5.691   3.125  1.00 1.93 ?  20 A1BEB A HZ1  1  
HETATM 299  H HZ2  . A1BEB A 1 20 ? -10.932 7.166   3.076  1.00 1.93 ?  20 A1BEB A HZ2  1  
HETATM 300  H HZ3  . A1BEB A 1 20 ? -12.051 6.868   4.304  1.00 1.84 ?  20 A1BEB A HZ3  1  
ATOM   301  N N    . SER   A 1 21 ? -9.059  3.834   -1.186 1.00 0.18 ?  21 SER   A N    1  
ATOM   302  C CA   . SER   A 1 21 ? -9.730  4.513   -2.285 1.00 0.23 ?  21 SER   A CA   1  
ATOM   303  C C    . SER   A 1 21 ? -10.410 3.505   -3.214 1.00 0.23 ?  21 SER   A C    1  
ATOM   304  O O    . SER   A 1 21 ? -11.153 3.885   -4.121 1.00 0.31 ?  21 SER   A O    1  
ATOM   305  C CB   . SER   A 1 21 ? -8.728  5.373   -3.066 1.00 0.33 ?  21 SER   A CB   1  
ATOM   306  O OG   . SER   A 1 21 ? -9.345  6.030   -4.165 1.00 1.18 ?  21 SER   A OG   1  
ATOM   307  H H    . SER   A 1 21 ? -8.078  3.740   -1.209 1.00 0.17 ?  21 SER   A H    1  
ATOM   308  H HA   . SER   A 1 21 ? -10.483 5.157   -1.864 1.00 0.26 ?  21 SER   A HA   1  
ATOM   309  H HB2  . SER   A 1 21 ? -8.312  6.120   -2.410 1.00 1.01 ?  21 SER   A HB2  1  
ATOM   310  H HB3  . SER   A 1 21 ? -7.936  4.744   -3.438 1.00 1.21 ?  21 SER   A HB3  1  
ATOM   311  H HG   . SER   A 1 21 ? -10.158 5.561   -4.401 1.00 1.82 ?  21 SER   A HG   1  
ATOM   312  N N    . ILE   A 1 22 ? -10.152 2.224   -2.991 1.00 0.19 ?  22 ILE   A N    1  
ATOM   313  C CA   . ILE   A 1 22 ? -10.769 1.176   -3.780 1.00 0.20 ?  22 ILE   A CA   1  
ATOM   314  C C    . ILE   A 1 22 ? -11.899 0.507   -2.997 1.00 0.17 ?  22 ILE   A C    1  
ATOM   315  O O    . ILE   A 1 22 ? -11.681 -0.042  -1.910 1.00 0.14 ?  22 ILE   A O    1  
ATOM   316  C CB   . ILE   A 1 22 ? -9.748  0.105   -4.198 1.00 0.21 ?  22 ILE   A CB   1  
ATOM   317  C CG1  . ILE   A 1 22 ? -8.556  0.750   -4.904 1.00 0.24 ?  22 ILE   A CG1  1  
ATOM   318  C CG2  . ILE   A 1 22 ? -10.414 -0.921  -5.108 1.00 0.24 ?  22 ILE   A CG2  1  
ATOM   319  C CD1  . ILE   A 1 22 ? -7.490  -0.239  -5.331 1.00 0.26 ?  22 ILE   A CD1  1  
ATOM   320  H H    . ILE   A 1 22 ? -9.528  1.974   -2.277 1.00 0.19 ?  22 ILE   A H    1  
ATOM   321  H HA   . ILE   A 1 22 ? -11.174 1.626   -4.672 1.00 0.25 ?  22 ILE   A HA   1  
ATOM   322  H HB   . ILE   A 1 22 ? -9.405  -0.396  -3.307 1.00 0.18 ?  22 ILE   A HB   1  
ATOM   323  H HG12 . ILE   A 1 22 ? -8.905  1.260   -5.787 1.00 0.28 ?  22 ILE   A HG12 1  
ATOM   324  H HG13 . ILE   A 1 22 ? -8.098  1.466   -4.238 1.00 0.24 ?  22 ILE   A HG13 1  
ATOM   325  H HG21 . ILE   A 1 22 ? -11.254 -1.366  -4.593 1.00 0.99 ?  22 ILE   A HG21 1  
ATOM   326  H HG22 . ILE   A 1 22 ? -9.701  -1.688  -5.369 1.00 0.98 ?  22 ILE   A HG22 1  
ATOM   327  H HG23 . ILE   A 1 22 ? -10.762 -0.429  -6.005 1.00 0.97 ?  22 ILE   A HG23 1  
ATOM   328  H HD11 . ILE   A 1 22 ? -7.894  -0.902  -6.082 1.00 1.05 ?  22 ILE   A HD11 1  
ATOM   329  H HD12 . ILE   A 1 22 ? -7.172  -0.818  -4.478 1.00 1.05 ?  22 ILE   A HD12 1  
ATOM   330  H HD13 . ILE   A 1 22 ? -6.646  0.295   -5.740 1.00 0.99 ?  22 ILE   A HD13 1  
ATOM   331  N N    . PRO   A 1 23 ? -13.126 0.562   -3.532 1.00 0.19 ?  23 PRO   A N    1  
ATOM   332  C CA   . PRO   A 1 23 ? -14.282 -0.093  -2.921 1.00 0.19 ?  23 PRO   A CA   1  
ATOM   333  C C    . PRO   A 1 23 ? -14.042 -1.586  -2.708 1.00 0.18 ?  23 PRO   A C    1  
ATOM   334  O O    . PRO   A 1 23 ? -13.431 -2.254  -3.546 1.00 0.21 ?  23 PRO   A O    1  
ATOM   335  C CB   . PRO   A 1 23 ? -15.403 0.133   -3.936 1.00 0.25 ?  23 PRO   A CB   1  
ATOM   336  C CG   . PRO   A 1 23 ? -14.986 1.338   -4.696 1.00 0.29 ?  23 PRO   A CG   1  
ATOM   337  C CD   . PRO   A 1 23 ? -13.489 1.275   -4.769 1.00 0.26 ?  23 PRO   A CD   1  
ATOM   338  H HA   . PRO   A 1 23 ? -14.544 0.367   -1.981 1.00 0.19 ?  23 PRO   A HA   1  
ATOM   339  H HB2  . PRO   A 1 23 ? -15.486 -0.728  -4.581 1.00 0.28 ?  23 PRO   A HB2  1  
ATOM   340  H HB3  . PRO   A 1 23 ? -16.338 0.296   -3.419 1.00 0.28 ?  23 PRO   A HB3  1  
ATOM   341  H HG2  . PRO   A 1 23 ? -15.410 1.311   -5.686 1.00 0.34 ?  23 PRO   A HG2  1  
ATOM   342  H HG3  . PRO   A 1 23 ? -15.299 2.231   -4.174 1.00 0.30 ?  23 PRO   A HG3  1  
ATOM   343  H HD2  . PRO   A 1 23 ? -13.175 0.720   -5.640 1.00 0.30 ?  23 PRO   A HD2  1  
ATOM   344  H HD3  . PRO   A 1 23 ? -13.071 2.269   -4.779 1.00 0.28 ?  23 PRO   A HD3  1  
HETATM 345  N N    . DPR   A 1 24 ? -14.523 -2.124  -1.585 1.00 0.19 ?  24 DPR   A N    1  
HETATM 346  C CA   . DPR   A 1 24 ? -14.327 -3.527  -1.223 1.00 0.23 ?  24 DPR   A CA   1  
HETATM 347  C CB   . DPR   A 1 24 ? -15.540 -3.797  -0.348 1.00 0.30 ?  24 DPR   A CB   1  
HETATM 348  C CG   . DPR   A 1 24 ? -15.753 -2.512  0.376  1.00 0.29 ?  24 DPR   A CG   1  
HETATM 349  C CD   . DPR   A 1 24 ? -15.346 -1.418  -0.581 1.00 0.23 ?  24 DPR   A CD   1  
HETATM 350  C C    . DPR   A 1 24 ? -13.038 -3.756  -0.434 1.00 0.22 ?  24 DPR   A C    1  
HETATM 351  O O    . DPR   A 1 24 ? -12.760 -4.870  0.011  1.00 0.31 ?  24 DPR   A O    1  
HETATM 352  H HA   . DPR   A 1 24 ? -14.352 -4.175  -2.080 1.00 0.27 ?  24 DPR   A HA   1  
HETATM 353  H HB2  . DPR   A 1 24 ? -15.326 -4.604  0.334  1.00 0.34 ?  24 DPR   A HB2  1  
HETATM 354  H HB3  . DPR   A 1 24 ? -16.389 -4.052  -0.967 1.00 0.33 ?  24 DPR   A HB3  1  
HETATM 355  H HG2  . DPR   A 1 24 ? -15.135 -2.484  1.260  1.00 0.31 ?  24 DPR   A HG2  1  
HETATM 356  H HG3  . DPR   A 1 24 ? -16.794 -2.408  0.642  1.00 0.35 ?  24 DPR   A HG3  1  
HETATM 357  H HD2  . DPR   A 1 24 ? -14.770 -0.662  -0.072 1.00 0.23 ?  24 DPR   A HD2  1  
HETATM 358  H HD3  . DPR   A 1 24 ? -16.219 -0.979  -1.043 1.00 0.24 ?  24 DPR   A HD3  1  
ATOM   359  N N    . TYR   A 1 25 ? -12.246 -2.708  -0.275 1.00 0.15 ?  25 TYR   A N    1  
ATOM   360  C CA   . TYR   A 1 25 ? -11.068 -2.779  0.568  1.00 0.14 ?  25 TYR   A CA   1  
ATOM   361  C C    . TYR   A 1 25 ? -11.175 -1.766  1.698  1.00 0.15 ?  25 TYR   A C    1  
ATOM   362  O O    . TYR   A 1 25 ? -11.906 -0.782  1.592  1.00 0.17 ?  25 TYR   A O    1  
ATOM   363  C CB   . TYR   A 1 25 ? -9.803  -2.534  -0.254 1.00 0.12 ?  25 TYR   A CB   1  
ATOM   364  C CG   . TYR   A 1 25 ? -9.510  -3.636  -1.249 1.00 0.15 ?  25 TYR   A CG   1  
ATOM   365  C CD1  . TYR   A 1 25 ? -9.564  -3.401  -2.615 1.00 0.18 ?  25 TYR   A CD1  1  
ATOM   366  C CD2  . TYR   A 1 25 ? -9.183  -4.913  -0.818 1.00 0.21 ?  25 TYR   A CD2  1  
ATOM   367  C CE1  . TYR   A 1 25 ? -9.301  -4.408  -3.523 1.00 0.24 ?  25 TYR   A CE1  1  
ATOM   368  C CE2  . TYR   A 1 25 ? -8.919  -5.925  -1.718 1.00 0.26 ?  25 TYR   A CE2  1  
ATOM   369  C CZ   . TYR   A 1 25 ? -8.979  -5.667  -3.069 1.00 0.26 ?  25 TYR   A CZ   1  
ATOM   370  O OH   . TYR   A 1 25 ? -8.717  -6.673  -3.968 1.00 0.32 ?  25 TYR   A OH   1  
ATOM   371  H H    . TYR   A 1 25 ? -12.450 -1.869  -0.743 1.00 0.14 ?  25 TYR   A H    1  
ATOM   372  H HA   . TYR   A 1 25 ? -11.025 -3.770  0.995  1.00 0.16 ?  25 TYR   A HA   1  
ATOM   373  H HB2  . TYR   A 1 25 ? -9.915  -1.612  -0.802 1.00 0.11 ?  25 TYR   A HB2  1  
ATOM   374  H HB3  . TYR   A 1 25 ? -8.959  -2.451  0.413  1.00 0.12 ?  25 TYR   A HB3  1  
ATOM   375  H HD1  . TYR   A 1 25 ? -9.814  -2.416  -2.967 1.00 0.20 ?  25 TYR   A HD1  1  
ATOM   376  H HD2  . TYR   A 1 25 ? -9.136  -5.112  0.240  1.00 0.25 ?  25 TYR   A HD2  1  
ATOM   377  H HE1  . TYR   A 1 25 ? -9.349  -4.205  -4.583 1.00 0.29 ?  25 TYR   A HE1  1  
ATOM   378  H HE2  . TYR   A 1 25 ? -8.665  -6.911  -1.361 1.00 0.32 ?  25 TYR   A HE2  1  
ATOM   379  H HH   . TYR   A 1 25 ? -9.114  -7.495  -3.649 1.00 0.97 ?  25 TYR   A HH   1  
ATOM   380  N N    . LYS   A 1 26 ? -10.464 -2.029  2.782  1.00 0.16 ?  26 LYS   A N    1  
ATOM   381  C CA   . LYS   A 1 26 ? -10.476 -1.143  3.943  1.00 0.21 ?  26 LYS   A CA   1  
ATOM   382  C C    . LYS   A 1 26 ? -9.071  -0.642  4.265  1.00 0.24 ?  26 LYS   A C    1  
ATOM   383  O O    . LYS   A 1 26 ? -8.896  0.310   5.024  1.00 0.46 ?  26 LYS   A O    1  
ATOM   384  C CB   . LYS   A 1 26 ? -11.066 -1.858  5.167  1.00 0.27 ?  26 LYS   A CB   1  
ATOM   385  C CG   . LYS   A 1 26 ? -10.341 -3.143  5.544  1.00 0.30 ?  26 LYS   A CG   1  
ATOM   386  C CD   . LYS   A 1 26 ? -10.719 -3.612  6.938  1.00 0.43 ?  26 LYS   A CD   1  
ATOM   387  C CE   . LYS   A 1 26 ? -10.148 -2.692  8.006  1.00 1.65 ?  26 LYS   A CE   1  
ATOM   388  N NZ   . LYS   A 1 26 ? -10.475 -3.155  9.377  1.00 1.94 1  26 LYS   A NZ   1  
ATOM   389  H H    . LYS   A 1 26 ? -9.917  -2.842  2.804  1.00 0.16 ?  26 LYS   A H    1  
ATOM   390  H HA   . LYS   A 1 26 ? -11.096 -0.295  3.700  1.00 0.22 ?  26 LYS   A HA   1  
ATOM   391  H HB2  . LYS   A 1 26 ? -11.028 -1.189  6.013  1.00 0.31 ?  26 LYS   A HB2  1  
ATOM   392  H HB3  . LYS   A 1 26 ? -12.098 -2.104  4.963  1.00 0.32 ?  26 LYS   A HB3  1  
ATOM   393  H HG2  . LYS   A 1 26 ? -10.601 -3.915  4.834  1.00 0.34 ?  26 LYS   A HG2  1  
ATOM   394  H HG3  . LYS   A 1 26 ? -9.276  -2.964  5.513  1.00 0.36 ?  26 LYS   A HG3  1  
ATOM   395  H HD2  . LYS   A 1 26 ? -11.796 -3.624  7.024  1.00 1.07 ?  26 LYS   A HD2  1  
ATOM   396  H HD3  . LYS   A 1 26 ? -10.332 -4.609  7.090  1.00 0.96 ?  26 LYS   A HD3  1  
ATOM   397  H HE2  . LYS   A 1 26 ? -9.074  -2.657  7.894  1.00 2.28 ?  26 LYS   A HE2  1  
ATOM   398  H HE3  . LYS   A 1 26 ? -10.554 -1.702  7.863  1.00 2.30 ?  26 LYS   A HE3  1  
ATOM   399  H HZ1  . LYS   A 1 26 ? -10.074 -2.502  10.080 1.00 2.33 ?  26 LYS   A HZ1  1  
ATOM   400  H HZ2  . LYS   A 1 26 ? -10.078 -4.102  9.538  1.00 2.04 ?  26 LYS   A HZ2  1  
ATOM   401  H HZ3  . LYS   A 1 26 ? -11.506 -3.196  9.505  1.00 2.40 ?  26 LYS   A HZ3  1  
ATOM   402  N N    . GLY   A 1 27 ? -8.073  -1.286  3.684  1.00 0.14 ?  27 GLY   A N    1  
ATOM   403  C CA   . GLY   A 1 27 ? -6.703  -0.907  3.931  1.00 0.13 ?  27 GLY   A CA   1  
ATOM   404  C C    . GLY   A 1 27 ? -5.755  -1.630  3.006  1.00 0.12 ?  27 GLY   A C    1  
ATOM   405  O O    . GLY   A 1 27 ? -6.196  -2.390  2.142  1.00 0.15 ?  27 GLY   A O    1  
ATOM   406  H H    . GLY   A 1 27 ? -8.267  -2.031  3.076  1.00 0.25 ?  27 GLY   A H    1  
ATOM   407  H HA2  . GLY   A 1 27 ? -6.598  0.158   3.785  1.00 0.14 ?  27 GLY   A HA2  1  
ATOM   408  H HA3  . GLY   A 1 27 ? -6.449  -1.150  4.951  1.00 0.17 ?  27 GLY   A HA3  1  
ATOM   409  N N    . GLY   A 1 28 ? -4.466  -1.408  3.183  1.00 0.13 ?  28 GLY   A N    1  
ATOM   410  C CA   . GLY   A 1 28 ? -3.483  -2.068  2.357  1.00 0.13 ?  28 GLY   A CA   1  
ATOM   411  C C    . GLY   A 1 28 ? -2.108  -2.024  2.979  1.00 0.16 ?  28 GLY   A C    1  
ATOM   412  O O    . GLY   A 1 28 ? -1.565  -0.945  3.233  1.00 0.20 ?  28 GLY   A O    1  
ATOM   413  H H    . GLY   A 1 28 ? -4.171  -0.801  3.895  1.00 0.15 ?  28 GLY   A H    1  
ATOM   414  H HA2  . GLY   A 1 28 ? -3.775  -3.099  2.230  1.00 0.14 ?  28 GLY   A HA2  1  
ATOM   415  H HA3  . GLY   A 1 28 ? -3.450  -1.588  1.393  1.00 0.15 ?  28 GLY   A HA3  1  
ATOM   416  N N    . TYR   A 1 29 ? -1.564  -3.195  3.268  1.00 0.17 ?  29 TYR   A N    1  
ATOM   417  C CA   . TYR   A 1 29 ? -0.249  -3.286  3.871  1.00 0.22 ?  29 TYR   A CA   1  
ATOM   418  C C    . TYR   A 1 29 ? 0.811   -3.458  2.792  1.00 0.20 ?  29 TYR   A C    1  
ATOM   419  O O    . TYR   A 1 29 ? 0.562   -4.076  1.753  1.00 0.17 ?  29 TYR   A O    1  
ATOM   420  C CB   . TYR   A 1 29 ? -0.182  -4.413  4.917  1.00 0.28 ?  29 TYR   A CB   1  
ATOM   421  C CG   . TYR   A 1 29 ? -0.476  -5.806  4.401  1.00 0.33 ?  29 TYR   A CG   1  
ATOM   422  C CD1  . TYR   A 1 29 ? 0.551   -6.648  3.990  1.00 0.46 ?  29 TYR   A CD1  1  
ATOM   423  C CD2  . TYR   A 1 29 ? -1.777  -6.290  4.354  1.00 0.44 ?  29 TYR   A CD2  1  
ATOM   424  C CE1  . TYR   A 1 29 ? 0.288   -7.929  3.546  1.00 0.58 ?  29 TYR   A CE1  1  
ATOM   425  C CE2  . TYR   A 1 29 ? -2.047  -7.567  3.907  1.00 0.55 ?  29 TYR   A CE2  1  
ATOM   426  C CZ   . TYR   A 1 29 ? -1.013  -8.383  3.506  1.00 0.60 ?  29 TYR   A CZ   1  
ATOM   427  O OH   . TYR   A 1 29 ? -1.280  -9.661  3.069  1.00 0.73 ?  29 TYR   A OH   1  
ATOM   428  H H    . TYR   A 1 29 ? -2.037  -4.018  3.015  1.00 0.17 ?  29 TYR   A H    1  
ATOM   429  H HA   . TYR   A 1 29 ? -0.066  -2.345  4.371  1.00 0.26 ?  29 TYR   A HA   1  
ATOM   430  H HB2  . TYR   A 1 29 ? 0.806   -4.430  5.344  1.00 0.35 ?  29 TYR   A HB2  1  
ATOM   431  H HB3  . TYR   A 1 29 ? -0.892  -4.197  5.702  1.00 0.30 ?  29 TYR   A HB3  1  
ATOM   432  H HD1  . TYR   A 1 29 ? 1.567   -6.288  4.020  1.00 0.55 ?  29 TYR   A HD1  1  
ATOM   433  H HD2  . TYR   A 1 29 ? -2.585  -5.648  4.669  1.00 0.53 ?  29 TYR   A HD2  1  
ATOM   434  H HE1  . TYR   A 1 29 ? 1.098   -8.569  3.235  1.00 0.72 ?  29 TYR   A HE1  1  
ATOM   435  H HE2  . TYR   A 1 29 ? -3.066  -7.923  3.875  1.00 0.69 ?  29 TYR   A HE2  1  
ATOM   436  H HH   . TYR   A 1 29 ? -0.634  -10.270 3.448  1.00 1.12 ?  29 TYR   A HH   1  
ATOM   437  N N    . CYS   A 1 30 ? 1.989   -2.911  3.036  1.00 0.22 ?  30 CYS   A N    1  
ATOM   438  C CA   . CYS   A 1 30 ? 3.068   -2.975  2.069  1.00 0.19 ?  30 CYS   A CA   1  
ATOM   439  C C    . CYS   A 1 30 ? 3.924   -4.207  2.329  1.00 0.20 ?  30 CYS   A C    1  
ATOM   440  O O    . CYS   A 1 30 ? 4.396   -4.420  3.448  1.00 0.32 ?  30 CYS   A O    1  
ATOM   441  C CB   . CYS   A 1 30 ? 3.918   -1.710  2.151  1.00 0.27 ?  30 CYS   A CB   1  
ATOM   442  S SG   . CYS   A 1 30 ? 5.077   -1.513  0.770  1.00 0.86 ?  30 CYS   A SG   1  
ATOM   443  H H    . CYS   A 1 30 ? 2.141   -2.467  3.897  1.00 0.27 ?  30 CYS   A H    1  
ATOM   444  H HA   . CYS   A 1 30 ? 2.633   -3.048  1.084  1.00 0.21 ?  30 CYS   A HA   1  
ATOM   445  H HB2  . CYS   A 1 30 ? 3.268   -0.846  2.156  1.00 0.76 ?  30 CYS   A HB2  1  
ATOM   446  H HB3  . CYS   A 1 30 ? 4.492   -1.732  3.064  1.00 0.88 ?  30 CYS   A HB3  1  
ATOM   447  N N    . ALA   A 1 31 ? 4.125   -5.016  1.301  1.00 0.19 ?  31 ALA   A N    1  
ATOM   448  C CA   . ALA   A 1 31 ? 4.808   -6.289  1.461  1.00 0.28 ?  31 ALA   A CA   1  
ATOM   449  C C    . ALA   A 1 31 ? 5.879   -6.508  0.395  1.00 0.22 ?  31 ALA   A C    1  
ATOM   450  O O    . ALA   A 1 31 ? 6.048   -5.694  -0.522 1.00 0.16 ?  31 ALA   A O    1  
ATOM   451  C CB   . ALA   A 1 31 ? 3.797   -7.424  1.425  1.00 0.42 ?  31 ALA   A CB   1  
ATOM   452  H H    . ALA   A 1 31 ? 3.805   -4.749  0.409  1.00 0.20 ?  31 ALA   A H    1  
ATOM   453  H HA   . ALA   A 1 31 ? 5.278   -6.293  2.432  1.00 0.36 ?  31 ALA   A HA   1  
ATOM   454  H HB1  . ALA   A 1 31 ? 4.295   -8.360  1.631  1.00 1.01 ?  31 ALA   A HB1  1  
ATOM   455  H HB2  . ALA   A 1 31 ? 3.341   -7.469  0.447  1.00 1.08 ?  31 ALA   A HB2  1  
ATOM   456  H HB3  . ALA   A 1 31 ? 3.035   -7.252  2.169  1.00 1.16 ?  31 ALA   A HB3  1  
ATOM   457  N N    . LYS   A 1 32 ? 6.604   -7.617  0.552  1.00 0.28 ?  32 LYS   A N    1  
ATOM   458  C CA   . LYS   A 1 32 ? 7.606   -8.072  -0.406 1.00 0.26 ?  32 LYS   A CA   1  
ATOM   459  C C    . LYS   A 1 32 ? 8.656   -6.995  -0.671 1.00 0.26 ?  32 LYS   A C    1  
ATOM   460  O O    . LYS   A 1 32 ? 8.656   -6.357  -1.728 1.00 0.24 ?  32 LYS   A O    1  
ATOM   461  C CB   . LYS   A 1 32 ? 6.932   -8.509  -1.713 1.00 0.25 ?  32 LYS   A CB   1  
ATOM   462  C CG   . LYS   A 1 32 ? 7.833   -9.316  -2.632 1.00 1.09 ?  32 LYS   A CG   1  
ATOM   463  C CD   . LYS   A 1 32 ? 7.085   -9.797  -3.860 1.00 1.62 ?  32 LYS   A CD   1  
ATOM   464  C CE   . LYS   A 1 32 ? 7.942   -10.720 -4.712 1.00 2.37 ?  32 LYS   A CE   1  
ATOM   465  N NZ   . LYS   A 1 32 ? 8.344   -11.950 -3.977 1.00 2.43 1  32 LYS   A NZ   1  
ATOM   466  H H    . LYS   A 1 32 ? 6.463   -8.149  1.362  1.00 0.37 ?  32 LYS   A H    1  
ATOM   467  H HA   . LYS   A 1 32 ? 8.098   -8.926  0.031  1.00 0.32 ?  32 LYS   A HA   1  
ATOM   468  H HB2  . LYS   A 1 32 ? 6.070   -9.111  -1.477 1.00 0.88 ?  32 LYS   A HB2  1  
ATOM   469  H HB3  . LYS   A 1 32 ? 6.609   -7.627  -2.244 1.00 0.84 ?  32 LYS   A HB3  1  
ATOM   470  H HG2  . LYS   A 1 32 ? 8.653   -8.695  -2.952 1.00 1.65 ?  32 LYS   A HG2  1  
ATOM   471  H HG3  . LYS   A 1 32 ? 8.211   -10.171 -2.093 1.00 1.76 ?  32 LYS   A HG3  1  
ATOM   472  H HD2  . LYS   A 1 32 ? 6.203   -10.332 -3.544 1.00 2.05 ?  32 LYS   A HD2  1  
ATOM   473  H HD3  . LYS   A 1 32 ? 6.798   -8.941  -4.449 1.00 1.80 ?  32 LYS   A HD3  1  
ATOM   474  H HE2  . LYS   A 1 32 ? 7.380   -11.004 -5.588 1.00 2.75 ?  32 LYS   A HE2  1  
ATOM   475  H HE3  . LYS   A 1 32 ? 8.831   -10.184 -5.014 1.00 3.09 ?  32 LYS   A HE3  1  
ATOM   476  H HZ1  . LYS   A 1 32 ? 7.501   -12.447 -3.623 1.00 2.11 ?  32 LYS   A HZ1  1  
ATOM   477  H HZ2  . LYS   A 1 32 ? 8.950   -11.706 -3.170 1.00 3.00 ?  32 LYS   A HZ2  1  
ATOM   478  H HZ3  . LYS   A 1 32 ? 8.868   -12.590 -4.608 1.00 2.96 ?  32 LYS   A HZ3  1  
HETATM 479  N N    . DPR   A 1 33 ? 9.568   -6.784  0.295  1.00 0.37 ?  33 DPR   A N    1  
HETATM 480  C CA   . DPR   A 1 33 ? 10.627  -5.773  0.186  1.00 0.44 ?  33 DPR   A CA   1  
HETATM 481  C CB   . DPR   A 1 33 ? 11.339  -5.832  1.540  1.00 0.59 ?  33 DPR   A CB   1  
HETATM 482  C CG   . DPR   A 1 33 ? 11.011  -7.169  2.096  1.00 0.61 ?  33 DPR   A CG   1  
HETATM 483  C CD   . DPR   A 1 33 ? 9.648   -7.522  1.567  1.00 0.47 ?  33 DPR   A CD   1  
HETATM 484  C C    . DPR   A 1 33 ? 10.063  -4.379  -0.055 1.00 0.39 ?  33 DPR   A C    1  
HETATM 485  O O    . DPR   A 1 33 ? 10.712  -3.532  -0.666 1.00 0.47 ?  33 DPR   A O    1  
HETATM 486  H HA   . DPR   A 1 33 ? 11.327  -6.017  -0.595 1.00 0.48 ?  33 DPR   A HA   1  
HETATM 487  H HB2  . DPR   A 1 33 ? 10.969  -5.045  2.178  1.00 0.61 ?  33 DPR   A HB2  1  
HETATM 488  H HB3  . DPR   A 1 33 ? 12.404  -5.715  1.397  1.00 0.67 ?  33 DPR   A HB3  1  
HETATM 489  H HG2  . DPR   A 1 33 ? 10.994  -7.119  3.173  1.00 0.70 ?  33 DPR   A HG2  1  
HETATM 490  H HG3  . DPR   A 1 33 ? 11.741  -7.892  1.764  1.00 0.65 ?  33 DPR   A HG3  1  
HETATM 491  H HD2  . DPR   A 1 33 ? 8.877   -7.194  2.251  1.00 0.49 ?  33 DPR   A HD2  1  
HETATM 492  H HD3  . DPR   A 1 33 ? 9.573   -8.584  1.401  1.00 0.47 ?  33 DPR   A HD3  1  
ATOM   493  N N    . GLY   A 1 34 ? 8.847   -4.158  0.430  1.00 0.32 ?  34 GLY   A N    1  
ATOM   494  C CA   . GLY   A 1 34 ? 8.197   -2.876  0.266  1.00 0.30 ?  34 GLY   A CA   1  
ATOM   495  C C    . GLY   A 1 34 ? 7.939   -2.535  -1.186 1.00 0.25 ?  34 GLY   A C    1  
ATOM   496  O O    . GLY   A 1 34 ? 7.993   -1.369  -1.571 1.00 0.30 ?  34 GLY   A O    1  
ATOM   497  H H    . GLY   A 1 34 ? 8.385   -4.878  0.909  1.00 0.32 ?  34 GLY   A H    1  
ATOM   498  H HA2  . GLY   A 1 34 ? 7.255   -2.891  0.794  1.00 0.31 ?  34 GLY   A HA2  1  
ATOM   499  H HA3  . GLY   A 1 34 ? 8.825   -2.112  0.695  1.00 0.36 ?  34 GLY   A HA3  1  
ATOM   500  N N    . PHE   A 1 35 ? 7.673   -3.546  -2.003 1.00 0.19 ?  35 PHE   A N    1  
ATOM   501  C CA   . PHE   A 1 35 ? 7.388   -3.317  -3.413 1.00 0.20 ?  35 PHE   A CA   1  
ATOM   502  C C    . PHE   A 1 35 ? 5.940   -3.634  -3.762 1.00 0.17 ?  35 PHE   A C    1  
ATOM   503  O O    . PHE   A 1 35 ? 5.396   -3.094  -4.727 1.00 0.29 ?  35 PHE   A O    1  
ATOM   504  C CB   . PHE   A 1 35 ? 8.318   -4.143  -4.297 1.00 0.23 ?  35 PHE   A CB   1  
ATOM   505  C CG   . PHE   A 1 35 ? 9.682   -3.540  -4.466 1.00 0.31 ?  35 PHE   A CG   1  
ATOM   506  C CD1  . PHE   A 1 35 ? 10.787  -4.095  -3.842 1.00 0.40 ?  35 PHE   A CD1  1  
ATOM   507  C CD2  . PHE   A 1 35 ? 9.860   -2.413  -5.254 1.00 0.37 ?  35 PHE   A CD2  1  
ATOM   508  C CE1  . PHE   A 1 35 ? 12.041  -3.543  -4.002 1.00 0.49 ?  35 PHE   A CE1  1  
ATOM   509  C CE2  . PHE   A 1 35 ? 11.112  -1.856  -5.417 1.00 0.46 ?  35 PHE   A CE2  1  
ATOM   510  C CZ   . PHE   A 1 35 ? 12.204  -2.420  -4.791 1.00 0.51 ?  35 PHE   A CZ   1  
ATOM   511  H H    . PHE   A 1 35 ? 7.689   -4.469  -1.654 1.00 0.19 ?  35 PHE   A H    1  
ATOM   512  H HA   . PHE   A 1 35 ? 7.566   -2.272  -3.612 1.00 0.24 ?  35 PHE   A HA   1  
ATOM   513  H HB2  . PHE   A 1 35 ? 8.439   -5.123  -3.860 1.00 0.24 ?  35 PHE   A HB2  1  
ATOM   514  H HB3  . PHE   A 1 35 ? 7.874   -4.243  -5.275 1.00 0.27 ?  35 PHE   A HB3  1  
ATOM   515  H HD1  . PHE   A 1 35 ? 10.661  -4.971  -3.225 1.00 0.45 ?  35 PHE   A HD1  1  
ATOM   516  H HD2  . PHE   A 1 35 ? 9.004   -1.970  -5.743 1.00 0.40 ?  35 PHE   A HD2  1  
ATOM   517  H HE1  . PHE   A 1 35 ? 12.893  -3.985  -3.512 1.00 0.59 ?  35 PHE   A HE1  1  
ATOM   518  H HE2  . PHE   A 1 35 ? 11.237  -0.977  -6.032 1.00 0.54 ?  35 PHE   A HE2  1  
ATOM   519  H HZ   . PHE   A 1 35 ? 13.184  -1.986  -4.917 1.00 0.60 ?  35 PHE   A HZ   1  
ATOM   520  N N    . VAL   A 1 36 ? 5.313   -4.499  -2.984 1.00 0.12 ?  36 VAL   A N    1  
ATOM   521  C CA   . VAL   A 1 36 ? 3.969   -4.944  -3.291 1.00 0.17 ?  36 VAL   A CA   1  
ATOM   522  C C    . VAL   A 1 36 ? 2.950   -4.351  -2.329 1.00 0.15 ?  36 VAL   A C    1  
ATOM   523  O O    . VAL   A 1 36 ? 2.951   -4.648  -1.138 1.00 0.17 ?  36 VAL   A O    1  
ATOM   524  C CB   . VAL   A 1 36 ? 3.871   -6.483  -3.267 1.00 0.23 ?  36 VAL   A CB   1  
ATOM   525  C CG1  . VAL   A 1 36 ? 2.429   -6.939  -3.438 1.00 0.32 ?  36 VAL   A CG1  1  
ATOM   526  C CG2  . VAL   A 1 36 ? 4.744   -7.087  -4.353 1.00 0.25 ?  36 VAL   A CG2  1  
ATOM   527  H H    . VAL   A 1 36 ? 5.754   -4.837  -2.176 1.00 0.17 ?  36 VAL   A H    1  
ATOM   528  H HA   . VAL   A 1 36 ? 3.733   -4.610  -4.290 1.00 0.20 ?  36 VAL   A HA   1  
ATOM   529  H HB   . VAL   A 1 36 ? 4.229   -6.833  -2.309 1.00 0.24 ?  36 VAL   A HB   1  
ATOM   530  H HG11 . VAL   A 1 36 ? 1.825   -6.527  -2.643 1.00 1.12 ?  36 VAL   A HG11 1  
ATOM   531  H HG12 . VAL   A 1 36 ? 2.386   -8.017  -3.402 1.00 1.04 ?  36 VAL   A HG12 1  
ATOM   532  H HG13 . VAL   A 1 36 ? 2.054   -6.595  -4.390 1.00 1.00 ?  36 VAL   A HG13 1  
ATOM   533  H HG21 . VAL   A 1 36 ? 5.760   -6.734  -4.239 1.00 1.04 ?  36 VAL   A HG21 1  
ATOM   534  H HG22 . VAL   A 1 36 ? 4.368   -6.793  -5.321 1.00 0.94 ?  36 VAL   A HG22 1  
ATOM   535  H HG23 . VAL   A 1 36 ? 4.726   -8.164  -4.272 1.00 1.08 ?  36 VAL   A HG23 1  
ATOM   536  N N    . CYS   A 1 37 ? 2.095   -3.501  -2.859 1.00 0.15 ?  37 CYS   A N    1  
ATOM   537  C CA   . CYS   A 1 37 ? 0.985   -2.951  -2.101 1.00 0.14 ?  37 CYS   A CA   1  
ATOM   538  C C    . CYS   A 1 37 ? -0.154  -3.964  -2.094 1.00 0.12 ?  37 CYS   A C    1  
ATOM   539  O O    . CYS   A 1 37 ? -0.708  -4.290  -3.148 1.00 0.18 ?  37 CYS   A O    1  
ATOM   540  C CB   . CYS   A 1 37 ? 0.534   -1.629  -2.735 1.00 0.16 ?  37 CYS   A CB   1  
ATOM   541  S SG   . CYS   A 1 37 ? -0.895  -0.834  -1.928 1.00 0.14 ?  37 CYS   A SG   1  
ATOM   542  H H    . CYS   A 1 37 ? 2.206   -3.240  -3.798 1.00 0.16 ?  37 CYS   A H    1  
ATOM   543  H HA   . CYS   A 1 37 ? 1.316   -2.776  -1.088 1.00 0.14 ?  37 CYS   A HA   1  
ATOM   544  H HB2  . CYS   A 1 37 ? 1.354   -0.925  -2.706 1.00 0.20 ?  37 CYS   A HB2  1  
ATOM   545  H HB3  . CYS   A 1 37 ? 0.265   -1.812  -3.764 1.00 0.18 ?  37 CYS   A HB3  1  
ATOM   546  N N    . LYS   A 1 38 ? -0.480  -4.499  -0.925 1.00 0.10 ?  38 LYS   A N    1  
ATOM   547  C CA   . LYS   A 1 38 ? -1.485  -5.543  -0.846 1.00 0.11 ?  38 LYS   A CA   1  
ATOM   548  C C    . LYS   A 1 38 ? -2.695  -5.076  -0.054 1.00 0.11 ?  38 LYS   A C    1  
ATOM   549  O O    . LYS   A 1 38 ? -2.617  -4.832  1.152  1.00 0.12 ?  38 LYS   A O    1  
ATOM   550  C CB   . LYS   A 1 38 ? -0.893  -6.815  -0.240 1.00 0.15 ?  38 LYS   A CB   1  
ATOM   551  C CG   . LYS   A 1 38 ? -1.803  -8.024  -0.396 1.00 0.26 ?  38 LYS   A CG   1  
ATOM   552  C CD   . LYS   A 1 38 ? -1.077  -9.334  -0.118 1.00 0.70 ?  38 LYS   A CD   1  
ATOM   553  C CE   . LYS   A 1 38 ? -0.037  -9.656  -1.188 1.00 1.19 ?  38 LYS   A CE   1  
ATOM   554  N NZ   . LYS   A 1 38 ? -0.637  -9.733  -2.546 1.00 2.16 1  38 LYS   A NZ   1  
ATOM   555  H H    . LYS   A 1 38 ? -0.047  -4.178  -0.099 1.00 0.13 ?  38 LYS   A H    1  
ATOM   556  H HA   . LYS   A 1 38 ? -1.805  -5.757  -1.854 1.00 0.12 ?  38 LYS   A HA   1  
ATOM   557  H HB2  . LYS   A 1 38 ? 0.049   -7.026  -0.723 1.00 0.14 ?  38 LYS   A HB2  1  
ATOM   558  H HB3  . LYS   A 1 38 ? -0.719  -6.652  0.815  1.00 0.19 ?  38 LYS   A HB3  1  
ATOM   559  H HG2  . LYS   A 1 38 ? -2.626  -7.929  0.291  1.00 0.63 ?  38 LYS   A HG2  1  
ATOM   560  H HG3  . LYS   A 1 38 ? -2.185  -8.042  -1.403 1.00 0.69 ?  38 LYS   A HG3  1  
ATOM   561  H HD2  . LYS   A 1 38 ? -0.584  -9.261  0.839  1.00 1.20 ?  38 LYS   A HD2  1  
ATOM   562  H HD3  . LYS   A 1 38 ? -1.805  -10.134 -0.086 1.00 1.36 ?  38 LYS   A HD3  1  
ATOM   563  H HE2  . LYS   A 1 38 ? 0.724   -8.890  -1.183 1.00 1.63 ?  38 LYS   A HE2  1  
ATOM   564  H HE3  . LYS   A 1 38 ? 0.418   -10.608 -0.953 1.00 1.57 ?  38 LYS   A HE3  1  
ATOM   565  H HZ1  . LYS   A 1 38 ? -1.375  -10.466 -2.571 1.00 2.60 ?  38 LYS   A HZ1  1  
ATOM   566  H HZ2  . LYS   A 1 38 ? 0.094   -9.972  -3.245 1.00 2.57 ?  38 LYS   A HZ2  1  
ATOM   567  H HZ3  . LYS   A 1 38 ? -1.063  -8.820  -2.805 1.00 2.71 ?  38 LYS   A HZ3  1  
ATOM   568  N N    . CYS   A 1 39 ? -3.815  -4.975  -0.748 1.00 0.12 ?  39 CYS   A N    1  
ATOM   569  C CA   . CYS   A 1 39 ? -5.032  -4.437  -0.173 1.00 0.12 ?  39 CYS   A CA   1  
ATOM   570  C C    . CYS   A 1 39 ? -5.837  -5.522  0.528  1.00 0.15 ?  39 CYS   A C    1  
ATOM   571  O O    . CYS   A 1 39 ? -5.799  -6.691  0.141  1.00 0.19 ?  39 CYS   A O    1  
ATOM   572  C CB   . CYS   A 1 39 ? -5.881  -3.794  -1.265 1.00 0.13 ?  39 CYS   A CB   1  
ATOM   573  S SG   . CYS   A 1 39 ? -4.974  -2.612  -2.311 1.00 0.14 ?  39 CYS   A SG   1  
ATOM   574  H H    . CYS   A 1 39 ? -3.825  -5.279  -1.679 1.00 0.16 ?  39 CYS   A H    1  
ATOM   575  H HA   . CYS   A 1 39 ? -4.757  -3.685  0.547  1.00 0.11 ?  39 CYS   A HA   1  
ATOM   576  H HB2  . CYS   A 1 39 ? -6.275  -4.567  -1.906 1.00 0.15 ?  39 CYS   A HB2  1  
ATOM   577  H HB3  . CYS   A 1 39 ? -6.701  -3.261  -0.802 1.00 0.15 ?  39 CYS   A HB3  1  
ATOM   578  N N    . TYR   A 1 40 ? -6.565  -5.117  1.555  1.00 0.18 ?  40 TYR   A N    1  
ATOM   579  C CA   . TYR   A 1 40 ? -7.423  -6.017  2.307  1.00 0.25 ?  40 TYR   A CA   1  
ATOM   580  C C    . TYR   A 1 40 ? -8.701  -5.292  2.715  1.00 0.32 ?  40 TYR   A C    1  
ATOM   581  O O    . TYR   A 1 40 ? -8.678  -4.098  3.018  1.00 0.88 ?  40 TYR   A O    1  
ATOM   582  C CB   . TYR   A 1 40 ? -6.692  -6.561  3.541  1.00 0.27 ?  40 TYR   A CB   1  
ATOM   583  C CG   . TYR   A 1 40 ? -6.214  -5.499  4.507  1.00 0.25 ?  40 TYR   A CG   1  
ATOM   584  C CD1  . TYR   A 1 40 ? -4.951  -4.935  4.381  1.00 0.22 ?  40 TYR   A CD1  1  
ATOM   585  C CD2  . TYR   A 1 40 ? -7.022  -5.070  5.553  1.00 0.32 ?  40 TYR   A CD2  1  
ATOM   586  C CE1  . TYR   A 1 40 ? -4.509  -3.974  5.267  1.00 0.25 ?  40 TYR   A CE1  1  
ATOM   587  C CE2  . TYR   A 1 40 ? -6.586  -4.107  6.441  1.00 0.35 ?  40 TYR   A CE2  1  
ATOM   588  C CZ   . TYR   A 1 40 ? -5.329  -3.563  6.294  1.00 0.31 ?  40 TYR   A CZ   1  
ATOM   589  O OH   . TYR   A 1 40 ? -4.894  -2.599  7.171  1.00 0.37 ?  40 TYR   A OH   1  
ATOM   590  H H    . TYR   A 1 40 ? -6.525  -4.168  1.819  1.00 0.18 ?  40 TYR   A H    1  
ATOM   591  H HA   . TYR   A 1 40 ? -7.683  -6.842  1.661  1.00 0.31 ?  40 TYR   A HA   1  
ATOM   592  H HB2  . TYR   A 1 40 ? -7.353  -7.220  4.081  1.00 0.32 ?  40 TYR   A HB2  1  
ATOM   593  H HB3  . TYR   A 1 40 ? -5.828  -7.122  3.214  1.00 0.28 ?  40 TYR   A HB3  1  
ATOM   594  H HD1  . TYR   A 1 40 ? -4.313  -5.253  3.569  1.00 0.22 ?  40 TYR   A HD1  1  
ATOM   595  H HD2  . TYR   A 1 40 ? -8.006  -5.499  5.664  1.00 0.36 ?  40 TYR   A HD2  1  
ATOM   596  H HE1  . TYR   A 1 40 ? -3.524  -3.547  5.152  1.00 0.26 ?  40 TYR   A HE1  1  
ATOM   597  H HE2  . TYR   A 1 40 ? -7.230  -3.786  7.246  1.00 0.41 ?  40 TYR   A HE2  1  
ATOM   598  H HH   . TYR   A 1 40 ? -5.218  -2.802  8.059  1.00 1.13 ?  40 TYR   A HH   1  
HETATM 599  N N    . NH2   A 1 41 ? -9.818  -5.996  2.692  1.00 0.59 ?  41 NH2   A N    1  
HETATM 600  H HN1  . NH2   A 1 41 ? -9.764  -6.942  2.440  1.00 1.06 ?  41 NH2   A HN1  1  
HETATM 601  H HN2  . NH2   A 1 41 ? -10.657 -5.548  2.937  1.00 0.56 ?  41 NH2   A HN2  1  
ATOM   602  N N    . GLY   A 1 1  ? 4.108   2.395   -8.959 1.00 1.74 ?  1  GLY   A N    2  
ATOM   603  C CA   . GLY   A 1 1  ? 3.930   1.887   -7.578 1.00 0.89 ?  1  GLY   A CA   2  
ATOM   604  C C    . GLY   A 1 1  ? 2.830   2.620   -6.841 1.00 0.90 ?  1  GLY   A C    2  
ATOM   605  O O    . GLY   A 1 1  ? 2.257   3.575   -7.366 1.00 1.76 ?  1  GLY   A O    2  
ATOM   606  H H1   . GLY   A 1 1  ? 3.221   2.293   -9.494 1.00 2.34 ?  1  GLY   A H1   2  
ATOM   607  H H2   . GLY   A 1 1  ? 4.855   1.863   -9.445 1.00 1.93 ?  1  GLY   A H2   2  
ATOM   608  H H3   . GLY   A 1 1  ? 4.369   3.401   -8.937 1.00 2.29 ?  1  GLY   A H3   2  
ATOM   609  H HA2  . GLY   A 1 1  ? 3.682   0.837   -7.621 1.00 0.93 ?  1  GLY   A HA2  2  
ATOM   610  H HA3  . GLY   A 1 1  ? 4.857   2.008   -7.038 1.00 1.19 ?  1  GLY   A HA3  2  
ATOM   611  N N    . PHE   A 1 2  ? 2.528   2.173   -5.628 1.00 0.43 ?  2  PHE   A N    2  
ATOM   612  C CA   . PHE   A 1 2  ? 1.475   2.783   -4.824 1.00 0.24 ?  2  PHE   A CA   2  
ATOM   613  C C    . PHE   A 1 2  ? 1.977   3.054   -3.412 1.00 0.22 ?  2  PHE   A C    2  
ATOM   614  O O    . PHE   A 1 2  ? 1.384   2.611   -2.433 1.00 0.35 ?  2  PHE   A O    2  
ATOM   615  C CB   . PHE   A 1 2  ? 0.243   1.875   -4.777 1.00 0.16 ?  2  PHE   A CB   2  
ATOM   616  C CG   . PHE   A 1 2  ? -0.287  1.521   -6.137 1.00 0.18 ?  2  PHE   A CG   2  
ATOM   617  C CD1  . PHE   A 1 2  ? -0.108  0.252   -6.659 1.00 0.25 ?  2  PHE   A CD1  2  
ATOM   618  C CD2  . PHE   A 1 2  ? -0.953  2.467   -6.894 1.00 0.22 ?  2  PHE   A CD2  2  
ATOM   619  C CE1  . PHE   A 1 2  ? -0.591  -0.069  -7.913 1.00 0.30 ?  2  PHE   A CE1  2  
ATOM   620  C CE2  . PHE   A 1 2  ? -1.437  2.153   -8.149 1.00 0.28 ?  2  PHE   A CE2  2  
ATOM   621  C CZ   . PHE   A 1 2  ? -1.255  0.884   -8.660 1.00 0.29 ?  2  PHE   A CZ   2  
ATOM   622  H H    . PHE   A 1 2  ? 3.027   1.417   -5.261 1.00 1.00 ?  2  PHE   A H    2  
ATOM   623  H HA   . PHE   A 1 2  ? 1.208   3.719   -5.288 1.00 0.34 ?  2  PHE   A HA   2  
ATOM   624  H HB2  . PHE   A 1 2  ? 0.497   0.957   -4.268 1.00 0.26 ?  2  PHE   A HB2  2  
ATOM   625  H HB3  . PHE   A 1 2  ? -0.546  2.374   -4.231 1.00 0.20 ?  2  PHE   A HB3  2  
ATOM   626  H HD1  . PHE   A 1 2  ? 0.413   -0.493  -6.076 1.00 0.32 ?  2  PHE   A HD1  2  
ATOM   627  H HD2  . PHE   A 1 2  ? -1.096  3.459   -6.494 1.00 0.27 ?  2  PHE   A HD2  2  
ATOM   628  H HE1  . PHE   A 1 2  ? -0.445  -1.062  -8.308 1.00 0.37 ?  2  PHE   A HE1  2  
ATOM   629  H HE2  . PHE   A 1 2  ? -1.955  2.902   -8.731 1.00 0.36 ?  2  PHE   A HE2  2  
ATOM   630  H HZ   . PHE   A 1 2  ? -1.633  0.636   -9.640 1.00 0.34 ?  2  PHE   A HZ   2  
ATOM   631  N N    . GLY   A 1 3  ? 3.092   3.763   -3.321 1.00 0.18 ?  3  GLY   A N    2  
ATOM   632  C CA   . GLY   A 1 3  ? 3.683   4.064   -2.034 1.00 0.20 ?  3  GLY   A CA   2  
ATOM   633  C C    . GLY   A 1 3  ? 4.725   3.040   -1.637 1.00 0.19 ?  3  GLY   A C    2  
ATOM   634  O O    . GLY   A 1 3  ? 5.690   3.354   -0.941 1.00 0.21 ?  3  GLY   A O    2  
ATOM   635  H H    . GLY   A 1 3  ? 3.519   4.087   -4.140 1.00 0.21 ?  3  GLY   A H    2  
ATOM   636  H HA2  . GLY   A 1 3  ? 4.147   5.038   -2.083 1.00 0.23 ?  3  GLY   A HA2  2  
ATOM   637  H HA3  . GLY   A 1 3  ? 2.905   4.081   -1.286 1.00 0.24 ?  3  GLY   A HA3  2  
ATOM   638  N N    . CYS   A 1 4  ? 4.523   1.812   -2.083 1.00 0.25 ?  4  CYS   A N    2  
ATOM   639  C CA   . CYS   A 1 4  ? 5.468   0.739   -1.836 1.00 0.27 ?  4  CYS   A CA   2  
ATOM   640  C C    . CYS   A 1 4  ? 6.489   0.684   -2.969 1.00 0.29 ?  4  CYS   A C    2  
ATOM   641  O O    . CYS   A 1 4  ? 6.192   0.190   -4.056 1.00 0.30 ?  4  CYS   A O    2  
ATOM   642  C CB   . CYS   A 1 4  ? 4.723   -0.594  -1.738 1.00 0.28 ?  4  CYS   A CB   2  
ATOM   643  S SG   . CYS   A 1 4  ? 3.216   -0.536  -0.714 1.00 0.39 ?  4  CYS   A SG   2  
ATOM   644  H H    . CYS   A 1 4  ? 3.706   1.619   -2.583 1.00 0.30 ?  4  CYS   A H    2  
ATOM   645  H HA   . CYS   A 1 4  ? 5.976   0.937   -0.907 1.00 0.30 ?  4  CYS   A HA   2  
ATOM   646  H HB2  . CYS   A 1 4  ? 4.431   -0.906  -2.730 1.00 0.21 ?  4  CYS   A HB2  2  
ATOM   647  H HB3  . CYS   A 1 4  ? 5.383   -1.337  -1.313 1.00 0.42 ?  4  CYS   A HB3  2  
ATOM   648  N N    . ASN   A 1 5  ? 7.679   1.214   -2.724 1.00 0.34 ?  5  ASN   A N    2  
ATOM   649  C CA   . ASN   A 1 5  ? 8.721   1.247   -3.742 1.00 0.40 ?  5  ASN   A CA   2  
ATOM   650  C C    . ASN   A 1 5  ? 10.016  0.634   -3.232 1.00 0.40 ?  5  ASN   A C    2  
ATOM   651  O O    . ASN   A 1 5  ? 11.101  0.975   -3.706 1.00 0.47 ?  5  ASN   A O    2  
ATOM   652  C CB   . ASN   A 1 5  ? 8.990   2.683   -4.200 1.00 0.49 ?  5  ASN   A CB   2  
ATOM   653  C CG   . ASN   A 1 5  ? 7.790   3.333   -4.856 1.00 0.49 ?  5  ASN   A CG   2  
ATOM   654  O OD1  . ASN   A 1 5  ? 7.580   3.199   -6.061 1.00 0.65 ?  5  ASN   A OD1  2  
ATOM   655  N ND2  . ASN   A 1 5  ? 7.004   4.056   -4.073 1.00 0.56 ?  5  ASN   A ND2  2  
ATOM   656  H H    . ASN   A 1 5  ? 7.861   1.604   -1.839 1.00 0.36 ?  5  ASN   A H    2  
ATOM   657  H HA   . ASN   A 1 5  ? 8.374   0.670   -4.587 1.00 0.43 ?  5  ASN   A HA   2  
ATOM   658  H HB2  . ASN   A 1 5  ? 9.267   3.275   -3.344 1.00 0.51 ?  5  ASN   A HB2  2  
ATOM   659  H HB3  . ASN   A 1 5  ? 9.806   2.677   -4.906 1.00 0.57 ?  5  ASN   A HB3  2  
ATOM   660  H HD21 . ASN   A 1 5  ? 7.236   4.130   -3.122 1.00 0.70 ?  5  ASN   A HD21 2  
ATOM   661  H HD22 . ASN   A 1 5  ? 6.227   4.491   -4.476 1.00 0.61 ?  5  ASN   A HD22 2  
ATOM   662  N N    . GLY   A 1 6  ? 9.911   -0.265  -2.271 1.00 0.36 ?  6  GLY   A N    2  
ATOM   663  C CA   . GLY   A 1 6  ? 11.087  -0.942  -1.772 1.00 0.38 ?  6  GLY   A CA   2  
ATOM   664  C C    . GLY   A 1 6  ? 11.307  -0.727  -0.293 1.00 0.37 ?  6  GLY   A C    2  
ATOM   665  O O    . GLY   A 1 6  ? 10.597  0.057   0.335  1.00 0.36 ?  6  GLY   A O    2  
ATOM   666  H H    . GLY   A 1 6  ? 9.029   -0.475  -1.895 1.00 0.34 ?  6  GLY   A H    2  
ATOM   667  H HA2  . GLY   A 1 6  ? 10.980  -2.001  -1.958 1.00 0.48 ?  6  GLY   A HA2  2  
ATOM   668  H HA3  . GLY   A 1 6  ? 11.949  -0.578  -2.313 1.00 0.44 ?  6  GLY   A HA3  2  
HETATM 669  C C2   . 6ZS   A 1 7  ? 14.057  -3.318  0.955  1.00 1.49 ?  7  6ZS   A C2   2  
HETATM 670  N N    . 6ZS   A 1 7  ? 12.311  -1.417  0.250  1.00 0.47 ?  7  6ZS   A N    2  
HETATM 671  C CA   . 6ZS   A 1 7  ? 12.619  -1.395  1.689  1.00 0.61 ?  7  6ZS   A CA   2  
HETATM 672  C CB1  . 6ZS   A 1 7  ? 11.489  -2.031  2.480  1.00 0.71 ?  7  6ZS   A CB1  2  
HETATM 673  C C    . 6ZS   A 1 7  ? 12.843  0.044   2.154  1.00 0.59 ?  7  6ZS   A C    2  
HETATM 674  O O    . 6ZS   A 1 7  ? 12.425  0.434   3.246  1.00 1.09 ?  7  6ZS   A O    2  
HETATM 675  C CB   . 6ZS   A 1 7  ? 13.882  -2.200  1.967  1.00 0.75 ?  7  6ZS   A CB   2  
HETATM 676  H H1   . 6ZS   A 1 7  ? 14.893  -3.938  1.245  1.00 2.14 ?  7  6ZS   A H1   2  
HETATM 677  H H4   . 6ZS   A 1 7  ? 13.161  -3.918  0.916  1.00 1.94 ?  7  6ZS   A H4   2  
HETATM 678  H H3   . 6ZS   A 1 7  ? 14.251  -2.895  -0.019 1.00 2.00 ?  7  6ZS   A H3   2  
HETATM 679  H H    . 6ZS   A 1 7  ? 12.869  -1.965  -0.339 1.00 0.49 ?  7  6ZS   A H    2  
HETATM 680  H H7   . 6ZS   A 1 7  ? 10.578  -1.481  2.309  1.00 1.10 ?  7  6ZS   A H7   2  
HETATM 681  H H8   . 6ZS   A 1 7  ? 11.729  -2.008  3.532  1.00 1.35 ?  7  6ZS   A H8   2  
HETATM 682  H H9   . 6ZS   A 1 7  ? 11.356  -3.054  2.163  1.00 1.26 ?  7  6ZS   A H9   2  
HETATM 683  H H10  . 6ZS   A 1 7  ? 14.744  -1.549  1.906  1.00 1.09 ?  7  6ZS   A H10  2  
HETATM 684  H H11  . 6ZS   A 1 7  ? 13.825  -2.641  2.954  1.00 1.38 ?  7  6ZS   A H11  2  
ATOM   685  N N    . TRP   A 1 8  ? 13.502  0.824   1.315  1.00 0.64 ?  8  TRP   A N    2  
ATOM   686  C CA   . TRP   A 1 8  ? 13.886  2.178   1.668  1.00 0.67 ?  8  TRP   A CA   2  
ATOM   687  C C    . TRP   A 1 8  ? 12.848  3.190   1.200  1.00 0.49 ?  8  TRP   A C    2  
ATOM   688  O O    . TRP   A 1 8  ? 12.991  4.390   1.427  1.00 0.58 ?  8  TRP   A O    2  
ATOM   689  C CB   . TRP   A 1 8  ? 15.253  2.497   1.070  1.00 0.87 ?  8  TRP   A CB   2  
ATOM   690  C CG   . TRP   A 1 8  ? 16.311  1.532   1.506  1.00 1.12 ?  8  TRP   A CG   2  
ATOM   691  C CD1  . TRP   A 1 8  ? 16.806  0.482   0.791  1.00 1.27 ?  8  TRP   A CD1  2  
ATOM   692  C CD2  . TRP   A 1 8  ? 16.985  1.513   2.769  1.00 1.31 ?  8  TRP   A CD2  2  
ATOM   693  N NE1  . TRP   A 1 8  ? 17.756  -0.183  1.524  1.00 1.50 ?  8  TRP   A NE1  2  
ATOM   694  C CE2  . TRP   A 1 8  ? 17.884  0.430   2.745  1.00 1.52 ?  8  TRP   A CE2  2  
ATOM   695  C CE3  . TRP   A 1 8  ? 16.920  2.309   3.915  1.00 1.37 ?  8  TRP   A CE3  2  
ATOM   696  C CZ2  . TRP   A 1 8  ? 18.708  0.124   3.824  1.00 1.76 ?  8  TRP   A CZ2  2  
ATOM   697  C CZ3  . TRP   A 1 8  ? 17.739  2.002   4.985  1.00 1.63 ?  8  TRP   A CZ3  2  
ATOM   698  C CH2  . TRP   A 1 8  ? 18.623  0.918   4.932  1.00 1.80 ?  8  TRP   A CH2  2  
ATOM   699  H H    . TRP   A 1 8  ? 13.741  0.477   0.431  1.00 1.04 ?  8  TRP   A H    2  
ATOM   700  H HA   . TRP   A 1 8  ? 13.958  2.228   2.742  1.00 0.76 ?  8  TRP   A HA   2  
ATOM   701  H HB2  . TRP   A 1 8  ? 15.187  2.460   -0.007 1.00 0.85 ?  8  TRP   A HB2  2  
ATOM   702  H HB3  . TRP   A 1 8  ? 15.554  3.485   1.373  1.00 0.91 ?  8  TRP   A HB3  2  
ATOM   703  H HD1  . TRP   A 1 8  ? 16.490  0.227   -0.208 1.00 1.25 ?  8  TRP   A HD1  2  
ATOM   704  H HE1  . TRP   A 1 8  ? 18.260  -0.972  1.224  1.00 1.65 ?  8  TRP   A HE1  2  
ATOM   705  H HE3  . TRP   A 1 8  ? 16.244  3.148   3.975  1.00 1.26 ?  8  TRP   A HE3  2  
ATOM   706  H HZ2  . TRP   A 1 8  ? 19.396  -0.707  3.801  1.00 1.93 ?  8  TRP   A HZ2  2  
ATOM   707  H HZ3  . TRP   A 1 8  ? 17.701  2.605   5.880  1.00 1.73 ?  8  TRP   A HZ3  2  
ATOM   708  H HH2  . TRP   A 1 8  ? 19.244  0.714   5.790  1.00 2.00 ?  8  TRP   A HH2  2  
ATOM   709  N N    . ASN   A 1 9  ? 11.802  2.706   0.554  1.00 0.33 ?  9  ASN   A N    2  
ATOM   710  C CA   . ASN   A 1 9  ? 10.725  3.567   0.088  1.00 0.29 ?  9  ASN   A CA   2  
ATOM   711  C C    . ASN   A 1 9  ? 9.395   2.865   0.329  1.00 0.25 ?  9  ASN   A C    2  
ATOM   712  O O    . ASN   A 1 9  ? 8.590   2.678   -0.579 1.00 0.36 ?  9  ASN   A O    2  
ATOM   713  C CB   . ASN   A 1 9  ? 10.903  3.895   -1.400 1.00 0.46 ?  9  ASN   A CB   2  
ATOM   714  C CG   . ASN   A 1 9  ? 10.084  5.095   -1.847 1.00 1.31 ?  9  ASN   A CG   2  
ATOM   715  O OD1  . ASN   A 1 9  ? 9.049   5.419   -1.263 1.00 2.05 ?  9  ASN   A OD1  2  
ATOM   716  N ND2  . ASN   A 1 9  ? 10.536  5.759   -2.899 1.00 1.88 ?  9  ASN   A ND2  2  
ATOM   717  H H    . ASN   A 1 9  ? 11.741  1.736   0.395  1.00 0.35 ?  9  ASN   A H    2  
ATOM   718  H HA   . ASN   A 1 9  ? 10.751  4.479   0.663  1.00 0.37 ?  9  ASN   A HA   2  
ATOM   719  H HB2  . ASN   A 1 9  ? 11.945  4.106   -1.591 1.00 1.10 ?  9  ASN   A HB2  2  
ATOM   720  H HB3  . ASN   A 1 9  ? 10.604  3.042   -1.988 1.00 0.63 ?  9  ASN   A HB3  2  
ATOM   721  H HD21 . ASN   A 1 9  ? 11.362  5.445   -3.325 1.00 2.03 ?  9  ASN   A HD21 2  
ATOM   722  H HD22 . ASN   A 1 9  ? 10.024  6.534   -3.211 1.00 2.48 ?  9  ASN   A HD22 2  
ATOM   723  N N    . GLU   A 1 10 ? 9.189   2.463   1.569  1.00 0.23 ?  10 GLU   A N    2  
ATOM   724  C CA   . GLU   A 1 10 ? 8.020   1.687   1.943  1.00 0.26 ?  10 GLU   A CA   2  
ATOM   725  C C    . GLU   A 1 10 ? 7.022   2.565   2.685  1.00 0.28 ?  10 GLU   A C    2  
ATOM   726  O O    . GLU   A 1 10 ? 7.101   2.721   3.905  1.00 0.49 ?  10 GLU   A O    2  
ATOM   727  C CB   . GLU   A 1 10 ? 8.458   0.510   2.818  1.00 0.39 ?  10 GLU   A CB   2  
ATOM   728  C CG   . GLU   A 1 10 ? 7.346   -0.456  3.186  1.00 0.45 ?  10 GLU   A CG   2  
ATOM   729  C CD   . GLU   A 1 10 ? 7.814   -1.523  4.155  1.00 0.68 ?  10 GLU   A CD   2  
ATOM   730  O OE1  . GLU   A 1 10 ? 8.125   -1.182  5.319  1.00 0.95 ?  10 GLU   A OE1  2  
ATOM   731  O OE2  . GLU   A 1 10 ? 7.882   -2.706  3.766  1.00 0.78 -1 10 GLU   A OE2  2  
ATOM   732  H H    . GLU   A 1 10 ? 9.844   2.698   2.259  1.00 0.28 ?  10 GLU   A H    2  
ATOM   733  H HA   . GLU   A 1 10 ? 7.560   1.313   1.043  1.00 0.27 ?  10 GLU   A HA   2  
ATOM   734  H HB2  . GLU   A 1 10 ? 9.218   -0.044  2.292  1.00 0.43 ?  10 GLU   A HB2  2  
ATOM   735  H HB3  . GLU   A 1 10 ? 8.879   0.899   3.731  1.00 0.48 ?  10 GLU   A HB3  2  
ATOM   736  H HG2  . GLU   A 1 10 ? 6.539   0.096   3.637  1.00 0.47 ?  10 GLU   A HG2  2  
ATOM   737  H HG3  . GLU   A 1 10 ? 6.995   -0.936  2.288  1.00 0.40 ?  10 GLU   A HG3  2  
ATOM   738  N N    . ASP   A 1 11 ? 6.097   3.156   1.946  1.00 0.23 ?  11 ASP   A N    2  
ATOM   739  C CA   . ASP   A 1 11 ? 5.104   4.034   2.546  1.00 0.30 ?  11 ASP   A CA   2  
ATOM   740  C C    . ASP   A 1 11 ? 3.760   3.325   2.649  1.00 0.23 ?  11 ASP   A C    2  
ATOM   741  O O    . ASP   A 1 11 ? 2.901   3.444   1.764  1.00 0.20 ?  11 ASP   A O    2  
ATOM   742  C CB   . ASP   A 1 11 ? 4.959   5.321   1.736  1.00 0.38 ?  11 ASP   A CB   2  
ATOM   743  C CG   . ASP   A 1 11 ? 4.290   6.430   2.526  1.00 0.99 ?  11 ASP   A CG   2  
ATOM   744  O OD1  . ASP   A 1 11 ? 3.190   6.196   3.066  1.00 1.86 ?  11 ASP   A OD1  2  
ATOM   745  O OD2  . ASP   A 1 11 ? 4.848   7.541   2.605  1.00 1.32 -1 11 ASP   A OD2  2  
ATOM   746  H H    . ASP   A 1 11 ? 6.081   3.001   0.975  1.00 0.30 ?  11 ASP   A H    2  
ATOM   747  H HA   . ASP   A 1 11 ? 5.441   4.282   3.542  1.00 0.38 ?  11 ASP   A HA   2  
ATOM   748  H HB2  . ASP   A 1 11 ? 5.939   5.662   1.432  1.00 0.94 ?  11 ASP   A HB2  2  
ATOM   749  H HB3  . ASP   A 1 11 ? 4.364   5.120   0.858  1.00 0.78 ?  11 ASP   A HB3  2  
ATOM   750  N N    . ASP   A 1 12 ? 3.589   2.585   3.739  1.00 0.25 ?  12 ASP   A N    2  
ATOM   751  C CA   . ASP   A 1 12 ? 2.358   1.845   3.991  1.00 0.26 ?  12 ASP   A CA   2  
ATOM   752  C C    . ASP   A 1 12 ? 1.152   2.770   3.991  1.00 0.18 ?  12 ASP   A C    2  
ATOM   753  O O    . ASP   A 1 12 ? 0.066   2.376   3.565  1.00 0.18 ?  12 ASP   A O    2  
ATOM   754  C CB   . ASP   A 1 12 ? 2.427   1.108   5.331  1.00 0.39 ?  12 ASP   A CB   2  
ATOM   755  C CG   . ASP   A 1 12 ? 3.295   -0.132  5.286  1.00 0.82 ?  12 ASP   A CG   2  
ATOM   756  O OD1  . ASP   A 1 12 ? 4.506   -0.029  5.589  1.00 1.45 ?  12 ASP   A OD1  2  
ATOM   757  O OD2  . ASP   A 1 12 ? 2.784   -1.209  4.920  1.00 1.50 -1 12 ASP   A OD2  2  
ATOM   758  H H    . ASP   A 1 12 ? 4.318   2.534   4.393  1.00 0.31 ?  12 ASP   A H    2  
ATOM   759  H HA   . ASP   A 1 12 ? 2.237   1.123   3.201  1.00 0.27 ?  12 ASP   A HA   2  
ATOM   760  H HB2  . ASP   A 1 12 ? 2.826   1.772   6.078  1.00 1.12 ?  12 ASP   A HB2  2  
ATOM   761  H HB3  . ASP   A 1 12 ? 1.433   0.818   5.618  1.00 1.15 ?  12 ASP   A HB3  2  
HETATM 762  N N    . 2ML   A 1 13 ? 1.355   4.002   4.463  1.00 0.18 ?  13 2ML   A N    2  
HETATM 763  C CA   . 2ML   A 1 13 ? 0.288   5.001   4.530  1.00 0.19 ?  13 2ML   A CA   2  
HETATM 764  C CB1  . 2ML   A 1 13 ? 0.853   6.301   5.099  1.00 0.24 ?  13 2ML   A CB1  2  
HETATM 765  C CB2  . 2ML   A 1 13 ? -0.806  4.516   5.473  1.00 0.25 ?  13 2ML   A CB2  2  
HETATM 766  C CG   . 2ML   A 1 13 ? -0.245  7.363   5.268  1.00 0.33 ?  13 2ML   A CG   2  
HETATM 767  C CD1  . 2ML   A 1 13 ? -0.018  8.162   6.542  1.00 0.57 ?  13 2ML   A CD1  2  
HETATM 768  C CD2  . 2ML   A 1 13 ? -0.279  8.302   4.068  1.00 0.54 ?  13 2ML   A CD2  2  
HETATM 769  C C    . 2ML   A 1 13 ? -0.265  5.222   3.112  1.00 0.16 ?  13 2ML   A C    2  
HETATM 770  O O    . 2ML   A 1 13 ? -1.480  5.269   2.905  1.00 0.17 ?  13 2ML   A O    2  
HETATM 771  H H    . 2ML   A 1 13 ? 2.254   4.248   4.767  1.00 0.20 ?  13 2ML   A H    2  
HETATM 772  H HB11 . 2ML   A 1 13 ? 1.602   6.683   4.424  1.00 0.28 ?  13 2ML   A HB11 2  
HETATM 773  H HB12 . 2ML   A 1 13 ? 1.311   6.099   6.058  1.00 0.32 ?  13 2ML   A HB12 2  
HETATM 774  H HB21 . 2ML   A 1 13 ? -1.704  5.093   5.318  1.00 0.92 ?  13 2ML   A HB21 2  
HETATM 775  H HB22 . 2ML   A 1 13 ? -0.477  4.630   6.494  1.00 0.95 ?  13 2ML   A HB22 2  
HETATM 776  H HB23 . 2ML   A 1 13 ? -1.008  3.473   5.278  1.00 1.02 ?  13 2ML   A HB23 2  
HETATM 777  H HG   . 2ML   A 1 13 ? -1.204  6.877   5.343  1.00 0.64 ?  13 2ML   A HG   2  
HETATM 778  H HD11 . 2ML   A 1 13 ? -0.772  8.931   6.625  1.00 1.31 ?  13 2ML   A HD11 2  
HETATM 779  H HD12 . 2ML   A 1 13 ? 0.959   8.619   6.511  1.00 0.88 ?  13 2ML   A HD12 2  
HETATM 780  H HD13 . 2ML   A 1 13 ? -0.080  7.504   7.396  1.00 1.28 ?  13 2ML   A HD13 2  
HETATM 781  H HD21 . 2ML   A 1 13 ? -1.057  9.037   4.208  1.00 1.20 ?  13 2ML   A HD21 2  
HETATM 782  H HD22 . 2ML   A 1 13 ? -0.479  7.732   3.173  1.00 1.15 ?  13 2ML   A HD22 2  
HETATM 783  H HD23 . 2ML   A 1 13 ? 0.674   8.799   3.973  1.00 1.05 ?  13 2ML   A HD23 2  
ATOM   784  N N    . ARG   A 1 14 ? 0.637   5.327   2.136  1.00 0.14 ?  14 ARG   A N    2  
ATOM   785  C CA   . ARG   A 1 14 ? 0.245   5.588   0.752  1.00 0.16 ?  14 ARG   A CA   2  
ATOM   786  C C    . ARG   A 1 14 ? -0.411  4.364   0.125  1.00 0.12 ?  14 ARG   A C    2  
ATOM   787  O O    . ARG   A 1 14 ? -1.343  4.492   -0.674 1.00 0.14 ?  14 ARG   A O    2  
ATOM   788  C CB   . ARG   A 1 14 ? 1.442   6.040   -0.085 1.00 0.21 ?  14 ARG   A CB   2  
ATOM   789  C CG   . ARG   A 1 14 ? 1.825   7.495   0.142  1.00 1.03 ?  14 ARG   A CG   2  
ATOM   790  C CD   . ARG   A 1 14 ? 3.196   7.825   -0.444 1.00 1.04 ?  14 ARG   A CD   2  
ATOM   791  N NE   . ARG   A 1 14 ? 3.255   7.703   -1.905 1.00 1.37 ?  14 ARG   A NE   2  
ATOM   792  C CZ   . ARG   A 1 14 ? 4.389   7.764   -2.606 1.00 1.63 ?  14 ARG   A CZ   2  
ATOM   793  N NH1  . ARG   A 1 14 ? 5.549   7.965   -1.987 1.00 1.31 1  14 ARG   A NH1  2  
ATOM   794  N NH2  . ARG   A 1 14 ? 4.362   7.635   -3.928 1.00 2.60 ?  14 ARG   A NH2  2  
ATOM   795  H H    . ARG   A 1 14 ? 1.594   5.214   2.355  1.00 0.17 ?  14 ARG   A H    2  
ATOM   796  H HA   . ARG   A 1 14 ? -0.479  6.387   0.769  1.00 0.20 ?  14 ARG   A HA   2  
ATOM   797  H HB2  . ARG   A 1 14 ? 2.292   5.424   0.159  1.00 0.88 ?  14 ARG   A HB2  2  
ATOM   798  H HB3  . ARG   A 1 14 ? 1.201   5.910   -1.127 1.00 0.69 ?  14 ARG   A HB3  2  
ATOM   799  H HG2  . ARG   A 1 14 ? 1.082   8.127   -0.321 1.00 1.51 ?  14 ARG   A HG2  2  
ATOM   800  H HG3  . ARG   A 1 14 ? 1.843   7.687   1.205  1.00 1.60 ?  14 ARG   A HG3  2  
ATOM   801  H HD2  . ARG   A 1 14 ? 3.455   8.836   -0.174 1.00 1.51 ?  14 ARG   A HD2  2  
ATOM   802  H HD3  . ARG   A 1 14 ? 3.920   7.147   -0.013 1.00 1.55 ?  14 ARG   A HD3  2  
ATOM   803  H HE   . ARG   A 1 14 ? 2.405   7.571   -2.389 1.00 1.89 ?  14 ARG   A HE   2  
ATOM   804  H HH11 . ARG   A 1 14 ? 6.404   8.011   -2.513 1.00 1.53 ?  14 ARG   A HH11 2  
ATOM   805  H HH12 . ARG   A 1 14 ? 5.576   8.082   -0.989 1.00 1.40 ?  14 ARG   A HH12 2  
ATOM   806  H HH21 . ARG   A 1 14 ? 5.210   7.679   -4.459 1.00 2.84 ?  14 ARG   A HH21 2  
ATOM   807  H HH22 . ARG   A 1 14 ? 3.486   7.493   -4.402 1.00 3.21 ?  14 ARG   A HH22 2  
ATOM   808  N N    . CYS   A 1 15 ? 0.068   3.182   0.488  1.00 0.11 ?  15 CYS   A N    2  
ATOM   809  C CA   . CYS   A 1 15 ? -0.555  1.943   0.031  1.00 0.10 ?  15 CYS   A CA   2  
ATOM   810  C C    . CYS   A 1 15 ? -1.972  1.844   0.595  1.00 0.09 ?  15 CYS   A C    2  
ATOM   811  O O    . CYS   A 1 15 ? -2.914  1.472   -0.109 1.00 0.09 ?  15 CYS   A O    2  
ATOM   812  C CB   . CYS   A 1 15 ? 0.281   0.730   0.453  1.00 0.13 ?  15 CYS   A CB   2  
ATOM   813  S SG   . CYS   A 1 15 ? -0.413  -0.883  -0.045 1.00 0.13 ?  15 CYS   A SG   2  
ATOM   814  H H    . CYS   A 1 15 ? 0.861   3.141   1.071  1.00 0.12 ?  15 CYS   A H    2  
ATOM   815  H HA   . CYS   A 1 15 ? -0.615  1.975   -1.051 1.00 0.11 ?  15 CYS   A HA   2  
ATOM   816  H HB2  . CYS   A 1 15 ? 1.265   0.809   0.012  1.00 0.15 ?  15 CYS   A HB2  2  
ATOM   817  H HB3  . CYS   A 1 15 ? 0.376   0.729   1.530  1.00 0.15 ?  15 CYS   A HB3  2  
ATOM   818  N N    . HIS   A 1 16 ? -2.121  2.223   1.863  1.00 0.11 ?  16 HIS   A N    2  
ATOM   819  C CA   . HIS   A 1 16 ? -3.430  2.261   2.500  1.00 0.13 ?  16 HIS   A CA   2  
ATOM   820  C C    . HIS   A 1 16 ? -4.323  3.262   1.786  1.00 0.13 ?  16 HIS   A C    2  
ATOM   821  O O    . HIS   A 1 16 ? -5.477  2.961   1.506  1.00 0.15 ?  16 HIS   A O    2  
ATOM   822  C CB   . HIS   A 1 16 ? -3.308  2.621   3.988  1.00 0.17 ?  16 HIS   A CB   2  
ATOM   823  C CG   . HIS   A 1 16 ? -4.627  2.811   4.689  1.00 0.27 ?  16 HIS   A CG   2  
ATOM   824  N ND1  . HIS   A 1 16 ? -5.254  1.812   5.402  1.00 0.39 ?  16 HIS   A ND1  2  
ATOM   825  C CD2  . HIS   A 1 16 ? -5.440  3.893   4.770  1.00 0.34 ?  16 HIS   A CD2  2  
ATOM   826  C CE1  . HIS   A 1 16 ? -6.396  2.268   5.881  1.00 0.48 ?  16 HIS   A CE1  2  
ATOM   827  N NE2  . HIS   A 1 16 ? -6.531  3.525   5.515  1.00 0.45 ?  16 HIS   A NE2  2  
ATOM   828  H H    . HIS   A 1 16 ? -1.325  2.481   2.384  1.00 0.13 ?  16 HIS   A H    2  
ATOM   829  H HA   . HIS   A 1 16 ? -3.868  1.277   2.408  1.00 0.14 ?  16 HIS   A HA   2  
ATOM   830  H HB2  . HIS   A 1 16 ? -2.775  1.832   4.497  1.00 0.22 ?  16 HIS   A HB2  2  
ATOM   831  H HB3  . HIS   A 1 16 ? -2.749  3.539   4.079  1.00 0.15 ?  16 HIS   A HB3  2  
ATOM   832  H HD1  . HIS   A 1 16 ? -4.901  0.911   5.563  1.00 0.44 ?  16 HIS   A HD1  2  
ATOM   833  H HD2  . HIS   A 1 16 ? -5.260  4.864   4.332  1.00 0.35 ?  16 HIS   A HD2  2  
ATOM   834  H HE1  . HIS   A 1 16 ? -7.106  1.700   6.465  1.00 0.59 ?  16 HIS   A HE1  2  
ATOM   835  H HE2  . HIS   A 1 16 ? -7.262  4.123   5.798  1.00 0.54 ?  16 HIS   A HE2  2  
HETATM 836  N N    . AIB   A 1 17 ? -3.779  4.449   1.507  1.00 0.13 ?  17 AIB   A N    2  
HETATM 837  C CA   . AIB   A 1 17 ? -4.502  5.497   0.772  1.00 0.15 ?  17 AIB   A CA   2  
HETATM 838  C C    . AIB   A 1 17 ? -5.062  4.895   -0.521 1.00 0.13 ?  17 AIB   A C    2  
HETATM 839  O O    . AIB   A 1 17 ? -6.253  5.022   -0.832 1.00 0.15 ?  17 AIB   A O    2  
HETATM 840  C CB1  . AIB   A 1 17 ? -3.560  6.640   0.437  1.00 0.18 ?  17 AIB   A CB1  2  
HETATM 841  C CB2  . AIB   A 1 17 ? -5.615  6.062   1.632  1.00 0.19 ?  17 AIB   A CB2  2  
HETATM 842  H H    . AIB   A 1 17 ? -2.861  4.631   1.808  1.00 0.13 ?  17 AIB   A H    2  
HETATM 843  H HB11 . AIB   A 1 17 ? -3.173  7.070   1.350  1.00 0.99 ?  17 AIB   A HB11 2  
HETATM 844  H HB12 . AIB   A 1 17 ? -4.094  7.397   -0.117 1.00 0.95 ?  17 AIB   A HB12 2  
HETATM 845  H HB13 . AIB   A 1 17 ? -2.740  6.268   -0.160 1.00 1.05 ?  17 AIB   A HB13 2  
HETATM 846  H HB21 . AIB   A 1 17 ? -6.222  5.254   2.007  1.00 1.00 ?  17 AIB   A HB21 2  
HETATM 847  H HB22 . AIB   A 1 17 ? -6.225  6.727   1.042  1.00 1.02 ?  17 AIB   A HB22 2  
HETATM 848  H HB23 . AIB   A 1 17 ? -5.186  6.604   2.462  1.00 0.98 ?  17 AIB   A HB23 2  
ATOM   849  N N    . HIS   A 1 18 ? -4.186  4.214   -1.247 1.00 0.12 ?  18 HIS   A N    2  
ATOM   850  C CA   . HIS   A 1 18 ? -4.546  3.568   -2.499 1.00 0.12 ?  18 HIS   A CA   2  
ATOM   851  C C    . HIS   A 1 18 ? -5.692  2.576   -2.300 1.00 0.09 ?  18 HIS   A C    2  
ATOM   852  O O    . HIS   A 1 18 ? -6.745  2.701   -2.921 1.00 0.10 ?  18 HIS   A O    2  
ATOM   853  C CB   . HIS   A 1 18 ? -3.321  2.857   -3.086 1.00 0.15 ?  18 HIS   A CB   2  
ATOM   854  C CG   . HIS   A 1 18 ? -3.623  1.993   -4.268 1.00 0.19 ?  18 HIS   A CG   2  
ATOM   855  N ND1  . HIS   A 1 18 ? -4.075  2.485   -5.473 1.00 0.23 ?  18 HIS   A ND1  2  
ATOM   856  C CD2  . HIS   A 1 18 ? -3.547  0.654   -4.413 1.00 0.23 ?  18 HIS   A CD2  2  
ATOM   857  C CE1  . HIS   A 1 18 ? -4.267  1.483   -6.308 1.00 0.28 ?  18 HIS   A CE1  2  
ATOM   858  N NE2  . HIS   A 1 18 ? -3.951  0.360   -5.691 1.00 0.28 ?  18 HIS   A NE2  2  
ATOM   859  H H    . HIS   A 1 18 ? -3.257  4.143   -0.927 1.00 0.12 ?  18 HIS   A H    2  
ATOM   860  H HA   . HIS   A 1 18 ? -4.868  4.335   -3.185 1.00 0.14 ?  18 HIS   A HA   2  
ATOM   861  H HB2  . HIS   A 1 18 ? -2.600  3.596   -3.396 1.00 0.17 ?  18 HIS   A HB2  2  
ATOM   862  H HB3  . HIS   A 1 18 ? -2.879  2.234   -2.324 1.00 0.15 ?  18 HIS   A HB3  2  
ATOM   863  H HD1  . HIS   A 1 18 ? -4.227  3.436   -5.687 1.00 0.24 ?  18 HIS   A HD1  2  
ATOM   864  H HD2  . HIS   A 1 18 ? -3.221  -0.051  -3.663 1.00 0.24 ?  18 HIS   A HD2  2  
ATOM   865  H HE1  . HIS   A 1 18 ? -4.619  1.567   -7.325 1.00 0.33 ?  18 HIS   A HE1  2  
ATOM   866  H HE2  . HIS   A 1 18 ? -3.850  -0.516  -6.129 1.00 0.36 ?  18 HIS   A HE2  2  
ATOM   867  N N    . CYS   A 1 19 ? -5.484  1.610   -1.421 1.00 0.09 ?  19 CYS   A N    2  
ATOM   868  C CA   . CYS   A 1 19 ? -6.450  0.536   -1.221 1.00 0.09 ?  19 CYS   A CA   2  
ATOM   869  C C    . CYS   A 1 19 ? -7.763  1.052   -0.642 1.00 0.09 ?  19 CYS   A C    2  
ATOM   870  O O    . CYS   A 1 19 ? -8.829  0.549   -0.986 1.00 0.09 ?  19 CYS   A O    2  
ATOM   871  C CB   . CYS   A 1 19 ? -5.848  -0.533  -0.323 1.00 0.11 ?  19 CYS   A CB   2  
ATOM   872  S SG   . CYS   A 1 19 ? -4.363  -1.313  -1.031 1.00 0.12 ?  19 CYS   A SG   2  
ATOM   873  H H    . CYS   A 1 19 ? -4.655  1.616   -0.888 1.00 0.11 ?  19 CYS   A H    2  
ATOM   874  H HA   . CYS   A 1 19 ? -6.652  0.100   -2.185 1.00 0.10 ?  19 CYS   A HA   2  
ATOM   875  H HB2  . CYS   A 1 19 ? -5.573  -0.090  0.622  1.00 0.13 ?  19 CYS   A HB2  2  
ATOM   876  H HB3  . CYS   A 1 19 ? -6.582  -1.308  -0.154 1.00 0.13 ?  19 CYS   A HB3  2  
HETATM 877  N N    . A1BEB A 1 20 ? -7.672  2.062   0.222  1.00 0.11 ?  20 A1BEB A N    2  
HETATM 878  C CA   . A1BEB A 1 20 ? -8.845  2.725   0.804  1.00 0.14 ?  20 A1BEB A CA   2  
HETATM 879  C C    . A1BEB A 1 20 ? -9.685  3.332   -0.331 1.00 0.16 ?  20 A1BEB A C    2  
HETATM 880  O O    . A1BEB A 1 20 ? -10.907 3.435   -0.233 1.00 0.18 ?  20 A1BEB A O    2  
HETATM 881  C CB   . A1BEB A 1 20 ? -8.361  3.816   1.743  1.00 0.21 ?  20 A1BEB A CB   2  
HETATM 882  C CB2  . A1BEB A 1 20 ? -9.667  1.729   1.611  1.00 0.15 ?  20 A1BEB A CB2  2  
HETATM 883  C CG   . A1BEB A 1 20 ? -9.501  4.591   2.381  1.00 0.36 ?  20 A1BEB A CG   2  
HETATM 884  C CD   . A1BEB A 1 20 ? -8.958  5.726   3.234  1.00 0.44 ?  20 A1BEB A CD   2  
HETATM 885  C CE   . A1BEB A 1 20 ? -10.065 6.589   3.819  1.00 0.72 ?  20 A1BEB A CE   2  
HETATM 886  N NZ   . A1BEB A 1 20 ? -10.988 5.813   4.686  1.00 1.38 ?  20 A1BEB A NZ   2  
HETATM 887  H H    . A1BEB A 1 20 ? -6.781  2.375   0.489  1.00 0.12 ?  20 A1BEB A H    2  
HETATM 888  H HB2  . A1BEB A 1 20 ? -7.749  4.512   1.188  1.00 0.19 ?  20 A1BEB A HB2  2  
HETATM 889  H HB3  . A1BEB A 1 20 ? -7.770  3.373   2.530  1.00 0.23 ?  20 A1BEB A HB3  2  
HETATM 890  H HB23 . A1BEB A 1 20 ? -10.586 2.193   1.932  1.00 0.84 ?  20 A1BEB A HB23 2  
HETATM 891  H HB21 . A1BEB A 1 20 ? -9.100  1.408   2.474  1.00 0.80 ?  20 A1BEB A HB21 2  
HETATM 892  H HB22 . A1BEB A 1 20 ? -9.895  0.870   0.996  1.00 0.82 ?  20 A1BEB A HB22 2  
HETATM 893  H HG3  . A1BEB A 1 20 ? -10.076 3.926   3.006  1.00 0.42 ?  20 A1BEB A HG3  2  
HETATM 894  H HG2  . A1BEB A 1 20 ? -10.130 4.997   1.602  1.00 0.40 ?  20 A1BEB A HG2  2  
HETATM 895  H HD3  . A1BEB A 1 20 ? -8.382  5.304   4.045  1.00 0.93 ?  20 A1BEB A HD3  2  
HETATM 896  H HD2  . A1BEB A 1 20 ? -8.318  6.343   2.622  1.00 0.84 ?  20 A1BEB A HD2  2  
HETATM 897  H HE3  . A1BEB A 1 20 ? -9.616  7.375   4.406  1.00 1.49 ?  20 A1BEB A HE3  2  
HETATM 898  H HE2  . A1BEB A 1 20 ? -10.629 7.026   3.008  1.00 1.41 ?  20 A1BEB A HE2  2  
HETATM 899  H HZ1  . A1BEB A 1 20 ? -11.678 6.451   5.131  1.00 1.93 ?  20 A1BEB A HZ1  2  
HETATM 900  H HZ2  . A1BEB A 1 20 ? -10.455 5.325   5.432  1.00 1.93 ?  20 A1BEB A HZ2  2  
HETATM 901  H HZ3  . A1BEB A 1 20 ? -11.502 5.105   4.122  1.00 1.84 ?  20 A1BEB A HZ3  2  
ATOM   902  N N    . SER   A 1 21 ? -9.014  3.723   -1.412 1.00 0.18 ?  21 SER   A N    2  
ATOM   903  C CA   . SER   A 1 21 ? -9.691  4.307   -2.559 1.00 0.23 ?  21 SER   A CA   2  
ATOM   904  C C    . SER   A 1 21 ? -10.326 3.227   -3.437 1.00 0.23 ?  21 SER   A C    2  
ATOM   905  O O    . SER   A 1 21 ? -11.052 3.532   -4.388 1.00 0.31 ?  21 SER   A O    2  
ATOM   906  C CB   . SER   A 1 21 ? -8.701  5.140   -3.368 1.00 0.33 ?  21 SER   A CB   2  
ATOM   907  O OG   . SER   A 1 21 ? -8.022  6.065   -2.533 1.00 1.18 ?  21 SER   A OG   2  
ATOM   908  H H    . SER   A 1 21 ? -8.036  3.617   -1.441 1.00 0.17 ?  21 SER   A H    2  
ATOM   909  H HA   . SER   A 1 21 ? -10.467 4.956   -2.189 1.00 0.26 ?  21 SER   A HA   2  
ATOM   910  H HB2  . SER   A 1 21 ? -7.979  4.489   -3.828 1.00 1.01 ?  21 SER   A HB2  2  
ATOM   911  H HB3  . SER   A 1 21 ? -9.232  5.685   -4.131 1.00 1.21 ?  21 SER   A HB3  2  
ATOM   912  H HG   . SER   A 1 21 ? -7.343  5.598   -2.020 1.00 1.82 ?  21 SER   A HG   2  
ATOM   913  N N    . ILE   A 1 22 ? -10.049 1.966   -3.120 1.00 0.19 ?  22 ILE   A N    2  
ATOM   914  C CA   . ILE   A 1 22 ? -10.618 0.851   -3.852 1.00 0.20 ?  22 ILE   A CA   2  
ATOM   915  C C    . ILE   A 1 22 ? -11.770 0.226   -3.067 1.00 0.17 ?  22 ILE   A C    2  
ATOM   916  O O    . ILE   A 1 22 ? -11.582 -0.270  -1.950 1.00 0.14 ?  22 ILE   A O    2  
ATOM   917  C CB   . ILE   A 1 22 ? -9.566  -0.232  -4.143 1.00 0.21 ?  22 ILE   A CB   2  
ATOM   918  C CG1  . ILE   A 1 22 ? -8.377  0.372   -4.890 1.00 0.24 ?  22 ILE   A CG1  2  
ATOM   919  C CG2  . ILE   A 1 22 ? -10.189 -1.362  -4.952 1.00 0.24 ?  22 ILE   A CG2  2  
ATOM   920  C CD1  . ILE   A 1 22 ? -7.272  -0.620  -5.191 1.00 0.26 ?  22 ILE   A CD1  2  
ATOM   921  H H    . ILE   A 1 22 ? -9.444  1.780   -2.370 1.00 0.19 ?  22 ILE   A H    2  
ATOM   922  H HA   . ILE   A 1 22 ? -10.990 1.224   -4.791 1.00 0.25 ?  22 ILE   A HA   2  
ATOM   923  H HB   . ILE   A 1 22 ? -9.228  -0.631  -3.200 1.00 0.18 ?  22 ILE   A HB   2  
ATOM   924  H HG12 . ILE   A 1 22 ? -8.721  0.775   -5.828 1.00 0.28 ?  22 ILE   A HG12 2  
ATOM   925  H HG13 . ILE   A 1 22 ? -7.957  1.169   -4.296 1.00 0.24 ?  22 ILE   A HG13 2  
ATOM   926  H HG21 . ILE   A 1 22 ? -11.009 -1.793  -4.397 1.00 0.99 ?  22 ILE   A HG21 2  
ATOM   927  H HG22 . ILE   A 1 22 ? -9.446  -2.119  -5.147 1.00 0.98 ?  22 ILE   A HG22 2  
ATOM   928  H HG23 . ILE   A 1 22 ? -10.557 -0.970  -5.889 1.00 0.97 ?  22 ILE   A HG23 2  
ATOM   929  H HD11 . ILE   A 1 22 ? -6.945  -1.086  -4.274 1.00 1.05 ?  22 ILE   A HD11 2  
ATOM   930  H HD12 . ILE   A 1 22 ? -6.441  -0.104  -5.648 1.00 1.05 ?  22 ILE   A HD12 2  
ATOM   931  H HD13 . ILE   A 1 22 ? -7.641  -1.376  -5.867 1.00 0.99 ?  22 ILE   A HD13 2  
ATOM   932  N N    . PRO   A 1 23 ? -12.981 0.254   -3.642 1.00 0.19 ?  23 PRO   A N    2  
ATOM   933  C CA   . PRO   A 1 23 ? -14.182 -0.294  -3.006 1.00 0.19 ?  23 PRO   A CA   2  
ATOM   934  C C    . PRO   A 1 23 ? -14.002 -1.742  -2.556 1.00 0.18 ?  23 PRO   A C    2  
ATOM   935  O O    . PRO   A 1 23 ? -13.375 -2.549  -3.250 1.00 0.21 ?  23 PRO   A O    2  
ATOM   936  C CB   . PRO   A 1 23 ? -15.240 -0.209  -4.105 1.00 0.25 ?  23 PRO   A CB   2  
ATOM   937  C CG   . PRO   A 1 23 ? -14.773 0.885   -4.994 1.00 0.29 ?  23 PRO   A CG   2  
ATOM   938  C CD   . PRO   A 1 23 ? -13.275 0.826   -4.968 1.00 0.26 ?  23 PRO   A CD   2  
ATOM   939  H HA   . PRO   A 1 23 ? -14.488 0.307   -2.164 1.00 0.19 ?  23 PRO   A HA   2  
ATOM   940  H HB2  . PRO   A 1 23 ? -15.290 -1.150  -4.631 1.00 0.28 ?  23 PRO   A HB2  2  
ATOM   941  H HB3  . PRO   A 1 23 ? -16.200 0.019   -3.669 1.00 0.28 ?  23 PRO   A HB3  2  
ATOM   942  H HG2  . PRO   A 1 23 ? -15.137 0.722   -5.994 1.00 0.34 ?  23 PRO   A HG2  2  
ATOM   943  H HG3  . PRO   A 1 23 ? -15.117 1.836   -4.619 1.00 0.30 ?  23 PRO   A HG3  2  
ATOM   944  H HD2  . PRO   A 1 23 ? -12.911 0.183   -5.755 1.00 0.30 ?  23 PRO   A HD2  2  
ATOM   945  H HD3  . PRO   A 1 23 ? -12.858 1.817   -5.064 1.00 0.28 ?  23 PRO   A HD3  2  
HETATM 946  N N    . DPR   A 1 24 ? -14.565 -2.092  -1.391 1.00 0.19 ?  24 DPR   A N    2  
HETATM 947  C CA   . DPR   A 1 24 ? -14.468 -3.437  -0.827 1.00 0.23 ?  24 DPR   A CA   2  
HETATM 948  C CB   . DPR   A 1 24 ? -15.721 -3.512  0.034  1.00 0.30 ?  24 DPR   A CB   2  
HETATM 949  C CG   . DPR   A 1 24 ? -15.869 -2.127  0.560  1.00 0.29 ?  24 DPR   A CG   2  
HETATM 950  C CD   . DPR   A 1 24 ? -15.392 -1.211  -0.540 1.00 0.23 ?  24 DPR   A CD   2  
HETATM 951  C C    . DPR   A 1 24 ? -13.219 -3.641  0.034  1.00 0.22 ?  24 DPR   A C    2  
HETATM 952  O O    . DPR   A 1 24 ? -13.119 -4.623  0.771  1.00 0.31 ?  24 DPR   A O    2  
HETATM 953  H HA   . DPR   A 1 24 ? -14.513 -4.196  -1.587 1.00 0.27 ?  24 DPR   A HA   2  
HETATM 954  H HB2  . DPR   A 1 24 ? -15.573 -4.225  0.829  1.00 0.34 ?  24 DPR   A HB2  2  
HETATM 955  H HB3  . DPR   A 1 24 ? -16.567 -3.804  -0.572 1.00 0.33 ?  24 DPR   A HB3  2  
HETATM 956  H HG2  . DPR   A 1 24 ? -15.256 -2.003  1.440  1.00 0.31 ?  24 DPR   A HG2  2  
HETATM 957  H HG3  . DPR   A 1 24 ? -16.905 -1.929  0.791  1.00 0.35 ?  24 DPR   A HG3  2  
HETATM 958  H HD2  . DPR   A 1 24 ? -14.802 -0.404  -0.133 1.00 0.23 ?  24 DPR   A HD2  2  
HETATM 959  H HD3  . DPR   A 1 24 ? -16.232 -0.821  -1.095 1.00 0.24 ?  24 DPR   A HD3  2  
ATOM   960  N N    . TYR   A 1 25 ? -12.266 -2.722  -0.054 1.00 0.15 ?  25 TYR   A N    2  
ATOM   961  C CA   . TYR   A 1 25 ? -11.073 -2.806  0.775  1.00 0.14 ?  25 TYR   A CA   2  
ATOM   962  C C    . TYR   A 1 25 ? -11.123 -1.792  1.906  1.00 0.15 ?  25 TYR   A C    2  
ATOM   963  O O    . TYR   A 1 25 ? -11.871 -0.815  1.848  1.00 0.17 ?  25 TYR   A O    2  
ATOM   964  C CB   . TYR   A 1 25 ? -9.809  -2.616  -0.062 1.00 0.12 ?  25 TYR   A CB   2  
ATOM   965  C CG   . TYR   A 1 25 ? -9.488  -3.802  -0.947 1.00 0.15 ?  25 TYR   A CG   2  
ATOM   966  C CD1  . TYR   A 1 25 ? -9.327  -3.654  -2.317 1.00 0.18 ?  25 TYR   A CD1  2  
ATOM   967  C CD2  . TYR   A 1 25 ? -9.349  -5.076  -0.407 1.00 0.21 ?  25 TYR   A CD2  2  
ATOM   968  C CE1  . TYR   A 1 25 ? -9.038  -4.738  -3.123 1.00 0.24 ?  25 TYR   A CE1  2  
ATOM   969  C CE2  . TYR   A 1 25 ? -9.059  -6.162  -1.205 1.00 0.26 ?  25 TYR   A CE2  2  
ATOM   970  C CZ   . TYR   A 1 25 ? -8.904  -5.989  -2.562 1.00 0.26 ?  25 TYR   A CZ   2  
ATOM   971  O OH   . TYR   A 1 25 ? -8.617  -7.071  -3.359 1.00 0.32 ?  25 TYR   A OH   2  
ATOM   972  H H    . TYR   A 1 25 ? -12.368 -1.975  -0.686 1.00 0.14 ?  25 TYR   A H    2  
ATOM   973  H HA   . TYR   A 1 25 ? -11.053 -3.794  1.211  1.00 0.16 ?  25 TYR   A HA   2  
ATOM   974  H HB2  . TYR   A 1 25 ? -9.936  -1.750  -0.695 1.00 0.11 ?  25 TYR   A HB2  2  
ATOM   975  H HB3  . TYR   A 1 25 ? -8.970  -2.453  0.597  1.00 0.12 ?  25 TYR   A HB3  2  
ATOM   976  H HD1  . TYR   A 1 25 ? -9.427  -2.676  -2.753 1.00 0.20 ?  25 TYR   A HD1  2  
ATOM   977  H HD2  . TYR   A 1 25 ? -9.470  -5.211  0.657  1.00 0.25 ?  25 TYR   A HD2  2  
ATOM   978  H HE1  . TYR   A 1 25 ? -8.916  -4.602  -4.187 1.00 0.29 ?  25 TYR   A HE1  2  
ATOM   979  H HE2  . TYR   A 1 25 ? -8.955  -7.142  -0.764 1.00 0.32 ?  25 TYR   A HE2  2  
ATOM   980  H HH   . TYR   A 1 25 ? -9.281  -7.759  -3.211 1.00 0.97 ?  25 TYR   A HH   2  
ATOM   981  N N    . LYS   A 1 26 ? -10.338 -2.047  2.940  1.00 0.16 ?  26 LYS   A N    2  
ATOM   982  C CA   . LYS   A 1 26 ? -10.299 -1.180  4.112  1.00 0.21 ?  26 LYS   A CA   2  
ATOM   983  C C    . LYS   A 1 26 ? -8.897  -0.631  4.345  1.00 0.24 ?  26 LYS   A C    2  
ATOM   984  O O    . LYS   A 1 26 ? -8.716  0.346   5.070  1.00 0.46 ?  26 LYS   A O    2  
ATOM   985  C CB   . LYS   A 1 26 ? -10.777 -1.937  5.363  1.00 0.27 ?  26 LYS   A CB   2  
ATOM   986  C CG   . LYS   A 1 26 ? -9.994  -3.212  5.654  1.00 0.30 ?  26 LYS   A CG   2  
ATOM   987  C CD   . LYS   A 1 26 ? -10.352 -3.803  7.005  1.00 0.43 ?  26 LYS   A CD   2  
ATOM   988  C CE   . LYS   A 1 26 ? -9.791  -2.968  8.143  1.00 1.65 ?  26 LYS   A CE   2  
ATOM   989  N NZ   . LYS   A 1 26 ? -10.058 -3.585  9.466  1.00 1.94 1  26 LYS   A NZ   2  
ATOM   990  H H    . LYS   A 1 26 ? -9.766  -2.845  2.913  1.00 0.16 ?  26 LYS   A H    2  
ATOM   991  H HA   . LYS   A 1 26 ? -10.966 -0.352  3.926  1.00 0.22 ?  26 LYS   A HA   2  
ATOM   992  H HB2  . LYS   A 1 26 ? -10.688 -1.284  6.219  1.00 0.31 ?  26 LYS   A HB2  2  
ATOM   993  H HB3  . LYS   A 1 26 ? -11.816 -2.203  5.233  1.00 0.32 ?  26 LYS   A HB3  2  
ATOM   994  H HG2  . LYS   A 1 26 ? -10.214 -3.942  4.890  1.00 0.34 ?  26 LYS   A HG2  2  
ATOM   995  H HG3  . LYS   A 1 26 ? -8.937  -2.983  5.643  1.00 0.36 ?  26 LYS   A HG3  2  
ATOM   996  H HD2  . LYS   A 1 26 ? -11.426 -3.842  7.097  1.00 1.07 ?  26 LYS   A HD2  2  
ATOM   997  H HD3  . LYS   A 1 26 ? -9.947  -4.802  7.069  1.00 0.96 ?  26 LYS   A HD3  2  
ATOM   998  H HE2  . LYS   A 1 26 ? -8.723  -2.875  8.011  1.00 2.28 ?  26 LYS   A HE2  2  
ATOM   999  H HE3  . LYS   A 1 26 ? -10.244 -1.988  8.113  1.00 2.30 ?  26 LYS   A HE3  2  
ATOM   1000 H HZ1  . LYS   A 1 26 ? -9.623  -4.530  9.516  1.00 2.33 ?  26 LYS   A HZ1  2  
ATOM   1001 H HZ2  . LYS   A 1 26 ? -11.080 -3.679  9.617  1.00 2.04 ?  26 LYS   A HZ2  2  
ATOM   1002 H HZ3  . LYS   A 1 26 ? -9.661  -2.994  10.222 1.00 2.40 ?  26 LYS   A HZ3  2  
ATOM   1003 N N    . GLY   A 1 27 ? -7.910  -1.262  3.731  1.00 0.14 ?  27 GLY   A N    2  
ATOM   1004 C CA   . GLY   A 1 27 ? -6.540  -0.836  3.896  1.00 0.13 ?  27 GLY   A CA   2  
ATOM   1005 C C    . GLY   A 1 27 ? -5.615  -1.569  2.953  1.00 0.12 ?  27 GLY   A C    2  
ATOM   1006 O O    . GLY   A 1 27 ? -6.071  -2.375  2.144  1.00 0.15 ?  27 GLY   A O    2  
ATOM   1007 H H    . GLY   A 1 27 ? -8.110  -2.031  3.160  1.00 0.25 ?  27 GLY   A H    2  
ATOM   1008 H HA2  . GLY   A 1 27 ? -6.475  0.224   3.704  1.00 0.14 ?  27 GLY   A HA2  2  
ATOM   1009 H HA3  . GLY   A 1 27 ? -6.232  -1.029  4.912  1.00 0.17 ?  27 GLY   A HA3  2  
ATOM   1010 N N    . GLY   A 1 28 ? -4.324  -1.297  3.056  1.00 0.13 ?  28 GLY   A N    2  
ATOM   1011 C CA   . GLY   A 1 28 ? -3.355  -1.949  2.202  1.00 0.13 ?  28 GLY   A CA   2  
ATOM   1012 C C    . GLY   A 1 28 ? -1.947  -1.794  2.729  1.00 0.16 ?  28 GLY   A C    2  
ATOM   1013 O O    . GLY   A 1 28 ? -1.460  -0.674  2.889  1.00 0.20 ?  28 GLY   A O    2  
ATOM   1014 H H    . GLY   A 1 28 ? -4.020  -0.654  3.730  1.00 0.15 ?  28 GLY   A H    2  
ATOM   1015 H HA2  . GLY   A 1 28 ? -3.593  -3.001  2.145  1.00 0.14 ?  28 GLY   A HA2  2  
ATOM   1016 H HA3  . GLY   A 1 28 ? -3.409  -1.522  1.215  1.00 0.15 ?  28 GLY   A HA3  2  
ATOM   1017 N N    . TYR   A 1 29 ? -1.318  -2.910  3.058  1.00 0.17 ?  29 TYR   A N    2  
ATOM   1018 C CA   . TYR   A 1 29 ? 0.039   -2.891  3.584  1.00 0.22 ?  29 TYR   A CA   2  
ATOM   1019 C C    . TYR   A 1 29 ? 1.054   -3.147  2.472  1.00 0.20 ?  29 TYR   A C    2  
ATOM   1020 O O    . TYR   A 1 29 ? 0.753   -3.831  1.489  1.00 0.17 ?  29 TYR   A O    2  
ATOM   1021 C CB   . TYR   A 1 29 ? 0.203   -3.904  4.727  1.00 0.28 ?  29 TYR   A CB   2  
ATOM   1022 C CG   . TYR   A 1 29 ? 0.201   -5.358  4.306  1.00 0.33 ?  29 TYR   A CG   2  
ATOM   1023 C CD1  . TYR   A 1 29 ? 1.382   -6.083  4.218  1.00 0.46 ?  29 TYR   A CD1  2  
ATOM   1024 C CD2  . TYR   A 1 29 ? -0.988  -5.997  3.973  1.00 0.44 ?  29 TYR   A CD2  2  
ATOM   1025 C CE1  . TYR   A 1 29 ? 1.378   -7.403  3.812  1.00 0.58 ?  29 TYR   A CE1  2  
ATOM   1026 C CE2  . TYR   A 1 29 ? -0.999  -7.316  3.571  1.00 0.55 ?  29 TYR   A CE2  2  
ATOM   1027 C CZ   . TYR   A 1 29 ? 0.208   -8.038  3.573  1.00 0.60 ?  29 TYR   A CZ   2  
ATOM   1028 O OH   . TYR   A 1 29 ? 0.173   -9.326  3.082  1.00 0.73 ?  29 TYR   A OH   2  
ATOM   1029 H H    . TYR   A 1 29 ? -1.756  -3.771  2.883  1.00 0.17 ?  29 TYR   A H    2  
ATOM   1030 H HA   . TYR   A 1 29 ? 0.215   -1.900  3.976  1.00 0.26 ?  29 TYR   A HA   2  
ATOM   1031 H HB2  . TYR   A 1 29 ? 1.138   -3.715  5.228  1.00 0.35 ?  29 TYR   A HB2  2  
ATOM   1032 H HB3  . TYR   A 1 29 ? -0.602  -3.765  5.433  1.00 0.30 ?  29 TYR   A HB3  2  
ATOM   1033 H HD1  . TYR   A 1 29 ? 2.315   -5.602  4.474  1.00 0.55 ?  29 TYR   A HD1  2  
ATOM   1034 H HD2  . TYR   A 1 29 ? -1.916  -5.449  4.037  1.00 0.53 ?  29 TYR   A HD2  2  
ATOM   1035 H HE1  . TYR   A 1 29 ? 2.307   -7.950  3.751  1.00 0.72 ?  29 TYR   A HE1  2  
ATOM   1036 H HE2  . TYR   A 1 29 ? -1.934  -7.794  3.317  1.00 0.69 ?  29 TYR   A HE2  2  
ATOM   1037 H HH   . TYR   A 1 29 ? -0.336  -9.399  2.266  1.00 1.12 ?  29 TYR   A HH   2  
ATOM   1038 N N    . CYS   A 1 30 ? 2.253   -2.607  2.630  1.00 0.22 ?  30 CYS   A N    2  
ATOM   1039 C CA   . CYS   A 1 30 ? 3.331   -2.866  1.691  1.00 0.19 ?  30 CYS   A CA   2  
ATOM   1040 C C    . CYS   A 1 30 ? 3.944   -4.236  1.960  1.00 0.20 ?  30 CYS   A C    2  
ATOM   1041 O O    . CYS   A 1 30 ? 4.366   -4.533  3.078  1.00 0.32 ?  30 CYS   A O    2  
ATOM   1042 C CB   . CYS   A 1 30 ? 4.401   -1.781  1.789  1.00 0.27 ?  30 CYS   A CB   2  
ATOM   1043 S SG   . CYS   A 1 30 ? 3.882   -0.149  1.167  1.00 0.86 ?  30 CYS   A SG   2  
ATOM   1044 H H    . CYS   A 1 30 ? 2.419   -2.015  3.404  1.00 0.27 ?  30 CYS   A H    2  
ATOM   1045 H HA   . CYS   A 1 30 ? 2.911   -2.859  0.697  1.00 0.21 ?  30 CYS   A HA   2  
ATOM   1046 H HB2  . CYS   A 1 30 ? 4.681   -1.660  2.824  1.00 0.76 ?  30 CYS   A HB2  2  
ATOM   1047 H HB3  . CYS   A 1 30 ? 5.264   -2.089  1.221  1.00 0.88 ?  30 CYS   A HB3  2  
ATOM   1048 N N    . ALA   A 1 31 ? 3.992   -5.064  0.933  1.00 0.19 ?  31 ALA   A N    2  
ATOM   1049 C CA   . ALA   A 1 31 ? 4.484   -6.426  1.058  1.00 0.28 ?  31 ALA   A CA   2  
ATOM   1050 C C    . ALA   A 1 31 ? 5.644   -6.667  0.103  1.00 0.22 ?  31 ALA   A C    2  
ATOM   1051 O O    . ALA   A 1 31 ? 5.937   -5.824  -0.748 1.00 0.16 ?  31 ALA   A O    2  
ATOM   1052 C CB   . ALA   A 1 31 ? 3.357   -7.412  0.782  1.00 0.42 ?  31 ALA   A CB   2  
ATOM   1053 H H    . ALA   A 1 31 ? 3.689   -4.748  0.052  1.00 0.20 ?  31 ALA   A H    2  
ATOM   1054 H HA   . ALA   A 1 31 ? 4.822   -6.572  2.072  1.00 0.36 ?  31 ALA   A HA   2  
ATOM   1055 H HB1  . ALA   A 1 31 ? 2.520   -7.191  1.426  1.00 1.01 ?  31 ALA   A HB1  2  
ATOM   1056 H HB2  . ALA   A 1 31 ? 3.704   -8.416  0.972  1.00 1.08 ?  31 ALA   A HB2  2  
ATOM   1057 H HB3  . ALA   A 1 31 ? 3.049   -7.326  -0.250 1.00 1.16 ?  31 ALA   A HB3  2  
ATOM   1058 N N    . LYS   A 1 32 ? 6.302   -7.815  0.258  1.00 0.28 ?  32 LYS   A N    2  
ATOM   1059 C CA   . LYS   A 1 32 ? 7.406   -8.214  -0.612 1.00 0.26 ?  32 LYS   A CA   2  
ATOM   1060 C C    . LYS   A 1 32 ? 8.483   -7.131  -0.657 1.00 0.26 ?  32 LYS   A C    2  
ATOM   1061 O O    . LYS   A 1 32 ? 8.602   -6.400  -1.639 1.00 0.24 ?  32 LYS   A O    2  
ATOM   1062 C CB   . LYS   A 1 32 ? 6.890   -8.513  -2.026 1.00 0.25 ?  32 LYS   A CB   2  
ATOM   1063 C CG   . LYS   A 1 32 ? 7.973   -8.956  -3.004 1.00 1.09 ?  32 LYS   A CG   2  
ATOM   1064 C CD   . LYS   A 1 32 ? 8.505   -10.340 -2.679 1.00 1.62 ?  32 LYS   A CD   2  
ATOM   1065 C CE   . LYS   A 1 32 ? 9.748   -10.660 -3.496 1.00 2.37 ?  32 LYS   A CE   2  
ATOM   1066 N NZ   . LYS   A 1 32 ? 9.518   -10.497 -4.956 1.00 2.43 1  32 LYS   A NZ   2  
ATOM   1067 H H    . LYS   A 1 32 ? 6.044   -8.409  0.993  1.00 0.37 ?  32 LYS   A H    2  
ATOM   1068 H HA   . LYS   A 1 32 ? 7.839   -9.112  -0.200 1.00 0.32 ?  32 LYS   A HA   2  
ATOM   1069 H HB2  . LYS   A 1 32 ? 6.152   -9.294  -1.966 1.00 0.88 ?  32 LYS   A HB2  2  
ATOM   1070 H HB3  . LYS   A 1 32 ? 6.422   -7.621  -2.418 1.00 0.84 ?  32 LYS   A HB3  2  
ATOM   1071 H HG2  . LYS   A 1 32 ? 7.561   -8.971  -4.001 1.00 1.65 ?  32 LYS   A HG2  2  
ATOM   1072 H HG3  . LYS   A 1 32 ? 8.789   -8.250  -2.961 1.00 1.76 ?  32 LYS   A HG3  2  
ATOM   1073 H HD2  . LYS   A 1 32 ? 8.753   -10.384 -1.629 1.00 2.05 ?  32 LYS   A HD2  2  
ATOM   1074 H HD3  . LYS   A 1 32 ? 7.740   -11.067 -2.903 1.00 1.80 ?  32 LYS   A HD3  2  
ATOM   1075 H HE2  . LYS   A 1 32 ? 10.543  -9.997  -3.192 1.00 2.75 ?  32 LYS   A HE2  2  
ATOM   1076 H HE3  . LYS   A 1 32 ? 10.039  -11.681 -3.299 1.00 3.09 ?  32 LYS   A HE3  2  
ATOM   1077 H HZ1  . LYS   A 1 32 ? 8.750   -11.121 -5.274 1.00 2.11 ?  32 LYS   A HZ1  2  
ATOM   1078 H HZ2  . LYS   A 1 32 ? 10.380  -10.739 -5.483 1.00 3.00 ?  32 LYS   A HZ2  2  
ATOM   1079 H HZ3  . LYS   A 1 32 ? 9.262   -9.511  -5.171 1.00 2.96 ?  32 LYS   A HZ3  2  
HETATM 1080 N N    . DPR   A 1 33 ? 9.268   -6.997  0.424  1.00 0.37 ?  33 DPR   A N    2  
HETATM 1081 C CA   . DPR   A 1 33 ? 10.326  -5.984  0.513  1.00 0.44 ?  33 DPR   A CA   2  
HETATM 1082 C CB   . DPR   A 1 33 ? 10.865  -6.137  1.938  1.00 0.59 ?  33 DPR   A CB   2  
HETATM 1083 C CG   . DPR   A 1 33 ? 10.474  -7.507  2.357  1.00 0.61 ?  33 DPR   A CG   2  
HETATM 1084 C CD   . DPR   A 1 33 ? 9.187   -7.818  1.643  1.00 0.47 ?  33 DPR   A CD   2  
HETATM 1085 C C    . DPR   A 1 33 ? 9.780   -4.578  0.299  1.00 0.39 ?  33 DPR   A C    2  
HETATM 1086 O O    . DPR   A 1 33 ? 10.485  -3.692  -0.175 1.00 0.47 ?  33 DPR   A O    2  
HETATM 1087 H HA   . DPR   A 1 33 ? 11.119  -6.174  -0.190 1.00 0.48 ?  33 DPR   A HA   2  
HETATM 1088 H HB2  . DPR   A 1 33 ? 10.418  -5.391  2.575  1.00 0.61 ?  33 DPR   A HB2  2  
HETATM 1089 H HB3  . DPR   A 1 33 ? 11.940  -6.019  1.934  1.00 0.67 ?  33 DPR   A HB3  2  
HETATM 1090 H HG2  . DPR   A 1 33 ? 10.324  -7.529  3.425  1.00 0.70 ?  33 DPR   A HG2  2  
HETATM 1091 H HG3  . DPR   A 1 33 ? 11.242  -8.209  2.070  1.00 0.65 ?  33 DPR   A HG3  2  
HETATM 1092 H HD2  . DPR   A 1 33 ? 8.338   -7.531  2.245  1.00 0.49 ?  33 DPR   A HD2  2  
HETATM 1093 H HD3  . DPR   A 1 33 ? 9.138   -8.866  1.396  1.00 0.47 ?  33 DPR   A HD3  2  
ATOM   1094 N N    . GLY   A 1 34 ? 8.513   -4.399  0.643  1.00 0.32 ?  34 GLY   A N    2  
ATOM   1095 C CA   . GLY   A 1 34 ? 7.877   -3.107  0.519  1.00 0.30 ?  34 GLY   A CA   2  
ATOM   1096 C C    . GLY   A 1 34 ? 7.663   -2.689  -0.919 1.00 0.25 ?  34 GLY   A C    2  
ATOM   1097 O O    . GLY   A 1 34 ? 7.627   -1.498  -1.216 1.00 0.30 ?  34 GLY   A O    2  
ATOM   1098 H H    . GLY   A 1 34 ? 8.003   -5.160  0.989  1.00 0.32 ?  34 GLY   A H    2  
ATOM   1099 H HA2  . GLY   A 1 34 ? 6.920   -3.140  1.018  1.00 0.31 ?  34 GLY   A HA2  2  
ATOM   1100 H HA3  . GLY   A 1 34 ? 8.497   -2.369  1.006  1.00 0.36 ?  34 GLY   A HA3  2  
ATOM   1101 N N    . PHE   A 1 35 ? 7.521   -3.657  -1.816 1.00 0.19 ?  35 PHE   A N    2  
ATOM   1102 C CA   . PHE   A 1 35 ? 7.296   -3.354  -3.226 1.00 0.20 ?  35 PHE   A CA   2  
ATOM   1103 C C    . PHE   A 1 35 ? 5.830   -3.513  -3.610 1.00 0.17 ?  35 PHE   A C    2  
ATOM   1104 O O    . PHE   A 1 35 ? 5.268   -2.676  -4.312 1.00 0.29 ?  35 PHE   A O    2  
ATOM   1105 C CB   . PHE   A 1 35 ? 8.158   -4.246  -4.124 1.00 0.23 ?  35 PHE   A CB   2  
ATOM   1106 C CG   . PHE   A 1 35 ? 9.620   -3.903  -4.104 1.00 0.31 ?  35 PHE   A CG   2  
ATOM   1107 C CD1  . PHE   A 1 35 ? 10.527  -4.715  -3.442 1.00 0.40 ?  35 PHE   A CD1  2  
ATOM   1108 C CD2  . PHE   A 1 35 ? 10.086  -2.762  -4.736 1.00 0.37 ?  35 PHE   A CD2  2  
ATOM   1109 C CE1  . PHE   A 1 35 ? 11.869  -4.396  -3.412 1.00 0.49 ?  35 PHE   A CE1  2  
ATOM   1110 C CE2  . PHE   A 1 35 ? 11.429  -2.439  -4.711 1.00 0.46 ?  35 PHE   A CE2  2  
ATOM   1111 C CZ   . PHE   A 1 35 ? 12.327  -3.278  -4.086 1.00 0.51 ?  35 PHE   A CZ   2  
ATOM   1112 H H    . PHE   A 1 35 ? 7.578   -4.598  -1.527 1.00 0.19 ?  35 PHE   A H    2  
ATOM   1113 H HA   . PHE   A 1 35 ? 7.580   -2.326  -3.386 1.00 0.24 ?  35 PHE   A HA   2  
ATOM   1114 H HB2  . PHE   A 1 35 ? 8.057   -5.272  -3.801 1.00 0.24 ?  35 PHE   A HB2  2  
ATOM   1115 H HB3  . PHE   A 1 35 ? 7.810   -4.159  -5.141 1.00 0.27 ?  35 PHE   A HB3  2  
ATOM   1116 H HD1  . PHE   A 1 35 ? 10.175  -5.609  -2.948 1.00 0.45 ?  35 PHE   A HD1  2  
ATOM   1117 H HD2  . PHE   A 1 35 ? 9.388   -2.122  -5.255 1.00 0.40 ?  35 PHE   A HD2  2  
ATOM   1118 H HE1  . PHE   A 1 35 ? 12.566  -5.038  -2.895 1.00 0.59 ?  35 PHE   A HE1  2  
ATOM   1119 H HE2  . PHE   A 1 35 ? 11.780  -1.548  -5.210 1.00 0.54 ?  35 PHE   A HE2  2  
ATOM   1120 H HZ   . PHE   A 1 35 ? 13.379  -3.035  -4.082 1.00 0.60 ?  35 PHE   A HZ   2  
ATOM   1121 N N    . VAL   A 1 36 ? 5.205   -4.575  -3.137 1.00 0.12 ?  36 VAL   A N    2  
ATOM   1122 C CA   . VAL   A 1 36 ? 3.852   -4.898  -3.549 1.00 0.17 ?  36 VAL   A CA   2  
ATOM   1123 C C    . VAL   A 1 36 ? 2.832   -4.331  -2.576 1.00 0.15 ?  36 VAL   A C    2  
ATOM   1124 O O    . VAL   A 1 36 ? 2.791   -4.708  -1.412 1.00 0.17 ?  36 VAL   A O    2  
ATOM   1125 C CB   . VAL   A 1 36 ? 3.660   -6.422  -3.673 1.00 0.23 ?  36 VAL   A CB   2  
ATOM   1126 C CG1  . VAL   A 1 36 ? 2.219   -6.765  -4.020 1.00 0.32 ?  36 VAL   A CG1  2  
ATOM   1127 C CG2  . VAL   A 1 36 ? 4.604   -6.991  -4.719 1.00 0.25 ?  36 VAL   A CG2  2  
ATOM   1128 H H    . VAL   A 1 36 ? 5.652   -5.147  -2.475 1.00 0.17 ?  36 VAL   A H    2  
ATOM   1129 H HA   . VAL   A 1 36 ? 3.688   -4.457  -4.520 1.00 0.20 ?  36 VAL   A HA   2  
ATOM   1130 H HB   . VAL   A 1 36 ? 3.899   -6.872  -2.721 1.00 0.24 ?  36 VAL   A HB   2  
ATOM   1131 H HG11 . VAL   A 1 36 ? 2.111   -7.837  -4.087 1.00 1.12 ?  36 VAL   A HG11 2  
ATOM   1132 H HG12 . VAL   A 1 36 ? 1.963   -6.317  -4.969 1.00 1.04 ?  36 VAL   A HG12 2  
ATOM   1133 H HG13 . VAL   A 1 36 ? 1.562   -6.382  -3.252 1.00 1.00 ?  36 VAL   A HG13 2  
ATOM   1134 H HG21 . VAL   A 1 36 ? 4.497   -8.063  -4.752 1.00 1.04 ?  36 VAL   A HG21 2  
ATOM   1135 H HG22 . VAL   A 1 36 ? 5.622   -6.737  -4.465 1.00 0.94 ?  36 VAL   A HG22 2  
ATOM   1136 H HG23 . VAL   A 1 36 ? 4.359   -6.576  -5.686 1.00 1.08 ?  36 VAL   A HG23 2  
ATOM   1137 N N    . CYS   A 1 37 ? 2.011   -3.423  -3.064 1.00 0.15 ?  37 CYS   A N    2  
ATOM   1138 C CA   . CYS   A 1 37 ? 0.948   -2.842  -2.260 1.00 0.14 ?  37 CYS   A CA   2  
ATOM   1139 C C    . CYS   A 1 37 ? -0.224  -3.816  -2.205 1.00 0.12 ?  37 CYS   A C    2  
ATOM   1140 O O    . CYS   A 1 37 ? -0.930  -4.004  -3.199 1.00 0.18 ?  37 CYS   A O    2  
ATOM   1141 C CB   . CYS   A 1 37 ? 0.520   -1.501  -2.868 1.00 0.16 ?  37 CYS   A CB   2  
ATOM   1142 S SG   . CYS   A 1 37 ? -0.856  -0.666  -2.013 1.00 0.14 ?  37 CYS   A SG   2  
ATOM   1143 H H    . CYS   A 1 37 ? 2.111   -3.144  -3.999 1.00 0.16 ?  37 CYS   A H    2  
ATOM   1144 H HA   . CYS   A 1 37 ? 1.326   -2.683  -1.262 1.00 0.14 ?  37 CYS   A HA   2  
ATOM   1145 H HB2  . CYS   A 1 37 ? 1.364   -0.826  -2.855 1.00 0.20 ?  37 CYS   A HB2  2  
ATOM   1146 H HB3  . CYS   A 1 37 ? 0.217   -1.666  -3.891 1.00 0.18 ?  37 CYS   A HB3  2  
ATOM   1147 N N    . LYS   A 1 38 ? -0.405  -4.463  -1.063 1.00 0.10 ?  38 LYS   A N    2  
ATOM   1148 C CA   . LYS   A 1 38 ? -1.417  -5.499  -0.939 1.00 0.11 ?  38 LYS   A CA   2  
ATOM   1149 C C    . LYS   A 1 38 ? -2.616  -4.990  -0.159 1.00 0.11 ?  38 LYS   A C    2  
ATOM   1150 O O    . LYS   A 1 38 ? -2.509  -4.641  1.020  1.00 0.12 ?  38 LYS   A O    2  
ATOM   1151 C CB   . LYS   A 1 38 ? -0.842  -6.743  -0.262 1.00 0.15 ?  38 LYS   A CB   2  
ATOM   1152 C CG   . LYS   A 1 38 ? -1.778  -7.940  -0.333 1.00 0.26 ?  38 LYS   A CG   2  
ATOM   1153 C CD   . LYS   A 1 38 ? -1.257  -9.131  0.458  1.00 0.70 ?  38 LYS   A CD   2  
ATOM   1154 C CE   . LYS   A 1 38 ? 0.058   -9.663  -0.096 1.00 1.19 ?  38 LYS   A CE   2  
ATOM   1155 N NZ   . LYS   A 1 38 ? 0.567   -10.807 0.702  1.00 2.16 1  38 LYS   A NZ   2  
ATOM   1156 H H    . LYS   A 1 38 ? 0.139   -4.223  -0.277 1.00 0.13 ?  38 LYS   A H    2  
ATOM   1157 H HA   . LYS   A 1 38 ? -1.743  -5.760  -1.934 1.00 0.12 ?  38 LYS   A HA   2  
ATOM   1158 H HB2  . LYS   A 1 38 ? 0.089   -7.003  -0.742 1.00 0.14 ?  38 LYS   A HB2  2  
ATOM   1159 H HB3  . LYS   A 1 38 ? -0.654  -6.518  0.779  1.00 0.19 ?  38 LYS   A HB3  2  
ATOM   1160 H HG2  . LYS   A 1 38 ? -2.736  -7.651  0.065  1.00 0.63 ?  38 LYS   A HG2  2  
ATOM   1161 H HG3  . LYS   A 1 38 ? -1.895  -8.230  -1.365 1.00 0.69 ?  38 LYS   A HG3  2  
ATOM   1162 H HD2  . LYS   A 1 38 ? -1.104  -8.828  1.483  1.00 1.20 ?  38 LYS   A HD2  2  
ATOM   1163 H HD3  . LYS   A 1 38 ? -1.995  -9.919  0.425  1.00 1.36 ?  38 LYS   A HD3  2  
ATOM   1164 H HE2  . LYS   A 1 38 ? -0.098  -9.987  -1.116 1.00 1.63 ?  38 LYS   A HE2  2  
ATOM   1165 H HE3  . LYS   A 1 38 ? 0.792   -8.871  -0.080 1.00 1.57 ?  38 LYS   A HE3  2  
ATOM   1166 H HZ1  . LYS   A 1 38 ? -0.117  -11.590 0.686  1.00 2.60 ?  38 LYS   A HZ1  2  
ATOM   1167 H HZ2  . LYS   A 1 38 ? 0.719   -10.516 1.691  1.00 2.57 ?  38 LYS   A HZ2  2  
ATOM   1168 H HZ3  . LYS   A 1 38 ? 1.470   -11.143 0.312  1.00 2.71 ?  38 LYS   A HZ3  2  
ATOM   1169 N N    . CYS   A 1 39 ? -3.759  -4.971  -0.820 1.00 0.12 ?  39 CYS   A N    2  
ATOM   1170 C CA   . CYS   A 1 39 ? -4.974  -4.453  -0.230 1.00 0.12 ?  39 CYS   A CA   2  
ATOM   1171 C C    . CYS   A 1 39 ? -5.700  -5.530  0.562  1.00 0.15 ?  39 CYS   A C    2  
ATOM   1172 O O    . CYS   A 1 39 ? -5.650  -6.713  0.222  1.00 0.19 ?  39 CYS   A O    2  
ATOM   1173 C CB   . CYS   A 1 39 ? -5.891  -3.901  -1.316 1.00 0.13 ?  39 CYS   A CB   2  
ATOM   1174 S SG   . CYS   A 1 39 ? -5.112  -2.638  -2.370 1.00 0.14 ?  39 CYS   A SG   2  
ATOM   1175 H H    . CYS   A 1 39 ? -3.785  -5.325  -1.734 1.00 0.16 ?  39 CYS   A H    2  
ATOM   1176 H HA   . CYS   A 1 39 ? -4.701  -3.652  0.439  1.00 0.11 ?  39 CYS   A HA   2  
ATOM   1177 H HB2  . CYS   A 1 39 ? -6.210  -4.712  -1.953 1.00 0.15 ?  39 CYS   A HB2  2  
ATOM   1178 H HB3  . CYS   A 1 39 ? -6.758  -3.453  -0.850 1.00 0.15 ?  39 CYS   A HB3  2  
ATOM   1179 N N    . TYR   A 1 40 ? -6.372  -5.105  1.616  1.00 0.18 ?  40 TYR   A N    2  
ATOM   1180 C CA   . TYR   A 1 40 ? -7.134  -6.002  2.465  1.00 0.25 ?  40 TYR   A CA   2  
ATOM   1181 C C    . TYR   A 1 40 ? -8.368  -5.281  2.991  1.00 0.32 ?  40 TYR   A C    2  
ATOM   1182 O O    . TYR   A 1 40 ? -8.377  -4.055  3.106  1.00 0.88 ?  40 TYR   A O    2  
ATOM   1183 C CB   . TYR   A 1 40 ? -6.266  -6.522  3.619  1.00 0.27 ?  40 TYR   A CB   2  
ATOM   1184 C CG   . TYR   A 1 40 ? -5.741  -5.450  4.550  1.00 0.25 ?  40 TYR   A CG   2  
ATOM   1185 C CD1  . TYR   A 1 40 ? -4.516  -4.840  4.318  1.00 0.22 ?  40 TYR   A CD1  2  
ATOM   1186 C CD2  . TYR   A 1 40 ? -6.462  -5.065  5.672  1.00 0.32 ?  40 TYR   A CD2  2  
ATOM   1187 C CE1  . TYR   A 1 40 ? -4.024  -3.879  5.180  1.00 0.25 ?  40 TYR   A CE1  2  
ATOM   1188 C CE2  . TYR   A 1 40 ? -5.980  -4.100  6.534  1.00 0.35 ?  40 TYR   A CE2  2  
ATOM   1189 C CZ   . TYR   A 1 40 ? -4.760  -3.511  6.285  1.00 0.31 ?  40 TYR   A CZ   2  
ATOM   1190 O OH   . TYR   A 1 40 ? -4.271  -2.558  7.150  1.00 0.37 ?  40 TYR   A OH   2  
ATOM   1191 H H    . TYR   A 1 40 ? -6.356  -4.144  1.835  1.00 0.18 ?  40 TYR   A H    2  
ATOM   1192 H HA   . TYR   A 1 40 ? -7.451  -6.838  1.859  1.00 0.31 ?  40 TYR   A HA   2  
ATOM   1193 H HB2  . TYR   A 1 40 ? -6.845  -7.211  4.213  1.00 0.32 ?  40 TYR   A HB2  2  
ATOM   1194 H HB3  . TYR   A 1 40 ? -5.415  -7.045  3.205  1.00 0.28 ?  40 TYR   A HB3  2  
ATOM   1195 H HD1  . TYR   A 1 40 ? -3.945  -5.124  3.446  1.00 0.22 ?  40 TYR   A HD1  2  
ATOM   1196 H HD2  . TYR   A 1 40 ? -7.417  -5.527  5.864  1.00 0.36 ?  40 TYR   A HD2  2  
ATOM   1197 H HE1  . TYR   A 1 40 ? -3.069  -3.415  4.982  1.00 0.26 ?  40 TYR   A HE1  2  
ATOM   1198 H HE2  . TYR   A 1 40 ? -6.560  -3.813  7.398  1.00 0.41 ?  40 TYR   A HE2  2  
ATOM   1199 H HH   . TYR   A 1 40 ? -4.194  -2.941  8.037  1.00 1.13 ?  40 TYR   A HH   2  
HETATM 1200 N N    . NH2   A 1 41 ? -9.417  -6.028  3.276  1.00 0.59 ?  41 NH2   A N    2  
HETATM 1201 H HN1  . NH2   A 1 41 ? -9.340  -7.000  3.160  1.00 1.06 ?  41 NH2   A HN1  2  
HETATM 1202 H HN2  . NH2   A 1 41 ? -10.231 -5.583  3.598  1.00 0.56 ?  41 NH2   A HN2  2  
ATOM   1203 N N    . GLY   A 1 1  ? 5.135   2.358   -8.059 1.00 1.74 ?  1  GLY   A N    3  
ATOM   1204 C CA   . GLY   A 1 1  ? 4.162   1.589   -7.248 1.00 0.89 ?  1  GLY   A CA   3  
ATOM   1205 C C    . GLY   A 1 1  ? 3.114   2.478   -6.611 1.00 0.90 ?  1  GLY   A C    3  
ATOM   1206 O O    . GLY   A 1 1  ? 2.926   3.624   -7.021 1.00 1.76 ?  1  GLY   A O    3  
ATOM   1207 H H1   . GLY   A 1 1  ? 5.781   1.711   -8.551 1.00 2.34 ?  1  GLY   A H1   3  
ATOM   1208 H H2   . GLY   A 1 1  ? 5.693   2.987   -7.445 1.00 1.93 ?  1  GLY   A H2   3  
ATOM   1209 H H3   . GLY   A 1 1  ? 4.635   2.936   -8.762 1.00 2.29 ?  1  GLY   A H3   3  
ATOM   1210 H HA2  . GLY   A 1 1  ? 3.668   0.865   -7.879 1.00 0.93 ?  1  GLY   A HA2  3  
ATOM   1211 H HA3  . GLY   A 1 1  ? 4.696   1.065   -6.469 1.00 1.19 ?  1  GLY   A HA3  3  
ATOM   1212 N N    . PHE   A 1 2  ? 2.429   1.950   -5.608 1.00 0.43 ?  2  PHE   A N    3  
ATOM   1213 C CA   . PHE   A 1 2  ? 1.382   2.685   -4.917 1.00 0.24 ?  2  PHE   A CA   3  
ATOM   1214 C C    . PHE   A 1 2  ? 1.829   3.011   -3.503 1.00 0.22 ?  2  PHE   A C    3  
ATOM   1215 O O    . PHE   A 1 2  ? 1.121   2.752   -2.534 1.00 0.35 ?  2  PHE   A O    3  
ATOM   1216 C CB   . PHE   A 1 2  ? 0.085   1.874   -4.901 1.00 0.16 ?  2  PHE   A CB   3  
ATOM   1217 C CG   . PHE   A 1 2  ? -0.394  1.525   -6.278 1.00 0.18 ?  2  PHE   A CG   3  
ATOM   1218 C CD1  . PHE   A 1 2  ? -0.200  0.256   -6.799 1.00 0.25 ?  2  PHE   A CD1  3  
ATOM   1219 C CD2  . PHE   A 1 2  ? -1.025  2.476   -7.058 1.00 0.22 ?  2  PHE   A CD2  3  
ATOM   1220 C CE1  . PHE   A 1 2  ? -0.629  -0.055  -8.074 1.00 0.30 ?  2  PHE   A CE1  3  
ATOM   1221 C CE2  . PHE   A 1 2  ? -1.459  2.170   -8.333 1.00 0.28 ?  2  PHE   A CE2  3  
ATOM   1222 C CZ   . PHE   A 1 2  ? -1.259  0.902   -8.842 1.00 0.29 ?  2  PHE   A CZ   3  
ATOM   1223 H H    . PHE   A 1 2  ? 2.637   1.037   -5.318 1.00 1.00 ?  2  PHE   A H    3  
ATOM   1224 H HA   . PHE   A 1 2  ? 1.216   3.605   -5.455 1.00 0.34 ?  2  PHE   A HA   3  
ATOM   1225 H HB2  . PHE   A 1 2  ? 0.245   0.955   -4.356 1.00 0.26 ?  2  PHE   A HB2  3  
ATOM   1226 H HB3  . PHE   A 1 2  ? -0.689  2.446   -4.411 1.00 0.20 ?  2  PHE   A HB3  3  
ATOM   1227 H HD1  . PHE   A 1 2  ? 0.292   -0.494  -6.200 1.00 0.32 ?  2  PHE   A HD1  3  
ATOM   1228 H HD2  . PHE   A 1 2  ? -1.181  3.467   -6.657 1.00 0.27 ?  2  PHE   A HD2  3  
ATOM   1229 H HE1  . PHE   A 1 2  ? -0.471  -1.048  -8.469 1.00 0.37 ?  2  PHE   A HE1  3  
ATOM   1230 H HE2  . PHE   A 1 2  ? -1.950  2.923   -8.930 1.00 0.36 ?  2  PHE   A HE2  3  
ATOM   1231 H HZ   . PHE   A 1 2  ? -1.595  0.661   -9.838 1.00 0.34 ?  2  PHE   A HZ   3  
ATOM   1232 N N    . GLY   A 1 3  ? 3.020   3.574   -3.401 1.00 0.18 ?  3  GLY   A N    3  
ATOM   1233 C CA   . GLY   A 1 3  ? 3.598   3.874   -2.114 1.00 0.20 ?  3  GLY   A CA   3  
ATOM   1234 C C    . GLY   A 1 3  ? 4.680   2.885   -1.747 1.00 0.19 ?  3  GLY   A C    3  
ATOM   1235 O O    . GLY   A 1 3  ? 5.681   3.242   -1.132 1.00 0.21 ?  3  GLY   A O    3  
ATOM   1236 H H    . GLY   A 1 3  ? 3.512   3.800   -4.218 1.00 0.21 ?  3  GLY   A H    3  
ATOM   1237 H HA2  . GLY   A 1 3  ? 4.023   4.866   -2.143 1.00 0.23 ?  3  GLY   A HA2  3  
ATOM   1238 H HA3  . GLY   A 1 3  ? 2.823   3.841   -1.365 1.00 0.24 ?  3  GLY   A HA3  3  
ATOM   1239 N N    . CYS   A 1 4  ? 4.481   1.644   -2.138 1.00 0.25 ?  4  CYS   A N    3  
ATOM   1240 C CA   . CYS   A 1 4  ? 5.442   0.596   -1.859 1.00 0.27 ?  4  CYS   A CA   3  
ATOM   1241 C C    . CYS   A 1 4  ? 6.435   0.479   -3.008 1.00 0.29 ?  4  CYS   A C    3  
ATOM   1242 O O    . CYS   A 1 4  ? 6.144   -0.148  -4.026 1.00 0.30 ?  4  CYS   A O    3  
ATOM   1243 C CB   . CYS   A 1 4  ? 4.714   -0.733  -1.660 1.00 0.28 ?  4  CYS   A CB   3  
ATOM   1244 S SG   . CYS   A 1 4  ? 3.264   -0.623  -0.562 1.00 0.39 ?  4  CYS   A SG   3  
ATOM   1245 H H    . CYS   A 1 4  ? 3.662   1.421   -2.622 1.00 0.30 ?  4  CYS   A H    3  
ATOM   1246 H HA   . CYS   A 1 4  ? 5.973   0.851   -0.956 1.00 0.30 ?  4  CYS   A HA   3  
ATOM   1247 H HB2  . CYS   A 1 4  ? 4.373   -1.094  -2.618 1.00 0.21 ?  4  CYS   A HB2  3  
ATOM   1248 H HB3  . CYS   A 1 4  ? 5.399   -1.451  -1.233 1.00 0.42 ?  4  CYS   A HB3  3  
ATOM   1249 N N    . ASN   A 1 5  ? 7.595   1.104   -2.862 1.00 0.34 ?  5  ASN   A N    3  
ATOM   1250 C CA   . ASN   A 1 5  ? 8.620   1.033   -3.896 1.00 0.40 ?  5  ASN   A CA   3  
ATOM   1251 C C    . ASN   A 1 5  ? 9.920   0.487   -3.326 1.00 0.40 ?  5  ASN   A C    3  
ATOM   1252 O O    . ASN   A 1 5  ? 11.006  0.807   -3.815 1.00 0.47 ?  5  ASN   A O    3  
ATOM   1253 C CB   . ASN   A 1 5  ? 8.869   2.404   -4.536 1.00 0.49 ?  5  ASN   A CB   3  
ATOM   1254 C CG   . ASN   A 1 5  ? 7.626   2.999   -5.173 1.00 0.49 ?  5  ASN   A CG   3  
ATOM   1255 O OD1  . ASN   A 1 5  ? 7.320   2.737   -6.337 1.00 0.65 ?  5  ASN   A OD1  3  
ATOM   1256 N ND2  . ASN   A 1 5  ? 6.908   3.818   -4.421 1.00 0.56 ?  5  ASN   A ND2  3  
ATOM   1257 H H    . ASN   A 1 5  ? 7.766   1.627   -2.043 1.00 0.36 ?  5  ASN   A H    3  
ATOM   1258 H HA   . ASN   A 1 5  ? 8.267   0.352   -4.656 1.00 0.43 ?  5  ASN   A HA   3  
ATOM   1259 H HB2  . ASN   A 1 5  ? 9.224   3.086   -3.779 1.00 0.51 ?  5  ASN   A HB2  3  
ATOM   1260 H HB3  . ASN   A 1 5  ? 9.626   2.299   -5.300 1.00 0.57 ?  5  ASN   A HB3  3  
ATOM   1261 H HD21 . ASN   A 1 5  ? 7.211   3.994   -3.506 1.00 0.70 ?  5  ASN   A HD21 3  
ATOM   1262 H HD22 . ASN   A 1 5  ? 6.108   4.223   -4.810 1.00 0.61 ?  5  ASN   A HD22 3  
ATOM   1263 N N    . GLY   A 1 6  ? 9.808   -0.327  -2.287 1.00 0.36 ?  6  GLY   A N    3  
ATOM   1264 C CA   . GLY   A 1 6  ? 10.976  -0.956  -1.712 1.00 0.38 ?  6  GLY   A CA   3  
ATOM   1265 C C    . GLY   A 1 6  ? 11.094  -0.723  -0.223 1.00 0.37 ?  6  GLY   A C    3  
ATOM   1266 O O    . GLY   A 1 6  ? 10.360  0.088   0.340  1.00 0.36 ?  6  GLY   A O    3  
ATOM   1267 H H    . GLY   A 1 6  ? 8.922   -0.505  -1.904 1.00 0.34 ?  6  GLY   A H    3  
ATOM   1268 H HA2  . GLY   A 1 6  ? 10.921  -2.020  -1.896 1.00 0.48 ?  6  GLY   A HA2  3  
ATOM   1269 H HA3  . GLY   A 1 6  ? 11.856  -0.564  -2.199 1.00 0.44 ?  6  GLY   A HA3  3  
HETATM 1270 C C2   . 6ZS   A 1 7  ? 13.723  -3.296  1.202  1.00 1.49 ?  7  6ZS   A C2   3  
HETATM 1271 N N    . 6ZS   A 1 7  ? 12.034  -1.431  0.399  1.00 0.47 ?  7  6ZS   A N    3  
HETATM 1272 C CA   . 6ZS   A 1 7  ? 12.275  -1.353  1.849  1.00 0.61 ?  7  6ZS   A CA   3  
HETATM 1273 C CB1  . 6ZS   A 1 7  ? 11.083  -1.902  2.613  1.00 0.71 ?  7  6ZS   A CB1  3  
HETATM 1274 C C    . 6ZS   A 1 7  ? 12.537  0.101   2.248  1.00 0.59 ?  7  6ZS   A C    3  
HETATM 1275 O O    . 6ZS   A 1 7  ? 12.051  0.581   3.275  1.00 1.09 ?  7  6ZS   A O    3  
HETATM 1276 C CB   . 6ZS   A 1 7  ? 13.490  -2.195  2.222  1.00 0.75 ?  7  6ZS   A CB   3  
HETATM 1277 H H1   . 6ZS   A 1 7  ? 12.815  -3.865  1.071  1.00 2.14 ?  7  6ZS   A H1   3  
HETATM 1278 H H4   . 6ZS   A 1 7  ? 14.016  -2.859  0.259  1.00 1.94 ?  7  6ZS   A H4   3  
HETATM 1279 H H3   . 6ZS   A 1 7  ? 14.509  -3.950  1.552  1.00 2.00 ?  7  6ZS   A H3   3  
HETATM 1280 H H    . 6ZS   A 1 7  ? 12.589  -2.033  -0.133 1.00 0.49 ?  7  6ZS   A H    3  
HETATM 1281 H H7   . 6ZS   A 1 7  ? 11.279  -1.848  3.673  1.00 1.10 ?  7  6ZS   A H7   3  
HETATM 1282 H H8   . 6ZS   A 1 7  ? 10.916  -2.930  2.328  1.00 1.35 ?  7  6ZS   A H8   3  
HETATM 1283 H H9   . 6ZS   A 1 7  ? 10.207  -1.315  2.378  1.00 1.26 ?  7  6ZS   A H9   3  
HETATM 1284 H H10  . 6ZS   A 1 7  ? 14.370  -1.566  2.248  1.00 1.09 ?  7  6ZS   A H10  3  
HETATM 1285 H H11  . 6ZS   A 1 7  ? 13.337  -2.651  3.191  1.00 1.38 ?  7  6ZS   A H11  3  
ATOM   1286 N N    . TRP   A 1 8  ? 13.304  0.791   1.418  1.00 0.64 ?  8  TRP   A N    3  
ATOM   1287 C CA   . TRP   A 1 8  ? 13.709  2.155   1.702  1.00 0.67 ?  8  TRP   A CA   3  
ATOM   1288 C C    . TRP   A 1 8  ? 12.698  3.150   1.139  1.00 0.49 ?  8  TRP   A C    3  
ATOM   1289 O O    . TRP   A 1 8  ? 12.813  4.359   1.348  1.00 0.58 ?  8  TRP   A O    3  
ATOM   1290 C CB   . TRP   A 1 8  ? 15.097  2.409   1.119  1.00 0.87 ?  8  TRP   A CB   3  
ATOM   1291 C CG   . TRP   A 1 8  ? 16.107  1.391   1.559  1.00 1.12 ?  8  TRP   A CG   3  
ATOM   1292 C CD1  . TRP   A 1 8  ? 16.522  0.299   0.857  1.00 1.27 ?  8  TRP   A CD1  3  
ATOM   1293 C CD2  . TRP   A 1 8  ? 16.810  1.356   2.806  1.00 1.31 ?  8  TRP   A CD2  3  
ATOM   1294 N NE1  . TRP   A 1 8  ? 17.447  -0.408  1.582  1.00 1.50 ?  8  TRP   A NE1  3  
ATOM   1295 C CE2  . TRP   A 1 8  ? 17.642  0.219   2.785  1.00 1.52 ?  8  TRP   A CE2  3  
ATOM   1296 C CE3  . TRP   A 1 8  ? 16.823  2.176   3.937  1.00 1.37 ?  8  TRP   A CE3  3  
ATOM   1297 C CZ2  . TRP   A 1 8  ? 18.475  -0.115  3.851  1.00 1.76 ?  8  TRP   A CZ2  3  
ATOM   1298 C CZ3  . TRP   A 1 8  ? 17.648  1.843   4.993  1.00 1.63 ?  8  TRP   A CZ3  3  
ATOM   1299 C CH2  . TRP   A 1 8  ? 18.463  0.707   4.943  1.00 1.80 ?  8  TRP   A CH2  3  
ATOM   1300 H H    . TRP   A 1 8  ? 13.611  0.367   0.589  1.00 1.04 ?  8  TRP   A H    3  
ATOM   1301 H HA   . TRP   A 1 8  ? 13.754  2.268   2.773  1.00 0.76 ?  8  TRP   A HA   3  
ATOM   1302 H HB2  . TRP   A 1 8  ? 15.040  2.377   0.042  1.00 0.85 ?  8  TRP   A HB2  3  
ATOM   1303 H HB3  . TRP   A 1 8  ? 15.442  3.380   1.428  1.00 0.91 ?  8  TRP   A HB3  3  
ATOM   1304 H HD1  . TRP   A 1 8  ? 16.167  0.044   -0.129 1.00 1.25 ?  8  TRP   A HD1  3  
ATOM   1305 H HE1  . TRP   A 1 8  ? 17.893  -1.234  1.285  1.00 1.65 ?  8  TRP   A HE1  3  
ATOM   1306 H HE3  . TRP   A 1 8  ? 16.200  3.054   3.996  1.00 1.26 ?  8  TRP   A HE3  3  
ATOM   1307 H HZ2  . TRP   A 1 8  ? 19.111  -0.986  3.832  1.00 1.93 ?  8  TRP   A HZ2  3  
ATOM   1308 H HZ3  . TRP   A 1 8  ? 17.668  2.465   5.875  1.00 1.73 ?  8  TRP   A HZ3  3  
ATOM   1309 H HH2  . TRP   A 1 8  ? 19.091  0.484   5.791  1.00 2.00 ?  8  TRP   A HH2  3  
ATOM   1310 N N    . ASN   A 1 9  ? 11.700  2.628   0.438  1.00 0.33 ?  9  ASN   A N    3  
ATOM   1311 C CA   . ASN   A 1 9  ? 10.647  3.449   -0.150 1.00 0.29 ?  9  ASN   A CA   3  
ATOM   1312 C C    . ASN   A 1 9  ? 9.296   2.918   0.287  1.00 0.25 ?  9  ASN   A C    3  
ATOM   1313 O O    . ASN   A 1 9  ? 8.397   2.702   -0.532 1.00 0.36 ?  9  ASN   A O    3  
ATOM   1314 C CB   . ASN   A 1 9  ? 10.725  3.434   -1.678 1.00 0.46 ?  9  ASN   A CB   3  
ATOM   1315 C CG   . ASN   A 1 9  ? 11.973  4.090   -2.223 1.00 1.31 ?  9  ASN   A CG   3  
ATOM   1316 O OD1  . ASN   A 1 9  ? 12.510  5.028   -1.635 1.00 2.05 ?  9  ASN   A OD1  3  
ATOM   1317 N ND2  . ASN   A 1 9  ? 12.439  3.600   -3.356 1.00 1.88 ?  9  ASN   A ND2  3  
ATOM   1318 H H    . ASN   A 1 9  ? 11.656  1.652   0.328  1.00 0.35 ?  9  ASN   A H    3  
ATOM   1319 H HA   . ASN   A 1 9  ? 10.765  4.459   0.208  1.00 0.37 ?  9  ASN   A HA   3  
ATOM   1320 H HB2  . ASN   A 1 9  ? 10.707  2.411   -2.019 1.00 1.10 ?  9  ASN   A HB2  3  
ATOM   1321 H HB3  . ASN   A 1 9  ? 9.868   3.953   -2.076 1.00 0.63 ?  9  ASN   A HB3  3  
ATOM   1322 H HD21 . ASN   A 1 9  ? 11.958  2.851   -3.772 1.00 2.03 ?  9  ASN   A HD21 3  
ATOM   1323 H HD22 . ASN   A 1 9  ? 13.239  4.011   -3.743 1.00 2.48 ?  9  ASN   A HD22 3  
ATOM   1324 N N    . GLU   A 1 10 ? 9.170   2.687   1.580  1.00 0.23 ?  10 GLU   A N    3  
ATOM   1325 C CA   . GLU   A 1 10 ? 7.982   2.065   2.130  1.00 0.26 ?  10 GLU   A CA   3  
ATOM   1326 C C    . GLU   A 1 10 ? 6.975   3.117   2.571  1.00 0.28 ?  10 GLU   A C    3  
ATOM   1327 O O    . GLU   A 1 10 ? 6.984   3.557   3.721  1.00 0.49 ?  10 GLU   A O    3  
ATOM   1328 C CB   . GLU   A 1 10 ? 8.355   1.173   3.317  1.00 0.39 ?  10 GLU   A CB   3  
ATOM   1329 C CG   . GLU   A 1 10 ? 7.210   0.312   3.822  1.00 0.45 ?  10 GLU   A CG   3  
ATOM   1330 C CD   . GLU   A 1 10 ? 7.510   -0.326  5.160  1.00 0.68 ?  10 GLU   A CD   3  
ATOM   1331 O OE1  . GLU   A 1 10 ? 7.004   0.173   6.186  1.00 0.95 ?  10 GLU   A OE1  3  
ATOM   1332 O OE2  . GLU   A 1 10 ? 8.260   -1.326  5.197  1.00 0.78 -1 10 GLU   A OE2  3  
ATOM   1333 H H    . GLU   A 1 10 ? 9.895   2.946   2.182  1.00 0.28 ?  10 GLU   A H    3  
ATOM   1334 H HA   . GLU   A 1 10 ? 7.536   1.458   1.358  1.00 0.27 ?  10 GLU   A HA   3  
ATOM   1335 H HB2  . GLU   A 1 10 ? 9.163   0.521   3.022  1.00 0.43 ?  10 GLU   A HB2  3  
ATOM   1336 H HB3  . GLU   A 1 10 ? 8.689   1.800   4.130  1.00 0.48 ?  10 GLU   A HB3  3  
ATOM   1337 H HG2  . GLU   A 1 10 ? 6.331   0.926   3.921  1.00 0.47 ?  10 GLU   A HG2  3  
ATOM   1338 H HG3  . GLU   A 1 10 ? 7.020   -0.467  3.102  1.00 0.40 ?  10 GLU   A HG3  3  
ATOM   1339 N N    . ASP   A 1 11 ? 6.121   3.534   1.655  1.00 0.23 ?  11 ASP   A N    3  
ATOM   1340 C CA   . ASP   A 1 11 ? 5.017   4.411   2.005  1.00 0.30 ?  11 ASP   A CA   3  
ATOM   1341 C C    . ASP   A 1 11 ? 3.767   3.581   2.224  1.00 0.23 ?  11 ASP   A C    3  
ATOM   1342 O O    . ASP   A 1 11 ? 2.807   3.640   1.452  1.00 0.20 ?  11 ASP   A O    3  
ATOM   1343 C CB   . ASP   A 1 11 ? 4.780   5.490   0.943  1.00 0.38 ?  11 ASP   A CB   3  
ATOM   1344 C CG   . ASP   A 1 11 ? 5.799   6.608   1.016  1.00 0.99 ?  11 ASP   A CG   3  
ATOM   1345 O OD1  . ASP   A 1 11 ? 5.724   7.430   1.952  1.00 1.86 ?  11 ASP   A OD1  3  
ATOM   1346 O OD2  . ASP   A 1 11 ? 6.682   6.671   0.134  1.00 1.32 -1 11 ASP   A OD2  3  
ATOM   1347 H H    . ASP   A 1 11 ? 6.234   3.242   0.723  1.00 0.30 ?  11 ASP   A H    3  
ATOM   1348 H HA   . ASP   A 1 11 ? 5.271   4.889   2.939  1.00 0.38 ?  11 ASP   A HA   3  
ATOM   1349 H HB2  . ASP   A 1 11 ? 4.837   5.043   -0.037 1.00 0.94 ?  11 ASP   A HB2  3  
ATOM   1350 H HB3  . ASP   A 1 11 ? 3.796   5.915   1.084  1.00 0.78 ?  11 ASP   A HB3  3  
ATOM   1351 N N    . ASP   A 1 12 ? 3.801   2.805   3.297  1.00 0.25 ?  12 ASP   A N    3  
ATOM   1352 C CA   . ASP   A 1 12 ? 2.712   1.906   3.662  1.00 0.26 ?  12 ASP   A CA   3  
ATOM   1353 C C    . ASP   A 1 12 ? 1.431   2.699   3.865  1.00 0.18 ?  12 ASP   A C    3  
ATOM   1354 O O    . ASP   A 1 12 ? 0.343   2.261   3.485  1.00 0.18 ?  12 ASP   A O    3  
ATOM   1355 C CB   . ASP   A 1 12 ? 3.085   1.145   4.938  1.00 0.39 ?  12 ASP   A CB   3  
ATOM   1356 C CG   . ASP   A 1 12 ? 2.072   0.093   5.335  1.00 0.82 ?  12 ASP   A CG   3  
ATOM   1357 O OD1  . ASP   A 1 12 ? 2.291   -1.098  5.035  1.00 1.45 ?  12 ASP   A OD1  3  
ATOM   1358 O OD2  . ASP   A 1 12 ? 1.029   0.462   5.914  1.00 1.50 -1 12 ASP   A OD2  3  
ATOM   1359 H H    . ASP   A 1 12 ? 4.589   2.854   3.881  1.00 0.31 ?  12 ASP   A H    3  
ATOM   1360 H HA   . ASP   A 1 12 ? 2.570   1.204   2.855  1.00 0.27 ?  12 ASP   A HA   3  
ATOM   1361 H HB2  . ASP   A 1 12 ? 4.031   0.654   4.786  1.00 1.12 ?  12 ASP   A HB2  3  
ATOM   1362 H HB3  . ASP   A 1 12 ? 3.182   1.847   5.750  1.00 1.15 ?  12 ASP   A HB3  3  
HETATM 1363 N N    . 2ML   A 1 13 ? 1.594   3.892   4.436  1.00 0.18 ?  13 2ML   A N    3  
HETATM 1364 C CA   . 2ML   A 1 13 ? 0.496   4.835   4.649  1.00 0.19 ?  13 2ML   A CA   3  
HETATM 1365 C CB1  . 2ML   A 1 13 ? 1.081   6.111   5.253  1.00 0.24 ?  13 2ML   A CB1  3  
HETATM 1366 C CB2  . 2ML   A 1 13 ? -0.498  4.258   5.641  1.00 0.25 ?  13 2ML   A CB2  3  
HETATM 1367 C CG   . 2ML   A 1 13 ? 0.012   7.197   5.412  1.00 0.33 ?  13 2ML   A CG   3  
HETATM 1368 C CD1  . 2ML   A 1 13 ? 0.208   7.939   6.722  1.00 0.57 ?  13 2ML   A CD1  3  
HETATM 1369 C CD2  . 2ML   A 1 13 ? 0.069   8.180   4.252  1.00 0.54 ?  13 2ML   A CD2  3  
HETATM 1370 C C    . 2ML   A 1 13 ? -0.186  5.133   3.303  1.00 0.16 ?  13 2ML   A C    3  
HETATM 1371 O O    . 2ML   A 1 13 ? -1.416  5.248   3.215  1.00 0.17 ?  13 2ML   A O    3  
HETATM 1372 H H    . 2ML   A 1 13 ? 2.493   4.148   4.733  1.00 0.20 ?  13 2ML   A H    3  
HETATM 1373 H HB11 . 2ML   A 1 13 ? 1.856   6.486   4.604  1.00 0.28 ?  13 2ML   A HB11 3  
HETATM 1374 H HB12 . 2ML   A 1 13 ? 1.509   5.884   6.220  1.00 0.32 ?  13 2ML   A HB12 3  
HETATM 1375 H HB21 . 2ML   A 1 13 ? -1.354  4.911   5.719  1.00 0.92 ?  13 2ML   A HB21 3  
HETATM 1376 H HB22 . 2ML   A 1 13 ? -0.029  4.162   6.610  1.00 0.95 ?  13 2ML   A HB22 3  
HETATM 1377 H HB23 . 2ML   A 1 13 ? -0.817  3.285   5.302  1.00 1.02 ?  13 2ML   A HB23 3  
HETATM 1378 H HG   . 2ML   A 1 13 ? -0.966  6.742   5.422  1.00 0.64 ?  13 2ML   A HG   3  
HETATM 1379 H HD11 . 2ML   A 1 13 ? -0.519  8.735   6.798  1.00 1.31 ?  13 2ML   A HD11 3  
HETATM 1380 H HD12 . 2ML   A 1 13 ? 1.203   8.357   6.754  1.00 0.88 ?  13 2ML   A HD12 3  
HETATM 1381 H HD13 . 2ML   A 1 13 ? 0.079   7.255   7.549  1.00 1.28 ?  13 2ML   A HD13 3  
HETATM 1382 H HD21 . 2ML   A 1 13 ? 1.034   8.666   4.240  1.00 1.20 ?  13 2ML   A HD21 3  
HETATM 1383 H HD22 . 2ML   A 1 13 ? -0.706  8.922   4.369  1.00 1.15 ?  13 2ML   A HD22 3  
HETATM 1384 H HD23 . 2ML   A 1 13 ? -0.077  7.649   3.324  1.00 1.05 ?  13 2ML   A HD23 3  
ATOM   1385 N N    . ARG   A 1 14 ? 0.622   5.231   2.254  1.00 0.14 ?  14 ARG   A N    3  
ATOM   1386 C CA   . ARG   A 1 14 ? 0.133   5.614   0.938  1.00 0.16 ?  14 ARG   A CA   3  
ATOM   1387 C C    . ARG   A 1 14 ? -0.482  4.416   0.222  1.00 0.12 ?  14 ARG   A C    3  
ATOM   1388 O O    . ARG   A 1 14 ? -1.426  4.565   -0.554 1.00 0.14 ?  14 ARG   A O    3  
ATOM   1389 C CB   . ARG   A 1 14 ? 1.268   6.223   0.119  1.00 0.21 ?  14 ARG   A CB   3  
ATOM   1390 C CG   . ARG   A 1 14 ? 0.836   6.757   -1.232 1.00 1.03 ?  14 ARG   A CG   3  
ATOM   1391 C CD   . ARG   A 1 14 ? 1.980   7.478   -1.925 1.00 1.04 ?  14 ARG   A CD   3  
ATOM   1392 N NE   . ARG   A 1 14 ? 2.489   8.601   -1.131 1.00 1.37 ?  14 ARG   A NE   3  
ATOM   1393 C CZ   . ARG   A 1 14 ? 3.488   9.391   -1.515 1.00 1.63 ?  14 ARG   A CZ   3  
ATOM   1394 N NH1  . ARG   A 1 14 ? 4.087   9.197   -2.686 1.00 1.31 1  14 ARG   A NH1  3  
ATOM   1395 N NH2  . ARG   A 1 14 ? 3.889   10.380  -0.728 1.00 2.60 ?  14 ARG   A NH2  3  
ATOM   1396 H H    . ARG   A 1 14 ? 1.574   5.015   2.364  1.00 0.17 ?  14 ARG   A H    3  
ATOM   1397 H HA   . ARG   A 1 14 ? -0.632  6.360   1.075  1.00 0.20 ?  14 ARG   A HA   3  
ATOM   1398 H HB2  . ARG   A 1 14 ? 1.703   7.037   0.679  1.00 0.88 ?  14 ARG   A HB2  3  
ATOM   1399 H HB3  . ARG   A 1 14 ? 2.022   5.472   -0.041 1.00 0.69 ?  14 ARG   A HB3  3  
ATOM   1400 H HG2  . ARG   A 1 14 ? 0.517   5.927   -1.847 1.00 1.51 ?  14 ARG   A HG2  3  
ATOM   1401 H HG3  . ARG   A 1 14 ? 0.012   7.442   -1.092 1.00 1.60 ?  14 ARG   A HG3  3  
ATOM   1402 H HD2  . ARG   A 1 14 ? 2.784   6.775   -2.086 1.00 1.51 ?  14 ARG   A HD2  3  
ATOM   1403 H HD3  . ARG   A 1 14 ? 1.633   7.851   -2.878 1.00 1.55 ?  14 ARG   A HD3  3  
ATOM   1404 H HE   . ARG   A 1 14 ? 2.060   8.770   -0.259 1.00 1.89 ?  14 ARG   A HE   3  
ATOM   1405 H HH11 . ARG   A 1 14 ? 4.842   9.794   -2.974 1.00 1.53 ?  14 ARG   A HH11 3  
ATOM   1406 H HH12 . ARG   A 1 14 ? 3.786   8.454   -3.289 1.00 1.40 ?  14 ARG   A HH12 3  
ATOM   1407 H HH21 . ARG   A 1 14 ? 4.642   10.979  -1.013 1.00 2.84 ?  14 ARG   A HH21 3  
ATOM   1408 H HH22 . ARG   A 1 14 ? 3.442   10.532  0.157  1.00 3.21 ?  14 ARG   A HH22 3  
ATOM   1409 N N    . CYS   A 1 15 ? 0.049   3.230   0.491  1.00 0.11 ?  15 CYS   A N    3  
ATOM   1410 C CA   . CYS   A 1 15 ? -0.556  1.996   -0.005 1.00 0.10 ?  15 CYS   A CA   3  
ATOM   1411 C C    . CYS   A 1 15 ? -1.942  1.831   0.607  1.00 0.09 ?  15 CYS   A C    3  
ATOM   1412 O O    . CYS   A 1 15 ? -2.913  1.501   -0.084 1.00 0.09 ?  15 CYS   A O    3  
ATOM   1413 C CB   . CYS   A 1 15 ? 0.325   0.788   0.334  1.00 0.13 ?  15 CYS   A CB   3  
ATOM   1414 S SG   . CYS   A 1 15 ? -0.409  -0.827  -0.096 1.00 0.13 ?  15 CYS   A SG   3  
ATOM   1415 H H    . CYS   A 1 15 ? 0.872   3.182   1.031  1.00 0.12 ?  15 CYS   A H    3  
ATOM   1416 H HA   . CYS   A 1 15 ? -0.654  2.077   -1.081 1.00 0.11 ?  15 CYS   A HA   3  
ATOM   1417 H HB2  . CYS   A 1 15 ? 1.259   0.874   -0.201 1.00 0.15 ?  15 CYS   A HB2  3  
ATOM   1418 H HB3  . CYS   A 1 15 ? 0.523   0.787   1.396  1.00 0.15 ?  15 CYS   A HB3  3  
ATOM   1419 N N    . HIS   A 1 16 ? -2.037  2.105   1.906  1.00 0.11 ?  16 HIS   A N    3  
ATOM   1420 C CA   . HIS   A 1 16 ? -3.306  2.055   2.611  1.00 0.13 ?  16 HIS   A CA   3  
ATOM   1421 C C    . HIS   A 1 16 ? -4.267  3.066   2.007  1.00 0.13 ?  16 HIS   A C    3  
ATOM   1422 O O    . HIS   A 1 16 ? -5.437  2.755   1.794  1.00 0.15 ?  16 HIS   A O    3  
ATOM   1423 C CB   . HIS   A 1 16 ? -3.095  2.331   4.109  1.00 0.17 ?  16 HIS   A CB   3  
ATOM   1424 C CG   . HIS   A 1 16 ? -4.340  2.244   4.947  1.00 0.27 ?  16 HIS   A CG   3  
ATOM   1425 N ND1  . HIS   A 1 16 ? -4.634  1.164   5.757  1.00 0.39 ?  16 HIS   A ND1  3  
ATOM   1426 C CD2  . HIS   A 1 16 ? -5.359  3.119   5.112  1.00 0.34 ?  16 HIS   A CD2  3  
ATOM   1427 C CE1  . HIS   A 1 16 ? -5.781  1.381   6.375  1.00 0.48 ?  16 HIS   A CE1  3  
ATOM   1428 N NE2  . HIS   A 1 16 ? -6.240  2.559   6.002  1.00 0.45 ?  16 HIS   A NE2  3  
ATOM   1429 H H    . HIS   A 1 16 ? -1.220  2.339   2.406  1.00 0.13 ?  16 HIS   A H    3  
ATOM   1430 H HA   . HIS   A 1 16 ? -3.717  1.065   2.484  1.00 0.14 ?  16 HIS   A HA   3  
ATOM   1431 H HB2  . HIS   A 1 16 ? -2.392  1.613   4.498  1.00 0.22 ?  16 HIS   A HB2  3  
ATOM   1432 H HB3  . HIS   A 1 16 ? -2.687  3.323   4.225  1.00 0.15 ?  16 HIS   A HB3  3  
ATOM   1433 H HD1  . HIS   A 1 16 ? -4.065  0.372   5.892  1.00 0.44 ?  16 HIS   A HD1  3  
ATOM   1434 H HD2  . HIS   A 1 16 ? -5.454  4.085   4.636  1.00 0.35 ?  16 HIS   A HD2  3  
ATOM   1435 H HE1  . HIS   A 1 16 ? -6.268  0.702   7.056  1.00 0.59 ?  16 HIS   A HE1  3  
ATOM   1436 H HE2  . HIS   A 1 16 ? -6.983  3.035   6.440  1.00 0.54 ?  16 HIS   A HE2  3  
HETATM 1437 N N    . AIB   A 1 17 ? -3.756  4.269   1.734  1.00 0.13 ?  17 AIB   A N    3  
HETATM 1438 C CA   . AIB   A 1 17 ? -4.533  5.326   1.071  1.00 0.15 ?  17 AIB   A CA   3  
HETATM 1439 C C    . AIB   A 1 17 ? -5.099  4.780   -0.247 1.00 0.13 ?  17 AIB   A C    3  
HETATM 1440 O O    . AIB   A 1 17 ? -6.302  4.880   -0.517 1.00 0.15 ?  17 AIB   A O    3  
HETATM 1441 C CB1  . AIB   A 1 17 ? -3.642  6.521   0.782  1.00 0.18 ?  17 AIB   A CB1  3  
HETATM 1442 C CB2  . AIB   A 1 17 ? -5.647  5.798   1.982  1.00 0.19 ?  17 AIB   A CB2  3  
HETATM 1443 H H    . AIB   A 1 17 ? -2.826  4.458   1.994  1.00 0.13 ?  17 AIB   A H    3  
HETATM 1444 H HB11 . AIB   A 1 17 ? -4.226  7.299   0.312  1.00 0.99 ?  17 AIB   A HB11 3  
HETATM 1445 H HB12 . AIB   A 1 17 ? -2.841  6.224   0.121  1.00 0.95 ?  17 AIB   A HB12 3  
HETATM 1446 H HB13 . AIB   A 1 17 ? -3.226  6.894   1.705  1.00 1.05 ?  17 AIB   A HB13 3  
HETATM 1447 H HB21 . AIB   A 1 17 ? -5.222  6.250   2.864  1.00 1.00 ?  17 AIB   A HB21 3  
HETATM 1448 H HB22 . AIB   A 1 17 ? -6.256  4.956   2.270  1.00 1.02 ?  17 AIB   A HB22 3  
HETATM 1449 H HB23 . AIB   A 1 17 ? -6.256  6.522   1.463  1.00 0.98 ?  17 AIB   A HB23 3  
ATOM   1450 N N    . HIS   A 1 18 ? -4.212  4.187   -1.043 1.00 0.12 ?  18 HIS   A N    3  
ATOM   1451 C CA   . HIS   A 1 18 ? -4.573  3.615   -2.338 1.00 0.12 ?  18 HIS   A CA   3  
ATOM   1452 C C    . HIS   A 1 18 ? -5.716  2.618   -2.198 1.00 0.09 ?  18 HIS   A C    3  
ATOM   1453 O O    . HIS   A 1 18 ? -6.776  2.785   -2.796 1.00 0.10 ?  18 HIS   A O    3  
ATOM   1454 C CB   . HIS   A 1 18 ? -3.347  2.934   -2.970 1.00 0.15 ?  18 HIS   A CB   3  
ATOM   1455 C CG   . HIS   A 1 18 ? -3.651  2.087   -4.172 1.00 0.19 ?  18 HIS   A CG   3  
ATOM   1456 N ND1  . HIS   A 1 18 ? -4.059  2.604   -5.381 1.00 0.23 ?  18 HIS   A ND1  3  
ATOM   1457 C CD2  . HIS   A 1 18 ? -3.599  0.745   -4.339 1.00 0.23 ?  18 HIS   A CD2  3  
ATOM   1458 C CE1  . HIS   A 1 18 ? -4.250  1.618   -6.238 1.00 0.28 ?  18 HIS   A CE1  3  
ATOM   1459 N NE2  . HIS   A 1 18 ? -3.977  0.480   -5.632 1.00 0.28 ?  18 HIS   A NE2  3  
ATOM   1460 H H    . HIS   A 1 18 ? -3.276  4.127   -0.745 1.00 0.12 ?  18 HIS   A H    3  
ATOM   1461 H HA   . HIS   A 1 18 ? -4.894  4.423   -2.977 1.00 0.14 ?  18 HIS   A HA   3  
ATOM   1462 H HB2  . HIS   A 1 18 ? -2.644  3.689   -3.276 1.00 0.17 ?  18 HIS   A HB2  3  
ATOM   1463 H HB3  . HIS   A 1 18 ? -2.880  2.301   -2.231 1.00 0.15 ?  18 HIS   A HB3  3  
ATOM   1464 H HD1  . HIS   A 1 18 ? -4.190  3.561   -5.587 1.00 0.24 ?  18 HIS   A HD1  3  
ATOM   1465 H HD2  . HIS   A 1 18 ? -3.307  0.020   -3.594 1.00 0.24 ?  18 HIS   A HD2  3  
ATOM   1466 H HE1  . HIS   A 1 18 ? -4.568  1.728   -7.264 1.00 0.33 ?  18 HIS   A HE1  3  
ATOM   1467 H HE2  . HIS   A 1 18 ? -3.904  -0.396  -6.080 1.00 0.36 ?  18 HIS   A HE2  3  
ATOM   1468 N N    . CYS   A 1 19 ? -5.498  1.598   -1.389 1.00 0.09 ?  19 CYS   A N    3  
ATOM   1469 C CA   . CYS   A 1 19 ? -6.460  0.518   -1.254 1.00 0.09 ?  19 CYS   A CA   3  
ATOM   1470 C C    . CYS   A 1 19 ? -7.767  1.004   -0.642 1.00 0.09 ?  19 CYS   A C    3  
ATOM   1471 O O    . CYS   A 1 19 ? -8.837  0.541   -1.029 1.00 0.09 ?  19 CYS   A O    3  
ATOM   1472 C CB   . CYS   A 1 19 ? -5.858  -0.607  -0.424 1.00 0.11 ?  19 CYS   A CB   3  
ATOM   1473 S SG   . CYS   A 1 19 ? -4.314  -1.275  -1.121 1.00 0.12 ?  19 CYS   A SG   3  
ATOM   1474 H H    . CYS   A 1 19 ? -4.663  1.570   -0.863 1.00 0.11 ?  19 CYS   A H    3  
ATOM   1475 H HA   . CYS   A 1 19 ? -6.666  0.141   -2.244 1.00 0.10 ?  19 CYS   A HA   3  
ATOM   1476 H HB2  . CYS   A 1 19 ? -5.640  -0.237  0.566  1.00 0.13 ?  19 CYS   A HB2  3  
ATOM   1477 H HB3  . CYS   A 1 19 ? -6.569  -1.419  -0.355 1.00 0.13 ?  19 CYS   A HB3  3  
HETATM 1478 N N    . A1BEB A 1 20 ? -7.674  1.953   0.297  1.00 0.11 ?  20 A1BEB A N    3  
HETATM 1479 C CA   . A1BEB A 1 20 ? -8.854  2.549   0.937  1.00 0.14 ?  20 A1BEB A CA   3  
HETATM 1480 C C    . A1BEB A 1 20 ? -9.692  3.272   -0.127 1.00 0.16 ?  20 A1BEB A C    3  
HETATM 1481 O O    . A1BEB A 1 20 ? -10.915 3.383   -0.005 1.00 0.18 ?  20 A1BEB A O    3  
HETATM 1482 C CB   . A1BEB A 1 20 ? -8.400  3.538   2.000  1.00 0.21 ?  20 A1BEB A CB   3  
HETATM 1483 C CB2  . A1BEB A 1 20 ? -9.680  1.473   1.620  1.00 0.15 ?  20 A1BEB A CB2  3  
HETATM 1484 C CG   . A1BEB A 1 20 ? -9.566  4.046   2.832  1.00 0.36 ?  20 A1BEB A CG   3  
HETATM 1485 C CD   . A1BEB A 1 20 ? -9.120  5.101   3.827  1.00 0.44 ?  20 A1BEB A CD   3  
HETATM 1486 C CE   . A1BEB A 1 20 ? -10.269 5.550   4.718  1.00 0.72 ?  20 A1BEB A CE   3  
HETATM 1487 N NZ   . A1BEB A 1 20 ? -11.381 6.154   3.939  1.00 1.38 ?  20 A1BEB A NZ   3  
HETATM 1488 H H    . A1BEB A 1 20 ? -6.783  2.260   0.575  1.00 0.12 ?  20 A1BEB A H    3  
HETATM 1489 H HB2  . A1BEB A 1 20 ? -7.926  4.383   1.520  1.00 0.19 ?  20 A1BEB A HB2  3  
HETATM 1490 H HB3  . A1BEB A 1 20 ? -7.693  3.056   2.659  1.00 0.23 ?  20 A1BEB A HB3  3  
HETATM 1491 H HB23 . A1BEB A 1 20 ? -9.872  0.670   0.922  1.00 0.84 ?  20 A1BEB A HB23 3  
HETATM 1492 H HB21 . A1BEB A 1 20 ? -10.618 1.891   1.953  1.00 0.80 ?  20 A1BEB A HB21 3  
HETATM 1493 H HB22 . A1BEB A 1 20 ? -9.136  1.087   2.470  1.00 0.82 ?  20 A1BEB A HB22 3  
HETATM 1494 H HG3  . A1BEB A 1 20 ? -9.993  3.218   3.373  1.00 0.42 ?  20 A1BEB A HG3  3  
HETATM 1495 H HG2  . A1BEB A 1 20 ? -10.308 4.473   2.173  1.00 0.40 ?  20 A1BEB A HG2  3  
HETATM 1496 H HD3  . A1BEB A 1 20 ? -8.337  4.688   4.445  1.00 0.93 ?  20 A1BEB A HD3  3  
HETATM 1497 H HD2  . A1BEB A 1 20 ? -8.741  5.955   3.285  1.00 0.84 ?  20 A1BEB A HD2  3  
HETATM 1498 H HE3  . A1BEB A 1 20 ? -10.647 4.694   5.257  1.00 1.49 ?  20 A1BEB A HE3  3  
HETATM 1499 H HE2  . A1BEB A 1 20 ? -9.897  6.281   5.422  1.00 1.41 ?  20 A1BEB A HE2  3  
HETATM 1500 H HZ1  . A1BEB A 1 20 ? -12.142 6.456   4.580  1.00 1.93 ?  20 A1BEB A HZ1  3  
HETATM 1501 H HZ2  . A1BEB A 1 20 ? -11.767 5.464   3.265  1.00 1.93 ?  20 A1BEB A HZ2  3  
HETATM 1502 H HZ3  . A1BEB A 1 20 ? -11.039 6.983   3.412  1.00 1.84 ?  20 A1BEB A HZ3  3  
ATOM   1503 N N    . SER   A 1 21 ? -9.026  3.760   -1.170 1.00 0.18 ?  21 SER   A N    3  
ATOM   1504 C CA   . SER   A 1 21 ? -9.711  4.455   -2.249 1.00 0.23 ?  21 SER   A CA   3  
ATOM   1505 C C    . SER   A 1 21 ? -10.437 3.454   -3.151 1.00 0.23 ?  21 SER   A C    3  
ATOM   1506 O O    . SER   A 1 21 ? -11.309 3.827   -3.938 1.00 0.31 ?  21 SER   A O    3  
ATOM   1507 C CB   . SER   A 1 21 ? -8.709  5.285   -3.060 1.00 0.33 ?  21 SER   A CB   3  
ATOM   1508 O OG   . SER   A 1 21 ? -9.358  6.119   -4.007 1.00 1.18 ?  21 SER   A OG   3  
ATOM   1509 H H    . SER   A 1 21 ? -8.048  3.648   -1.217 1.00 0.17 ?  21 SER   A H    3  
ATOM   1510 H HA   . SER   A 1 21 ? -10.437 5.116   -1.808 1.00 0.26 ?  21 SER   A HA   3  
ATOM   1511 H HB2  . SER   A 1 21 ? -8.138  5.906   -2.391 1.00 1.01 ?  21 SER   A HB2  3  
ATOM   1512 H HB3  . SER   A 1 21 ? -8.042  4.620   -3.584 1.00 1.21 ?  21 SER   A HB3  3  
ATOM   1513 H HG   . SER   A 1 21 ? -10.100 6.568   -3.582 1.00 1.82 ?  21 SER   A HG   3  
ATOM   1514 N N    . ILE   A 1 22 ? -10.086 2.181   -3.016 1.00 0.19 ?  22 ILE   A N    3  
ATOM   1515 C CA   . ILE   A 1 22 ? -10.675 1.133   -3.828 1.00 0.20 ?  22 ILE   A CA   3  
ATOM   1516 C C    . ILE   A 1 22 ? -11.808 0.432   -3.080 1.00 0.17 ?  22 ILE   A C    3  
ATOM   1517 O O    . ILE   A 1 22 ? -11.619 -0.082  -1.969 1.00 0.14 ?  22 ILE   A O    3  
ATOM   1518 C CB   . ILE   A 1 22 ? -9.623  0.086   -4.238 1.00 0.21 ?  22 ILE   A CB   3  
ATOM   1519 C CG1  . ILE   A 1 22 ? -8.448  0.762   -4.945 1.00 0.24 ?  22 ILE   A CG1  3  
ATOM   1520 C CG2  . ILE   A 1 22 ? -10.253 -0.971  -5.137 1.00 0.24 ?  22 ILE   A CG2  3  
ATOM   1521 C CD1  . ILE   A 1 22 ? -7.354  -0.198  -5.364 1.00 0.26 ?  22 ILE   A CD1  3  
ATOM   1522 H H    . ILE   A 1 22 ? -9.417  1.935   -2.344 1.00 0.19 ?  22 ILE   A H    3  
ATOM   1523 H HA   . ILE   A 1 22 ? -11.067 1.587   -4.724 1.00 0.25 ?  22 ILE   A HA   3  
ATOM   1524 H HB   . ILE   A 1 22 ? -9.266  -0.396  -3.342 1.00 0.18 ?  22 ILE   A HB   3  
ATOM   1525 H HG12 . ILE   A 1 22 ? -8.810  1.258   -5.832 1.00 0.28 ?  22 ILE   A HG12 3  
ATOM   1526 H HG13 . ILE   A 1 22 ? -8.013  1.495   -4.282 1.00 0.24 ?  22 ILE   A HG13 3  
ATOM   1527 H HG21 . ILE   A 1 22 ? -9.512  -1.712  -5.396 1.00 0.99 ?  22 ILE   A HG21 3  
ATOM   1528 H HG22 . ILE   A 1 22 ? -10.621 -0.502  -6.038 1.00 0.98 ?  22 ILE   A HG22 3  
ATOM   1529 H HG23 . ILE   A 1 22 ? -11.073 -1.445  -4.618 1.00 0.97 ?  22 ILE   A HG23 3  
ATOM   1530 H HD11 . ILE   A 1 22 ? -7.022  -0.766  -4.508 1.00 1.05 ?  22 ILE   A HD11 3  
ATOM   1531 H HD12 . ILE   A 1 22 ? -6.523  0.359   -5.769 1.00 1.05 ?  22 ILE   A HD12 3  
ATOM   1532 H HD13 . ILE   A 1 22 ? -7.734  -0.872  -6.117 1.00 0.99 ?  22 ILE   A HD13 3  
ATOM   1533 N N    . PRO   A 1 23 ? -13.007 0.411   -3.678 1.00 0.19 ?  23 PRO   A N    3  
ATOM   1534 C CA   . PRO   A 1 23 ? -14.166 -0.279  -3.109 1.00 0.19 ?  23 PRO   A CA   3  
ATOM   1535 C C    . PRO   A 1 23 ? -13.874 -1.749  -2.811 1.00 0.18 ?  23 PRO   A C    3  
ATOM   1536 O O    . PRO   A 1 23 ? -13.191 -2.430  -3.582 1.00 0.21 ?  23 PRO   A O    3  
ATOM   1537 C CB   . PRO   A 1 23 ? -15.229 -0.156  -4.204 1.00 0.25 ?  23 PRO   A CB   3  
ATOM   1538 C CG   . PRO   A 1 23 ? -14.832 1.046   -4.981 1.00 0.29 ?  23 PRO   A CG   3  
ATOM   1539 C CD   . PRO   A 1 23 ? -13.333 1.066   -4.958 1.00 0.26 ?  23 PRO   A CD   3  
ATOM   1540 H HA   . PRO   A 1 23 ? -14.511 0.207   -2.210 1.00 0.19 ?  23 PRO   A HA   3  
ATOM   1541 H HB2  . PRO   A 1 23 ? -15.220 -1.043  -4.819 1.00 0.28 ?  23 PRO   A HB2  3  
ATOM   1542 H HB3  . PRO   A 1 23 ? -16.202 -0.031  -3.753 1.00 0.28 ?  23 PRO   A HB3  3  
ATOM   1543 H HG2  . PRO   A 1 23 ? -15.191 0.960   -5.993 1.00 0.34 ?  23 PRO   A HG2  3  
ATOM   1544 H HG3  . PRO   A 1 23 ? -15.226 1.935   -4.513 1.00 0.30 ?  23 PRO   A HG3  3  
ATOM   1545 H HD2  . PRO   A 1 23 ? -12.937 0.504   -5.792 1.00 0.30 ?  23 PRO   A HD2  3  
ATOM   1546 H HD3  . PRO   A 1 23 ? -12.970 2.081   -4.976 1.00 0.28 ?  23 PRO   A HD3  3  
HETATM 1547 N N    . DPR   A 1 24 ? -14.393 -2.253  -1.687 1.00 0.19 ?  24 DPR   A N    3  
HETATM 1548 C CA   . DPR   A 1 24 ? -14.189 -3.637  -1.265 1.00 0.23 ?  24 DPR   A CA   3  
HETATM 1549 C CB   . DPR   A 1 24 ? -15.426 -3.892  -0.421 1.00 0.30 ?  24 DPR   A CB   3  
HETATM 1550 C CG   . DPR   A 1 24 ? -15.667 -2.585  0.252  1.00 0.29 ?  24 DPR   A CG   3  
HETATM 1551 C CD   . DPR   A 1 24 ? -15.264 -1.525  -0.743 1.00 0.23 ?  24 DPR   A CD   3  
HETATM 1552 C C    . DPR   A 1 24 ? -12.930 -3.829  -0.422 1.00 0.22 ?  24 DPR   A C    3  
HETATM 1553 O O    . DPR   A 1 24 ? -12.700 -4.911  0.120  1.00 0.31 ?  24 DPR   A O    3  
HETATM 1554 H HA   . DPR   A 1 24 ? -14.180 -4.318  -2.098 1.00 0.27 ?  24 DPR   A HA   3  
HETATM 1555 H HB2  . DPR   A 1 24 ? -15.224 -4.673  0.294  1.00 0.34 ?  24 DPR   A HB2  3  
HETATM 1556 H HB3  . DPR   A 1 24 ? -16.253 -4.176  -1.056 1.00 0.33 ?  24 DPR   A HB3  3  
HETATM 1557 H HG2  . DPR   A 1 24 ? -15.058 -2.514  1.141  1.00 0.31 ?  24 DPR   A HG2  3  
HETATM 1558 H HG3  . DPR   A 1 24 ? -16.712 -2.488  0.504  1.00 0.35 ?  24 DPR   A HG3  3  
HETATM 1559 H HD2  . DPR   A 1 24 ? -14.724 -0.732  -0.252 1.00 0.23 ?  24 DPR   A HD2  3  
HETATM 1560 H HD3  . DPR   A 1 24 ? -16.135 -1.134  -1.248 1.00 0.24 ?  24 DPR   A HD3  3  
ATOM   1561 N N    . TYR   A 1 25 ? -12.113 -2.791  -0.310 1.00 0.15 ?  25 TYR   A N    3  
ATOM   1562 C CA   . TYR   A 1 25 ? -10.948 -2.852  0.558  1.00 0.14 ?  25 TYR   A CA   3  
ATOM   1563 C C    . TYR   A 1 25 ? -11.077 -1.859  1.702  1.00 0.15 ?  25 TYR   A C    3  
ATOM   1564 O O    . TYR   A 1 25 ? -11.821 -0.884  1.610  1.00 0.17 ?  25 TYR   A O    3  
ATOM   1565 C CB   . TYR   A 1 25 ? -9.670  -2.589  -0.236 1.00 0.12 ?  25 TYR   A CB   3  
ATOM   1566 C CG   . TYR   A 1 25 ? -9.350  -3.675  -1.240 1.00 0.15 ?  25 TYR   A CG   3  
ATOM   1567 C CD1  . TYR   A 1 25 ? -9.286  -3.396  -2.599 1.00 0.18 ?  25 TYR   A CD1  3  
ATOM   1568 C CD2  . TYR   A 1 25 ? -9.119  -4.981  -0.830 1.00 0.21 ?  25 TYR   A CD2  3  
ATOM   1569 C CE1  . TYR   A 1 25 ? -8.998  -4.385  -3.518 1.00 0.24 ?  25 TYR   A CE1  3  
ATOM   1570 C CE2  . TYR   A 1 25 ? -8.829  -5.974  -1.743 1.00 0.26 ?  25 TYR   A CE2  3  
ATOM   1571 C CZ   . TYR   A 1 25 ? -8.755  -5.669  -3.083 1.00 0.26 ?  25 TYR   A CZ   3  
ATOM   1572 O OH   . TYR   A 1 25 ? -8.486  -6.660  -3.994 1.00 0.32 ?  25 TYR   A OH   3  
ATOM   1573 H H    . TYR   A 1 25 ? -12.290 -1.971  -0.825 1.00 0.14 ?  25 TYR   A H    3  
ATOM   1574 H HA   . TYR   A 1 25 ? -10.901 -3.849  0.974  1.00 0.16 ?  25 TYR   A HA   3  
ATOM   1575 H HB2  . TYR   A 1 25 ? -9.776  -1.659  -0.773 1.00 0.11 ?  25 TYR   A HB2  3  
ATOM   1576 H HB3  . TYR   A 1 25 ? -8.841  -2.511  0.448  1.00 0.12 ?  25 TYR   A HB3  3  
ATOM   1577 H HD1  . TYR   A 1 25 ? -9.464  -2.386  -2.937 1.00 0.20 ?  25 TYR   A HD1  3  
ATOM   1578 H HD2  . TYR   A 1 25 ? -9.168  -5.216  0.219  1.00 0.25 ?  25 TYR   A HD2  3  
ATOM   1579 H HE1  . TYR   A 1 25 ? -8.951  -4.147  -4.571 1.00 0.29 ?  25 TYR   A HE1  3  
ATOM   1580 H HE2  . TYR   A 1 25 ? -8.651  -6.984  -1.403 1.00 0.32 ?  25 TYR   A HE2  3  
ATOM   1581 H HH   . TYR   A 1 25 ? -7.824  -6.340  -4.621 1.00 0.97 ?  25 TYR   A HH   3  
ATOM   1582 N N    . LYS   A 1 26 ? -10.366 -2.126  2.786  1.00 0.16 ?  26 LYS   A N    3  
ATOM   1583 C CA   . LYS   A 1 26 ? -10.399 -1.258  3.957  1.00 0.21 ?  26 LYS   A CA   3  
ATOM   1584 C C    . LYS   A 1 26 ? -9.012  -0.685  4.247  1.00 0.24 ?  26 LYS   A C    3  
ATOM   1585 O O    . LYS   A 1 26 ? -8.866  0.268   5.012  1.00 0.46 ?  26 LYS   A O    3  
ATOM   1586 C CB   . LYS   A 1 26 ? -10.927 -2.021  5.180  1.00 0.27 ?  26 LYS   A CB   3  
ATOM   1587 C CG   . LYS   A 1 26 ? -9.976  -3.085  5.710  1.00 0.30 ?  26 LYS   A CG   3  
ATOM   1588 C CD   . LYS   A 1 26 ? -10.575 -3.845  6.882  1.00 0.43 ?  26 LYS   A CD   3  
ATOM   1589 C CE   . LYS   A 1 26 ? -11.650 -4.816  6.425  1.00 1.65 ?  26 LYS   A CE   3  
ATOM   1590 N NZ   . LYS   A 1 26 ? -12.281 -5.521  7.571  1.00 1.94 1  26 LYS   A NZ   3  
ATOM   1591 H H    . LYS   A 1 26 ? -9.806  -2.935  2.801  1.00 0.16 ?  26 LYS   A H    3  
ATOM   1592 H HA   . LYS   A 1 26 ? -11.068 -0.441  3.736  1.00 0.22 ?  26 LYS   A HA   3  
ATOM   1593 H HB2  . LYS   A 1 26 ? -11.116 -1.316  5.975  1.00 0.31 ?  26 LYS   A HB2  3  
ATOM   1594 H HB3  . LYS   A 1 26 ? -11.855 -2.504  4.913  1.00 0.32 ?  26 LYS   A HB3  3  
ATOM   1595 H HG2  . LYS   A 1 26 ? -9.759  -3.787  4.918  1.00 0.34 ?  26 LYS   A HG2  3  
ATOM   1596 H HG3  . LYS   A 1 26 ? -9.062  -2.607  6.031  1.00 0.36 ?  26 LYS   A HG3  3  
ATOM   1597 H HD2  . LYS   A 1 26 ? -9.794  -4.397  7.381  1.00 1.07 ?  26 LYS   A HD2  3  
ATOM   1598 H HD3  . LYS   A 1 26 ? -11.013 -3.137  7.569  1.00 0.96 ?  26 LYS   A HD3  3  
ATOM   1599 H HE2  . LYS   A 1 26 ? -12.408 -4.270  5.887  1.00 2.28 ?  26 LYS   A HE2  3  
ATOM   1600 H HE3  . LYS   A 1 26 ? -11.200 -5.547  5.769  1.00 2.30 ?  26 LYS   A HE3  3  
ATOM   1601 H HZ1  . LYS   A 1 26 ? -13.015 -6.173  7.230  1.00 2.33 ?  26 LYS   A HZ1  3  
ATOM   1602 H HZ2  . LYS   A 1 26 ? -12.719 -4.835  8.219  1.00 2.04 ?  26 LYS   A HZ2  3  
ATOM   1603 H HZ3  . LYS   A 1 26 ? -11.567 -6.065  8.094  1.00 2.40 ?  26 LYS   A HZ3  3  
ATOM   1604 N N    . GLY   A 1 27 ? -7.998  -1.269  3.627  1.00 0.14 ?  27 GLY   A N    3  
ATOM   1605 C CA   . GLY   A 1 27 ? -6.641  -0.819  3.824  1.00 0.13 ?  27 GLY   A CA   3  
ATOM   1606 C C    . GLY   A 1 27 ? -5.685  -1.530  2.896  1.00 0.12 ?  27 GLY   A C    3  
ATOM   1607 O O    . GLY   A 1 27 ? -6.114  -2.320  2.057  1.00 0.15 ?  27 GLY   A O    3  
ATOM   1608 H H    . GLY   A 1 27 ? -8.173  -2.026  3.028  1.00 0.25 ?  27 GLY   A H    3  
ATOM   1609 H HA2  . GLY   A 1 27 ? -6.588  0.245   3.646  1.00 0.14 ?  27 GLY   A HA2  3  
ATOM   1610 H HA3  . GLY   A 1 27 ? -6.351  -1.018  4.844  1.00 0.17 ?  27 GLY   A HA3  3  
ATOM   1611 N N    . GLY   A 1 28 ? -4.398  -1.262  3.046  1.00 0.13 ?  28 GLY   A N    3  
ATOM   1612 C CA   . GLY   A 1 28 ? -3.399  -1.920  2.227  1.00 0.13 ?  28 GLY   A CA   3  
ATOM   1613 C C    . GLY   A 1 28 ? -2.003  -1.720  2.768  1.00 0.16 ?  28 GLY   A C    3  
ATOM   1614 O O    . GLY   A 1 28 ? -1.545  -0.588  2.907  1.00 0.20 ?  28 GLY   A O    3  
ATOM   1615 H H    . GLY   A 1 28 ? -4.116  -0.621  3.729  1.00 0.15 ?  28 GLY   A H    3  
ATOM   1616 H HA2  . GLY   A 1 28 ? -3.615  -2.978  2.201  1.00 0.14 ?  28 GLY   A HA2  3  
ATOM   1617 H HA3  . GLY   A 1 28 ? -3.447  -1.527  1.225  1.00 0.15 ?  28 GLY   A HA3  3  
ATOM   1618 N N    . TYR   A 1 29 ? -1.355  -2.807  3.147  1.00 0.17 ?  29 TYR   A N    3  
ATOM   1619 C CA   . TYR   A 1 29 ? 0.004   -2.731  3.666  1.00 0.22 ?  29 TYR   A CA   3  
ATOM   1620 C C    . TYR   A 1 29 ? 1.019   -3.028  2.573  1.00 0.20 ?  29 TYR   A C    3  
ATOM   1621 O O    . TYR   A 1 29 ? 0.718   -3.717  1.597  1.00 0.17 ?  29 TYR   A O    3  
ATOM   1622 C CB   . TYR   A 1 29 ? 0.206   -3.661  4.869  1.00 0.28 ?  29 TYR   A CB   3  
ATOM   1623 C CG   . TYR   A 1 29 ? 0.135   -5.143  4.573  1.00 0.33 ?  29 TYR   A CG   3  
ATOM   1624 C CD1  . TYR   A 1 29 ? 1.287   -5.906  4.439  1.00 0.46 ?  29 TYR   A CD1  3  
ATOM   1625 C CD2  . TYR   A 1 29 ? -1.092  -5.772  4.399  1.00 0.44 ?  29 TYR   A CD2  3  
ATOM   1626 C CE1  . TYR   A 1 29 ? 1.220   -7.252  4.136  1.00 0.58 ?  29 TYR   A CE1  3  
ATOM   1627 C CE2  . TYR   A 1 29 ? -1.170  -7.117  4.102  1.00 0.55 ?  29 TYR   A CE2  3  
ATOM   1628 C CZ   . TYR   A 1 29 ? 0.019   -7.878  4.091  1.00 0.60 ?  29 TYR   A CZ   3  
ATOM   1629 O OH   . TYR   A 1 29 ? -0.089  -9.194  3.663  1.00 0.73 ?  29 TYR   A OH   3  
ATOM   1630 H H    . TYR   A 1 29 ? -1.771  -3.686  3.006  1.00 0.17 ?  29 TYR   A H    3  
ATOM   1631 H HA   . TYR   A 1 29 ? 0.160   -1.712  3.993  1.00 0.26 ?  29 TYR   A HA   3  
ATOM   1632 H HB2  . TYR   A 1 29 ? 1.180   -3.465  5.290  1.00 0.35 ?  29 TYR   A HB2  3  
ATOM   1633 H HB3  . TYR   A 1 29 ? -0.541  -3.434  5.612  1.00 0.30 ?  29 TYR   A HB3  3  
ATOM   1634 H HD1  . TYR   A 1 29 ? 2.249   -5.433  4.572  1.00 0.55 ?  29 TYR   A HD1  3  
ATOM   1635 H HD2  . TYR   A 1 29 ? -1.997  -5.193  4.502  1.00 0.53 ?  29 TYR   A HD2  3  
ATOM   1636 H HE1  . TYR   A 1 29 ? 2.128   -7.828  4.035  1.00 0.72 ?  29 TYR   A HE1  3  
ATOM   1637 H HE2  . TYR   A 1 29 ? -2.133  -7.585  3.973  1.00 0.69 ?  29 TYR   A HE2  3  
ATOM   1638 H HH   . TYR   A 1 29 ? -0.753  -9.323  2.975  1.00 1.12 ?  29 TYR   A HH   3  
ATOM   1639 N N    . CYS   A 1 30 ? 2.223   -2.513  2.746  1.00 0.22 ?  30 CYS   A N    3  
ATOM   1640 C CA   . CYS   A 1 30 ? 3.316   -2.817  1.839  1.00 0.19 ?  30 CYS   A CA   3  
ATOM   1641 C C    . CYS   A 1 30 ? 3.850   -4.214  2.122  1.00 0.20 ?  30 CYS   A C    3  
ATOM   1642 O O    . CYS   A 1 30 ? 4.134   -4.562  3.270  1.00 0.32 ?  30 CYS   A O    3  
ATOM   1643 C CB   . CYS   A 1 30 ? 4.435   -1.786  1.971  1.00 0.27 ?  30 CYS   A CB   3  
ATOM   1644 S SG   . CYS   A 1 30 ? 4.041   -0.160  1.253  1.00 0.86 ?  30 CYS   A SG   3  
ATOM   1645 H H    . CYS   A 1 30 ? 2.381   -1.913  3.512  1.00 0.27 ?  30 CYS   A H    3  
ATOM   1646 H HA   . CYS   A 1 30 ? 2.927   -2.790  0.832  1.00 0.21 ?  30 CYS   A HA   3  
ATOM   1647 H HB2  . CYS   A 1 30 ? 4.651   -1.636  3.016  1.00 0.76 ?  30 CYS   A HB2  3  
ATOM   1648 H HB3  . CYS   A 1 30 ? 5.319   -2.160  1.476  1.00 0.88 ?  30 CYS   A HB3  3  
ATOM   1649 N N    . ALA   A 1 31 ? 3.967   -5.009  1.074  1.00 0.19 ?  31 ALA   A N    3  
ATOM   1650 C CA   . ALA   A 1 31 ? 4.404   -6.387  1.190  1.00 0.28 ?  31 ALA   A CA   3  
ATOM   1651 C C    . ALA   A 1 31 ? 5.518   -6.682  0.193  1.00 0.22 ?  31 ALA   A C    3  
ATOM   1652 O O    . ALA   A 1 31 ? 5.845   -5.838  -0.649 1.00 0.16 ?  31 ALA   A O    3  
ATOM   1653 C CB   . ALA   A 1 31 ? 3.226   -7.325  0.962  1.00 0.42 ?  31 ALA   A CB   3  
ATOM   1654 H H    . ALA   A 1 31 ? 3.748   -4.655  0.183  1.00 0.20 ?  31 ALA   A H    3  
ATOM   1655 H HA   . ALA   A 1 31 ? 4.773   -6.544  2.193  1.00 0.36 ?  31 ALA   A HA   3  
ATOM   1656 H HB1  . ALA   A 1 31 ? 2.881   -7.228  -0.057 1.00 1.01 ?  31 ALA   A HB1  3  
ATOM   1657 H HB2  . ALA   A 1 31 ? 2.424   -7.066  1.638  1.00 1.08 ?  31 ALA   A HB2  3  
ATOM   1658 H HB3  . ALA   A 1 31 ? 3.533   -8.343  1.142  1.00 1.16 ?  31 ALA   A HB3  3  
ATOM   1659 N N    . LYS   A 1 32 ? 6.096   -7.876  0.307  1.00 0.28 ?  32 LYS   A N    3  
ATOM   1660 C CA   . LYS   A 1 32 ? 7.148   -8.344  -0.594 1.00 0.26 ?  32 LYS   A CA   3  
ATOM   1661 C C    . LYS   A 1 32 ? 8.277   -7.320  -0.699 1.00 0.26 ?  32 LYS   A C    3  
ATOM   1662 O O    . LYS   A 1 32 ? 8.372   -6.582  -1.681 1.00 0.24 ?  32 LYS   A O    3  
ATOM   1663 C CB   . LYS   A 1 32 ? 6.572   -8.659  -1.978 1.00 0.25 ?  32 LYS   A CB   3  
ATOM   1664 C CG   . LYS   A 1 32 ? 7.573   -9.299  -2.924 1.00 1.09 ?  32 LYS   A CG   3  
ATOM   1665 C CD   . LYS   A 1 32 ? 6.921   -9.730  -4.222 1.00 1.62 ?  32 LYS   A CD   3  
ATOM   1666 C CE   . LYS   A 1 32 ? 7.914   -10.441 -5.126 1.00 2.37 ?  32 LYS   A CE   3  
ATOM   1667 N NZ   . LYS   A 1 32 ? 8.467   -11.670 -4.494 1.00 2.43 1  32 LYS   A NZ   3  
ATOM   1668 H H    . LYS   A 1 32 ? 5.809   -8.466  1.032  1.00 0.37 ?  32 LYS   A H    3  
ATOM   1669 H HA   . LYS   A 1 32 ? 7.549   -9.253  -0.170 1.00 0.32 ?  32 LYS   A HA   3  
ATOM   1670 H HB2  . LYS   A 1 32 ? 5.738   -9.334  -1.865 1.00 0.88 ?  32 LYS   A HB2  3  
ATOM   1671 H HB3  . LYS   A 1 32 ? 6.223   -7.741  -2.424 1.00 0.84 ?  32 LYS   A HB3  3  
ATOM   1672 H HG2  . LYS   A 1 32 ? 8.348   -8.584  -3.149 1.00 1.65 ?  32 LYS   A HG2  3  
ATOM   1673 H HG3  . LYS   A 1 32 ? 8.002   -10.162 -2.445 1.00 1.76 ?  32 LYS   A HG3  3  
ATOM   1674 H HD2  . LYS   A 1 32 ? 6.105   -10.400 -3.999 1.00 2.05 ?  32 LYS   A HD2  3  
ATOM   1675 H HD3  . LYS   A 1 32 ? 6.546   -8.856  -4.732 1.00 1.80 ?  32 LYS   A HD3  3  
ATOM   1676 H HE2  . LYS   A 1 32 ? 7.415   -10.712 -6.044 1.00 2.75 ?  32 LYS   A HE2  3  
ATOM   1677 H HE3  . LYS   A 1 32 ? 8.726   -9.765  -5.345 1.00 3.09 ?  32 LYS   A HE3  3  
ATOM   1678 H HZ1  . LYS   A 1 32 ? 7.702   -12.356 -4.313 1.00 2.11 ?  32 LYS   A HZ1  3  
ATOM   1679 H HZ2  . LYS   A 1 32 ? 8.928   -11.438 -3.590 1.00 3.00 ?  32 LYS   A HZ2  3  
ATOM   1680 H HZ3  . LYS   A 1 32 ? 9.167   -12.111 -5.121 1.00 2.96 ?  32 LYS   A HZ3  3  
HETATM 1681 N N    . DPR   A 1 33 ? 9.133   -7.250  0.332  1.00 0.37 ?  33 DPR   A N    3  
HETATM 1682 C CA   . DPR   A 1 33 ? 10.235  -6.281  0.390  1.00 0.44 ?  33 DPR   A CA   3  
HETATM 1683 C CB   . DPR   A 1 33 ? 10.891  -6.543  1.746  1.00 0.59 ?  33 DPR   A CB   3  
HETATM 1684 C CG   . DPR   A 1 33 ? 10.466  -7.917  2.124  1.00 0.61 ?  33 DPR   A CG   3  
HETATM 1685 C CD   . DPR   A 1 33 ? 9.106   -8.117  1.519  1.00 0.47 ?  33 DPR   A CD   3  
HETATM 1686 C C    . DPR   A 1 33 ? 9.734   -4.841  0.310  1.00 0.39 ?  33 DPR   A C    3  
HETATM 1687 O O    . DPR   A 1 33 ? 10.490  -3.926  -0.010 1.00 0.47 ?  33 DPR   A O    3  
HETATM 1688 H HA   . DPR   A 1 33 ? 10.956  -6.456  -0.392 1.00 0.48 ?  33 DPR   A HA   3  
HETATM 1689 H HB2  . DPR   A 1 33 ? 10.542  -5.816  2.463  1.00 0.61 ?  33 DPR   A HB2  3  
HETATM 1690 H HB3  . DPR   A 1 33 ? 11.965  -6.475  1.651  1.00 0.67 ?  33 DPR   A HB3  3  
HETATM 1691 H HG2  . DPR   A 1 33 ? 10.412  -7.998  3.199  1.00 0.70 ?  33 DPR   A HG2  3  
HETATM 1692 H HG3  . DPR   A 1 33 ? 11.164  -8.638  1.727  1.00 0.65 ?  33 DPR   A HG3  3  
HETATM 1693 H HD2  . DPR   A 1 33 ? 8.331   -7.807  2.206  1.00 0.49 ?  33 DPR   A HD2  3  
HETATM 1694 H HD3  . DPR   A 1 33 ? 8.969   -9.149  1.238  1.00 0.47 ?  33 DPR   A HD3  3  
ATOM   1695 N N    . GLY   A 1 34 ? 8.452   -4.658  0.604  1.00 0.32 ?  34 GLY   A N    3  
ATOM   1696 C CA   . GLY   A 1 34 ? 7.849   -3.344  0.543  1.00 0.30 ?  34 GLY   A CA   3  
ATOM   1697 C C    . GLY   A 1 34 ? 7.668   -2.858  -0.882 1.00 0.25 ?  34 GLY   A C    3  
ATOM   1698 O O    . GLY   A 1 34 ? 7.628   -1.655  -1.128 1.00 0.30 ?  34 GLY   A O    3  
ATOM   1699 H H    . GLY   A 1 34 ? 7.909   -5.430  0.861  1.00 0.32 ?  34 GLY   A H    3  
ATOM   1700 H HA2  . GLY   A 1 34 ? 6.884   -3.379  1.027  1.00 0.31 ?  34 GLY   A HA2  3  
ATOM   1701 H HA3  . GLY   A 1 34 ? 8.479   -2.648  1.071  1.00 0.36 ?  34 GLY   A HA3  3  
ATOM   1702 N N    . PHE   A 1 35 ? 7.558   -3.790  -1.822 1.00 0.19 ?  35 PHE   A N    3  
ATOM   1703 C CA   . PHE   A 1 35 ? 7.399   -3.438  -3.229 1.00 0.20 ?  35 PHE   A CA   3  
ATOM   1704 C C    . PHE   A 1 35 ? 5.954   -3.589  -3.684 1.00 0.17 ?  35 PHE   A C    3  
ATOM   1705 O O    . PHE   A 1 35 ? 5.491   -2.866  -4.569 1.00 0.29 ?  35 PHE   A O    3  
ATOM   1706 C CB   . PHE   A 1 35 ? 8.301   -4.303  -4.111 1.00 0.23 ?  35 PHE   A CB   3  
ATOM   1707 C CG   . PHE   A 1 35 ? 9.758   -3.957  -4.017 1.00 0.31 ?  35 PHE   A CG   3  
ATOM   1708 C CD1  . PHE   A 1 35 ? 10.624  -4.739  -3.271 1.00 0.40 ?  35 PHE   A CD1  3  
ATOM   1709 C CD2  . PHE   A 1 35 ? 10.263  -2.853  -4.682 1.00 0.37 ?  35 PHE   A CD2  3  
ATOM   1710 C CE1  . PHE   A 1 35 ? 11.965  -4.424  -3.187 1.00 0.49 ?  35 PHE   A CE1  3  
ATOM   1711 C CE2  . PHE   A 1 35 ? 11.603  -2.532  -4.602 1.00 0.46 ?  35 PHE   A CE2  3  
ATOM   1712 C CZ   . PHE   A 1 35 ? 12.456  -3.319  -3.854 1.00 0.51 ?  35 PHE   A CZ   3  
ATOM   1713 H H    . PHE   A 1 35 ? 7.588   -4.742  -1.562 1.00 0.19 ?  35 PHE   A H    3  
ATOM   1714 H HA   . PHE   A 1 35 ? 7.688   -2.406  -3.344 1.00 0.24 ?  35 PHE   A HA   3  
ATOM   1715 H HB2  . PHE   A 1 35 ? 8.188   -5.339  -3.823 1.00 0.24 ?  35 PHE   A HB2  3  
ATOM   1716 H HB3  . PHE   A 1 35 ? 7.999   -4.190  -5.140 1.00 0.27 ?  35 PHE   A HB3  3  
ATOM   1717 H HD1  . PHE   A 1 35 ? 10.239  -5.604  -2.750 1.00 0.45 ?  35 PHE   A HD1  3  
ATOM   1718 H HD2  . PHE   A 1 35 ? 9.594   -2.235  -5.266 1.00 0.40 ?  35 PHE   A HD2  3  
ATOM   1719 H HE1  . PHE   A 1 35 ? 12.630  -5.040  -2.600 1.00 0.59 ?  35 PHE   A HE1  3  
ATOM   1720 H HE2  . PHE   A 1 35 ? 11.984  -1.666  -5.122 1.00 0.54 ?  35 PHE   A HE2  3  
ATOM   1721 H HZ   . PHE   A 1 35 ? 13.505  -3.071  -3.791 1.00 0.60 ?  35 PHE   A HZ   3  
ATOM   1722 N N    . VAL   A 1 36 ? 5.241   -4.520  -3.081 1.00 0.12 ?  36 VAL   A N    3  
ATOM   1723 C CA   . VAL   A 1 36 ? 3.884   -4.816  -3.497 1.00 0.17 ?  36 VAL   A CA   3  
ATOM   1724 C C    . VAL   A 1 36 ? 2.874   -4.215  -2.532 1.00 0.15 ?  36 VAL   A C    3  
ATOM   1725 O O    . VAL   A 1 36 ? 2.894   -4.501  -1.342 1.00 0.17 ?  36 VAL   A O    3  
ATOM   1726 C CB   . VAL   A 1 36 ? 3.654   -6.336  -3.605 1.00 0.23 ?  36 VAL   A CB   3  
ATOM   1727 C CG1  . VAL   A 1 36 ? 2.201   -6.646  -3.928 1.00 0.32 ?  36 VAL   A CG1  3  
ATOM   1728 C CG2  . VAL   A 1 36 ? 4.568   -6.935  -4.660 1.00 0.25 ?  36 VAL   A CG2  3  
ATOM   1729 H H    . VAL   A 1 36 ? 5.627   -5.013  -2.326 1.00 0.17 ?  36 VAL   A H    3  
ATOM   1730 H HA   . VAL   A 1 36 ? 3.735   -4.381  -4.473 1.00 0.20 ?  36 VAL   A HA   3  
ATOM   1731 H HB   . VAL   A 1 36 ? 3.896   -6.784  -2.652 1.00 0.24 ?  36 VAL   A HB   3  
ATOM   1732 H HG11 . VAL   A 1 36 ? 2.064   -7.715  -3.979 1.00 1.12 ?  36 VAL   A HG11 3  
ATOM   1733 H HG12 . VAL   A 1 36 ? 1.943   -6.205  -4.881 1.00 1.04 ?  36 VAL   A HG12 3  
ATOM   1734 H HG13 . VAL   A 1 36 ? 1.564   -6.236  -3.157 1.00 1.00 ?  36 VAL   A HG13 3  
ATOM   1735 H HG21 . VAL   A 1 36 ? 4.451   -8.009  -4.669 1.00 1.04 ?  36 VAL   A HG21 3  
ATOM   1736 H HG22 . VAL   A 1 36 ? 5.595   -6.686  -4.434 1.00 0.94 ?  36 VAL   A HG22 3  
ATOM   1737 H HG23 . VAL   A 1 36 ? 4.306   -6.537  -5.629 1.00 1.08 ?  36 VAL   A HG23 3  
ATOM   1738 N N    . CYS   A 1 37 ? 2.008   -3.372  -3.052 1.00 0.15 ?  37 CYS   A N    3  
ATOM   1739 C CA   . CYS   A 1 37 ? 0.936   -2.794  -2.264 1.00 0.14 ?  37 CYS   A CA   3  
ATOM   1740 C C    . CYS   A 1 37 ? -0.195  -3.811  -2.147 1.00 0.12 ?  37 CYS   A C    3  
ATOM   1741 O O    . CYS   A 1 37 ? -0.886  -4.100  -3.127 1.00 0.18 ?  37 CYS   A O    3  
ATOM   1742 C CB   . CYS   A 1 37 ? 0.448   -1.500  -2.926 1.00 0.16 ?  37 CYS   A CB   3  
ATOM   1743 S SG   . CYS   A 1 37 ? -0.909  -0.653  -2.054 1.00 0.14 ?  37 CYS   A SG   3  
ATOM   1744 H H    . CYS   A 1 37 ? 2.083   -3.137  -4.002 1.00 0.16 ?  37 CYS   A H    3  
ATOM   1745 H HA   . CYS   A 1 37 ? 1.320   -2.574  -1.277 1.00 0.14 ?  37 CYS   A HA   3  
ATOM   1746 H HB2  . CYS   A 1 37 ? 1.274   -0.808  -2.988 1.00 0.20 ?  37 CYS   A HB2  3  
ATOM   1747 H HB3  . CYS   A 1 37 ? 0.104   -1.730  -3.924 1.00 0.18 ?  37 CYS   A HB3  3  
ATOM   1748 N N    . LYS   A 1 38 ? -0.361  -4.380  -0.960 1.00 0.10 ?  38 LYS   A N    3  
ATOM   1749 C CA   . LYS   A 1 38 ? -1.331  -5.445  -0.764 1.00 0.11 ?  38 LYS   A CA   3  
ATOM   1750 C C    . LYS   A 1 38 ? -2.548  -4.939  -0.012 1.00 0.11 ?  38 LYS   A C    3  
ATOM   1751 O O    . LYS   A 1 38 ? -2.457  -4.539  1.152  1.00 0.12 ?  38 LYS   A O    3  
ATOM   1752 C CB   . LYS   A 1 38 ? -0.702  -6.614  -0.009 1.00 0.15 ?  38 LYS   A CB   3  
ATOM   1753 C CG   . LYS   A 1 38 ? -1.635  -7.799  0.126  1.00 0.26 ?  38 LYS   A CG   3  
ATOM   1754 C CD   . LYS   A 1 38 ? -0.977  -8.933  0.887  1.00 0.70 ?  38 LYS   A CD   3  
ATOM   1755 C CE   . LYS   A 1 38 ? -1.979  -10.013 1.273  1.00 1.19 ?  38 LYS   A CE   3  
ATOM   1756 N NZ   . LYS   A 1 38 ? -1.372  -11.019 2.179  1.00 2.16 1  38 LYS   A NZ   3  
ATOM   1757 H H    . LYS   A 1 38 ? 0.168   -4.062  -0.191 1.00 0.13 ?  38 LYS   A H    3  
ATOM   1758 H HA   . LYS   A 1 38 ? -1.645  -5.788  -1.738 1.00 0.12 ?  38 LYS   A HA   3  
ATOM   1759 H HB2  . LYS   A 1 38 ? 0.184   -6.937  -0.532 1.00 0.14 ?  38 LYS   A HB2  3  
ATOM   1760 H HB3  . LYS   A 1 38 ? -0.428  -6.284  0.984  1.00 0.19 ?  38 LYS   A HB3  3  
ATOM   1761 H HG2  . LYS   A 1 38 ? -2.523  -7.490  0.649  1.00 0.63 ?  38 LYS   A HG2  3  
ATOM   1762 H HG3  . LYS   A 1 38 ? -1.898  -8.141  -0.860 1.00 0.69 ?  38 LYS   A HG3  3  
ATOM   1763 H HD2  . LYS   A 1 38 ? -0.213  -9.373  0.264  1.00 1.20 ?  38 LYS   A HD2  3  
ATOM   1764 H HD3  . LYS   A 1 38 ? -0.527  -8.537  1.784  1.00 1.36 ?  38 LYS   A HD3  3  
ATOM   1765 H HE2  . LYS   A 1 38 ? -2.817  -9.549  1.773  1.00 1.63 ?  38 LYS   A HE2  3  
ATOM   1766 H HE3  . LYS   A 1 38 ? -2.323  -10.509 0.378  1.00 1.57 ?  38 LYS   A HE3  3  
ATOM   1767 H HZ1  . LYS   A 1 38 ? -1.002  -10.550 3.033  1.00 2.60 ?  38 LYS   A HZ1  3  
ATOM   1768 H HZ2  . LYS   A 1 38 ? -0.591  -11.510 1.700  1.00 2.57 ?  38 LYS   A HZ2  3  
ATOM   1769 H HZ3  . LYS   A 1 38 ? -2.082  -11.722 2.464  1.00 2.71 ?  38 LYS   A HZ3  3  
ATOM   1770 N N    . CYS   A 1 39 ? -3.688  -4.991  -0.674 1.00 0.12 ?  39 CYS   A N    3  
ATOM   1771 C CA   . CYS   A 1 39 ? -4.916  -4.460  -0.124 1.00 0.12 ?  39 CYS   A CA   3  
ATOM   1772 C C    . CYS   A 1 39 ? -5.676  -5.521  0.660  1.00 0.15 ?  39 CYS   A C    3  
ATOM   1773 O O    . CYS   A 1 39 ? -5.637  -6.708  0.334  1.00 0.19 ?  39 CYS   A O    3  
ATOM   1774 C CB   . CYS   A 1 39 ? -5.795  -3.913  -1.244 1.00 0.13 ?  39 CYS   A CB   3  
ATOM   1775 S SG   . CYS   A 1 39 ? -4.944  -2.750  -2.361 1.00 0.14 ?  39 CYS   A SG   3  
ATOM   1776 H H    . CYS   A 1 39 ? -3.707  -5.414  -1.558 1.00 0.16 ?  39 CYS   A H    3  
ATOM   1777 H HA   . CYS   A 1 39 ? -4.658  -3.654  0.543  1.00 0.11 ?  39 CYS   A HA   3  
ATOM   1778 H HB2  . CYS   A 1 39 ? -6.158  -4.736  -1.839 1.00 0.15 ?  39 CYS   A HB2  3  
ATOM   1779 H HB3  . CYS   A 1 39 ? -6.636  -3.391  -0.807 1.00 0.15 ?  39 CYS   A HB3  3  
ATOM   1780 N N    . TYR   A 1 40 ? -6.366  -5.073  1.691  1.00 0.18 ?  40 TYR   A N    3  
ATOM   1781 C CA   . TYR   A 1 40 ? -7.172  -5.937  2.533  1.00 0.25 ?  40 TYR   A CA   3  
ATOM   1782 C C    . TYR   A 1 40 ? -8.448  -5.200  2.924  1.00 0.32 ?  40 TYR   A C    3  
ATOM   1783 O O    . TYR   A 1 40 ? -8.422  -3.998  3.169  1.00 0.88 ?  40 TYR   A O    3  
ATOM   1784 C CB   . TYR   A 1 40 ? -6.386  -6.370  3.782  1.00 0.27 ?  40 TYR   A CB   3  
ATOM   1785 C CG   . TYR   A 1 40 ? -5.868  -5.219  4.620  1.00 0.25 ?  40 TYR   A CG   3  
ATOM   1786 C CD1  . TYR   A 1 40 ? -4.617  -4.668  4.378  1.00 0.22 ?  40 TYR   A CD1  3  
ATOM   1787 C CD2  . TYR   A 1 40 ? -6.628  -4.690  5.653  1.00 0.32 ?  40 TYR   A CD2  3  
ATOM   1788 C CE1  . TYR   A 1 40 ? -4.136  -3.626  5.149  1.00 0.25 ?  40 TYR   A CE1  3  
ATOM   1789 C CE2  . TYR   A 1 40 ? -6.157  -3.647  6.423  1.00 0.35 ?  40 TYR   A CE2  3  
ATOM   1790 C CZ   . TYR   A 1 40 ? -4.924  -3.096  6.146  1.00 0.31 ?  40 TYR   A CZ   3  
ATOM   1791 O OH   . TYR   A 1 40 ? -4.431  -2.093  6.953  1.00 0.37 ?  40 TYR   A OH   3  
ATOM   1792 H H    . TYR   A 1 40 ? -6.335  -4.111  1.895  1.00 0.18 ?  40 TYR   A H    3  
ATOM   1793 H HA   . TYR   A 1 40 ? -7.435  -6.812  1.958  1.00 0.31 ?  40 TYR   A HA   3  
ATOM   1794 H HB2  . TYR   A 1 40 ? -7.025  -6.970  4.411  1.00 0.32 ?  40 TYR   A HB2  3  
ATOM   1795 H HB3  . TYR   A 1 40 ? -5.537  -6.962  3.473  1.00 0.28 ?  40 TYR   A HB3  3  
ATOM   1796 H HD1  . TYR   A 1 40 ? -4.013  -5.070  3.577  1.00 0.22 ?  40 TYR   A HD1  3  
ATOM   1797 H HD2  . TYR   A 1 40 ? -7.604  -5.108  5.854  1.00 0.36 ?  40 TYR   A HD2  3  
ATOM   1798 H HE1  . TYR   A 1 40 ? -3.160  -3.210  4.945  1.00 0.26 ?  40 TYR   A HE1  3  
ATOM   1799 H HE2  . TYR   A 1 40 ? -6.763  -3.250  7.223  1.00 0.41 ?  40 TYR   A HE2  3  
ATOM   1800 H HH   . TYR   A 1 40 ? -4.109  -1.380  6.388  1.00 1.13 ?  40 TYR   A HH   3  
HETATM 1801 N N    . NH2   A 1 41 ? -9.566  -5.897  2.935  1.00 0.59 ?  41 NH2   A N    3  
HETATM 1802 H HN1  . NH2   A 1 41 ? -9.516  -6.853  2.730  1.00 1.06 ?  41 NH2   A HN1  3  
HETATM 1803 H HN2  . NH2   A 1 41 ? -10.400 -5.432  3.154  1.00 0.56 ?  41 NH2   A HN2  3  
ATOM   1804 N N    . GLY   A 1 1  ? 5.379   2.214   -8.033 1.00 1.74 ?  1  GLY   A N    4  
ATOM   1805 C CA   . GLY   A 1 1  ? 4.488   1.472   -7.111 1.00 0.89 ?  1  GLY   A CA   4  
ATOM   1806 C C    . GLY   A 1 1  ? 3.534   2.395   -6.387 1.00 0.90 ?  1  GLY   A C    4  
ATOM   1807 O O    . GLY   A 1 1  ? 3.651   3.617   -6.488 1.00 1.76 ?  1  GLY   A O    4  
ATOM   1808 H H1   . GLY   A 1 1  ? 5.952   2.898   -7.500 1.00 2.34 ?  1  GLY   A H1   4  
ATOM   1809 H H2   . GLY   A 1 1  ? 4.813   2.728   -8.737 1.00 1.93 ?  1  GLY   A H2   4  
ATOM   1810 H H3   . GLY   A 1 1  ? 6.012   1.554   -8.528 1.00 2.29 ?  1  GLY   A H3   4  
ATOM   1811 H HA2  . GLY   A 1 1  ? 3.915   0.751   -7.676 1.00 0.93 ?  1  GLY   A HA2  4  
ATOM   1812 H HA3  . GLY   A 1 1  ? 5.091   0.949   -6.383 1.00 1.19 ?  1  GLY   A HA3  4  
ATOM   1813 N N    . PHE   A 1 2  ? 2.608   1.817   -5.635 1.00 0.43 ?  2  PHE   A N    4  
ATOM   1814 C CA   . PHE   A 1 2  ? 1.583   2.590   -4.946 1.00 0.24 ?  2  PHE   A CA   4  
ATOM   1815 C C    . PHE   A 1 2  ? 2.053   2.969   -3.552 1.00 0.22 ?  2  PHE   A C    4  
ATOM   1816 O O    . PHE   A 1 2  ? 1.398   2.674   -2.553 1.00 0.35 ?  2  PHE   A O    4  
ATOM   1817 C CB   . PHE   A 1 2  ? 0.272   1.801   -4.875 1.00 0.16 ?  2  PHE   A CB   4  
ATOM   1818 C CG   . PHE   A 1 2  ? -0.276  1.462   -6.229 1.00 0.18 ?  2  PHE   A CG   4  
ATOM   1819 C CD1  . PHE   A 1 2  ? -0.084  0.201   -6.763 1.00 0.25 ?  2  PHE   A CD1  4  
ATOM   1820 C CD2  . PHE   A 1 2  ? -0.991  2.396   -6.961 1.00 0.22 ?  2  PHE   A CD2  4  
ATOM   1821 C CE1  . PHE   A 1 2  ? -0.594  -0.124  -8.004 1.00 0.30 ?  2  PHE   A CE1  4  
ATOM   1822 C CE2  . PHE   A 1 2  ? -1.501  2.077   -8.202 1.00 0.28 ?  2  PHE   A CE2  4  
ATOM   1823 C CZ   . PHE   A 1 2  ? -1.279  0.855   -8.745 1.00 0.29 ?  2  PHE   A CZ   4  
ATOM   1824 H H    . PHE   A 1 2  ? 2.627   0.845   -5.525 1.00 1.00 ?  2  PHE   A H    4  
ATOM   1825 H HA   . PHE   A 1 2  ? 1.417   3.492   -5.515 1.00 0.34 ?  2  PHE   A HA   4  
ATOM   1826 H HB2  . PHE   A 1 2  ? 0.437   0.879   -4.337 1.00 0.26 ?  2  PHE   A HB2  4  
ATOM   1827 H HB3  . PHE   A 1 2  ? -0.469  2.387   -4.349 1.00 0.20 ?  2  PHE   A HB3  4  
ATOM   1828 H HD1  . PHE   A 1 2  ? 0.474   -0.532  -6.200 1.00 0.32 ?  2  PHE   A HD1  4  
ATOM   1829 H HD2  . PHE   A 1 2  ? -1.146  3.384   -6.553 1.00 0.27 ?  2  PHE   A HD2  4  
ATOM   1830 H HE1  . PHE   A 1 2  ? -0.437  -1.112  -8.409 1.00 0.37 ?  2  PHE   A HE1  4  
ATOM   1831 H HE2  . PHE   A 1 2  ? -2.056  2.813   -8.764 1.00 0.36 ?  2  PHE   A HE2  4  
ATOM   1832 H HZ   . PHE   A 1 2  ? -1.668  0.619   -9.724 1.00 0.34 ?  2  PHE   A HZ   4  
ATOM   1833 N N    . GLY   A 1 3  ? 3.206   3.614   -3.497 1.00 0.18 ?  3  GLY   A N    4  
ATOM   1834 C CA   . GLY   A 1 3  ? 3.792   3.980   -2.229 1.00 0.20 ?  3  GLY   A CA   4  
ATOM   1835 C C    . GLY   A 1 3  ? 4.815   2.963   -1.786 1.00 0.19 ?  3  GLY   A C    4  
ATOM   1836 O O    . GLY   A 1 3  ? 5.830   3.308   -1.188 1.00 0.21 ?  3  GLY   A O    4  
ATOM   1837 H H    . GLY   A 1 3  ? 3.670   3.835   -4.331 1.00 0.21 ?  3  GLY   A H    4  
ATOM   1838 H HA2  . GLY   A 1 3  ? 4.269   4.944   -2.329 1.00 0.23 ?  3  GLY   A HA2  4  
ATOM   1839 H HA3  . GLY   A 1 3  ? 3.011   4.044   -1.486 1.00 0.24 ?  3  GLY   A HA3  4  
ATOM   1840 N N    . CYS   A 1 4  ? 4.544   1.706   -2.086 1.00 0.25 ?  4  CYS   A N    4  
ATOM   1841 C CA   . CYS   A 1 4  ? 5.474   0.631   -1.794 1.00 0.27 ?  4  CYS   A CA   4  
ATOM   1842 C C    . CYS   A 1 4  ? 6.542   0.570   -2.880 1.00 0.29 ?  4  CYS   A C    4  
ATOM   1843 O O    . CYS   A 1 4  ? 6.333   -0.026  -3.937 1.00 0.30 ?  4  CYS   A O    4  
ATOM   1844 C CB   . CYS   A 1 4  ? 4.728   -0.703  -1.719 1.00 0.28 ?  4  CYS   A CB   4  
ATOM   1845 S SG   . CYS   A 1 4  ? 3.222   -0.659  -0.694 1.00 0.39 ?  4  CYS   A SG   4  
ATOM   1846 H H    . CYS   A 1 4  ? 3.690   1.492   -2.515 1.00 0.30 ?  4  CYS   A H    4  
ATOM   1847 H HA   . CYS   A 1 4  ? 5.942   0.835   -0.844 1.00 0.30 ?  4  CYS   A HA   4  
ATOM   1848 H HB2  . CYS   A 1 4  ? 4.437   -0.998  -2.716 1.00 0.21 ?  4  CYS   A HB2  4  
ATOM   1849 H HB3  . CYS   A 1 4  ? 5.386   -1.453  -1.306 1.00 0.42 ?  4  CYS   A HB3  4  
ATOM   1850 N N    . ASN   A 1 5  ? 7.673   1.213   -2.629 1.00 0.34 ?  5  ASN   A N    4  
ATOM   1851 C CA   . ASN   A 1 5  ? 8.753   1.257   -3.604 1.00 0.40 ?  5  ASN   A CA   4  
ATOM   1852 C C    . ASN   A 1 5  ? 10.054  0.717   -3.021 1.00 0.40 ?  5  ASN   A C    4  
ATOM   1853 O O    . ASN   A 1 5  ? 11.144  1.087   -3.462 1.00 0.47 ?  5  ASN   A O    4  
ATOM   1854 C CB   . ASN   A 1 5  ? 8.957   2.689   -4.105 1.00 0.49 ?  5  ASN   A CB   4  
ATOM   1855 C CG   . ASN   A 1 5  ? 7.831   3.170   -5.006 1.00 0.49 ?  5  ASN   A CG   4  
ATOM   1856 O OD1  . ASN   A 1 5  ? 7.252   2.398   -5.767 1.00 0.65 ?  5  ASN   A OD1  4  
ATOM   1857 N ND2  . ASN   A 1 5  ? 7.502   4.451   -4.918 1.00 0.56 ?  5  ASN   A ND2  4  
ATOM   1858 H H    . ASN   A 1 5  ? 7.783   1.685   -1.770 1.00 0.36 ?  5  ASN   A H    4  
ATOM   1859 H HA   . ASN   A 1 5  ? 8.467   0.633   -4.438 1.00 0.43 ?  5  ASN   A HA   4  
ATOM   1860 H HB2  . ASN   A 1 5  ? 9.018   3.351   -3.254 1.00 0.51 ?  5  ASN   A HB2  4  
ATOM   1861 H HB3  . ASN   A 1 5  ? 9.885   2.737   -4.659 1.00 0.57 ?  5  ASN   A HB3  4  
ATOM   1862 H HD21 . ASN   A 1 5  ? 7.994   5.016   -4.285 1.00 0.70 ?  5  ASN   A HD21 4  
ATOM   1863 H HD22 . ASN   A 1 5  ? 6.784   4.784   -5.493 1.00 0.61 ?  5  ASN   A HD22 4  
ATOM   1864 N N    . GLY   A 1 6  ? 9.944   -0.156  -2.032 1.00 0.36 ?  6  GLY   A N    4  
ATOM   1865 C CA   . GLY   A 1 6  ? 11.121  -0.793  -1.479 1.00 0.38 ?  6  GLY   A CA   4  
ATOM   1866 C C    . GLY   A 1 6  ? 11.275  -0.571  0.009  1.00 0.37 ?  6  GLY   A C    4  
ATOM   1867 O O    . GLY   A 1 6  ? 10.558  0.235   0.599  1.00 0.36 ?  6  GLY   A O    4  
ATOM   1868 H H    . GLY   A 1 6  ? 9.056   -0.374  -1.674 1.00 0.34 ?  6  GLY   A H    4  
ATOM   1869 H HA2  . GLY   A 1 6  ? 11.054  -1.856  -1.664 1.00 0.48 ?  6  GLY   A HA2  4  
ATOM   1870 H HA3  . GLY   A 1 6  ? 11.994  -0.407  -1.982 1.00 0.44 ?  6  GLY   A HA3  4  
HETATM 1871 C C2   . 6ZS   A 1 7  ? 14.340  -1.767  3.678  1.00 1.49 ?  7  6ZS   A C2   4  
HETATM 1872 N N    . 6ZS   A 1 7  ? 12.233  -1.285  0.601  1.00 0.47 ?  7  6ZS   A N    4  
HETATM 1873 C CA   . 6ZS   A 1 7  ? 12.494  -1.248  2.047  1.00 0.61 ?  7  6ZS   A CA   4  
HETATM 1874 C CB1  . 6ZS   A 1 7  ? 11.308  -1.825  2.801  1.00 0.71 ?  7  6ZS   A CB1  4  
HETATM 1875 C C    . 6ZS   A 1 7  ? 12.757  0.198   2.494  1.00 0.59 ?  7  6ZS   A C    4  
HETATM 1876 O O    . 6ZS   A 1 7  ? 12.348  0.611   3.583  1.00 1.09 ?  7  6ZS   A O    4  
HETATM 1877 C CB   . 6ZS   A 1 7  ? 13.704  -2.133  2.347  1.00 0.75 ?  7  6ZS   A CB   4  
HETATM 1878 H H1   . 6ZS   A 1 7  ? 13.625  -1.915  4.473  1.00 2.14 ?  7  6ZS   A H1   4  
HETATM 1879 H H4   . 6ZS   A 1 7  ? 15.204  -2.394  3.850  1.00 1.94 ?  7  6ZS   A H4   4  
HETATM 1880 H H3   . 6ZS   A 1 7  ? 14.646  -0.732  3.657  1.00 2.00 ?  7  6ZS   A H3   4  
HETATM 1881 H H    . 6ZS   A 1 7  ? 12.790  -1.869  0.045  1.00 0.49 ?  7  6ZS   A H    4  
HETATM 1882 H H7   . 6ZS   A 1 7  ? 11.165  -2.855  2.511  1.00 1.10 ?  7  6ZS   A H7   4  
HETATM 1883 H H8   . 6ZS   A 1 7  ? 10.423  -1.257  2.562  1.00 1.35 ?  7  6ZS   A H8   4  
HETATM 1884 H H9   . 6ZS   A 1 7  ? 11.493  -1.771  3.862  1.00 1.26 ?  7  6ZS   A H9   4  
HETATM 1885 H H10  . 6ZS   A 1 7  ? 13.396  -3.167  2.390  1.00 1.09 ?  7  6ZS   A H10  4  
HETATM 1886 H H11  . 6ZS   A 1 7  ? 14.449  -2.007  1.573  1.00 1.38 ?  7  6ZS   A H11  4  
ATOM   1887 N N    . TRP   A 1 8  ? 13.432  0.963   1.646  1.00 0.64 ?  8  TRP   A N    4  
ATOM   1888 C CA   . TRP   A 1 8  ? 13.818  2.320   1.992  1.00 0.67 ?  8  TRP   A CA   4  
ATOM   1889 C C    . TRP   A 1 8  ? 12.898  3.345   1.340  1.00 0.49 ?  8  TRP   A C    4  
ATOM   1890 O O    . TRP   A 1 8  ? 13.156  4.550   1.391  1.00 0.58 ?  8  TRP   A O    4  
ATOM   1891 C CB   . TRP   A 1 8  ? 15.266  2.572   1.578  1.00 0.87 ?  8  TRP   A CB   4  
ATOM   1892 C CG   . TRP   A 1 8  ? 16.230  1.605   2.196  1.00 1.12 ?  8  TRP   A CG   4  
ATOM   1893 C CD1  . TRP   A 1 8  ? 16.931  0.633   1.552  1.00 1.27 ?  8  TRP   A CD1  4  
ATOM   1894 C CD2  . TRP   A 1 8  ? 16.580  1.502   3.584  1.00 1.31 ?  8  TRP   A CD2  4  
ATOM   1895 N NE1  . TRP   A 1 8  ? 17.712  -0.058  2.445  1.00 1.50 ?  8  TRP   A NE1  4  
ATOM   1896 C CE2  . TRP   A 1 8  ? 17.512  0.454   3.701  1.00 1.52 ?  8  TRP   A CE2  4  
ATOM   1897 C CE3  . TRP   A 1 8  ? 16.206  2.199   4.737  1.00 1.37 ?  8  TRP   A CE3  4  
ATOM   1898 C CZ2  . TRP   A 1 8  ? 18.068  0.084   4.924  1.00 1.76 ?  8  TRP   A CZ2  4  
ATOM   1899 C CZ3  . TRP   A 1 8  ? 16.758  1.828   5.947  1.00 1.63 ?  8  TRP   A CZ3  4  
ATOM   1900 C CH2  . TRP   A 1 8  ? 17.682  0.781   6.032  1.00 1.80 ?  8  TRP   A CH2  4  
ATOM   1901 H H    . TRP   A 1 8  ? 13.674  0.606   0.769  1.00 1.04 ?  8  TRP   A H    4  
ATOM   1902 H HA   . TRP   A 1 8  ? 13.741  2.419   3.060  1.00 0.76 ?  8  TRP   A HA   4  
ATOM   1903 H HB2  . TRP   A 1 8  ? 15.345  2.483   0.504  1.00 0.85 ?  8  TRP   A HB2  4  
ATOM   1904 H HB3  . TRP   A 1 8  ? 15.553  3.568   1.873  1.00 0.91 ?  8  TRP   A HB3  4  
ATOM   1905 H HD1  . TRP   A 1 8  ? 16.877  0.451   0.491  1.00 1.25 ?  8  TRP   A HD1  4  
ATOM   1906 H HE1  . TRP   A 1 8  ? 18.315  -0.804  2.220  1.00 1.65 ?  8  TRP   A HE1  4  
ATOM   1907 H HE3  . TRP   A 1 8  ? 15.496  3.011   4.695  1.00 1.26 ?  8  TRP   A HE3  4  
ATOM   1908 H HZ2  . TRP   A 1 8  ? 18.782  -0.721  5.008  1.00 1.93 ?  8  TRP   A HZ2  4  
ATOM   1909 H HZ3  . TRP   A 1 8  ? 16.478  2.355   6.847  1.00 1.73 ?  8  TRP   A HZ3  4  
ATOM   1910 H HH2  . TRP   A 1 8  ? 18.087  0.526   6.998  1.00 2.00 ?  8  TRP   A HH2  4  
ATOM   1911 N N    . ASN   A 1 9  ? 11.831  2.862   0.728  1.00 0.33 ?  9  ASN   A N    4  
ATOM   1912 C CA   . ASN   A 1 9  ? 10.840  3.728   0.108  1.00 0.29 ?  9  ASN   A CA   4  
ATOM   1913 C C    . ASN   A 1 9  ? 9.466   3.106   0.314  1.00 0.25 ?  9  ASN   A C    4  
ATOM   1914 O O    . ASN   A 1 9  ? 8.688   2.925   -0.623 1.00 0.36 ?  9  ASN   A O    4  
ATOM   1915 C CB   . ASN   A 1 9  ? 11.139  3.909   -1.386 1.00 0.46 ?  9  ASN   A CB   4  
ATOM   1916 C CG   . ASN   A 1 9  ? 10.437  5.106   -2.003 1.00 1.31 ?  9  ASN   A CG   4  
ATOM   1917 O OD1  . ASN   A 1 9  ? 9.371   5.531   -1.559 1.00 2.05 ?  9  ASN   A OD1  4  
ATOM   1918 N ND2  . ASN   A 1 9  ? 11.031  5.657   -3.046 1.00 1.88 ?  9  ASN   A ND2  4  
ATOM   1919 H H    . ASN   A 1 9  ? 11.696  1.887   0.698  1.00 0.35 ?  9  ASN   A H    4  
ATOM   1920 H HA   . ASN   A 1 9  ? 10.873  4.687   0.604  1.00 0.37 ?  9  ASN   A HA   4  
ATOM   1921 H HB2  . ASN   A 1 9  ? 12.203  4.039   -1.518 1.00 1.10 ?  9  ASN   A HB2  4  
ATOM   1922 H HB3  . ASN   A 1 9  ? 10.826  3.023   -1.918 1.00 0.63 ?  9  ASN   A HB3  4  
ATOM   1923 H HD21 . ASN   A 1 9  ? 11.879  5.269   -3.357 1.00 2.03 ?  9  ASN   A HD21 4  
ATOM   1924 H HD22 . ASN   A 1 9  ? 10.602  6.428   -3.471 1.00 2.48 ?  9  ASN   A HD22 4  
ATOM   1925 N N    . GLU   A 1 10 ? 9.199   2.747   1.556  1.00 0.23 ?  10 GLU   A N    4  
ATOM   1926 C CA   . GLU   A 1 10 ? 7.970   2.066   1.905  1.00 0.26 ?  10 GLU   A CA   4  
ATOM   1927 C C    . GLU   A 1 10 ? 6.954   3.051   2.455  1.00 0.28 ?  10 GLU   A C    4  
ATOM   1928 O O    . GLU   A 1 10 ? 6.955   3.367   3.646  1.00 0.49 ?  10 GLU   A O    4  
ATOM   1929 C CB   . GLU   A 1 10 ? 8.242   0.976   2.942  1.00 0.39 ?  10 GLU   A CB   4  
ATOM   1930 C CG   . GLU   A 1 10 ? 7.017   0.159   3.305  1.00 0.45 ?  10 GLU   A CG   4  
ATOM   1931 C CD   . GLU   A 1 10 ? 7.161   -0.541  4.637  1.00 0.68 ?  10 GLU   A CD   4  
ATOM   1932 O OE1  . GLU   A 1 10 ? 6.975   0.120   5.680  1.00 0.95 ?  10 GLU   A OE1  4  
ATOM   1933 O OE2  . GLU   A 1 10 ? 7.461   -1.755  4.653  1.00 0.78 -1 10 GLU   A OE2  4  
ATOM   1934 H H    . GLU   A 1 10 ? 9.848   2.950   2.262  1.00 0.28 ?  10 GLU   A H    4  
ATOM   1935 H HA   . GLU   A 1 10 ? 7.570   1.614   1.010  1.00 0.27 ?  10 GLU   A HA   4  
ATOM   1936 H HB2  . GLU   A 1 10 ? 8.993   0.305   2.554  1.00 0.43 ?  10 GLU   A HB2  4  
ATOM   1937 H HB3  . GLU   A 1 10 ? 8.617   1.439   3.841  1.00 0.48 ?  10 GLU   A HB3  4  
ATOM   1938 H HG2  . GLU   A 1 10 ? 6.162   0.813   3.349  1.00 0.47 ?  10 GLU   A HG2  4  
ATOM   1939 H HG3  . GLU   A 1 10 ? 6.858   -0.585  2.541  1.00 0.40 ?  10 GLU   A HG3  4  
ATOM   1940 N N    . ASP   A 1 11 ? 6.101   3.555   1.587  1.00 0.23 ?  11 ASP   A N    4  
ATOM   1941 C CA   . ASP   A 1 11 ? 4.993   4.379   2.025  1.00 0.30 ?  11 ASP   A CA   4  
ATOM   1942 C C    . ASP   A 1 11 ? 3.759   3.520   2.211  1.00 0.23 ?  11 ASP   A C    4  
ATOM   1943 O O    . ASP   A 1 11 ? 2.836   3.529   1.392  1.00 0.20 ?  11 ASP   A O    4  
ATOM   1944 C CB   . ASP   A 1 11 ? 4.714   5.529   1.056  1.00 0.38 ?  11 ASP   A CB   4  
ATOM   1945 C CG   . ASP   A 1 11 ? 5.682   6.680   1.226  1.00 0.99 ?  11 ASP   A CG   4  
ATOM   1946 O OD1  . ASP   A 1 11 ? 6.405   7.004   0.262  1.00 1.86 ?  11 ASP   A OD1  4  
ATOM   1947 O OD2  . ASP   A 1 11 ? 5.716   7.274   2.325  1.00 1.32 -1 11 ASP   A OD2  4  
ATOM   1948 H H    . ASP   A 1 11 ? 6.222   3.369   0.628  1.00 0.30 ?  11 ASP   A H    4  
ATOM   1949 H HA   . ASP   A 1 11 ? 5.261   4.794   2.984  1.00 0.38 ?  11 ASP   A HA   4  
ATOM   1950 H HB2  . ASP   A 1 11 ? 4.794   5.166   0.042  1.00 0.94 ?  11 ASP   A HB2  4  
ATOM   1951 H HB3  . ASP   A 1 11 ? 3.713   5.897   1.224  1.00 0.78 ?  11 ASP   A HB3  4  
ATOM   1952 N N    . ASP   A 1 12 ? 3.763   2.771   3.305  1.00 0.25 ?  12 ASP   A N    4  
ATOM   1953 C CA   . ASP   A 1 12 ? 2.647   1.901   3.661  1.00 0.26 ?  12 ASP   A CA   4  
ATOM   1954 C C    . ASP   A 1 12 ? 1.387   2.734   3.823  1.00 0.18 ?  12 ASP   A C    4  
ATOM   1955 O O    . ASP   A 1 12 ? 0.285   2.300   3.486  1.00 0.18 ?  12 ASP   A O    4  
ATOM   1956 C CB   . ASP   A 1 12 ? 2.967   1.150   4.956  1.00 0.39 ?  12 ASP   A CB   4  
ATOM   1957 C CG   . ASP   A 1 12 ? 1.876   0.189   5.375  1.00 0.82 ?  12 ASP   A CG   4  
ATOM   1958 O OD1  . ASP   A 1 12 ? 1.929   -0.985  4.954  1.00 1.45 ?  12 ASP   A OD1  4  
ATOM   1959 O OD2  . ASP   A 1 12 ? 0.985   0.590   6.156  1.00 1.50 -1 12 ASP   A OD2  4  
ATOM   1960 H H    . ASP   A 1 12 ? 4.544   2.811   3.900  1.00 0.31 ?  12 ASP   A H    4  
ATOM   1961 H HA   . ASP   A 1 12 ? 2.503   1.191   2.859  1.00 0.27 ?  12 ASP   A HA   4  
ATOM   1962 H HB2  . ASP   A 1 12 ? 3.873   0.586   4.817  1.00 1.12 ?  12 ASP   A HB2  4  
ATOM   1963 H HB3  . ASP   A 1 12 ? 3.116   1.864   5.749  1.00 1.15 ?  12 ASP   A HB3  4  
HETATM 1964 N N    . 2ML   A 1 13 ? 1.588   3.956   4.313  1.00 0.18 ?  13 2ML   A N    4  
HETATM 1965 C CA   . 2ML   A 1 13 ? 0.529   4.955   4.441  1.00 0.19 ?  13 2ML   A CA   4  
HETATM 1966 C CB1  . 2ML   A 1 13 ? 1.171   6.260   4.921  1.00 0.24 ?  13 2ML   A CB1  4  
HETATM 1967 C CB2  . 2ML   A 1 13 ? -0.489  4.507   5.479  1.00 0.25 ?  13 2ML   A CB2  4  
HETATM 1968 C CG   . 2ML   A 1 13 ? 0.127   7.356   5.201  1.00 0.33 ?  13 2ML   A CG   4  
HETATM 1969 C CD1  . 2ML   A 1 13 ? 0.658   8.322   6.249  1.00 0.57 ?  13 2ML   A CD1  4  
HETATM 1970 C CD2  . 2ML   A 1 13 ? -0.220  8.129   3.935  1.00 0.54 ?  13 2ML   A CD2  4  
HETATM 1971 C C    . 2ML   A 1 13 ? -0.136  5.144   3.069  1.00 0.16 ?  13 2ML   A C    4  
HETATM 1972 O O    . 2ML   A 1 13 ? -1.361  5.217   2.960  1.00 0.17 ?  13 2ML   A O    4  
HETATM 1973 H H    . 2ML   A 1 13 ? 2.493   4.197   4.609  1.00 0.20 ?  13 2ML   A H    4  
HETATM 1974 H HB11 . 2ML   A 1 13 ? 1.847   6.617   4.159  1.00 0.28 ?  13 2ML   A HB11 4  
HETATM 1975 H HB12 . 2ML   A 1 13 ? 1.732   6.066   5.824  1.00 0.32 ?  13 2ML   A HB12 4  
HETATM 1976 H HB21 . 2ML   A 1 13 ? -0.765  3.481   5.287  1.00 0.92 ?  13 2ML   A HB21 4  
HETATM 1977 H HB22 . 2ML   A 1 13 ? -1.369  5.130   5.418  1.00 0.95 ?  13 2ML   A HB22 4  
HETATM 1978 H HB23 . 2ML   A 1 13 ? -0.059  4.584   6.466  1.00 1.02 ?  13 2ML   A HB23 4  
HETATM 1979 H HG   . 2ML   A 1 13 ? -0.775  6.904   5.584  1.00 0.64 ?  13 2ML   A HG   4  
HETATM 1980 H HD11 . 2ML   A 1 13 ? 1.566   8.782   5.887  1.00 1.31 ?  13 2ML   A HD11 4  
HETATM 1981 H HD12 . 2ML   A 1 13 ? 0.868   7.786   7.163  1.00 0.88 ?  13 2ML   A HD12 4  
HETATM 1982 H HD13 . 2ML   A 1 13 ? -0.080  9.086   6.442  1.00 1.28 ?  13 2ML   A HD13 4  
HETATM 1983 H HD21 . 2ML   A 1 13 ? -0.969  8.873   4.161  1.00 1.20 ?  13 2ML   A HD21 4  
HETATM 1984 H HD22 . 2ML   A 1 13 ? -0.603  7.446   3.191  1.00 1.15 ?  13 2ML   A HD22 4  
HETATM 1985 H HD23 . 2ML   A 1 13 ? 0.667   8.615   3.556  1.00 1.05 ?  13 2ML   A HD23 4  
ATOM   1986 N N    . ARG   A 1 14 ? 0.688   5.192   2.025  1.00 0.14 ?  14 ARG   A N    4  
ATOM   1987 C CA   . ARG   A 1 14 ? 0.204   5.464   0.675  1.00 0.16 ?  14 ARG   A CA   4  
ATOM   1988 C C    . ARG   A 1 14 ? -0.469  4.241   0.068  1.00 0.12 ?  14 ARG   A C    4  
ATOM   1989 O O    . ARG   A 1 14 ? -1.452  4.371   -0.658 1.00 0.14 ?  14 ARG   A O    4  
ATOM   1990 C CB   . ARG   A 1 14 ? 1.335   5.945   -0.232 1.00 0.21 ?  14 ARG   A CB   4  
ATOM   1991 C CG   . ARG   A 1 14 ? 1.758   7.381   0.029  1.00 1.03 ?  14 ARG   A CG   4  
ATOM   1992 C CD   . ARG   A 1 14 ? 2.749   7.862   -1.020 1.00 1.04 ?  14 ARG   A CD   4  
ATOM   1993 N NE   . ARG   A 1 14 ? 2.134   7.966   -2.345 1.00 1.37 ?  14 ARG   A NE   4  
ATOM   1994 C CZ   . ARG   A 1 14 ? 2.806   7.863   -3.491 1.00 1.63 ?  14 ARG   A CZ   4  
ATOM   1995 N NH1  . ARG   A 1 14 ? 4.124   7.671   -3.478 1.00 1.31 1  14 ARG   A NH1  4  
ATOM   1996 N NH2  . ARG   A 1 14 ? 2.160   7.953   -4.647 1.00 2.60 ?  14 ARG   A NH2  4  
ATOM   1997 H H    . ARG   A 1 14 ? 1.642   5.012   2.164  1.00 0.17 ?  14 ARG   A H    4  
ATOM   1998 H HA   . ARG   A 1 14 ? -0.529  6.249   0.750  1.00 0.20 ?  14 ARG   A HA   4  
ATOM   1999 H HB2  . ARG   A 1 14 ? 2.193   5.310   -0.086 1.00 0.88 ?  14 ARG   A HB2  4  
ATOM   2000 H HB3  . ARG   A 1 14 ? 1.017   5.867   -1.258 1.00 0.69 ?  14 ARG   A HB3  4  
ATOM   2001 H HG2  . ARG   A 1 14 ? 0.882   8.013   0.002  1.00 1.51 ?  14 ARG   A HG2  4  
ATOM   2002 H HG3  . ARG   A 1 14 ? 2.218   7.440   1.003  1.00 1.60 ?  14 ARG   A HG3  4  
ATOM   2003 H HD2  . ARG   A 1 14 ? 3.126   8.831   -0.728 1.00 1.51 ?  14 ARG   A HD2  4  
ATOM   2004 H HD3  . ARG   A 1 14 ? 3.566   7.156   -1.069 1.00 1.55 ?  14 ARG   A HD3  4  
ATOM   2005 H HE   . ARG   A 1 14 ? 1.161   8.122   -2.379 1.00 1.89 ?  14 ARG   A HE   4  
ATOM   2006 H HH11 . ARG   A 1 14 ? 4.633   7.593   -4.340 1.00 1.53 ?  14 ARG   A HH11 4  
ATOM   2007 H HH12 . ARG   A 1 14 ? 4.617   7.607   -2.606 1.00 1.40 ?  14 ARG   A HH12 4  
ATOM   2008 H HH21 . ARG   A 1 14 ? 2.659   7.876   -5.514 1.00 2.84 ?  14 ARG   A HH21 4  
ATOM   2009 H HH22 . ARG   A 1 14 ? 1.166   8.099   -4.659 1.00 3.21 ?  14 ARG   A HH22 4  
ATOM   2010 N N    . CYS   A 1 15 ? 0.060   3.062   0.356  1.00 0.11 ?  15 CYS   A N    4  
ATOM   2011 C CA   . CYS   A 1 15 ? -0.580  1.825   -0.085 1.00 0.10 ?  15 CYS   A CA   4  
ATOM   2012 C C    . CYS   A 1 15 ? -1.959  1.717   0.554  1.00 0.09 ?  15 CYS   A C    4  
ATOM   2013 O O    . CYS   A 1 15 ? -2.946  1.380   -0.106 1.00 0.09 ?  15 CYS   A O    4  
ATOM   2014 C CB   . CYS   A 1 15 ? 0.279   0.608   0.281  1.00 0.13 ?  15 CYS   A CB   4  
ATOM   2015 S SG   . CYS   A 1 15 ? -0.462  -1.006  -0.148 1.00 0.13 ?  15 CYS   A SG   4  
ATOM   2016 H H    . CYS   A 1 15 ? 0.898   3.020   0.870  1.00 0.12 ?  15 CYS   A H    4  
ATOM   2017 H HA   . CYS   A 1 15 ? -0.696  1.870   -1.163 1.00 0.11 ?  15 CYS   A HA   4  
ATOM   2018 H HB2  . CYS   A 1 15 ? 1.226   0.678   -0.235 1.00 0.15 ?  15 CYS   A HB2  4  
ATOM   2019 H HB3  . CYS   A 1 15 ? 0.457   0.615   1.348  1.00 0.15 ?  15 CYS   A HB3  4  
ATOM   2020 N N    . HIS   A 1 16 ? -2.025  2.055   1.840  1.00 0.11 ?  16 HIS   A N    4  
ATOM   2021 C CA   . HIS   A 1 16 ? -3.280  2.056   2.569  1.00 0.13 ?  16 HIS   A CA   4  
ATOM   2022 C C    . HIS   A 1 16 ? -4.232  3.082   1.973  1.00 0.13 ?  16 HIS   A C    4  
ATOM   2023 O O    . HIS   A 1 16 ? -5.406  2.787   1.773  1.00 0.15 ?  16 HIS   A O    4  
ATOM   2024 C CB   . HIS   A 1 16 ? -3.038  2.349   4.056  1.00 0.17 ?  16 HIS   A CB   4  
ATOM   2025 C CG   . HIS   A 1 16 ? -4.281  2.337   4.899  1.00 0.27 ?  16 HIS   A CG   4  
ATOM   2026 N ND1  . HIS   A 1 16 ? -4.675  1.248   5.649  1.00 0.39 ?  16 HIS   A ND1  4  
ATOM   2027 C CD2  . HIS   A 1 16 ? -5.222  3.288   5.103  1.00 0.34 ?  16 HIS   A CD2  4  
ATOM   2028 C CE1  . HIS   A 1 16 ? -5.805  1.530   6.269  1.00 0.48 ?  16 HIS   A CE1  4  
ATOM   2029 N NE2  . HIS   A 1 16 ? -6.158  2.761   5.955  1.00 0.45 ?  16 HIS   A NE2  4  
ATOM   2030 H H    . HIS   A 1 16 ? -1.196  2.298   2.313  1.00 0.13 ?  16 HIS   A H    4  
ATOM   2031 H HA   . HIS   A 1 16 ? -3.722  1.075   2.469  1.00 0.14 ?  16 HIS   A HA   4  
ATOM   2032 H HB2  . HIS   A 1 16 ? -2.364  1.608   4.454  1.00 0.22 ?  16 HIS   A HB2  4  
ATOM   2033 H HB3  . HIS   A 1 16 ? -2.585  3.325   4.150  1.00 0.15 ?  16 HIS   A HB3  4  
ATOM   2034 H HD1  . HIS   A 1 16 ? -4.181  0.404   5.741  1.00 0.44 ?  16 HIS   A HD1  4  
ATOM   2035 H HD2  . HIS   A 1 16 ? -5.230  4.281   4.676  1.00 0.35 ?  16 HIS   A HD2  4  
ATOM   2036 H HE1  . HIS   A 1 16 ? -6.354  0.860   6.913  1.00 0.59 ?  16 HIS   A HE1  4  
ATOM   2037 H HE2  . HIS   A 1 16 ? -7.030  3.169   6.165  1.00 0.54 ?  16 HIS   A HE2  4  
HETATM 2038 N N    . AIB   A 1 17 ? -3.710  4.282   1.702  1.00 0.13 ?  17 AIB   A N    4  
HETATM 2039 C CA   . AIB   A 1 17 ? -4.484  5.359   1.069  1.00 0.15 ?  17 AIB   A CA   4  
HETATM 2040 C C    . AIB   A 1 17 ? -5.095  4.835   -0.236 1.00 0.13 ?  17 AIB   A C    4  
HETATM 2041 O O    . AIB   A 1 17 ? -6.302  4.945   -0.475 1.00 0.15 ?  17 AIB   A O    4  
HETATM 2042 C CB1  . AIB   A 1 17 ? -3.572  6.533   0.765  1.00 0.18 ?  17 AIB   A CB1  4  
HETATM 2043 C CB2  . AIB   A 1 17 ? -5.560  5.854   2.015  1.00 0.19 ?  17 AIB   A CB2  4  
HETATM 2044 H H    . AIB   A 1 17 ? -2.772  4.453   1.940  1.00 0.13 ?  17 AIB   A H    4  
HETATM 2045 H HB11 . AIB   A 1 17 ? -4.142  7.316   0.289  1.00 0.99 ?  17 AIB   A HB11 4  
HETATM 2046 H HB12 . AIB   A 1 17 ? -2.780  6.212   0.105  1.00 0.95 ?  17 AIB   A HB12 4  
HETATM 2047 H HB13 . AIB   A 1 17 ? -3.146  6.908   1.684  1.00 1.05 ?  17 AIB   A HB13 4  
HETATM 2048 H HB21 . AIB   A 1 17 ? -6.155  5.019   2.349  1.00 1.00 ?  17 AIB   A HB21 4  
HETATM 2049 H HB22 . AIB   A 1 17 ? -6.192  6.564   1.503  1.00 1.02 ?  17 AIB   A HB22 4  
HETATM 2050 H HB23 . AIB   A 1 17 ? -5.098  6.331   2.867  1.00 0.98 ?  17 AIB   A HB23 4  
ATOM   2051 N N    . HIS   A 1 18 ? -4.240  4.240   -1.058 1.00 0.12 ?  18 HIS   A N    4  
ATOM   2052 C CA   . HIS   A 1 18 ? -4.644  3.707   -2.347 1.00 0.12 ?  18 HIS   A CA   4  
ATOM   2053 C C    . HIS   A 1 18 ? -5.757  2.676   -2.184 1.00 0.09 ?  18 HIS   A C    4  
ATOM   2054 O O    . HIS   A 1 18 ? -6.833  2.817   -2.761 1.00 0.10 ?  18 HIS   A O    4  
ATOM   2055 C CB   . HIS   A 1 18 ? -3.432  3.090   -3.060 1.00 0.15 ?  18 HIS   A CB   4  
ATOM   2056 C CG   . HIS   A 1 18 ? -3.767  2.377   -4.332 1.00 0.19 ?  18 HIS   A CG   4  
ATOM   2057 N ND1  . HIS   A 1 18 ? -4.220  3.017   -5.465 1.00 0.23 ?  18 HIS   A ND1  4  
ATOM   2058 C CD2  . HIS   A 1 18 ? -3.726  1.060   -4.637 1.00 0.23 ?  18 HIS   A CD2  4  
ATOM   2059 C CE1  . HIS   A 1 18 ? -4.448  2.126   -6.410 1.00 0.28 ?  18 HIS   A CE1  4  
ATOM   2060 N NE2  . HIS   A 1 18 ? -4.155  0.931   -5.933 1.00 0.28 ?  18 HIS   A NE2  4  
ATOM   2061 H H    . HIS   A 1 18 ? -3.300  4.156   -0.784 1.00 0.12 ?  18 HIS   A H    4  
ATOM   2062 H HA   . HIS   A 1 18 ? -5.017  4.527   -2.940 1.00 0.14 ?  18 HIS   A HA   4  
ATOM   2063 H HB2  . HIS   A 1 18 ? -2.729  3.872   -3.300 1.00 0.17 ?  18 HIS   A HB2  4  
ATOM   2064 H HB3  . HIS   A 1 18 ? -2.957  2.383   -2.398 1.00 0.15 ?  18 HIS   A HB3  4  
ATOM   2065 H HD1  . HIS   A 1 18 ? -4.354  3.991   -5.564 1.00 0.24 ?  18 HIS   A HD1  4  
ATOM   2066 H HD2  . HIS   A 1 18 ? -3.408  0.262   -3.981 1.00 0.24 ?  18 HIS   A HD2  4  
ATOM   2067 H HE1  . HIS   A 1 18 ? -4.814  2.339   -7.404 1.00 0.33 ?  18 HIS   A HE1  4  
ATOM   2068 H HE2  . HIS   A 1 18 ? -4.133  0.103   -6.462 1.00 0.36 ?  18 HIS   A HE2  4  
ATOM   2069 N N    . CYS   A 1 19 ? -5.506  1.659   -1.379 1.00 0.09 ?  19 CYS   A N    4  
ATOM   2070 C CA   . CYS   A 1 19 ? -6.472  0.584   -1.189 1.00 0.09 ?  19 CYS   A CA   4  
ATOM   2071 C C    . CYS   A 1 19 ? -7.767  1.101   -0.575 1.00 0.09 ?  19 CYS   A C    4  
ATOM   2072 O O    . CYS   A 1 19 ? -8.849  0.639   -0.930 1.00 0.09 ?  19 CYS   A O    4  
ATOM   2073 C CB   . CYS   A 1 19 ? -5.875  -0.511  -0.316 1.00 0.11 ?  19 CYS   A CB   4  
ATOM   2074 S SG   . CYS   A 1 19 ? -4.405  -1.306  -1.035 1.00 0.12 ?  19 CYS   A SG   4  
ATOM   2075 H H    . CYS   A 1 19 ? -4.649  1.627   -0.894 1.00 0.11 ?  19 CYS   A H    4  
ATOM   2076 H HA   . CYS   A 1 19 ? -6.695  0.170   -2.162 1.00 0.10 ?  19 CYS   A HA   4  
ATOM   2077 H HB2  . CYS   A 1 19 ? -5.589  -0.086  0.635  1.00 0.13 ?  19 CYS   A HB2  4  
ATOM   2078 H HB3  . CYS   A 1 19 ? -6.619  -1.277  -0.155 1.00 0.13 ?  19 CYS   A HB3  4  
HETATM 2079 N N    . A1BEB A 1 20 ? -7.644  2.073   0.329  1.00 0.11 ?  20 A1BEB A N    4  
HETATM 2080 C CA   . A1BEB A 1 20 ? -8.796  2.689   0.992  1.00 0.14 ?  20 A1BEB A CA   4  
HETATM 2081 C C    . A1BEB A 1 20 ? -9.689  3.353   -0.063 1.00 0.16 ?  20 A1BEB A C    4  
HETATM 2082 O O    . A1BEB A 1 20 ? -10.916 3.344   0.056  1.00 0.18 ?  20 A1BEB A O    4  
HETATM 2083 C CB   . A1BEB A 1 20 ? -8.296  3.729   1.982  1.00 0.21 ?  20 A1BEB A CB   4  
HETATM 2084 C CB2  . A1BEB A 1 20 ? -9.578  1.639   1.767  1.00 0.15 ?  20 A1BEB A CB2  4  
HETATM 2085 C CG   . A1BEB A 1 20 ? -9.428  4.362   2.773  1.00 0.36 ?  20 A1BEB A CG   4  
HETATM 2086 C CD   . A1BEB A 1 20 ? -8.907  5.461   3.682  1.00 0.44 ?  20 A1BEB A CD   4  
HETATM 2087 C CE   . A1BEB A 1 20 ? -9.998  6.007   4.593  1.00 0.72 ?  20 A1BEB A CE   4  
HETATM 2088 N NZ   . A1BEB A 1 20 ? -10.535 4.962   5.506  1.00 1.38 ?  20 A1BEB A NZ   4  
HETATM 2089 H H    . A1BEB A 1 20 ? -6.745  2.388   0.566  1.00 0.12 ?  20 A1BEB A H    4  
HETATM 2090 H HB2  . A1BEB A 1 20 ? -7.776  4.510   1.445  1.00 0.19 ?  20 A1BEB A HB2  4  
HETATM 2091 H HB3  . A1BEB A 1 20 ? -7.615  3.261   2.676  1.00 0.23 ?  20 A1BEB A HB3  4  
HETATM 2092 H HB23 . A1BEB A 1 20 ? -9.788  0.799   1.121  1.00 0.84 ?  20 A1BEB A HB23 4  
HETATM 2093 H HB21 . A1BEB A 1 20 ? -10.506 2.064   2.117  1.00 0.80 ?  20 A1BEB A HB21 4  
HETATM 2094 H HB22 . A1BEB A 1 20 ? -8.994  1.305   2.612  1.00 0.82 ?  20 A1BEB A HB22 4  
HETATM 2095 H HG3  . A1BEB A 1 20 ? -9.899  3.605   3.377  1.00 0.42 ?  20 A1BEB A HG3  4  
HETATM 2096 H HG2  . A1BEB A 1 20 ? -10.146 4.779   2.084  1.00 0.40 ?  20 A1BEB A HG2  4  
HETATM 2097 H HD3  . A1BEB A 1 20 ? -8.111  5.060   4.289  1.00 0.93 ?  20 A1BEB A HD3  4  
HETATM 2098 H HD2  . A1BEB A 1 20 ? -8.524  6.265   3.071  1.00 0.84 ?  20 A1BEB A HD2  4  
HETATM 2099 H HE3  . A1BEB A 1 20 ? -9.587  6.810   5.185  1.00 1.49 ?  20 A1BEB A HE3  4  
HETATM 2100 H HE2  . A1BEB A 1 20 ? -10.802 6.387   3.983  1.00 1.41 ?  20 A1BEB A HE2  4  
HETATM 2101 H HZ1  . A1BEB A 1 20 ? -10.916 4.167   4.957  1.00 1.93 ?  20 A1BEB A HZ1  4  
HETATM 2102 H HZ2  . A1BEB A 1 20 ? -11.297 5.355   6.093  1.00 1.93 ?  20 A1BEB A HZ2  4  
HETATM 2103 H HZ3  . A1BEB A 1 20 ? -9.781  4.607   6.129  1.00 1.84 ?  20 A1BEB A HZ3  4  
ATOM   2104 N N    . SER   A 1 21 ? -9.078  3.918   -1.103 1.00 0.18 ?  21 SER   A N    4  
ATOM   2105 C CA   . SER   A 1 21 ? -9.843  4.587   -2.143 1.00 0.23 ?  21 SER   A CA   4  
ATOM   2106 C C    . SER   A 1 21 ? -10.376 3.589   -3.172 1.00 0.23 ?  21 SER   A C    4  
ATOM   2107 O O    . SER   A 1 21 ? -10.951 3.977   -4.194 1.00 0.31 ?  21 SER   A O    4  
ATOM   2108 C CB   . SER   A 1 21 ? -8.999  5.675   -2.812 1.00 0.33 ?  21 SER   A CB   4  
ATOM   2109 O OG   . SER   A 1 21 ? -7.735  5.185   -3.222 1.00 1.18 ?  21 SER   A OG   4  
ATOM   2110 H H    . SER   A 1 21 ? -8.094  3.894   -1.167 1.00 0.17 ?  21 SER   A H    4  
ATOM   2111 H HA   . SER   A 1 21 ? -10.688 5.057   -1.663 1.00 0.26 ?  21 SER   A HA   4  
ATOM   2112 H HB2  . SER   A 1 21 ? -9.521  6.042   -3.677 1.00 1.01 ?  21 SER   A HB2  4  
ATOM   2113 H HB3  . SER   A 1 21 ? -8.847  6.485   -2.117 1.00 1.21 ?  21 SER   A HB3  4  
ATOM   2114 H HG   . SER   A 1 21 ? -7.680  4.234   -3.040 1.00 1.82 ?  21 SER   A HG   4  
ATOM   2115 N N    . ILE   A 1 22 ? -10.177 2.305   -2.904 1.00 0.19 ?  22 ILE   A N    4  
ATOM   2116 C CA   . ILE   A 1 22 ? -10.737 1.255   -3.732 1.00 0.20 ?  22 ILE   A CA   4  
ATOM   2117 C C    . ILE   A 1 22 ? -11.860 0.532   -2.987 1.00 0.17 ?  22 ILE   A C    4  
ATOM   2118 O O    . ILE   A 1 22 ? -11.655 -0.003  -1.888 1.00 0.14 ?  22 ILE   A O    4  
ATOM   2119 C CB   . ILE   A 1 22 ? -9.669  0.232   -4.150 1.00 0.21 ?  22 ILE   A CB   4  
ATOM   2120 C CG1  . ILE   A 1 22 ? -8.512  0.933   -4.862 1.00 0.24 ?  22 ILE   A CG1  4  
ATOM   2121 C CG2  . ILE   A 1 22 ? -10.286 -0.829  -5.053 1.00 0.24 ?  22 ILE   A CG2  4  
ATOM   2122 C CD1  . ILE   A 1 22 ? -7.417  -0.006  -5.322 1.00 0.26 ?  22 ILE   A CD1  4  
ATOM   2123 H H    . ILE   A 1 22 ? -9.630  2.053   -2.129 1.00 0.19 ?  22 ILE   A H    4  
ATOM   2124 H HA   . ILE   A 1 22 ? -11.138 1.711   -4.622 1.00 0.25 ?  22 ILE   A HA   4  
ATOM   2125 H HB   . ILE   A 1 22 ? -9.298  -0.249  -3.259 1.00 0.18 ?  22 ILE   A HB   4  
ATOM   2126 H HG12 . ILE   A 1 22 ? -8.892  1.447   -5.729 1.00 0.28 ?  22 ILE   A HG12 4  
ATOM   2127 H HG13 . ILE   A 1 22 ? -8.072  1.653   -4.187 1.00 0.24 ?  22 ILE   A HG13 4  
ATOM   2128 H HG21 . ILE   A 1 22 ? -10.674 -0.358  -5.944 1.00 0.99 ?  22 ILE   A HG21 4  
ATOM   2129 H HG22 . ILE   A 1 22 ? -11.093 -1.323  -4.529 1.00 0.98 ?  22 ILE   A HG22 4  
ATOM   2130 H HG23 . ILE   A 1 22 ? -9.535  -1.554  -5.326 1.00 0.97 ?  22 ILE   A HG23 4  
ATOM   2131 H HD11 . ILE   A 1 22 ? -6.598  0.567   -5.731 1.00 1.05 ?  22 ILE   A HD11 4  
ATOM   2132 H HD12 . ILE   A 1 22 ? -7.806  -0.665  -6.084 1.00 1.05 ?  22 ILE   A HD12 4  
ATOM   2133 H HD13 . ILE   A 1 22 ? -7.066  -0.592  -4.486 1.00 0.99 ?  22 ILE   A HD13 4  
ATOM   2134 N N    . PRO   A 1 23 ? -13.069 0.518   -3.565 1.00 0.19 ?  23 PRO   A N    4  
ATOM   2135 C CA   . PRO   A 1 23 ? -14.222 -0.151  -2.966 1.00 0.19 ?  23 PRO   A CA   4  
ATOM   2136 C C    . PRO   A 1 23 ? -13.952 -1.629  -2.717 1.00 0.18 ?  23 PRO   A C    4  
ATOM   2137 O O    . PRO   A 1 23 ? -13.272 -2.289  -3.505 1.00 0.21 ?  23 PRO   A O    4  
ATOM   2138 C CB   . PRO   A 1 23 ? -15.329 0.021   -4.009 1.00 0.25 ?  23 PRO   A CB   4  
ATOM   2139 C CG   . PRO   A 1 23 ? -14.907 1.192   -4.819 1.00 0.29 ?  23 PRO   A CG   4  
ATOM   2140 C CD   . PRO   A 1 23 ? -13.410 1.145   -4.853 1.00 0.26 ?  23 PRO   A CD   4  
ATOM   2141 H HA   . PRO   A 1 23 ? -14.516 0.322   -2.041 1.00 0.19 ?  23 PRO   A HA   4  
ATOM   2142 H HB2  . PRO   A 1 23 ? -15.398 -0.869  -4.614 1.00 0.28 ?  23 PRO   A HB2  4  
ATOM   2143 H HB3  . PRO   A 1 23 ? -16.272 0.203   -3.514 1.00 0.28 ?  23 PRO   A HB3  4  
ATOM   2144 H HG2  . PRO   A 1 23 ? -15.306 1.107   -5.815 1.00 0.34 ?  23 PRO   A HG2  4  
ATOM   2145 H HG3  . PRO   A 1 23 ? -15.243 2.105   -4.352 1.00 0.30 ?  23 PRO   A HG3  4  
ATOM   2146 H HD2  . PRO   A 1 23 ? -13.070 0.538   -5.681 1.00 0.30 ?  23 PRO   A HD2  4  
ATOM   2147 H HD3  . PRO   A 1 23 ? -13.004 2.140   -4.920 1.00 0.28 ?  23 PRO   A HD3  4  
HETATM 2148 N N    . DPR   A 1 24 ? -14.487 -2.167  -1.619 1.00 0.19 ?  24 DPR   A N    4  
HETATM 2149 C CA   . DPR   A 1 24 ? -14.287 -3.564  -1.246 1.00 0.23 ?  24 DPR   A CA   4  
HETATM 2150 C CB   . DPR   A 1 24 ? -15.529 -3.853  -0.417 1.00 0.30 ?  24 DPR   A CB   4  
HETATM 2151 C CG   . DPR   A 1 24 ? -15.799 -2.566  0.285  1.00 0.29 ?  24 DPR   A CG   4  
HETATM 2152 C CD   . DPR   A 1 24 ? -15.376 -1.473  -0.665 1.00 0.23 ?  24 DPR   A CD   4  
HETATM 2153 C C    . DPR   A 1 24 ? -13.023 -3.787  -0.413 1.00 0.22 ?  24 DPR   A C    4  
HETATM 2154 O O    . DPR   A 1 24 ? -12.787 -4.893  0.074  1.00 0.31 ?  24 DPR   A O    4  
HETATM 2155 H HA   . DPR   A 1 24 ? -14.275 -4.211  -2.104 1.00 0.27 ?  24 DPR   A HA   4  
HETATM 2156 H HB2  . DPR   A 1 24 ? -15.323 -4.649  0.282  1.00 0.34 ?  24 DPR   A HB2  4  
HETATM 2157 H HB3  . DPR   A 1 24 ? -16.347 -4.134  -1.065 1.00 0.33 ?  24 DPR   A HB3  4  
HETATM 2158 H HG2  . DPR   A 1 24 ? -15.217 -2.515  1.195  1.00 0.31 ?  24 DPR   A HG2  4  
HETATM 2159 H HG3  . DPR   A 1 24 ? -16.852 -2.480  0.509  1.00 0.35 ?  24 DPR   A HG3  4  
HETATM 2160 H HD2  . DPR   A 1 24 ? -14.844 -0.698  -0.137 1.00 0.23 ?  24 DPR   A HD2  4  
HETATM 2161 H HD3  . DPR   A 1 24 ? -16.236 -1.063  -1.173 1.00 0.24 ?  24 DPR   A HD3  4  
ATOM   2162 N N    . TYR   A 1 25 ? -12.204 -2.752  -0.254 1.00 0.15 ?  25 TYR   A N    4  
ATOM   2163 C CA   . TYR   A 1 25 ? -11.035 -2.854  0.609  1.00 0.14 ?  25 TYR   A CA   4  
ATOM   2164 C C    . TYR   A 1 25 ? -11.147 -1.905  1.793  1.00 0.15 ?  25 TYR   A C    4  
ATOM   2165 O O    . TYR   A 1 25 ? -11.887 -0.921  1.746  1.00 0.17 ?  25 TYR   A O    4  
ATOM   2166 C CB   . TYR   A 1 25 ? -9.754  -2.575  -0.175 1.00 0.12 ?  25 TYR   A CB   4  
ATOM   2167 C CG   . TYR   A 1 25 ? -9.461  -3.611  -1.238 1.00 0.15 ?  25 TYR   A CG   4  
ATOM   2168 C CD1  . TYR   A 1 25 ? -9.393  -3.260  -2.582 1.00 0.18 ?  25 TYR   A CD1  4  
ATOM   2169 C CD2  . TYR   A 1 25 ? -9.256  -4.938  -0.900 1.00 0.21 ?  25 TYR   A CD2  4  
ATOM   2170 C CE1  . TYR   A 1 25 ? -9.125  -4.206  -3.552 1.00 0.24 ?  25 TYR   A CE1  4  
ATOM   2171 C CE2  . TYR   A 1 25 ? -8.988  -5.888  -1.863 1.00 0.26 ?  25 TYR   A CE2  4  
ATOM   2172 C CZ   . TYR   A 1 25 ? -8.925  -5.509  -3.195 1.00 0.26 ?  25 TYR   A CZ   4  
ATOM   2173 O OH   . TYR   A 1 25 ? -8.654  -6.464  -4.148 1.00 0.32 ?  25 TYR   A OH   4  
ATOM   2174 H H    . TYR   A 1 25 ? -12.383 -1.909  -0.734 1.00 0.14 ?  25 TYR   A H    4  
ATOM   2175 H HA   . TYR   A 1 25 ? -10.997 -3.865  0.986  1.00 0.16 ?  25 TYR   A HA   4  
ATOM   2176 H HB2  . TYR   A 1 25 ? -9.839  -1.612  -0.657 1.00 0.11 ?  25 TYR   A HB2  4  
ATOM   2177 H HB3  . TYR   A 1 25 ? -8.921  -2.555  0.508  1.00 0.12 ?  25 TYR   A HB3  4  
ATOM   2178 H HD1  . TYR   A 1 25 ? -9.551  -2.232  -2.866 1.00 0.20 ?  25 TYR   A HD1  4  
ATOM   2179 H HD2  . TYR   A 1 25 ? -9.309  -5.228  0.135  1.00 0.25 ?  25 TYR   A HD2  4  
ATOM   2180 H HE1  . TYR   A 1 25 ? -9.075  -3.914  -4.590 1.00 0.29 ?  25 TYR   A HE1  4  
ATOM   2181 H HE2  . TYR   A 1 25 ? -8.832  -6.916  -1.576 1.00 0.32 ?  25 TYR   A HE2  4  
ATOM   2182 H HH   . TYR   A 1 25 ? -7.981  -6.124  -4.751 1.00 0.97 ?  25 TYR   A HH   4  
ATOM   2183 N N    . LYS   A 1 26 ? -10.417 -2.214  2.856  1.00 0.16 ?  26 LYS   A N    4  
ATOM   2184 C CA   . LYS   A 1 26 ? -10.442 -1.405  4.069  1.00 0.21 ?  26 LYS   A CA   4  
ATOM   2185 C C    . LYS   A 1 26 ? -9.020  -1.066  4.506  1.00 0.24 ?  26 LYS   A C    4  
ATOM   2186 O O    . LYS   A 1 26 ? -8.778  -0.664  5.646  1.00 0.46 ?  26 LYS   A O    4  
ATOM   2187 C CB   . LYS   A 1 26 ? -11.189 -2.145  5.190  1.00 0.27 ?  26 LYS   A CB   4  
ATOM   2188 C CG   . LYS   A 1 26 ? -10.505 -3.425  5.654  1.00 0.30 ?  26 LYS   A CG   4  
ATOM   2189 C CD   . LYS   A 1 26 ? -11.344 -4.177  6.675  1.00 0.43 ?  26 LYS   A CD   4  
ATOM   2190 C CE   . LYS   A 1 26 ? -12.600 -4.756  6.043  1.00 1.65 ?  26 LYS   A CE   4  
ATOM   2191 N NZ   . LYS   A 1 26 ? -13.458 -5.464  7.030  1.00 1.94 1  26 LYS   A NZ   4  
ATOM   2192 H H    . LYS   A 1 26 ? -9.843  -3.012  2.824  1.00 0.16 ?  26 LYS   A H    4  
ATOM   2193 H HA   . LYS   A 1 26 ? -10.963 -0.487  3.841  1.00 0.22 ?  26 LYS   A HA   4  
ATOM   2194 H HB2  . LYS   A 1 26 ? -11.281 -1.487  6.041  1.00 0.31 ?  26 LYS   A HB2  4  
ATOM   2195 H HB3  . LYS   A 1 26 ? -12.176 -2.401  4.837  1.00 0.32 ?  26 LYS   A HB3  4  
ATOM   2196 H HG2  . LYS   A 1 26 ? -10.345 -4.065  4.801  1.00 0.34 ?  26 LYS   A HG2  4  
ATOM   2197 H HG3  . LYS   A 1 26 ? -9.555  -3.171  6.099  1.00 0.36 ?  26 LYS   A HG3  4  
ATOM   2198 H HD2  . LYS   A 1 26 ? -10.755 -4.981  7.089  1.00 1.07 ?  26 LYS   A HD2  4  
ATOM   2199 H HD3  . LYS   A 1 26 ? -11.629 -3.496  7.464  1.00 0.96 ?  26 LYS   A HD3  4  
ATOM   2200 H HE2  . LYS   A 1 26 ? -13.167 -3.951  5.604  1.00 2.28 ?  26 LYS   A HE2  4  
ATOM   2201 H HE3  . LYS   A 1 26 ? -12.308 -5.451  5.270  1.00 2.30 ?  26 LYS   A HE3  4  
ATOM   2202 H HZ1  . LYS   A 1 26 ? -13.739 -4.814  7.793  1.00 2.33 ?  26 LYS   A HZ1  4  
ATOM   2203 H HZ2  . LYS   A 1 26 ? -12.945 -6.266  7.444  1.00 2.04 ?  26 LYS   A HZ2  4  
ATOM   2204 H HZ3  . LYS   A 1 26 ? -14.317 -5.821  6.563  1.00 2.40 ?  26 LYS   A HZ3  4  
ATOM   2205 N N    . GLY   A 1 27 ? -8.080  -1.243  3.591  1.00 0.14 ?  27 GLY   A N    4  
ATOM   2206 C CA   . GLY   A 1 27 ? -6.696  -0.935  3.872  1.00 0.13 ?  27 GLY   A CA   4  
ATOM   2207 C C    . GLY   A 1 27 ? -5.763  -1.649  2.922  1.00 0.12 ?  27 GLY   A C    4  
ATOM   2208 O O    . GLY   A 1 27 ? -6.216  -2.428  2.080  1.00 0.15 ?  27 GLY   A O    4  
ATOM   2209 H H    . GLY   A 1 27 ? -8.328  -1.606  2.715  1.00 0.25 ?  27 GLY   A H    4  
ATOM   2210 H HA2  . GLY   A 1 27 ? -6.544  0.128   3.783  1.00 0.14 ?  27 GLY   A HA2  4  
ATOM   2211 H HA3  . GLY   A 1 27 ? -6.468  -1.240  4.881  1.00 0.17 ?  27 GLY   A HA3  4  
ATOM   2212 N N    . GLY   A 1 28 ? -4.470  -1.398  3.054  1.00 0.13 ?  28 GLY   A N    4  
ATOM   2213 C CA   . GLY   A 1 28 ? -3.492  -2.050  2.205  1.00 0.13 ?  28 GLY   A CA   4  
ATOM   2214 C C    . GLY   A 1 28 ? -2.082  -1.837  2.701  1.00 0.16 ?  28 GLY   A C    4  
ATOM   2215 O O    . GLY   A 1 28 ? -1.620  -0.703  2.809  1.00 0.20 ?  28 GLY   A O    4  
ATOM   2216 H H    . GLY   A 1 28 ? -4.168  -0.773  3.745  1.00 0.15 ?  28 GLY   A H    4  
ATOM   2217 H HA2  . GLY   A 1 28 ? -3.700  -3.111  2.191  1.00 0.14 ?  28 GLY   A HA2  4  
ATOM   2218 H HA3  . GLY   A 1 28 ? -3.578  -1.660  1.206  1.00 0.15 ?  28 GLY   A HA3  4  
ATOM   2219 N N    . TYR   A 1 29 ? -1.422  -2.921  3.068  1.00 0.17 ?  29 TYR   A N    4  
ATOM   2220 C CA   . TYR   A 1 29 ? -0.069  -2.844  3.595  1.00 0.22 ?  29 TYR   A CA   4  
ATOM   2221 C C    . TYR   A 1 29 ? 0.964   -3.104  2.506  1.00 0.20 ?  29 TYR   A C    4  
ATOM   2222 O O    . TYR   A 1 29 ? 0.692   -3.802  1.526  1.00 0.17 ?  29 TYR   A O    4  
ATOM   2223 C CB   . TYR   A 1 29 ? 0.126   -3.813  4.764  1.00 0.28 ?  29 TYR   A CB   4  
ATOM   2224 C CG   . TYR   A 1 29 ? -0.066  -5.273  4.422  1.00 0.33 ?  29 TYR   A CG   4  
ATOM   2225 C CD1  . TYR   A 1 29 ? 1.020   -6.094  4.153  1.00 0.46 ?  29 TYR   A CD1  4  
ATOM   2226 C CD2  . TYR   A 1 29 ? -1.339  -5.822  4.348  1.00 0.44 ?  29 TYR   A CD2  4  
ATOM   2227 C CE1  . TYR   A 1 29 ? 0.843   -7.420  3.820  1.00 0.58 ?  29 TYR   A CE1  4  
ATOM   2228 C CE2  . TYR   A 1 29 ? -1.525  -7.147  4.019  1.00 0.55 ?  29 TYR   A CE2  4  
ATOM   2229 C CZ   . TYR   A 1 29 ? -0.405  -7.965  3.835  1.00 0.60 ?  29 TYR   A CZ   4  
ATOM   2230 O OH   . TYR   A 1 29 ? -0.611  -9.264  3.416  1.00 0.73 ?  29 TYR   A OH   4  
ATOM   2231 H H    . TYR   A 1 29 ? -1.833  -3.801  2.920  1.00 0.17 ?  29 TYR   A H    4  
ATOM   2232 H HA   . TYR   A 1 29 ? 0.076   -1.836  3.959  1.00 0.26 ?  29 TYR   A HA   4  
ATOM   2233 H HB2  . TYR   A 1 29 ? 1.128   -3.699  5.141  1.00 0.35 ?  29 TYR   A HB2  4  
ATOM   2234 H HB3  . TYR   A 1 29 ? -0.572  -3.560  5.547  1.00 0.30 ?  29 TYR   A HB3  4  
ATOM   2235 H HD1  . TYR   A 1 29 ? 2.016   -5.682  4.206  1.00 0.55 ?  29 TYR   A HD1  4  
ATOM   2236 H HD2  . TYR   A 1 29 ? -2.193  -5.196  4.557  1.00 0.53 ?  29 TYR   A HD2  4  
ATOM   2237 H HE1  . TYR   A 1 29 ? 1.700   -8.043  3.615  1.00 0.72 ?  29 TYR   A HE1  4  
ATOM   2238 H HE2  . TYR   A 1 29 ? -2.523  -7.555  3.967  1.00 0.69 ?  29 TYR   A HE2  4  
ATOM   2239 H HH   . TYR   A 1 29 ? -1.339  -9.337  2.786  1.00 1.12 ?  29 TYR   A HH   4  
ATOM   2240 N N    . CYS   A 1 30 ? 2.152   -2.555  2.695  1.00 0.22 ?  30 CYS   A N    4  
ATOM   2241 C CA   . CYS   A 1 30 ? 3.261   -2.812  1.791  1.00 0.19 ?  30 CYS   A CA   4  
ATOM   2242 C C    . CYS   A 1 30 ? 3.866   -4.183  2.072  1.00 0.20 ?  30 CYS   A C    4  
ATOM   2243 O O    . CYS   A 1 30 ? 4.241   -4.491  3.205  1.00 0.32 ?  30 CYS   A O    4  
ATOM   2244 C CB   . CYS   A 1 30 ? 4.329   -1.728  1.920  1.00 0.27 ?  30 CYS   A CB   4  
ATOM   2245 S SG   . CYS   A 1 30 ? 3.883   -0.137  1.154  1.00 0.86 ?  30 CYS   A SG   4  
ATOM   2246 H H    . CYS   A 1 30 ? 2.284   -1.959  3.470  1.00 0.27 ?  30 CYS   A H    4  
ATOM   2247 H HA   . CYS   A 1 30 ? 2.872   -2.804  0.783  1.00 0.21 ?  30 CYS   A HA   4  
ATOM   2248 H HB2  . CYS   A 1 30 ? 4.513   -1.545  2.966  1.00 0.76 ?  30 CYS   A HB2  4  
ATOM   2249 H HB3  . CYS   A 1 30 ? 5.238   -2.075  1.453  1.00 0.88 ?  30 CYS   A HB3  4  
ATOM   2250 N N    . ALA   A 1 31 ? 3.959   -4.993  1.036  1.00 0.19 ?  31 ALA   A N    4  
ATOM   2251 C CA   . ALA   A 1 31 ? 4.410   -6.368  1.157  1.00 0.28 ?  31 ALA   A CA   4  
ATOM   2252 C C    . ALA   A 1 31 ? 5.603   -6.632  0.246  1.00 0.22 ?  31 ALA   A C    4  
ATOM   2253 O O    . ALA   A 1 31 ? 5.966   -5.777  -0.563 1.00 0.16 ?  31 ALA   A O    4  
ATOM   2254 C CB   . ALA   A 1 31 ? 3.270   -7.313  0.808  1.00 0.42 ?  31 ALA   A CB   4  
ATOM   2255 H H    . ALA   A 1 31 ? 3.716   -4.652  0.146  1.00 0.20 ?  31 ALA   A H    4  
ATOM   2256 H HA   . ALA   A 1 31 ? 4.696   -6.544  2.183  1.00 0.36 ?  31 ALA   A HA   4  
ATOM   2257 H HB1  . ALA   A 1 31 ? 3.590   -8.334  0.953  1.00 1.01 ?  31 ALA   A HB1  4  
ATOM   2258 H HB2  . ALA   A 1 31 ? 2.990   -7.169  -0.225 1.00 1.08 ?  31 ALA   A HB2  4  
ATOM   2259 H HB3  . ALA   A 1 31 ? 2.422   -7.105  1.442  1.00 1.16 ?  31 ALA   A HB3  4  
ATOM   2260 N N    . LYS   A 1 32 ? 6.203   -7.814  0.395  1.00 0.28 ?  32 LYS   A N    4  
ATOM   2261 C CA   . LYS   A 1 32 ? 7.316   -8.254  -0.450 1.00 0.26 ?  32 LYS   A CA   4  
ATOM   2262 C C    . LYS   A 1 32 ? 8.420   -7.198  -0.500 1.00 0.26 ?  32 LYS   A C    4  
ATOM   2263 O O    . LYS   A 1 32 ? 8.558   -6.473  -1.489 1.00 0.24 ?  32 LYS   A O    4  
ATOM   2264 C CB   . LYS   A 1 32 ? 6.812   -8.579  -1.863 1.00 0.25 ?  32 LYS   A CB   4  
ATOM   2265 C CG   . LYS   A 1 32 ? 7.866   -9.183  -2.784 1.00 1.09 ?  32 LYS   A CG   4  
ATOM   2266 C CD   . LYS   A 1 32 ? 7.279   -9.520  -4.142 1.00 1.62 ?  32 LYS   A CD   4  
ATOM   2267 C CE   . LYS   A 1 32 ? 8.309   -10.147 -5.070 1.00 2.37 ?  32 LYS   A CE   4  
ATOM   2268 N NZ   . LYS   A 1 32 ? 8.842   -11.426 -4.532 1.00 2.43 1  32 LYS   A NZ   4  
ATOM   2269 H H    . LYS   A 1 32 ? 5.892   -8.412  1.107  1.00 0.37 ?  32 LYS   A H    4  
ATOM   2270 H HA   . LYS   A 1 32 ? 7.719   -9.152  -0.007 1.00 0.32 ?  32 LYS   A HA   4  
ATOM   2271 H HB2  . LYS   A 1 32 ? 5.996   -9.279  -1.788 1.00 0.88 ?  32 LYS   A HB2  4  
ATOM   2272 H HB3  . LYS   A 1 32 ? 6.450   -7.668  -2.316 1.00 0.84 ?  32 LYS   A HB3  4  
ATOM   2273 H HG2  . LYS   A 1 32 ? 8.664   -8.470  -2.921 1.00 1.65 ?  32 LYS   A HG2  4  
ATOM   2274 H HG3  . LYS   A 1 32 ? 8.255   -10.083 -2.334 1.00 1.76 ?  32 LYS   A HG3  4  
ATOM   2275 H HD2  . LYS   A 1 32 ? 6.465   -10.215 -4.005 1.00 2.05 ?  32 LYS   A HD2  4  
ATOM   2276 H HD3  . LYS   A 1 32 ? 6.908   -8.614  -4.593 1.00 1.80 ?  32 LYS   A HD3  4  
ATOM   2277 H HE2  . LYS   A 1 32 ? 7.844   -10.337 -6.025 1.00 2.75 ?  32 LYS   A HE2  4  
ATOM   2278 H HE3  . LYS   A 1 32 ? 9.127   -9.453  -5.200 1.00 3.09 ?  32 LYS   A HE3  4  
ATOM   2279 H HZ1  . LYS   A 1 32 ? 8.067   -12.101 -4.370 1.00 2.11 ?  32 LYS   A HZ1  4  
ATOM   2280 H HZ2  . LYS   A 1 32 ? 9.334   -11.261 -3.632 1.00 3.00 ?  32 LYS   A HZ2  4  
ATOM   2281 H HZ3  . LYS   A 1 32 ? 9.513   -11.843 -5.206 1.00 2.96 ?  32 LYS   A HZ3  4  
HETATM 2282 N N    . DPR   A 1 33 ? 9.206   -7.083  0.585  1.00 0.37 ?  33 DPR   A N    4  
HETATM 2283 C CA   . DPR   A 1 33 ? 10.284  -6.089  0.690  1.00 0.44 ?  33 DPR   A CA   4  
HETATM 2284 C CB   . DPR   A 1 33 ? 10.841  -6.293  2.102  1.00 0.59 ?  33 DPR   A CB   4  
HETATM 2285 C CG   . DPR   A 1 33 ? 10.416  -7.662  2.497  1.00 0.61 ?  33 DPR   A CG   4  
HETATM 2286 C CD   . DPR   A 1 33 ? 9.114   -7.922  1.791  1.00 0.47 ?  33 DPR   A CD   4  
HETATM 2287 C C    . DPR   A 1 33 ? 9.767   -4.663  0.525  1.00 0.39 ?  33 DPR   A C    4  
HETATM 2288 O O    . DPR   A 1 33 ? 10.514  -3.756  0.164  1.00 0.47 ?  33 DPR   A O    4  
HETATM 2289 H HA   . DPR   A 1 33 ? 11.064  -6.274  -0.029 1.00 0.48 ?  33 DPR   A HA   4  
HETATM 2290 H HB2  . DPR   A 1 33 ? 10.425  -5.549  2.765  1.00 0.61 ?  33 DPR   A HB2  4  
HETATM 2291 H HB3  . DPR   A 1 33 ? 11.918  -6.205  2.084  1.00 0.67 ?  33 DPR   A HB3  4  
HETATM 2292 H HG2  . DPR   A 1 33 ? 10.278  -7.704  3.566  1.00 0.70 ?  33 DPR   A HG2  4  
HETATM 2293 H HG3  . DPR   A 1 33 ? 11.161  -8.378  2.185  1.00 0.65 ?  33 DPR   A HG3  4  
HETATM 2294 H HD2  . DPR   A 1 33 ? 8.280   -7.621  2.407  1.00 0.49 ?  33 DPR   A HD2  4  
HETATM 2295 H HD3  . DPR   A 1 33 ? 9.032   -8.964  1.527  1.00 0.47 ?  33 DPR   A HD3  4  
ATOM   2296 N N    . GLY   A 1 34 ? 8.478   -4.484  0.784  1.00 0.32 ?  34 GLY   A N    4  
ATOM   2297 C CA   . GLY   A 1 34 ? 7.867   -3.180  0.671  1.00 0.30 ?  34 GLY   A CA   4  
ATOM   2298 C C    . GLY   A 1 34 ? 7.706   -2.735  -0.769 1.00 0.25 ?  34 GLY   A C    4  
ATOM   2299 O O    . GLY   A 1 34 ? 7.686   -1.540  -1.047 1.00 0.30 ?  34 GLY   A O    4  
ATOM   2300 H H    . GLY   A 1 34 ? 7.937   -5.253  1.052  1.00 0.32 ?  34 GLY   A H    4  
ATOM   2301 H HA2  . GLY   A 1 34 ? 6.893   -3.208  1.139  1.00 0.31 ?  34 GLY   A HA2  4  
ATOM   2302 H HA3  . GLY   A 1 34 ? 8.483   -2.464  1.190  1.00 0.36 ?  34 GLY   A HA3  4  
ATOM   2303 N N    . PHE   A 1 35 ? 7.597   -3.690  -1.687 1.00 0.19 ?  35 PHE   A N    4  
ATOM   2304 C CA   . PHE   A 1 35 ? 7.441   -3.367  -3.102 1.00 0.20 ?  35 PHE   A CA   4  
ATOM   2305 C C    . PHE   A 1 35 ? 6.002   -3.557  -3.569 1.00 0.17 ?  35 PHE   A C    4  
ATOM   2306 O O    . PHE   A 1 35 ? 5.510   -2.813  -4.418 1.00 0.29 ?  35 PHE   A O    4  
ATOM   2307 C CB   . PHE   A 1 35 ? 8.368   -4.232  -3.962 1.00 0.23 ?  35 PHE   A CB   4  
ATOM   2308 C CG   . PHE   A 1 35 ? 9.826   -3.893  -3.835 1.00 0.31 ?  35 PHE   A CG   4  
ATOM   2309 C CD1  . PHE   A 1 35 ? 10.688  -4.724  -3.137 1.00 0.40 ?  35 PHE   A CD1  4  
ATOM   2310 C CD2  . PHE   A 1 35 ? 10.336  -2.745  -4.419 1.00 0.37 ?  35 PHE   A CD2  4  
ATOM   2311 C CE1  . PHE   A 1 35 ? 12.032  -4.418  -3.028 1.00 0.49 ?  35 PHE   A CE1  4  
ATOM   2312 C CE2  . PHE   A 1 35 ? 11.679  -2.434  -4.312 1.00 0.46 ?  35 PHE   A CE2  4  
ATOM   2313 C CZ   . PHE   A 1 35 ? 12.527  -3.271  -3.615 1.00 0.51 ?  35 PHE   A CZ   4  
ATOM   2314 H H    . PHE   A 1 35 ? 7.633   -4.636  -1.407 1.00 0.19 ?  35 PHE   A H    4  
ATOM   2315 H HA   . PHE   A 1 35 ? 7.712   -2.332  -3.233 1.00 0.24 ?  35 PHE   A HA   4  
ATOM   2316 H HB2  . PHE   A 1 35 ? 8.245   -5.266  -3.676 1.00 0.24 ?  35 PHE   A HB2  4  
ATOM   2317 H HB3  . PHE   A 1 35 ? 8.088   -4.117  -4.998 1.00 0.27 ?  35 PHE   A HB3  4  
ATOM   2318 H HD1  . PHE   A 1 35 ? 10.302  -5.621  -2.679 1.00 0.45 ?  35 PHE   A HD1  4  
ATOM   2319 H HD2  . PHE   A 1 35 ? 9.672   -2.087  -4.964 1.00 0.40 ?  35 PHE   A HD2  4  
ATOM   2320 H HE1  . PHE   A 1 35 ? 12.694  -5.075  -2.482 1.00 0.59 ?  35 PHE   A HE1  4  
ATOM   2321 H HE2  . PHE   A 1 35 ? 12.063  -1.534  -4.769 1.00 0.54 ?  35 PHE   A HE2  4  
ATOM   2322 H HZ   . PHE   A 1 35 ? 13.576  -3.031  -3.530 1.00 0.60 ?  35 PHE   A HZ   4  
ATOM   2323 N N    . VAL   A 1 36 ? 5.326   -4.547  -3.013 1.00 0.12 ?  36 VAL   A N    4  
ATOM   2324 C CA   . VAL   A 1 36 ? 3.996   -4.901  -3.471 1.00 0.17 ?  36 VAL   A CA   4  
ATOM   2325 C C    . VAL   A 1 36 ? 2.929   -4.348  -2.542 1.00 0.15 ?  36 VAL   A C    4  
ATOM   2326 O O    . VAL   A 1 36 ? 2.887   -4.680  -1.365 1.00 0.17 ?  36 VAL   A O    4  
ATOM   2327 C CB   . VAL   A 1 36 ? 3.837   -6.429  -3.580 1.00 0.23 ?  36 VAL   A CB   4  
ATOM   2328 C CG1  . VAL   A 1 36 ? 2.402   -6.803  -3.922 1.00 0.32 ?  36 VAL   A CG1  4  
ATOM   2329 C CG2  . VAL   A 1 36 ? 4.790   -6.990  -4.623 1.00 0.25 ?  36 VAL   A CG2  4  
ATOM   2330 H H    . VAL   A 1 36 ? 5.722   -5.044  -2.266 1.00 0.17 ?  36 VAL   A H    4  
ATOM   2331 H HA   . VAL   A 1 36 ? 3.860   -4.476  -4.452 1.00 0.20 ?  36 VAL   A HA   4  
ATOM   2332 H HB   . VAL   A 1 36 ? 4.086   -6.867  -2.623 1.00 0.24 ?  36 VAL   A HB   4  
ATOM   2333 H HG11 . VAL   A 1 36 ? 1.737   -6.402  -3.170 1.00 1.12 ?  36 VAL   A HG11 4  
ATOM   2334 H HG12 . VAL   A 1 36 ? 2.306   -7.878  -3.949 1.00 1.04 ?  36 VAL   A HG12 4  
ATOM   2335 H HG13 . VAL   A 1 36 ? 2.144   -6.393  -4.886 1.00 1.00 ?  36 VAL   A HG13 4  
ATOM   2336 H HG21 . VAL   A 1 36 ? 4.522   -6.605  -5.596 1.00 1.04 ?  36 VAL   A HG21 4  
ATOM   2337 H HG22 . VAL   A 1 36 ? 4.724   -8.067  -4.629 1.00 0.94 ?  36 VAL   A HG22 4  
ATOM   2338 H HG23 . VAL   A 1 36 ? 5.801   -6.690  -4.385 1.00 1.08 ?  36 VAL   A HG23 4  
ATOM   2339 N N    . CYS   A 1 37 ? 2.070   -3.509  -3.076 1.00 0.15 ?  37 CYS   A N    4  
ATOM   2340 C CA   . CYS   A 1 37 ? 0.968   -2.961  -2.305 1.00 0.14 ?  37 CYS   A CA   4  
ATOM   2341 C C    . CYS   A 1 37 ? -0.148  -3.998  -2.224 1.00 0.12 ?  37 CYS   A C    4  
ATOM   2342 O O    . CYS   A 1 37 ? -0.724  -4.382  -3.245 1.00 0.18 ?  37 CYS   A O    4  
ATOM   2343 C CB   . CYS   A 1 37 ? 0.472   -1.668  -2.964 1.00 0.16 ?  37 CYS   A CB   4  
ATOM   2344 S SG   . CYS   A 1 37 ? -0.922  -0.852  -2.119 1.00 0.14 ?  37 CYS   A SG   4  
ATOM   2345 H H    . CYS   A 1 37 ? 2.167   -3.262  -4.020 1.00 0.16 ?  37 CYS   A H    4  
ATOM   2346 H HA   . CYS   A 1 37 ? 1.326   -2.745  -1.309 1.00 0.14 ?  37 CYS   A HA   4  
ATOM   2347 H HB2  . CYS   A 1 37 ? 1.287   -0.959  -2.999 1.00 0.20 ?  37 CYS   A HB2  4  
ATOM   2348 H HB3  . CYS   A 1 37 ? 0.157   -1.893  -3.973 1.00 0.18 ?  37 CYS   A HB3  4  
ATOM   2349 N N    . LYS   A 1 38 ? -0.432  -4.487  -1.022 1.00 0.10 ?  38 LYS   A N    4  
ATOM   2350 C CA   . LYS   A 1 38 ? -1.432  -5.530  -0.859 1.00 0.11 ?  38 LYS   A CA   4  
ATOM   2351 C C    . LYS   A 1 38 ? -2.627  -5.026  -0.066 1.00 0.11 ?  38 LYS   A C    4  
ATOM   2352 O O    . LYS   A 1 38 ? -2.523  -4.726  1.125  1.00 0.12 ?  38 LYS   A O    4  
ATOM   2353 C CB   . LYS   A 1 38 ? -0.836  -6.760  -0.174 1.00 0.15 ?  38 LYS   A CB   4  
ATOM   2354 C CG   . LYS   A 1 38 ? -1.803  -7.932  -0.133 1.00 0.26 ?  38 LYS   A CG   4  
ATOM   2355 C CD   . LYS   A 1 38 ? -1.202  -9.157  0.536  1.00 0.70 ?  38 LYS   A CD   4  
ATOM   2356 C CE   . LYS   A 1 38 ? -0.070  -9.757  -0.282 1.00 1.19 ?  38 LYS   A CE   4  
ATOM   2357 N NZ   . LYS   A 1 38 ? 0.496   -10.967 0.367  1.00 2.16 1  38 LYS   A NZ   4  
ATOM   2358 H H    . LYS   A 1 38 ? 0.030   -4.129  -0.227 1.00 0.13 ?  38 LYS   A H    4  
ATOM   2359 H HA   . LYS   A 1 38 ? -1.772  -5.812  -1.844 1.00 0.12 ?  38 LYS   A HA   4  
ATOM   2360 H HB2  . LYS   A 1 38 ? 0.054   -7.063  -0.705 1.00 0.14 ?  38 LYS   A HB2  4  
ATOM   2361 H HB3  . LYS   A 1 38 ? -0.573  -6.503  0.842  1.00 0.19 ?  38 LYS   A HB3  4  
ATOM   2362 H HG2  . LYS   A 1 38 ? -2.676  -7.631  0.414  1.00 0.63 ?  38 LYS   A HG2  4  
ATOM   2363 H HG3  . LYS   A 1 38 ? -2.084  -8.188  -1.141 1.00 0.69 ?  38 LYS   A HG3  4  
ATOM   2364 H HD2  . LYS   A 1 38 ? -0.819  -8.874  1.505  1.00 1.20 ?  38 LYS   A HD2  4  
ATOM   2365 H HD3  . LYS   A 1 38 ? -1.977  -9.900  0.660  1.00 1.36 ?  38 LYS   A HD3  4  
ATOM   2366 H HE2  . LYS   A 1 38 ? -0.449  -10.027 -1.256 1.00 1.63 ?  38 LYS   A HE2  4  
ATOM   2367 H HE3  . LYS   A 1 38 ? 0.711   -9.022  -0.393 1.00 1.57 ?  38 LYS   A HE3  4  
ATOM   2368 H HZ1  . LYS   A 1 38 ? 1.254   -11.368 -0.220 1.00 2.60 ?  38 LYS   A HZ1  4  
ATOM   2369 H HZ2  . LYS   A 1 38 ? -0.244  -11.686 0.492  1.00 2.57 ?  38 LYS   A HZ2  4  
ATOM   2370 H HZ3  . LYS   A 1 38 ? 0.887   -10.726 1.302  1.00 2.71 ?  38 LYS   A HZ3  4  
ATOM   2371 N N    . CYS   A 1 39 ? -3.764  -4.961  -0.735 1.00 0.12 ?  39 CYS   A N    4  
ATOM   2372 C CA   . CYS   A 1 39 ? -4.985  -4.475  -0.126 1.00 0.12 ?  39 CYS   A CA   4  
ATOM   2373 C C    . CYS   A 1 39 ? -5.680  -5.587  0.648  1.00 0.15 ?  39 CYS   A C    4  
ATOM   2374 O O    . CYS   A 1 39 ? -5.479  -6.774  0.375  1.00 0.19 ?  39 CYS   A O    4  
ATOM   2375 C CB   . CYS   A 1 39 ? -5.927  -3.932  -1.198 1.00 0.13 ?  39 CYS   A CB   4  
ATOM   2376 S SG   . CYS   A 1 39 ? -5.180  -2.688  -2.302 1.00 0.14 ?  39 CYS   A SG   4  
ATOM   2377 H H    . CYS   A 1 39 ? -3.785  -5.257  -1.669 1.00 0.16 ?  39 CYS   A H    4  
ATOM   2378 H HA   . CYS   A 1 39 ? -4.728  -3.682  0.555  1.00 0.11 ?  39 CYS   A HA   4  
ATOM   2379 H HB2  . CYS   A 1 39 ? -6.266  -4.751  -1.811 1.00 0.15 ?  39 CYS   A HB2  4  
ATOM   2380 H HB3  . CYS   A 1 39 ? -6.779  -3.474  -0.716 1.00 0.15 ?  39 CYS   A HB3  4  
ATOM   2381 N N    . TYR   A 1 40 ? -6.485  -5.194  1.619  1.00 0.18 ?  40 TYR   A N    4  
ATOM   2382 C CA   . TYR   A 1 40 ? -7.266  -6.133  2.404  1.00 0.25 ?  40 TYR   A CA   4  
ATOM   2383 C C    . TYR   A 1 40 ? -8.613  -5.515  2.754  1.00 0.32 ?  40 TYR   A C    4  
ATOM   2384 O O    . TYR   A 1 40 ? -8.696  -4.336  3.095  1.00 0.88 ?  40 TYR   A O    4  
ATOM   2385 C CB   . TYR   A 1 40 ? -6.508  -6.551  3.673  1.00 0.27 ?  40 TYR   A CB   4  
ATOM   2386 C CG   . TYR   A 1 40 ? -6.094  -5.399  4.562  1.00 0.25 ?  40 TYR   A CG   4  
ATOM   2387 C CD1  . TYR   A 1 40 ? -4.852  -4.796  4.417  1.00 0.22 ?  40 TYR   A CD1  4  
ATOM   2388 C CD2  . TYR   A 1 40 ? -6.947  -4.914  5.544  1.00 0.32 ?  40 TYR   A CD2  4  
ATOM   2389 C CE1  . TYR   A 1 40 ? -4.469  -3.745  5.226  1.00 0.25 ?  40 TYR   A CE1  4  
ATOM   2390 C CE2  . TYR   A 1 40 ? -6.572  -3.861  6.356  1.00 0.35 ?  40 TYR   A CE2  4  
ATOM   2391 C CZ   . TYR   A 1 40 ? -5.335  -3.284  6.199  1.00 0.31 ?  40 TYR   A CZ   4  
ATOM   2392 O OH   . TYR   A 1 40 ? -4.951  -2.242  7.009  1.00 0.37 ?  40 TYR   A OH   4  
ATOM   2393 H H    . TYR   A 1 40 ? -6.551  -4.234  1.821  1.00 0.18 ?  40 TYR   A H    4  
ATOM   2394 H HA   . TYR   A 1 40 ? -7.436  -7.008  1.793  1.00 0.31 ?  40 TYR   A HA   4  
ATOM   2395 H HB2  . TYR   A 1 40 ? -7.137  -7.205  4.257  1.00 0.32 ?  40 TYR   A HB2  4  
ATOM   2396 H HB3  . TYR   A 1 40 ? -5.614  -7.085  3.385  1.00 0.28 ?  40 TYR   A HB3  4  
ATOM   2397 H HD1  . TYR   A 1 40 ? -4.176  -5.166  3.660  1.00 0.22 ?  40 TYR   A HD1  4  
ATOM   2398 H HD2  . TYR   A 1 40 ? -7.916  -5.374  5.671  1.00 0.36 ?  40 TYR   A HD2  4  
ATOM   2399 H HE1  . TYR   A 1 40 ? -3.499  -3.291  5.098  1.00 0.26 ?  40 TYR   A HE1  4  
ATOM   2400 H HE2  . TYR   A 1 40 ? -7.250  -3.499  7.113  1.00 0.41 ?  40 TYR   A HE2  4  
ATOM   2401 H HH   . TYR   A 1 40 ? -4.643  -1.507  6.464  1.00 1.13 ?  40 TYR   A HH   4  
HETATM 2402 N N    . NH2   A 1 41 ? -9.671  -6.293  2.638  1.00 0.59 ?  41 NH2   A N    4  
HETATM 2403 H HN1  . NH2   A 1 41 ? -9.534  -7.225  2.359  1.00 1.06 ?  41 NH2   A HN1  4  
HETATM 2404 H HN2  . NH2   A 1 41 ? -10.552 -5.913  2.844  1.00 0.56 ?  41 NH2   A HN2  4  
ATOM   2405 N N    . GLY   A 1 1  ? 5.458   1.361   -7.344 1.00 1.74 ?  1  GLY   A N    5  
ATOM   2406 C CA   . GLY   A 1 1  ? 4.359   0.808   -6.518 1.00 0.89 ?  1  GLY   A CA   5  
ATOM   2407 C C    . GLY   A 1 1  ? 3.536   1.895   -5.863 1.00 0.90 ?  1  GLY   A C    5  
ATOM   2408 O O    . GLY   A 1 1  ? 3.923   3.064   -5.871 1.00 1.76 ?  1  GLY   A O    5  
ATOM   2409 H H1   . GLY   A 1 1  ? 5.069   1.961   -8.097 1.00 2.34 ?  1  GLY   A H1   5  
ATOM   2410 H H2   . GLY   A 1 1  ? 6.005   0.591   -7.776 1.00 1.93 ?  1  GLY   A H2   5  
ATOM   2411 H H3   . GLY   A 1 1  ? 6.095   1.935   -6.752 1.00 2.29 ?  1  GLY   A H3   5  
ATOM   2412 H HA2  . GLY   A 1 1  ? 3.713   0.213   -7.145 1.00 0.93 ?  1  GLY   A HA2  5  
ATOM   2413 H HA3  . GLY   A 1 1  ? 4.781   0.176   -5.749 1.00 1.19 ?  1  GLY   A HA3  5  
ATOM   2414 N N    . PHE   A 1 2  ? 2.408   1.510   -5.286 1.00 0.43 ?  2  PHE   A N    5  
ATOM   2415 C CA   . PHE   A 1 2  ? 1.502   2.457   -4.648 1.00 0.24 ?  2  PHE   A CA   5  
ATOM   2416 C C    . PHE   A 1 2  ? 1.962   2.760   -3.230 1.00 0.22 ?  2  PHE   A C    5  
ATOM   2417 O O    . PHE   A 1 2  ? 1.347   2.336   -2.258 1.00 0.35 ?  2  PHE   A O    5  
ATOM   2418 C CB   . PHE   A 1 2  ? 0.072   1.910   -4.641 1.00 0.16 ?  2  PHE   A CB   5  
ATOM   2419 C CG   . PHE   A 1 2  ? -0.468  1.673   -6.020 1.00 0.18 ?  2  PHE   A CG   5  
ATOM   2420 C CD1  . PHE   A 1 2  ? -0.572  0.387   -6.516 1.00 0.25 ?  2  PHE   A CD1  5  
ATOM   2421 C CD2  . PHE   A 1 2  ? -0.879  2.732   -6.815 1.00 0.22 ?  2  PHE   A CD2  5  
ATOM   2422 C CE1  . PHE   A 1 2  ? -1.075  0.157   -7.781 1.00 0.30 ?  2  PHE   A CE1  5  
ATOM   2423 C CE2  . PHE   A 1 2  ? -1.381  2.509   -8.083 1.00 0.28 ?  2  PHE   A CE2  5  
ATOM   2424 C CZ   . PHE   A 1 2  ? -1.457  1.250   -8.580 1.00 0.29 ?  2  PHE   A CZ   5  
ATOM   2425 H H    . PHE   A 1 2  ? 2.179   0.557   -5.283 1.00 1.00 ?  2  PHE   A H    5  
ATOM   2426 H HA   . PHE   A 1 2  ? 1.524   3.369   -5.226 1.00 0.34 ?  2  PHE   A HA   5  
ATOM   2427 H HB2  . PHE   A 1 2  ? 0.049   0.973   -4.105 1.00 0.26 ?  2  PHE   A HB2  5  
ATOM   2428 H HB3  . PHE   A 1 2  ? -0.577  2.618   -4.145 1.00 0.20 ?  2  PHE   A HB3  5  
ATOM   2429 H HD1  . PHE   A 1 2  ? -0.254  -0.443  -5.902 1.00 0.32 ?  2  PHE   A HD1  5  
ATOM   2430 H HD2  . PHE   A 1 2  ? -0.801  3.740   -6.438 1.00 0.27 ?  2  PHE   A HD2  5  
ATOM   2431 H HE1  . PHE   A 1 2  ? -1.150  -0.852  -8.157 1.00 0.37 ?  2  PHE   A HE1  5  
ATOM   2432 H HE2  . PHE   A 1 2  ? -1.696  3.342   -8.693 1.00 0.36 ?  2  PHE   A HE2  5  
ATOM   2433 H HZ   . PHE   A 1 2  ? -1.841  1.088   -9.576 1.00 0.34 ?  2  PHE   A HZ   5  
ATOM   2434 N N    . GLY   A 1 3  ? 3.065   3.479   -3.126 1.00 0.18 ?  3  GLY   A N    5  
ATOM   2435 C CA   . GLY   A 1 3  ? 3.632   3.798   -1.832 1.00 0.20 ?  3  GLY   A CA   5  
ATOM   2436 C C    . GLY   A 1 3  ? 4.705   2.813   -1.453 1.00 0.19 ?  3  GLY   A C    5  
ATOM   2437 O O    . GLY   A 1 3  ? 5.712   3.170   -0.848 1.00 0.21 ?  3  GLY   A O    5  
ATOM   2438 H H    . GLY   A 1 3  ? 3.512   3.786   -3.943 1.00 0.21 ?  3  GLY   A H    5  
ATOM   2439 H HA2  . GLY   A 1 3  ? 4.057   4.789   -1.867 1.00 0.23 ?  3  GLY   A HA2  5  
ATOM   2440 H HA3  . GLY   A 1 3  ? 2.850   3.768   -1.088 1.00 0.24 ?  3  GLY   A HA3  5  
ATOM   2441 N N    . CYS   A 1 4  ? 4.478   1.568   -1.815 1.00 0.25 ?  4  CYS   A N    5  
ATOM   2442 C CA   . CYS   A 1 4  ? 5.455   0.518   -1.621 1.00 0.27 ?  4  CYS   A CA   5  
ATOM   2443 C C    . CYS   A 1 4  ? 6.478   0.573   -2.747 1.00 0.29 ?  4  CYS   A C    5  
ATOM   2444 O O    . CYS   A 1 4  ? 6.270   0.013   -3.824 1.00 0.30 ?  4  CYS   A O    5  
ATOM   2445 C CB   . CYS   A 1 4  ? 4.749   -0.833  -1.598 1.00 0.28 ?  4  CYS   A CB   5  
ATOM   2446 S SG   . CYS   A 1 4  ? 3.229   -0.843  -0.592 1.00 0.39 ?  4  CYS   A SG   5  
ATOM   2447 H H    . CYS   A 1 4  ? 3.616   1.343   -2.219 1.00 0.30 ?  4  CYS   A H    5  
ATOM   2448 H HA   . CYS   A 1 4  ? 5.952   0.685   -0.677 1.00 0.30 ?  4  CYS   A HA   5  
ATOM   2449 H HB2  . CYS   A 1 4  ? 4.478   -1.106  -2.607 1.00 0.21 ?  4  CYS   A HB2  5  
ATOM   2450 H HB3  . CYS   A 1 4  ? 5.419   -1.578  -1.194 1.00 0.42 ?  4  CYS   A HB3  5  
ATOM   2451 N N    . ASN   A 1 5  ? 7.567   1.278   -2.505 1.00 0.34 ?  5  ASN   A N    5  
ATOM   2452 C CA   . ASN   A 1 5  ? 8.567   1.512   -3.534 1.00 0.40 ?  5  ASN   A CA   5  
ATOM   2453 C C    . ASN   A 1 5  ? 9.937   1.000   -3.103 1.00 0.40 ?  5  ASN   A C    5  
ATOM   2454 O O    . ASN   A 1 5  ? 10.969  1.534   -3.514 1.00 0.47 ?  5  ASN   A O    5  
ATOM   2455 C CB   . ASN   A 1 5  ? 8.638   3.006   -3.849 1.00 0.49 ?  5  ASN   A CB   5  
ATOM   2456 C CG   . ASN   A 1 5  ? 7.400   3.522   -4.559 1.00 0.49 ?  5  ASN   A CG   5  
ATOM   2457 O OD1  . ASN   A 1 5  ? 6.809   2.829   -5.389 1.00 0.65 ?  5  ASN   A OD1  5  
ATOM   2458 N ND2  . ASN   A 1 5  ? 6.981   4.736   -4.222 1.00 0.56 ?  5  ASN   A ND2  5  
ATOM   2459 H H    . ASN   A 1 5  ? 7.703   1.663   -1.608 1.00 0.36 ?  5  ASN   A H    5  
ATOM   2460 H HA   . ASN   A 1 5  ? 8.260   0.980   -4.420 1.00 0.43 ?  5  ASN   A HA   5  
ATOM   2461 H HB2  . ASN   A 1 5  ? 8.746   3.549   -2.924 1.00 0.51 ?  5  ASN   A HB2  5  
ATOM   2462 H HB3  . ASN   A 1 5  ? 9.497   3.195   -4.474 1.00 0.57 ?  5  ASN   A HB3  5  
ATOM   2463 H HD21 . ASN   A 1 5  ? 7.484   5.231   -3.539 1.00 0.70 ?  5  ASN   A HD21 5  
ATOM   2464 H HD22 . ASN   A 1 5  ? 6.186   5.091   -4.666 1.00 0.61 ?  5  ASN   A HD22 5  
ATOM   2465 N N    . GLY   A 1 6  ? 9.944   -0.026  -2.270 1.00 0.36 ?  6  GLY   A N    5  
ATOM   2466 C CA   . GLY   A 1 6  ? 11.191  -0.625  -1.846 1.00 0.38 ?  6  GLY   A CA   5  
ATOM   2467 C C    . GLY   A 1 6  ? 11.378  -0.568  -0.348 1.00 0.37 ?  6  GLY   A C    5  
ATOM   2468 O O    . GLY   A 1 6  ? 10.594  0.070   0.347  1.00 0.36 ?  6  GLY   A O    5  
ATOM   2469 H H    . GLY   A 1 6  ? 9.092   -0.381  -1.930 1.00 0.34 ?  6  GLY   A H    5  
ATOM   2470 H HA2  . GLY   A 1 6  ? 11.205  -1.658  -2.160 1.00 0.48 ?  6  GLY   A HA2  5  
ATOM   2471 H HA3  . GLY   A 1 6  ? 12.007  -0.103  -2.321 1.00 0.44 ?  6  GLY   A HA3  5  
HETATM 2472 C C2   . 6ZS   A 1 7  ? 14.304  -3.087  0.763  1.00 1.49 ?  7  6ZS   A C2   5  
HETATM 2473 N N    . 6ZS   A 1 7  ? 12.436  -1.217  0.137  1.00 0.47 ?  7  6ZS   A N    5  
HETATM 2474 C CA   . 6ZS   A 1 7  ? 12.713  -1.327  1.579  1.00 0.61 ?  7  6ZS   A CA   5  
HETATM 2475 C CB1  . 6ZS   A 1 7  ? 11.643  -2.165  2.253  1.00 0.71 ?  7  6ZS   A CB1  5  
HETATM 2476 C C    . 6ZS   A 1 7  ? 12.769  0.068   2.209  1.00 0.59 ?  7  6ZS   A C    5  
HETATM 2477 O O    . 6ZS   A 1 7  ? 12.182  0.319   3.264  1.00 1.09 ?  7  6ZS   A O    5  
HETATM 2478 C CB   . 6ZS   A 1 7  ? 14.051  -2.017  1.809  1.00 0.75 ?  7  6ZS   A CB   5  
HETATM 2479 H H1   . 6ZS   A 1 7  ? 15.210  -3.621  1.009  1.00 2.14 ?  7  6ZS   A H1   5  
HETATM 2480 H H4   . 6ZS   A 1 7  ? 13.475  -3.778  0.740  1.00 1.94 ?  7  6ZS   A H4   5  
HETATM 2481 H H3   . 6ZS   A 1 7  ? 14.416  -2.624  -0.206 1.00 2.00 ?  7  6ZS   A H3   5  
HETATM 2482 H H    . 6ZS   A 1 7  ? 13.056  -1.636  -0.494 1.00 0.49 ?  7  6ZS   A H    5  
HETATM 2483 H H7   . 6ZS   A 1 7  ? 10.695  -1.652  2.191  1.00 1.10 ?  7  6ZS   A H7   5  
HETATM 2484 H H8   . 6ZS   A 1 7  ? 11.902  -2.316  3.290  1.00 1.35 ?  7  6ZS   A H8   5  
HETATM 2485 H H9   . 6ZS   A 1 7  ? 11.566  -3.121  1.758  1.00 1.26 ?  7  6ZS   A H9   5  
HETATM 2486 H H10  . 6ZS   A 1 7  ? 14.849  -1.290  1.747  1.00 1.09 ?  7  6ZS   A H10  5  
HETATM 2487 H H11  . 6ZS   A 1 7  ? 14.057  -2.483  2.782  1.00 1.38 ?  7  6ZS   A H11  5  
ATOM   2488 N N    . TRP   A 1 8  ? 13.478  0.967   1.549  1.00 0.64 ?  8  TRP   A N    5  
ATOM   2489 C CA   . TRP   A 1 8  ? 13.701  2.305   2.074  1.00 0.67 ?  8  TRP   A CA   5  
ATOM   2490 C C    . TRP   A 1 8  ? 12.596  3.256   1.636  1.00 0.49 ?  8  TRP   A C    5  
ATOM   2491 O O    . TRP   A 1 8  ? 12.484  4.374   2.140  1.00 0.58 ?  8  TRP   A O    5  
ATOM   2492 C CB   . TRP   A 1 8  ? 15.058  2.825   1.602  1.00 0.87 ?  8  TRP   A CB   5  
ATOM   2493 C CG   . TRP   A 1 8  ? 16.182  1.901   1.947  1.00 1.12 ?  8  TRP   A CG   5  
ATOM   2494 C CD1  . TRP   A 1 8  ? 16.775  0.995   1.119  1.00 1.27 ?  8  TRP   A CD1  5  
ATOM   2495 C CD2  . TRP   A 1 8  ? 16.834  1.779   3.212  1.00 1.31 ?  8  TRP   A CD2  5  
ATOM   2496 N NE1  . TRP   A 1 8  ? 17.766  0.322   1.789  1.00 1.50 ?  8  TRP   A NE1  5  
ATOM   2497 C CE2  . TRP   A 1 8  ? 17.821  0.785   3.078  1.00 1.52 ?  8  TRP   A CE2  5  
ATOM   2498 C CE3  . TRP   A 1 8  ? 16.682  2.417   4.446  1.00 1.37 ?  8  TRP   A CE3  5  
ATOM   2499 C CZ2  . TRP   A 1 8  ? 18.650  0.416   4.134  1.00 1.76 ?  8  TRP   A CZ2  5  
ATOM   2500 C CZ3  . TRP   A 1 8  ? 17.505  2.047   5.491  1.00 1.63 ?  8  TRP   A CZ3  5  
ATOM   2501 C CH2  . TRP   A 1 8  ? 18.479  1.055   5.328  1.00 1.80 ?  8  TRP   A CH2  5  
ATOM   2502 H H    . TRP   A 1 8  ? 13.866  0.725   0.684  1.00 1.04 ?  8  TRP   A H    5  
ATOM   2503 H HA   . TRP   A 1 8  ? 13.704  2.242   3.149  1.00 0.76 ?  8  TRP   A HA   5  
ATOM   2504 H HB2  . TRP   A 1 8  ? 15.039  2.944   0.531  1.00 0.85 ?  8  TRP   A HB2  5  
ATOM   2505 H HB3  . TRP   A 1 8  ? 15.252  3.778   2.063  1.00 0.91 ?  8  TRP   A HB3  5  
ATOM   2506 H HD1  . TRP   A 1 8  ? 16.498  0.844   0.088  1.00 1.25 ?  8  TRP   A HD1  5  
ATOM   2507 H HE1  . TRP   A 1 8  ? 18.339  -0.377  1.406  1.00 1.65 ?  8  TRP   A HE1  5  
ATOM   2508 H HE3  . TRP   A 1 8  ? 15.937  3.183   4.590  1.00 1.26 ?  8  TRP   A HE3  5  
ATOM   2509 H HZ2  . TRP   A 1 8  ? 19.407  -0.345  4.028  1.00 1.93 ?  8  TRP   A HZ2  5  
ATOM   2510 H HZ3  . TRP   A 1 8  ? 17.400  2.527   6.452  1.00 1.73 ?  8  TRP   A HZ3  5  
ATOM   2511 H HH2  . TRP   A 1 8  ? 19.100  0.797   6.170  1.00 2.00 ?  8  TRP   A HH2  5  
ATOM   2512 N N    . ASN   A 1 9  ? 11.776  2.804   0.703  1.00 0.33 ?  9  ASN   A N    5  
ATOM   2513 C CA   . ASN   A 1 9  ? 10.698  3.626   0.169  1.00 0.29 ?  9  ASN   A CA   5  
ATOM   2514 C C    . ASN   A 1 9  ? 9.366   2.933   0.407  1.00 0.25 ?  9  ASN   A C    5  
ATOM   2515 O O    . ASN   A 1 9  ? 8.469   2.964   -0.434 1.00 0.36 ?  9  ASN   A O    5  
ATOM   2516 C CB   . ASN   A 1 9  ? 10.885  3.891   -1.332 1.00 0.46 ?  9  ASN   A CB   5  
ATOM   2517 C CG   . ASN   A 1 9  ? 12.097  4.749   -1.664 1.00 1.31 ?  9  ASN   A CG   5  
ATOM   2518 O OD1  . ASN   A 1 9  ? 13.134  4.684   -1.003 1.00 2.05 ?  9  ASN   A OD1  5  
ATOM   2519 N ND2  . ASN   A 1 9  ? 11.974  5.568   -2.698 1.00 1.88 ?  9  ASN   A ND2  5  
ATOM   2520 H H    . ASN   A 1 9  ? 11.880  1.882   0.378  1.00 0.35 ?  9  ASN   A H    5  
ATOM   2521 H HA   . ASN   A 1 9  ? 10.703  4.564   0.700  1.00 0.37 ?  9  ASN   A HA   5  
ATOM   2522 H HB2  . ASN   A 1 9  ? 10.996  2.946   -1.840 1.00 1.10 ?  9  ASN   A HB2  5  
ATOM   2523 H HB3  . ASN   A 1 9  ? 10.005  4.389   -1.710 1.00 0.63 ?  9  ASN   A HB3  5  
ATOM   2524 H HD21 . ASN   A 1 9  ? 11.123  5.579   -3.185 1.00 2.03 ?  9  ASN   A HD21 5  
ATOM   2525 H HD22 . ASN   A 1 9  ? 12.739  6.133   -2.935 1.00 2.48 ?  9  ASN   A HD22 5  
ATOM   2526 N N    . GLU   A 1 10 ? 9.257   2.298   1.558  1.00 0.23 ?  10 GLU   A N    5  
ATOM   2527 C CA   . GLU   A 1 10 ? 8.072   1.536   1.912  1.00 0.26 ?  10 GLU   A CA   5  
ATOM   2528 C C    . GLU   A 1 10 ? 7.097   2.414   2.683  1.00 0.28 ?  10 GLU   A C    5  
ATOM   2529 O O    . GLU   A 1 10 ? 7.240   2.604   3.892  1.00 0.49 ?  10 GLU   A O    5  
ATOM   2530 C CB   . GLU   A 1 10 ? 8.481   0.322   2.753  1.00 0.39 ?  10 GLU   A CB   5  
ATOM   2531 C CG   . GLU   A 1 10 ? 7.336   -0.610  3.093  1.00 0.45 ?  10 GLU   A CG   5  
ATOM   2532 C CD   . GLU   A 1 10 ? 7.744   -1.702  4.061  1.00 0.68 ?  10 GLU   A CD   5  
ATOM   2533 O OE1  . GLU   A 1 10 ? 8.076   -1.375  5.223  1.00 0.95 ?  10 GLU   A OE1  5  
ATOM   2534 O OE2  . GLU   A 1 10 ? 7.728   -2.890  3.674  1.00 0.78 -1 10 GLU   A OE2  5  
ATOM   2535 H H    . GLU   A 1 10 ? 9.998   2.341   2.193  1.00 0.28 ?  10 GLU   A H    5  
ATOM   2536 H HA   . GLU   A 1 10 ? 7.602   1.201   1.001  1.00 0.27 ?  10 GLU   A HA   5  
ATOM   2537 H HB2  . GLU   A 1 10 ? 9.221   -0.242  2.207  1.00 0.43 ?  10 GLU   A HB2  5  
ATOM   2538 H HB3  . GLU   A 1 10 ? 8.917   0.671   3.677  1.00 0.48 ?  10 GLU   A HB3  5  
ATOM   2539 H HG2  . GLU   A 1 10 ? 6.540   -0.034  3.533  1.00 0.47 ?  10 GLU   A HG2  5  
ATOM   2540 H HG3  . GLU   A 1 10 ? 6.985   -1.069  2.184  1.00 0.40 ?  10 GLU   A HG3  5  
ATOM   2541 N N    . ASP   A 1 11 ? 6.119   2.971   1.986  1.00 0.23 ?  11 ASP   A N    5  
ATOM   2542 C CA   . ASP   A 1 11 ? 5.155   3.845   2.630  1.00 0.30 ?  11 ASP   A CA   5  
ATOM   2543 C C    . ASP   A 1 11 ? 3.766   3.219   2.665  1.00 0.23 ?  11 ASP   A C    5  
ATOM   2544 O O    . ASP   A 1 11 ? 2.947   3.403   1.751  1.00 0.20 ?  11 ASP   A O    5  
ATOM   2545 C CB   . ASP   A 1 11 ? 5.105   5.205   1.943  1.00 0.38 ?  11 ASP   A CB   5  
ATOM   2546 C CG   . ASP   A 1 11 ? 4.221   6.172   2.696  1.00 0.99 ?  11 ASP   A CG   5  
ATOM   2547 O OD1  . ASP   A 1 11 ? 3.183   6.585   2.145  1.00 1.86 ?  11 ASP   A OD1  5  
ATOM   2548 O OD2  . ASP   A 1 11 ? 4.556   6.511   3.852  1.00 1.32 -1 11 ASP   A OD2  5  
ATOM   2549 H H    . ASP   A 1 11 ? 6.048   2.797   1.021  1.00 0.30 ?  11 ASP   A H    5  
ATOM   2550 H HA   . ASP   A 1 11 ? 5.484   3.989   3.648  1.00 0.38 ?  11 ASP   A HA   5  
ATOM   2551 H HB2  . ASP   A 1 11 ? 6.103   5.616   1.890  1.00 0.94 ?  11 ASP   A HB2  5  
ATOM   2552 H HB3  . ASP   A 1 11 ? 4.712   5.085   0.944  1.00 0.78 ?  11 ASP   A HB3  5  
ATOM   2553 N N    . ASP   A 1 12 ? 3.514   2.480   3.737  1.00 0.25 ?  12 ASP   A N    5  
ATOM   2554 C CA   . ASP   A 1 12 ? 2.216   1.857   3.982  1.00 0.26 ?  12 ASP   A CA   5  
ATOM   2555 C C    . ASP   A 1 12 ? 1.085   2.874   3.922  1.00 0.18 ?  12 ASP   A C    5  
ATOM   2556 O O    . ASP   A 1 12 ? -0.031  2.543   3.524  1.00 0.18 ?  12 ASP   A O    5  
ATOM   2557 C CB   . ASP   A 1 12 ? 2.200   1.184   5.354  1.00 0.39 ?  12 ASP   A CB   5  
ATOM   2558 C CG   . ASP   A 1 12 ? 2.900   -0.158  5.378  1.00 0.82 ?  12 ASP   A CG   5  
ATOM   2559 O OD1  . ASP   A 1 12 ? 4.118   -0.194  5.651  1.00 1.45 ?  12 ASP   A OD1  5  
ATOM   2560 O OD2  . ASP   A 1 12 ? 2.226   -1.186  5.153  1.00 1.50 -1 12 ASP   A OD2  5  
ATOM   2561 H H    . ASP   A 1 12 ? 4.233   2.336   4.388  1.00 0.31 ?  12 ASP   A H    5  
ATOM   2562 H HA   . ASP   A 1 12 ? 2.055   1.108   3.223  1.00 0.27 ?  12 ASP   A HA   5  
ATOM   2563 H HB2  . ASP   A 1 12 ? 2.686   1.829   6.068  1.00 1.12 ?  12 ASP   A HB2  5  
ATOM   2564 H HB3  . ASP   A 1 12 ? 1.179   1.042   5.656  1.00 1.15 ?  12 ASP   A HB3  5  
HETATM 2565 N N    . 2ML   A 1 13 ? 1.386   4.108   4.325  1.00 0.18 ?  13 2ML   A N    5  
HETATM 2566 C CA   . 2ML   A 1 13 ? 0.398   5.189   4.387  1.00 0.19 ?  13 2ML   A CA   5  
HETATM 2567 C CB1  . 2ML   A 1 13 ? 1.104   6.472   4.833  1.00 0.24 ?  13 2ML   A CB1  5  
HETATM 2568 C CB2  . 2ML   A 1 13 ? -0.660  4.846   5.425  1.00 0.25 ?  13 2ML   A CB2  5  
HETATM 2569 C CG   . 2ML   A 1 13 ? 0.107   7.608   5.127  1.00 0.33 ?  13 2ML   A CG   5  
HETATM 2570 C CD1  . 2ML   A 1 13 ? 0.689   8.563   6.160  1.00 0.57 ?  13 2ML   A CD1  5  
HETATM 2571 C CD2  . 2ML   A 1 13 ? -0.238  8.380   3.859  1.00 0.54 ?  13 2ML   A CD2  5  
HETATM 2572 C C    . 2ML   A 1 13 ? -0.248  5.362   3.003  1.00 0.16 ?  13 2ML   A C    5  
HETATM 2573 O O    . 2ML   A 1 13 ? -1.476  5.432   2.881  1.00 0.17 ?  13 2ML   A O    5  
HETATM 2574 H H    . 2ML   A 1 13 ? 2.309   4.303   4.590  1.00 0.20 ?  13 2ML   A H    5  
HETATM 2575 H HB11 . 2ML   A 1 13 ? 1.771   6.794   4.051  1.00 0.28 ?  13 2ML   A HB11 5  
HETATM 2576 H HB12 . 2ML   A 1 13 ? 1.680   6.265   5.725  1.00 0.32 ?  13 2ML   A HB12 5  
HETATM 2577 H HB21 . 2ML   A 1 13 ? -0.247  4.964   6.414  1.00 0.92 ?  13 2ML   A HB21 5  
HETATM 2578 H HB22 . 2ML   A 1 13 ? -0.972  3.821   5.288  1.00 0.95 ?  13 2ML   A HB22 5  
HETATM 2579 H HB23 . 2ML   A 1 13 ? -1.510  5.497   5.306  1.00 1.02 ?  13 2ML   A HB23 5  
HETATM 2580 H HG   . 2ML   A 1 13 ? -0.804  7.192   5.530  1.00 0.64 ?  13 2ML   A HG   5  
HETATM 2581 H HD11 . 2ML   A 1 13 ? 0.903   8.023   7.070  1.00 1.31 ?  13 2ML   A HD11 5  
HETATM 2582 H HD12 . 2ML   A 1 13 ? -0.023  9.347   6.366  1.00 0.88 ?  13 2ML   A HD12 5  
HETATM 2583 H HD13 . 2ML   A 1 13 ? 1.599   8.997   5.775  1.00 1.28 ?  13 2ML   A HD13 5  
HETATM 2584 H HD21 . 2ML   A 1 13 ? -0.637  7.699   3.122  1.00 1.20 ?  13 2ML   A HD21 5  
HETATM 2585 H HD22 . 2ML   A 1 13 ? 0.652   8.851   3.471  1.00 1.15 ?  13 2ML   A HD22 5  
HETATM 2586 H HD23 . 2ML   A 1 13 ? -0.976  9.136   4.087  1.00 1.05 ?  13 2ML   A HD23 5  
ATOM   2587 N N    . ARG   A 1 14 ? 0.580   5.414   1.966  1.00 0.14 ?  14 ARG   A N    5  
ATOM   2588 C CA   . ARG   A 1 14 ? 0.088   5.640   0.614  1.00 0.16 ?  14 ARG   A CA   5  
ATOM   2589 C C    . ARG   A 1 14 ? -0.595  4.394   0.070  1.00 0.12 ?  14 ARG   A C    5  
ATOM   2590 O O    . ARG   A 1 14 ? -1.585  4.489   -0.655 1.00 0.14 ?  14 ARG   A O    5  
ATOM   2591 C CB   . ARG   A 1 14 ? 1.221   6.076   -0.313 1.00 0.21 ?  14 ARG   A CB   5  
ATOM   2592 C CG   . ARG   A 1 14 ? 0.766   6.348   -1.734 1.00 1.03 ?  14 ARG   A CG   5  
ATOM   2593 C CD   . ARG   A 1 14 ? 1.906   6.868   -2.594 1.00 1.04 ?  14 ARG   A CD   5  
ATOM   2594 N NE   . ARG   A 1 14 ? 1.529   6.957   -4.002 1.00 1.37 ?  14 ARG   A NE   5  
ATOM   2595 C CZ   . ARG   A 1 14 ? 2.404   7.057   -5.002 1.00 1.63 ?  14 ARG   A CZ   5  
ATOM   2596 N NH1  . ARG   A 1 14 ? 3.707   7.102   -4.750 1.00 1.31 1  14 ARG   A NH1  5  
ATOM   2597 N NH2  . ARG   A 1 14 ? 1.973   7.115   -6.255 1.00 2.60 ?  14 ARG   A NH2  5  
ATOM   2598 H H    . ARG   A 1 14 ? 1.547   5.294   2.115  1.00 0.17 ?  14 ARG   A H    5  
ATOM   2599 H HA   . ARG   A 1 14 ? -0.640  6.433   0.662  1.00 0.20 ?  14 ARG   A HA   5  
ATOM   2600 H HB2  . ARG   A 1 14 ? 1.664   6.976   0.081  1.00 0.88 ?  14 ARG   A HB2  5  
ATOM   2601 H HB3  . ARG   A 1 14 ? 1.967   5.301   -0.339 1.00 0.69 ?  14 ARG   A HB3  5  
ATOM   2602 H HG2  . ARG   A 1 14 ? 0.391   5.430   -2.164 1.00 1.51 ?  14 ARG   A HG2  5  
ATOM   2603 H HG3  . ARG   A 1 14 ? -0.025  7.085   -1.713 1.00 1.60 ?  14 ARG   A HG3  5  
ATOM   2604 H HD2  . ARG   A 1 14 ? 2.189   7.850   -2.242 1.00 1.51 ?  14 ARG   A HD2  5  
ATOM   2605 H HD3  . ARG   A 1 14 ? 2.747   6.197   -2.497 1.00 1.55 ?  14 ARG   A HD3  5  
ATOM   2606 H HE   . ARG   A 1 14 ? 0.566   6.935   -4.213 1.00 1.89 ?  14 ARG   A HE   5  
ATOM   2607 H HH11 . ARG   A 1 14 ? 4.364   7.176   -5.507 1.00 1.53 ?  14 ARG   A HH11 5  
ATOM   2608 H HH12 . ARG   A 1 14 ? 4.042   7.067   -3.805 1.00 1.40 ?  14 ARG   A HH12 5  
ATOM   2609 H HH21 . ARG   A 1 14 ? 2.629   7.190   -7.013 1.00 2.84 ?  14 ARG   A HH21 5  
ATOM   2610 H HH22 . ARG   A 1 14 ? 0.989   7.089   -6.452 1.00 3.21 ?  14 ARG   A HH22 5  
ATOM   2611 N N    . CYS   A 1 15 ? -0.076  3.228   0.428  1.00 0.11 ?  15 CYS   A N    5  
ATOM   2612 C CA   . CYS   A 1 15 ? -0.706  1.972   0.033  1.00 0.10 ?  15 CYS   A CA   5  
ATOM   2613 C C    . CYS   A 1 15 ? -2.115  1.906   0.619  1.00 0.09 ?  15 CYS   A C    5  
ATOM   2614 O O    . CYS   A 1 15 ? -3.076  1.560   -0.070 1.00 0.09 ?  15 CYS   A O    5  
ATOM   2615 C CB   . CYS   A 1 15 ? 0.139   0.780   0.502  1.00 0.13 ?  15 CYS   A CB   5  
ATOM   2616 S SG   . CYS   A 1 15 ? -0.549  -0.856  0.077  1.00 0.13 ?  15 CYS   A SG   5  
ATOM   2617 H H    . CYS   A 1 15 ? 0.746   3.209   0.972  1.00 0.12 ?  15 CYS   A H    5  
ATOM   2618 H HA   . CYS   A 1 15 ? -0.778  1.958   -1.049 1.00 0.11 ?  15 CYS   A HA   5  
ATOM   2619 H HB2  . CYS   A 1 15 ? 1.120   0.845   0.054  1.00 0.15 ?  15 CYS   A HB2  5  
ATOM   2620 H HB3  . CYS   A 1 15 ? 0.237   0.826   1.576  1.00 0.15 ?  15 CYS   A HB3  5  
ATOM   2621 N N    . HIS   A 1 16 ? -2.232  2.296   1.883  1.00 0.11 ?  16 HIS   A N    5  
ATOM   2622 C CA   . HIS   A 1 16 ? -3.517  2.336   2.561  1.00 0.13 ?  16 HIS   A CA   5  
ATOM   2623 C C    . HIS   A 1 16 ? -4.441  3.345   1.884  1.00 0.13 ?  16 HIS   A C    5  
ATOM   2624 O O    . HIS   A 1 16 ? -5.615  3.056   1.659  1.00 0.15 ?  16 HIS   A O    5  
ATOM   2625 C CB   . HIS   A 1 16 ? -3.316  2.695   4.040  1.00 0.17 ?  16 HIS   A CB   5  
ATOM   2626 C CG   . HIS   A 1 16 ? -4.579  2.757   4.847  1.00 0.27 ?  16 HIS   A CG   5  
ATOM   2627 N ND1  . HIS   A 1 16 ? -5.046  1.699   5.592  1.00 0.39 ?  16 HIS   A ND1  5  
ATOM   2628 C CD2  . HIS   A 1 16 ? -5.465  3.763   5.036  1.00 0.34 ?  16 HIS   A CD2  5  
ATOM   2629 C CE1  . HIS   A 1 16 ? -6.164  2.046   6.196  1.00 0.48 ?  16 HIS   A CE1  5  
ATOM   2630 N NE2  . HIS   A 1 16 ? -6.441  3.295   5.879  1.00 0.45 ?  16 HIS   A NE2  5  
ATOM   2631 H H    . HIS   A 1 16 ? -1.422  2.561   2.376  1.00 0.13 ?  16 HIS   A H    5  
ATOM   2632 H HA   . HIS   A 1 16 ? -3.960  1.353   2.491  1.00 0.14 ?  16 HIS   A HA   5  
ATOM   2633 H HB2  . HIS   A 1 16 ? -2.676  1.956   4.495  1.00 0.22 ?  16 HIS   A HB2  5  
ATOM   2634 H HB3  . HIS   A 1 16 ? -2.836  3.661   4.102  1.00 0.15 ?  16 HIS   A HB3  5  
ATOM   2635 H HD1  . HIS   A 1 16 ? -4.607  0.827   5.688  1.00 0.44 ?  16 HIS   A HD1  5  
ATOM   2636 H HD2  . HIS   A 1 16 ? -5.411  4.753   4.605  1.00 0.35 ?  16 HIS   A HD2  5  
ATOM   2637 H HE1  . HIS   A 1 16 ? -6.759  1.410   6.833  1.00 0.59 ?  16 HIS   A HE1  5  
ATOM   2638 H HE2  . HIS   A 1 16 ? -7.089  3.859   6.360  1.00 0.54 ?  16 HIS   A HE2  5  
HETATM 2639 N N    . AIB   A 1 17 ? -3.896  4.523   1.568  1.00 0.13 ?  17 AIB   A N    5  
HETATM 2640 C CA   . AIB   A 1 17 ? -4.641  5.585   0.874  1.00 0.15 ?  17 AIB   A CA   5  
HETATM 2641 C C    . AIB   A 1 17 ? -5.205  5.033   -0.440 1.00 0.13 ?  17 AIB   A C    5  
HETATM 2642 O O    . AIB   A 1 17 ? -6.390  5.193   -0.750 1.00 0.15 ?  17 AIB   A O    5  
HETATM 2643 C CB1  . AIB   A 1 17 ? -3.716  6.752   0.578  1.00 0.18 ?  17 AIB   A CB1  5  
HETATM 2644 C CB2  . AIB   A 1 17 ? -5.757  6.106   1.759  1.00 0.19 ?  17 AIB   A CB2  5  
HETATM 2645 H H    . AIB   A 1 17 ? -2.958  4.687   1.811  1.00 0.13 ?  17 AIB   A H    5  
HETATM 2646 H HB11 . AIB   A 1 17 ? -3.306  7.132   1.503  1.00 0.99 ?  17 AIB   A HB11 5  
HETATM 2647 H HB12 . AIB   A 1 17 ? -4.273  7.535   0.085  1.00 0.95 ?  17 AIB   A HB12 5  
HETATM 2648 H HB13 . AIB   A 1 17 ? -2.913  6.423   -0.063 1.00 1.05 ?  17 AIB   A HB13 5  
HETATM 2649 H HB21 . AIB   A 1 17 ? -6.363  6.805   1.200  1.00 1.00 ?  17 AIB   A HB21 5  
HETATM 2650 H HB22 . AIB   A 1 17 ? -5.331  6.605   2.615  1.00 1.02 ?  17 AIB   A HB22 5  
HETATM 2651 H HB23 . AIB   A 1 17 ? -6.369  5.282   2.089  1.00 0.98 ?  17 AIB   A HB23 5  
ATOM   2652 N N    . HIS   A 1 18 ? -4.340  4.369   -1.198 1.00 0.12 ?  18 HIS   A N    5  
ATOM   2653 C CA   . HIS   A 1 18 ? -4.716  3.806   -2.486 1.00 0.12 ?  18 HIS   A CA   5  
ATOM   2654 C C    . HIS   A 1 18 ? -5.811  2.756   -2.329 1.00 0.09 ?  18 HIS   A C    5  
ATOM   2655 O O    . HIS   A 1 18 ? -6.854  2.835   -2.976 1.00 0.10 ?  18 HIS   A O    5  
ATOM   2656 C CB   . HIS   A 1 18 ? -3.488  3.199   -3.177 1.00 0.15 ?  18 HIS   A CB   5  
ATOM   2657 C CG   . HIS   A 1 18 ? -3.812  2.434   -4.424 1.00 0.19 ?  18 HIS   A CG   5  
ATOM   2658 N ND1  . HIS   A 1 18 ? -4.223  3.031   -5.596 1.00 0.23 ?  18 HIS   A ND1  5  
ATOM   2659 C CD2  . HIS   A 1 18 ? -3.796  1.104   -4.667 1.00 0.23 ?  18 HIS   A CD2  5  
ATOM   2660 C CE1  . HIS   A 1 18 ? -4.449  2.102   -6.505 1.00 0.28 ?  18 HIS   A CE1  5  
ATOM   2661 N NE2  . HIS   A 1 18 ? -4.197  0.925   -5.967 1.00 0.28 ?  18 HIS   A NE2  5  
ATOM   2662 H H    . HIS   A 1 18 ? -3.416  4.256   -0.880 1.00 0.12 ?  18 HIS   A H    5  
ATOM   2663 H HA   . HIS   A 1 18 ? -5.096  4.610   -3.096 1.00 0.14 ?  18 HIS   A HA   5  
ATOM   2664 H HB2  . HIS   A 1 18 ? -2.803  3.988   -3.441 1.00 0.17 ?  18 HIS   A HB2  5  
ATOM   2665 H HB3  . HIS   A 1 18 ? -2.998  2.523   -2.490 1.00 0.15 ?  18 HIS   A HB3  5  
ATOM   2666 H HD1  . HIS   A 1 18 ? -4.331  4.000   -5.743 1.00 0.24 ?  18 HIS   A HD1  5  
ATOM   2667 H HD2  . HIS   A 1 18 ? -3.514  0.331   -3.968 1.00 0.24 ?  18 HIS   A HD2  5  
ATOM   2668 H HE1  . HIS   A 1 18 ? -4.781  2.277   -7.516 1.00 0.33 ?  18 HIS   A HE1  5  
ATOM   2669 H HE2  . HIS   A 1 18 ? -4.201  0.070   -6.451 1.00 0.36 ?  18 HIS   A HE2  5  
ATOM   2670 N N    . CYS   A 1 19 ? -5.573  1.784   -1.463 1.00 0.09 ?  19 CYS   A N    5  
ATOM   2671 C CA   . CYS   A 1 19 ? -6.506  0.681   -1.280 1.00 0.09 ?  19 CYS   A CA   5  
ATOM   2672 C C    . CYS   A 1 19 ? -7.841  1.167   -0.725 1.00 0.09 ?  19 CYS   A C    5  
ATOM   2673 O O    . CYS   A 1 19 ? -8.886  0.622   -1.072 1.00 0.09 ?  19 CYS   A O    5  
ATOM   2674 C CB   . CYS   A 1 19 ? -5.893  -0.379  -0.367 1.00 0.11 ?  19 CYS   A CB   5  
ATOM   2675 S SG   . CYS   A 1 19 ? -4.337  -1.078  -1.007 1.00 0.12 ?  19 CYS   A SG   5  
ATOM   2676 H H    . CYS   A 1 19 ? -4.743  1.805   -0.931 1.00 0.11 ?  19 CYS   A H    5  
ATOM   2677 H HA   . CYS   A 1 19 ? -6.683  0.239   -2.251 1.00 0.10 ?  19 CYS   A HA   5  
ATOM   2678 H HB2  . CYS   A 1 19 ? -5.685  0.061   0.598  1.00 0.13 ?  19 CYS   A HB2  5  
ATOM   2679 H HB3  . CYS   A 1 19 ? -6.594  -1.192  -0.244 1.00 0.13 ?  19 CYS   A HB3  5  
HETATM 2680 N N    . A1BEB A 1 20 ? -7.795  2.203   0.119  1.00 0.11 ?  20 A1BEB A N    5  
HETATM 2681 C CA   . A1BEB A 1 20 ? -9.007  2.828   0.672  1.00 0.14 ?  20 A1BEB A CA   5  
HETATM 2682 C C    . A1BEB A 1 20 ? -9.878  3.352   -0.477 1.00 0.16 ?  20 A1BEB A C    5  
HETATM 2683 O O    . A1BEB A 1 20 ? -11.108 3.325   -0.403 1.00 0.18 ?  20 A1BEB A O    5  
HETATM 2684 C CB   . A1BEB A 1 20 ? -8.613  3.977   1.589  1.00 0.21 ?  20 A1BEB A CB   5  
HETATM 2685 C CB2  . A1BEB A 1 20 ? -9.774  1.814   1.506  1.00 0.15 ?  20 A1BEB A CB2  5  
HETATM 2686 C CG   . A1BEB A 1 20 ? -9.815  4.838   1.961  1.00 0.36 ?  20 A1BEB A CG   5  
HETATM 2687 C CD   . A1BEB A 1 20 ? -9.413  6.013   2.834  1.00 0.44 ?  20 A1BEB A CD   5  
HETATM 2688 C CE   . A1BEB A 1 20 ? -9.168  5.587   4.271  1.00 0.72 ?  20 A1BEB A CE   5  
HETATM 2689 N NZ   . A1BEB A 1 20 ? -10.420 5.137   4.939  1.00 1.38 ?  20 A1BEB A NZ   5  
HETATM 2690 H H    . A1BEB A 1 20 ? -6.919  2.559   0.388  1.00 0.12 ?  20 A1BEB A H    5  
HETATM 2691 H HB2  . A1BEB A 1 20 ? -7.886  4.601   1.088  1.00 0.19 ?  20 A1BEB A HB2  5  
HETATM 2692 H HB3  . A1BEB A 1 20 ? -8.180  3.581   2.496  1.00 0.23 ?  20 A1BEB A HB3  5  
HETATM 2693 H HB23 . A1BEB A 1 20 ? -10.002 0.949   0.899  1.00 0.84 ?  20 A1BEB A HB23 5  
HETATM 2694 H HB21 . A1BEB A 1 20 ? -10.691 2.258   1.862  1.00 0.80 ?  20 A1BEB A HB21 5  
HETATM 2695 H HB22 . A1BEB A 1 20 ? -9.169  1.510   2.349  1.00 0.82 ?  20 A1BEB A HB22 5  
HETATM 2696 H HG3  . A1BEB A 1 20 ? -10.524 4.233   2.501  1.00 0.42 ?  20 A1BEB A HG3  5  
HETATM 2697 H HG2  . A1BEB A 1 20 ? -10.271 5.211   1.058  1.00 0.40 ?  20 A1BEB A HG2  5  
HETATM 2698 H HD3  . A1BEB A 1 20 ? -8.506  6.445   2.439  1.00 0.93 ?  20 A1BEB A HD3  5  
HETATM 2699 H HD2  . A1BEB A 1 20 ? -10.202 6.749   2.816  1.00 0.84 ?  20 A1BEB A HD2  5  
HETATM 2700 H HE3  . A1BEB A 1 20 ? -8.458  4.773   4.274  1.00 1.49 ?  20 A1BEB A HE3  5  
HETATM 2701 H HE2  . A1BEB A 1 20 ? -8.759  6.422   4.816  1.00 1.41 ?  20 A1BEB A HE2  5  
HETATM 2702 H HZ1  . A1BEB A 1 20 ? -10.228 4.886   5.930  1.00 1.93 ?  20 A1BEB A HZ1  5  
HETATM 2703 H HZ2  . A1BEB A 1 20 ? -10.811 4.305   4.455  1.00 1.93 ?  20 A1BEB A HZ2  5  
HETATM 2704 H HZ3  . A1BEB A 1 20 ? -11.129 5.897   4.919  1.00 1.84 ?  20 A1BEB A HZ3  5  
ATOM   2705 N N    . SER   A 1 21 ? -9.230  3.818   -1.540 1.00 0.18 ?  21 SER   A N    5  
ATOM   2706 C CA   . SER   A 1 21 ? -9.941  4.380   -2.679 1.00 0.23 ?  21 SER   A CA   5  
ATOM   2707 C C    . SER   A 1 21 ? -10.633 3.278   -3.484 1.00 0.23 ?  21 SER   A C    5  
ATOM   2708 O O    . SER   A 1 21 ? -11.515 3.549   -4.302 1.00 0.31 ?  21 SER   A O    5  
ATOM   2709 C CB   . SER   A 1 21 ? -8.970  5.167   -3.568 1.00 0.33 ?  21 SER   A CB   5  
ATOM   2710 O OG   . SER   A 1 21 ? -9.663  5.955   -4.521 1.00 1.18 ?  21 SER   A OG   5  
ATOM   2711 H H    . SER   A 1 21 ? -8.247  3.779   -1.559 1.00 0.17 ?  21 SER   A H    5  
ATOM   2712 H HA   . SER   A 1 21 ? -10.691 5.053   -2.298 1.00 0.26 ?  21 SER   A HA   5  
ATOM   2713 H HB2  . SER   A 1 21 ? -8.372  5.819   -2.953 1.00 1.01 ?  21 SER   A HB2  5  
ATOM   2714 H HB3  . SER   A 1 21 ? -8.327  4.477   -4.091 1.00 1.21 ?  21 SER   A HB3  5  
ATOM   2715 H HG   . SER   A 1 21 ? -10.300 6.519   -4.062 1.00 1.82 ?  21 SER   A HG   5  
ATOM   2716 N N    . ILE   A 1 22 ? -10.238 2.034   -3.243 1.00 0.19 ?  22 ILE   A N    5  
ATOM   2717 C CA   . ILE   A 1 22 ? -10.815 0.906   -3.945 1.00 0.20 ?  22 ILE   A CA   5  
ATOM   2718 C C    . ILE   A 1 22 ? -11.878 0.222   -3.084 1.00 0.17 ?  22 ILE   A C    5  
ATOM   2719 O O    . ILE   A 1 22 ? -11.582 -0.289  -1.997 1.00 0.14 ?  22 ILE   A O    5  
ATOM   2720 C CB   . ILE   A 1 22 ? -9.738  -0.121  -4.330 1.00 0.21 ?  22 ILE   A CB   5  
ATOM   2721 C CG1  . ILE   A 1 22 ? -8.614  0.559   -5.113 1.00 0.24 ?  22 ILE   A CG1  5  
ATOM   2722 C CG2  . ILE   A 1 22 ? -10.360 -1.244  -5.149 1.00 0.24 ?  22 ILE   A CG2  5  
ATOM   2723 C CD1  . ILE   A 1 22 ? -7.471  -0.367  -5.476 1.00 0.26 ?  22 ILE   A CD1  5  
ATOM   2724 H H    . ILE   A 1 22 ? -9.547  1.871   -2.568 1.00 0.19 ?  22 ILE   A H    5  
ATOM   2725 H HA   . ILE   A 1 22 ? -11.273 1.272   -4.849 1.00 0.25 ?  22 ILE   A HA   5  
ATOM   2726 H HB   . ILE   A 1 22 ? -9.335  -0.539  -3.422 1.00 0.18 ?  22 ILE   A HB   5  
ATOM   2727 H HG12 . ILE   A 1 22 ? -9.016  0.961   -6.029 1.00 0.28 ?  22 ILE   A HG12 5  
ATOM   2728 H HG13 . ILE   A 1 22 ? -8.211  1.366   -4.519 1.00 0.24 ?  22 ILE   A HG13 5  
ATOM   2729 H HG21 . ILE   A 1 22 ? -10.794 -0.832  -6.048 1.00 0.99 ?  22 ILE   A HG21 5  
ATOM   2730 H HG22 . ILE   A 1 22 ? -11.132 -1.728  -4.568 1.00 0.98 ?  22 ILE   A HG22 5  
ATOM   2731 H HG23 . ILE   A 1 22 ? -9.601  -1.963  -5.411 1.00 0.97 ?  22 ILE   A HG23 5  
ATOM   2732 H HD11 . ILE   A 1 22 ? -7.835  -1.145  -6.131 1.00 1.05 ?  22 ILE   A HD11 5  
ATOM   2733 H HD12 . ILE   A 1 22 ? -7.068  -0.813  -4.579 1.00 1.05 ?  22 ILE   A HD12 5  
ATOM   2734 H HD13 . ILE   A 1 22 ? -6.698  0.194   -5.979 1.00 0.99 ?  22 ILE   A HD13 5  
ATOM   2735 N N    . PRO   A 1 23 ? -13.135 0.214   -3.552 1.00 0.19 ?  23 PRO   A N    5  
ATOM   2736 C CA   . PRO   A 1 23 ? -14.241 -0.421  -2.832 1.00 0.19 ?  23 PRO   A CA   5  
ATOM   2737 C C    . PRO   A 1 23 ? -13.980 -1.902  -2.568 1.00 0.18 ?  23 PRO   A C    5  
ATOM   2738 O O    . PRO   A 1 23 ? -13.416 -2.607  -3.411 1.00 0.21 ?  23 PRO   A O    5  
ATOM   2739 C CB   . PRO   A 1 23 ? -15.437 -0.244  -3.770 1.00 0.25 ?  23 PRO   A CB   5  
ATOM   2740 C CG   . PRO   A 1 23 ? -15.070 0.900   -4.644 1.00 0.29 ?  23 PRO   A CG   5  
ATOM   2741 C CD   . PRO   A 1 23 ? -13.581 0.825   -4.814 1.00 0.26 ?  23 PRO   A CD   5  
ATOM   2742 H HA   . PRO   A 1 23 ? -14.438 0.080   -1.897 1.00 0.19 ?  23 PRO   A HA   5  
ATOM   2743 H HB2  . PRO   A 1 23 ? -15.582 -1.145  -4.344 1.00 0.28 ?  23 PRO   A HB2  5  
ATOM   2744 H HB3  . PRO   A 1 23 ? -16.325 -0.031  -3.193 1.00 0.28 ?  23 PRO   A HB3  5  
ATOM   2745 H HG2  . PRO   A 1 23 ? -15.562 0.803   -5.598 1.00 0.34 ?  23 PRO   A HG2  5  
ATOM   2746 H HG3  . PRO   A 1 23 ? -15.347 1.829   -4.169 1.00 0.30 ?  23 PRO   A HG3  5  
ATOM   2747 H HD2  . PRO   A 1 23 ? -13.327 0.198   -5.658 1.00 0.30 ?  23 PRO   A HD2  5  
ATOM   2748 H HD3  . PRO   A 1 23 ? -13.167 1.812   -4.934 1.00 0.28 ?  23 PRO   A HD3  5  
HETATM 2749 N N    . DPR   A 1 24 ? -14.406 -2.392  -1.398 1.00 0.19 ?  24 DPR   A N    5  
HETATM 2750 C CA   . DPR   A 1 24 ? -14.159 -3.764  -0.962 1.00 0.23 ?  24 DPR   A CA   5  
HETATM 2751 C CB   . DPR   A 1 24 ? -15.387 -4.039  -0.112 1.00 0.30 ?  24 DPR   A CB   5  
HETATM 2752 C CG   . DPR   A 1 24 ? -15.642 -2.734  0.568  1.00 0.29 ?  24 DPR   A CG   5  
HETATM 2753 C CD   . DPR   A 1 24 ? -15.220 -1.659  -0.407 1.00 0.23 ?  24 DPR   A CD   5  
HETATM 2754 C C    . DPR   A 1 24 ? -12.891 -3.886  -0.114 1.00 0.22 ?  24 DPR   A C    5  
HETATM 2755 O O    . DPR   A 1 24 ? -12.692 -4.884  0.582  1.00 0.31 ?  24 DPR   A O    5  
HETATM 2756 H HA   . DPR   A 1 24 ? -14.125 -4.457  -1.784 1.00 0.27 ?  24 DPR   A HA   5  
HETATM 2757 H HB2  . DPR   A 1 24 ? -15.172 -4.820  0.599  1.00 0.34 ?  24 DPR   A HB2  5  
HETATM 2758 H HB3  . DPR   A 1 24 ? -16.214 -4.330  -0.744 1.00 0.33 ?  24 DPR   A HB3  5  
HETATM 2759 H HG2  . DPR   A 1 24 ? -15.052 -2.671  1.470  1.00 0.31 ?  24 DPR   A HG2  5  
HETATM 2760 H HG3  . DPR   A 1 24 ? -16.692 -2.638  0.798  1.00 0.35 ?  24 DPR   A HG3  5  
HETATM 2761 H HD2  . DPR   A 1 24 ? -14.633 -0.906  0.091  1.00 0.23 ?  24 DPR   A HD2  5  
HETATM 2762 H HD3  . DPR   A 1 24 ? -16.086 -1.215  -0.875 1.00 0.24 ?  24 DPR   A HD3  5  
ATOM   2763 N N    . TYR   A 1 25 ? -12.046 -2.867  -0.162 1.00 0.15 ?  25 TYR   A N    5  
ATOM   2764 C CA   . TYR   A 1 25 ? -10.855 -2.831  0.670  1.00 0.14 ?  25 TYR   A CA   5  
ATOM   2765 C C    . TYR   A 1 25 ? -10.978 -1.736  1.719  1.00 0.15 ?  25 TYR   A C    5  
ATOM   2766 O O    . TYR   A 1 25 ? -11.746 -0.790  1.548  1.00 0.17 ?  25 TYR   A O    5  
ATOM   2767 C CB   . TYR   A 1 25 ? -9.610  -2.601  -0.185 1.00 0.12 ?  25 TYR   A CB   5  
ATOM   2768 C CG   . TYR   A 1 25 ? -9.330  -3.719  -1.169 1.00 0.15 ?  25 TYR   A CG   5  
ATOM   2769 C CD1  . TYR   A 1 25 ? -9.300  -3.478  -2.536 1.00 0.18 ?  25 TYR   A CD1  5  
ATOM   2770 C CD2  . TYR   A 1 25 ? -9.100  -5.015  -0.731 1.00 0.21 ?  25 TYR   A CD2  5  
ATOM   2771 C CE1  . TYR   A 1 25 ? -9.049  -4.495  -3.437 1.00 0.24 ?  25 TYR   A CE1  5  
ATOM   2772 C CE2  . TYR   A 1 25 ? -8.847  -6.038  -1.624 1.00 0.26 ?  25 TYR   A CE2  5  
ATOM   2773 C CZ   . TYR   A 1 25 ? -8.809  -5.768  -2.978 1.00 0.26 ?  25 TYR   A CZ   5  
ATOM   2774 O OH   . TYR   A 1 25 ? -8.569  -6.793  -3.865 1.00 0.32 ?  25 TYR   A OH   5  
ATOM   2775 H H    . TYR   A 1 25 ? -12.227 -2.116  -0.770 1.00 0.14 ?  25 TYR   A H    5  
ATOM   2776 H HA   . TYR   A 1 25 ? -10.769 -3.784  1.171  1.00 0.16 ?  25 TYR   A HA   5  
ATOM   2777 H HB2  . TYR   A 1 25 ? -9.736  -1.687  -0.746 1.00 0.11 ?  25 TYR   A HB2  5  
ATOM   2778 H HB3  . TYR   A 1 25 ? -8.753  -2.502  0.464  1.00 0.12 ?  25 TYR   A HB3  5  
ATOM   2779 H HD1  . TYR   A 1 25 ? -9.477  -2.477  -2.895 1.00 0.20 ?  25 TYR   A HD1  5  
ATOM   2780 H HD2  . TYR   A 1 25 ? -9.122  -5.221  0.325  1.00 0.25 ?  25 TYR   A HD2  5  
ATOM   2781 H HE1  . TYR   A 1 25 ? -9.031  -4.287  -4.496 1.00 0.29 ?  25 TYR   A HE1  5  
ATOM   2782 H HE2  . TYR   A 1 25 ? -8.670  -7.040  -1.261 1.00 0.32 ?  25 TYR   A HE2  5  
ATOM   2783 H HH   . TYR   A 1 25 ? -7.982  -6.469  -4.562 1.00 0.97 ?  25 TYR   A HH   5  
ATOM   2784 N N    . LYS   A 1 26 ? -10.240 -1.882  2.807  1.00 0.16 ?  26 LYS   A N    5  
ATOM   2785 C CA   . LYS   A 1 26 ? -10.260 -0.896  3.883  1.00 0.21 ?  26 LYS   A CA   5  
ATOM   2786 C C    . LYS   A 1 26 ? -8.850  -0.404  4.205  1.00 0.24 ?  26 LYS   A C    5  
ATOM   2787 O O    . LYS   A 1 26 ? -8.671  0.590   4.909  1.00 0.46 ?  26 LYS   A O    5  
ATOM   2788 C CB   . LYS   A 1 26 ? -10.918 -1.479  5.141  1.00 0.27 ?  26 LYS   A CB   5  
ATOM   2789 C CG   . LYS   A 1 26 ? -10.244 -2.734  5.685  1.00 0.30 ?  26 LYS   A CG   5  
ATOM   2790 C CD   . LYS   A 1 26 ? -10.918 -3.216  6.961  1.00 0.43 ?  26 LYS   A CD   5  
ATOM   2791 C CE   . LYS   A 1 26 ? -10.670 -2.265  8.120  1.00 1.65 ?  26 LYS   A CE   5  
ATOM   2792 N NZ   . LYS   A 1 26 ? -11.555 -2.555  9.281  1.00 1.94 1  26 LYS   A NZ   5  
ATOM   2793 H H    . LYS   A 1 26 ? -9.669  -2.676  2.892  1.00 0.16 ?  26 LYS   A H    5  
ATOM   2794 H HA   . LYS   A 1 26 ? -10.844 -0.057  3.541  1.00 0.22 ?  26 LYS   A HA   5  
ATOM   2795 H HB2  . LYS   A 1 26 ? -10.905 -0.729  5.916  1.00 0.31 ?  26 LYS   A HB2  5  
ATOM   2796 H HB3  . LYS   A 1 26 ? -11.944 -1.725  4.910  1.00 0.32 ?  26 LYS   A HB3  5  
ATOM   2797 H HG2  . LYS   A 1 26 ? -10.303 -3.516  4.942  1.00 0.34 ?  26 LYS   A HG2  5  
ATOM   2798 H HG3  . LYS   A 1 26 ? -9.207  -2.511  5.896  1.00 0.36 ?  26 LYS   A HG3  5  
ATOM   2799 H HD2  . LYS   A 1 26 ? -11.981 -3.288  6.789  1.00 1.07 ?  26 LYS   A HD2  5  
ATOM   2800 H HD3  . LYS   A 1 26 ? -10.526 -4.190  7.216  1.00 0.96 ?  26 LYS   A HD3  5  
ATOM   2801 H HE2  . LYS   A 1 26 ? -9.641  -2.363  8.433  1.00 2.28 ?  26 LYS   A HE2  5  
ATOM   2802 H HE3  . LYS   A 1 26 ? -10.848 -1.255  7.787  1.00 2.30 ?  26 LYS   A HE3  5  
ATOM   2803 H HZ1  . LYS   A 1 26 ? -11.440 -3.544  9.583  1.00 2.33 ?  26 LYS   A HZ1  5  
ATOM   2804 H HZ2  . LYS   A 1 26 ? -12.549 -2.394  9.022  1.00 2.04 ?  26 LYS   A HZ2  5  
ATOM   2805 H HZ3  . LYS   A 1 26 ? -11.315 -1.933  10.077 1.00 2.40 ?  26 LYS   A HZ3  5  
ATOM   2806 N N    . GLY   A 1 27 ? -7.854  -1.097  3.677  1.00 0.14 ?  27 GLY   A N    5  
ATOM   2807 C CA   . GLY   A 1 27 ? -6.480  -0.727  3.921  1.00 0.13 ?  27 GLY   A CA   5  
ATOM   2808 C C    . GLY   A 1 27 ? -5.537  -1.466  3.002  1.00 0.12 ?  27 GLY   A C    5  
ATOM   2809 O O    . GLY   A 1 27 ? -5.982  -2.241  2.157  1.00 0.15 ?  27 GLY   A O    5  
ATOM   2810 H H    . GLY   A 1 27 ? -8.052  -1.873  3.113  1.00 0.25 ?  27 GLY   A H    5  
ATOM   2811 H HA2  . GLY   A 1 27 ? -6.369  0.335   3.768  1.00 0.14 ?  27 GLY   A HA2  5  
ATOM   2812 H HA3  . GLY   A 1 27 ? -6.230  -0.963  4.945  1.00 0.17 ?  27 GLY   A HA3  5  
ATOM   2813 N N    . GLY   A 1 28 ? -4.244  -1.237  3.164  1.00 0.13 ?  28 GLY   A N    5  
ATOM   2814 C CA   . GLY   A 1 28 ? -3.266  -1.912  2.339  1.00 0.13 ?  28 GLY   A CA   5  
ATOM   2815 C C    . GLY   A 1 28 ? -1.874  -1.835  2.924  1.00 0.16 ?  28 GLY   A C    5  
ATOM   2816 O O    . GLY   A 1 28 ? -1.360  -0.745  3.181  1.00 0.20 ?  28 GLY   A O    5  
ATOM   2817 H H    . GLY   A 1 28 ? -3.944  -0.612  3.858  1.00 0.15 ?  28 GLY   A H    5  
ATOM   2818 H HA2  . GLY   A 1 28 ? -3.547  -2.951  2.251  1.00 0.14 ?  28 GLY   A HA2  5  
ATOM   2819 H HA3  . GLY   A 1 28 ? -3.262  -1.465  1.359  1.00 0.15 ?  28 GLY   A HA3  5  
ATOM   2820 N N    . TYR   A 1 29 ? -1.291  -2.992  3.190  1.00 0.17 ?  29 TYR   A N    5  
ATOM   2821 C CA   . TYR   A 1 29 ? 0.062   -3.061  3.715  1.00 0.22 ?  29 TYR   A CA   5  
ATOM   2822 C C    . TYR   A 1 29 ? 1.072   -3.285  2.602  1.00 0.20 ?  29 TYR   A C    5  
ATOM   2823 O O    . TYR   A 1 29 ? 0.760   -3.886  1.571  1.00 0.17 ?  29 TYR   A O    5  
ATOM   2824 C CB   . TYR   A 1 29 ? 0.190   -4.141  4.795  1.00 0.28 ?  29 TYR   A CB   5  
ATOM   2825 C CG   . TYR   A 1 29 ? -0.333  -5.507  4.410  1.00 0.33 ?  29 TYR   A CG   5  
ATOM   2826 C CD1  . TYR   A 1 29 ? 0.463   -6.412  3.722  1.00 0.46 ?  29 TYR   A CD1  5  
ATOM   2827 C CD2  . TYR   A 1 29 ? -1.617  -5.901  4.761  1.00 0.44 ?  29 TYR   A CD2  5  
ATOM   2828 C CE1  . TYR   A 1 29 ? -0.006  -7.668  3.391  1.00 0.58 ?  29 TYR   A CE1  5  
ATOM   2829 C CE2  . TYR   A 1 29 ? -2.094  -7.152  4.430  1.00 0.55 ?  29 TYR   A CE2  5  
ATOM   2830 C CZ   . TYR   A 1 29 ? -1.286  -8.031  3.748  1.00 0.60 ?  29 TYR   A CZ   5  
ATOM   2831 O OH   . TYR   A 1 29 ? -1.758  -9.280  3.423  1.00 0.73 ?  29 TYR   A OH   5  
ATOM   2832 H H    . TYR   A 1 29 ? -1.760  -3.824  2.966  1.00 0.17 ?  29 TYR   A H    5  
ATOM   2833 H HA   . TYR   A 1 29 ? 0.274   -2.104  4.166  1.00 0.26 ?  29 TYR   A HA   5  
ATOM   2834 H HB2  . TYR   A 1 29 ? 1.233   -4.254  5.044  1.00 0.35 ?  29 TYR   A HB2  5  
ATOM   2835 H HB3  . TYR   A 1 29 ? -0.344  -3.816  5.674  1.00 0.30 ?  29 TYR   A HB3  5  
ATOM   2836 H HD1  . TYR   A 1 29 ? 1.464   -6.119  3.441  1.00 0.55 ?  29 TYR   A HD1  5  
ATOM   2837 H HD2  . TYR   A 1 29 ? -2.250  -5.210  5.297  1.00 0.53 ?  29 TYR   A HD2  5  
ATOM   2838 H HE1  . TYR   A 1 29 ? 0.629   -8.357  2.855  1.00 0.72 ?  29 TYR   A HE1  5  
ATOM   2839 H HE2  . TYR   A 1 29 ? -3.095  -7.438  4.710  1.00 0.69 ?  29 TYR   A HE2  5  
ATOM   2840 H HH   . TYR   A 1 29 ? -1.138  -9.948  3.746  1.00 1.12 ?  29 TYR   A HH   5  
ATOM   2841 N N    . CYS   A 1 30 ? 2.285   -2.812  2.818  1.00 0.22 ?  30 CYS   A N    5  
ATOM   2842 C CA   . CYS   A 1 30 ? 3.365   -3.028  1.871  1.00 0.19 ?  30 CYS   A CA   5  
ATOM   2843 C C    . CYS   A 1 30 ? 4.025   -4.378  2.112  1.00 0.20 ?  30 CYS   A C    5  
ATOM   2844 O O    . CYS   A 1 30 ? 4.400   -4.707  3.238  1.00 0.32 ?  30 CYS   A O    5  
ATOM   2845 C CB   . CYS   A 1 30 ? 4.400   -1.915  1.973  1.00 0.27 ?  30 CYS   A CB   5  
ATOM   2846 S SG   . CYS   A 1 30 ? 3.856   -0.328  1.267  1.00 0.86 ?  30 CYS   A SG   5  
ATOM   2847 H H    . CYS   A 1 30 ? 2.461   -2.302  3.644  1.00 0.27 ?  30 CYS   A H    5  
ATOM   2848 H HA   . CYS   A 1 30 ? 2.939   -3.021  0.879  1.00 0.21 ?  30 CYS   A HA   5  
ATOM   2849 H HB2  . CYS   A 1 30 ? 4.633   -1.747  3.014  1.00 0.76 ?  30 CYS   A HB2  5  
ATOM   2850 H HB3  . CYS   A 1 30 ? 5.295   -2.218  1.453  1.00 0.88 ?  30 CYS   A HB3  5  
ATOM   2851 N N    . ALA   A 1 31 ? 4.158   -5.158  1.052  1.00 0.19 ?  31 ALA   A N    5  
ATOM   2852 C CA   . ALA   A 1 31 ? 4.741   -6.485  1.142  1.00 0.28 ?  31 ALA   A CA   5  
ATOM   2853 C C    . ALA   A 1 31 ? 5.758   -6.706  0.030  1.00 0.22 ?  31 ALA   A C    5  
ATOM   2854 O O    . ALA   A 1 31 ? 5.951   -5.836  -0.829 1.00 0.16 ?  31 ALA   A O    5  
ATOM   2855 C CB   . ALA   A 1 31 ? 3.646   -7.539  1.071  1.00 0.42 ?  31 ALA   A CB   5  
ATOM   2856 H H    . ALA   A 1 31 ? 3.848   -4.830  0.176  1.00 0.20 ?  31 ALA   A H    5  
ATOM   2857 H HA   . ALA   A 1 31 ? 5.236   -6.574  2.098  1.00 0.36 ?  31 ALA   A HA   5  
ATOM   2858 H HB1  . ALA   A 1 31 ? 4.083   -8.521  1.167  1.00 1.01 ?  31 ALA   A HB1  5  
ATOM   2859 H HB2  . ALA   A 1 31 ? 3.135   -7.463  0.123  1.00 1.08 ?  31 ALA   A HB2  5  
ATOM   2860 H HB3  . ALA   A 1 31 ? 2.941   -7.380  1.872  1.00 1.16 ?  31 ALA   A HB3  5  
ATOM   2861 N N    . LYS   A 1 32 ? 6.413   -7.867  0.067  1.00 0.28 ?  32 LYS   A N    5  
ATOM   2862 C CA   . LYS   A 1 32 ? 7.320   -8.296  -0.991 1.00 0.26 ?  32 LYS   A CA   5  
ATOM   2863 C C    . LYS   A 1 32 ? 8.427   -7.273  -1.233 1.00 0.26 ?  32 LYS   A C    5  
ATOM   2864 O O    . LYS   A 1 32 ? 8.396   -6.521  -2.212 1.00 0.24 ?  32 LYS   A O    5  
ATOM   2865 C CB   . LYS   A 1 32 ? 6.520   -8.571  -2.261 1.00 0.25 ?  32 LYS   A CB   5  
ATOM   2866 C CG   . LYS   A 1 32 ? 5.593   -9.769  -2.120 1.00 1.09 ?  32 LYS   A CG   5  
ATOM   2867 C CD   . LYS   A 1 32 ? 4.629   -9.888  -3.283 1.00 1.62 ?  32 LYS   A CD   5  
ATOM   2868 C CE   . LYS   A 1 32 ? 3.706   -11.085 -3.119 1.00 2.37 ?  32 LYS   A CE   5  
ATOM   2869 N NZ   . LYS   A 1 32 ? 2.737   -11.202 -4.240 1.00 2.43 1  32 LYS   A NZ   5  
ATOM   2870 H H    . LYS   A 1 32 ? 6.284   -8.455  0.836  1.00 0.37 ?  32 LYS   A H    5  
ATOM   2871 H HA   . LYS   A 1 32 ? 7.775   -9.219  -0.667 1.00 0.32 ?  32 LYS   A HA   5  
ATOM   2872 H HB2  . LYS   A 1 32 ? 5.920   -7.704  -2.485 1.00 0.88 ?  32 LYS   A HB2  5  
ATOM   2873 H HB3  . LYS   A 1 32 ? 7.199   -8.755  -3.078 1.00 0.84 ?  32 LYS   A HB3  5  
ATOM   2874 H HG2  . LYS   A 1 32 ? 6.190   -10.665 -2.075 1.00 1.65 ?  32 LYS   A HG2  5  
ATOM   2875 H HG3  . LYS   A 1 32 ? 5.030   -9.663  -1.204 1.00 1.76 ?  32 LYS   A HG3  5  
ATOM   2876 H HD2  . LYS   A 1 32 ? 4.032   -8.989  -3.337 1.00 2.05 ?  32 LYS   A HD2  5  
ATOM   2877 H HD3  . LYS   A 1 32 ? 5.195   -10.002 -4.193 1.00 1.80 ?  32 LYS   A HD3  5  
ATOM   2878 H HE2  . LYS   A 1 32 ? 4.305   -11.981 -3.081 1.00 2.75 ?  32 LYS   A HE2  5  
ATOM   2879 H HE3  . LYS   A 1 32 ? 3.159   -10.980 -2.193 1.00 3.09 ?  32 LYS   A HE3  5  
ATOM   2880 H HZ1  . LYS   A 1 32 ? 3.244   -11.291 -5.143 1.00 2.11 ?  32 LYS   A HZ1  5  
ATOM   2881 H HZ2  . LYS   A 1 32 ? 2.128   -10.360 -4.278 1.00 3.00 ?  32 LYS   A HZ2  5  
ATOM   2882 H HZ3  . LYS   A 1 32 ? 2.138   -12.042 -4.107 1.00 2.96 ?  32 LYS   A HZ3  5  
HETATM 2883 N N    . DPR   A 1 33 ? 9.419   -7.236  -0.324 1.00 0.37 ?  33 DPR   A N    5  
HETATM 2884 C CA   . DPR   A 1 33 ? 10.522  -6.263  -0.369 1.00 0.44 ?  33 DPR   A CA   5  
HETATM 2885 C CB   . DPR   A 1 33 ? 11.369  -6.602  0.861  1.00 0.59 ?  33 DPR   A CB   5  
HETATM 2886 C CG   . DPR   A 1 33 ? 10.996  -7.996  1.217  1.00 0.61 ?  33 DPR   A CG   5  
HETATM 2887 C CD   . DPR   A 1 33 ? 9.558   -8.160  0.815  1.00 0.47 ?  33 DPR   A CD   5  
HETATM 2888 C C    . DPR   A 1 33 ? 10.019  -4.827  -0.284 1.00 0.39 ?  33 DPR   A C    5  
HETATM 2889 O O    . DPR   A 1 33 ? 10.713  -3.887  -0.673 1.00 0.47 ?  33 DPR   A O    5  
HETATM 2890 H HA   . DPR   A 1 33 ? 11.121  -6.382  -1.255 1.00 0.48 ?  33 DPR   A HA   5  
HETATM 2891 H HB2  . DPR   A 1 33 ? 11.132  -5.920  1.662  1.00 0.61 ?  33 DPR   A HB2  5  
HETATM 2892 H HB3  . DPR   A 1 33 ? 12.417  -6.526  0.613  1.00 0.67 ?  33 DPR   A HB3  5  
HETATM 2893 H HG2  . DPR   A 1 33 ? 11.107  -8.142  2.279  1.00 0.70 ?  33 DPR   A HG2  5  
HETATM 2894 H HG3  . DPR   A 1 33 ? 11.619  -8.691  0.674  1.00 0.65 ?  33 DPR   A HG3  5  
HETATM 2895 H HD2  . DPR   A 1 33 ? 8.900   -7.877  1.624  1.00 0.49 ?  33 DPR   A HD2  5  
HETATM 2896 H HD3  . DPR   A 1 33 ? 9.367   -9.177  0.513  1.00 0.47 ?  33 DPR   A HD3  5  
ATOM   2897 N N    . GLY   A 1 34 ? 8.807   -4.671  0.234  1.00 0.32 ?  34 GLY   A N    5  
ATOM   2898 C CA   . GLY   A 1 34 ? 8.195   -3.365  0.325  1.00 0.30 ?  34 GLY   A CA   5  
ATOM   2899 C C    . GLY   A 1 34 ? 7.895   -2.781  -1.039 1.00 0.25 ?  34 GLY   A C    5  
ATOM   2900 O O    . GLY   A 1 34 ? 7.849   -1.564  -1.200 1.00 0.30 ?  34 GLY   A O    5  
ATOM   2901 H H    . GLY   A 1 34 ? 8.325   -5.459  0.565  1.00 0.32 ?  34 GLY   A H    5  
ATOM   2902 H HA2  . GLY   A 1 34 ? 7.273   -3.445  0.884  1.00 0.31 ?  34 GLY   A HA2  5  
ATOM   2903 H HA3  . GLY   A 1 34 ? 8.866   -2.702  0.848  1.00 0.36 ?  34 GLY   A HA3  5  
ATOM   2904 N N    . PHE   A 1 35 ? 7.696   -3.649  -2.025 1.00 0.19 ?  35 PHE   A N    5  
ATOM   2905 C CA   . PHE   A 1 35 ? 7.432   -3.205  -3.389 1.00 0.20 ?  35 PHE   A CA   5  
ATOM   2906 C C    . PHE   A 1 35 ? 5.967   -3.363  -3.762 1.00 0.17 ?  35 PHE   A C    5  
ATOM   2907 O O    . PHE   A 1 35 ? 5.451   -2.631  -4.605 1.00 0.29 ?  35 PHE   A O    5  
ATOM   2908 C CB   . PHE   A 1 35 ? 8.283   -3.990  -4.387 1.00 0.23 ?  35 PHE   A CB   5  
ATOM   2909 C CG   . PHE   A 1 35 ? 9.743   -3.644  -4.365 1.00 0.31 ?  35 PHE   A CG   5  
ATOM   2910 C CD1  . PHE   A 1 35 ? 10.680  -4.564  -3.926 1.00 0.40 ?  35 PHE   A CD1  5  
ATOM   2911 C CD2  . PHE   A 1 35 ? 10.179  -2.402  -4.794 1.00 0.37 ?  35 PHE   A CD2  5  
ATOM   2912 C CE1  . PHE   A 1 35 ? 12.025  -4.251  -3.916 1.00 0.49 ?  35 PHE   A CE1  5  
ATOM   2913 C CE2  . PHE   A 1 35 ? 11.523  -2.083  -4.784 1.00 0.46 ?  35 PHE   A CE2  5  
ATOM   2914 C CZ   . PHE   A 1 35 ? 12.447  -3.008  -4.345 1.00 0.51 ?  35 PHE   A CZ   5  
ATOM   2915 H H    . PHE   A 1 35 ? 7.737   -4.613  -1.833 1.00 0.19 ?  35 PHE   A H    5  
ATOM   2916 H HA   . PHE   A 1 35 ? 7.694   -2.161  -3.452 1.00 0.24 ?  35 PHE   A HA   5  
ATOM   2917 H HB2  . PHE   A 1 35 ? 8.192   -5.044  -4.170 1.00 0.24 ?  35 PHE   A HB2  5  
ATOM   2918 H HB3  . PHE   A 1 35 ? 7.914   -3.802  -5.384 1.00 0.27 ?  35 PHE   A HB3  5  
ATOM   2919 H HD1  . PHE   A 1 35 ? 10.351  -5.537  -3.590 1.00 0.45 ?  35 PHE   A HD1  5  
ATOM   2920 H HD2  . PHE   A 1 35 ? 9.457   -1.676  -5.137 1.00 0.40 ?  35 PHE   A HD2  5  
ATOM   2921 H HE1  . PHE   A 1 35 ? 12.748  -4.977  -3.570 1.00 0.59 ?  35 PHE   A HE1  5  
ATOM   2922 H HE2  . PHE   A 1 35 ? 11.849  -1.109  -5.118 1.00 0.54 ?  35 PHE   A HE2  5  
ATOM   2923 H HZ   . PHE   A 1 35 ? 13.497  -2.761  -4.338 1.00 0.60 ?  35 PHE   A HZ   5  
ATOM   2924 N N    . VAL   A 1 36 ? 5.294   -4.313  -3.140 1.00 0.12 ?  36 VAL   A N    5  
ATOM   2925 C CA   . VAL   A 1 36 ? 3.933   -4.633  -3.517 1.00 0.17 ?  36 VAL   A CA   5  
ATOM   2926 C C    . VAL   A 1 36 ? 2.936   -4.108  -2.498 1.00 0.15 ?  36 VAL   A C    5  
ATOM   2927 O O    . VAL   A 1 36 ? 3.023   -4.408  -1.310 1.00 0.17 ?  36 VAL   A O    5  
ATOM   2928 C CB   . VAL   A 1 36 ? 3.754   -6.152  -3.700 1.00 0.23 ?  36 VAL   A CB   5  
ATOM   2929 C CG1  . VAL   A 1 36 ? 2.293   -6.506  -3.939 1.00 0.32 ?  36 VAL   A CG1  5  
ATOM   2930 C CG2  . VAL   A 1 36 ? 4.614   -6.648  -4.854 1.00 0.25 ?  36 VAL   A CG2  5  
ATOM   2931 H H    . VAL   A 1 36 ? 5.713   -4.804  -2.400 1.00 0.17 ?  36 VAL   A H    5  
ATOM   2932 H HA   . VAL   A 1 36 ? 3.737   -4.157  -4.465 1.00 0.20 ?  36 VAL   A HA   5  
ATOM   2933 H HB   . VAL   A 1 36 ? 4.081   -6.644  -2.798 1.00 0.24 ?  36 VAL   A HB   5  
ATOM   2934 H HG11 . VAL   A 1 36 ? 1.713   -6.247  -3.066 1.00 1.12 ?  36 VAL   A HG11 5  
ATOM   2935 H HG12 . VAL   A 1 36 ? 2.205   -7.565  -4.129 1.00 1.04 ?  36 VAL   A HG12 5  
ATOM   2936 H HG13 . VAL   A 1 36 ? 1.926   -5.956  -4.791 1.00 1.00 ?  36 VAL   A HG13 5  
ATOM   2937 H HG21 . VAL   A 1 36 ? 4.296   -6.169  -5.769 1.00 1.04 ?  36 VAL   A HG21 5  
ATOM   2938 H HG22 . VAL   A 1 36 ? 4.502   -7.717  -4.953 1.00 0.94 ?  36 VAL   A HG22 5  
ATOM   2939 H HG23 . VAL   A 1 36 ? 5.650   -6.408  -4.663 1.00 1.08 ?  36 VAL   A HG23 5  
ATOM   2940 N N    . CYS   A 1 37 ? 2.005   -3.308  -2.977 1.00 0.15 ?  37 CYS   A N    5  
ATOM   2941 C CA   . CYS   A 1 37 ? 0.925   -2.790  -2.153 1.00 0.14 ?  37 CYS   A CA   5  
ATOM   2942 C C    . CYS   A 1 37 ? -0.216  -3.799  -2.113 1.00 0.12 ?  37 CYS   A C    5  
ATOM   2943 O O    . CYS   A 1 37 ? -0.916  -3.998  -3.110 1.00 0.18 ?  37 CYS   A O    5  
ATOM   2944 C CB   . CYS   A 1 37 ? 0.446   -1.451  -2.728 1.00 0.16 ?  37 CYS   A CB   5  
ATOM   2945 S SG   . CYS   A 1 37 ? -0.998  -0.719  -1.894 1.00 0.14 ?  37 CYS   A SG   5  
ATOM   2946 H H    . CYS   A 1 37 ? 2.041   -3.053  -3.922 1.00 0.16 ?  37 CYS   A H    5  
ATOM   2947 H HA   . CYS   A 1 37 ? 1.304   -2.639  -1.152 1.00 0.14 ?  37 CYS   A HA   5  
ATOM   2948 H HB2  . CYS   A 1 37 ? 1.252   -0.734  -2.668 1.00 0.20 ?  37 CYS   A HB2  5  
ATOM   2949 H HB3  . CYS   A 1 37 ? 0.184   -1.597  -3.765 1.00 0.18 ?  37 CYS   A HB3  5  
ATOM   2950 N N    . LYS   A 1 38 ? -0.390  -4.458  -0.975 1.00 0.10 ?  38 LYS   A N    5  
ATOM   2951 C CA   . LYS   A 1 38 ? -1.407  -5.488  -0.853 1.00 0.11 ?  38 LYS   A CA   5  
ATOM   2952 C C    . LYS   A 1 38 ? -2.580  -4.987  -0.026 1.00 0.11 ?  38 LYS   A C    5  
ATOM   2953 O O    . LYS   A 1 38 ? -2.442  -4.691  1.163  1.00 0.12 ?  38 LYS   A O    5  
ATOM   2954 C CB   . LYS   A 1 38 ? -0.821  -6.760  -0.238 1.00 0.15 ?  38 LYS   A CB   5  
ATOM   2955 C CG   . LYS   A 1 38 ? -1.797  -7.919  -0.223 1.00 0.26 ?  38 LYS   A CG   5  
ATOM   2956 C CD   . LYS   A 1 38 ? -1.139  -9.203  0.254  1.00 0.70 ?  38 LYS   A CD   5  
ATOM   2957 C CE   . LYS   A 1 38 ? -2.126  -10.362 0.284  1.00 1.19 ?  38 LYS   A CE   5  
ATOM   2958 N NZ   . LYS   A 1 38 ? -3.226  -10.136 1.259  1.00 2.16 1  38 LYS   A NZ   5  
ATOM   2959 H H    . LYS   A 1 38 ? 0.165   -4.231  -0.191 1.00 0.13 ?  38 LYS   A H    5  
ATOM   2960 H HA   . LYS   A 1 38 ? -1.763  -5.714  -1.846 1.00 0.12 ?  38 LYS   A HA   5  
ATOM   2961 H HB2  . LYS   A 1 38 ? 0.053   -7.054  -0.801 1.00 0.14 ?  38 LYS   A HB2  5  
ATOM   2962 H HB3  . LYS   A 1 38 ? -0.531  -6.551  0.782  1.00 0.19 ?  38 LYS   A HB3  5  
ATOM   2963 H HG2  . LYS   A 1 38 ? -2.608  -7.674  0.439  1.00 0.63 ?  38 LYS   A HG2  5  
ATOM   2964 H HG3  . LYS   A 1 38 ? -2.180  -8.071  -1.219 1.00 0.69 ?  38 LYS   A HG3  5  
ATOM   2965 H HD2  . LYS   A 1 38 ? -0.328  -9.450  -0.415 1.00 1.20 ?  38 LYS   A HD2  5  
ATOM   2966 H HD3  . LYS   A 1 38 ? -0.752  -9.047  1.250  1.00 1.36 ?  38 LYS   A HD3  5  
ATOM   2967 H HE2  . LYS   A 1 38 ? -2.552  -10.482 -0.701 1.00 1.63 ?  38 LYS   A HE2  5  
ATOM   2968 H HE3  . LYS   A 1 38 ? -1.596  -11.263 0.556  1.00 1.57 ?  38 LYS   A HE3  5  
ATOM   2969 H HZ1  . LYS   A 1 38 ? -3.791  -11.000 1.368  1.00 2.60 ?  38 LYS   A HZ1  5  
ATOM   2970 H HZ2  . LYS   A 1 38 ? -3.850  -9.372  0.929  1.00 2.57 ?  38 LYS   A HZ2  5  
ATOM   2971 H HZ3  . LYS   A 1 38 ? -2.832  -9.870  2.189  1.00 2.71 ?  38 LYS   A HZ3  5  
ATOM   2972 N N    . CYS   A 1 39 ? -3.734  -4.911  -0.663 1.00 0.12 ?  39 CYS   A N    5  
ATOM   2973 C CA   . CYS   A 1 39 ? -4.916  -4.343  -0.048 1.00 0.12 ?  39 CYS   A CA   5  
ATOM   2974 C C    . CYS   A 1 39 ? -5.701  -5.399  0.717  1.00 0.15 ?  39 CYS   A C    5  
ATOM   2975 O O    . CYS   A 1 39 ? -5.696  -6.578  0.362  1.00 0.19 ?  39 CYS   A O    5  
ATOM   2976 C CB   . CYS   A 1 39 ? -5.807  -3.717  -1.119 1.00 0.13 ?  39 CYS   A CB   5  
ATOM   2977 S SG   . CYS   A 1 39 ? -4.941  -2.570  -2.238 1.00 0.14 ?  39 CYS   A SG   5  
ATOM   2978 H H    . CYS   A 1 39 ? -3.797  -5.260  -1.574 1.00 0.16 ?  39 CYS   A H    5  
ATOM   2979 H HA   . CYS   A 1 39 ? -4.600  -3.576  0.637  1.00 0.11 ?  39 CYS   A HA   5  
ATOM   2980 H HB2  . CYS   A 1 39 ? -6.239  -4.500  -1.720 1.00 0.15 ?  39 CYS   A HB2  5  
ATOM   2981 H HB3  . CYS   A 1 39 ? -6.600  -3.164  -0.634 1.00 0.15 ?  39 CYS   A HB3  5  
ATOM   2982 N N    . TYR   A 1 40 ? -6.370  -4.963  1.768  1.00 0.18 ?  40 TYR   A N    5  
ATOM   2983 C CA   . TYR   A 1 40 ? -7.218  -5.828  2.568  1.00 0.25 ?  40 TYR   A CA   5  
ATOM   2984 C C    . TYR   A 1 40 ? -8.470  -5.068  2.972  1.00 0.32 ?  40 TYR   A C    5  
ATOM   2985 O O    . TYR   A 1 40 ? -8.421  -3.864  3.211  1.00 0.88 ?  40 TYR   A O    5  
ATOM   2986 C CB   . TYR   A 1 40 ? -6.474  -6.339  3.807  1.00 0.27 ?  40 TYR   A CB   5  
ATOM   2987 C CG   . TYR   A 1 40 ? -6.013  -5.252  4.754  1.00 0.25 ?  40 TYR   A CG   5  
ATOM   2988 C CD1  . TYR   A 1 40 ? -4.771  -4.646  4.599  1.00 0.22 ?  40 TYR   A CD1  5  
ATOM   2989 C CD2  . TYR   A 1 40 ? -6.824  -4.826  5.794  1.00 0.32 ?  40 TYR   A CD2  5  
ATOM   2990 C CE1  . TYR   A 1 40 ? -4.354  -3.648  5.457  1.00 0.25 ?  40 TYR   A CE1  5  
ATOM   2991 C CE2  . TYR   A 1 40 ? -6.414  -3.829  6.655  1.00 0.35 ?  40 TYR   A CE2  5  
ATOM   2992 C CZ   . TYR   A 1 40 ? -5.151  -3.270  6.500  1.00 0.31 ?  40 TYR   A CZ   5  
ATOM   2993 O OH   . TYR   A 1 40 ? -4.771  -2.248  7.341  1.00 0.37 ?  40 TYR   A OH   5  
ATOM   2994 H H    . TYR   A 1 40 ? -6.296  -4.012  2.014  1.00 0.18 ?  40 TYR   A H    5  
ATOM   2995 H HA   . TYR   A 1 40 ? -7.502  -6.671  1.954  1.00 0.31 ?  40 TYR   A HA   5  
ATOM   2996 H HB2  . TYR   A 1 40 ? -7.124  -7.000  4.361  1.00 0.32 ?  40 TYR   A HB2  5  
ATOM   2997 H HB3  . TYR   A 1 40 ? -5.602  -6.890  3.488  1.00 0.28 ?  40 TYR   A HB3  5  
ATOM   2998 H HD1  . TYR   A 1 40 ? -4.125  -4.967  3.794  1.00 0.22 ?  40 TYR   A HD1  5  
ATOM   2999 H HD2  . TYR   A 1 40 ? -7.789  -5.290  5.931  1.00 0.36 ?  40 TYR   A HD2  5  
ATOM   3000 H HE1  . TYR   A 1 40 ? -3.386  -3.191  5.321  1.00 0.26 ?  40 TYR   A HE1  5  
ATOM   3001 H HE2  . TYR   A 1 40 ? -7.060  -3.512  7.459  1.00 0.41 ?  40 TYR   A HE2  5  
ATOM   3002 H HH   . TYR   A 1 40 ? -4.367  -1.535  6.832  1.00 1.13 ?  40 TYR   A HH   5  
HETATM 3003 N N    . NH2   A 1 41 ? -9.593  -5.752  3.008  1.00 0.59 ?  41 NH2   A N    5  
HETATM 3004 H HN1  . NH2   A 1 41 ? -9.560  -6.711  2.806  1.00 1.06 ?  41 NH2   A HN1  5  
HETATM 3005 H HN2  . NH2   A 1 41 ? -10.418 -5.276  3.241  1.00 0.56 ?  41 NH2   A HN2  5  
ATOM   3006 N N    . GLY   A 1 1  ? 4.208   3.787   -8.709 1.00 1.74 ?  1  GLY   A N    6  
ATOM   3007 C CA   . GLY   A 1 1  ? 3.810   2.765   -7.710 1.00 0.89 ?  1  GLY   A CA   6  
ATOM   3008 C C    . GLY   A 1 1  ? 2.799   3.308   -6.729 1.00 0.90 ?  1  GLY   A C    6  
ATOM   3009 O O    . GLY   A 1 1  ? 2.319   4.428   -6.888 1.00 1.76 ?  1  GLY   A O    6  
ATOM   3010 H H1   . GLY   A 1 1  ? 3.374   4.115   -9.234 1.00 2.34 ?  1  GLY   A H1   6  
ATOM   3011 H H2   . GLY   A 1 1  ? 4.892   3.388   -9.377 1.00 1.93 ?  1  GLY   A H2   6  
ATOM   3012 H H3   . GLY   A 1 1  ? 4.645   4.600   -8.230 1.00 2.29 ?  1  GLY   A H3   6  
ATOM   3013 H HA2  . GLY   A 1 1  ? 3.379   1.918   -8.224 1.00 0.93 ?  1  GLY   A HA2  6  
ATOM   3014 H HA3  . GLY   A 1 1  ? 4.687   2.441   -7.169 1.00 1.19 ?  1  GLY   A HA3  6  
ATOM   3015 N N    . PHE   A 1 2  ? 2.468   2.525   -5.713 1.00 0.43 ?  2  PHE   A N    6  
ATOM   3016 C CA   . PHE   A 1 2  ? 1.502   2.954   -4.717 1.00 0.24 ?  2  PHE   A CA   6  
ATOM   3017 C C    . PHE   A 1 2  ? 2.154   3.062   -3.347 1.00 0.22 ?  2  PHE   A C    6  
ATOM   3018 O O    . PHE   A 1 2  ? 1.608   2.602   -2.346 1.00 0.35 ?  2  PHE   A O    6  
ATOM   3019 C CB   . PHE   A 1 2  ? 0.315   1.987   -4.668 1.00 0.16 ?  2  PHE   A CB   6  
ATOM   3020 C CG   . PHE   A 1 2  ? -0.321  1.776   -6.008 1.00 0.18 ?  2  PHE   A CG   6  
ATOM   3021 C CD1  . PHE   A 1 2  ? -0.234  0.552   -6.650 1.00 0.25 ?  2  PHE   A CD1  6  
ATOM   3022 C CD2  . PHE   A 1 2  ? -0.995  2.809   -6.632 1.00 0.22 ?  2  PHE   A CD2  6  
ATOM   3023 C CE1  . PHE   A 1 2  ? -0.810  0.363   -7.891 1.00 0.30 ?  2  PHE   A CE1  6  
ATOM   3024 C CE2  . PHE   A 1 2  ? -1.573  2.629   -7.872 1.00 0.28 ?  2  PHE   A CE2  6  
ATOM   3025 C CZ   . PHE   A 1 2  ? -1.481  1.403   -8.502 1.00 0.29 ?  2  PHE   A CZ   6  
ATOM   3026 H H    . PHE   A 1 2  ? 2.879   1.638   -5.635 1.00 1.00 ?  2  PHE   A H    6  
ATOM   3027 H HA   . PHE   A 1 2  ? 1.147   3.929   -5.009 1.00 0.34 ?  2  PHE   A HA   6  
ATOM   3028 H HB2  . PHE   A 1 2  ? 0.651   1.030   -4.299 1.00 0.26 ?  2  PHE   A HB2  6  
ATOM   3029 H HB3  . PHE   A 1 2  ? -0.436  2.381   -4.000 1.00 0.20 ?  2  PHE   A HB3  6  
ATOM   3030 H HD1  . PHE   A 1 2  ? 0.291   -0.261  -6.171 1.00 0.32 ?  2  PHE   A HD1  6  
ATOM   3031 H HD2  . PHE   A 1 2  ? -1.069  3.767   -6.137 1.00 0.27 ?  2  PHE   A HD2  6  
ATOM   3032 H HE1  . PHE   A 1 2  ? -0.735  -0.595  -8.381 1.00 0.37 ?  2  PHE   A HE1  6  
ATOM   3033 H HE2  . PHE   A 1 2  ? -2.096  3.444   -8.347 1.00 0.36 ?  2  PHE   A HE2  6  
ATOM   3034 H HZ   . PHE   A 1 2  ? -1.932  1.259   -9.472 1.00 0.34 ?  2  PHE   A HZ   6  
ATOM   3035 N N    . GLY   A 1 3  ? 3.338   3.654   -3.313 1.00 0.18 ?  3  GLY   A N    6  
ATOM   3036 C CA   . GLY   A 1 3  ? 4.020   3.867   -2.056 1.00 0.20 ?  3  GLY   A CA   6  
ATOM   3037 C C    . GLY   A 1 3  ? 5.117   2.861   -1.798 1.00 0.19 ?  3  GLY   A C    6  
ATOM   3038 O O    . GLY   A 1 3  ? 6.093   3.166   -1.121 1.00 0.21 ?  3  GLY   A O    6  
ATOM   3039 H H    . GLY   A 1 3  ? 3.749   3.962   -4.150 1.00 0.21 ?  3  GLY   A H    6  
ATOM   3040 H HA2  . GLY   A 1 3  ? 4.451   4.856   -2.056 1.00 0.23 ?  3  GLY   A HA2  6  
ATOM   3041 H HA3  . GLY   A 1 3  ? 3.297   3.800   -1.259 1.00 0.24 ?  3  GLY   A HA3  6  
ATOM   3042 N N    . CYS   A 1 4  ? 4.955   1.662   -2.333 1.00 0.25 ?  4  CYS   A N    6  
ATOM   3043 C CA   . CYS   A 1 4  ? 5.918   0.591   -2.119 1.00 0.27 ?  4  CYS   A CA   6  
ATOM   3044 C C    . CYS   A 1 4  ? 6.883   0.472   -3.294 1.00 0.29 ?  4  CYS   A C    6  
ATOM   3045 O O    . CYS   A 1 4  ? 6.486   0.084   -4.396 1.00 0.30 ?  4  CYS   A O    6  
ATOM   3046 C CB   . CYS   A 1 4  ? 5.187   -0.734  -1.908 1.00 0.28 ?  4  CYS   A CB   6  
ATOM   3047 S SG   . CYS   A 1 4  ? 4.130   -0.773  -0.425 1.00 0.39 ?  4  CYS   A SG   6  
ATOM   3048 H H    . CYS   A 1 4  ? 4.166   1.490   -2.881 1.00 0.30 ?  4  CYS   A H    6  
ATOM   3049 H HA   . CYS   A 1 4  ? 6.483   0.824   -1.229 1.00 0.30 ?  4  CYS   A HA   6  
ATOM   3050 H HB2  . CYS   A 1 4  ? 4.557   -0.930  -2.764 1.00 0.21 ?  4  CYS   A HB2  6  
ATOM   3051 H HB3  . CYS   A 1 4  ? 5.913   -1.527  -1.814 1.00 0.42 ?  4  CYS   A HB3  6  
ATOM   3052 N N    . ASN   A 1 5  ? 8.144   0.828   -3.062 1.00 0.34 ?  5  ASN   A N    6  
ATOM   3053 C CA   . ASN   A 1 5  ? 9.179   0.693   -4.082 1.00 0.40 ?  5  ASN   A CA   6  
ATOM   3054 C C    . ASN   A 1 5  ? 10.492  0.197   -3.474 1.00 0.40 ?  5  ASN   A C    6  
ATOM   3055 O O    . ASN   A 1 5  ? 11.572  0.503   -3.980 1.00 0.47 ?  5  ASN   A O    6  
ATOM   3056 C CB   . ASN   A 1 5  ? 9.427   2.025   -4.801 1.00 0.49 ?  5  ASN   A CB   6  
ATOM   3057 C CG   . ASN   A 1 5  ? 8.199   2.557   -5.515 1.00 0.49 ?  5  ASN   A CG   6  
ATOM   3058 O OD1  . ASN   A 1 5  ? 7.928   2.190   -6.658 1.00 0.65 ?  5  ASN   A OD1  6  
ATOM   3059 N ND2  . ASN   A 1 5  ? 7.461   3.442   -4.860 1.00 0.56 ?  5  ASN   A ND2  6  
ATOM   3060 H H    . ASN   A 1 5  ? 8.382   1.203   -2.183 1.00 0.36 ?  5  ASN   A H    6  
ATOM   3061 H HA   . ASN   A 1 5  ? 8.836   -0.034  -4.802 1.00 0.43 ?  5  ASN   A HA   6  
ATOM   3062 H HB2  . ASN   A 1 5  ? 9.744   2.761   -4.079 1.00 0.51 ?  5  ASN   A HB2  6  
ATOM   3063 H HB3  . ASN   A 1 5  ? 10.213  1.888   -5.530 1.00 0.57 ?  5  ASN   A HB3  6  
ATOM   3064 H HD21 . ASN   A 1 5  ? 7.742   3.708   -3.957 1.00 0.70 ?  5  ASN   A HD21 6  
ATOM   3065 H HD22 . ASN   A 1 5  ? 6.665   3.802   -5.305 1.00 0.61 ?  5  ASN   A HD22 6  
ATOM   3066 N N    . GLY   A 1 6  ? 10.405  -0.552  -2.383 1.00 0.36 ?  6  GLY   A N    6  
ATOM   3067 C CA   . GLY   A 1 6  ? 11.601  -1.106  -1.778 1.00 0.38 ?  6  GLY   A CA   6  
ATOM   3068 C C    . GLY   A 1 6  ? 11.710  -0.810  -0.294 1.00 0.37 ?  6  GLY   A C    6  
ATOM   3069 O O    . GLY   A 1 6  ? 10.849  -0.139  0.272  1.00 0.36 ?  6  GLY   A O    6  
ATOM   3070 H H    . GLY   A 1 6  ? 9.525   -0.735  -1.984 1.00 0.34 ?  6  GLY   A H    6  
ATOM   3071 H HA2  . GLY   A 1 6  ? 11.592  -2.178  -1.918 1.00 0.48 ?  6  GLY   A HA2  6  
ATOM   3072 H HA3  . GLY   A 1 6  ? 12.464  -0.697  -2.282 1.00 0.44 ?  6  GLY   A HA3  6  
HETATM 3073 C C2   . 6ZS   A 1 7  ? 14.909  -1.270  3.438  1.00 1.49 ?  7  6ZS   A C2   6  
HETATM 3074 N N    . 6ZS   A 1 7  ? 12.793  -1.301  0.317  1.00 0.47 ?  7  6ZS   A N    6  
HETATM 3075 C CA   . 6ZS   A 1 7  ? 13.030  -1.188  1.766  1.00 0.61 ?  7  6ZS   A CA   6  
HETATM 3076 C CB1  . 6ZS   A 1 7  ? 12.010  -2.029  2.514  1.00 0.71 ?  7  6ZS   A CB1  6  
HETATM 3077 C C    . 6ZS   A 1 7  ? 12.933  0.283   2.214  1.00 0.59 ?  7  6ZS   A C    6  
HETATM 3078 O O    . 6ZS   A 1 7  ? 12.243  0.610   3.184  1.00 1.09 ?  7  6ZS   A O    6  
HETATM 3079 C CB   . 6ZS   A 1 7  ? 14.414  -1.751  2.085  1.00 0.75 ?  7  6ZS   A CB   6  
HETATM 3080 H H1   . 6ZS   A 1 7  ? 15.915  -1.627  3.603  1.00 2.14 ?  7  6ZS   A H1   6  
HETATM 3081 H H4   . 6ZS   A 1 7  ? 14.904  -0.190  3.461  1.00 1.94 ?  7  6ZS   A H4   6  
HETATM 3082 H H3   . 6ZS   A 1 7  ? 14.264  -1.648  4.216  1.00 2.00 ?  7  6ZS   A H3   6  
HETATM 3083 H H    . 6ZS   A 1 7  ? 13.464  -1.766  -0.227 1.00 0.49 ?  7  6ZS   A H    6  
HETATM 3084 H H7   . 6ZS   A 1 7  ? 12.154  -3.071  2.267  1.00 1.10 ?  7  6ZS   A H7   6  
HETATM 3085 H H8   . 6ZS   A 1 7  ? 11.017  -1.726  2.226  1.00 1.35 ?  7  6ZS   A H8   6  
HETATM 3086 H H9   . 6ZS   A 1 7  ? 12.134  -1.889  3.576  1.00 1.26 ?  7  6ZS   A H9   6  
HETATM 3087 H H10  . 6ZS   A 1 7  ? 14.370  -2.832  2.104  1.00 1.09 ?  7  6ZS   A H10  6  
HETATM 3088 H H11  . 6ZS   A 1 7  ? 15.122  -1.432  1.332  1.00 1.38 ?  7  6ZS   A H11  6  
ATOM   3089 N N    . TRP   A 1 8  ? 13.617  1.164   1.501  1.00 0.64 ?  8  TRP   A N    6  
ATOM   3090 C CA   . TRP   A 1 8  ? 13.664  2.570   1.867  1.00 0.67 ?  8  TRP   A CA   6  
ATOM   3091 C C    . TRP   A 1 8  ? 12.593  3.352   1.125  1.00 0.49 ?  8  TRP   A C    6  
ATOM   3092 O O    . TRP   A 1 8  ? 12.596  4.583   1.105  1.00 0.58 ?  8  TRP   A O    6  
ATOM   3093 C CB   . TRP   A 1 8  ? 15.045  3.149   1.571  1.00 0.87 ?  8  TRP   A CB   6  
ATOM   3094 C CG   . TRP   A 1 8  ? 16.138  2.478   2.343  1.00 1.12 ?  8  TRP   A CG   6  
ATOM   3095 C CD1  . TRP   A 1 8  ? 17.087  1.633   1.848  1.00 1.27 ?  8  TRP   A CD1  6  
ATOM   3096 C CD2  . TRP   A 1 8  ? 16.386  2.581   3.751  1.00 1.31 ?  8  TRP   A CD2  6  
ATOM   3097 N NE1  . TRP   A 1 8  ? 17.915  1.210   2.857  1.00 1.50 ?  8  TRP   A NE1  6  
ATOM   3098 C CE2  . TRP   A 1 8  ? 17.506  1.777   4.035  1.00 1.52 ?  8  TRP   A CE2  6  
ATOM   3099 C CE3  . TRP   A 1 8  ? 15.772  3.277   4.796  1.00 1.37 ?  8  TRP   A CE3  6  
ATOM   3100 C CZ2  . TRP   A 1 8  ? 18.021  1.650   5.323  1.00 1.76 ?  8  TRP   A CZ2  6  
ATOM   3101 C CZ3  . TRP   A 1 8  ? 16.286  3.151   6.072  1.00 1.63 ?  8  TRP   A CZ3  6  
ATOM   3102 C CH2  . TRP   A 1 8  ? 17.400  2.343   6.326  1.00 1.80 ?  8  TRP   A CH2  6  
ATOM   3103 H H    . TRP   A 1 8  ? 14.091  0.865   0.699  1.00 1.04 ?  8  TRP   A H    6  
ATOM   3104 H HA   . TRP   A 1 8  ? 13.474  2.639   2.925  1.00 0.76 ?  8  TRP   A HA   6  
ATOM   3105 H HB2  . TRP   A 1 8  ? 15.256  3.035   0.520  1.00 0.85 ?  8  TRP   A HB2  6  
ATOM   3106 H HB3  . TRP   A 1 8  ? 15.051  4.197   1.822  1.00 0.91 ?  8  TRP   A HB3  6  
ATOM   3107 H HD1  . TRP   A 1 8  ? 17.165  1.351   0.810  1.00 1.25 ?  8  TRP   A HD1  6  
ATOM   3108 H HE1  . TRP   A 1 8  ? 18.679  0.597   2.748  1.00 1.65 ?  8  TRP   A HE1  6  
ATOM   3109 H HE3  . TRP   A 1 8  ? 14.913  3.905   4.621  1.00 1.26 ?  8  TRP   A HE3  6  
ATOM   3110 H HZ2  . TRP   A 1 8  ? 18.877  1.032   5.538  1.00 1.93 ?  8  TRP   A HZ2  6  
ATOM   3111 H HZ3  . TRP   A 1 8  ? 15.823  3.680   6.893  1.00 1.73 ?  8  TRP   A HZ3  6  
ATOM   3112 H HH2  . TRP   A 1 8  ? 17.769  2.271   7.338  1.00 2.00 ?  8  TRP   A HH2  6  
ATOM   3113 N N    . ASN   A 1 9  ? 11.683  2.618   0.512  1.00 0.33 ?  9  ASN   A N    6  
ATOM   3114 C CA   . ASN   A 1 9  ? 10.566  3.205   -0.204 1.00 0.29 ?  9  ASN   A CA   6  
ATOM   3115 C C    . ASN   A 1 9  ? 9.280   2.520   0.226  1.00 0.25 ?  9  ASN   A C    6  
ATOM   3116 O O    . ASN   A 1 9  ? 8.500   2.068   -0.605 1.00 0.36 ?  9  ASN   A O    6  
ATOM   3117 C CB   . ASN   A 1 9  ? 10.745  3.057   -1.719 1.00 0.46 ?  9  ASN   A CB   6  
ATOM   3118 C CG   . ASN   A 1 9  ? 11.920  3.835   -2.278 1.00 1.31 ?  9  ASN   A CG   6  
ATOM   3119 O OD1  . ASN   A 1 9  ? 12.262  4.918   -1.799 1.00 2.05 ?  9  ASN   A OD1  6  
ATOM   3120 N ND2  . ASN   A 1 9  ? 12.550  3.282   -3.305 1.00 1.88 ?  9  ASN   A ND2  6  
ATOM   3121 H H    . ASN   A 1 9  ? 11.757  1.638   0.550  1.00 0.35 ?  9  ASN   A H    6  
ATOM   3122 H HA   . ASN   A 1 9  ? 10.514  4.250   0.053  1.00 0.37 ?  9  ASN   A HA   6  
ATOM   3123 H HB2  . ASN   A 1 9  ? 10.895  2.015   -1.953 1.00 1.10 ?  9  ASN   A HB2  6  
ATOM   3124 H HB3  . ASN   A 1 9  ? 9.848   3.400   -2.209 1.00 0.63 ?  9  ASN   A HB3  6  
ATOM   3125 H HD21 . ASN   A 1 9  ? 12.227  2.415   -3.636 1.00 2.03 ?  9  ASN   A HD21 6  
ATOM   3126 H HD22 . ASN   A 1 9  ? 13.311  3.758   -3.694 1.00 2.48 ?  9  ASN   A HD22 6  
ATOM   3127 N N    . GLU   A 1 10 ? 9.086   2.416   1.530  1.00 0.23 ?  10 GLU   A N    6  
ATOM   3128 C CA   . GLU   A 1 10 ? 7.908   1.765   2.075  1.00 0.26 ?  10 GLU   A CA   6  
ATOM   3129 C C    . GLU   A 1 10 ? 6.931   2.800   2.614  1.00 0.28 ?  10 GLU   A C    6  
ATOM   3130 O O    . GLU   A 1 10 ? 6.848   3.030   3.825  1.00 0.49 ?  10 GLU   A O    6  
ATOM   3131 C CB   . GLU   A 1 10 ? 8.304   0.785   3.188  1.00 0.39 ?  10 GLU   A CB   6  
ATOM   3132 C CG   . GLU   A 1 10 ? 7.131   0.004   3.758  1.00 0.45 ?  10 GLU   A CG   6  
ATOM   3133 C CD   . GLU   A 1 10 ? 7.474   -0.718  5.045  1.00 0.68 ?  10 GLU   A CD   6  
ATOM   3134 O OE1  . GLU   A 1 10 ? 7.339   -0.107  6.127  1.00 0.95 ?  10 GLU   A OE1  6  
ATOM   3135 O OE2  . GLU   A 1 10 ? 7.865   -1.902  4.988  1.00 0.78 -1 10 GLU   A OE2  6  
ATOM   3136 H H    . GLU   A 1 10 ? 9.750   2.789   2.145  1.00 0.28 ?  10 GLU   A H    6  
ATOM   3137 H HA   . GLU   A 1 10 ? 7.430   1.219   1.276  1.00 0.27 ?  10 GLU   A HA   6  
ATOM   3138 H HB2  . GLU   A 1 10 ? 9.019   0.081   2.794  1.00 0.43 ?  10 GLU   A HB2  6  
ATOM   3139 H HB3  . GLU   A 1 10 ? 8.763   1.339   3.993  1.00 0.48 ?  10 GLU   A HB3  6  
ATOM   3140 H HG2  . GLU   A 1 10 ? 6.324   0.689   3.953  1.00 0.47 ?  10 GLU   A HG2  6  
ATOM   3141 H HG3  . GLU   A 1 10 ? 6.811   -0.723  3.029  1.00 0.40 ?  10 GLU   A HG3  6  
ATOM   3142 N N    . ASP   A 1 11 ? 6.200   3.440   1.719  1.00 0.23 ?  11 ASP   A N    6  
ATOM   3143 C CA   . ASP   A 1 11 ? 5.175   4.381   2.138  1.00 0.30 ?  11 ASP   A CA   6  
ATOM   3144 C C    . ASP   A 1 11 ? 3.846   3.647   2.293  1.00 0.23 ?  11 ASP   A C    6  
ATOM   3145 O O    . ASP   A 1 11 ? 2.927   3.779   1.476  1.00 0.20 ?  11 ASP   A O    6  
ATOM   3146 C CB   . ASP   A 1 11 ? 5.052   5.553   1.158  1.00 0.38 ?  11 ASP   A CB   6  
ATOM   3147 C CG   . ASP   A 1 11 ? 4.164   6.662   1.695  1.00 0.99 ?  11 ASP   A CG   6  
ATOM   3148 O OD1  . ASP   A 1 11 ? 3.749   7.539   0.907  1.00 1.86 ?  11 ASP   A OD1  6  
ATOM   3149 O OD2  . ASP   A 1 11 ? 3.865   6.655   2.909  1.00 1.32 -1 11 ASP   A OD2  6  
ATOM   3150 H H    . ASP   A 1 11 ? 6.350   3.274   0.761  1.00 0.30 ?  11 ASP   A H    6  
ATOM   3151 H HA   . ASP   A 1 11 ? 5.466   4.764   3.105  1.00 0.38 ?  11 ASP   A HA   6  
ATOM   3152 H HB2  . ASP   A 1 11 ? 6.034   5.962   0.970  1.00 0.94 ?  11 ASP   A HB2  6  
ATOM   3153 H HB3  . ASP   A 1 11 ? 4.632   5.196   0.231  1.00 0.78 ?  11 ASP   A HB3  6  
ATOM   3154 N N    . ASP   A 1 12 ? 3.777   2.859   3.361  1.00 0.25 ?  12 ASP   A N    6  
ATOM   3155 C CA   . ASP   A 1 12 ? 2.602   2.046   3.681  1.00 0.26 ?  12 ASP   A CA   6  
ATOM   3156 C C    . ASP   A 1 12 ? 1.362   2.919   3.804  1.00 0.18 ?  12 ASP   A C    6  
ATOM   3157 O O    . ASP   A 1 12 ? 0.259   2.499   3.453  1.00 0.18 ?  12 ASP   A O    6  
ATOM   3158 C CB   . ASP   A 1 12 ? 2.844   1.284   4.989  1.00 0.39 ?  12 ASP   A CB   6  
ATOM   3159 C CG   . ASP   A 1 12 ? 1.645   0.473   5.450  1.00 0.82 ?  12 ASP   A CG   6  
ATOM   3160 O OD1  . ASP   A 1 12 ? 1.561   -0.728  5.107  1.00 1.45 ?  12 ASP   A OD1  6  
ATOM   3161 O OD2  . ASP   A 1 12 ? 0.759   1.045   6.119  1.00 1.50 -1 12 ASP   A OD2  6  
ATOM   3162 H H    . ASP   A 1 12 ? 4.550   2.829   3.964  1.00 0.31 ?  12 ASP   A H    6  
ATOM   3163 H HA   . ASP   A 1 12 ? 2.457   1.338   2.879  1.00 0.27 ?  12 ASP   A HA   6  
ATOM   3164 H HB2  . ASP   A 1 12 ? 3.670   0.608   4.850  1.00 1.12 ?  12 ASP   A HB2  6  
ATOM   3165 H HB3  . ASP   A 1 12 ? 3.097   1.988   5.764  1.00 1.15 ?  12 ASP   A HB3  6  
HETATM 3166 N N    . 2ML   A 1 13 ? 1.571   4.144   4.284  1.00 0.18 ?  13 2ML   A N    6  
HETATM 3167 C CA   . 2ML   A 1 13 ? 0.500   5.127   4.457  1.00 0.19 ?  13 2ML   A CA   6  
HETATM 3168 C CB1  . 2ML   A 1 13 ? 1.124   6.426   4.977  1.00 0.24 ?  13 2ML   A CB1  6  
HETATM 3169 C CB2  . 2ML   A 1 13 ? -0.502  4.628   5.486  1.00 0.25 ?  13 2ML   A CB2  6  
HETATM 3170 C CG   . 2ML   A 1 13 ? 0.072   7.391   5.553  1.00 0.33 ?  13 2ML   A CG   6  
HETATM 3171 C CD1  . 2ML   A 1 13 ? 0.738   8.381   6.498  1.00 0.57 ?  13 2ML   A CD1  6  
HETATM 3172 C CD2  . 2ML   A 1 13 ? -0.656  8.148   4.450  1.00 0.54 ?  13 2ML   A CD2  6  
HETATM 3173 C C    . 2ML   A 1 13 ? -0.173  5.347   3.091  1.00 0.16 ?  13 2ML   A C    6  
HETATM 3174 O O    . 2ML   A 1 13 ? -1.400  5.397   2.983  1.00 0.17 ?  13 2ML   A O    6  
HETATM 3175 H H    . 2ML   A 1 13 ? 2.484   4.401   4.528  1.00 0.20 ?  13 2ML   A H    6  
HETATM 3176 H HB11 . 2ML   A 1 13 ? 1.634   6.919   4.166  1.00 0.28 ?  13 2ML   A HB11 6  
HETATM 3177 H HB12 . 2ML   A 1 13 ? 1.842   6.185   5.749  1.00 0.32 ?  13 2ML   A HB12 6  
HETATM 3178 H HB21 . 2ML   A 1 13 ? -0.075  4.707   6.475  1.00 0.92 ?  13 2ML   A HB21 6  
HETATM 3179 H HB22 . 2ML   A 1 13 ? -0.735  3.595   5.282  1.00 0.95 ?  13 2ML   A HB22 6  
HETATM 3180 H HB23 . 2ML   A 1 13 ? -1.404  5.217   5.431  1.00 1.02 ?  13 2ML   A HB23 6  
HETATM 3181 H HG   . 2ML   A 1 13 ? -0.656  6.828   6.117  1.00 0.64 ?  13 2ML   A HG   6  
HETATM 3182 H HD11 . 2ML   A 1 13 ? 1.196   7.846   7.319  1.00 1.31 ?  13 2ML   A HD11 6  
HETATM 3183 H HD12 . 2ML   A 1 13 ? -0.001  9.066   6.884  1.00 0.88 ?  13 2ML   A HD12 6  
HETATM 3184 H HD13 . 2ML   A 1 13 ? 1.497   8.934   5.964  1.00 1.28 ?  13 2ML   A HD13 6  
HETATM 3185 H HD21 . 2ML   A 1 13 ? 0.046   8.770   3.917  1.00 1.20 ?  13 2ML   A HD21 6  
HETATM 3186 H HD22 . 2ML   A 1 13 ? -1.428  8.767   4.885  1.00 1.15 ?  13 2ML   A HD22 6  
HETATM 3187 H HD23 . 2ML   A 1 13 ? -1.103  7.443   3.765  1.00 1.05 ?  13 2ML   A HD23 6  
ATOM   3188 N N    . ARG   A 1 14 ? 0.647   5.433   2.049  1.00 0.14 ?  14 ARG   A N    6  
ATOM   3189 C CA   . ARG   A 1 14 ? 0.158   5.716   0.706  1.00 0.16 ?  14 ARG   A CA   6  
ATOM   3190 C C    . ARG   A 1 14 ? -0.531  4.492   0.129  1.00 0.12 ?  14 ARG   A C    6  
ATOM   3191 O O    . ARG   A 1 14 ? -1.542  4.604   -0.562 1.00 0.14 ?  14 ARG   A O    6  
ATOM   3192 C CB   . ARG   A 1 14 ? 1.307   6.131   -0.202 1.00 0.21 ?  14 ARG   A CB   6  
ATOM   3193 C CG   . ARG   A 1 14 ? 0.866   6.888   -1.437 1.00 1.03 ?  14 ARG   A CG   6  
ATOM   3194 C CD   . ARG   A 1 14 ? 2.021   7.077   -2.409 1.00 1.04 ?  14 ARG   A CD   6  
ATOM   3195 N NE   . ARG   A 1 14 ? 3.209   7.655   -1.770 1.00 1.37 ?  14 ARG   A NE   6  
ATOM   3196 C CZ   . ARG   A 1 14 ? 4.220   8.204   -2.442 1.00 1.63 ?  14 ARG   A CZ   6  
ATOM   3197 N NH1  . ARG   A 1 14 ? 4.176   8.285   -3.769 1.00 1.31 1  14 ARG   A NH1  6  
ATOM   3198 N NH2  . ARG   A 1 14 ? 5.275   8.673   -1.787 1.00 2.60 ?  14 ARG   A NH2  6  
ATOM   3199 H H    . ARG   A 1 14 ? 1.608   5.282   2.185  1.00 0.17 ?  14 ARG   A H    6  
ATOM   3200 H HA   . ARG   A 1 14 ? -0.552  6.523   0.768  1.00 0.20 ?  14 ARG   A HA   6  
ATOM   3201 H HB2  . ARG   A 1 14 ? 1.986   6.756   0.354  1.00 0.88 ?  14 ARG   A HB2  6  
ATOM   3202 H HB3  . ARG   A 1 14 ? 1.828   5.247   -0.522 1.00 0.69 ?  14 ARG   A HB3  6  
ATOM   3203 H HG2  . ARG   A 1 14 ? 0.079   6.332   -1.925 1.00 1.51 ?  14 ARG   A HG2  6  
ATOM   3204 H HG3  . ARG   A 1 14 ? 0.491   7.856   -1.137 1.00 1.60 ?  14 ARG   A HG3  6  
ATOM   3205 H HD2  . ARG   A 1 14 ? 2.284   6.114   -2.821 1.00 1.51 ?  14 ARG   A HD2  6  
ATOM   3206 H HD3  . ARG   A 1 14 ? 1.700   7.733   -3.206 1.00 1.55 ?  14 ARG   A HD3  6  
ATOM   3207 H HE   . ARG   A 1 14 ? 3.263   7.614   -0.779 1.00 1.89 ?  14 ARG   A HE   6  
ATOM   3208 H HH11 . ARG   A 1 14 ? 4.937   8.699   -4.276 1.00 1.53 ?  14 ARG   A HH11 6  
ATOM   3209 H HH12 . ARG   A 1 14 ? 3.382   7.928   -4.271 1.00 1.40 ?  14 ARG   A HH12 6  
ATOM   3210 H HH21 . ARG   A 1 14 ? 6.039   9.089   -2.287 1.00 2.84 ?  14 ARG   A HH21 6  
ATOM   3211 H HH22 . ARG   A 1 14 ? 5.318   8.607   -0.786 1.00 3.21 ?  14 ARG   A HH22 6  
ATOM   3212 N N    . CYS   A 1 15 ? 0.024   3.322   0.416  1.00 0.11 ?  15 CYS   A N    6  
ATOM   3213 C CA   . CYS   A 1 15 ? -0.586  2.066   -0.006 1.00 0.10 ?  15 CYS   A CA   6  
ATOM   3214 C C    . CYS   A 1 15 ? -1.968  1.932   0.624  1.00 0.09 ?  15 CYS   A C    6  
ATOM   3215 O O    . CYS   A 1 15 ? -2.942  1.552   -0.034 1.00 0.09 ?  15 CYS   A O    6  
ATOM   3216 C CB   . CYS   A 1 15 ? 0.302   0.882   0.395  1.00 0.13 ?  15 CYS   A CB   6  
ATOM   3217 S SG   . CYS   A 1 15 ? -0.400  -0.753  0.003  1.00 0.13 ?  15 CYS   A SG   6  
ATOM   3218 H H    . CYS   A 1 15 ? 0.867   3.304   0.926  1.00 0.12 ?  15 CYS   A H    6  
ATOM   3219 H HA   . CYS   A 1 15 ? -0.691  2.087   -1.083 1.00 0.11 ?  15 CYS   A HA   6  
ATOM   3220 H HB2  . CYS   A 1 15 ? 1.250   0.961   -0.118 1.00 0.15 ?  15 CYS   A HB2  6  
ATOM   3221 H HB3  . CYS   A 1 15 ? 0.473   0.920   1.461  1.00 0.15 ?  15 CYS   A HB3  6  
ATOM   3222 N N    . HIS   A 1 16 ? -2.049  2.292   1.897  1.00 0.11 ?  16 HIS   A N    6  
ATOM   3223 C CA   . HIS   A 1 16 ? -3.294  2.236   2.640  1.00 0.13 ?  16 HIS   A CA   6  
ATOM   3224 C C    . HIS   A 1 16 ? -4.299  3.218   2.050  1.00 0.13 ?  16 HIS   A C    6  
ATOM   3225 O O    . HIS   A 1 16 ? -5.470  2.877   1.872  1.00 0.15 ?  16 HIS   A O    6  
ATOM   3226 C CB   . HIS   A 1 16 ? -3.021  2.551   4.115  1.00 0.17 ?  16 HIS   A CB   6  
ATOM   3227 C CG   . HIS   A 1 16 ? -4.164  2.269   5.041  1.00 0.27 ?  16 HIS   A CG   6  
ATOM   3228 N ND1  . HIS   A 1 16 ? -4.225  1.142   5.832  1.00 0.39 ?  16 HIS   A ND1  6  
ATOM   3229 C CD2  . HIS   A 1 16 ? -5.283  2.978   5.313  1.00 0.34 ?  16 HIS   A CD2  6  
ATOM   3230 C CE1  . HIS   A 1 16 ? -5.335  1.169   6.545  1.00 0.48 ?  16 HIS   A CE1  6  
ATOM   3231 N NE2  . HIS   A 1 16 ? -5.996  2.273   6.251  1.00 0.45 ?  16 HIS   A NE2  6  
ATOM   3232 H H    . HIS   A 1 16 ? -1.234  2.603   2.355  1.00 0.13 ?  16 HIS   A H    6  
ATOM   3233 H HA   . HIS   A 1 16 ? -3.690  1.235   2.556  1.00 0.14 ?  16 HIS   A HA   6  
ATOM   3234 H HB2  . HIS   A 1 16 ? -2.183  1.961   4.445  1.00 0.22 ?  16 HIS   A HB2  6  
ATOM   3235 H HB3  . HIS   A 1 16 ? -2.770  3.598   4.207  1.00 0.15 ?  16 HIS   A HB3  6  
ATOM   3236 H HD1  . HIS   A 1 16 ? -3.543  0.435   5.882  1.00 0.44 ?  16 HIS   A HD1  6  
ATOM   3237 H HD2  . HIS   A 1 16 ? -5.557  3.927   4.877  1.00 0.35 ?  16 HIS   A HD2  6  
ATOM   3238 H HE1  . HIS   A 1 16 ? -5.655  0.410   7.242  1.00 0.59 ?  16 HIS   A HE1  6  
ATOM   3239 H HE2  . HIS   A 1 16 ? -6.938  2.439   6.482  1.00 0.54 ?  16 HIS   A HE2  6  
HETATM 3240 N N    . AIB   A 1 17 ? -3.824  4.430   1.744  1.00 0.13 ?  17 AIB   A N    6  
HETATM 3241 C CA   . AIB   A 1 17 ? -4.646  5.464   1.096  1.00 0.15 ?  17 AIB   A CA   6  
HETATM 3242 C C    . AIB   A 1 17 ? -5.203  4.908   -0.221 1.00 0.13 ?  17 AIB   A C    6  
HETATM 3243 O O    . AIB   A 1 17 ? -6.412  4.959   -0.481 1.00 0.15 ?  17 AIB   A O    6  
HETATM 3244 C CB1  . AIB   A 1 17 ? -3.798  6.692   0.813  1.00 0.18 ?  17 AIB   A CB1  6  
HETATM 3245 C CB2  . AIB   A 1 17 ? -5.768  5.891   2.019  1.00 0.19 ?  17 AIB   A CB2  6  
HETATM 3246 H H    . AIB   A 1 17 ? -2.889  4.639   1.966  1.00 0.13 ?  17 AIB   A H    6  
HETATM 3247 H HB11 . AIB   A 1 17 ? -4.403  7.441   0.326  1.00 0.99 ?  17 AIB   A HB11 6  
HETATM 3248 H HB12 . AIB   A 1 17 ? -2.975  6.420   0.168  1.00 0.95 ?  17 AIB   A HB12 6  
HETATM 3249 H HB13 . AIB   A 1 17 ? -3.413  7.087   1.741  1.00 1.05 ?  17 AIB   A HB13 6  
HETATM 3250 H HB21 . AIB   A 1 17 ? -5.350  6.355   2.900  1.00 1.00 ?  17 AIB   A HB21 6  
HETATM 3251 H HB22 . AIB   A 1 17 ? -6.339  5.023   2.309  1.00 1.02 ?  17 AIB   A HB22 6  
HETATM 3252 H HB23 . AIB   A 1 17 ? -6.409  6.593   1.509  1.00 0.98 ?  17 AIB   A HB23 6  
ATOM   3253 N N    . HIS   A 1 18 ? -4.301  4.362   -1.030 1.00 0.12 ?  18 HIS   A N    6  
ATOM   3254 C CA   . HIS   A 1 18 ? -4.650  3.775   -2.318 1.00 0.12 ?  18 HIS   A CA   6  
ATOM   3255 C C    . HIS   A 1 18 ? -5.764  2.747   -2.169 1.00 0.09 ?  18 HIS   A C    6  
ATOM   3256 O O    . HIS   A 1 18 ? -6.804  2.845   -2.816 1.00 0.10 ?  18 HIS   A O    6  
ATOM   3257 C CB   . HIS   A 1 18 ? -3.404  3.125   -2.942 1.00 0.15 ?  18 HIS   A CB   6  
ATOM   3258 C CG   . HIS   A 1 18 ? -3.692  2.206   -4.092 1.00 0.19 ?  18 HIS   A CG   6  
ATOM   3259 N ND1  . HIS   A 1 18 ? -4.130  2.641   -5.323 1.00 0.23 ?  18 HIS   A ND1  6  
ATOM   3260 C CD2  . HIS   A 1 18 ? -3.605  0.859   -4.182 1.00 0.23 ?  18 HIS   A CD2  6  
ATOM   3261 C CE1  . HIS   A 1 18 ? -4.303  1.602   -6.120 1.00 0.28 ?  18 HIS   A CE1  6  
ATOM   3262 N NE2  . HIS   A 1 18 ? -3.990  0.509   -5.451 1.00 0.28 ?  18 HIS   A NE2  6  
ATOM   3263 H H    . HIS   A 1 18 ? -3.358  4.354   -0.747 1.00 0.12 ?  18 HIS   A H    6  
ATOM   3264 H HA   . HIS   A 1 18 ? -4.991  4.569   -2.963 1.00 0.14 ?  18 HIS   A HA   6  
ATOM   3265 H HB2  . HIS   A 1 18 ? -2.744  3.898   -3.299 1.00 0.17 ?  18 HIS   A HB2  6  
ATOM   3266 H HB3  . HIS   A 1 18 ? -2.893  2.553   -2.182 1.00 0.15 ?  18 HIS   A HB3  6  
ATOM   3267 H HD1  . HIS   A 1 18 ? -4.293  3.579   -5.577 1.00 0.24 ?  18 HIS   A HD1  6  
ATOM   3268 H HD2  . HIS   A 1 18 ? -3.285  0.186   -3.399 1.00 0.24 ?  18 HIS   A HD2  6  
ATOM   3269 H HE1  . HIS   A 1 18 ? -4.635  1.642   -7.148 1.00 0.33 ?  18 HIS   A HE1  6  
ATOM   3270 H HE2  . HIS   A 1 18 ? -3.898  -0.389  -5.847 1.00 0.36 ?  18 HIS   A HE2  6  
ATOM   3271 N N    . CYS   A 1 19 ? -5.544  1.775   -1.303 1.00 0.09 ?  19 CYS   A N    6  
ATOM   3272 C CA   . CYS   A 1 19 ? -6.478  0.674   -1.142 1.00 0.09 ?  19 CYS   A CA   6  
ATOM   3273 C C    . CYS   A 1 19 ? -7.810  1.137   -0.564 1.00 0.09 ?  19 CYS   A C    6  
ATOM   3274 O O    . CYS   A 1 19 ? -8.857  0.613   -0.939 1.00 0.09 ?  19 CYS   A O    6  
ATOM   3275 C CB   . CYS   A 1 19 ? -5.857  -0.402  -0.267 1.00 0.11 ?  19 CYS   A CB   6  
ATOM   3276 S SG   . CYS   A 1 19 ? -4.342  -1.121  -0.977 1.00 0.12 ?  19 CYS   A SG   6  
ATOM   3277 H H    . CYS   A 1 19 ? -4.726  1.798   -0.753 1.00 0.11 ?  19 CYS   A H    6  
ATOM   3278 H HA   . CYS   A 1 19 ? -6.660  0.257   -2.122 1.00 0.10 ?  19 CYS   A HA   6  
ATOM   3279 H HB2  . CYS   A 1 19 ? -5.605  0.023   0.693  1.00 0.13 ?  19 CYS   A HB2  6  
ATOM   3280 H HB3  . CYS   A 1 19 ? -6.570  -1.201  -0.128 1.00 0.13 ?  19 CYS   A HB3  6  
HETATM 3281 N N    . A1BEB A 1 20 ? -7.765  2.125   0.335  1.00 0.11 ?  20 A1BEB A N    6  
HETATM 3282 C CA   . A1BEB A 1 20 ? -8.984  2.719   0.908  1.00 0.14 ?  20 A1BEB A CA   6  
HETATM 3283 C C    . A1BEB A 1 20 ? -9.826  3.316   -0.228 1.00 0.16 ?  20 A1BEB A C    6  
HETATM 3284 O O    . A1BEB A 1 20 ? -11.057 3.347   -0.161 1.00 0.18 ?  20 A1BEB A O    6  
HETATM 3285 C CB   . A1BEB A 1 20 ? -8.601  3.819   1.888  1.00 0.21 ?  20 A1BEB A CB   6  
HETATM 3286 C CB2  . A1BEB A 1 20 ? -9.775  1.661   1.664  1.00 0.15 ?  20 A1BEB A CB2  6  
HETATM 3287 C CG   . A1BEB A 1 20 ? -9.832  4.461   2.518  1.00 0.36 ?  20 A1BEB A CG   6  
HETATM 3288 C CD   . A1BEB A 1 20 ? -9.479  5.693   3.337  1.00 0.44 ?  20 A1BEB A CD   6  
HETATM 3289 C CE   . A1BEB A 1 20 ? -8.609  5.354   4.536  1.00 0.72 ?  20 A1BEB A CE   6  
HETATM 3290 N NZ   . A1BEB A 1 20 ? -8.241  6.563   5.312  1.00 1.38 ?  20 A1BEB A NZ   6  
HETATM 3291 H H    . A1BEB A 1 20 ? -6.891  2.464   0.630  1.00 0.12 ?  20 A1BEB A H    6  
HETATM 3292 H HB2  . A1BEB A 1 20 ? -8.043  4.584   1.365  1.00 0.19 ?  20 A1BEB A HB2  6  
HETATM 3293 H HB3  . A1BEB A 1 20 ? -7.988  3.402   2.673  1.00 0.23 ?  20 A1BEB A HB3  6  
HETATM 3294 H HB23 . A1BEB A 1 20 ? -10.716 2.075   1.991  1.00 0.84 ?  20 A1BEB A HB23 6  
HETATM 3295 H HB21 . A1BEB A 1 20 ? -9.207  1.330   2.520  1.00 0.80 ?  20 A1BEB A HB21 6  
HETATM 3296 H HB22 . A1BEB A 1 20 ? -9.962  0.820   1.011  1.00 0.82 ?  20 A1BEB A HB22 6  
HETATM 3297 H HG3  . A1BEB A 1 20 ? -10.306 3.740   3.163  1.00 0.42 ?  20 A1BEB A HG3  6  
HETATM 3298 H HG2  . A1BEB A 1 20 ? -10.515 4.747   1.733  1.00 0.40 ?  20 A1BEB A HG2  6  
HETATM 3299 H HD3  . A1BEB A 1 20 ? -8.945  6.387   2.707  1.00 0.93 ?  20 A1BEB A HD3  6  
HETATM 3300 H HD2  . A1BEB A 1 20 ? -10.393 6.153   3.685  1.00 0.84 ?  20 A1BEB A HD2  6  
HETATM 3301 H HE3  . A1BEB A 1 20 ? -9.151  4.678   5.180  1.00 1.49 ?  20 A1BEB A HE3  6  
HETATM 3302 H HE2  . A1BEB A 1 20 ? -7.708  4.872   4.187  1.00 1.41 ?  20 A1BEB A HE2  6  
HETATM 3303 H HZ1  . A1BEB A 1 20 ? -7.573  6.312   6.070  1.00 1.93 ?  20 A1BEB A HZ1  6  
HETATM 3304 H HZ2  . A1BEB A 1 20 ? -9.086  6.988   5.738  1.00 1.93 ?  20 A1BEB A HZ2  6  
HETATM 3305 H HZ3  . A1BEB A 1 20 ? -7.792  7.265   4.691  1.00 1.84 ?  20 A1BEB A HZ3  6  
ATOM   3306 N N    . SER   A 1 21 ? -9.146  3.782   -1.270 1.00 0.18 ?  21 SER   A N    6  
ATOM   3307 C CA   . SER   A 1 21 ? -9.809  4.397   -2.411 1.00 0.23 ?  21 SER   A CA   6  
ATOM   3308 C C    . SER   A 1 21 ? -10.503 3.338   -3.277 1.00 0.23 ?  21 SER   A C    6  
ATOM   3309 O O    . SER   A 1 21 ? -11.293 3.664   -4.168 1.00 0.31 ?  21 SER   A O    6  
ATOM   3310 C CB   . SER   A 1 21 ? -8.783  5.188   -3.239 1.00 0.33 ?  21 SER   A CB   6  
ATOM   3311 O OG   . SER   A 1 21 ? -9.396  5.915   -4.291 1.00 1.18 ?  21 SER   A OG   6  
ATOM   3312 H H    . SER   A 1 21 ? -8.163  3.713   -1.271 1.00 0.17 ?  21 SER   A H    6  
ATOM   3313 H HA   . SER   A 1 21 ? -10.553 5.079   -2.032 1.00 0.26 ?  21 SER   A HA   6  
ATOM   3314 H HB2  . SER   A 1 21 ? -8.268  5.885   -2.596 1.00 1.01 ?  21 SER   A HB2  6  
ATOM   3315 H HB3  . SER   A 1 21 ? -8.066  4.503   -3.665 1.00 1.21 ?  21 SER   A HB3  6  
ATOM   3316 H HG   . SER   A 1 21 ? -10.184 6.361   -3.954 1.00 1.82 ?  21 SER   A HG   6  
ATOM   3317 N N    . ILE   A 1 22 ? -10.212 2.070   -3.013 1.00 0.19 ?  22 ILE   A N    6  
ATOM   3318 C CA   . ILE   A 1 22 ? -10.784 0.979   -3.781 1.00 0.20 ?  22 ILE   A CA   6  
ATOM   3319 C C    . ILE   A 1 22 ? -11.878 0.258   -2.989 1.00 0.17 ?  22 ILE   A C    6  
ATOM   3320 O O    . ILE   A 1 22 ? -11.625 -0.290  -1.909 1.00 0.14 ?  22 ILE   A O    6  
ATOM   3321 C CB   . ILE   A 1 22 ? -9.705  -0.037  -4.185 1.00 0.21 ?  22 ILE   A CB   6  
ATOM   3322 C CG1  . ILE   A 1 22 ? -8.549  0.669   -4.892 1.00 0.24 ?  22 ILE   A CG1  6  
ATOM   3323 C CG2  . ILE   A 1 22 ? -10.308 -1.105  -5.087 1.00 0.24 ?  22 ILE   A CG2  6  
ATOM   3324 C CD1  . ILE   A 1 22 ? -7.412  -0.254  -5.276 1.00 0.26 ?  22 ILE   A CD1  6  
ATOM   3325 H H    . ILE   A 1 22 ? -9.595  1.859   -2.279 1.00 0.19 ?  22 ILE   A H    6  
ATOM   3326 H HA   . ILE   A 1 22 ? -11.212 1.393   -4.679 1.00 0.25 ?  22 ILE   A HA   6  
ATOM   3327 H HB   . ILE   A 1 22 ? -9.336  -0.509  -3.289 1.00 0.18 ?  22 ILE   A HB   6  
ATOM   3328 H HG12 . ILE   A 1 22 ? -8.917  1.131   -5.794 1.00 0.28 ?  22 ILE   A HG12 6  
ATOM   3329 H HG13 . ILE   A 1 22 ? -8.152  1.433   -4.239 1.00 0.24 ?  22 ILE   A HG13 6  
ATOM   3330 H HG21 . ILE   A 1 22 ? -10.693 -0.641  -5.982 1.00 0.99 ?  22 ILE   A HG21 6  
ATOM   3331 H HG22 . ILE   A 1 22 ? -11.113 -1.603  -4.565 1.00 0.98 ?  22 ILE   A HG22 6  
ATOM   3332 H HG23 . ILE   A 1 22 ? -9.549  -1.823  -5.352 1.00 0.97 ?  22 ILE   A HG23 6  
ATOM   3333 H HD11 . ILE   A 1 22 ? -6.597  0.326   -5.682 1.00 1.05 ?  22 ILE   A HD11 6  
ATOM   3334 H HD12 . ILE   A 1 22 ? -7.756  -0.956  -6.020 1.00 1.05 ?  22 ILE   A HD12 6  
ATOM   3335 H HD13 . ILE   A 1 22 ? -7.073  -0.792  -4.404 1.00 0.99 ?  22 ILE   A HD13 6  
ATOM   3336 N N    . PRO   A 1 23 ? -13.112 0.258   -3.518 1.00 0.19 ?  23 PRO   A N    6  
ATOM   3337 C CA   . PRO   A 1 23 ? -14.249 -0.421  -2.888 1.00 0.19 ?  23 PRO   A CA   6  
ATOM   3338 C C    . PRO   A 1 23 ? -13.965 -1.893  -2.607 1.00 0.18 ?  23 PRO   A C    6  
ATOM   3339 O O    . PRO   A 1 23 ? -13.294 -2.569  -3.393 1.00 0.21 ?  23 PRO   A O    6  
ATOM   3340 C CB   . PRO   A 1 23 ? -15.366 -0.287  -3.922 1.00 0.25 ?  23 PRO   A CB   6  
ATOM   3341 C CG   . PRO   A 1 23 ? -15.003 0.913   -4.716 1.00 0.29 ?  23 PRO   A CG   6  
ATOM   3342 C CD   . PRO   A 1 23 ? -13.502 0.927   -4.772 1.00 0.26 ?  23 PRO   A CD   6  
ATOM   3343 H HA   . PRO   A 1 23 ? -14.541 0.069   -1.974 1.00 0.19 ?  23 PRO   A HA   6  
ATOM   3344 H HB2  . PRO   A 1 23 ? -15.397 -1.172  -4.539 1.00 0.28 ?  23 PRO   A HB2  6  
ATOM   3345 H HB3  . PRO   A 1 23 ? -16.314 -0.157  -3.421 1.00 0.28 ?  23 PRO   A HB3  6  
ATOM   3346 H HG2  . PRO   A 1 23 ? -15.414 0.832   -5.708 1.00 0.34 ?  23 PRO   A HG2  6  
ATOM   3347 H HG3  . PRO   A 1 23 ? -15.368 1.802   -4.227 1.00 0.30 ?  23 PRO   A HG3  6  
ATOM   3348 H HD2  . PRO   A 1 23 ? -13.151 0.375   -5.631 1.00 0.30 ?  23 PRO   A HD2  6  
ATOM   3349 H HD3  . PRO   A 1 23 ? -13.136 1.943   -4.797 1.00 0.28 ?  23 PRO   A HD3  6  
HETATM 3350 N N    . DPR   A 1 24 ? -14.484 -2.409  -1.487 1.00 0.19 ?  24 DPR   A N    6  
HETATM 3351 C CA   . DPR   A 1 24 ? -14.266 -3.791  -1.067 1.00 0.23 ?  24 DPR   A CA   6  
HETATM 3352 C CB   . DPR   A 1 24 ? -15.521 -4.073  -0.254 1.00 0.30 ?  24 DPR   A CB   6  
HETATM 3353 C CG   . DPR   A 1 24 ? -15.803 -2.774  0.421  1.00 0.29 ?  24 DPR   A CG   6  
HETATM 3354 C CD   . DPR   A 1 24 ? -15.368 -1.695  -0.542 1.00 0.23 ?  24 DPR   A CD   6  
HETATM 3355 C C    . DPR   A 1 24 ? -13.020 -3.951  -0.196 1.00 0.22 ?  24 DPR   A C    6  
HETATM 3356 O O    . DPR   A 1 24 ? -12.854 -4.964  0.485  1.00 0.31 ?  24 DPR   A O    6  
HETATM 3357 H HA   . DPR   A 1 24 ? -14.221 -4.468  -1.901 1.00 0.27 ?  24 DPR   A HA   6  
HETATM 3358 H HB2  . DPR   A 1 24 ? -15.324 -4.855  0.460  1.00 0.34 ?  24 DPR   A HB2  6  
HETATM 3359 H HB3  . DPR   A 1 24 ? -16.328 -4.366  -0.911 1.00 0.33 ?  24 DPR   A HB3  6  
HETATM 3360 H HG2  . DPR   A 1 24 ? -15.233 -2.708  1.336  1.00 0.31 ?  24 DPR   A HG2  6  
HETATM 3361 H HG3  . DPR   A 1 24 ? -16.859 -2.687  0.629  1.00 0.35 ?  24 DPR   A HG3  6  
HETATM 3362 H HD2  . DPR   A 1 24 ? -14.829 -0.919  -0.022 1.00 0.23 ?  24 DPR   A HD2  6  
HETATM 3363 H HD3  . DPR   A 1 24 ? -16.224 -1.282  -1.055 1.00 0.24 ?  24 DPR   A HD3  6  
ATOM   3364 N N    . TYR   A 1 25 ? -12.144 -2.955  -0.214 1.00 0.15 ?  25 TYR   A N    6  
ATOM   3365 C CA   . TYR   A 1 25 ? -10.964 -2.985  0.633  1.00 0.14 ?  25 TYR   A CA   6  
ATOM   3366 C C    . TYR   A 1 25 ? -11.111 -1.991  1.775  1.00 0.15 ?  25 TYR   A C    6  
ATOM   3367 O O    . TYR   A 1 25 ? -11.854 -1.015  1.668  1.00 0.17 ?  25 TYR   A O    6  
ATOM   3368 C CB   . TYR   A 1 25 ? -9.704  -2.683  -0.181 1.00 0.12 ?  25 TYR   A CB   6  
ATOM   3369 C CG   . TYR   A 1 25 ? -9.373  -3.750  -1.207 1.00 0.15 ?  25 TYR   A CG   6  
ATOM   3370 C CD1  . TYR   A 1 25 ? -9.358  -3.459  -2.564 1.00 0.18 ?  25 TYR   A CD1  6  
ATOM   3371 C CD2  . TYR   A 1 25 ? -9.071  -5.047  -0.815 1.00 0.21 ?  25 TYR   A CD2  6  
ATOM   3372 C CE1  . TYR   A 1 25 ? -9.051  -4.429  -3.500 1.00 0.24 ?  25 TYR   A CE1  6  
ATOM   3373 C CE2  . TYR   A 1 25 ? -8.764  -6.023  -1.745 1.00 0.26 ?  25 TYR   A CE2  6  
ATOM   3374 C CZ   . TYR   A 1 25 ? -8.755  -5.708  -3.086 1.00 0.26 ?  25 TYR   A CZ   6  
ATOM   3375 O OH   . TYR   A 1 25 ? -8.442  -6.675  -4.016 1.00 0.32 ?  25 TYR   A OH   6  
ATOM   3376 H H    . TYR   A 1 25 ? -12.294 -2.182  -0.805 1.00 0.14 ?  25 TYR   A H    6  
ATOM   3377 H HA   . TYR   A 1 25 ? -10.882 -3.978  1.050  1.00 0.16 ?  25 TYR   A HA   6  
ATOM   3378 H HB2  . TYR   A 1 25 ? -9.838  -1.748  -0.702 1.00 0.11 ?  25 TYR   A HB2  6  
ATOM   3379 H HB3  . TYR   A 1 25 ? -8.864  -2.596  0.490  1.00 0.12 ?  25 TYR   A HB3  6  
ATOM   3380 H HD1  . TYR   A 1 25 ? -9.588  -2.460  -2.886 1.00 0.20 ?  25 TYR   A HD1  6  
ATOM   3381 H HD2  . TYR   A 1 25 ? -9.077  -5.292  0.234  1.00 0.25 ?  25 TYR   A HD2  6  
ATOM   3382 H HE1  . TYR   A 1 25 ? -9.044  -4.180  -4.551 1.00 0.29 ?  25 TYR   A HE1  6  
ATOM   3383 H HE2  . TYR   A 1 25 ? -8.533  -7.025  -1.417 1.00 0.32 ?  25 TYR   A HE2  6  
ATOM   3384 H HH   . TYR   A 1 25 ? -8.939  -7.480  -3.822 1.00 0.97 ?  25 TYR   A HH   6  
ATOM   3385 N N    . LYS   A 1 26 ? -10.416 -2.254  2.870  1.00 0.16 ?  26 LYS   A N    6  
ATOM   3386 C CA   . LYS   A 1 26 ? -10.478 -1.391  4.043  1.00 0.21 ?  26 LYS   A CA   6  
ATOM   3387 C C    . LYS   A 1 26 ? -9.078  -0.973  4.468  1.00 0.24 ?  26 LYS   A C    6  
ATOM   3388 O O    . LYS   A 1 26 ? -8.879  -0.417  5.550  1.00 0.46 ?  26 LYS   A O    6  
ATOM   3389 C CB   . LYS   A 1 26 ? -11.194 -2.094  5.204  1.00 0.27 ?  26 LYS   A CB   6  
ATOM   3390 C CG   . LYS   A 1 26 ? -10.511 -3.368  5.686  1.00 0.30 ?  26 LYS   A CG   6  
ATOM   3391 C CD   . LYS   A 1 26 ? -11.206 -3.944  6.906  1.00 0.43 ?  26 LYS   A CD   6  
ATOM   3392 C CE   . LYS   A 1 26 ? -10.564 -5.242  7.362  1.00 1.65 ?  26 LYS   A CE   6  
ATOM   3393 N NZ   . LYS   A 1 26 ? -11.264 -5.824  8.535  1.00 1.94 1  26 LYS   A NZ   6  
ATOM   3394 H H    . LYS   A 1 26 ? -9.836  -3.048  2.888  1.00 0.16 ?  26 LYS   A H    6  
ATOM   3395 H HA   . LYS   A 1 26 ? -11.032 -0.506  3.768  1.00 0.22 ?  26 LYS   A HA   6  
ATOM   3396 H HB2  . LYS   A 1 26 ? -11.256 -1.412  6.039  1.00 0.31 ?  26 LYS   A HB2  6  
ATOM   3397 H HB3  . LYS   A 1 26 ? -12.195 -2.350  4.890  1.00 0.32 ?  26 LYS   A HB3  6  
ATOM   3398 H HG2  . LYS   A 1 26 ? -10.535 -4.100  4.894  1.00 0.34 ?  26 LYS   A HG2  6  
ATOM   3399 H HG3  . LYS   A 1 26 ? -9.486  -3.140  5.940  1.00 0.36 ?  26 LYS   A HG3  6  
ATOM   3400 H HD2  . LYS   A 1 26 ? -11.146 -3.228  7.710  1.00 1.07 ?  26 LYS   A HD2  6  
ATOM   3401 H HD3  . LYS   A 1 26 ? -12.242 -4.129  6.663  1.00 0.96 ?  26 LYS   A HD3  6  
ATOM   3402 H HE2  . LYS   A 1 26 ? -10.596 -5.948  6.547  1.00 2.28 ?  26 LYS   A HE2  6  
ATOM   3403 H HE3  . LYS   A 1 26 ? -9.536  -5.046  7.628  1.00 2.30 ?  26 LYS   A HE3  6  
ATOM   3404 H HZ1  . LYS   A 1 26 ? -11.229 -5.165  9.338  1.00 2.33 ?  26 LYS   A HZ1  6  
ATOM   3405 H HZ2  . LYS   A 1 26 ? -10.812 -6.716  8.817  1.00 2.04 ?  26 LYS   A HZ2  6  
ATOM   3406 H HZ3  . LYS   A 1 26 ? -12.260 -6.015  8.302  1.00 2.40 ?  26 LYS   A HZ3  6  
ATOM   3407 N N    . GLY   A 1 27 ? -8.111  -1.243  3.612  1.00 0.14 ?  27 GLY   A N    6  
ATOM   3408 C CA   . GLY   A 1 27 ? -6.742  -0.883  3.895  1.00 0.13 ?  27 GLY   A CA   6  
ATOM   3409 C C    . GLY   A 1 27 ? -5.790  -1.560  2.943  1.00 0.12 ?  27 GLY   A C    6  
ATOM   3410 O O    . GLY   A 1 27 ? -6.218  -2.344  2.096  1.00 0.15 ?  27 GLY   A O    6  
ATOM   3411 H H    . GLY   A 1 27 ? -8.325  -1.708  2.776  1.00 0.25 ?  27 GLY   A H    6  
ATOM   3412 H HA2  . GLY   A 1 27 ? -6.631  0.187   3.809  1.00 0.14 ?  27 GLY   A HA2  6  
ATOM   3413 H HA3  . GLY   A 1 27 ? -6.502  -1.181  4.904  1.00 0.17 ?  27 GLY   A HA3  6  
ATOM   3414 N N    . GLY   A 1 28 ? -4.511  -1.266  3.073  1.00 0.13 ?  28 GLY   A N    6  
ATOM   3415 C CA   . GLY   A 1 28 ? -3.517  -1.896  2.233  1.00 0.13 ?  28 GLY   A CA   6  
ATOM   3416 C C    . GLY   A 1 28 ? -2.138  -1.803  2.832  1.00 0.16 ?  28 GLY   A C    6  
ATOM   3417 O O    . GLY   A 1 28 ? -1.608  -0.707  3.016  1.00 0.20 ?  28 GLY   A O    6  
ATOM   3418 H H    . GLY   A 1 28 ? -4.233  -0.620  3.751  1.00 0.15 ?  28 GLY   A H    6  
ATOM   3419 H HA2  . GLY   A 1 28 ? -3.775  -2.937  2.110  1.00 0.14 ?  28 GLY   A HA2  6  
ATOM   3420 H HA3  . GLY   A 1 28 ? -3.513  -1.418  1.267  1.00 0.15 ?  28 GLY   A HA3  6  
ATOM   3421 N N    . TYR   A 1 29 ? -1.580  -2.944  3.191  1.00 0.17 ?  29 TYR   A N    6  
ATOM   3422 C CA   . TYR   A 1 29 ? -0.261  -2.978  3.797  1.00 0.22 ?  29 TYR   A CA   6  
ATOM   3423 C C    . TYR   A 1 29 ? 0.804   -3.219  2.739  1.00 0.20 ?  29 TYR   A C    6  
ATOM   3424 O O    . TYR   A 1 29 ? 0.556   -3.874  1.721  1.00 0.17 ?  29 TYR   A O    6  
ATOM   3425 C CB   . TYR   A 1 29 ? -0.184  -4.034  4.911  1.00 0.28 ?  29 TYR   A CB   6  
ATOM   3426 C CG   . TYR   A 1 29 ? -0.288  -5.473  4.451  1.00 0.33 ?  29 TYR   A CG   6  
ATOM   3427 C CD1  . TYR   A 1 29 ? 0.852   -6.211  4.157  1.00 0.46 ?  29 TYR   A CD1  6  
ATOM   3428 C CD2  . TYR   A 1 29 ? -1.519  -6.100  4.337  1.00 0.44 ?  29 TYR   A CD2  6  
ATOM   3429 C CE1  . TYR   A 1 29 ? 0.765   -7.530  3.765  1.00 0.58 ?  29 TYR   A CE1  6  
ATOM   3430 C CE2  . TYR   A 1 29 ? -1.615  -7.418  3.941  1.00 0.55 ?  29 TYR   A CE2  6  
ATOM   3431 C CZ   . TYR   A 1 29 ? -0.469  -8.129  3.657  1.00 0.60 ?  29 TYR   A CZ   6  
ATOM   3432 O OH   . TYR   A 1 29 ? -0.556  -9.447  3.271  1.00 0.73 ?  29 TYR   A OH   6  
ATOM   3433 H H    . TYR   A 1 29 ? -2.041  -3.788  2.989  1.00 0.17 ?  29 TYR   A H    6  
ATOM   3434 H HA   . TYR   A 1 29 ? -0.086  -2.005  4.233  1.00 0.26 ?  29 TYR   A HA   6  
ATOM   3435 H HB2  . TYR   A 1 29 ? 0.758   -3.927  5.424  1.00 0.35 ?  29 TYR   A HB2  6  
ATOM   3436 H HB3  . TYR   A 1 29 ? -0.983  -3.855  5.614  1.00 0.30 ?  29 TYR   A HB3  6  
ATOM   3437 H HD1  . TYR   A 1 29 ? 1.818   -5.738  4.237  1.00 0.55 ?  29 TYR   A HD1  6  
ATOM   3438 H HD2  . TYR   A 1 29 ? -2.415  -5.539  4.560  1.00 0.53 ?  29 TYR   A HD2  6  
ATOM   3439 H HE1  . TYR   A 1 29 ? 1.663   -8.085  3.543  1.00 0.72 ?  29 TYR   A HE1  6  
ATOM   3440 H HE2  . TYR   A 1 29 ? -2.584  -7.888  3.859  1.00 0.69 ?  29 TYR   A HE2  6  
ATOM   3441 H HH   . TYR   A 1 29 ? -0.016  -9.984  3.864  1.00 1.12 ?  29 TYR   A HH   6  
ATOM   3442 N N    . CYS   A 1 30 ? 1.985   -2.681  2.979  1.00 0.22 ?  30 CYS   A N    6  
ATOM   3443 C CA   . CYS   A 1 30 ? 3.108   -2.901  2.089  1.00 0.19 ?  30 CYS   A CA   6  
ATOM   3444 C C    . CYS   A 1 30 ? 3.610   -4.337  2.238  1.00 0.20 ?  30 CYS   A C    6  
ATOM   3445 O O    . CYS   A 1 30 ? 3.689   -4.869  3.351  1.00 0.32 ?  30 CYS   A O    6  
ATOM   3446 C CB   . CYS   A 1 30 ? 4.223   -1.905  2.390  1.00 0.27 ?  30 CYS   A CB   6  
ATOM   3447 S SG   . CYS   A 1 30 ? 5.336   -1.590  0.988  1.00 0.86 ?  30 CYS   A SG   6  
ATOM   3448 H H    . CYS   A 1 30 ? 2.098   -2.110  3.772  1.00 0.27 ?  30 CYS   A H    6  
ATOM   3449 H HA   . CYS   A 1 30 ? 2.764   -2.754  1.075  1.00 0.21 ?  30 CYS   A HA   6  
ATOM   3450 H HB2  . CYS   A 1 30 ? 3.787   -0.961  2.684  1.00 0.76 ?  30 CYS   A HB2  6  
ATOM   3451 H HB3  . CYS   A 1 30 ? 4.821   -2.288  3.200  1.00 0.88 ?  30 CYS   A HB3  6  
ATOM   3452 N N    . ALA   A 1 31 ? 3.932   -4.963  1.117  1.00 0.19 ?  31 ALA   A N    6  
ATOM   3453 C CA   . ALA   A 1 31 ? 4.303   -6.370  1.097  1.00 0.28 ?  31 ALA   A CA   6  
ATOM   3454 C C    . ALA   A 1 31 ? 5.466   -6.626  0.142  1.00 0.22 ?  31 ALA   A C    6  
ATOM   3455 O O    . ALA   A 1 31 ? 5.899   -5.723  -0.577 1.00 0.16 ?  31 ALA   A O    6  
ATOM   3456 C CB   . ALA   A 1 31 ? 3.098   -7.212  0.699  1.00 0.42 ?  31 ALA   A CB   6  
ATOM   3457 H H    . ALA   A 1 31 ? 3.916   -4.462  0.270  1.00 0.20 ?  31 ALA   A H    6  
ATOM   3458 H HA   . ALA   A 1 31 ? 4.597   -6.653  2.094  1.00 0.36 ?  31 ALA   A HA   6  
ATOM   3459 H HB1  . ALA   A 1 31 ? 2.268   -6.985  1.352  1.00 1.01 ?  31 ALA   A HB1  6  
ATOM   3460 H HB2  . ALA   A 1 31 ? 3.347   -8.260  0.785  1.00 1.08 ?  31 ALA   A HB2  6  
ATOM   3461 H HB3  . ALA   A 1 31 ? 2.824   -6.990  -0.322 1.00 1.16 ?  31 ALA   A HB3  6  
ATOM   3462 N N    . LYS   A 1 32 ? 5.962   -7.864  0.152  1.00 0.28 ?  32 LYS   A N    6  
ATOM   3463 C CA   . LYS   A 1 32 ? 7.059   -8.292  -0.721 1.00 0.26 ?  32 LYS   A CA   6  
ATOM   3464 C C    . LYS   A 1 32 ? 8.267   -7.367  -0.599 1.00 0.26 ?  32 LYS   A C    6  
ATOM   3465 O O    . LYS   A 1 32 ? 8.618   -6.668  -1.550 1.00 0.24 ?  32 LYS   A O    6  
ATOM   3466 C CB   . LYS   A 1 32 ? 6.612   -8.362  -2.191 1.00 0.25 ?  32 LYS   A CB   6  
ATOM   3467 C CG   . LYS   A 1 32 ? 5.783   -9.589  -2.559 1.00 1.09 ?  32 LYS   A CG   6  
ATOM   3468 C CD   . LYS   A 1 32 ? 4.408   -9.576  -1.916 1.00 1.62 ?  32 LYS   A CD   6  
ATOM   3469 C CE   . LYS   A 1 32 ? 3.605   -10.811 -2.291 1.00 2.37 ?  32 LYS   A CE   6  
ATOM   3470 N NZ   . LYS   A 1 32 ? 3.378   -10.910 -3.759 1.00 2.43 1  32 LYS   A NZ   6  
ATOM   3471 H H    . LYS   A 1 32 ? 5.587   -8.514  0.785  1.00 0.37 ?  32 LYS   A H    6  
ATOM   3472 H HA   . LYS   A 1 32 ? 7.356   -9.279  -0.400 1.00 0.32 ?  32 LYS   A HA   6  
ATOM   3473 H HB2  . LYS   A 1 32 ? 6.022   -7.485  -2.406 1.00 0.88 ?  32 LYS   A HB2  6  
ATOM   3474 H HB3  . LYS   A 1 32 ? 7.492   -8.349  -2.816 1.00 0.84 ?  32 LYS   A HB3  6  
ATOM   3475 H HG2  . LYS   A 1 32 ? 5.656   -9.612  -3.631 1.00 1.65 ?  32 LYS   A HG2  6  
ATOM   3476 H HG3  . LYS   A 1 32 ? 6.311   -10.476 -2.242 1.00 1.76 ?  32 LYS   A HG3  6  
ATOM   3477 H HD2  . LYS   A 1 32 ? 4.522   -9.544  -0.844 1.00 2.05 ?  32 LYS   A HD2  6  
ATOM   3478 H HD3  . LYS   A 1 32 ? 3.876   -8.698  -2.251 1.00 1.80 ?  32 LYS   A HD3  6  
ATOM   3479 H HE2  . LYS   A 1 32 ? 4.144   -11.688 -1.962 1.00 2.75 ?  32 LYS   A HE2  6  
ATOM   3480 H HE3  . LYS   A 1 32 ? 2.650   -10.767 -1.790 1.00 3.09 ?  32 LYS   A HE3  6  
ATOM   3481 H HZ1  . LYS   A 1 32 ? 4.285   -11.023 -4.257 1.00 2.11 ?  32 LYS   A HZ1  6  
ATOM   3482 H HZ2  . LYS   A 1 32 ? 2.905   -10.055 -4.110 1.00 3.00 ?  32 LYS   A HZ2  6  
ATOM   3483 H HZ3  . LYS   A 1 32 ? 2.777   -11.732 -3.972 1.00 2.96 ?  32 LYS   A HZ3  6  
HETATM 3484 N N    . DPR   A 1 33 ? 8.921   -7.360  0.573  1.00 0.37 ?  33 DPR   A N    6  
HETATM 3485 C CA   . DPR   A 1 33 ? 10.085  -6.499  0.834  1.00 0.44 ?  33 DPR   A CA   6  
HETATM 3486 C CB   . DPR   A 1 33 ? 10.395  -6.742  2.312  1.00 0.59 ?  33 DPR   A CB   6  
HETATM 3487 C CG   . DPR   A 1 33 ? 9.801   -8.067  2.621  1.00 0.61 ?  33 DPR   A CG   6  
HETATM 3488 C CD   . DPR   A 1 33 ? 8.597   -8.209  1.733  1.00 0.47 ?  33 DPR   A CD   6  
HETATM 3489 C C    . DPR   A 1 33 ? 9.783   -5.022  0.584  1.00 0.39 ?  33 DPR   A C    6  
HETATM 3490 O O    . DPR   A 1 33 ? 10.678  -4.245  0.246  1.00 0.47 ?  33 DPR   A O    6  
HETATM 3491 H HA   . DPR   A 1 33 ? 10.933  -6.794  0.242  1.00 0.48 ?  33 DPR   A HA   6  
HETATM 3492 H HB2  . DPR   A 1 33 ? 9.945   -5.965  2.908  1.00 0.61 ?  33 DPR   A HB2  6  
HETATM 3493 H HB3  . DPR   A 1 33 ? 11.465  -6.744  2.464  1.00 0.67 ?  33 DPR   A HB3  6  
HETATM 3494 H HG2  . DPR   A 1 33 ? 9.505   -8.097  3.658  1.00 0.70 ?  33 DPR   A HG2  6  
HETATM 3495 H HG3  . DPR   A 1 33 ? 10.516  -8.848  2.411  1.00 0.65 ?  33 DPR   A HG3  6  
HETATM 3496 H HD2  . DPR   A 1 33 ? 7.709   -7.853  2.232  1.00 0.49 ?  33 DPR   A HD2  6  
HETATM 3497 H HD3  . DPR   A 1 33 ? 8.471   -9.238  1.431  1.00 0.47 ?  33 DPR   A HD3  6  
ATOM   3498 N N    . GLY   A 1 34 ? 8.519   -4.650  0.737  1.00 0.32 ?  34 GLY   A N    6  
ATOM   3499 C CA   . GLY   A 1 34 ? 8.120   -3.272  0.541  1.00 0.30 ?  34 GLY   A CA   6  
ATOM   3500 C C    . GLY   A 1 34 ? 8.001   -2.892  -0.922 1.00 0.25 ?  34 GLY   A C    6  
ATOM   3501 O O    . GLY   A 1 34 ? 8.120   -1.718  -1.272 1.00 0.30 ?  34 GLY   A O    6  
ATOM   3502 H H    . GLY   A 1 34 ? 7.850   -5.319  0.991  1.00 0.32 ?  34 GLY   A H    6  
ATOM   3503 H HA2  . GLY   A 1 34 ? 7.164   -3.114  1.021  1.00 0.31 ?  34 GLY   A HA2  6  
ATOM   3504 H HA3  . GLY   A 1 34 ? 8.852   -2.632  1.008  1.00 0.36 ?  34 GLY   A HA3  6  
ATOM   3505 N N    . PHE   A 1 35 ? 7.770   -3.872  -1.787 1.00 0.19 ?  35 PHE   A N    6  
ATOM   3506 C CA   . PHE   A 1 35 ? 7.641   -3.602  -3.216 1.00 0.20 ?  35 PHE   A CA   6  
ATOM   3507 C C    . PHE   A 1 35 ? 6.194   -3.674  -3.688 1.00 0.17 ?  35 PHE   A C    6  
ATOM   3508 O O    . PHE   A 1 35 ? 5.815   -3.003  -4.645 1.00 0.29 ?  35 PHE   A O    6  
ATOM   3509 C CB   . PHE   A 1 35 ? 8.487   -4.579  -4.030 1.00 0.23 ?  35 PHE   A CB   6  
ATOM   3510 C CG   . PHE   A 1 35 ? 9.955   -4.279  -3.996 1.00 0.31 ?  35 PHE   A CG   6  
ATOM   3511 C CD1  . PHE   A 1 35 ? 10.800  -5.020  -3.189 1.00 0.40 ?  35 PHE   A CD1  6  
ATOM   3512 C CD2  . PHE   A 1 35 ? 10.487  -3.258  -4.762 1.00 0.37 ?  35 PHE   A CD2  6  
ATOM   3513 C CE1  . PHE   A 1 35 ? 12.153  -4.747  -3.146 1.00 0.49 ?  35 PHE   A CE1  6  
ATOM   3514 C CE2  . PHE   A 1 35 ? 11.839  -2.981  -4.725 1.00 0.46 ?  35 PHE   A CE2  6  
ATOM   3515 C CZ   . PHE   A 1 35 ? 12.673  -3.723  -3.951 1.00 0.51 ?  35 PHE   A CZ   6  
ATOM   3516 H H    . PHE   A 1 35 ? 7.700   -4.799  -1.459 1.00 0.19 ?  35 PHE   A H    6  
ATOM   3517 H HA   . PHE   A 1 35 ? 8.009   -2.603  -3.391 1.00 0.24 ?  35 PHE   A HA   6  
ATOM   3518 H HB2  . PHE   A 1 35 ? 8.342   -5.577  -3.644 1.00 0.24 ?  35 PHE   A HB2  6  
ATOM   3519 H HB3  . PHE   A 1 35 ? 8.163   -4.547  -5.061 1.00 0.27 ?  35 PHE   A HB3  6  
ATOM   3520 H HD1  . PHE   A 1 35 ? 10.394  -5.822  -2.588 1.00 0.45 ?  35 PHE   A HD1  6  
ATOM   3521 H HD2  . PHE   A 1 35 ? 9.836   -2.676  -5.395 1.00 0.40 ?  35 PHE   A HD2  6  
ATOM   3522 H HE1  . PHE   A 1 35 ? 12.802  -5.333  -2.516 1.00 0.59 ?  35 PHE   A HE1  6  
ATOM   3523 H HE2  . PHE   A 1 35 ? 12.243  -2.180  -5.327 1.00 0.54 ?  35 PHE   A HE2  6  
ATOM   3524 H HZ   . PHE   A 1 35 ? 13.731  -3.506  -3.934 1.00 0.60 ?  35 PHE   A HZ   6  
ATOM   3525 N N    . VAL   A 1 36 ? 5.386   -4.480  -3.027 1.00 0.12 ?  36 VAL   A N    6  
ATOM   3526 C CA   . VAL   A 1 36 ? 4.025   -4.710  -3.475 1.00 0.17 ?  36 VAL   A CA   6  
ATOM   3527 C C    . VAL   A 1 36 ? 3.015   -4.143  -2.493 1.00 0.15 ?  36 VAL   A C    6  
ATOM   3528 O O    . VAL   A 1 36 ? 3.017   -4.487  -1.320 1.00 0.17 ?  36 VAL   A O    6  
ATOM   3529 C CB   . VAL   A 1 36 ? 3.754   -6.215  -3.678 1.00 0.23 ?  36 VAL   A CB   6  
ATOM   3530 C CG1  . VAL   A 1 36 ? 2.288   -6.471  -3.995 1.00 0.32 ?  36 VAL   A CG1  6  
ATOM   3531 C CG2  . VAL   A 1 36 ? 4.637   -6.767  -4.785 1.00 0.25 ?  36 VAL   A CG2  6  
ATOM   3532 H H    . VAL   A 1 36 ? 5.702   -4.921  -2.211 1.00 0.17 ?  36 VAL   A H    6  
ATOM   3533 H HA   . VAL   A 1 36 ? 3.902   -4.215  -4.425 1.00 0.20 ?  36 VAL   A HA   6  
ATOM   3534 H HB   . VAL   A 1 36 ? 4.000   -6.728  -2.760 1.00 0.24 ?  36 VAL   A HB   6  
ATOM   3535 H HG11 . VAL   A 1 36 ? 2.023   -5.961  -4.909 1.00 1.12 ?  36 VAL   A HG11 6  
ATOM   3536 H HG12 . VAL   A 1 36 ? 1.675   -6.102  -3.186 1.00 1.04 ?  36 VAL   A HG12 6  
ATOM   3537 H HG13 . VAL   A 1 36 ? 2.126   -7.533  -4.113 1.00 1.00 ?  36 VAL   A HG13 6  
ATOM   3538 H HG21 . VAL   A 1 36 ? 5.674   -6.580  -4.545 1.00 1.04 ?  36 VAL   A HG21 6  
ATOM   3539 H HG22 . VAL   A 1 36 ? 4.390   -6.282  -5.716 1.00 0.94 ?  36 VAL   A HG22 6  
ATOM   3540 H HG23 . VAL   A 1 36 ? 4.475   -7.830  -4.878 1.00 1.08 ?  36 VAL   A HG23 6  
ATOM   3541 N N    . CYS   A 1 37 ? 2.161   -3.272  -2.984 1.00 0.15 ?  37 CYS   A N    6  
ATOM   3542 C CA   . CYS   A 1 37 ? 1.075   -2.729  -2.187 1.00 0.14 ?  37 CYS   A CA   6  
ATOM   3543 C C    . CYS   A 1 37 ? -0.085  -3.720  -2.182 1.00 0.12 ?  37 CYS   A C    6  
ATOM   3544 O O    . CYS   A 1 37 ? -0.730  -3.925  -3.213 1.00 0.18 ?  37 CYS   A O    6  
ATOM   3545 C CB   . CYS   A 1 37 ? 0.634   -1.384  -2.773 1.00 0.16 ?  37 CYS   A CB   6  
ATOM   3546 S SG   . CYS   A 1 37 ? -0.827  -0.644  -1.976 1.00 0.14 ?  37 CYS   A SG   6  
ATOM   3547 H H    . CYS   A 1 37 ? 2.254   -2.990  -3.918 1.00 0.16 ?  37 CYS   A H    6  
ATOM   3548 H HA   . CYS   A 1 37 ? 1.430   -2.588  -1.176 1.00 0.14 ?  37 CYS   A HA   6  
ATOM   3549 H HB2  . CYS   A 1 37 ? 1.446   -0.677  -2.682 1.00 0.20 ?  37 CYS   A HB2  6  
ATOM   3550 H HB3  . CYS   A 1 37 ? 0.401   -1.519  -3.819 1.00 0.18 ?  37 CYS   A HB3  6  
ATOM   3551 N N    . LYS   A 1 38 ? -0.335  -4.359  -1.043 1.00 0.10 ?  38 LYS   A N    6  
ATOM   3552 C CA   . LYS   A 1 38 ? -1.382  -5.368  -0.976 1.00 0.11 ?  38 LYS   A CA   6  
ATOM   3553 C C    . LYS   A 1 38 ? -2.590  -4.857  -0.207 1.00 0.11 ?  38 LYS   A C    6  
ATOM   3554 O O    . LYS   A 1 38 ? -2.510  -4.562  0.989  1.00 0.12 ?  38 LYS   A O    6  
ATOM   3555 C CB   . LYS   A 1 38 ? -0.882  -6.662  -0.331 1.00 0.15 ?  38 LYS   A CB   6  
ATOM   3556 C CG   . LYS   A 1 38 ? -1.869  -7.811  -0.507 1.00 0.26 ?  38 LYS   A CG   6  
ATOM   3557 C CD   . LYS   A 1 38 ? -1.528  -9.014  0.357  1.00 0.70 ?  38 LYS   A CD   6  
ATOM   3558 C CE   . LYS   A 1 38 ? -0.205  -9.653  -0.033 1.00 1.19 ?  38 LYS   A CE   6  
ATOM   3559 N NZ   . LYS   A 1 38 ? 0.117   -10.807 0.843  1.00 2.16 1  38 LYS   A NZ   6  
ATOM   3560 H H    . LYS   A 1 38 ? 0.178   -4.134  -0.231 1.00 0.13 ?  38 LYS   A H    6  
ATOM   3561 H HA   . LYS   A 1 38 ? -1.690  -5.582  -1.987 1.00 0.12 ?  38 LYS   A HA   6  
ATOM   3562 H HB2  . LYS   A 1 38 ? 0.060   -6.940  -0.779 1.00 0.14 ?  38 LYS   A HB2  6  
ATOM   3563 H HB3  . LYS   A 1 38 ? -0.739  -6.496  0.729  1.00 0.19 ?  38 LYS   A HB3  6  
ATOM   3564 H HG2  . LYS   A 1 38 ? -2.851  -7.462  -0.242 1.00 0.63 ?  38 LYS   A HG2  6  
ATOM   3565 H HG3  . LYS   A 1 38 ? -1.869  -8.113  -1.541 1.00 0.69 ?  38 LYS   A HG3  6  
ATOM   3566 H HD2  . LYS   A 1 38 ? -1.468  -8.696  1.386  1.00 1.20 ?  38 LYS   A HD2  6  
ATOM   3567 H HD3  . LYS   A 1 38 ? -2.314  -9.748  0.254  1.00 1.36 ?  38 LYS   A HD3  6  
ATOM   3568 H HE2  . LYS   A 1 38 ? -0.268  -9.993  -1.056 1.00 1.63 ?  38 LYS   A HE2  6  
ATOM   3569 H HE3  . LYS   A 1 38 ? 0.580   -8.916  0.054  1.00 1.57 ?  38 LYS   A HE3  6  
ATOM   3570 H HZ1  . LYS   A 1 38 ? -0.587  -11.561 0.718  1.00 2.60 ?  38 LYS   A HZ1  6  
ATOM   3571 H HZ2  . LYS   A 1 38 ? 0.114   -10.507 1.841  1.00 2.57 ?  38 LYS   A HZ2  6  
ATOM   3572 H HZ3  . LYS   A 1 38 ? 1.058   -11.184 0.611  1.00 2.71 ?  38 LYS   A HZ3  6  
ATOM   3573 N N    . CYS   A 1 39 ? -3.709  -4.778  -0.902 1.00 0.12 ?  39 CYS   A N    6  
ATOM   3574 C CA   . CYS   A 1 39 ? -4.944  -4.300  -0.314 1.00 0.12 ?  39 CYS   A CA   6  
ATOM   3575 C C    . CYS   A 1 39 ? -5.676  -5.424  0.408  1.00 0.15 ?  39 CYS   A C    6  
ATOM   3576 O O    . CYS   A 1 39 ? -5.624  -6.583  -0.008 1.00 0.19 ?  39 CYS   A O    6  
ATOM   3577 C CB   . CYS   A 1 39 ? -5.839  -3.708  -1.398 1.00 0.13 ?  39 CYS   A CB   6  
ATOM   3578 S SG   . CYS   A 1 39 ? -5.042  -2.401  -2.383 1.00 0.14 ?  39 CYS   A SG   6  
ATOM   3579 H H    . CYS   A 1 39 ? -3.705  -5.049  -1.845 1.00 0.16 ?  39 CYS   A H    6  
ATOM   3580 H HA   . CYS   A 1 39 ? -4.697  -3.530  0.399  1.00 0.11 ?  39 CYS   A HA   6  
ATOM   3581 H HB2  . CYS   A 1 39 ? -6.141  -4.494  -2.073 1.00 0.15 ?  39 CYS   A HB2  6  
ATOM   3582 H HB3  . CYS   A 1 39 ? -6.717  -3.282  -0.933 1.00 0.15 ?  39 CYS   A HB3  6  
ATOM   3583 N N    . TYR   A 1 40 ? -6.356  -5.070  1.486  1.00 0.18 ?  40 TYR   A N    6  
ATOM   3584 C CA   . TYR   A 1 40 ? -7.113  -6.029  2.274  1.00 0.25 ?  40 TYR   A CA   6  
ATOM   3585 C C    . TYR   A 1 40 ? -8.450  -5.427  2.686  1.00 0.32 ?  40 TYR   A C    6  
ATOM   3586 O O    . TYR   A 1 40 ? -8.541  -4.234  2.970  1.00 0.88 ?  40 TYR   A O    6  
ATOM   3587 C CB   . TYR   A 1 40 ? -6.319  -6.471  3.510  1.00 0.27 ?  40 TYR   A CB   6  
ATOM   3588 C CG   . TYR   A 1 40 ? -5.915  -5.344  4.436  1.00 0.25 ?  40 TYR   A CG   6  
ATOM   3589 C CD1  . TYR   A 1 40 ? -4.687  -4.708  4.302  1.00 0.22 ?  40 TYR   A CD1  6  
ATOM   3590 C CD2  . TYR   A 1 40 ? -6.770  -4.910  5.438  1.00 0.32 ?  40 TYR   A CD2  6  
ATOM   3591 C CE1  . TYR   A 1 40 ? -4.324  -3.673  5.141  1.00 0.25 ?  40 TYR   A CE1  6  
ATOM   3592 C CE2  . TYR   A 1 40 ? -6.415  -3.877  6.281  1.00 0.35 ?  40 TYR   A CE2  6  
ATOM   3593 C CZ   . TYR   A 1 40 ? -5.157  -3.287  6.144  1.00 0.31 ?  40 TYR   A CZ   6  
ATOM   3594 O OH   . TYR   A 1 40 ? -4.838  -2.235  6.972  1.00 0.37 ?  40 TYR   A OH   6  
ATOM   3595 H H    . TYR   A 1 40 ? -6.353  -4.125  1.762  1.00 0.18 ?  40 TYR   A H    6  
ATOM   3596 H HA   . TYR   A 1 40 ? -7.300  -6.892  1.652  1.00 0.31 ?  40 TYR   A HA   6  
ATOM   3597 H HB2  . TYR   A 1 40 ? -6.916  -7.162  4.082  1.00 0.32 ?  40 TYR   A HB2  6  
ATOM   3598 H HB3  . TYR   A 1 40 ? -5.417  -6.969  3.184  1.00 0.28 ?  40 TYR   A HB3  6  
ATOM   3599 H HD1  . TYR   A 1 40 ? -4.010  -5.037  3.527  1.00 0.22 ?  40 TYR   A HD1  6  
ATOM   3600 H HD2  . TYR   A 1 40 ? -7.725  -5.399  5.560  1.00 0.36 ?  40 TYR   A HD2  6  
ATOM   3601 H HE1  . TYR   A 1 40 ? -3.364  -3.191  5.020  1.00 0.26 ?  40 TYR   A HE1  6  
ATOM   3602 H HE2  . TYR   A 1 40 ? -7.096  -3.555  7.055  1.00 0.41 ?  40 TYR   A HE2  6  
ATOM   3603 H HH   . TYR   A 1 40 ? -4.486  -1.504  6.450  1.00 1.13 ?  40 TYR   A HH   6  
HETATM 3604 N N    . NH2   A 1 41 ? -9.489  -6.239  2.695  1.00 0.59 ?  41 NH2   A N    6  
HETATM 3605 H HN1  . NH2   A 1 41 ? -9.345  -7.179  2.455  1.00 1.06 ?  41 NH2   A HN1  6  
HETATM 3606 H HN2  . NH2   A 1 41 ? -10.363 -5.871  2.950  1.00 0.56 ?  41 NH2   A HN2  6  
ATOM   3607 N N    . GLY   A 1 1  ? 4.726   -0.402  -6.549 1.00 1.74 ?  1  GLY   A N    7  
ATOM   3608 C CA   . GLY   A 1 1  ? 4.071   0.916   -6.722 1.00 0.89 ?  1  GLY   A CA   7  
ATOM   3609 C C    . GLY   A 1 1  ? 3.172   1.262   -5.553 1.00 0.90 ?  1  GLY   A C    7  
ATOM   3610 O O    . GLY   A 1 1  ? 3.168   0.557   -4.543 1.00 1.76 ?  1  GLY   A O    7  
ATOM   3611 H H1   . GLY   A 1 1  ? 5.309   -0.401  -5.684 1.00 2.34 ?  1  GLY   A H1   7  
ATOM   3612 H H2   . GLY   A 1 1  ? 5.339   -0.607  -7.362 1.00 1.93 ?  1  GLY   A H2   7  
ATOM   3613 H H3   . GLY   A 1 1  ? 4.010   -1.148  -6.468 1.00 2.29 ?  1  GLY   A H3   7  
ATOM   3614 H HA2  . GLY   A 1 1  ? 4.831   1.677   -6.818 1.00 0.93 ?  1  GLY   A HA2  7  
ATOM   3615 H HA3  . GLY   A 1 1  ? 3.479   0.894   -7.625 1.00 1.19 ?  1  GLY   A HA3  7  
ATOM   3616 N N    . PHE   A 1 2  ? 2.422   2.355   -5.693 1.00 0.43 ?  2  PHE   A N    7  
ATOM   3617 C CA   . PHE   A 1 2  ? 1.459   2.800   -4.684 1.00 0.24 ?  2  PHE   A CA   7  
ATOM   3618 C C    . PHE   A 1 2  ? 2.112   2.969   -3.316 1.00 0.22 ?  2  PHE   A C    7  
ATOM   3619 O O    . PHE   A 1 2  ? 1.561   2.566   -2.294 1.00 0.35 ?  2  PHE   A O    7  
ATOM   3620 C CB   . PHE   A 1 2  ? 0.286   1.821   -4.604 1.00 0.16 ?  2  PHE   A CB   7  
ATOM   3621 C CG   . PHE   A 1 2  ? -0.363  1.581   -5.936 1.00 0.18 ?  2  PHE   A CG   7  
ATOM   3622 C CD1  . PHE   A 1 2  ? -0.291  0.339   -6.544 1.00 0.25 ?  2  PHE   A CD1  7  
ATOM   3623 C CD2  . PHE   A 1 2  ? -1.029  2.605   -6.585 1.00 0.22 ?  2  PHE   A CD2  7  
ATOM   3624 C CE1  . PHE   A 1 2  ? -0.876  0.124   -7.777 1.00 0.30 ?  2  PHE   A CE1  7  
ATOM   3625 C CE2  . PHE   A 1 2  ? -1.617  2.396   -7.816 1.00 0.28 ?  2  PHE   A CE2  7  
ATOM   3626 C CZ   . PHE   A 1 2  ? -1.540  1.154   -8.415 1.00 0.29 ?  2  PHE   A CZ   7  
ATOM   3627 H H    . PHE   A 1 2  ? 2.513   2.883   -6.515 1.00 1.00 ?  2  PHE   A H    7  
ATOM   3628 H HA   . PHE   A 1 2  ? 1.084   3.762   -5.000 1.00 0.34 ?  2  PHE   A HA   7  
ATOM   3629 H HB2  . PHE   A 1 2  ? 0.638   0.875   -4.226 1.00 0.26 ?  2  PHE   A HB2  7  
ATOM   3630 H HB3  . PHE   A 1 2  ? -0.465  2.217   -3.934 1.00 0.20 ?  2  PHE   A HB3  7  
ATOM   3631 H HD1  . PHE   A 1 2  ? 0.228   -0.467  -6.046 1.00 0.32 ?  2  PHE   A HD1  7  
ATOM   3632 H HD2  . PHE   A 1 2  ? -1.090  3.576   -6.115 1.00 0.27 ?  2  PHE   A HD2  7  
ATOM   3633 H HE1  . PHE   A 1 2  ? -0.814  -0.848  -8.242 1.00 0.37 ?  2  PHE   A HE1  7  
ATOM   3634 H HE2  . PHE   A 1 2  ? -2.133  3.204   -8.311 1.00 0.36 ?  2  PHE   A HE2  7  
ATOM   3635 H HZ   . PHE   A 1 2  ? -1.998  0.989   -9.378 1.00 0.34 ?  2  PHE   A HZ   7  
ATOM   3636 N N    . GLY   A 1 3  ? 3.291   3.572   -3.309 1.00 0.18 ?  3  GLY   A N    7  
ATOM   3637 C CA   . GLY   A 1 3  ? 4.001   3.801   -2.067 1.00 0.20 ?  3  GLY   A CA   7  
ATOM   3638 C C    . GLY   A 1 3  ? 5.052   2.750   -1.803 1.00 0.19 ?  3  GLY   A C    7  
ATOM   3639 O O    . GLY   A 1 3  ? 5.951   2.955   -0.995 1.00 0.21 ?  3  GLY   A O    7  
ATOM   3640 H H    . GLY   A 1 3  ? 3.682   3.869   -4.157 1.00 0.21 ?  3  GLY   A H    7  
ATOM   3641 H HA2  . GLY   A 1 3  ? 4.479   4.768   -2.113 1.00 0.23 ?  3  GLY   A HA2  7  
ATOM   3642 H HA3  . GLY   A 1 3  ? 3.293   3.795   -1.255 1.00 0.24 ?  3  GLY   A HA3  7  
ATOM   3643 N N    . CYS   A 1 4  ? 4.927   1.623   -2.477 1.00 0.25 ?  4  CYS   A N    7  
ATOM   3644 C CA   . CYS   A 1 4  ? 5.888   0.543   -2.339 1.00 0.27 ?  4  CYS   A CA   7  
ATOM   3645 C C    . CYS   A 1 4  ? 6.839   0.522   -3.525 1.00 0.29 ?  4  CYS   A C    7  
ATOM   3646 O O    . CYS   A 1 4  ? 6.502   0.004   -4.590 1.00 0.30 ?  4  CYS   A O    7  
ATOM   3647 C CB   . CYS   A 1 4  ? 5.158   -0.793  -2.235 1.00 0.28 ?  4  CYS   A CB   7  
ATOM   3648 S SG   . CYS   A 1 4  ? 4.001   -0.896  -0.837 1.00 0.39 ?  4  CYS   A SG   7  
ATOM   3649 H H    . CYS   A 1 4  ? 4.160   1.504   -3.074 1.00 0.30 ?  4  CYS   A H    7  
ATOM   3650 H HA   . CYS   A 1 4  ? 6.453   0.710   -1.437 1.00 0.30 ?  4  CYS   A HA   7  
ATOM   3651 H HB2  . CYS   A 1 4  ? 4.593   -0.958  -3.140 1.00 0.21 ?  4  CYS   A HB2  7  
ATOM   3652 H HB3  . CYS   A 1 4  ? 5.884   -1.582  -2.119 1.00 0.42 ?  4  CYS   A HB3  7  
ATOM   3653 N N    . ASN   A 1 5  ? 8.016   1.105   -3.351 1.00 0.34 ?  5  ASN   A N    7  
ATOM   3654 C CA   . ASN   A 1 5  ? 9.022   1.113   -4.404 1.00 0.40 ?  5  ASN   A CA   7  
ATOM   3655 C C    . ASN   A 1 5  ? 10.359  0.599   -3.879 1.00 0.40 ?  5  ASN   A C    7  
ATOM   3656 O O    . ASN   A 1 5  ? 11.424  0.968   -4.381 1.00 0.47 ?  5  ASN   A O    7  
ATOM   3657 C CB   . ASN   A 1 5  ? 9.191   2.518   -4.994 1.00 0.49 ?  5  ASN   A CB   7  
ATOM   3658 C CG   . ASN   A 1 5  ? 7.911   3.060   -5.603 1.00 0.49 ?  5  ASN   A CG   7  
ATOM   3659 O OD1  . ASN   A 1 5  ? 7.616   2.822   -6.774 1.00 0.65 ?  5  ASN   A OD1  7  
ATOM   3660 N ND2  . ASN   A 1 5  ? 7.147   3.808   -4.820 1.00 0.56 ?  5  ASN   A ND2  7  
ATOM   3661 H H    . ASN   A 1 5  ? 8.212   1.549   -2.493 1.00 0.36 ?  5  ASN   A H    7  
ATOM   3662 H HA   . ASN   A 1 5  ? 8.683   0.445   -5.183 1.00 0.43 ?  5  ASN   A HA   7  
ATOM   3663 H HB2  . ASN   A 1 5  ? 9.508   3.193   -4.214 1.00 0.51 ?  5  ASN   A HB2  7  
ATOM   3664 H HB3  . ASN   A 1 5  ? 9.949   2.485   -5.764 1.00 0.57 ?  5  ASN   A HB3  7  
ATOM   3665 H HD21 . ASN   A 1 5  ? 7.450   3.974   -3.896 1.00 0.70 ?  5  ASN   A HD21 7  
ATOM   3666 H HD22 . ASN   A 1 5  ? 6.316   4.167   -5.189 1.00 0.61 ?  5  ASN   A HD22 7  
ATOM   3667 N N    . GLY   A 1 6  ? 10.303  -0.247  -2.862 1.00 0.36 ?  6  GLY   A N    7  
ATOM   3668 C CA   . GLY   A 1 6  ? 11.506  -0.867  -2.357 1.00 0.38 ?  6  GLY   A CA   7  
ATOM   3669 C C    . GLY   A 1 6  ? 11.817  -0.493  -0.922 1.00 0.37 ?  6  GLY   A C    7  
ATOM   3670 O O    . GLY   A 1 6  ? 11.073  0.261   -0.295 1.00 0.36 ?  6  GLY   A O    7  
ATOM   3671 H H    . GLY   A 1 6  ? 9.436   -0.453  -2.447 1.00 0.34 ?  6  GLY   A H    7  
ATOM   3672 H HA2  . GLY   A 1 6  ? 11.392  -1.939  -2.416 1.00 0.48 ?  6  GLY   A HA2  7  
ATOM   3673 H HA3  . GLY   A 1 6  ? 12.335  -0.571  -2.983 1.00 0.44 ?  6  GLY   A HA3  7  
HETATM 3674 C C2   . 6ZS   A 1 7  ? 15.482  -0.892  2.350  1.00 1.49 ?  7  6ZS   A C2   7  
HETATM 3675 N N    . 6ZS   A 1 7  ? 12.942  -1.013  -0.427 1.00 0.47 ?  7  6ZS   A N    7  
HETATM 3676 C CA   . 6ZS   A 1 7  ? 13.377  -0.833  0.967  1.00 0.61 ?  7  6ZS   A CA   7  
HETATM 3677 C CB1  . 6ZS   A 1 7  ? 12.433  -1.578  1.896  1.00 0.71 ?  7  6ZS   A CB1  7  
HETATM 3678 C C    . 6ZS   A 1 7  ? 13.416  0.660   1.325  1.00 0.59 ?  7  6ZS   A C    7  
HETATM 3679 O O    . 6ZS   A 1 7  ? 12.980  1.069   2.406  1.00 1.09 ?  7  6ZS   A O    7  
HETATM 3680 C CB   . 6ZS   A 1 7  ? 14.765  -1.452  1.131  1.00 0.75 ?  7  6ZS   A CB   7  
HETATM 3681 H H1   . 6ZS   A 1 7  ? 15.560  0.181   2.260  1.00 2.14 ?  7  6ZS   A H1   7  
HETATM 3682 H H4   . 6ZS   A 1 7  ? 14.928  -1.140  3.243  1.00 1.94 ?  7  6ZS   A H4   7  
HETATM 3683 H H3   . 6ZS   A 1 7  ? 16.473  -1.319  2.413  1.00 2.00 ?  7  6ZS   A H3   7  
HETATM 3684 H H    . 6ZS   A 1 7  ? 13.507  -1.548  -1.022 1.00 0.49 ?  7  6ZS   A H    7  
HETATM 3685 H H7   . 6ZS   A 1 7  ? 11.428  -1.219  1.749  1.00 1.10 ?  7  6ZS   A H7   7  
HETATM 3686 H H8   . 6ZS   A 1 7  ? 12.728  -1.412  2.920  1.00 1.35 ?  7  6ZS   A H8   7  
HETATM 3687 H H9   . 6ZS   A 1 7  ? 12.473  -2.635  1.677  1.00 1.26 ?  7  6ZS   A H9   7  
HETATM 3688 H H10  . 6ZS   A 1 7  ? 14.673  -2.521  1.252  1.00 1.09 ?  7  6ZS   A H10  7  
HETATM 3689 H H11  . 6ZS   A 1 7  ? 15.366  -1.236  0.258  1.00 1.38 ?  7  6ZS   A H11  7  
ATOM   3690 N N    . TRP   A 1 8  ? 13.922  1.470   0.406  1.00 0.64 ?  8  TRP   A N    7  
ATOM   3691 C CA   . TRP   A 1 8  ? 14.156  2.878   0.680  1.00 0.67 ?  8  TRP   A CA   7  
ATOM   3692 C C    . TRP   A 1 8  ? 12.953  3.728   0.306  1.00 0.49 ?  8  TRP   A C    7  
ATOM   3693 O O    . TRP   A 1 8  ? 12.980  4.952   0.441  1.00 0.58 ?  8  TRP   A O    7  
ATOM   3694 C CB   . TRP   A 1 8  ? 15.403  3.351   -0.062 1.00 0.87 ?  8  TRP   A CB   7  
ATOM   3695 C CG   . TRP   A 1 8  ? 16.630  2.594   0.339  1.00 1.12 ?  8  TRP   A CG   7  
ATOM   3696 C CD1  . TRP   A 1 8  ? 17.270  1.632   -0.383 1.00 1.27 ?  8  TRP   A CD1  7  
ATOM   3697 C CD2  . TRP   A 1 8  ? 17.349  2.719   1.571  1.00 1.31 ?  8  TRP   A CD2  7  
ATOM   3698 N NE1  . TRP   A 1 8  ? 18.347  1.153   0.319  1.00 1.50 ?  8  TRP   A NE1  7  
ATOM   3699 C CE2  . TRP   A 1 8  ? 18.419  1.806   1.522  1.00 1.52 ?  8  TRP   A CE2  7  
ATOM   3700 C CE3  . TRP   A 1 8  ? 17.199  3.517   2.710  1.00 1.37 ?  8  TRP   A CE3  7  
ATOM   3701 C CZ2  . TRP   A 1 8  ? 19.328  1.668   2.567  1.00 1.76 ?  8  TRP   A CZ2  7  
ATOM   3702 C CZ3  . TRP   A 1 8  ? 18.102  3.378   3.744  1.00 1.63 ?  8  TRP   A CZ3  7  
ATOM   3703 C CH2  . TRP   A 1 8  ? 19.155  2.460   3.665  1.00 1.80 ?  8  TRP   A CH2  7  
ATOM   3704 H H    . TRP   A 1 8  ? 14.134  1.114   -0.481 1.00 1.04 ?  8  TRP   A H    7  
ATOM   3705 H HA   . TRP   A 1 8  ? 14.330  2.975   1.739  1.00 0.76 ?  8  TRP   A HA   7  
ATOM   3706 H HB2  . TRP   A 1 8  ? 15.256  3.219   -1.123 1.00 0.85 ?  8  TRP   A HB2  7  
ATOM   3707 H HB3  . TRP   A 1 8  ? 15.566  4.395   0.147  1.00 0.91 ?  8  TRP   A HB3  7  
ATOM   3708 H HD1  . TRP   A 1 8  ? 16.962  1.304   -1.364 1.00 1.25 ?  8  TRP   A HD1  7  
ATOM   3709 H HE1  . TRP   A 1 8  ? 18.968  0.455   0.010  1.00 1.65 ?  8  TRP   A HE1  7  
ATOM   3710 H HE3  . TRP   A 1 8  ? 16.393  4.231   2.791  1.00 1.26 ?  8  TRP   A HE3  7  
ATOM   3711 H HZ2  . TRP   A 1 8  ? 20.146  0.966   2.525  1.00 1.93 ?  8  TRP   A HZ2  7  
ATOM   3712 H HZ3  . TRP   A 1 8  ? 18.000  3.985   4.630  1.00 1.73 ?  8  TRP   A HZ3  7  
ATOM   3713 H HH2  . TRP   A 1 8  ? 19.838  2.384   4.497  1.00 2.00 ?  8  TRP   A HH2  7  
ATOM   3714 N N    . ASN   A 1 9  ? 11.896  3.080   -0.151 1.00 0.33 ?  9  ASN   A N    7  
ATOM   3715 C CA   . ASN   A 1 9  ? 10.672  3.776   -0.512 1.00 0.29 ?  9  ASN   A CA   7  
ATOM   3716 C C    . ASN   A 1 9  ? 9.478   2.902   -0.163 1.00 0.25 ?  9  ASN   A C    7  
ATOM   3717 O O    . ASN   A 1 9  ? 8.798   2.368   -1.035 1.00 0.36 ?  9  ASN   A O    7  
ATOM   3718 C CB   . ASN   A 1 9  ? 10.661  4.124   -2.002 1.00 0.46 ?  9  ASN   A CB   7  
ATOM   3719 C CG   . ASN   A 1 9  ? 9.554   5.099   -2.362 1.00 1.31 ?  9  ASN   A CG   7  
ATOM   3720 O OD1  . ASN   A 1 9  ? 8.424   4.707   -2.645 1.00 2.05 ?  9  ASN   A OD1  7  
ATOM   3721 N ND2  . ASN   A 1 9  ? 9.876   6.379   -2.369 1.00 1.88 ?  9  ASN   A ND2  7  
ATOM   3722 H H    . ASN   A 1 9  ? 11.929  2.101   -0.234 1.00 0.35 ?  9  ASN   A H    7  
ATOM   3723 H HA   . ASN   A 1 9  ? 10.622  4.685   0.068  1.00 0.37 ?  9  ASN   A HA   7  
ATOM   3724 H HB2  . ASN   A 1 9  ? 11.608  4.571   -2.270 1.00 1.10 ?  9  ASN   A HB2  7  
ATOM   3725 H HB3  . ASN   A 1 9  ? 10.520  3.221   -2.573 1.00 0.63 ?  9  ASN   A HB3  7  
ATOM   3726 H HD21 . ASN   A 1 9  ? 10.799  6.628   -2.147 1.00 2.03 ?  9  ASN   A HD21 7  
ATOM   3727 H HD22 . ASN   A 1 9  ? 9.177   7.029   -2.587 1.00 2.48 ?  9  ASN   A HD22 7  
ATOM   3728 N N    . GLU   A 1 10 ? 9.266   2.728   1.126  1.00 0.23 ?  10 GLU   A N    7  
ATOM   3729 C CA   . GLU   A 1 10 ? 8.184   1.902   1.625  1.00 0.26 ?  10 GLU   A CA   7  
ATOM   3730 C C    . GLU   A 1 10 ? 7.229   2.748   2.449  1.00 0.28 ?  10 GLU   A C    7  
ATOM   3731 O O    . GLU   A 1 10 ? 7.505   3.059   3.611  1.00 0.49 ?  10 GLU   A O    7  
ATOM   3732 C CB   . GLU   A 1 10 ? 8.756   0.763   2.471  1.00 0.39 ?  10 GLU   A CB   7  
ATOM   3733 C CG   . GLU   A 1 10 ? 7.708   -0.067  3.190  1.00 0.45 ?  10 GLU   A CG   7  
ATOM   3734 C CD   . GLU   A 1 10 ? 8.320   -1.056  4.159  1.00 0.68 ?  10 GLU   A CD   7  
ATOM   3735 O OE1  . GLU   A 1 10 ? 9.040   -0.622  5.088  1.00 0.95 ?  10 GLU   A OE1  7  
ATOM   3736 O OE2  . GLU   A 1 10 ? 8.073   -2.269  4.013  1.00 0.78 -1 10 GLU   A OE2  7  
ATOM   3737 H H    . GLU   A 1 10 ? 9.854   3.174   1.768  1.00 0.28 ?  10 GLU   A H    7  
ATOM   3738 H HA   . GLU   A 1 10 ? 7.654   1.493   0.780  1.00 0.27 ?  10 GLU   A HA   7  
ATOM   3739 H HB2  . GLU   A 1 10 ? 9.319   0.108   1.828  1.00 0.43 ?  10 GLU   A HB2  7  
ATOM   3740 H HB3  . GLU   A 1 10 ? 9.420   1.181   3.211  1.00 0.48 ?  10 GLU   A HB3  7  
ATOM   3741 H HG2  . GLU   A 1 10 ? 7.057   0.596   3.735  1.00 0.47 ?  10 GLU   A HG2  7  
ATOM   3742 H HG3  . GLU   A 1 10 ? 7.133   -0.609  2.458  1.00 0.40 ?  10 GLU   A HG3  7  
ATOM   3743 N N    . ASP   A 1 11 ? 6.120   3.141   1.846  1.00 0.23 ?  11 ASP   A N    7  
ATOM   3744 C CA   . ASP   A 1 11 ? 5.137   3.957   2.537  1.00 0.30 ?  11 ASP   A CA   7  
ATOM   3745 C C    . ASP   A 1 11 ? 3.789   3.253   2.610  1.00 0.23 ?  11 ASP   A C    7  
ATOM   3746 O O    . ASP   A 1 11 ? 2.940   3.393   1.719  1.00 0.20 ?  11 ASP   A O    7  
ATOM   3747 C CB   . ASP   A 1 11 ? 4.989   5.315   1.858  1.00 0.38 ?  11 ASP   A CB   7  
ATOM   3748 C CG   . ASP   A 1 11 ? 4.118   6.259   2.657  1.00 0.99 ?  11 ASP   A CG   7  
ATOM   3749 O OD1  . ASP   A 1 11 ? 3.015   6.593   2.191  1.00 1.86 ?  11 ASP   A OD1  7  
ATOM   3750 O OD2  . ASP   A 1 11 ? 4.538   6.674   3.762  1.00 1.32 -1 11 ASP   A OD2  7  
ATOM   3751 H H    . ASP   A 1 11 ? 5.964   2.886   0.909  1.00 0.30 ?  11 ASP   A H    7  
ATOM   3752 H HA   . ASP   A 1 11 ? 5.496   4.112   3.543  1.00 0.38 ?  11 ASP   A HA   7  
ATOM   3753 H HB2  . ASP   A 1 11 ? 5.964   5.761   1.741  1.00 0.94 ?  11 ASP   A HB2  7  
ATOM   3754 H HB3  . ASP   A 1 11 ? 4.540   5.175   0.886  1.00 0.78 ?  11 ASP   A HB3  7  
ATOM   3755 N N    . ASP   A 1 12 ? 3.601   2.498   3.687  1.00 0.25 ?  12 ASP   A N    7  
ATOM   3756 C CA   . ASP   A 1 12 ? 2.349   1.794   3.943  1.00 0.26 ?  12 ASP   A CA   7  
ATOM   3757 C C    . ASP   A 1 12 ? 1.177   2.764   3.944  1.00 0.18 ?  12 ASP   A C    7  
ATOM   3758 O O    . ASP   A 1 12 ? 0.057   2.395   3.592  1.00 0.18 ?  12 ASP   A O    7  
ATOM   3759 C CB   . ASP   A 1 12 ? 2.407   1.071   5.292  1.00 0.39 ?  12 ASP   A CB   7  
ATOM   3760 C CG   . ASP   A 1 12 ? 3.425   -0.053  5.324  1.00 0.82 ?  12 ASP   A CG   7  
ATOM   3761 O OD1  . ASP   A 1 12 ? 4.619   0.225   5.577  1.00 1.45 ?  12 ASP   A OD1  7  
ATOM   3762 O OD2  . ASP   A 1 12 ? 3.036   -1.220  5.113  1.00 1.50 -1 12 ASP   A OD2  7  
ATOM   3763 H H    . ASP   A 1 12 ? 4.336   2.402   4.328  1.00 0.31 ?  12 ASP   A H    7  
ATOM   3764 H HA   . ASP   A 1 12 ? 2.205   1.069   3.159  1.00 0.27 ?  12 ASP   A HA   7  
ATOM   3765 H HB2  . ASP   A 1 12 ? 2.663   1.780   6.060  1.00 1.12 ?  12 ASP   A HB2  7  
ATOM   3766 H HB3  . ASP   A 1 12 ? 1.436   0.659   5.506  1.00 1.15 ?  12 ASP   A HB3  7  
HETATM 3767 N N    . 2ML   A 1 13 ? 1.461   4.008   4.331  1.00 0.18 ?  13 2ML   A N    7  
HETATM 3768 C CA   . 2ML   A 1 13 ? 0.456   5.070   4.399  1.00 0.19 ?  13 2ML   A CA   7  
HETATM 3769 C CB1  . 2ML   A 1 13 ? 1.147   6.365   4.832  1.00 0.24 ?  13 2ML   A CB1  7  
HETATM 3770 C CB2  . 2ML   A 1 13 ? -0.581  4.720   5.453  1.00 0.25 ?  13 2ML   A CB2  7  
HETATM 3771 C CG   . 2ML   A 1 13 ? 0.159   7.540   4.914  1.00 0.33 ?  13 2ML   A CG   7  
HETATM 3772 C CD1  . 2ML   A 1 13 ? 0.544   8.470   6.052  1.00 0.57 ?  13 2ML   A CD1  7  
HETATM 3773 C CD2  . 2ML   A 1 13 ? 0.133   8.321   3.606  1.00 0.54 ?  13 2ML   A CD2  7  
HETATM 3774 C C    . 2ML   A 1 13 ? -0.211  5.232   3.023  1.00 0.16 ?  13 2ML   A C    7  
HETATM 3775 O O    . 2ML   A 1 13 ? -1.440  5.273   2.919  1.00 0.17 ?  13 2ML   A O    7  
HETATM 3776 H H    . 2ML   A 1 13 ? 2.381   4.222   4.578  1.00 0.20 ?  13 2ML   A H    7  
HETATM 3777 H HB11 . 2ML   A 1 13 ? 1.915   6.611   4.116  1.00 0.28 ?  13 2ML   A HB11 7  
HETATM 3778 H HB12 . 2ML   A 1 13 ? 1.605   6.214   5.800  1.00 0.32 ?  13 2ML   A HB12 7  
HETATM 3779 H HB21 . 2ML   A 1 13 ? -0.130  4.757   6.433  1.00 0.92 ?  13 2ML   A HB21 7  
HETATM 3780 H HB22 . 2ML   A 1 13 ? -0.950  3.722   5.270  1.00 0.95 ?  13 2ML   A HB22 7  
HETATM 3781 H HB23 . 2ML   A 1 13 ? -1.402  5.419   5.405  1.00 1.02 ?  13 2ML   A HB23 7  
HETATM 3782 H HG   . 2ML   A 1 13 ? -0.833  7.164   5.104  1.00 0.64 ?  13 2ML   A HG   7  
HETATM 3783 H HD11 . 2ML   A 1 13 ? -0.141  9.306   6.081  1.00 1.31 ?  13 2ML   A HD11 7  
HETATM 3784 H HD12 . 2ML   A 1 13 ? 1.549   8.834   5.896  1.00 0.88 ?  13 2ML   A HD12 7  
HETATM 3785 H HD13 . 2ML   A 1 13 ? 0.496   7.935   6.989  1.00 1.28 ?  13 2ML   A HD13 7  
HETATM 3786 H HD21 . 2ML   A 1 13 ? 1.115   8.723   3.406  1.00 1.20 ?  13 2ML   A HD21 7  
HETATM 3787 H HD22 . 2ML   A 1 13 ? -0.580  9.128   3.682  1.00 1.15 ?  13 2ML   A HD22 7  
HETATM 3788 H HD23 . 2ML   A 1 13 ? -0.155  7.660   2.801  1.00 1.05 ?  13 2ML   A HD23 7  
ATOM   3789 N N    . ARG   A 1 14 ? 0.602   5.310   1.973  1.00 0.14 ?  14 ARG   A N    7  
ATOM   3790 C CA   . ARG   A 1 14 ? 0.083   5.531   0.628  1.00 0.16 ?  14 ARG   A CA   7  
ATOM   3791 C C    . ARG   A 1 14 ? -0.569  4.269   0.091  1.00 0.12 ?  14 ARG   A C    7  
ATOM   3792 O O    . ARG   A 1 14 ? -1.544  4.336   -0.654 1.00 0.14 ?  14 ARG   A O    7  
ATOM   3793 C CB   . ARG   A 1 14 ? 1.182   5.990   -0.325 1.00 0.21 ?  14 ARG   A CB   7  
ATOM   3794 C CG   . ARG   A 1 14 ? 0.653   6.397   -1.689 1.00 1.03 ?  14 ARG   A CG   7  
ATOM   3795 C CD   . ARG   A 1 14 ? 1.778   6.666   -2.676 1.00 1.04 ?  14 ARG   A CD   7  
ATOM   3796 N NE   . ARG   A 1 14 ? 2.678   7.732   -2.230 1.00 1.37 ?  14 ARG   A NE   7  
ATOM   3797 C CZ   . ARG   A 1 14 ? 3.557   8.338   -3.027 1.00 1.63 ?  14 ARG   A CZ   7  
ATOM   3798 N NH1  . ARG   A 1 14 ? 3.664   7.977   -4.300 1.00 1.31 1  14 ARG   A NH1  7  
ATOM   3799 N NH2  . ARG   A 1 14 ? 4.330   9.300   -2.550 1.00 2.60 ?  14 ARG   A NH2  7  
ATOM   3800 H H    . ARG   A 1 14 ? 1.574   5.218   2.106  1.00 0.17 ?  14 ARG   A H    7  
ATOM   3801 H HA   . ARG   A 1 14 ? -0.666  6.303   0.688  1.00 0.20 ?  14 ARG   A HA   7  
ATOM   3802 H HB2  . ARG   A 1 14 ? 1.693   6.834   0.110  1.00 0.88 ?  14 ARG   A HB2  7  
ATOM   3803 H HB3  . ARG   A 1 14 ? 1.884   5.188   -0.461 1.00 0.69 ?  14 ARG   A HB3  7  
ATOM   3804 H HG2  . ARG   A 1 14 ? 0.034   5.599   -2.072 1.00 1.51 ?  14 ARG   A HG2  7  
ATOM   3805 H HG3  . ARG   A 1 14 ? 0.057   7.292   -1.579 1.00 1.60 ?  14 ARG   A HG3  7  
ATOM   3806 H HD2  . ARG   A 1 14 ? 2.350   5.759   -2.800 1.00 1.51 ?  14 ARG   A HD2  7  
ATOM   3807 H HD3  . ARG   A 1 14 ? 1.347   6.948   -3.625 1.00 1.55 ?  14 ARG   A HD3  7  
ATOM   3808 H HE   . ARG   A 1 14 ? 2.624   8.007   -1.285 1.00 1.89 ?  14 ARG   A HE   7  
ATOM   3809 H HH11 . ARG   A 1 14 ? 4.326   8.436   -4.902 1.00 1.53 ?  14 ARG   A HH11 7  
ATOM   3810 H HH12 . ARG   A 1 14 ? 3.085   7.246   -4.668 1.00 1.40 ?  14 ARG   A HH12 7  
ATOM   3811 H HH21 . ARG   A 1 14 ? 4.991   9.758   -3.149 1.00 2.84 ?  14 ARG   A HH21 7  
ATOM   3812 H HH22 . ARG   A 1 14 ? 4.269   9.570   -1.585 1.00 3.21 ?  14 ARG   A HH22 7  
ATOM   3813 N N    . CYS   A 1 15 ? -0.033  3.120   0.473  1.00 0.11 ?  15 CYS   A N    7  
ATOM   3814 C CA   . CYS   A 1 15 ? -0.632  1.849   0.086  1.00 0.10 ?  15 CYS   A CA   7  
ATOM   3815 C C    . CYS   A 1 15 ? -2.039  1.756   0.673  1.00 0.09 ?  15 CYS   A C    7  
ATOM   3816 O O    . CYS   A 1 15 ? -2.997  1.395   -0.016 1.00 0.09 ?  15 CYS   A O    7  
ATOM   3817 C CB   . CYS   A 1 15 ? 0.233   0.675   0.558  1.00 0.13 ?  15 CYS   A CB   7  
ATOM   3818 S SG   . CYS   A 1 15 ? -0.415  -0.968  0.102  1.00 0.13 ?  15 CYS   A SG   7  
ATOM   3819 H H    . CYS   A 1 15 ? 0.783   3.127   1.025  1.00 0.12 ?  15 CYS   A H    7  
ATOM   3820 H HA   . CYS   A 1 15 ? -0.705  1.828   -0.994 1.00 0.11 ?  15 CYS   A HA   7  
ATOM   3821 H HB2  . CYS   A 1 15 ? 1.220   0.768   0.126  1.00 0.15 ?  15 CYS   A HB2  7  
ATOM   3822 H HB3  . CYS   A 1 15 ? 0.312   0.710   1.634  1.00 0.15 ?  15 CYS   A HB3  7  
ATOM   3823 N N    . HIS   A 1 16 ? -2.165  2.139   1.941  1.00 0.11 ?  16 HIS   A N    7  
ATOM   3824 C CA   . HIS   A 1 16 ? -3.458  2.171   2.603  1.00 0.13 ?  16 HIS   A CA   7  
ATOM   3825 C C    . HIS   A 1 16 ? -4.365  3.187   1.923  1.00 0.13 ?  16 HIS   A C    7  
ATOM   3826 O O    . HIS   A 1 16 ? -5.529  2.897   1.668  1.00 0.15 ?  16 HIS   A O    7  
ATOM   3827 C CB   . HIS   A 1 16 ? -3.297  2.510   4.092  1.00 0.17 ?  16 HIS   A CB   7  
ATOM   3828 C CG   . HIS   A 1 16 ? -4.594  2.631   4.842  1.00 0.27 ?  16 HIS   A CG   7  
ATOM   3829 N ND1  . HIS   A 1 16 ? -5.163  1.587   5.539  1.00 0.39 ?  16 HIS   A ND1  7  
ATOM   3830 C CD2  . HIS   A 1 16 ? -5.436  3.680   4.994  1.00 0.34 ?  16 HIS   A CD2  7  
ATOM   3831 C CE1  . HIS   A 1 16 ? -6.300  1.986   6.076  1.00 0.48 ?  16 HIS   A CE1  7  
ATOM   3832 N NE2  . HIS   A 1 16 ? -6.489  3.253   5.764  1.00 0.45 ?  16 HIS   A NE2  7  
ATOM   3833 H H    . HIS   A 1 16 ? -1.361  2.403   2.445  1.00 0.13 ?  16 HIS   A H    7  
ATOM   3834 H HA   . HIS   A 1 16 ? -3.903  1.191   2.508  1.00 0.14 ?  16 HIS   A HA   7  
ATOM   3835 H HB2  . HIS   A 1 16 ? -2.715  1.735   4.565  1.00 0.22 ?  16 HIS   A HB2  7  
ATOM   3836 H HB3  . HIS   A 1 16 ? -2.773  3.449   4.182  1.00 0.15 ?  16 HIS   A HB3  7  
ATOM   3837 H HD1  . HIS   A 1 16 ? -4.777  0.693   5.650  1.00 0.44 ?  16 HIS   A HD1  7  
ATOM   3838 H HD2  . HIS   A 1 16 ? -5.300  4.671   4.587  1.00 0.35 ?  16 HIS   A HD2  7  
ATOM   3839 H HE1  . HIS   A 1 16 ? -6.966  1.375   6.664  1.00 0.59 ?  16 HIS   A HE1  7  
ATOM   3840 H HE2  . HIS   A 1 16 ? -7.136  3.845   6.209  1.00 0.54 ?  16 HIS   A HE2  7  
HETATM 3841 N N    . AIB   A 1 17 ? -3.818  4.373   1.642  1.00 0.13 ?  17 AIB   A N    7  
HETATM 3842 C CA   . AIB   A 1 17 ? -4.554  5.442   0.952  1.00 0.15 ?  17 AIB   A CA   7  
HETATM 3843 C C    . AIB   A 1 17 ? -5.133  4.890   -0.356 1.00 0.13 ?  17 AIB   A C    7  
HETATM 3844 O O    . AIB   A 1 17 ? -6.320  5.065   -0.661 1.00 0.15 ?  17 AIB   A O    7  
HETATM 3845 C CB1  . AIB   A 1 17 ? -3.618  6.595   0.647  1.00 0.18 ?  17 AIB   A CB1  7  
HETATM 3846 C CB2  . AIB   A 1 17 ? -5.656  5.976   1.847  1.00 0.19 ?  17 AIB   A CB2  7  
HETATM 3847 H H    . AIB   A 1 17 ? -2.887  4.537   1.909  1.00 0.13 ?  17 AIB   A H    7  
HETATM 3848 H HB11 . AIB   A 1 17 ? -3.234  7.003   1.570  1.00 0.99 ?  17 AIB   A HB11 7  
HETATM 3849 H HB12 . AIB   A 1 17 ? -4.156  7.362   0.110  1.00 0.95 ?  17 AIB   A HB12 7  
HETATM 3850 H HB13 . AIB   A 1 17 ? -2.797  6.243   0.041  1.00 1.05 ?  17 AIB   A HB13 7  
HETATM 3851 H HB21 . AIB   A 1 17 ? -6.302  6.625   1.276  1.00 1.00 ?  17 AIB   A HB21 7  
HETATM 3852 H HB22 . AIB   A 1 17 ? -5.216  6.531   2.661  1.00 1.02 ?  17 AIB   A HB22 7  
HETATM 3853 H HB23 . AIB   A 1 17 ? -6.227  5.151   2.243  1.00 0.98 ?  17 AIB   A HB23 7  
ATOM   3854 N N    . HIS   A 1 18 ? -4.276  4.215   -1.112 1.00 0.12 ?  18 HIS   A N    7  
ATOM   3855 C CA   . HIS   A 1 18 ? -4.655  3.603   -2.375 1.00 0.12 ?  18 HIS   A CA   7  
ATOM   3856 C C    . HIS   A 1 18 ? -5.826  2.648   -2.185 1.00 0.09 ?  18 HIS   A C    7  
ATOM   3857 O O    . HIS   A 1 18 ? -6.897  2.840   -2.757 1.00 0.10 ?  18 HIS   A O    7  
ATOM   3858 C CB   . HIS   A 1 18 ? -3.445  2.863   -2.971 1.00 0.15 ?  18 HIS   A CB   7  
ATOM   3859 C CG   . HIS   A 1 18 ? -3.763  1.994   -4.152 1.00 0.19 ?  18 HIS   A CG   7  
ATOM   3860 N ND1  . HIS   A 1 18 ? -4.228  2.482   -5.354 1.00 0.23 ?  18 HIS   A ND1  7  
ATOM   3861 C CD2  . HIS   A 1 18 ? -3.670  0.653   -4.305 1.00 0.23 ?  18 HIS   A CD2  7  
ATOM   3862 C CE1  . HIS   A 1 18 ? -4.406  1.479   -6.195 1.00 0.28 ?  18 HIS   A CE1  7  
ATOM   3863 N NE2  . HIS   A 1 18 ? -4.074  0.356   -5.584 1.00 0.28 ?  18 HIS   A NE2  7  
ATOM   3864 H H    . HIS   A 1 18 ? -3.344  4.125   -0.804 1.00 0.12 ?  18 HIS   A H    7  
ATOM   3865 H HA   . HIS   A 1 18 ? -4.952  4.390   -3.050 1.00 0.14 ?  18 HIS   A HA   7  
ATOM   3866 H HB2  . HIS   A 1 18 ? -2.711  3.586   -3.286 1.00 0.17 ?  18 HIS   A HB2  7  
ATOM   3867 H HB3  . HIS   A 1 18 ? -3.010  2.234   -2.208 1.00 0.15 ?  18 HIS   A HB3  7  
ATOM   3868 H HD1  . HIS   A 1 18 ? -4.403  3.431   -5.561 1.00 0.24 ?  18 HIS   A HD1  7  
ATOM   3869 H HD2  . HIS   A 1 18 ? -3.335  -0.052  -3.558 1.00 0.24 ?  18 HIS   A HD2  7  
ATOM   3870 H HE1  . HIS   A 1 18 ? -4.750  1.565   -7.214 1.00 0.33 ?  18 HIS   A HE1  7  
ATOM   3871 H HE2  . HIS   A 1 18 ? -3.934  -0.508  -6.035 1.00 0.36 ?  18 HIS   A HE2  7  
ATOM   3872 N N    . CYS   A 1 19 ? -5.626  1.644   -1.353 1.00 0.09 ?  19 CYS   A N    7  
ATOM   3873 C CA   . CYS   A 1 19 ? -6.612  0.591   -1.179 1.00 0.09 ?  19 CYS   A CA   7  
ATOM   3874 C C    . CYS   A 1 19 ? -7.903  1.124   -0.560 1.00 0.09 ?  19 CYS   A C    7  
ATOM   3875 O O    . CYS   A 1 19 ? -8.992  0.678   -0.917 1.00 0.09 ?  19 CYS   A O    7  
ATOM   3876 C CB   . CYS   A 1 19 ? -6.017  -0.520  -0.323 1.00 0.11 ?  19 CYS   A CB   7  
ATOM   3877 S SG   . CYS   A 1 19 ? -4.434  -1.152  -0.965 1.00 0.12 ?  19 CYS   A SG   7  
ATOM   3878 H H    . CYS   A 1 19 ? -4.786  1.605   -0.837 1.00 0.11 ?  19 CYS   A H    7  
ATOM   3879 H HA   . CYS   A 1 19 ? -6.840  0.191   -2.155 1.00 0.10 ?  19 CYS   A HA   7  
ATOM   3880 H HB2  . CYS   A 1 19 ? -5.840  -0.143  0.675  1.00 0.13 ?  19 CYS   A HB2  7  
ATOM   3881 H HB3  . CYS   A 1 19 ? -6.711  -1.346  -0.276 1.00 0.13 ?  19 CYS   A HB3  7  
HETATM 3882 N N    . A1BEB A 1 20 ? -7.770  2.096   0.344  1.00 0.11 ?  20 A1BEB A N    7  
HETATM 3883 C CA   . A1BEB A 1 20 ? -8.913  2.710   1.031  1.00 0.14 ?  20 A1BEB A CA   7  
HETATM 3884 C C    . A1BEB A 1 20 ? -9.830  3.389   0.007  1.00 0.16 ?  20 A1BEB A C    7  
HETATM 3885 O O    . A1BEB A 1 20 ? -11.053 3.390   0.163  1.00 0.18 ?  20 A1BEB A O    7  
HETATM 3886 C CB   . A1BEB A 1 20 ? -8.396  3.736   2.027  1.00 0.21 ?  20 A1BEB A CB   7  
HETATM 3887 C CB2  . A1BEB A 1 20 ? -9.682  1.652   1.805  1.00 0.15 ?  20 A1BEB A CB2  7  
HETATM 3888 C CG   . A1BEB A 1 20 ? -9.519  4.420   2.791  1.00 0.36 ?  20 A1BEB A CG   7  
HETATM 3889 C CD   . A1BEB A 1 20 ? -8.972  5.496   3.715  1.00 0.44 ?  20 A1BEB A CD   7  
HETATM 3890 C CE   . A1BEB A 1 20 ? -10.078 6.185   4.505  1.00 0.72 ?  20 A1BEB A CE   7  
HETATM 3891 N NZ   . A1BEB A 1 20 ? -10.837 5.233   5.359  1.00 1.38 ?  20 A1BEB A NZ   7  
HETATM 3892 H H    . A1BEB A 1 20 ? -6.867  2.412   0.567  1.00 0.12 ?  20 A1BEB A H    7  
HETATM 3893 H HB2  . A1BEB A 1 20 ? -7.833  4.491   1.498  1.00 0.19 ?  20 A1BEB A HB2  7  
HETATM 3894 H HB3  . A1BEB A 1 20 ? -7.749  3.245   2.739  1.00 0.23 ?  20 A1BEB A HB3  7  
HETATM 3895 H HB23 . A1BEB A 1 20 ? -10.590 2.079   2.200  1.00 0.84 ?  20 A1BEB A HB23 7  
HETATM 3896 H HB21 . A1BEB A 1 20 ? -9.071  1.282   2.615  1.00 0.80 ?  20 A1BEB A HB21 7  
HETATM 3897 H HB22 . A1BEB A 1 20 ? -9.929  0.835   1.142  1.00 0.82 ?  20 A1BEB A HB22 7  
HETATM 3898 H HG3  . A1BEB A 1 20 ? -10.040 3.686   3.383  1.00 0.42 ?  20 A1BEB A HG3  7  
HETATM 3899 H HG2  . A1BEB A 1 20 ? -10.199 4.869   2.084  1.00 0.40 ?  20 A1BEB A HG2  7  
HETATM 3900 H HD3  . A1BEB A 1 20 ? -8.280  5.040   4.408  1.00 0.93 ?  20 A1BEB A HD3  7  
HETATM 3901 H HD2  . A1BEB A 1 20 ? -8.453  6.232   3.120  1.00 0.84 ?  20 A1BEB A HD2  7  
HETATM 3902 H HE3  . A1BEB A 1 20 ? -9.634  6.941   5.136  1.00 1.49 ?  20 A1BEB A HE3  7  
HETATM 3903 H HE2  . A1BEB A 1 20 ? -10.761 6.655   3.813  1.00 1.41 ?  20 A1BEB A HE2  7  
HETATM 3904 H HZ1  . A1BEB A 1 20 ? -10.201 4.783   6.049  1.00 1.93 ?  20 A1BEB A HZ1  7  
HETATM 3905 H HZ2  . A1BEB A 1 20 ? -11.271 4.491   4.775  1.00 1.93 ?  20 A1BEB A HZ2  7  
HETATM 3906 H HZ3  . A1BEB A 1 20 ? -11.587 5.734   5.876  1.00 1.84 ?  20 A1BEB A HZ3  7  
ATOM   3907 N N    . SER   A 1 21 ? -9.245  3.957   -1.045 1.00 0.18 ?  21 SER   A N    7  
ATOM   3908 C CA   . SER   A 1 21 ? -10.034 4.656   -2.046 1.00 0.23 ?  21 SER   A CA   7  
ATOM   3909 C C    . SER   A 1 21 ? -10.690 3.674   -3.016 1.00 0.23 ?  21 SER   A C    7  
ATOM   3910 O O    . SER   A 1 21 ? -11.449 4.071   -3.899 1.00 0.31 ?  21 SER   A O    7  
ATOM   3911 C CB   . SER   A 1 21 ? -9.172  5.668   -2.806 1.00 0.33 ?  21 SER   A CB   7  
ATOM   3912 O OG   . SER   A 1 21 ? -8.088  5.040   -3.475 1.00 1.18 ?  21 SER   A OG   7  
ATOM   3913 H H    . SER   A 1 21 ? -8.267  3.909   -1.145 1.00 0.17 ?  21 SER   A H    7  
ATOM   3914 H HA   . SER   A 1 21 ? -10.815 5.192   -1.526 1.00 0.26 ?  21 SER   A HA   7  
ATOM   3915 H HB2  . SER   A 1 21 ? -9.781  6.172   -3.536 1.00 1.01 ?  21 SER   A HB2  7  
ATOM   3916 H HB3  . SER   A 1 21 ? -8.778  6.393   -2.111 1.00 1.21 ?  21 SER   A HB3  7  
ATOM   3917 H HG   . SER   A 1 21 ? -7.827  4.243   -2.990 1.00 1.82 ?  21 SER   A HG   7  
ATOM   3918 N N    . ILE   A 1 22 ? -10.389 2.392   -2.850 1.00 0.19 ?  22 ILE   A N    7  
ATOM   3919 C CA   . ILE   A 1 22 ? -10.961 1.362   -3.696 1.00 0.20 ?  22 ILE   A CA   7  
ATOM   3920 C C    . ILE   A 1 22 ? -12.040 0.591   -2.943 1.00 0.17 ?  22 ILE   A C    7  
ATOM   3921 O O    . ILE   A 1 22 ? -11.773 -0.021  -1.903 1.00 0.14 ?  22 ILE   A O    7  
ATOM   3922 C CB   . ILE   A 1 22 ? -9.890  0.373   -4.183 1.00 0.21 ?  22 ILE   A CB   7  
ATOM   3923 C CG1  . ILE   A 1 22 ? -8.772  1.115   -4.914 1.00 0.24 ?  22 ILE   A CG1  7  
ATOM   3924 C CG2  . ILE   A 1 22 ? -10.518 -0.674  -5.092 1.00 0.24 ?  22 ILE   A CG2  7  
ATOM   3925 C CD1  . ILE   A 1 22 ? -7.640  0.219   -5.366 1.00 0.26 ?  22 ILE   A CD1  7  
ATOM   3926 H H    . ILE   A 1 22 ? -9.770  2.129   -2.136 1.00 0.19 ?  22 ILE   A H    7  
ATOM   3927 H HA   . ILE   A 1 22 ? -11.400 1.841   -4.556 1.00 0.25 ?  22 ILE   A HA   7  
ATOM   3928 H HB   . ILE   A 1 22 ? -9.479  -0.125  -3.321 1.00 0.18 ?  22 ILE   A HB   7  
ATOM   3929 H HG12 . ILE   A 1 22 ? -9.181  1.595   -5.790 1.00 0.28 ?  22 ILE   A HG12 7  
ATOM   3930 H HG13 . ILE   A 1 22 ? -8.362  1.866   -4.255 1.00 0.24 ?  22 ILE   A HG13 7  
ATOM   3931 H HG21 . ILE   A 1 22 ? -11.295 -1.200  -4.555 1.00 0.99 ?  22 ILE   A HG21 7  
ATOM   3932 H HG22 . ILE   A 1 22 ? -9.764  -1.376  -5.413 1.00 0.98 ?  22 ILE   A HG22 7  
ATOM   3933 H HG23 . ILE   A 1 22 ? -10.947 -0.187  -5.955 1.00 0.97 ?  22 ILE   A HG23 7  
ATOM   3934 H HD11 . ILE   A 1 22 ? -7.222  -0.296  -4.515 1.00 1.05 ?  22 ILE   A HD11 7  
ATOM   3935 H HD12 . ILE   A 1 22 ? -6.874  0.819   -5.833 1.00 1.05 ?  22 ILE   A HD12 7  
ATOM   3936 H HD13 . ILE   A 1 22 ? -8.012  -0.504  -6.076 1.00 0.99 ?  22 ILE   A HD13 7  
ATOM   3937 N N    . PRO   A 1 23 ? -13.280 0.626   -3.451 1.00 0.19 ?  23 PRO   A N    7  
ATOM   3938 C CA   . PRO   A 1 23 ? -14.394 -0.116  -2.861 1.00 0.19 ?  23 PRO   A CA   7  
ATOM   3939 C C    . PRO   A 1 23 ? -14.080 -1.604  -2.743 1.00 0.18 ?  23 PRO   A C    7  
ATOM   3940 O O    . PRO   A 1 23 ? -13.400 -2.174  -3.599 1.00 0.21 ?  23 PRO   A O    7  
ATOM   3941 C CB   . PRO   A 1 23 ? -15.543 0.116   -3.845 1.00 0.25 ?  23 PRO   A CB   7  
ATOM   3942 C CG   . PRO   A 1 23 ? -15.194 1.383   -4.539 1.00 0.29 ?  23 PRO   A CG   7  
ATOM   3943 C CD   . PRO   A 1 23 ? -13.696 1.396   -4.635 1.00 0.26 ?  23 PRO   A CD   7  
ATOM   3944 H HA   . PRO   A 1 23 ? -14.659 0.274   -1.891 1.00 0.19 ?  23 PRO   A HA   7  
ATOM   3945 H HB2  . PRO   A 1 23 ? -15.598 -0.711  -4.538 1.00 0.28 ?  23 PRO   A HB2  7  
ATOM   3946 H HB3  . PRO   A 1 23 ? -16.473 0.206   -3.305 1.00 0.28 ?  23 PRO   A HB3  7  
ATOM   3947 H HG2  . PRO   A 1 23 ? -15.632 1.391   -5.523 1.00 0.34 ?  23 PRO   A HG2  7  
ATOM   3948 H HG3  . PRO   A 1 23 ? -15.541 2.227   -3.963 1.00 0.30 ?  23 PRO   A HG3  7  
ATOM   3949 H HD2  . PRO   A 1 23 ? -13.372 0.913   -5.544 1.00 0.30 ?  23 PRO   A HD2  7  
ATOM   3950 H HD3  . PRO   A 1 23 ? -13.324 2.410   -4.589 1.00 0.28 ?  23 PRO   A HD3  7  
HETATM 3951 N N    . DPR   A 1 24 ? -14.575 -2.252  -1.684 1.00 0.19 ?  24 DPR   A N    7  
HETATM 3952 C CA   . DPR   A 1 24 ? -14.300 -3.658  -1.412 1.00 0.23 ?  24 DPR   A CA   7  
HETATM 3953 C CB   . DPR   A 1 24 ? -15.559 -4.084  -0.675 1.00 0.30 ?  24 DPR   A CB   7  
HETATM 3954 C CG   . DPR   A 1 24 ? -15.921 -2.883  0.134  1.00 0.29 ?  24 DPR   A CG   7  
HETATM 3955 C CD   . DPR   A 1 24 ? -15.487 -1.680  -0.673 1.00 0.23 ?  24 DPR   A CD   7  
HETATM 3956 C C    . DPR   A 1 24 ? -13.070 -3.850  -0.524 1.00 0.22 ?  24 DPR   A C    7  
HETATM 3957 O O    . DPR   A 1 24 ? -12.894 -4.907  0.087  1.00 0.31 ?  24 DPR   A O    7  
HETATM 3958 H HA   . DPR   A 1 24 ? -14.199 -4.235  -2.313 1.00 0.27 ?  24 DPR   A HA   7  
HETATM 3959 H HB2  . DPR   A 1 24 ? -15.345 -4.935  -0.048 1.00 0.34 ?  24 DPR   A HB2  7  
HETATM 3960 H HB3  . DPR   A 1 24 ? -16.334 -4.334  -1.386 1.00 0.33 ?  24 DPR   A HB3  7  
HETATM 3961 H HG2  . DPR   A 1 24 ? -15.395 -2.910  1.076  1.00 0.31 ?  24 DPR   A HG2  7  
HETATM 3962 H HG3  . DPR   A 1 24 ? -16.987 -2.857  0.300  1.00 0.35 ?  24 DPR   A HG3  7  
HETATM 3963 H HD2  . DPR   A 1 24 ? -14.970 -0.970  -0.046 1.00 0.23 ?  24 DPR   A HD2  7  
HETATM 3964 H HD3  . DPR   A 1 24 ? -16.340 -1.216  -1.145 1.00 0.24 ?  24 DPR   A HD3  7  
ATOM   3965 N N    . TYR   A 1 25 ? -12.224 -2.831  -0.443 1.00 0.15 ?  25 TYR   A N    7  
ATOM   3966 C CA   . TYR   A 1 25 ? -11.058 -2.880  0.426  1.00 0.14 ?  25 TYR   A CA   7  
ATOM   3967 C C    . TYR   A 1 25 ? -11.215 -1.894  1.576  1.00 0.15 ?  25 TYR   A C    7  
ATOM   3968 O O    . TYR   A 1 25 ? -12.013 -0.961  1.501  1.00 0.17 ?  25 TYR   A O    7  
ATOM   3969 C CB   . TYR   A 1 25 ? -9.783  -2.572  -0.360 1.00 0.12 ?  25 TYR   A CB   7  
ATOM   3970 C CG   . TYR   A 1 25 ? -9.458  -3.589  -1.440 1.00 0.15 ?  25 TYR   A CG   7  
ATOM   3971 C CD1  . TYR   A 1 25 ? -9.251  -3.191  -2.753 1.00 0.18 ?  25 TYR   A CD1  7  
ATOM   3972 C CD2  . TYR   A 1 25 ? -9.363  -4.946  -1.148 1.00 0.21 ?  25 TYR   A CD2  7  
ATOM   3973 C CE1  . TYR   A 1 25 ? -8.957  -4.108  -3.742 1.00 0.24 ?  25 TYR   A CE1  7  
ATOM   3974 C CE2  . TYR   A 1 25 ? -9.069  -5.871  -2.134 1.00 0.26 ?  25 TYR   A CE2  7  
ATOM   3975 C CZ   . TYR   A 1 25 ? -8.867  -5.444  -3.430 1.00 0.26 ?  25 TYR   A CZ   7  
ATOM   3976 O OH   . TYR   A 1 25 ? -8.572  -6.358  -4.419 1.00 0.32 ?  25 TYR   A OH   7  
ATOM   3977 H H    . TYR   A 1 25 ? -12.388 -2.022  -0.977 1.00 0.14 ?  25 TYR   A H    7  
ATOM   3978 H HA   . TYR   A 1 25 ? -10.990 -3.877  0.833  1.00 0.16 ?  25 TYR   A HA   7  
ATOM   3979 H HB2  . TYR   A 1 25 ? -9.889  -1.608  -0.833 1.00 0.11 ?  25 TYR   A HB2  7  
ATOM   3980 H HB3  . TYR   A 1 25 ? -8.949  -2.536  0.325  1.00 0.12 ?  25 TYR   A HB3  7  
ATOM   3981 H HD1  . TYR   A 1 25 ? -9.317  -2.145  -2.998 1.00 0.20 ?  25 TYR   A HD1  7  
ATOM   3982 H HD2  . TYR   A 1 25 ? -9.521  -5.276  -0.133 1.00 0.25 ?  25 TYR   A HD2  7  
ATOM   3983 H HE1  . TYR   A 1 25 ? -8.798  -3.773  -4.757 1.00 0.29 ?  25 TYR   A HE1  7  
ATOM   3984 H HE2  . TYR   A 1 25 ? -9.000  -6.919  -1.886 1.00 0.32 ?  25 TYR   A HE2  7  
ATOM   3985 H HH   . TYR   A 1 25 ? -9.169  -7.116  -4.345 1.00 0.97 ?  25 TYR   A HH   7  
ATOM   3986 N N    . LYS   A 1 26 ? -10.476 -2.125  2.649  1.00 0.16 ?  26 LYS   A N    7  
ATOM   3987 C CA   . LYS   A 1 26 ? -10.528 -1.252  3.818  1.00 0.21 ?  26 LYS   A CA   7  
ATOM   3988 C C    . LYS   A 1 26 ? -9.137  -0.730  4.176  1.00 0.24 ?  26 LYS   A C    7  
ATOM   3989 O O    . LYS   A 1 26 ? -8.998  0.259   4.893  1.00 0.46 ?  26 LYS   A O    7  
ATOM   3990 C CB   . LYS   A 1 26 ? -11.146 -1.987  5.016  1.00 0.27 ?  26 LYS   A CB   7  
ATOM   3991 C CG   . LYS   A 1 26 ? -10.309 -3.145  5.538  1.00 0.30 ?  26 LYS   A CG   7  
ATOM   3992 C CD   . LYS   A 1 26 ? -11.026 -3.896  6.648  1.00 0.43 ?  26 LYS   A CD   7  
ATOM   3993 C CE   . LYS   A 1 26 ? -12.226 -4.663  6.114  1.00 1.65 ?  26 LYS   A CE   7  
ATOM   3994 N NZ   . LYS   A 1 26 ? -12.947 -5.392  7.190  1.00 1.94 1  26 LYS   A NZ   7  
ATOM   3995 H H    . LYS   A 1 26 ? -9.885  -2.911  2.659  1.00 0.16 ?  26 LYS   A H    7  
ATOM   3996 H HA   . LYS   A 1 26 ? -11.153 -0.410  3.565  1.00 0.22 ?  26 LYS   A HA   7  
ATOM   3997 H HB2  . LYS   A 1 26 ? -11.285 -1.283  5.822  1.00 0.31 ?  26 LYS   A HB2  7  
ATOM   3998 H HB3  . LYS   A 1 26 ? -12.108 -2.376  4.723  1.00 0.32 ?  26 LYS   A HB3  7  
ATOM   3999 H HG2  . LYS   A 1 26 ? -10.112 -3.830  4.728  1.00 0.34 ?  26 LYS   A HG2  7  
ATOM   4000 H HG3  . LYS   A 1 26 ? -9.375  -2.759  5.921  1.00 0.36 ?  26 LYS   A HG3  7  
ATOM   4001 H HD2  . LYS   A 1 26 ? -10.339 -4.594  7.100  1.00 1.07 ?  26 LYS   A HD2  7  
ATOM   4002 H HD3  . LYS   A 1 26 ? -11.363 -3.186  7.390  1.00 0.96 ?  26 LYS   A HD3  7  
ATOM   4003 H HE2  . LYS   A 1 26 ? -12.906 -3.966  5.649  1.00 2.28 ?  26 LYS   A HE2  7  
ATOM   4004 H HE3  . LYS   A 1 26 ? -11.882 -5.374  5.379  1.00 2.30 ?  26 LYS   A HE3  7  
ATOM   4005 H HZ1  . LYS   A 1 26 ? -13.354 -4.718  7.870  1.00 2.33 ?  26 LYS   A HZ1  7  
ATOM   4006 H HZ2  . LYS   A 1 26 ? -12.293 -6.023  7.694  1.00 2.04 ?  26 LYS   A HZ2  7  
ATOM   4007 H HZ3  . LYS   A 1 26 ? -13.716 -5.961  6.782  1.00 2.40 ?  26 LYS   A HZ3  7  
ATOM   4008 N N    . GLY   A 1 27 ? -8.115  -1.392  3.662  1.00 0.14 ?  27 GLY   A N    7  
ATOM   4009 C CA   . GLY   A 1 27 ? -6.753  -0.992  3.935  1.00 0.13 ?  27 GLY   A CA   7  
ATOM   4010 C C    . GLY   A 1 27 ? -5.785  -1.663  2.991  1.00 0.12 ?  27 GLY   A C    7  
ATOM   4011 O O    . GLY   A 1 27 ? -6.201  -2.422  2.116  1.00 0.15 ?  27 GLY   A O    7  
ATOM   4012 H H    . GLY   A 1 27 ? -8.282  -2.168  3.088  1.00 0.25 ?  27 GLY   A H    7  
ATOM   4013 H HA2  . GLY   A 1 27 ? -6.671  0.079   3.827  1.00 0.14 ?  27 GLY   A HA2  7  
ATOM   4014 H HA3  . GLY   A 1 27 ? -6.503  -1.265  4.947  1.00 0.17 ?  27 GLY   A HA3  7  
ATOM   4015 N N    . GLY   A 1 28 ? -4.503  -1.395  3.164  1.00 0.13 ?  28 GLY   A N    7  
ATOM   4016 C CA   . GLY   A 1 28 ? -3.498  -2.004  2.322  1.00 0.13 ?  28 GLY   A CA   7  
ATOM   4017 C C    . GLY   A 1 28 ? -2.114  -1.891  2.920  1.00 0.16 ?  28 GLY   A C    7  
ATOM   4018 O O    . GLY   A 1 28 ? -1.614  -0.786  3.144  1.00 0.20 ?  28 GLY   A O    7  
ATOM   4019 H H    . GLY   A 1 28 ? -4.229  -0.787  3.881  1.00 0.15 ?  28 GLY   A H    7  
ATOM   4020 H HA2  . GLY   A 1 28 ? -3.739  -3.050  2.197  1.00 0.14 ?  28 GLY   A HA2  7  
ATOM   4021 H HA3  . GLY   A 1 28 ? -3.506  -1.524  1.357  1.00 0.15 ?  28 GLY   A HA3  7  
ATOM   4022 N N    . TYR   A 1 29 ? -1.516  -3.029  3.222  1.00 0.17 ?  29 TYR   A N    7  
ATOM   4023 C CA   . TYR   A 1 29 ? -0.187  -3.053  3.810  1.00 0.22 ?  29 TYR   A CA   7  
ATOM   4024 C C    . TYR   A 1 29 ? 0.878   -3.232  2.736  1.00 0.20 ?  29 TYR   A C    7  
ATOM   4025 O O    . TYR   A 1 29 ? 0.630   -3.844  1.691  1.00 0.17 ?  29 TYR   A O    7  
ATOM   4026 C CB   . TYR   A 1 29 ? -0.071  -4.132  4.893  1.00 0.28 ?  29 TYR   A CB   7  
ATOM   4027 C CG   . TYR   A 1 29 ? -0.503  -5.521  4.475  1.00 0.33 ?  29 TYR   A CG   7  
ATOM   4028 C CD1  . TYR   A 1 29 ? 0.383   -6.384  3.851  1.00 0.46 ?  29 TYR   A CD1  7  
ATOM   4029 C CD2  . TYR   A 1 29 ? -1.790  -5.974  4.731  1.00 0.44 ?  29 TYR   A CD2  7  
ATOM   4030 C CE1  . TYR   A 1 29 ? 0.000   -7.661  3.488  1.00 0.58 ?  29 TYR   A CE1  7  
ATOM   4031 C CE2  . TYR   A 1 29 ? -2.183  -7.247  4.369  1.00 0.55 ?  29 TYR   A CE2  7  
ATOM   4032 C CZ   . TYR   A 1 29 ? -1.286  -8.087  3.749  1.00 0.60 ?  29 TYR   A CZ   7  
ATOM   4033 O OH   . TYR   A 1 29 ? -1.675  -9.357  3.392  1.00 0.73 ?  29 TYR   A OH   7  
ATOM   4034 H H    . TYR   A 1 29 ? -1.951  -3.875  2.983  1.00 0.17 ?  29 TYR   A H    7  
ATOM   4035 H HA   . TYR   A 1 29 ? -0.031  -2.090  4.274  1.00 0.26 ?  29 TYR   A HA   7  
ATOM   4036 H HB2  . TYR   A 1 29 ? 0.959   -4.198  5.202  1.00 0.35 ?  29 TYR   A HB2  7  
ATOM   4037 H HB3  . TYR   A 1 29 ? -0.670  -3.840  5.741  1.00 0.30 ?  29 TYR   A HB3  7  
ATOM   4038 H HD1  . TYR   A 1 29 ? 1.387   -6.045  3.644  1.00 0.55 ?  29 TYR   A HD1  7  
ATOM   4039 H HD2  . TYR   A 1 29 ? -2.492  -5.315  5.218  1.00 0.53 ?  29 TYR   A HD2  7  
ATOM   4040 H HE1  . TYR   A 1 29 ? 0.708   -8.319  3.007  1.00 0.72 ?  29 TYR   A HE1  7  
ATOM   4041 H HE2  . TYR   A 1 29 ? -3.190  -7.579  4.573  1.00 0.69 ?  29 TYR   A HE2  7  
ATOM   4042 H HH   . TYR   A 1 29 ? -2.575  -9.329  3.041  1.00 1.12 ?  29 TYR   A HH   7  
ATOM   4043 N N    . CYS   A 1 30 ? 2.064   -2.711  3.001  1.00 0.22 ?  30 CYS   A N    7  
ATOM   4044 C CA   . CYS   A 1 30 ? 3.162   -2.810  2.057  1.00 0.19 ?  30 CYS   A CA   7  
ATOM   4045 C C    . CYS   A 1 30 ? 4.005   -4.037  2.379  1.00 0.20 ?  30 CYS   A C    7  
ATOM   4046 O O    . CYS   A 1 30 ? 4.475   -4.202  3.507  1.00 0.32 ?  30 CYS   A O    7  
ATOM   4047 C CB   . CYS   A 1 30 ? 4.018   -1.547  2.106  1.00 0.27 ?  30 CYS   A CB   7  
ATOM   4048 S SG   . CYS   A 1 30 ? 5.192   -1.392  0.728  1.00 0.86 ?  30 CYS   A SG   7  
ATOM   4049 H H    . CYS   A 1 30 ? 2.211   -2.255  3.864  1.00 0.27 ?  30 CYS   A H    7  
ATOM   4050 H HA   . CYS   A 1 30 ? 2.744   -2.919  1.067  1.00 0.21 ?  30 CYS   A HA   7  
ATOM   4051 H HB2  . CYS   A 1 30 ? 3.373   -0.680  2.083  1.00 0.76 ?  30 CYS   A HB2  7  
ATOM   4052 H HB3  . CYS   A 1 30 ? 4.584   -1.544  3.023  1.00 0.88 ?  30 CYS   A HB3  7  
ATOM   4053 N N    . ALA   A 1 31 ? 4.194   -4.897  1.391  1.00 0.19 ?  31 ALA   A N    7  
ATOM   4054 C CA   . ALA   A 1 31 ? 4.856   -6.173  1.610  1.00 0.28 ?  31 ALA   A CA   7  
ATOM   4055 C C    . ALA   A 1 31 ? 5.868   -6.480  0.511  1.00 0.22 ?  31 ALA   A C    7  
ATOM   4056 O O    . ALA   A 1 31 ? 6.050   -5.692  -0.423 1.00 0.16 ?  31 ALA   A O    7  
ATOM   4057 C CB   . ALA   A 1 31 ? 3.815   -7.281  1.690  1.00 0.42 ?  31 ALA   A CB   7  
ATOM   4058 H H    . ALA   A 1 31 ? 3.885   -4.664  0.484  1.00 0.20 ?  31 ALA   A H    7  
ATOM   4059 H HA   . ALA   A 1 31 ? 5.369   -6.127  2.559  1.00 0.36 ?  31 ALA   A HA   7  
ATOM   4060 H HB1  . ALA   A 1 31 ? 3.232   -7.292  0.780  1.00 1.01 ?  31 ALA   A HB1  7  
ATOM   4061 H HB2  . ALA   A 1 31 ? 3.165   -7.104  2.531  1.00 1.08 ?  31 ALA   A HB2  7  
ATOM   4062 H HB3  . ALA   A 1 31 ? 4.310   -8.233  1.810  1.00 1.16 ?  31 ALA   A HB3  7  
ATOM   4063 N N    . LYS   A 1 32 ? 6.531   -7.628  0.655  1.00 0.28 ?  32 LYS   A N    7  
ATOM   4064 C CA   . LYS   A 1 32 ? 7.473   -8.137  -0.337 1.00 0.26 ?  32 LYS   A CA   7  
ATOM   4065 C C    . LYS   A 1 32 ? 8.589   -7.132  -0.612 1.00 0.26 ?  32 LYS   A C    7  
ATOM   4066 O O    . LYS   A 1 32 ? 8.602   -6.469  -1.650 1.00 0.24 ?  32 LYS   A O    7  
ATOM   4067 C CB   . LYS   A 1 32 ? 6.739   -8.491  -1.632 1.00 0.25 ?  32 LYS   A CB   7  
ATOM   4068 C CG   . LYS   A 1 32 ? 7.602   -9.225  -2.650 1.00 1.09 ?  32 LYS   A CG   7  
ATOM   4069 C CD   . LYS   A 1 32 ? 8.056   -10.575 -2.123 1.00 1.62 ?  32 LYS   A CD   7  
ATOM   4070 C CE   . LYS   A 1 32 ? 8.808   -11.363 -3.182 1.00 2.37 ?  32 LYS   A CE   7  
ATOM   4071 N NZ   . LYS   A 1 32 ? 7.976   -11.602 -4.390 1.00 2.43 1  32 LYS   A NZ   7  
ATOM   4072 H H    . LYS   A 1 32 ? 6.387   -8.152  1.471  1.00 0.37 ?  32 LYS   A H    7  
ATOM   4073 H HA   . LYS   A 1 32 ? 7.913   -9.035  0.067  1.00 0.32 ?  32 LYS   A HA   7  
ATOM   4074 H HB2  . LYS   A 1 32 ? 5.892   -9.118  -1.390 1.00 0.88 ?  32 LYS   A HB2  7  
ATOM   4075 H HB3  . LYS   A 1 32 ? 6.379   -7.578  -2.083 1.00 0.84 ?  32 LYS   A HB3  7  
ATOM   4076 H HG2  . LYS   A 1 32 ? 7.029   -9.378  -3.550 1.00 1.65 ?  32 LYS   A HG2  7  
ATOM   4077 H HG3  . LYS   A 1 32 ? 8.473   -8.623  -2.869 1.00 1.76 ?  32 LYS   A HG3  7  
ATOM   4078 H HD2  . LYS   A 1 32 ? 8.705   -10.421 -1.276 1.00 2.05 ?  32 LYS   A HD2  7  
ATOM   4079 H HD3  . LYS   A 1 32 ? 7.187   -11.137 -1.817 1.00 1.80 ?  32 LYS   A HD3  7  
ATOM   4080 H HE2  . LYS   A 1 32 ? 9.691   -10.811 -3.469 1.00 2.75 ?  32 LYS   A HE2  7  
ATOM   4081 H HE3  . LYS   A 1 32 ? 9.100   -12.315 -2.763 1.00 3.09 ?  32 LYS   A HE3  7  
ATOM   4082 H HZ1  . LYS   A 1 32 ? 7.122   -12.139 -4.137 1.00 2.11 ?  32 LYS   A HZ1  7  
ATOM   4083 H HZ2  . LYS   A 1 32 ? 8.513   -12.143 -5.096 1.00 3.00 ?  32 LYS   A HZ2  7  
ATOM   4084 H HZ3  . LYS   A 1 32 ? 7.688   -10.698 -4.814 1.00 2.96 ?  32 LYS   A HZ3  7  
HETATM 4085 N N    . DPR   A 1 33 ? 9.537   -7.001  0.330  1.00 0.37 ?  33 DPR   A N    7  
HETATM 4086 C CA   . DPR   A 1 33 ? 10.668  -6.071  0.205  1.00 0.44 ?  33 DPR   A CA   7  
HETATM 4087 C CB   . DPR   A 1 33 ? 11.426  -6.234  1.524  1.00 0.59 ?  33 DPR   A CB   7  
HETATM 4088 C CG   . DPR   A 1 33 ? 11.002  -7.553  2.059  1.00 0.61 ?  33 DPR   A CG   7  
HETATM 4089 C CD   . DPR   A 1 33 ? 9.590   -7.763  1.588  1.00 0.47 ?  33 DPR   A CD   7  
HETATM 4090 C C    . DPR   A 1 33 ? 10.217  -4.623  0.023  1.00 0.39 ?  33 DPR   A C    7  
HETATM 4091 O O    . DPR   A 1 33 ? 10.986  -3.776  -0.439 1.00 0.47 ?  33 DPR   A O    7  
HETATM 4092 H HA   . DPR   A 1 33 ? 11.315  -6.348  -0.609 1.00 0.48 ?  33 DPR   A HA   7  
HETATM 4093 H HB2  . DPR   A 1 33 ? 11.155  -5.436  2.196  1.00 0.61 ?  33 DPR   A HB2  7  
HETATM 4094 H HB3  . DPR   A 1 33 ? 12.490  -6.209  1.337  1.00 0.67 ?  33 DPR   A HB3  7  
HETATM 4095 H HG2  . DPR   A 1 33 ? 11.038  -7.534  3.137  1.00 0.70 ?  33 DPR   A HG2  7  
HETATM 4096 H HG3  . DPR   A 1 33 ? 11.645  -8.328  1.674  1.00 0.65 ?  33 DPR   A HG3  7  
HETATM 4097 H HD2  . DPR   A 1 33 ? 8.886   -7.370  2.305  1.00 0.49 ?  33 DPR   A HD2  7  
HETATM 4098 H HD3  . DPR   A 1 33 ? 9.406   -8.810  1.412  1.00 0.47 ?  33 DPR   A HD3  7  
ATOM   4099 N N    . GLY   A 1 34 ? 8.971   -4.349  0.391  1.00 0.32 ?  34 GLY   A N    7  
ATOM   4100 C CA   . GLY   A 1 34 ? 8.418   -3.023  0.224  1.00 0.30 ?  34 GLY   A CA   7  
ATOM   4101 C C    . GLY   A 1 34 ? 8.123   -2.703  -1.229 1.00 0.25 ?  34 GLY   A C    7  
ATOM   4102 O O    . GLY   A 1 34 ? 8.154   -1.541  -1.629 1.00 0.30 ?  34 GLY   A O    7  
ATOM   4103 H H    . GLY   A 1 34 ? 8.422   -5.060  0.781  1.00 0.32 ?  34 GLY   A H    7  
ATOM   4104 H HA2  . GLY   A 1 34 ? 7.502   -2.948  0.793  1.00 0.31 ?  34 GLY   A HA2  7  
ATOM   4105 H HA3  . GLY   A 1 34 ? 9.125   -2.302  0.603  1.00 0.36 ?  34 GLY   A HA3  7  
ATOM   4106 N N    . PHE   A 1 35 ? 7.851   -3.731  -2.025 1.00 0.19 ?  35 PHE   A N    7  
ATOM   4107 C CA   . PHE   A 1 35 ? 7.570   -3.541  -3.445 1.00 0.20 ?  35 PHE   A CA   7  
ATOM   4108 C C    . PHE   A 1 35 ? 6.103   -3.792  -3.779 1.00 0.17 ?  35 PHE   A C    7  
ATOM   4109 O O    . PHE   A 1 35 ? 5.594   -3.290  -4.784 1.00 0.29 ?  35 PHE   A O    7  
ATOM   4110 C CB   . PHE   A 1 35 ? 8.439   -4.465  -4.299 1.00 0.23 ?  35 PHE   A CB   7  
ATOM   4111 C CG   . PHE   A 1 35 ? 9.862   -4.006  -4.446 1.00 0.31 ?  35 PHE   A CG   7  
ATOM   4112 C CD1  . PHE   A 1 35 ? 10.883  -4.667  -3.780 1.00 0.40 ?  35 PHE   A CD1  7  
ATOM   4113 C CD2  . PHE   A 1 35 ? 10.178  -2.911  -5.233 1.00 0.37 ?  35 PHE   A CD2  7  
ATOM   4114 C CE1  . PHE   A 1 35 ? 12.193  -4.243  -3.898 1.00 0.49 ?  35 PHE   A CE1  7  
ATOM   4115 C CE2  . PHE   A 1 35 ? 11.486  -2.484  -5.356 1.00 0.46 ?  35 PHE   A CE2  7  
ATOM   4116 C CZ   . PHE   A 1 35 ? 12.494  -3.165  -4.745 1.00 0.51 ?  35 PHE   A CZ   7  
ATOM   4117 H H    . PHE   A 1 35 ? 7.854   -4.643  -1.652 1.00 0.19 ?  35 PHE   A H    7  
ATOM   4118 H HA   . PHE   A 1 35 ? 7.808   -2.519  -3.692 1.00 0.24 ?  35 PHE   A HA   7  
ATOM   4119 H HB2  . PHE   A 1 35 ? 8.453   -5.447  -3.849 1.00 0.24 ?  35 PHE   A HB2  7  
ATOM   4120 H HB3  . PHE   A 1 35 ? 8.009   -4.534  -5.286 1.00 0.27 ?  35 PHE   A HB3  7  
ATOM   4121 H HD1  . PHE   A 1 35 ? 10.648  -5.523  -3.165 1.00 0.45 ?  35 PHE   A HD1  7  
ATOM   4122 H HD2  . PHE   A 1 35 ? 9.391   -2.389  -5.755 1.00 0.40 ?  35 PHE   A HD2  7  
ATOM   4123 H HE1  . PHE   A 1 35 ? 12.980  -4.768  -3.377 1.00 0.59 ?  35 PHE   A HE1  7  
ATOM   4124 H HE2  . PHE   A 1 35 ? 11.721  -1.632  -5.973 1.00 0.54 ?  35 PHE   A HE2  7  
ATOM   4125 H HZ   . PHE   A 1 35 ? 13.517  -2.839  -4.861 1.00 0.60 ?  35 PHE   A HZ   7  
ATOM   4126 N N    . VAL   A 1 36 ? 5.421   -4.564  -2.946 1.00 0.12 ?  36 VAL   A N    7  
ATOM   4127 C CA   . VAL   A 1 36 ? 4.060   -4.972  -3.244 1.00 0.17 ?  36 VAL   A CA   7  
ATOM   4128 C C    . VAL   A 1 36 ? 3.059   -4.352  -2.279 1.00 0.15 ?  36 VAL   A C    7  
ATOM   4129 O O    . VAL   A 1 36 ? 3.072   -4.628  -1.082 1.00 0.17 ?  36 VAL   A O    7  
ATOM   4130 C CB   . VAL   A 1 36 ? 3.922   -6.509  -3.215 1.00 0.23 ?  36 VAL   A CB   7  
ATOM   4131 C CG1  . VAL   A 1 36 ? 2.468   -6.930  -3.366 1.00 0.32 ?  36 VAL   A CG1  7  
ATOM   4132 C CG2  . VAL   A 1 36 ? 4.766   -7.138  -4.312 1.00 0.25 ?  36 VAL   A CG2  7  
ATOM   4133 H H    . VAL   A 1 36 ? 5.834   -4.860  -2.105 1.00 0.17 ?  36 VAL   A H    7  
ATOM   4134 H HA   . VAL   A 1 36 ? 3.829   -4.636  -4.242 1.00 0.20 ?  36 VAL   A HA   7  
ATOM   4135 H HB   . VAL   A 1 36 ? 4.284   -6.865  -2.261 1.00 0.24 ?  36 VAL   A HB   7  
ATOM   4136 H HG11 . VAL   A 1 36 ? 2.402   -8.009  -3.364 1.00 1.12 ?  36 VAL   A HG11 7  
ATOM   4137 H HG12 . VAL   A 1 36 ? 2.080   -6.548  -4.297 1.00 1.04 ?  36 VAL   A HG12 7  
ATOM   4138 H HG13 . VAL   A 1 36 ? 1.889   -6.533  -2.544 1.00 1.00 ?  36 VAL   A HG13 7  
ATOM   4139 H HG21 . VAL   A 1 36 ? 5.785   -6.789  -4.227 1.00 1.04 ?  36 VAL   A HG21 7  
ATOM   4140 H HG22 . VAL   A 1 36 ? 4.369   -6.859  -5.276 1.00 0.94 ?  36 VAL   A HG22 7  
ATOM   4141 H HG23 . VAL   A 1 36 ? 4.744   -8.213  -4.210 1.00 1.08 ?  36 VAL   A HG23 7  
ATOM   4142 N N    . CYS   A 1 37 ? 2.198   -3.509  -2.817 1.00 0.15 ?  37 CYS   A N    7  
ATOM   4143 C CA   . CYS   A 1 37 ? 1.096   -2.943  -2.056 1.00 0.14 ?  37 CYS   A CA   7  
ATOM   4144 C C    . CYS   A 1 37 ? -0.080  -3.916  -2.081 1.00 0.12 ?  37 CYS   A C    7  
ATOM   4145 O O    . CYS   A 1 37 ? -0.694  -4.126  -3.130 1.00 0.18 ?  37 CYS   A O    7  
ATOM   4146 C CB   . CYS   A 1 37 ? 0.692   -1.589  -2.655 1.00 0.16 ?  37 CYS   A CB   7  
ATOM   4147 S SG   . CYS   A 1 37 ? -0.774  -0.822  -1.889 1.00 0.14 ?  37 CYS   A SG   7  
ATOM   4148 H H    . CYS   A 1 37 ? 2.302   -3.260  -3.759 1.00 0.16 ?  37 CYS   A H    7  
ATOM   4149 H HA   . CYS   A 1 37 ? 1.423   -2.806  -1.035 1.00 0.14 ?  37 CYS   A HA   7  
ATOM   4150 H HB2  . CYS   A 1 37 ? 1.513   -0.896  -2.550 1.00 0.20 ?  37 CYS   A HB2  7  
ATOM   4151 H HB3  . CYS   A 1 37 ? 0.478   -1.725  -3.705 1.00 0.18 ?  37 CYS   A HB3  7  
ATOM   4152 N N    . LYS   A 1 38 ? -0.378  -4.536  -0.946 1.00 0.10 ?  38 LYS   A N    7  
ATOM   4153 C CA   . LYS   A 1 38 ? -1.435  -5.535  -0.897 1.00 0.11 ?  38 LYS   A CA   7  
ATOM   4154 C C    . LYS   A 1 38 ? -2.638  -5.017  -0.124 1.00 0.11 ?  38 LYS   A C    7  
ATOM   4155 O O    . LYS   A 1 38 ? -2.546  -4.711  1.068  1.00 0.12 ?  38 LYS   A O    7  
ATOM   4156 C CB   . LYS   A 1 38 ? -0.932  -6.842  -0.282 1.00 0.15 ?  38 LYS   A CB   7  
ATOM   4157 C CG   . LYS   A 1 38 ? -1.983  -7.939  -0.276 1.00 0.26 ?  38 LYS   A CG   7  
ATOM   4158 C CD   . LYS   A 1 38 ? -1.433  -9.266  0.226  1.00 0.70 ?  38 LYS   A CD   7  
ATOM   4159 C CE   . LYS   A 1 38 ? -0.685  -10.039 -0.856 1.00 1.19 ?  38 LYS   A CE   7  
ATOM   4160 N NZ   . LYS   A 1 38 ? 0.571   -9.369  -1.286 1.00 2.16 1  38 LYS   A NZ   7  
ATOM   4161 H H    . LYS   A 1 38 ? 0.106   -4.300  -0.117 1.00 0.13 ?  38 LYS   A H    7  
ATOM   4162 H HA   . LYS   A 1 38 ? -1.745  -5.726  -1.914 1.00 0.12 ?  38 LYS   A HA   7  
ATOM   4163 H HB2  . LYS   A 1 38 ? -0.076  -7.191  -0.839 1.00 0.14 ?  38 LYS   A HB2  7  
ATOM   4164 H HB3  . LYS   A 1 38 ? -0.637  -6.655  0.740  1.00 0.19 ?  38 LYS   A HB3  7  
ATOM   4165 H HG2  . LYS   A 1 38 ? -2.789  -7.631  0.363  1.00 0.63 ?  38 LYS   A HG2  7  
ATOM   4166 H HG3  . LYS   A 1 38 ? -2.355  -8.070  -1.280 1.00 0.69 ?  38 LYS   A HG3  7  
ATOM   4167 H HD2  . LYS   A 1 38 ? -0.754  -9.071  1.039  1.00 1.20 ?  38 LYS   A HD2  7  
ATOM   4168 H HD3  . LYS   A 1 38 ? -2.255  -9.869  0.583  1.00 1.36 ?  38 LYS   A HD3  7  
ATOM   4169 H HE2  . LYS   A 1 38 ? -0.442  -11.018 -0.475 1.00 1.63 ?  38 LYS   A HE2  7  
ATOM   4170 H HE3  . LYS   A 1 38 ? -1.334  -10.143 -1.713 1.00 1.57 ?  38 LYS   A HE3  7  
ATOM   4171 H HZ1  . LYS   A 1 38 ? 0.352   -8.498  -1.807 1.00 2.60 ?  38 LYS   A HZ1  7  
ATOM   4172 H HZ2  . LYS   A 1 38 ? 1.117   -10.000 -1.906 1.00 2.57 ?  38 LYS   A HZ2  7  
ATOM   4173 H HZ3  . LYS   A 1 38 ? 1.155   -9.131  -0.459 1.00 2.71 ?  38 LYS   A HZ3  7  
ATOM   4174 N N    . CYS   A 1 39 ? -3.764  -4.943  -0.811 1.00 0.12 ?  39 CYS   A N    7  
ATOM   4175 C CA   . CYS   A 1 39 ? -4.984  -4.421  -0.228 1.00 0.12 ?  39 CYS   A CA   7  
ATOM   4176 C C    . CYS   A 1 39 ? -5.767  -5.517  0.481  1.00 0.15 ?  39 CYS   A C    7  
ATOM   4177 O O    . CYS   A 1 39 ? -5.618  -6.704  0.184  1.00 0.19 ?  39 CYS   A O    7  
ATOM   4178 C CB   . CYS   A 1 39 ? -5.856  -3.787  -1.312 1.00 0.13 ?  39 CYS   A CB   7  
ATOM   4179 S SG   . CYS   A 1 39 ? -4.991  -2.547  -2.326 1.00 0.14 ?  39 CYS   A SG   7  
ATOM   4180 H H    . CYS   A 1 39 ? -3.778  -5.250  -1.741 1.00 0.16 ?  39 CYS   A H    7  
ATOM   4181 H HA   . CYS   A 1 39 ? -4.713  -3.666  0.489  1.00 0.11 ?  39 CYS   A HA   7  
ATOM   4182 H HB2  . CYS   A 1 39 ? -6.215  -4.561  -1.973 1.00 0.15 ?  39 CYS   A HB2  7  
ATOM   4183 H HB3  . CYS   A 1 39 ? -6.698  -3.296  -0.844 1.00 0.15 ?  39 CYS   A HB3  7  
ATOM   4184 N N    . TYR   A 1 40 ? -6.587  -5.100  1.429  1.00 0.18 ?  40 TYR   A N    7  
ATOM   4185 C CA   . TYR   A 1 40 ? -7.464  -5.997  2.157  1.00 0.25 ?  40 TYR   A CA   7  
ATOM   4186 C C    . TYR   A 1 40 ? -8.696  -5.231  2.624  1.00 0.32 ?  40 TYR   A C    7  
ATOM   4187 O O    . TYR   A 1 40 ? -8.602  -4.065  3.003  1.00 0.88 ?  40 TYR   A O    7  
ATOM   4188 C CB   . TYR   A 1 40 ? -6.736  -6.625  3.351  1.00 0.27 ?  40 TYR   A CB   7  
ATOM   4189 C CG   . TYR   A 1 40 ? -6.258  -5.626  4.382  1.00 0.25 ?  40 TYR   A CG   7  
ATOM   4190 C CD1  . TYR   A 1 40 ? -5.042  -4.979  4.234  1.00 0.22 ?  40 TYR   A CD1  7  
ATOM   4191 C CD2  . TYR   A 1 40 ? -7.022  -5.340  5.507  1.00 0.32 ?  40 TYR   A CD2  7  
ATOM   4192 C CE1  . TYR   A 1 40 ? -4.595  -4.076  5.177  1.00 0.25 ?  40 TYR   A CE1  7  
ATOM   4193 C CE2  . TYR   A 1 40 ? -6.585  -4.434  6.453  1.00 0.35 ?  40 TYR   A CE2  7  
ATOM   4194 C CZ   . TYR   A 1 40 ? -5.369  -3.806  6.283  1.00 0.31 ?  40 TYR   A CZ   7  
ATOM   4195 O OH   . TYR   A 1 40 ? -4.920  -2.907  7.224  1.00 0.37 ?  40 TYR   A OH   7  
ATOM   4196 H H    . TYR   A 1 40 ? -6.594  -4.142  1.658  1.00 0.18 ?  40 TYR   A H    7  
ATOM   4197 H HA   . TYR   A 1 40 ? -7.773  -6.780  1.480  1.00 0.31 ?  40 TYR   A HA   7  
ATOM   4198 H HB2  . TYR   A 1 40 ? -7.399  -7.314  3.846  1.00 0.32 ?  40 TYR   A HB2  7  
ATOM   4199 H HB3  . TYR   A 1 40 ? -5.871  -7.162  2.988  1.00 0.28 ?  40 TYR   A HB3  7  
ATOM   4200 H HD1  . TYR   A 1 40 ? -4.438  -5.189  3.362  1.00 0.22 ?  40 TYR   A HD1  7  
ATOM   4201 H HD2  . TYR   A 1 40 ? -7.976  -5.834  5.633  1.00 0.36 ?  40 TYR   A HD2  7  
ATOM   4202 H HE1  . TYR   A 1 40 ? -3.646  -3.580  5.041  1.00 0.26 ?  40 TYR   A HE1  7  
ATOM   4203 H HE2  . TYR   A 1 40 ? -7.193  -4.221  7.319  1.00 0.41 ?  40 TYR   A HE2  7  
ATOM   4204 H HH   . TYR   A 1 40 ? -4.882  -3.339  8.090  1.00 1.13 ?  40 TYR   A HH   7  
HETATM 4205 N N    . NH2   A 1 41 ? -9.848  -5.862  2.567  1.00 0.59 ?  41 NH2   A N    7  
HETATM 4206 H HN1  . NH2   A 1 41 ? -9.852  -6.793  2.254  1.00 1.06 ?  41 NH2   A HN1  7  
HETATM 4207 H HN2  . NH2   A 1 41 ? -10.654 -5.384  2.848  1.00 0.56 ?  41 NH2   A HN2  7  
ATOM   4208 N N    . GLY   A 1 1  ? 5.569   0.240   -6.636 1.00 1.74 ?  1  GLY   A N    8  
ATOM   4209 C CA   . GLY   A 1 1  ? 4.121   0.048   -6.404 1.00 0.89 ?  1  GLY   A CA   8  
ATOM   4210 C C    . GLY   A 1 1  ? 3.480   1.271   -5.793 1.00 0.90 ?  1  GLY   A C    8  
ATOM   4211 O O    . GLY   A 1 1  ? 4.087   2.341   -5.758 1.00 1.76 ?  1  GLY   A O    8  
ATOM   4212 H H1   . GLY   A 1 1  ? 6.061   0.370   -5.728 1.00 2.34 ?  1  GLY   A H1   8  
ATOM   4213 H H2   . GLY   A 1 1  ? 5.729   1.079   -7.225 1.00 1.93 ?  1  GLY   A H2   8  
ATOM   4214 H H3   . GLY   A 1 1  ? 5.969   -0.590  -7.118 1.00 2.29 ?  1  GLY   A H3   8  
ATOM   4215 H HA2  . GLY   A 1 1  ? 3.637   -0.169  -7.344 1.00 0.93 ?  1  GLY   A HA2  8  
ATOM   4216 H HA3  . GLY   A 1 1  ? 3.985   -0.789  -5.737 1.00 1.19 ?  1  GLY   A HA3  8  
ATOM   4217 N N    . PHE   A 1 2  ? 2.255   1.113   -5.312 1.00 0.43 ?  2  PHE   A N    8  
ATOM   4218 C CA   . PHE   A 1 2  ? 1.513   2.213   -4.709 1.00 0.24 ?  2  PHE   A CA   8  
ATOM   4219 C C    . PHE   A 1 2  ? 2.036   2.508   -3.310 1.00 0.22 ?  2  PHE   A C    8  
ATOM   4220 O O    . PHE   A 1 2  ? 1.638   1.866   -2.341 1.00 0.35 ?  2  PHE   A O    8  
ATOM   4221 C CB   . PHE   A 1 2  ? 0.018   1.886   -4.666 1.00 0.16 ?  2  PHE   A CB   8  
ATOM   4222 C CG   . PHE   A 1 2  ? -0.582  1.760   -6.033 1.00 0.18 ?  2  PHE   A CG   8  
ATOM   4223 C CD1  . PHE   A 1 2  ? -0.770  0.518   -6.617 1.00 0.25 ?  2  PHE   A CD1  8  
ATOM   4224 C CD2  . PHE   A 1 2  ? -0.943  2.892   -6.741 1.00 0.22 ?  2  PHE   A CD2  8  
ATOM   4225 C CE1  . PHE   A 1 2  ? -1.308  0.408   -7.883 1.00 0.30 ?  2  PHE   A CE1  8  
ATOM   4226 C CE2  . PHE   A 1 2  ? -1.484  2.788   -8.006 1.00 0.28 ?  2  PHE   A CE2  8  
ATOM   4227 C CZ   . PHE   A 1 2  ? -1.665  1.544   -8.578 1.00 0.29 ?  2  PHE   A CZ   8  
ATOM   4228 H H    . PHE   A 1 2  ? 1.839   0.229   -5.365 1.00 1.00 ?  2  PHE   A H    8  
ATOM   4229 H HA   . PHE   A 1 2  ? 1.660   3.084   -5.329 1.00 0.34 ?  2  PHE   A HA   8  
ATOM   4230 H HB2  . PHE   A 1 2  ? -0.132  0.951   -4.144 1.00 0.26 ?  2  PHE   A HB2  8  
ATOM   4231 H HB3  . PHE   A 1 2  ? -0.505  2.672   -4.141 1.00 0.20 ?  2  PHE   A HB3  8  
ATOM   4232 H HD1  . PHE   A 1 2  ? -0.493  -0.373  -6.072 1.00 0.32 ?  2  PHE   A HD1  8  
ATOM   4233 H HD2  . PHE   A 1 2  ? -0.800  3.864   -6.293 1.00 0.27 ?  2  PHE   A HD2  8  
ATOM   4234 H HE1  . PHE   A 1 2  ? -1.449  -0.563  -8.329 1.00 0.37 ?  2  PHE   A HE1  8  
ATOM   4235 H HE2  . PHE   A 1 2  ? -1.761  3.680   -8.548 1.00 0.36 ?  2  PHE   A HE2  8  
ATOM   4236 H HZ   . PHE   A 1 2  ? -2.087  1.460   -9.569 1.00 0.34 ?  2  PHE   A HZ   8  
ATOM   4237 N N    . GLY   A 1 3  ? 2.959   3.456   -3.222 1.00 0.18 ?  3  GLY   A N    8  
ATOM   4238 C CA   . GLY   A 1 3  ? 3.573   3.792   -1.954 1.00 0.20 ?  3  GLY   A CA   8  
ATOM   4239 C C    . GLY   A 1 3  ? 4.718   2.863   -1.629 1.00 0.19 ?  3  GLY   A C    8  
ATOM   4240 O O    . GLY   A 1 3  ? 5.756   3.283   -1.121 1.00 0.21 ?  3  GLY   A O    8  
ATOM   4241 H H    . GLY   A 1 3  ? 3.234   3.932   -4.033 1.00 0.21 ?  3  GLY   A H    8  
ATOM   4242 H HA2  . GLY   A 1 3  ? 3.943   4.806   -2.001 1.00 0.23 ?  3  GLY   A HA2  8  
ATOM   4243 H HA3  . GLY   A 1 3  ? 2.830   3.721   -1.175 1.00 0.24 ?  3  GLY   A HA3  8  
ATOM   4244 N N    . CYS   A 1 4  ? 4.520   1.598   -1.936 1.00 0.25 ?  4  CYS   A N    8  
ATOM   4245 C CA   . CYS   A 1 4  ? 5.524   0.578   -1.726 1.00 0.27 ?  4  CYS   A CA   8  
ATOM   4246 C C    . CYS   A 1 4  ? 6.536   0.597   -2.866 1.00 0.29 ?  4  CYS   A C    8  
ATOM   4247 O O    . CYS   A 1 4  ? 6.234   0.169   -3.980 1.00 0.30 ?  4  CYS   A O    8  
ATOM   4248 C CB   . CYS   A 1 4  ? 4.839   -0.784  -1.650 1.00 0.28 ?  4  CYS   A CB   8  
ATOM   4249 S SG   . CYS   A 1 4  ? 3.310   -0.783  -0.658 1.00 0.39 ?  4  CYS   A SG   8  
ATOM   4250 H H    . CYS   A 1 4  ? 3.653   1.339   -2.311 1.00 0.30 ?  4  CYS   A H    8  
ATOM   4251 H HA   . CYS   A 1 4  ? 6.029   0.780   -0.794 1.00 0.30 ?  4  CYS   A HA   8  
ATOM   4252 H HB2  . CYS   A 1 4  ? 4.581   -1.103  -2.650 1.00 0.21 ?  4  CYS   A HB2  8  
ATOM   4253 H HB3  . CYS   A 1 4  ? 5.518   -1.500  -1.211 1.00 0.42 ?  4  CYS   A HB3  8  
ATOM   4254 N N    . ASN   A 1 5  ? 7.721   1.123   -2.598 1.00 0.34 ?  5  ASN   A N    8  
ATOM   4255 C CA   . ASN   A 1 5  ? 8.774   1.187   -3.605 1.00 0.40 ?  5  ASN   A CA   8  
ATOM   4256 C C    . ASN   A 1 5  ? 10.086  0.641   -3.058 1.00 0.40 ?  5  ASN   A C    8  
ATOM   4257 O O    . ASN   A 1 5  ? 11.168  1.093   -3.436 1.00 0.47 ?  5  ASN   A O    8  
ATOM   4258 C CB   . ASN   A 1 5  ? 8.978   2.626   -4.082 1.00 0.49 ?  5  ASN   A CB   8  
ATOM   4259 C CG   . ASN   A 1 5  ? 7.764   3.196   -4.794 1.00 0.49 ?  5  ASN   A CG   8  
ATOM   4260 O OD1  . ASN   A 1 5  ? 7.632   3.075   -6.012 1.00 0.65 ?  5  ASN   A OD1  8  
ATOM   4261 N ND2  . ASN   A 1 5  ? 6.876   3.829   -4.042 1.00 0.56 ?  5  ASN   A ND2  8  
ATOM   4262 H H    . ASN   A 1 5  ? 7.893   1.494   -1.703 1.00 0.36 ?  5  ASN   A H    8  
ATOM   4263 H HA   . ASN   A 1 5  ? 8.467   0.579   -4.444 1.00 0.43 ?  5  ASN   A HA   8  
ATOM   4264 H HB2  . ASN   A 1 5  ? 9.192   3.247   -3.228 1.00 0.51 ?  5  ASN   A HB2  8  
ATOM   4265 H HB3  . ASN   A 1 5  ? 9.818   2.655   -4.759 1.00 0.57 ?  5  ASN   A HB3  8  
ATOM   4266 H HD21 . ASN   A 1 5  ? 7.043   3.892   -3.076 1.00 0.70 ?  5  ASN   A HD21 8  
ATOM   4267 H HD22 . ASN   A 1 5  ? 6.085   4.210   -4.480 1.00 0.61 ?  5  ASN   A HD22 8  
ATOM   4268 N N    . GLY   A 1 6  ? 9.990   -0.317  -2.154 1.00 0.36 ?  6  GLY   A N    8  
ATOM   4269 C CA   . GLY   A 1 6  ? 11.175  -0.962  -1.634 1.00 0.38 ?  6  GLY   A CA   8  
ATOM   4270 C C    . GLY   A 1 6  ? 11.399  -0.677  -0.167 1.00 0.37 ?  6  GLY   A C    8  
ATOM   4271 O O    . GLY   A 1 6  ? 10.668  0.110   0.433  1.00 0.36 ?  6  GLY   A O    8  
ATOM   4272 H H    . GLY   A 1 6  ? 9.105   -0.588  -1.827 1.00 0.34 ?  6  GLY   A H    8  
ATOM   4273 H HA2  . GLY   A 1 6  ? 11.076  -2.030  -1.770 1.00 0.48 ?  6  GLY   A HA2  8  
ATOM   4274 H HA3  . GLY   A 1 6  ? 12.032  -0.617  -2.194 1.00 0.44 ?  6  GLY   A HA3  8  
HETATM 4275 C C2   . 6ZS   A 1 7  ? 14.213  -3.162  1.208  1.00 1.49 ?  7  6ZS   A C2   8  
HETATM 4276 N N    . 6ZS   A 1 7  ? 12.437  -1.298  0.391  1.00 0.47 ?  7  6ZS   A N    8  
HETATM 4277 C CA   . 6ZS   A 1 7  ? 12.752  -1.213  1.826  1.00 0.61 ?  7  6ZS   A CA   8  
HETATM 4278 C CB1  . 6ZS   A 1 7  ? 11.644  -1.855  2.645  1.00 0.71 ?  7  6ZS   A CB1  8  
HETATM 4279 C C    . 6ZS   A 1 7  ? 12.933  0.252   2.238  1.00 0.59 ?  7  6ZS   A C    8  
HETATM 4280 O O    . 6ZS   A 1 7  ? 12.515  0.664   3.321  1.00 1.09 ?  7  6ZS   A O    8  
HETATM 4281 C CB   . 6ZS   A 1 7  ? 14.043  -1.966  2.129  1.00 0.75 ?  7  6ZS   A CB   8  
HETATM 4282 H H1   . 6ZS   A 1 7  ? 15.077  -3.734  1.517  1.00 2.14 ?  7  6ZS   A H1   8  
HETATM 4283 H H4   . 6ZS   A 1 7  ? 13.333  -3.785  1.254  1.00 1.94 ?  7  6ZS   A H4   8  
HETATM 4284 H H3   . 6ZS   A 1 7  ? 14.359  -2.818  0.195  1.00 2.00 ?  7  6ZS   A H3   8  
HETATM 4285 H H    . 6ZS   A 1 7  ? 13.026  -1.827  -0.185 1.00 0.49 ?  7  6ZS   A H    8  
HETATM 4286 H H7   . 6ZS   A 1 7  ? 10.718  -1.332  2.467  1.00 1.10 ?  7  6ZS   A H7   8  
HETATM 4287 H H8   . 6ZS   A 1 7  ? 11.893  -1.800  3.694  1.00 1.35 ?  7  6ZS   A H8   8  
HETATM 4288 H H9   . 6ZS   A 1 7  ? 11.534  -2.889  2.354  1.00 1.26 ?  7  6ZS   A H9   8  
HETATM 4289 H H10  . 6ZS   A 1 7  ? 14.888  -1.305  1.985  1.00 1.09 ?  7  6ZS   A H10  8  
HETATM 4290 H H11  . 6ZS   A 1 7  ? 14.028  -2.321  3.151  1.00 1.38 ?  7  6ZS   A H11  8  
ATOM   4291 N N    . TRP   A 1 8  ? 13.551  1.032   1.365  1.00 0.64 ?  8  TRP   A N    8  
ATOM   4292 C CA   . TRP   A 1 8  ? 13.910  2.403   1.690  1.00 0.67 ?  8  TRP   A CA   8  
ATOM   4293 C C    . TRP   A 1 8  ? 12.818  3.386   1.281  1.00 0.49 ?  8  TRP   A C    8  
ATOM   4294 O O    . TRP   A 1 8  ? 12.932  4.589   1.525  1.00 0.58 ?  8  TRP   A O    8  
ATOM   4295 C CB   . TRP   A 1 8  ? 15.234  2.765   1.022  1.00 0.87 ?  8  TRP   A CB   8  
ATOM   4296 C CG   . TRP   A 1 8  ? 16.350  1.855   1.432  1.00 1.12 ?  8  TRP   A CG   8  
ATOM   4297 C CD1  . TRP   A 1 8  ? 16.858  0.814   0.716  1.00 1.27 ?  8  TRP   A CD1  8  
ATOM   4298 C CD2  . TRP   A 1 8  ? 17.076  1.888   2.666  1.00 1.31 ?  8  TRP   A CD2  8  
ATOM   4299 N NE1  . TRP   A 1 8  ? 17.864  0.202   1.422  1.00 1.50 ?  8  TRP   A NE1  8  
ATOM   4300 C CE2  . TRP   A 1 8  ? 18.017  0.844   2.623  1.00 1.52 ?  8  TRP   A CE2  8  
ATOM   4301 C CE3  . TRP   A 1 8  ? 17.025  2.703   3.800  1.00 1.37 ?  8  TRP   A CE3  8  
ATOM   4302 C CZ2  . TRP   A 1 8  ? 18.900  0.594   3.671  1.00 1.76 ?  8  TRP   A CZ2  8  
ATOM   4303 C CZ3  . TRP   A 1 8  ? 17.899  2.454   4.839  1.00 1.63 ?  8  TRP   A CZ3  8  
ATOM   4304 C CH2  . TRP   A 1 8  ? 18.826  1.407   4.768  1.00 1.80 ?  8  TRP   A CH2  8  
ATOM   4305 H H    . TRP   A 1 8  ? 13.772  0.676   0.480  1.00 1.04 ?  8  TRP   A H    8  
ATOM   4306 H HA   . TRP   A 1 8  ? 14.039  2.459   2.758  1.00 0.76 ?  8  TRP   A HA   8  
ATOM   4307 H HB2  . TRP   A 1 8  ? 15.122  2.698   -0.049 1.00 0.85 ?  8  TRP   A HB2  8  
ATOM   4308 H HB3  . TRP   A 1 8  ? 15.505  3.772   1.288  1.00 0.91 ?  8  TRP   A HB3  8  
ATOM   4309 H HD1  . TRP   A 1 8  ? 16.510  0.525   -0.263 1.00 1.25 ?  8  TRP   A HD1  8  
ATOM   4310 H HE1  . TRP   A 1 8  ? 18.385  -0.570  1.114  1.00 1.65 ?  8  TRP   A HE1  8  
ATOM   4311 H HE3  . TRP   A 1 8  ? 16.318  3.514   3.872  1.00 1.26 ?  8  TRP   A HE3  8  
ATOM   4312 H HZ2  . TRP   A 1 8  ? 19.622  -0.207  3.635  1.00 1.93 ?  8  TRP   A HZ2  8  
ATOM   4313 H HZ3  . TRP   A 1 8  ? 17.873  3.072   5.722  1.00 1.73 ?  8  TRP   A HZ3  8  
ATOM   4314 H HH2  . TRP   A 1 8  ? 19.490  1.247   5.603  1.00 2.00 ?  8  TRP   A HH2  8  
ATOM   4315 N N    . ASN   A 1 9  ? 11.762  2.876   0.667  1.00 0.33 ?  9  ASN   A N    8  
ATOM   4316 C CA   . ASN   A 1 9  ? 10.632  3.710   0.282  1.00 0.29 ?  9  ASN   A CA   8  
ATOM   4317 C C    . ASN   A 1 9  ? 9.346   2.911   0.407  1.00 0.25 ?  9  ASN   A C    8  
ATOM   4318 O O    . ASN   A 1 9  ? 8.589   2.748   -0.550 1.00 0.36 ?  9  ASN   A O    8  
ATOM   4319 C CB   . ASN   A 1 9  ? 10.807  4.252   -1.143 1.00 0.46 ?  9  ASN   A CB   8  
ATOM   4320 C CG   . ASN   A 1 9  ? 9.796   5.332   -1.483 1.00 1.31 ?  9  ASN   A CG   8  
ATOM   4321 O OD1  . ASN   A 1 9  ? 9.275   6.011   -0.600 1.00 2.05 ?  9  ASN   A OD1  8  
ATOM   4322 N ND2  . ASN   A 1 9  ? 9.534   5.519   -2.766 1.00 1.88 ?  9  ASN   A ND2  8  
ATOM   4323 H H    . ASN   A 1 9  ? 11.733  1.911   0.480  1.00 0.35 ?  9  ASN   A H    8  
ATOM   4324 H HA   . ASN   A 1 9  ? 10.588  4.539   0.971  1.00 0.37 ?  9  ASN   A HA   8  
ATOM   4325 H HB2  . ASN   A 1 9  ? 11.797  4.669   -1.245 1.00 1.10 ?  9  ASN   A HB2  8  
ATOM   4326 H HB3  . ASN   A 1 9  ? 10.689  3.441   -1.847 1.00 0.63 ?  9  ASN   A HB3  8  
ATOM   4327 H HD21 . ASN   A 1 9  ? 10.002  4.958   -3.422 1.00 2.03 ?  9  ASN   A HD21 8  
ATOM   4328 H HD22 . ASN   A 1 9  ? 8.885   6.215   -3.011 1.00 2.48 ?  9  ASN   A HD22 8  
ATOM   4329 N N    . GLU   A 1 10 ? 9.127   2.393   1.601  1.00 0.23 ?  10 GLU   A N    8  
ATOM   4330 C CA   . GLU   A 1 10 ? 7.955   1.595   1.898  1.00 0.26 ?  10 GLU   A CA   8  
ATOM   4331 C C    . GLU   A 1 10 ? 6.911   2.472   2.574  1.00 0.28 ?  10 GLU   A C    8  
ATOM   4332 O O    . GLU   A 1 10 ? 6.817   2.516   3.800  1.00 0.49 ?  10 GLU   A O    8  
ATOM   4333 C CB   . GLU   A 1 10 ? 8.350   0.417   2.801  1.00 0.39 ?  10 GLU   A CB   8  
ATOM   4334 C CG   . GLU   A 1 10 ? 7.212   -0.535  3.119  1.00 0.45 ?  10 GLU   A CG   8  
ATOM   4335 C CD   . GLU   A 1 10 ? 7.607   -1.612  4.112  1.00 0.68 ?  10 GLU   A CD   8  
ATOM   4336 O OE1  . GLU   A 1 10 ? 7.790   -1.298  5.309  1.00 0.95 ?  10 GLU   A OE1  8  
ATOM   4337 O OE2  . GLU   A 1 10 ? 7.743   -2.785  3.703  1.00 0.78 -1 10 GLU   A OE2  8  
ATOM   4338 H H    . GLU   A 1 10 ? 9.776   2.563   2.316  1.00 0.28 ?  10 GLU   A H    8  
ATOM   4339 H HA   . GLU   A 1 10 ? 7.555   1.220   0.969  1.00 0.27 ?  10 GLU   A HA   8  
ATOM   4340 H HB2  . GLU   A 1 10 ? 9.129   -0.146  2.312  1.00 0.43 ?  10 GLU   A HB2  8  
ATOM   4341 H HB3  . GLU   A 1 10 ? 8.733   0.807   3.731  1.00 0.48 ?  10 GLU   A HB3  8  
ATOM   4342 H HG2  . GLU   A 1 10 ? 6.394   0.032   3.530  1.00 0.47 ?  10 GLU   A HG2  8  
ATOM   4343 H HG3  . GLU   A 1 10 ? 6.894   -1.009  2.206  1.00 0.40 ?  10 GLU   A HG3  8  
ATOM   4344 N N    . ASP   A 1 11 ? 6.143   3.197   1.777  1.00 0.23 ?  11 ASP   A N    8  
ATOM   4345 C CA   . ASP   A 1 11 ? 5.161   4.119   2.325  1.00 0.30 ?  11 ASP   A CA   8  
ATOM   4346 C C    . ASP   A 1 11 ? 3.799   3.442   2.437  1.00 0.23 ?  11 ASP   A C    8  
ATOM   4347 O O    . ASP   A 1 11 ? 2.937   3.575   1.557  1.00 0.20 ?  11 ASP   A O    8  
ATOM   4348 C CB   . ASP   A 1 11 ? 5.063   5.389   1.475  1.00 0.38 ?  11 ASP   A CB   8  
ATOM   4349 C CG   . ASP   A 1 11 ? 4.401   6.531   2.222  1.00 0.99 ?  11 ASP   A CG   8  
ATOM   4350 O OD1  . ASP   A 1 11 ? 3.153   6.569   2.275  1.00 1.86 ?  11 ASP   A OD1  8  
ATOM   4351 O OD2  . ASP   A 1 11 ? 5.115   7.397   2.760  1.00 1.32 -1 11 ASP   A OD2  8  
ATOM   4352 H H    . ASP   A 1 11 ? 6.237   3.110   0.800  1.00 0.30 ?  11 ASP   A H    8  
ATOM   4353 H HA   . ASP   A 1 11 ? 5.489   4.390   3.319  1.00 0.38 ?  11 ASP   A HA   8  
ATOM   4354 H HB2  . ASP   A 1 11 ? 6.056   5.701   1.186  1.00 0.94 ?  11 ASP   A HB2  8  
ATOM   4355 H HB3  . ASP   A 1 11 ? 4.484   5.177   0.589  1.00 0.78 ?  11 ASP   A HB3  8  
ATOM   4356 N N    . ASP   A 1 12 ? 3.624   2.704   3.531  1.00 0.25 ?  12 ASP   A N    8  
ATOM   4357 C CA   . ASP   A 1 12 ? 2.375   2.003   3.813  1.00 0.26 ?  12 ASP   A CA   8  
ATOM   4358 C C    . ASP   A 1 12 ? 1.195   2.962   3.790  1.00 0.18 ?  12 ASP   A C    8  
ATOM   4359 O O    . ASP   A 1 12 ? 0.085   2.578   3.427  1.00 0.18 ?  12 ASP   A O    8  
ATOM   4360 C CB   . ASP   A 1 12 ? 2.430   1.323   5.181  1.00 0.39 ?  12 ASP   A CB   8  
ATOM   4361 C CG   . ASP   A 1 12 ? 3.446   0.202   5.262  1.00 0.82 ?  12 ASP   A CG   8  
ATOM   4362 O OD1  . ASP   A 1 12 ? 4.618   0.474   5.612  1.00 1.45 ?  12 ASP   A OD1  8  
ATOM   4363 O OD2  . ASP   A 1 12 ? 3.086   -0.951  4.938  1.00 1.50 -1 12 ASP   A OD2  8  
ATOM   4364 H H    . ASP   A 1 12 ? 4.367   2.618   4.166  1.00 0.31 ?  12 ASP   A H    8  
ATOM   4365 H HA   . ASP   A 1 12 ? 2.231   1.252   3.050  1.00 0.27 ?  12 ASP   A HA   8  
ATOM   4366 H HB2  . ASP   A 1 12 ? 2.683   2.057   5.926  1.00 1.12 ?  12 ASP   A HB2  8  
ATOM   4367 H HB3  . ASP   A 1 12 ? 1.459   0.920   5.407  1.00 1.15 ?  12 ASP   A HB3  8  
HETATM 4368 N N    . 2ML   A 1 13 ? 1.454   4.209   4.187  1.00 0.18 ?  13 2ML   A N    8  
HETATM 4369 C CA   . 2ML   A 1 13 ? 0.434   5.259   4.225  1.00 0.19 ?  13 2ML   A CA   8  
HETATM 4370 C CB1  . 2ML   A 1 13 ? 1.105   6.572   4.640  1.00 0.24 ?  13 2ML   A CB1  8  
HETATM 4371 C CB2  . 2ML   A 1 13 ? -0.620  4.910   5.265  1.00 0.25 ?  13 2ML   A CB2  8  
HETATM 4372 C CG   . 2ML   A 1 13 ? 0.082   7.684   4.942  1.00 0.33 ?  13 2ML   A CG   8  
HETATM 4373 C CD1  . 2ML   A 1 13 ? 0.709   8.739   5.843  1.00 0.57 ?  13 2ML   A CD1  8  
HETATM 4374 C CD2  . 2ML   A 1 13 ? -0.414  8.347   3.664  1.00 0.54 ?  13 2ML   A CD2  8  
HETATM 4375 C C    . 2ML   A 1 13 ? -0.193  5.374   2.826  1.00 0.16 ?  13 2ML   A C    8  
HETATM 4376 O O    . 2ML   A 1 13 ? -1.415  5.388   2.681  1.00 0.17 ?  13 2ML   A O    8  
HETATM 4377 H H    . 2ML   A 1 13 ? 2.367   4.433   4.463  1.00 0.20 ?  13 2ML   A H    8  
HETATM 4378 H HB11 . 2ML   A 1 13 ? 1.746   6.906   3.839  1.00 0.28 ?  13 2ML   A HB11 8  
HETATM 4379 H HB12 . 2ML   A 1 13 ? 1.707   6.398   5.521  1.00 0.32 ?  13 2ML   A HB12 8  
HETATM 4380 H HB21 . 2ML   A 1 13 ? -0.892  3.870   5.160  1.00 0.92 ?  13 2ML   A HB21 8  
HETATM 4381 H HB22 . 2ML   A 1 13 ? -1.494  5.525   5.114  1.00 0.95 ?  13 2ML   A HB22 8  
HETATM 4382 H HB23 . 2ML   A 1 13 ? -0.223  5.080   6.254  1.00 1.02 ?  13 2ML   A HB23 8  
HETATM 4383 H HG   . 2ML   A 1 13 ? -0.766  7.261   5.458  1.00 0.64 ?  13 2ML   A HG   8  
HETATM 4384 H HD11 . 2ML   A 1 13 ? 1.595   9.135   5.370  1.00 1.31 ?  13 2ML   A HD11 8  
HETATM 4385 H HD12 . 2ML   A 1 13 ? 0.973   8.294   6.792  1.00 0.88 ?  13 2ML   A HD12 8  
HETATM 4386 H HD13 . 2ML   A 1 13 ? 0.002   9.539   6.006  1.00 1.28 ?  13 2ML   A HD13 8  
HETATM 4387 H HD21 . 2ML   A 1 13 ? -1.135  9.111   3.910  1.00 1.20 ?  13 2ML   A HD21 8  
HETATM 4388 H HD22 . 2ML   A 1 13 ? -0.876  7.604   3.032  1.00 1.15 ?  13 2ML   A HD22 8  
HETATM 4389 H HD23 . 2ML   A 1 13 ? 0.421   8.793   3.145  1.00 1.05 ?  13 2ML   A HD23 8  
ATOM   4390 N N    . ARG   A 1 14 ? 0.658   5.432   1.805  1.00 0.14 ?  14 ARG   A N    8  
ATOM   4391 C CA   . ARG   A 1 14 ? 0.200   5.596   0.427  1.00 0.16 ?  14 ARG   A CA   8  
ATOM   4392 C C    . ARG   A 1 14 ? -0.505  4.346   -0.070 1.00 0.12 ?  14 ARG   A C    8  
ATOM   4393 O O    . ARG   A 1 14 ? -1.500  4.433   -0.790 1.00 0.14 ?  14 ARG   A O    8  
ATOM   4394 C CB   . ARG   A 1 14 ? 1.361   5.931   -0.506 1.00 0.21 ?  14 ARG   A CB   8  
ATOM   4395 C CG   . ARG   A 1 14 ? 1.837   7.367   -0.406 1.00 1.03 ?  14 ARG   A CG   8  
ATOM   4396 C CD   . ARG   A 1 14 ? 3.049   7.606   -1.293 1.00 1.04 ?  14 ARG   A CD   8  
ATOM   4397 N NE   . ARG   A 1 14 ? 3.537   8.982   -1.204 1.00 1.37 ?  14 ARG   A NE   8  
ATOM   4398 C CZ   . ARG   A 1 14 ? 4.691   9.396   -1.730 1.00 1.63 ?  14 ARG   A CZ   8  
ATOM   4399 N NH1  . ARG   A 1 14 ? 5.478   8.535   -2.363 1.00 1.31 1  14 ARG   A NH1  8  
ATOM   4400 N NH2  . ARG   A 1 14 ? 5.060   10.666  -1.622 1.00 2.60 ?  14 ARG   A NH2  8  
ATOM   4401 H H    . ARG   A 1 14 ? 1.625   5.351   1.985  1.00 0.17 ?  14 ARG   A H    8  
ATOM   4402 H HA   . ARG   A 1 14 ? -0.501  6.414   0.410  1.00 0.20 ?  14 ARG   A HA   8  
ATOM   4403 H HB2  . ARG   A 1 14 ? 2.192   5.287   -0.270 1.00 0.88 ?  14 ARG   A HB2  8  
ATOM   4404 H HB3  . ARG   A 1 14 ? 1.053   5.747   -1.522 1.00 0.69 ?  14 ARG   A HB3  8  
ATOM   4405 H HG2  . ARG   A 1 14 ? 1.038   8.022   -0.719 1.00 1.51 ?  14 ARG   A HG2  8  
ATOM   4406 H HG3  . ARG   A 1 14 ? 2.102   7.581   0.618  1.00 1.60 ?  14 ARG   A HG3  8  
ATOM   4407 H HD2  . ARG   A 1 14 ? 3.839   6.935   -0.987 1.00 1.51 ?  14 ARG   A HD2  8  
ATOM   4408 H HD3  . ARG   A 1 14 ? 2.777   7.393   -2.317 1.00 1.55 ?  14 ARG   A HD3  8  
ATOM   4409 H HE   . ARG   A 1 14 ? 2.968   9.632   -0.731 1.00 1.89 ?  14 ARG   A HE   8  
ATOM   4410 H HH11 . ARG   A 1 14 ? 6.347   8.842   -2.761 1.00 1.53 ?  14 ARG   A HH11 8  
ATOM   4411 H HH12 . ARG   A 1 14 ? 5.208   7.576   -2.453 1.00 1.40 ?  14 ARG   A HH12 8  
ATOM   4412 H HH21 . ARG   A 1 14 ? 5.930   10.974  -2.020 1.00 2.84 ?  14 ARG   A HH21 8  
ATOM   4413 H HH22 . ARG   A 1 14 ? 4.476   11.325  -1.142 1.00 3.21 ?  14 ARG   A HH22 8  
ATOM   4414 N N    . CYS   A 1 15 ? 0.010   3.186   0.313  1.00 0.11 ?  15 CYS   A N    8  
ATOM   4415 C CA   . CYS   A 1 15 ? -0.622  1.922   -0.053 1.00 0.10 ?  15 CYS   A CA   8  
ATOM   4416 C C    . CYS   A 1 15 ? -2.013  1.847   0.572  1.00 0.09 ?  15 CYS   A C    8  
ATOM   4417 O O    . CYS   A 1 15 ? -2.988  1.470   -0.084 1.00 0.09 ?  15 CYS   A O    8  
ATOM   4418 C CB   . CYS   A 1 15 ? 0.237   0.736   0.397  1.00 0.13 ?  15 CYS   A CB   8  
ATOM   4419 S SG   . CYS   A 1 15 ? -0.448  -0.901  -0.032 1.00 0.13 ?  15 CYS   A SG   8  
ATOM   4420 H H    . CYS   A 1 15 ? 0.835   3.179   0.853  1.00 0.12 ?  15 CYS   A H    8  
ATOM   4421 H HA   . CYS   A 1 15 ? -0.724  1.901   -1.130 1.00 0.11 ?  15 CYS   A HA   8  
ATOM   4422 H HB2  . CYS   A 1 15 ? 1.211   0.810   -0.065 1.00 0.15 ?  15 CYS   A HB2  8  
ATOM   4423 H HB3  . CYS   A 1 15 ? 0.350   0.773   1.471  1.00 0.15 ?  15 CYS   A HB3  8  
ATOM   4424 N N    . HIS   A 1 16 ? -2.106  2.256   1.832  1.00 0.11 ?  16 HIS   A N    8  
ATOM   4425 C CA   . HIS   A 1 16 ? -3.377  2.292   2.533  1.00 0.13 ?  16 HIS   A CA   8  
ATOM   4426 C C    . HIS   A 1 16 ? -4.311  3.292   1.865  1.00 0.13 ?  16 HIS   A C    8  
ATOM   4427 O O    . HIS   A 1 16 ? -5.480  2.992   1.657  1.00 0.15 ?  16 HIS   A O    8  
ATOM   4428 C CB   . HIS   A 1 16 ? -3.171  2.656   4.010  1.00 0.17 ?  16 HIS   A CB   8  
ATOM   4429 C CG   . HIS   A 1 16 ? -4.443  2.775   4.798  1.00 0.27 ?  16 HIS   A CG   8  
ATOM   4430 N ND1  . HIS   A 1 16 ? -4.992  1.731   5.510  1.00 0.39 ?  16 HIS   A ND1  8  
ATOM   4431 C CD2  . HIS   A 1 16 ? -5.280  3.824   4.976  1.00 0.34 ?  16 HIS   A CD2  8  
ATOM   4432 C CE1  . HIS   A 1 16 ? -6.110  2.130   6.083  1.00 0.48 ?  16 HIS   A CE1  8  
ATOM   4433 N NE2  . HIS   A 1 16 ? -6.306  3.396   5.776  1.00 0.45 ?  16 HIS   A NE2  8  
ATOM   4434 H H    . HIS   A 1 16 ? -1.290  2.539   2.304  1.00 0.13 ?  16 HIS   A H    8  
ATOM   4435 H HA   . HIS   A 1 16 ? -3.818  1.307   2.468  1.00 0.14 ?  16 HIS   A HA   8  
ATOM   4436 H HB2  . HIS   A 1 16 ? -2.565  1.896   4.477  1.00 0.22 ?  16 HIS   A HB2  8  
ATOM   4437 H HB3  . HIS   A 1 16 ? -2.656  3.603   4.067  1.00 0.15 ?  16 HIS   A HB3  8  
ATOM   4438 H HD1  . HIS   A 1 16 ? -4.606  0.835   5.605  1.00 0.44 ?  16 HIS   A HD1  8  
ATOM   4439 H HD2  . HIS   A 1 16 ? -5.158  4.816   4.563  1.00 0.35 ?  16 HIS   A HD2  8  
ATOM   4440 H HE1  . HIS   A 1 16 ? -6.760  1.517   6.690  1.00 0.59 ?  16 HIS   A HE1  8  
ATOM   4441 H HE2  . HIS   A 1 16 ? -6.964  3.982   6.215  1.00 0.54 ?  16 HIS   A HE2  8  
HETATM 4442 N N    . AIB   A 1 17 ? -3.779  4.473   1.540  1.00 0.13 ?  17 AIB   A N    8  
HETATM 4443 C CA   . AIB   A 1 17 ? -4.538  5.522   0.846  1.00 0.15 ?  17 AIB   A CA   8  
HETATM 4444 C C    . AIB   A 1 17 ? -5.151  4.928   -0.425 1.00 0.13 ?  17 AIB   A C    8  
HETATM 4445 O O    . AIB   A 1 17 ? -6.359  5.032   -0.670 1.00 0.15 ?  17 AIB   A O    8  
HETATM 4446 C CB1  . AIB   A 1 17 ? -3.614  6.669   0.476  1.00 0.18 ?  17 AIB   A CB1  8  
HETATM 4447 C CB2  . AIB   A 1 17 ? -5.614  6.077   1.760  1.00 0.19 ?  17 AIB   A CB2  8  
HETATM 4448 H H    . AIB   A 1 17 ? -2.840  4.649   1.775  1.00 0.13 ?  17 AIB   A H    8  
HETATM 4449 H HB11 . AIB   A 1 17 ? -2.812  6.299   -0.146 1.00 0.99 ?  17 AIB   A HB11 8  
HETATM 4450 H HB12 . AIB   A 1 17 ? -3.201  7.106   1.374  1.00 0.95 ?  17 AIB   A HB12 8  
HETATM 4451 H HB13 . AIB   A 1 17 ? -4.170  7.419   -0.066 1.00 1.05 ?  17 AIB   A HB13 8  
HETATM 4452 H HB21 . AIB   A 1 17 ? -6.192  5.263   2.168  1.00 1.00 ?  17 AIB   A HB21 8  
HETATM 4453 H HB22 . AIB   A 1 17 ? -6.261  6.733   1.197  1.00 1.02 ?  17 AIB   A HB22 8  
HETATM 4454 H HB23 . AIB   A 1 17 ? -5.152  6.629   2.565  1.00 0.98 ?  17 AIB   A HB23 8  
ATOM   4455 N N    . HIS   A 1 18 ? -4.295  4.285   -1.210 1.00 0.12 ?  18 HIS   A N    8  
ATOM   4456 C CA   . HIS   A 1 18 ? -4.695  3.640   -2.451 1.00 0.12 ?  18 HIS   A CA   8  
ATOM   4457 C C    . HIS   A 1 18 ? -5.831  2.651   -2.214 1.00 0.09 ?  18 HIS   A C    8  
ATOM   4458 O O    . HIS   A 1 18 ? -6.913  2.793   -2.780 1.00 0.10 ?  18 HIS   A O    8  
ATOM   4459 C CB   . HIS   A 1 18 ? -3.480  2.934   -3.072 1.00 0.15 ?  18 HIS   A CB   8  
ATOM   4460 C CG   . HIS   A 1 18 ? -3.802  1.999   -4.199 1.00 0.19 ?  18 HIS   A CG   8  
ATOM   4461 N ND1  . HIS   A 1 18 ? -4.221  2.417   -5.442 1.00 0.23 ?  18 HIS   A ND1  8  
ATOM   4462 C CD2  . HIS   A 1 18 ? -3.746  0.651   -4.259 1.00 0.23 ?  18 HIS   A CD2  8  
ATOM   4463 C CE1  . HIS   A 1 18 ? -4.407  1.367   -6.218 1.00 0.28 ?  18 HIS   A CE1  8  
ATOM   4464 N NE2  . HIS   A 1 18 ? -4.126  0.280   -5.523 1.00 0.28 ?  18 HIS   A NE2  8  
ATOM   4465 H H    . HIS   A 1 18 ? -3.349  4.244   -0.941 1.00 0.12 ?  18 HIS   A H    8  
ATOM   4466 H HA   . HIS   A 1 18 ? -5.038  4.407   -3.125 1.00 0.14 ?  18 HIS   A HA   8  
ATOM   4467 H HB2  . HIS   A 1 18 ? -2.799  3.678   -3.453 1.00 0.17 ?  18 HIS   A HB2  8  
ATOM   4468 H HB3  . HIS   A 1 18 ? -2.978  2.364   -2.305 1.00 0.15 ?  18 HIS   A HB3  8  
ATOM   4469 H HD1  . HIS   A 1 18 ? -4.374  3.350   -5.714 1.00 0.24 ?  18 HIS   A HD1  8  
ATOM   4470 H HD2  . HIS   A 1 18 ? -3.446  -0.011  -3.458 1.00 0.24 ?  18 HIS   A HD2  8  
ATOM   4471 H HE1  . HIS   A 1 18 ? -4.717  1.394   -7.251 1.00 0.33 ?  18 HIS   A HE1  8  
ATOM   4472 H HE2  . HIS   A 1 18 ? -4.355  -0.637  -5.798 1.00 0.36 ?  18 HIS   A HE2  8  
ATOM   4473 N N    . CYS   A 1 19 ? -5.591  1.674   -1.355 1.00 0.09 ?  19 CYS   A N    8  
ATOM   4474 C CA   . CYS   A 1 19 ? -6.555  0.609   -1.118 1.00 0.09 ?  19 CYS   A CA   8  
ATOM   4475 C C    . CYS   A 1 19 ? -7.845  1.148   -0.508 1.00 0.09 ?  19 CYS   A C    8  
ATOM   4476 O O    . CYS   A 1 19 ? -8.931  0.676   -0.837 1.00 0.09 ?  19 CYS   A O    8  
ATOM   4477 C CB   . CYS   A 1 19 ? -5.943  -0.452  -0.212 1.00 0.11 ?  19 CYS   A CB   8  
ATOM   4478 S SG   . CYS   A 1 19 ? -4.397  -1.164  -0.859 1.00 0.12 ?  19 CYS   A SG   8  
ATOM   4479 H H    . CYS   A 1 19 ? -4.737  1.667   -0.862 1.00 0.11 ?  19 CYS   A H    8  
ATOM   4480 H HA   . CYS   A 1 19 ? -6.787  0.161   -2.073 1.00 0.10 ?  19 CYS   A HA   8  
ATOM   4481 H HB2  . CYS   A 1 19 ? -5.724  -0.013  0.750  1.00 0.13 ?  19 CYS   A HB2  8  
ATOM   4482 H HB3  . CYS   A 1 19 ? -6.649  -1.257  -0.084 1.00 0.13 ?  19 CYS   A HB3  8  
HETATM 4483 N N    . A1BEB A 1 20 ? -7.713  2.144   0.369  1.00 0.11 ?  20 A1BEB A N    8  
HETATM 4484 C CA   . A1BEB A 1 20 ? -8.856  2.785   1.033  1.00 0.14 ?  20 A1BEB A CA   8  
HETATM 4485 C C    . A1BEB A 1 20 ? -9.751  3.434   -0.026 1.00 0.16 ?  20 A1BEB A C    8  
HETATM 4486 O O    . A1BEB A 1 20 ? -10.973 3.498   0.130  1.00 0.18 ?  20 A1BEB A O    8  
HETATM 4487 C CB   . A1BEB A 1 20 ? -8.335  3.838   1.998  1.00 0.21 ?  20 A1BEB A CB   8  
HETATM 4488 C CB2  . A1BEB A 1 20 ? -9.640  1.757   1.830  1.00 0.15 ?  20 A1BEB A CB2  8  
HETATM 4489 C CG   . A1BEB A 1 20 ? -9.445  4.519   2.781  1.00 0.36 ?  20 A1BEB A CG   8  
HETATM 4490 C CD   . A1BEB A 1 20 ? -8.868  5.552   3.734  1.00 0.44 ?  20 A1BEB A CD   8  
HETATM 4491 C CE   . A1BEB A 1 20 ? -9.945  6.249   4.552  1.00 0.72 ?  20 A1BEB A CE   8  
HETATM 4492 N NZ   . A1BEB A 1 20 ? -9.358  7.118   5.608  1.00 1.38 ?  20 A1BEB A NZ   8  
HETATM 4493 H H    . A1BEB A 1 20 ? -6.809  2.464   0.586  1.00 0.12 ?  20 A1BEB A H    8  
HETATM 4494 H HB2  . A1BEB A 1 20 ? -7.801  4.595   1.440  1.00 0.19 ?  20 A1BEB A HB2  8  
HETATM 4495 H HB3  . A1BEB A 1 20 ? -7.660  3.374   2.701  1.00 0.23 ?  20 A1BEB A HB3  8  
HETATM 4496 H HB23 . A1BEB A 1 20 ? -9.863  0.908   1.199  1.00 0.84 ?  20 A1BEB A HB23 8  
HETATM 4497 H HB21 . A1BEB A 1 20 ? -10.560 2.196   2.183  1.00 0.80 ?  20 A1BEB A HB21 8  
HETATM 4498 H HB22 . A1BEB A 1 20 ? -9.049  1.430   2.674  1.00 0.82 ?  20 A1BEB A HB22 8  
HETATM 4499 H HG3  . A1BEB A 1 20 ? -9.977  3.775   3.353  1.00 0.42 ?  20 A1BEB A HG3  8  
HETATM 4500 H HG2  . A1BEB A 1 20 ? -10.118 5.003   2.090  1.00 0.40 ?  20 A1BEB A HG2  8  
HETATM 4501 H HD3  . A1BEB A 1 20 ? -8.186  5.059   4.408  1.00 0.93 ?  20 A1BEB A HD3  8  
HETATM 4502 H HD2  . A1BEB A 1 20 ? -8.331  6.292   3.157  1.00 0.84 ?  20 A1BEB A HD2  8  
HETATM 4503 H HE3  . A1BEB A 1 20 ? -10.545 6.857   3.892  1.00 1.49 ?  20 A1BEB A HE3  8  
HETATM 4504 H HE2  . A1BEB A 1 20 ? -10.567 5.501   5.018  1.00 1.41 ?  20 A1BEB A HE2  8  
HETATM 4505 H HZ1  . A1BEB A 1 20 ? -10.111 7.614   6.124  1.00 1.93 ?  20 A1BEB A HZ1  8  
HETATM 4506 H HZ2  . A1BEB A 1 20 ? -8.722  7.821   5.183  1.00 1.93 ?  20 A1BEB A HZ2  8  
HETATM 4507 H HZ3  . A1BEB A 1 20 ? -8.814  6.541   6.283  1.00 1.84 ?  20 A1BEB A HZ3  8  
ATOM   4508 N N    . SER   A 1 21 ? -9.139  3.901   -1.108 1.00 0.18 ?  21 SER   A N    8  
ATOM   4509 C CA   . SER   A 1 21 ? -9.872  4.571   -2.168 1.00 0.23 ?  21 SER   A CA   8  
ATOM   4510 C C    . SER   A 1 21 ? -10.561 3.560   -3.087 1.00 0.23 ?  21 SER   A C    8  
ATOM   4511 O O    . SER   A 1 21 ? -11.338 3.937   -3.968 1.00 0.31 ?  21 SER   A O    8  
ATOM   4512 C CB   . SER   A 1 21 ? -8.923  5.455   -2.970 1.00 0.33 ?  21 SER   A CB   8  
ATOM   4513 O OG   . SER   A 1 21 ? -8.213  6.346   -2.120 1.00 1.18 ?  21 SER   A OG   8  
ATOM   4514 H H    . SER   A 1 21 ? -8.165  3.790   -1.199 1.00 0.17 ?  21 SER   A H    8  
ATOM   4515 H HA   . SER   A 1 21 ? -10.622 5.193   -1.710 1.00 0.26 ?  21 SER   A HA   8  
ATOM   4516 H HB2  . SER   A 1 21 ? -8.214  4.836   -3.494 1.00 1.01 ?  21 SER   A HB2  8  
ATOM   4517 H HB3  . SER   A 1 21 ? -9.489  6.033   -3.682 1.00 1.21 ?  21 SER   A HB3  8  
ATOM   4518 H HG   . SER   A 1 21 ? -7.578  5.842   -1.587 1.00 1.82 ?  21 SER   A HG   8  
ATOM   4519 N N    . ILE   A 1 22 ? -10.276 2.280   -2.880 1.00 0.19 ?  22 ILE   A N    8  
ATOM   4520 C CA   . ILE   A 1 22 ? -10.865 1.228   -3.689 1.00 0.20 ?  22 ILE   A CA   8  
ATOM   4521 C C    . ILE   A 1 22 ? -11.962 0.497   -2.922 1.00 0.17 ?  22 ILE   A C    8  
ATOM   4522 O O    . ILE   A 1 22 ? -11.729 -0.032  -1.827 1.00 0.14 ?  22 ILE   A O    8  
ATOM   4523 C CB   . ILE   A 1 22 ? -9.808  0.202   -4.128 1.00 0.21 ?  22 ILE   A CB   8  
ATOM   4524 C CG1  . ILE   A 1 22 ? -8.661  0.902   -4.852 1.00 0.24 ?  22 ILE   A CG1  8  
ATOM   4525 C CG2  . ILE   A 1 22 ? -10.442 -0.855  -5.024 1.00 0.24 ?  22 ILE   A CG2  8  
ATOM   4526 C CD1  . ILE   A 1 22 ? -7.569  -0.038  -5.313 1.00 0.26 ?  22 ILE   A CD1  8  
ATOM   4527 H H    . ILE   A 1 22 ? -9.652  2.033   -2.166 1.00 0.19 ?  22 ILE   A H    8  
ATOM   4528 H HA   . ILE   A 1 22 ? -11.285 1.681   -4.571 1.00 0.25 ?  22 ILE   A HA   8  
ATOM   4529 H HB   . ILE   A 1 22 ? -9.426  -0.282  -3.244 1.00 0.18 ?  22 ILE   A HB   8  
ATOM   4530 H HG12 . ILE   A 1 22 ? -9.050  1.406   -5.721 1.00 0.28 ?  22 ILE   A HG12 8  
ATOM   4531 H HG13 . ILE   A 1 22 ? -8.218  1.628   -4.187 1.00 0.24 ?  22 ILE   A HG13 8  
ATOM   4532 H HG21 . ILE   A 1 22 ? -10.835 -0.381  -5.911 1.00 0.99 ?  22 ILE   A HG21 8  
ATOM   4533 H HG22 . ILE   A 1 22 ? -11.245 -1.343  -4.493 1.00 0.98 ?  22 ILE   A HG22 8  
ATOM   4534 H HG23 . ILE   A 1 22 ? -9.698  -1.584  -5.305 1.00 0.97 ?  22 ILE   A HG23 8  
ATOM   4535 H HD11 . ILE   A 1 22 ? -7.198  -0.602  -4.470 1.00 1.05 ?  22 ILE   A HD11 8  
ATOM   4536 H HD12 . ILE   A 1 22 ? -6.763  0.535   -5.743 1.00 1.05 ?  22 ILE   A HD12 8  
ATOM   4537 H HD13 . ILE   A 1 22 ? -7.965  -0.716  -6.054 1.00 0.99 ?  22 ILE   A HD13 8  
ATOM   4538 N N    . PRO   A 1 23 ? -13.179 0.461   -3.487 1.00 0.19 ?  23 PRO   A N    8  
ATOM   4539 C CA   . PRO   A 1 23 ? -14.297 -0.275  -2.900 1.00 0.19 ?  23 PRO   A CA   8  
ATOM   4540 C C    . PRO   A 1 23 ? -13.956 -1.748  -2.685 1.00 0.18 ?  23 PRO   A C    8  
ATOM   4541 O O    . PRO   A 1 23 ? -13.291 -2.373  -3.516 1.00 0.21 ?  23 PRO   A O    8  
ATOM   4542 C CB   . PRO   A 1 23 ? -15.413 -0.128  -3.937 1.00 0.25 ?  23 PRO   A CB   8  
ATOM   4543 C CG   . PRO   A 1 23 ? -15.063 1.099   -4.697 1.00 0.29 ?  23 PRO   A CG   8  
ATOM   4544 C CD   . PRO   A 1 23 ? -13.564 1.137   -4.738 1.00 0.26 ?  23 PRO   A CD   8  
ATOM   4545 H HA   . PRO   A 1 23 ? -14.610 0.162   -1.964 1.00 0.19 ?  23 PRO   A HA   8  
ATOM   4546 H HB2  . PRO   A 1 23 ? -15.427 -0.996  -4.576 1.00 0.28 ?  23 PRO   A HB2  8  
ATOM   4547 H HB3  . PRO   A 1 23 ? -16.366 -0.024  -3.436 1.00 0.28 ?  23 PRO   A HB3  8  
ATOM   4548 H HG2  . PRO   A 1 23 ? -15.466 1.036   -5.695 1.00 0.34 ?  23 PRO   A HG2  8  
ATOM   4549 H HG3  . PRO   A 1 23 ? -15.448 1.970   -4.188 1.00 0.30 ?  23 PRO   A HG3  8  
ATOM   4550 H HD2  . PRO   A 1 23 ? -13.196 0.596   -5.598 1.00 0.30 ?  23 PRO   A HD2  8  
ATOM   4551 H HD3  . PRO   A 1 23 ? -13.213 2.156   -4.750 1.00 0.28 ?  23 PRO   A HD3  8  
HETATM 4552 N N    . DPR   A 1 24 ? -14.414 -2.319  -1.568 1.00 0.19 ?  24 DPR   A N    8  
HETATM 4553 C CA   . DPR   A 1 24 ? -14.128 -3.705  -1.207 1.00 0.23 ?  24 DPR   A CA   8  
HETATM 4554 C CB   . DPR   A 1 24 ? -15.339 -4.063  -0.363 1.00 0.30 ?  24 DPR   A CB   8  
HETATM 4555 C CG   . DPR   A 1 24 ? -15.653 -2.800  0.363  1.00 0.29 ?  24 DPR   A CG   8  
HETATM 4556 C CD   . DPR   A 1 24 ? -15.294 -1.673  -0.575 1.00 0.23 ?  24 DPR   A CD   8  
HETATM 4557 C C    . DPR   A 1 24 ? -12.846 -3.851  -0.387 1.00 0.22 ?  24 DPR   A C    8  
HETATM 4558 O O    . DPR   A 1 24 ? -12.534 -4.936  0.103  1.00 0.31 ?  24 DPR   A O    8  
HETATM 4559 H HA   . DPR   A 1 24 ? -14.089 -4.349  -2.067 1.00 0.27 ?  24 DPR   A HA   8  
HETATM 4560 H HB2  . DPR   A 1 24 ? -15.086 -4.858  0.317  1.00 0.34 ?  24 DPR   A HB2  8  
HETATM 4561 H HB3  . DPR   A 1 24 ? -16.155 -4.369  -1.002 1.00 0.33 ?  24 DPR   A HB3  8  
HETATM 4562 H HG2  . DPR   A 1 24 ? -15.061 -2.741  1.264  1.00 0.31 ?  24 DPR   A HG2  8  
HETATM 4563 H HG3  . DPR   A 1 24 ? -16.705 -2.768  0.601  1.00 0.35 ?  24 DPR   A HG3  8  
HETATM 4564 H HD2  . DPR   A 1 24 ? -14.771 -0.892  -0.045 1.00 0.23 ?  24 DPR   A HD2  8  
HETATM 4565 H HD3  . DPR   A 1 24 ? -16.181 -1.281  -1.047 1.00 0.24 ?  24 DPR   A HD3  8  
ATOM   4566 N N    . TYR   A 1 25 ? -12.095 -2.766  -0.246 1.00 0.15 ?  25 TYR   A N    8  
ATOM   4567 C CA   . TYR   A 1 25 ? -10.925 -2.768  0.614  1.00 0.14 ?  25 TYR   A CA   8  
ATOM   4568 C C    . TYR   A 1 25 ? -11.069 -1.722  1.711  1.00 0.15 ?  25 TYR   A C    8  
ATOM   4569 O O    . TYR   A 1 25 ? -11.803 -0.744  1.559  1.00 0.17 ?  25 TYR   A O    8  
ATOM   4570 C CB   . TYR   A 1 25 ? -9.650  -2.514  -0.189 1.00 0.12 ?  25 TYR   A CB   8  
ATOM   4571 C CG   . TYR   A 1 25 ? -9.330  -3.600  -1.199 1.00 0.15 ?  25 TYR   A CG   8  
ATOM   4572 C CD1  . TYR   A 1 25 ? -9.303  -3.325  -2.562 1.00 0.18 ?  25 TYR   A CD1  8  
ATOM   4573 C CD2  . TYR   A 1 25 ? -9.064  -4.900  -0.790 1.00 0.21 ?  25 TYR   A CD2  8  
ATOM   4574 C CE1  . TYR   A 1 25 ? -9.020  -4.315  -3.485 1.00 0.24 ?  25 TYR   A CE1  8  
ATOM   4575 C CE2  . TYR   A 1 25 ? -8.777  -5.894  -1.706 1.00 0.26 ?  25 TYR   A CE2  8  
ATOM   4576 C CZ   . TYR   A 1 25 ? -8.726  -5.589  -3.051 1.00 0.26 ?  25 TYR   A CZ   8  
ATOM   4577 O OH   . TYR   A 1 25 ? -8.480  -6.590  -3.968 1.00 0.32 ?  25 TYR   A OH   8  
ATOM   4578 H H    . TYR   A 1 25 ? -12.331 -1.946  -0.736 1.00 0.14 ?  25 TYR   A H    8  
ATOM   4579 H HA   . TYR   A 1 25 ? -10.859 -3.742  1.075  1.00 0.16 ?  25 TYR   A HA   8  
ATOM   4580 H HB2  . TYR   A 1 25 ? -9.752  -1.582  -0.721 1.00 0.11 ?  25 TYR   A HB2  8  
ATOM   4581 H HB3  . TYR   A 1 25 ? -8.817  -2.440  0.494  1.00 0.12 ?  25 TYR   A HB3  8  
ATOM   4582 H HD1  . TYR   A 1 25 ? -9.511  -2.320  -2.900 1.00 0.20 ?  25 TYR   A HD1  8  
ATOM   4583 H HD2  . TYR   A 1 25 ? -9.081  -5.132  0.260  1.00 0.25 ?  25 TYR   A HD2  8  
ATOM   4584 H HE1  . TYR   A 1 25 ? -9.005  -4.081  -4.539 1.00 0.29 ?  25 TYR   A HE1  8  
ATOM   4585 H HE2  . TYR   A 1 25 ? -8.572  -6.898  -1.365 1.00 0.32 ?  25 TYR   A HE2  8  
ATOM   4586 H HH   . TYR   A 1 25 ? -7.825  -6.268  -4.604 1.00 0.97 ?  25 TYR   A HH   8  
ATOM   4587 N N    . LYS   A 1 26 ? -10.385 -1.952  2.820  1.00 0.16 ?  26 LYS   A N    8  
ATOM   4588 C CA   . LYS   A 1 26 ? -10.403 -1.022  3.947  1.00 0.21 ?  26 LYS   A CA   8  
ATOM   4589 C C    . LYS   A 1 26 ? -8.990  -0.556  4.286  1.00 0.24 ?  26 LYS   A C    8  
ATOM   4590 O O    . LYS   A 1 26 ? -8.795  0.308   5.137  1.00 0.46 ?  26 LYS   A O    8  
ATOM   4591 C CB   . LYS   A 1 26 ? -11.043 -1.677  5.178  1.00 0.27 ?  26 LYS   A CB   8  
ATOM   4592 C CG   . LYS   A 1 26 ? -10.267 -2.871  5.713  1.00 0.30 ?  26 LYS   A CG   8  
ATOM   4593 C CD   . LYS   A 1 26 ? -10.939 -3.469  6.933  1.00 0.43 ?  26 LYS   A CD   8  
ATOM   4594 C CE   . LYS   A 1 26 ? -10.226 -4.728  7.394  1.00 1.65 ?  26 LYS   A CE   8  
ATOM   4595 N NZ   . LYS   A 1 26 ? -10.878 -5.334  8.582  1.00 1.94 1  26 LYS   A NZ   8  
ATOM   4596 H H    . LYS   A 1 26 ? -9.871  -2.775  2.888  1.00 0.16 ?  26 LYS   A H    8  
ATOM   4597 H HA   . LYS   A 1 26 ? -10.991 -0.165  3.656  1.00 0.22 ?  26 LYS   A HA   8  
ATOM   4598 H HB2  . LYS   A 1 26 ? -11.113 -0.942  5.966  1.00 0.31 ?  26 LYS   A HB2  8  
ATOM   4599 H HB3  . LYS   A 1 26 ? -12.035 -2.009  4.919  1.00 0.32 ?  26 LYS   A HB3  8  
ATOM   4600 H HG2  . LYS   A 1 26 ? -10.209 -3.625  4.946  1.00 0.34 ?  26 LYS   A HG2  8  
ATOM   4601 H HG3  . LYS   A 1 26 ? -9.271  -2.550  5.983  1.00 0.36 ?  26 LYS   A HG3  8  
ATOM   4602 H HD2  . LYS   A 1 26 ? -10.919 -2.745  7.731  1.00 1.07 ?  26 LYS   A HD2  8  
ATOM   4603 H HD3  . LYS   A 1 26 ? -11.961 -3.712  6.686  1.00 0.96 ?  26 LYS   A HD3  8  
ATOM   4604 H HE2  . LYS   A 1 26 ? -10.235 -5.444  6.587  1.00 2.28 ?  26 LYS   A HE2  8  
ATOM   4605 H HE3  . LYS   A 1 26 ? -9.206  -4.477  7.641  1.00 2.30 ?  26 LYS   A HE3  8  
ATOM   4606 H HZ1  . LYS   A 1 26 ? -10.349 -6.174  8.891  1.00 2.33 ?  26 LYS   A HZ1  8  
ATOM   4607 H HZ2  . LYS   A 1 26 ? -11.850 -5.616  8.353  1.00 2.04 ?  26 LYS   A HZ2  8  
ATOM   4608 H HZ3  . LYS   A 1 26 ? -10.903 -4.650  9.364  1.00 2.40 ?  26 LYS   A HZ3  8  
ATOM   4609 N N    . GLY   A 1 27 ? -8.011  -1.125  3.601  1.00 0.14 ?  27 GLY   A N    8  
ATOM   4610 C CA   . GLY   A 1 27 ? -6.629  -0.811  3.883  1.00 0.13 ?  27 GLY   A CA   8  
ATOM   4611 C C    . GLY   A 1 27 ? -5.693  -1.643  3.043  1.00 0.12 ?  27 GLY   A C    8  
ATOM   4612 O O    . GLY   A 1 27 ? -6.136  -2.570  2.355  1.00 0.15 ?  27 GLY   A O    8  
ATOM   4613 H H    . GLY   A 1 27 ? -8.226  -1.756  2.887  1.00 0.25 ?  27 GLY   A H    8  
ATOM   4614 H HA2  . GLY   A 1 27 ? -6.454  0.234   3.680  1.00 0.14 ?  27 GLY   A HA2  8  
ATOM   4615 H HA3  . GLY   A 1 27 ? -6.430  -1.005  4.925  1.00 0.17 ?  27 GLY   A HA3  8  
ATOM   4616 N N    . GLY   A 1 28 ? -4.409  -1.329  3.106  1.00 0.13 ?  28 GLY   A N    8  
ATOM   4617 C CA   . GLY   A 1 28 ? -3.428  -2.035  2.314  1.00 0.13 ?  28 GLY   A CA   8  
ATOM   4618 C C    . GLY   A 1 28 ? -2.025  -1.830  2.837  1.00 0.16 ?  28 GLY   A C    8  
ATOM   4619 O O    . GLY   A 1 28 ? -1.552  -0.696  2.932  1.00 0.20 ?  28 GLY   A O    8  
ATOM   4620 H H    . GLY   A 1 28 ? -4.115  -0.623  3.719  1.00 0.15 ?  28 GLY   A H    8  
ATOM   4621 H HA2  . GLY   A 1 28 ? -3.657  -3.091  2.331  1.00 0.14 ?  28 GLY   A HA2  8  
ATOM   4622 H HA3  . GLY   A 1 28 ? -3.478  -1.681  1.297  1.00 0.15 ?  28 GLY   A HA3  8  
ATOM   4623 N N    . TYR   A 1 29 ? -1.383  -2.917  3.233  1.00 0.17 ?  29 TYR   A N    8  
ATOM   4624 C CA   . TYR   A 1 29 ? -0.019  -2.854  3.733  1.00 0.22 ?  29 TYR   A CA   8  
ATOM   4625 C C    . TYR   A 1 29 ? 0.981   -3.155  2.625  1.00 0.20 ?  29 TYR   A C    8  
ATOM   4626 O O    . TYR   A 1 29 ? 0.660   -3.841  1.654  1.00 0.17 ?  29 TYR   A O    8  
ATOM   4627 C CB   . TYR   A 1 29 ? 0.186   -3.805  4.919  1.00 0.28 ?  29 TYR   A CB   8  
ATOM   4628 C CG   . TYR   A 1 29 ? -0.034  -5.275  4.620  1.00 0.33 ?  29 TYR   A CG   8  
ATOM   4629 C CD1  . TYR   A 1 29 ? 1.011   -6.081  4.184  1.00 0.46 ?  29 TYR   A CD1  8  
ATOM   4630 C CD2  . TYR   A 1 29 ? -1.295  -5.846  4.744  1.00 0.44 ?  29 TYR   A CD2  8  
ATOM   4631 C CE1  . TYR   A 1 29 ? 0.804   -7.413  3.879  1.00 0.58 ?  29 TYR   A CE1  8  
ATOM   4632 C CE2  . TYR   A 1 29 ? -1.508  -7.176  4.448  1.00 0.55 ?  29 TYR   A CE2  8  
ATOM   4633 C CZ   . TYR   A 1 29 ? -0.420  -7.984  4.130  1.00 0.60 ?  29 TYR   A CZ   8  
ATOM   4634 O OH   . TYR   A 1 29 ? -0.669  -9.278  3.702  1.00 0.73 ?  29 TYR   A OH   8  
ATOM   4635 H H    . TYR   A 1 29 ? -1.818  -3.791  3.130  1.00 0.17 ?  29 TYR   A H    8  
ATOM   4636 H HA   . TYR   A 1 29 ? 0.150   -1.843  4.072  1.00 0.26 ?  29 TYR   A HA   8  
ATOM   4637 H HB2  . TYR   A 1 29 ? 1.198   -3.698  5.274  1.00 0.35 ?  29 TYR   A HB2  8  
ATOM   4638 H HB3  . TYR   A 1 29 ? -0.490  -3.523  5.711  1.00 0.30 ?  29 TYR   A HB3  8  
ATOM   4639 H HD1  . TYR   A 1 29 ? 1.997   -5.654  4.083  1.00 0.55 ?  29 TYR   A HD1  8  
ATOM   4640 H HD2  . TYR   A 1 29 ? -2.117  -5.235  5.085  1.00 0.53 ?  29 TYR   A HD2  8  
ATOM   4641 H HE1  . TYR   A 1 29 ? 1.627   -8.023  3.544  1.00 0.72 ?  29 TYR   A HE1  8  
ATOM   4642 H HE2  . TYR   A 1 29 ? -2.496  -7.600  4.552  1.00 0.69 ?  29 TYR   A HE2  8  
ATOM   4643 H HH   . TYR   A 1 29 ? 0.105   -9.798  3.958  1.00 1.12 ?  29 TYR   A HH   8  
ATOM   4644 N N    . CYS   A 1 30 ? 2.195   -2.652  2.779  1.00 0.22 ?  30 CYS   A N    8  
ATOM   4645 C CA   . CYS   A 1 30 ? 3.259   -2.949  1.839  1.00 0.19 ?  30 CYS   A CA   8  
ATOM   4646 C C    . CYS   A 1 30 ? 3.819   -4.342  2.090  1.00 0.20 ?  30 CYS   A C    8  
ATOM   4647 O O    . CYS   A 1 30 ? 4.045   -4.736  3.237  1.00 0.32 ?  30 CYS   A O    8  
ATOM   4648 C CB   . CYS   A 1 30 ? 4.367   -1.906  1.937  1.00 0.27 ?  30 CYS   A CB   8  
ATOM   4649 S SG   . CYS   A 1 30 ? 3.929   -0.295  1.212  1.00 0.86 ?  30 CYS   A SG   8  
ATOM   4650 H H    . CYS   A 1 30 ? 2.381   -2.064  3.548  1.00 0.27 ?  30 CYS   A H    8  
ATOM   4651 H HA   . CYS   A 1 30 ? 2.838   -2.919  0.844  1.00 0.21 ?  30 CYS   A HA   8  
ATOM   4652 H HB2  . CYS   A 1 30 ? 4.604   -1.745  2.976  1.00 0.76 ?  30 CYS   A HB2  8  
ATOM   4653 H HB3  . CYS   A 1 30 ? 5.242   -2.272  1.423  1.00 0.88 ?  30 CYS   A HB3  8  
ATOM   4654 N N    . ALA   A 1 31 ? 4.027   -5.084  1.015  1.00 0.19 ?  31 ALA   A N    8  
ATOM   4655 C CA   . ALA   A 1 31 ? 4.492   -6.456  1.102  1.00 0.28 ?  31 ALA   A CA   8  
ATOM   4656 C C    . ALA   A 1 31 ? 5.643   -6.706  0.133  1.00 0.22 ?  31 ALA   A C    8  
ATOM   4657 O O    . ALA   A 1 31 ? 5.943   -5.861  -0.720 1.00 0.16 ?  31 ALA   A O    8  
ATOM   4658 C CB   . ALA   A 1 31 ? 3.344   -7.408  0.808  1.00 0.42 ?  31 ALA   A CB   8  
ATOM   4659 H H    . ALA   A 1 31 ? 3.857   -4.695  0.127  1.00 0.20 ?  31 ALA   A H    8  
ATOM   4660 H HA   . ALA   A 1 31 ? 4.830   -6.636  2.111  1.00 0.36 ?  31 ALA   A HA   8  
ATOM   4661 H HB1  . ALA   A 1 31 ? 2.513   -7.182  1.458  1.00 1.01 ?  31 ALA   A HB1  8  
ATOM   4662 H HB2  . ALA   A 1 31 ? 3.667   -8.424  0.976  1.00 1.08 ?  31 ALA   A HB2  8  
ATOM   4663 H HB3  . ALA   A 1 31 ? 3.037   -7.294  -0.222 1.00 1.16 ?  31 ALA   A HB3  8  
ATOM   4664 N N    . LYS   A 1 32 ? 6.278   -7.870  0.278  1.00 0.28 ?  32 LYS   A N    8  
ATOM   4665 C CA   . LYS   A 1 32 ? 7.362   -8.304  -0.605 1.00 0.26 ?  32 LYS   A CA   8  
ATOM   4666 C C    . LYS   A 1 32 ? 8.463   -7.250  -0.702 1.00 0.26 ?  32 LYS   A C    8  
ATOM   4667 O O    . LYS   A 1 32 ? 8.576   -6.544  -1.709 1.00 0.24 ?  32 LYS   A O    8  
ATOM   4668 C CB   . LYS   A 1 32 ? 6.821   -8.638  -1.998 1.00 0.25 ?  32 LYS   A CB   8  
ATOM   4669 C CG   . LYS   A 1 32 ? 5.825   -9.788  -2.006 1.00 1.09 ?  32 LYS   A CG   8  
ATOM   4670 C CD   . LYS   A 1 32 ? 5.485   -10.220 -3.419 1.00 1.62 ?  32 LYS   A CD   8  
ATOM   4671 C CE   . LYS   A 1 32 ? 4.631   -11.478 -3.431 1.00 2.37 ?  32 LYS   A CE   8  
ATOM   4672 N NZ   . LYS   A 1 32 ? 5.292   -12.608 -2.725 1.00 2.43 1  32 LYS   A NZ   8  
ATOM   4673 H H    . LYS   A 1 32 ? 6.013   -8.460  1.015  1.00 0.37 ?  32 LYS   A H    8  
ATOM   4674 H HA   . LYS   A 1 32 ? 7.788   -9.198  -0.175 1.00 0.32 ?  32 LYS   A HA   8  
ATOM   4675 H HB2  . LYS   A 1 32 ? 6.332   -7.763  -2.397 1.00 0.88 ?  32 LYS   A HB2  8  
ATOM   4676 H HB3  . LYS   A 1 32 ? 7.646   -8.902  -2.640 1.00 0.84 ?  32 LYS   A HB3  8  
ATOM   4677 H HG2  . LYS   A 1 32 ? 6.250   -10.625 -1.478 1.00 1.65 ?  32 LYS   A HG2  8  
ATOM   4678 H HG3  . LYS   A 1 32 ? 4.920   -9.468  -1.513 1.00 1.76 ?  32 LYS   A HG3  8  
ATOM   4679 H HD2  . LYS   A 1 32 ? 4.937   -9.425  -3.901 1.00 2.05 ?  32 LYS   A HD2  8  
ATOM   4680 H HD3  . LYS   A 1 32 ? 6.401   -10.410 -3.958 1.00 1.80 ?  32 LYS   A HD3  8  
ATOM   4681 H HE2  . LYS   A 1 32 ? 3.691   -11.264 -2.947 1.00 2.75 ?  32 LYS   A HE2  8  
ATOM   4682 H HE3  . LYS   A 1 32 ? 4.449   -11.763 -4.456 1.00 3.09 ?  32 LYS   A HE3  8  
ATOM   4683 H HZ1  . LYS   A 1 32 ? 6.211   -12.818 -3.166 1.00 2.11 ?  32 LYS   A HZ1  8  
ATOM   4684 H HZ2  . LYS   A 1 32 ? 4.697   -13.457 -2.772 1.00 3.00 ?  32 LYS   A HZ2  8  
ATOM   4685 H HZ3  . LYS   A 1 32 ? 5.449   -12.366 -1.726 1.00 2.96 ?  32 LYS   A HZ3  8  
HETATM 4686 N N    . DPR   A 1 33 ? 9.288   -7.131  0.350  1.00 0.37 ?  33 DPR   A N    8  
HETATM 4687 C CA   . DPR   A 1 33 ? 10.369  -6.139  0.413  1.00 0.44 ?  33 DPR   A CA   8  
HETATM 4688 C CB   . DPR   A 1 33 ? 10.987  -6.352  1.796  1.00 0.59 ?  33 DPR   A CB   8  
HETATM 4689 C CG   . DPR   A 1 33 ? 10.582  -7.723  2.200  1.00 0.61 ?  33 DPR   A CG   8  
HETATM 4690 C CD   . DPR   A 1 33 ? 9.243   -7.968  1.561  1.00 0.47 ?  33 DPR   A CD   8  
HETATM 4691 C C    . DPR   A 1 33 ? 9.844   -4.713  0.286  1.00 0.39 ?  33 DPR   A C    8  
HETATM 4692 O O    . DPR   A 1 33 ? 10.575  -3.800  -0.090 1.00 0.47 ?  33 DPR   A O    8  
HETATM 4693 H HA   . DPR   A 1 33 ? 11.117  -6.317  -0.341 1.00 0.48 ?  33 DPR   A HA   8  
HETATM 4694 H HB2  . DPR   A 1 33 ? 10.601  -5.614  2.481  1.00 0.61 ?  33 DPR   A HB2  8  
HETATM 4695 H HB3  . DPR   A 1 33 ? 12.062  -6.262  1.731  1.00 0.67 ?  33 DPR   A HB3  8  
HETATM 4696 H HG2  . DPR   A 1 33 ? 10.499  -7.776  3.274  1.00 0.70 ?  33 DPR   A HG2  8  
HETATM 4697 H HG3  . DPR   A 1 33 ? 11.306  -8.439  1.842  1.00 0.65 ?  33 DPR   A HG3  8  
HETATM 4698 H HD2  . DPR   A 1 33 ? 8.443   -7.655  2.215  1.00 0.49 ?  33 DPR   A HD2  8  
HETATM 4699 H HD3  . DPR   A 1 33 ? 9.135   -9.010  1.304  1.00 0.47 ?  33 DPR   A HD3  8  
ATOM   4700 N N    . GLY   A 1 34 ? 8.568   -4.541  0.604  1.00 0.32 ?  34 GLY   A N    8  
ATOM   4701 C CA   . GLY   A 1 34 ? 7.946   -3.239  0.529  1.00 0.30 ?  34 GLY   A CA   8  
ATOM   4702 C C    . GLY   A 1 34 ? 7.777   -2.757  -0.893 1.00 0.25 ?  34 GLY   A C    8  
ATOM   4703 O O    . GLY   A 1 34 ? 7.744   -1.556  -1.137 1.00 0.30 ?  34 GLY   A O    8  
ATOM   4704 H H    . GLY   A 1 34 ? 8.043   -5.314  0.904  1.00 0.32 ?  34 GLY   A H    8  
ATOM   4705 H HA2  . GLY   A 1 34 ? 6.975   -3.289  1.000  1.00 0.31 ?  34 GLY   A HA2  8  
ATOM   4706 H HA3  . GLY   A 1 34 ? 8.558   -2.532  1.068  1.00 0.36 ?  34 GLY   A HA3  8  
ATOM   4707 N N    . PHE   A 1 35 ? 7.673   -3.685  -1.838 1.00 0.19 ?  35 PHE   A N    8  
ATOM   4708 C CA   . PHE   A 1 35 ? 7.519   -3.319  -3.244 1.00 0.20 ?  35 PHE   A CA   8  
ATOM   4709 C C    . PHE   A 1 35 ? 6.076   -3.464  -3.710 1.00 0.17 ?  35 PHE   A C    8  
ATOM   4710 O O    . PHE   A 1 35 ? 5.625   -2.747  -4.603 1.00 0.29 ?  35 PHE   A O    8  
ATOM   4711 C CB   . PHE   A 1 35 ? 8.428   -4.174  -4.130 1.00 0.23 ?  35 PHE   A CB   8  
ATOM   4712 C CG   . PHE   A 1 35 ? 9.883   -3.811  -4.052 1.00 0.31 ?  35 PHE   A CG   8  
ATOM   4713 C CD1  . PHE   A 1 35 ? 10.767  -4.584  -3.320 1.00 0.40 ?  35 PHE   A CD1  8  
ATOM   4714 C CD2  . PHE   A 1 35 ? 10.368  -2.698  -4.720 1.00 0.37 ?  35 PHE   A CD2  8  
ATOM   4715 C CE1  . PHE   A 1 35 ? 12.108  -4.258  -3.258 1.00 0.49 ?  35 PHE   A CE1  8  
ATOM   4716 C CE2  . PHE   A 1 35 ? 11.708  -2.364  -4.661 1.00 0.46 ?  35 PHE   A CE2  8  
ATOM   4717 C CZ   . PHE   A 1 35 ? 12.579  -3.146  -3.928 1.00 0.51 ?  35 PHE   A CZ   8  
ATOM   4718 H H    . PHE   A 1 35 ? 7.710   -4.637  -1.587 1.00 0.19 ?  35 PHE   A H    8  
ATOM   4719 H HA   . PHE   A 1 35 ? 7.810   -2.285  -3.346 1.00 0.24 ?  35 PHE   A HA   8  
ATOM   4720 H HB2  . PHE   A 1 35 ? 8.332   -5.208  -3.835 1.00 0.24 ?  35 PHE   A HB2  8  
ATOM   4721 H HB3  . PHE   A 1 35 ? 8.114   -4.068  -5.157 1.00 0.27 ?  35 PHE   A HB3  8  
ATOM   4722 H HD1  . PHE   A 1 35 ? 10.400  -5.452  -2.796 1.00 0.45 ?  35 PHE   A HD1  8  
ATOM   4723 H HD2  . PHE   A 1 35 ? 9.685   -2.084  -5.291 1.00 0.40 ?  35 PHE   A HD2  8  
ATOM   4724 H HE1  . PHE   A 1 35 ? 12.787  -4.870  -2.682 1.00 0.59 ?  35 PHE   A HE1  8  
ATOM   4725 H HE2  . PHE   A 1 35 ? 12.072  -1.494  -5.185 1.00 0.54 ?  35 PHE   A HE2  8  
ATOM   4726 H HZ   . PHE   A 1 35 ? 13.627  -2.889  -3.879 1.00 0.60 ?  35 PHE   A HZ   8  
ATOM   4727 N N    . VAL   A 1 36 ? 5.349   -4.384  -3.101 1.00 0.12 ?  36 VAL   A N    8  
ATOM   4728 C CA   . VAL   A 1 36 ? 4.000   -4.692  -3.537 1.00 0.17 ?  36 VAL   A CA   8  
ATOM   4729 C C    . VAL   A 1 36 ? 2.967   -4.148  -2.561 1.00 0.15 ?  36 VAL   A C    8  
ATOM   4730 O O    . VAL   A 1 36 ? 3.003   -4.450  -1.374 1.00 0.17 ?  36 VAL   A O    8  
ATOM   4731 C CB   . VAL   A 1 36 ? 3.814   -6.214  -3.703 1.00 0.23 ?  36 VAL   A CB   8  
ATOM   4732 C CG1  . VAL   A 1 36 ? 2.377   -6.556  -4.066 1.00 0.32 ?  36 VAL   A CG1  8  
ATOM   4733 C CG2  . VAL   A 1 36 ? 4.769   -6.748  -4.761 1.00 0.25 ?  36 VAL   A CG2  8  
ATOM   4734 H H    . VAL   A 1 36 ? 5.723   -4.866  -2.333 1.00 0.17 ?  36 VAL   A H    8  
ATOM   4735 H HA   . VAL   A 1 36 ? 3.848   -4.226  -4.497 1.00 0.20 ?  36 VAL   A HA   8  
ATOM   4736 H HB   . VAL   A 1 36 ? 4.052   -6.689  -2.763 1.00 0.24 ?  36 VAL   A HB   8  
ATOM   4737 H HG11 . VAL   A 1 36 ? 1.715   -6.203  -3.290 1.00 1.12 ?  36 VAL   A HG11 8  
ATOM   4738 H HG12 . VAL   A 1 36 ? 2.278   -7.628  -4.167 1.00 1.04 ?  36 VAL   A HG12 8  
ATOM   4739 H HG13 . VAL   A 1 36 ? 2.121   -6.082  -5.002 1.00 1.00 ?  36 VAL   A HG13 8  
ATOM   4740 H HG21 . VAL   A 1 36 ? 4.591   -7.802  -4.909 1.00 1.04 ?  36 VAL   A HG21 8  
ATOM   4741 H HG22 . VAL   A 1 36 ? 5.790   -6.598  -4.437 1.00 0.94 ?  36 VAL   A HG22 8  
ATOM   4742 H HG23 . VAL   A 1 36 ? 4.606   -6.222  -5.691 1.00 1.08 ?  36 VAL   A HG23 8  
ATOM   4743 N N    . CYS   A 1 37 ? 2.059   -3.334  -3.068 1.00 0.15 ?  37 CYS   A N    8  
ATOM   4744 C CA   . CYS   A 1 37 ? 0.973   -2.803  -2.258 1.00 0.14 ?  37 CYS   A CA   8  
ATOM   4745 C C    . CYS   A 1 37 ? -0.143  -3.835  -2.164 1.00 0.12 ?  37 CYS   A C    8  
ATOM   4746 O O    . CYS   A 1 37 ? -0.842  -4.095  -3.148 1.00 0.18 ?  37 CYS   A O    8  
ATOM   4747 C CB   . CYS   A 1 37 ? 0.452   -1.500  -2.873 1.00 0.16 ?  37 CYS   A CB   8  
ATOM   4748 S SG   . CYS   A 1 37 ? -0.952  -0.741  -1.992 1.00 0.14 ?  37 CYS   A SG   8  
ATOM   4749 H H    . CYS   A 1 37 ? 2.111   -3.090  -4.017 1.00 0.16 ?  37 CYS   A H    8  
ATOM   4750 H HA   . CYS   A 1 37 ? 1.356   -2.606  -1.267 1.00 0.14 ?  37 CYS   A HA   8  
ATOM   4751 H HB2  . CYS   A 1 37 ? 1.252   -0.775  -2.889 1.00 0.20 ?  37 CYS   A HB2  8  
ATOM   4752 H HB3  . CYS   A 1 37 ? 0.133   -1.697  -3.885 1.00 0.18 ?  37 CYS   A HB3  8  
ATOM   4753 N N    . LYS   A 1 38 ? -0.297  -4.442  -0.994 1.00 0.10 ?  38 LYS   A N    8  
ATOM   4754 C CA   . LYS   A 1 38 ? -1.293  -5.482  -0.816 1.00 0.11 ?  38 LYS   A CA   8  
ATOM   4755 C C    . LYS   A 1 38 ? -2.502  -4.962  -0.055 1.00 0.11 ?  38 LYS   A C    8  
ATOM   4756 O O    . LYS   A 1 38 ? -2.434  -4.688  1.148  1.00 0.12 ?  38 LYS   A O    8  
ATOM   4757 C CB   . LYS   A 1 38 ? -0.710  -6.700  -0.092 1.00 0.15 ?  38 LYS   A CB   8  
ATOM   4758 C CG   . LYS   A 1 38 ? -1.746  -7.786  0.157  1.00 0.26 ?  38 LYS   A CG   8  
ATOM   4759 C CD   . LYS   A 1 38 ? -1.135  -9.061  0.712  1.00 0.70 ?  38 LYS   A CD   8  
ATOM   4760 C CE   . LYS   A 1 38 ? -0.396  -9.852  -0.357 1.00 1.19 ?  38 LYS   A CE   8  
ATOM   4761 N NZ   . LYS   A 1 38 ? -1.295  -10.266 -1.469 1.00 2.16 1  38 LYS   A NZ   8  
ATOM   4762 H H    . LYS   A 1 38 ? 0.261   -4.170  -0.228 1.00 0.13 ?  38 LYS   A H    8  
ATOM   4763 H HA   . LYS   A 1 38 ? -1.618  -5.785  -1.800 1.00 0.12 ?  38 LYS   A HA   8  
ATOM   4764 H HB2  . LYS   A 1 38 ? 0.090   -7.115  -0.685 1.00 0.14 ?  38 LYS   A HB2  8  
ATOM   4765 H HB3  . LYS   A 1 38 ? -0.318  -6.383  0.864  1.00 0.19 ?  38 LYS   A HB3  8  
ATOM   4766 H HG2  . LYS   A 1 38 ? -2.468  -7.414  0.863  1.00 0.63 ?  38 LYS   A HG2  8  
ATOM   4767 H HG3  . LYS   A 1 38 ? -2.243  -8.012  -0.773 1.00 0.69 ?  38 LYS   A HG3  8  
ATOM   4768 H HD2  . LYS   A 1 38 ? -0.441  -8.801  1.498  1.00 1.20 ?  38 LYS   A HD2  8  
ATOM   4769 H HD3  . LYS   A 1 38 ? -1.926  -9.676  1.120  1.00 1.36 ?  38 LYS   A HD3  8  
ATOM   4770 H HE2  . LYS   A 1 38 ? 0.396   -9.241  -0.759 1.00 1.63 ?  38 LYS   A HE2  8  
ATOM   4771 H HE3  . LYS   A 1 38 ? 0.029   -10.736 0.097  1.00 1.57 ?  38 LYS   A HE3  8  
ATOM   4772 H HZ1  . LYS   A 1 38 ? -1.666  -9.429  -1.960 1.00 2.60 ?  38 LYS   A HZ1  8  
ATOM   4773 H HZ2  . LYS   A 1 38 ? -2.093  -10.819 -1.102 1.00 2.57 ?  38 LYS   A HZ2  8  
ATOM   4774 H HZ3  . LYS   A 1 38 ? -0.772  -10.848 -2.154 1.00 2.71 ?  38 LYS   A HZ3  8  
ATOM   4775 N N    . CYS   A 1 39 ? -3.609  -4.852  -0.762 1.00 0.12 ?  39 CYS   A N    8  
ATOM   4776 C CA   . CYS   A 1 39 ? -4.859  -4.425  -0.166 1.00 0.12 ?  39 CYS   A CA   8  
ATOM   4777 C C    . CYS   A 1 39 ? -5.537  -5.612  0.499  1.00 0.15 ?  39 CYS   A C    8  
ATOM   4778 O O    . CYS   A 1 39 ? -5.400  -6.749  0.043  1.00 0.19 ?  39 CYS   A O    8  
ATOM   4779 C CB   . CYS   A 1 39 ? -5.777  -3.835  -1.233 1.00 0.13 ?  39 CYS   A CB   8  
ATOM   4780 S SG   . CYS   A 1 39 ? -5.020  -2.516  -2.236 1.00 0.14 ?  39 CYS   A SG   8  
ATOM   4781 H H    . CYS   A 1 39 ? -3.588  -5.078  -1.715 1.00 0.16 ?  39 CYS   A H    8  
ATOM   4782 H HA   . CYS   A 1 39 ? -4.642  -3.674  0.577  1.00 0.11 ?  39 CYS   A HA   8  
ATOM   4783 H HB2  . CYS   A 1 39 ? -6.081  -4.622  -1.905 1.00 0.15 ?  39 CYS   A HB2  8  
ATOM   4784 H HB3  . CYS   A 1 39 ? -6.652  -3.421  -0.751 1.00 0.15 ?  39 CYS   A HB3  8  
ATOM   4785 N N    . TYR   A 1 40 ? -6.260  -5.358  1.576  1.00 0.18 ?  40 TYR   A N    8  
ATOM   4786 C CA   . TYR   A 1 40 ? -6.944  -6.428  2.284  1.00 0.25 ?  40 TYR   A CA   8  
ATOM   4787 C C    . TYR   A 1 40 ? -8.376  -6.040  2.616  1.00 0.32 ?  40 TYR   A C    8  
ATOM   4788 O O    . TYR   A 1 40 ? -9.302  -6.818  2.409  1.00 0.88 ?  40 TYR   A O    8  
ATOM   4789 C CB   . TYR   A 1 40 ? -6.172  -6.848  3.547  1.00 0.27 ?  40 TYR   A CB   8  
ATOM   4790 C CG   . TYR   A 1 40 ? -5.879  -5.730  4.530  1.00 0.25 ?  40 TYR   A CG   8  
ATOM   4791 C CD1  . TYR   A 1 40 ? -4.748  -4.937  4.394  1.00 0.22 ?  40 TYR   A CD1  8  
ATOM   4792 C CD2  . TYR   A 1 40 ? -6.727  -5.485  5.604  1.00 0.32 ?  40 TYR   A CD2  8  
ATOM   4793 C CE1  . TYR   A 1 40 ? -4.471  -3.930  5.298  1.00 0.25 ?  40 TYR   A CE1  8  
ATOM   4794 C CE2  . TYR   A 1 40 ? -6.458  -4.476  6.508  1.00 0.35 ?  40 TYR   A CE2  8  
ATOM   4795 C CZ   . TYR   A 1 40 ? -5.329  -3.702  6.351  1.00 0.31 ?  40 TYR   A CZ   8  
ATOM   4796 O OH   . TYR   A 1 40 ? -5.054  -2.700  7.254  1.00 0.37 ?  40 TYR   A OH   8  
ATOM   4797 H H    . TYR   A 1 40 ? -6.336  -4.430  1.898  1.00 0.18 ?  40 TYR   A H    8  
ATOM   4798 H HA   . TYR   A 1 40 ? -6.980  -7.274  1.614  1.00 0.31 ?  40 TYR   A HA   8  
ATOM   4799 H HB2  . TYR   A 1 40 ? -6.746  -7.595  4.071  1.00 0.32 ?  40 TYR   A HB2  8  
ATOM   4800 H HB3  . TYR   A 1 40 ? -5.227  -7.278  3.248  1.00 0.28 ?  40 TYR   A HB3  8  
ATOM   4801 H HD1  . TYR   A 1 40 ? -4.079  -5.114  3.564  1.00 0.22 ?  40 TYR   A HD1  8  
ATOM   4802 H HD2  . TYR   A 1 40 ? -7.609  -6.095  5.725  1.00 0.36 ?  40 TYR   A HD2  8  
ATOM   4803 H HE1  . TYR   A 1 40 ? -3.587  -3.323  5.174  1.00 0.26 ?  40 TYR   A HE1  8  
ATOM   4804 H HE2  . TYR   A 1 40 ? -7.134  -4.297  7.332  1.00 0.41 ?  40 TYR   A HE2  8  
ATOM   4805 H HH   . TYR   A 1 40 ? -5.065  -3.064  8.149  1.00 1.13 ?  40 TYR   A HH   8  
HETATM 4806 N N    . NH2   A 1 41 ? -8.559  -4.843  3.143  1.00 0.59 ?  41 NH2   A N    8  
HETATM 4807 H HN1  . NH2   A 1 41 ? -7.774  -4.275  3.278  1.00 1.06 ?  41 NH2   A HN1  8  
HETATM 4808 H HN2  . NH2   A 1 41 ? -9.477  -4.584  3.386  1.00 0.56 ?  41 NH2   A HN2  8  
ATOM   4809 N N    . GLY   A 1 1  ? 4.550   1.734   -8.561 1.00 1.74 ?  1  GLY   A N    9  
ATOM   4810 C CA   . GLY   A 1 1  ? 3.913   1.183   -7.339 1.00 0.89 ?  1  GLY   A CA   9  
ATOM   4811 C C    . GLY   A 1 1  ? 2.872   2.119   -6.760 1.00 0.90 ?  1  GLY   A C    9  
ATOM   4812 O O    . GLY   A 1 1  ? 2.492   3.103   -7.397 1.00 1.76 ?  1  GLY   A O    9  
ATOM   4813 H H1   . GLY   A 1 1  ? 5.260   1.068   -8.926 1.00 2.34 ?  1  GLY   A H1   9  
ATOM   4814 H H2   . GLY   A 1 1  ? 5.019   2.635   -8.343 1.00 1.93 ?  1  GLY   A H2   9  
ATOM   4815 H H3   . GLY   A 1 1  ? 3.835   1.899   -9.296 1.00 2.29 ?  1  GLY   A H3   9  
ATOM   4816 H HA2  . GLY   A 1 1  ? 3.439   0.244   -7.584 1.00 0.93 ?  1  GLY   A HA2  9  
ATOM   4817 H HA3  . GLY   A 1 1  ? 4.678   1.007   -6.597 1.00 1.19 ?  1  GLY   A HA3  9  
ATOM   4818 N N    . PHE   A 1 2  ? 2.405   1.807   -5.556 1.00 0.43 ?  2  PHE   A N    9  
ATOM   4819 C CA   . PHE   A 1 2  ? 1.407   2.620   -4.876 1.00 0.24 ?  2  PHE   A CA   9  
ATOM   4820 C C    . PHE   A 1 2  ? 1.883   2.982   -3.477 1.00 0.22 ?  2  PHE   A C    9  
ATOM   4821 O O    . PHE   A 1 2  ? 1.194   2.738   -2.489 1.00 0.35 ?  2  PHE   A O    9  
ATOM   4822 C CB   . PHE   A 1 2  ? 0.065   1.886   -4.800 1.00 0.16 ?  2  PHE   A CB   9  
ATOM   4823 C CG   . PHE   A 1 2  ? -0.547  1.635   -6.144 1.00 0.18 ?  2  PHE   A CG   9  
ATOM   4824 C CD1  . PHE   A 1 2  ? -0.492  0.380   -6.726 1.00 0.25 ?  2  PHE   A CD1  9  
ATOM   4825 C CD2  . PHE   A 1 2  ? -1.174  2.660   -6.828 1.00 0.22 ?  2  PHE   A CD2  9  
ATOM   4826 C CE1  . PHE   A 1 2  ? -1.053  0.154   -7.967 1.00 0.30 ?  2  PHE   A CE1  9  
ATOM   4827 C CE2  . PHE   A 1 2  ? -1.736  2.442   -8.069 1.00 0.28 ?  2  PHE   A CE2  9  
ATOM   4828 C CZ   . PHE   A 1 2  ? -1.675  1.188   -8.640 1.00 0.29 ?  2  PHE   A CZ   9  
ATOM   4829 H H    . PHE   A 1 2  ? 2.746   1.003   -5.108 1.00 1.00 ?  2  PHE   A H    9  
ATOM   4830 H HA   . PHE   A 1 2  ? 1.280   3.526   -5.446 1.00 0.34 ?  2  PHE   A HA   9  
ATOM   4831 H HB2  . PHE   A 1 2  ? 0.206   0.933   -4.314 1.00 0.26 ?  2  PHE   A HB2  9  
ATOM   4832 H HB3  . PHE   A 1 2  ? -0.631  2.477   -4.222 1.00 0.20 ?  2  PHE   A HB3  9  
ATOM   4833 H HD1  . PHE   A 1 2  ? -0.004  -0.428  -6.199 1.00 0.32 ?  2  PHE   A HD1  9  
ATOM   4834 H HD2  . PHE   A 1 2  ? -1.221  3.643   -6.381 1.00 0.27 ?  2  PHE   A HD2  9  
ATOM   4835 H HE1  . PHE   A 1 2  ? -1.003  -0.828  -8.411 1.00 0.37 ?  2  PHE   A HE1  9  
ATOM   4836 H HE2  . PHE   A 1 2  ? -2.221  3.252   -8.591 1.00 0.36 ?  2  PHE   A HE2  9  
ATOM   4837 H HZ   . PHE   A 1 2  ? -2.114  1.014   -9.611 1.00 0.34 ?  2  PHE   A HZ   9  
ATOM   4838 N N    . GLY   A 1 3  ? 3.072   3.551   -3.399 1.00 0.18 ?  3  GLY   A N    9  
ATOM   4839 C CA   . GLY   A 1 3  ? 3.637   3.919   -2.118 1.00 0.20 ?  3  GLY   A CA   9  
ATOM   4840 C C    . GLY   A 1 3  ? 4.676   2.927   -1.649 1.00 0.19 ?  3  GLY   A C    9  
ATOM   4841 O O    . GLY   A 1 3  ? 5.603   3.280   -0.924 1.00 0.21 ?  3  GLY   A O    9  
ATOM   4842 H H    . GLY   A 1 3  ? 3.572   3.731   -4.223 1.00 0.21 ?  3  GLY   A H    9  
ATOM   4843 H HA2  . GLY   A 1 3  ? 4.095   4.893   -2.206 1.00 0.23 ?  3  GLY   A HA2  9  
ATOM   4844 H HA3  . GLY   A 1 3  ? 2.844   3.969   -1.388 1.00 0.24 ?  3  GLY   A HA3  9  
ATOM   4845 N N    . CYS   A 1 4  ? 4.520   1.683   -2.062 1.00 0.25 ?  4  CYS   A N    9  
ATOM   4846 C CA   . CYS   A 1 4  ? 5.481   0.644   -1.737 1.00 0.27 ?  4  CYS   A CA   9  
ATOM   4847 C C    . CYS   A 1 4  ? 6.514   0.541   -2.852 1.00 0.29 ?  4  CYS   A C    9  
ATOM   4848 O O    . CYS   A 1 4  ? 6.249   -0.044  -3.903 1.00 0.30 ?  4  CYS   A O    9  
ATOM   4849 C CB   . CYS   A 1 4  ? 4.763   -0.695  -1.555 1.00 0.28 ?  4  CYS   A CB   9  
ATOM   4850 S SG   . CYS   A 1 4  ? 3.285   -0.612  -0.487 1.00 0.39 ?  4  CYS   A SG   9  
ATOM   4851 H H    . CYS   A 1 4  ? 3.737   1.455   -2.602 1.00 0.30 ?  4  CYS   A H    9  
ATOM   4852 H HA   . CYS   A 1 4  ? 5.976   0.916   -0.817 1.00 0.30 ?  4  CYS   A HA   9  
ATOM   4853 H HB2  . CYS   A 1 4  ? 4.448   -1.056  -2.520 1.00 0.21 ?  4  CYS   A HB2  9  
ATOM   4854 H HB3  . CYS   A 1 4  ? 5.449   -1.405  -1.117 1.00 0.42 ?  4  CYS   A HB3  9  
ATOM   4855 N N    . ASN   A 1 5  ? 7.678   1.136   -2.642 1.00 0.34 ?  5  ASN   A N    9  
ATOM   4856 C CA   . ASN   A 1 5  ? 8.714   1.146   -3.668 1.00 0.40 ?  5  ASN   A CA   9  
ATOM   4857 C C    . ASN   A 1 5  ? 10.005  0.522   -3.165 1.00 0.40 ?  5  ASN   A C    9  
ATOM   4858 O O    . ASN   A 1 5  ? 11.077  0.761   -3.728 1.00 0.47 ?  5  ASN   A O    9  
ATOM   4859 C CB   . ASN   A 1 5  ? 8.992   2.574   -4.140 1.00 0.49 ?  5  ASN   A CB   9  
ATOM   4860 C CG   . ASN   A 1 5  ? 7.767   3.258   -4.707 1.00 0.49 ?  5  ASN   A CG   9  
ATOM   4861 O OD1  . ASN   A 1 5  ? 7.457   3.125   -5.888 1.00 0.65 ?  5  ASN   A OD1  9  
ATOM   4862 N ND2  . ASN   A 1 5  ? 7.065   4.004   -3.868 1.00 0.56 ?  5  ASN   A ND2  9  
ATOM   4863 H H    . ASN   A 1 5  ? 7.844   1.594   -1.785 1.00 0.36 ?  5  ASN   A H    9  
ATOM   4864 H HA   . ASN   A 1 5  ? 8.354   0.566   -4.504 1.00 0.43 ?  5  ASN   A HA   9  
ATOM   4865 H HB2  . ASN   A 1 5  ? 9.346   3.153   -3.302 1.00 0.51 ?  5  ASN   A HB2  9  
ATOM   4866 H HB3  . ASN   A 1 5  ? 9.757   2.551   -4.902 1.00 0.57 ?  5  ASN   A HB3  9  
ATOM   4867 H HD21 . ASN   A 1 5  ? 7.369   4.071   -2.938 1.00 0.70 ?  5  ASN   A HD21 9  
ATOM   4868 H HD22 . ASN   A 1 5  ? 6.278   4.469   -4.216 1.00 0.61 ?  5  ASN   A HD22 9  
ATOM   4869 N N    . GLY   A 1 6  ? 9.910   -0.274  -2.115 1.00 0.36 ?  6  GLY   A N    9  
ATOM   4870 C CA   . GLY   A 1 6  ? 11.079  -0.937  -1.585 1.00 0.38 ?  6  GLY   A CA   9  
ATOM   4871 C C    . GLY   A 1 6  ? 11.246  -0.722  -0.099 1.00 0.37 ?  6  GLY   A C    9  
ATOM   4872 O O    . GLY   A 1 6  ? 10.559  0.112   0.487  1.00 0.36 ?  6  GLY   A O    9  
ATOM   4873 H H    . GLY   A 1 6  ? 9.034   -0.421  -1.696 1.00 0.34 ?  6  GLY   A H    9  
ATOM   4874 H HA2  . GLY   A 1 6  ? 10.992  -1.997  -1.778 1.00 0.48 ?  6  GLY   A HA2  9  
ATOM   4875 H HA3  . GLY   A 1 6  ? 11.953  -0.561  -2.095 1.00 0.44 ?  6  GLY   A HA3  9  
HETATM 4876 C C2   . 6ZS   A 1 7  ? 13.816  -3.420  1.251  1.00 1.49 ?  7  6ZS   A C2   9  
HETATM 4877 N N    . 6ZS   A 1 7  ? 12.181  -1.464  0.494  1.00 0.47 ?  7  6ZS   A N    9  
HETATM 4878 C CA   . 6ZS   A 1 7  ? 12.425  -1.449  1.944  1.00 0.61 ?  7  6ZS   A CA   9  
HETATM 4879 C CB1  . 6ZS   A 1 7  ? 11.234  -2.032  2.682  1.00 0.71 ?  7  6ZS   A CB1  9  
HETATM 4880 C C    . 6ZS   A 1 7  ? 12.691  -0.019  2.422  1.00 0.59 ?  7  6ZS   A C    9  
HETATM 4881 O O    . 6ZS   A 1 7  ? 12.273  0.378   3.514  1.00 1.09 ?  7  6ZS   A O    9  
HETATM 4882 C CB   . 6ZS   A 1 7  ? 13.636  -2.313  2.276  1.00 0.75 ?  7  6ZS   A CB   9  
HETATM 4883 H H1   . 6ZS   A 1 7  ? 12.890  -3.964  1.138  1.00 2.14 ?  7  6ZS   A H1   9  
HETATM 4884 H H4   . 6ZS   A 1 7  ? 14.101  -2.991  0.301  1.00 1.94 ?  7  6ZS   A H4   9  
HETATM 4885 H H3   . 6ZS   A 1 7  ? 14.589  -4.097  1.583  1.00 2.00 ?  7  6ZS   A H3   9  
HETATM 4886 H H    . 6ZS   A 1 7  ? 12.730  -2.049  -0.064 1.00 0.49 ?  7  6ZS   A H    9  
HETATM 4887 H H7   . 6ZS   A 1 7  ? 11.444  -2.060  3.739  1.00 1.10 ?  7  6ZS   A H7   9  
HETATM 4888 H H8   . 6ZS   A 1 7  ? 11.044  -3.032  2.325  1.00 1.35 ?  7  6ZS   A H8   9  
HETATM 4889 H H9   . 6ZS   A 1 7  ? 10.367  -1.415  2.505  1.00 1.26 ?  7  6ZS   A H9   9  
HETATM 4890 H H10  . 6ZS   A 1 7  ? 14.528  -1.700  2.272  1.00 1.09 ?  7  6ZS   A H10  9  
HETATM 4891 H H11  . 6ZS   A 1 7  ? 13.507  -2.767  3.249  1.00 1.38 ?  7  6ZS   A H11  9  
ATOM   4892 N N    . TRP   A 1 8  ? 13.395  0.741   1.600  1.00 0.64 ?  8  TRP   A N    9  
ATOM   4893 C CA   . TRP   A 1 8  ? 13.796  2.089   1.960  1.00 0.67 ?  8  TRP   A CA   9  
ATOM   4894 C C    . TRP   A 1 8  ? 12.834  3.123   1.381  1.00 0.49 ?  8  TRP   A C    9  
ATOM   4895 O O    . TRP   A 1 8  ? 12.860  4.294   1.762  1.00 0.58 ?  8  TRP   A O    9  
ATOM   4896 C CB   . TRP   A 1 8  ? 15.217  2.349   1.465  1.00 0.87 ?  8  TRP   A CB   9  
ATOM   4897 C CG   . TRP   A 1 8  ? 16.174  1.271   1.872  1.00 1.12 ?  8  TRP   A CG   9  
ATOM   4898 C CD1  . TRP   A 1 8  ? 16.646  0.261   1.087  1.00 1.27 ?  8  TRP   A CD1  9  
ATOM   4899 C CD2  . TRP   A 1 8  ? 16.751  1.079   3.165  1.00 1.31 ?  8  TRP   A CD2  9  
ATOM   4900 N NE1  . TRP   A 1 8  ? 17.490  -0.544  1.810  1.00 1.50 ?  8  TRP   A NE1  9  
ATOM   4901 C CE2  . TRP   A 1 8  ? 17.571  -0.063  3.092  1.00 1.52 ?  8  TRP   A CE2  9  
ATOM   4902 C CE3  . TRP   A 1 8  ? 16.658  1.764   4.377  1.00 1.37 ?  8  TRP   A CE3  9  
ATOM   4903 C CZ2  . TRP   A 1 8  ? 18.291  -0.533  4.189  1.00 1.76 ?  8  TRP   A CZ2  9  
ATOM   4904 C CZ3  . TRP   A 1 8  ? 17.369  1.296   5.462  1.00 1.63 ?  8  TRP   A CZ3  9  
ATOM   4905 C CH2  . TRP   A 1 8  ? 18.178  0.157   5.361  1.00 1.80 ?  8  TRP   A CH2  9  
ATOM   4906 H H    . TRP   A 1 8  ? 13.661  0.382   0.728  1.00 1.04 ?  8  TRP   A H    9  
ATOM   4907 H HA   . TRP   A 1 8  ? 13.781  2.160   3.035  1.00 0.76 ?  8  TRP   A HA   9  
ATOM   4908 H HB2  . TRP   A 1 8  ? 15.213  2.405   0.390  1.00 0.85 ?  8  TRP   A HB2  9  
ATOM   4909 H HB3  . TRP   A 1 8  ? 15.571  3.282   1.868  1.00 0.91 ?  8  TRP   A HB3  9  
ATOM   4910 H HD1  . TRP   A 1 8  ? 16.386  0.130   0.049  1.00 1.25 ?  8  TRP   A HD1  9  
ATOM   4911 H HE1  . TRP   A 1 8  ? 17.957  -1.335  1.463  1.00 1.65 ?  8  TRP   A HE1  9  
ATOM   4912 H HE3  . TRP   A 1 8  ? 16.041  2.643   4.474  1.00 1.26 ?  8  TRP   A HE3  9  
ATOM   4913 H HZ2  . TRP   A 1 8  ? 18.918  -1.408  4.132  1.00 1.93 ?  8  TRP   A HZ2  9  
ATOM   4914 H HZ3  . TRP   A 1 8  ? 17.307  1.814   6.406  1.00 1.73 ?  8  TRP   A HZ3  9  
ATOM   4915 H HH2  . TRP   A 1 8  ? 18.716  -0.173  6.236  1.00 2.00 ?  8  TRP   A HH2  9  
ATOM   4916 N N    . ASN   A 1 9  ? 11.978  2.685   0.469  1.00 0.33 ?  9  ASN   A N    9  
ATOM   4917 C CA   . ASN   A 1 9  ? 11.011  3.577   -0.163 1.00 0.29 ?  9  ASN   A CA   9  
ATOM   4918 C C    . ASN   A 1 9  ? 9.607   3.054   0.105  1.00 0.25 ?  9  ASN   A C    9  
ATOM   4919 O O    . ASN   A 1 9  ? 8.773   2.952   -0.795 1.00 0.36 ?  9  ASN   A O    9  
ATOM   4920 C CB   . ASN   A 1 9  ? 11.255  3.702   -1.678 1.00 0.46 ?  9  ASN   A CB   9  
ATOM   4921 C CG   . ASN   A 1 9  ? 12.571  4.383   -2.032 1.00 1.31 ?  9  ASN   A CG   9  
ATOM   4922 O OD1  . ASN   A 1 9  ? 13.569  4.263   -1.320 1.00 2.05 ?  9  ASN   A OD1  9  
ATOM   4923 N ND2  . ASN   A 1 9  ? 12.583  5.113   -3.139 1.00 1.88 ?  9  ASN   A ND2  9  
ATOM   4924 H H    . ASN   A 1 9  ? 11.974  1.732   0.234  1.00 0.35 ?  9  ASN   A H    9  
ATOM   4925 H HA   . ASN   A 1 9  ? 11.113  4.548   0.295  1.00 0.37 ?  9  ASN   A HA   9  
ATOM   4926 H HB2  . ASN   A 1 9  ? 11.258  2.717   -2.119 1.00 1.10 ?  9  ASN   A HB2  9  
ATOM   4927 H HB3  . ASN   A 1 9  ? 10.451  4.277   -2.111 1.00 0.63 ?  9  ASN   A HB3  9  
ATOM   4928 H HD21 . ASN   A 1 9  ? 11.756  5.177   -3.664 1.00 2.03 ?  9  ASN   A HD21 9  
ATOM   4929 H HD22 . ASN   A 1 9  ? 13.418  5.561   -3.389 1.00 2.48 ?  9  ASN   A HD22 9  
ATOM   4930 N N    . GLU   A 1 10 ? 9.371   2.724   1.360  1.00 0.23 ?  10 GLU   A N    9  
ATOM   4931 C CA   . GLU   A 1 10 ? 8.142   2.078   1.780  1.00 0.26 ?  10 GLU   A CA   9  
ATOM   4932 C C    . GLU   A 1 10 ? 7.200   3.077   2.443  1.00 0.28 ?  10 GLU   A C    9  
ATOM   4933 O O    . GLU   A 1 10 ? 7.562   3.724   3.426  1.00 0.49 ?  10 GLU   A O    9  
ATOM   4934 C CB   . GLU   A 1 10 ? 8.485   0.955   2.759  1.00 0.39 ?  10 GLU   A CB   9  
ATOM   4935 C CG   . GLU   A 1 10 ? 7.282   0.248   3.344  1.00 0.45 ?  10 GLU   A CG   9  
ATOM   4936 C CD   . GLU   A 1 10 ? 7.617   -0.457  4.639  1.00 0.68 ?  10 GLU   A CD   9  
ATOM   4937 O OE1  . GLU   A 1 10 ? 7.971   0.219   5.626  1.00 0.95 ?  10 GLU   A OE1  9  
ATOM   4938 O OE2  . GLU   A 1 10 ? 7.510   -1.704  4.679  1.00 0.78 -1 10 GLU   A OE2  9  
ATOM   4939 H H    . GLU   A 1 10 ? 10.050  2.925   2.036  1.00 0.28 ?  10 GLU   A H    9  
ATOM   4940 H HA   . GLU   A 1 10 ? 7.662   1.658   0.910  1.00 0.27 ?  10 GLU   A HA   9  
ATOM   4941 H HB2  . GLU   A 1 10 ? 9.087   0.222   2.245  1.00 0.43 ?  10 GLU   A HB2  9  
ATOM   4942 H HB3  . GLU   A 1 10 ? 9.060   1.370   3.572  1.00 0.48 ?  10 GLU   A HB3  9  
ATOM   4943 H HG2  . GLU   A 1 10 ? 6.509   0.974   3.530  1.00 0.47 ?  10 GLU   A HG2  9  
ATOM   4944 H HG3  . GLU   A 1 10 ? 6.927   -0.481  2.635  1.00 0.40 ?  10 GLU   A HG3  9  
ATOM   4945 N N    . ASP   A 1 11 ? 6.003   3.216   1.893  1.00 0.23 ?  11 ASP   A N    9  
ATOM   4946 C CA   . ASP   A 1 11 ? 4.984   4.060   2.498  1.00 0.30 ?  11 ASP   A CA   9  
ATOM   4947 C C    . ASP   A 1 11 ? 3.669   3.309   2.620  1.00 0.23 ?  11 ASP   A C    9  
ATOM   4948 O O    . ASP   A 1 11 ? 2.803   3.402   1.740  1.00 0.20 ?  11 ASP   A O    9  
ATOM   4949 C CB   . ASP   A 1 11 ? 4.769   5.345   1.694  1.00 0.38 ?  11 ASP   A CB   9  
ATOM   4950 C CG   . ASP   A 1 11 ? 5.930   6.312   1.796  1.00 0.99 ?  11 ASP   A CG   9  
ATOM   4951 O OD1  . ASP   A 1 11 ? 6.723   6.395   0.839  1.00 1.86 ?  11 ASP   A OD1  9  
ATOM   4952 O OD2  . ASP   A 1 11 ? 6.045   7.009   2.828  1.00 1.32 -1 11 ASP   A OD2  9  
ATOM   4953 H H    . ASP   A 1 11 ? 5.803   2.748   1.052  1.00 0.30 ?  11 ASP   A H    9  
ATOM   4954 H HA   . ASP   A 1 11 ? 5.324   4.322   3.489  1.00 0.38 ?  11 ASP   A HA   9  
ATOM   4955 H HB2  . ASP   A 1 11 ? 4.634   5.090   0.654  1.00 0.94 ?  11 ASP   A HB2  9  
ATOM   4956 H HB3  . ASP   A 1 11 ? 3.879   5.841   2.056  1.00 0.78 ?  11 ASP   A HB3  9  
ATOM   4957 N N    . ASP   A 1 12 ? 3.522   2.572   3.717  1.00 0.25 ?  12 ASP   A N    9  
ATOM   4958 C CA   . ASP   A 1 12 ? 2.280   1.858   4.011  1.00 0.26 ?  12 ASP   A CA   9  
ATOM   4959 C C    . ASP   A 1 12 ? 1.105   2.818   3.995  1.00 0.18 ?  12 ASP   A C    9  
ATOM   4960 O O    . ASP   A 1 12 ? 0.004   2.459   3.577  1.00 0.18 ?  12 ASP   A O    9  
ATOM   4961 C CB   . ASP   A 1 12 ? 2.346   1.170   5.378  1.00 0.39 ?  12 ASP   A CB   9  
ATOM   4962 C CG   . ASP   A 1 12 ? 3.088   -0.149  5.352  1.00 0.82 ?  12 ASP   A CG   9  
ATOM   4963 O OD1  . ASP   A 1 12 ? 4.285   -0.170  5.704  1.00 1.45 ?  12 ASP   A OD1  9  
ATOM   4964 O OD2  . ASP   A 1 12 ? 2.487   -1.167  4.951  1.00 1.50 -1 12 ASP   A OD2  9  
ATOM   4965 H H    . ASP   A 1 12 ? 4.269   2.508   4.351  1.00 0.31 ?  12 ASP   A H    9  
ATOM   4966 H HA   . ASP   A 1 12 ? 2.133   1.112   3.245  1.00 0.27 ?  12 ASP   A HA   9  
ATOM   4967 H HB2  . ASP   A 1 12 ? 2.842   1.822   6.077  1.00 1.12 ?  12 ASP   A HB2  9  
ATOM   4968 H HB3  . ASP   A 1 12 ? 1.343   0.989   5.723  1.00 1.15 ?  12 ASP   A HB3  9  
HETATM 4969 N N    . 2ML   A 1 13 ? 1.364   4.042   4.452  1.00 0.18 ?  13 2ML   A N    9  
HETATM 4970 C CA   . 2ML   A 1 13 ? 0.369   5.113   4.475  1.00 0.19 ?  13 2ML   A CA   9  
HETATM 4971 C CB1  . 2ML   A 1 13 ? 1.057   6.404   4.918  1.00 0.24 ?  13 2ML   A CB1  9  
HETATM 4972 C CB2  . 2ML   A 1 13 ? -0.715  4.766   5.482  1.00 0.25 ?  13 2ML   A CB2  9  
HETATM 4973 C CG   . 2ML   A 1 13 ? 0.158   7.627   4.682  1.00 0.33 ?  13 2ML   A CG   9  
HETATM 4974 C CD1  . 2ML   A 1 13 ? -0.609  8.010   5.942  1.00 0.57 ?  13 2ML   A CD1  9  
HETATM 4975 C CD2  . 2ML   A 1 13 ? 0.988   8.803   4.192  1.00 0.54 ?  13 2ML   A CD2  9  
HETATM 4976 C C    . 2ML   A 1 13 ? -0.226  5.293   3.069  1.00 0.16 ?  13 2ML   A C    9  
HETATM 4977 O O    . 2ML   A 1 13 ? -1.442  5.437   2.905  1.00 0.17 ?  13 2ML   A O    9  
HETATM 4978 H H    . 2ML   A 1 13 ? 2.262   4.231   4.800  1.00 0.20 ?  13 2ML   A H    9  
HETATM 4979 H HB11 . 2ML   A 1 13 ? 1.963   6.531   4.350  1.00 0.28 ?  13 2ML   A HB11 9  
HETATM 4980 H HB12 . 2ML   A 1 13 ? 1.305   6.334   5.970  1.00 0.32 ?  13 2ML   A HB12 9  
HETATM 4981 H HB21 . 2ML   A 1 13 ? -0.301  4.771   6.479  1.00 0.92 ?  13 2ML   A HB21 9  
HETATM 4982 H HB22 . 2ML   A 1 13 ? -1.102  3.782   5.262  1.00 0.95 ?  13 2ML   A HB22 9  
HETATM 4983 H HB23 . 2ML   A 1 13 ? -1.512  5.486   5.417  1.00 1.02 ?  13 2ML   A HB23 9  
HETATM 4984 H HG   . 2ML   A 1 13 ? -0.564  7.387   3.914  1.00 0.64 ?  13 2ML   A HG   9  
HETATM 4985 H HD11 . 2ML   A 1 13 ? -1.248  8.855   5.733  1.00 1.31 ?  13 2ML   A HD11 9  
HETATM 4986 H HD12 . 2ML   A 1 13 ? 0.091   8.274   6.720  1.00 0.88 ?  13 2ML   A HD12 9  
HETATM 4987 H HD13 . 2ML   A 1 13 ? -1.209  7.175   6.268  1.00 1.28 ?  13 2ML   A HD13 9  
HETATM 4988 H HD21 . 2ML   A 1 13 ? 1.758   9.026   4.914  1.00 1.20 ?  13 2ML   A HD21 9  
HETATM 4989 H HD22 . 2ML   A 1 13 ? 0.351   9.665   4.069  1.00 1.15 ?  13 2ML   A HD22 9  
HETATM 4990 H HD23 . 2ML   A 1 13 ? 1.443   8.554   3.245  1.00 1.05 ?  13 2ML   A HD23 9  
ATOM   4991 N N    . ARG   A 1 14 ? 0.637   5.256   2.057  1.00 0.14 ?  14 ARG   A N    9  
ATOM   4992 C CA   . ARG   A 1 14 ? 0.214   5.499   0.682  1.00 0.16 ?  14 ARG   A CA   9  
ATOM   4993 C C    . ARG   A 1 14 ? -0.464  4.275   0.085  1.00 0.12 ?  14 ARG   A C    9  
ATOM   4994 O O    . ARG   A 1 14 ? -1.423  4.402   -0.678 1.00 0.14 ?  14 ARG   A O    9  
ATOM   4995 C CB   . ARG   A 1 14 ? 1.386   5.935   -0.197 1.00 0.21 ?  14 ARG   A CB   9  
ATOM   4996 C CG   . ARG   A 1 14 ? 1.756   7.399   -0.031 1.00 1.03 ?  14 ARG   A CG   9  
ATOM   4997 C CD   . ARG   A 1 14 ? 2.718   7.857   -1.121 1.00 1.04 ?  14 ARG   A CD   9  
ATOM   4998 N NE   . ARG   A 1 14 ? 4.041   7.238   -1.015 1.00 1.37 ?  14 ARG   A NE   9  
ATOM   4999 C CZ   . ARG   A 1 14 ? 4.975   7.322   -1.965 1.00 1.63 ?  14 ARG   A CZ   9  
ATOM   5000 N NH1  . ARG   A 1 14 ? 4.716   7.955   -3.102 1.00 1.31 1  14 ARG   A NH1  9  
ATOM   5001 N NH2  . ARG   A 1 14 ? 6.168   6.777   -1.773 1.00 2.60 ?  14 ARG   A NH2  9  
ATOM   5002 H H    . ARG   A 1 14 ? 1.576   5.029   2.241  1.00 0.17 ?  14 ARG   A H    9  
ATOM   5003 H HA   . ARG   A 1 14 ? -0.507  6.300   0.709  1.00 0.20 ?  14 ARG   A HA   9  
ATOM   5004 H HB2  . ARG   A 1 14 ? 2.251   5.339   0.047  1.00 0.88 ?  14 ARG   A HB2  9  
ATOM   5005 H HB3  . ARG   A 1 14 ? 1.126   5.769   -1.230 1.00 0.69 ?  14 ARG   A HB3  9  
ATOM   5006 H HG2  . ARG   A 1 14 ? 0.855   7.993   -0.084 1.00 1.51 ?  14 ARG   A HG2  9  
ATOM   5007 H HG3  . ARG   A 1 14 ? 2.221   7.536   0.934  1.00 1.60 ?  14 ARG   A HG3  9  
ATOM   5008 H HD2  . ARG   A 1 14 ? 2.293   7.598   -2.080 1.00 1.51 ?  14 ARG   A HD2  9  
ATOM   5009 H HD3  . ARG   A 1 14 ? 2.828   8.931   -1.058 1.00 1.55 ?  14 ARG   A HD3  9  
ATOM   5010 H HE   . ARG   A 1 14 ? 4.251   6.750   -0.189 1.00 1.89 ?  14 ARG   A HE   9  
ATOM   5011 H HH11 . ARG   A 1 14 ? 5.421   8.017   -3.816 1.00 1.53 ?  14 ARG   A HH11 9  
ATOM   5012 H HH12 . ARG   A 1 14 ? 3.818   8.375   -3.255 1.00 1.40 ?  14 ARG   A HH12 9  
ATOM   5013 H HH21 . ARG   A 1 14 ? 6.870   6.839   -2.488 1.00 2.84 ?  14 ARG   A HH21 9  
ATOM   5014 H HH22 . ARG   A 1 14 ? 6.382   6.314   -0.901 1.00 3.21 ?  14 ARG   A HH22 9  
ATOM   5015 N N    . CYS   A 1 15 ? 0.025   3.093   0.434  1.00 0.11 ?  15 CYS   A N    9  
ATOM   5016 C CA   . CYS   A 1 15 ? -0.615  1.857   -0.005 1.00 0.10 ?  15 CYS   A CA   9  
ATOM   5017 C C    . CYS   A 1 15 ? -2.025  1.790   0.574  1.00 0.09 ?  15 CYS   A C    9  
ATOM   5018 O O    . CYS   A 1 15 ? -2.989  1.470   -0.128 1.00 0.09 ?  15 CYS   A O    9  
ATOM   5019 C CB   . CYS   A 1 15 ? 0.210   0.638   0.426  1.00 0.13 ?  15 CYS   A CB   9  
ATOM   5020 S SG   . CYS   A 1 15 ? -0.491  -0.971  -0.074 1.00 0.13 ?  15 CYS   A SG   9  
ATOM   5021 H H    . CYS   A 1 15 ? 0.833   3.049   0.995  1.00 0.12 ?  15 CYS   A H    9  
ATOM   5022 H HA   . CYS   A 1 15 ? -0.684  1.879   -1.086 1.00 0.11 ?  15 CYS   A HA   9  
ATOM   5023 H HB2  . CYS   A 1 15 ? 1.197   0.710   -0.008 1.00 0.15 ?  15 CYS   A HB2  9  
ATOM   5024 H HB3  . CYS   A 1 15 ? 0.297   0.638   1.504  1.00 0.15 ?  15 CYS   A HB3  9  
ATOM   5025 N N    . HIS   A 1 16 ? -2.148  2.148   1.849  1.00 0.11 ?  16 HIS   A N    9  
ATOM   5026 C CA   . HIS   A 1 16 ? -3.443  2.200   2.506  1.00 0.13 ?  16 HIS   A CA   9  
ATOM   5027 C C    . HIS   A 1 16 ? -4.332  3.226   1.821  1.00 0.13 ?  16 HIS   A C    9  
ATOM   5028 O O    . HIS   A 1 16 ? -5.498  2.951   1.572  1.00 0.15 ?  16 HIS   A O    9  
ATOM   5029 C CB   . HIS   A 1 16 ? -3.288  2.539   3.997  1.00 0.17 ?  16 HIS   A CB   9  
ATOM   5030 C CG   . HIS   A 1 16 ? -4.591  2.620   4.748  1.00 0.27 ?  16 HIS   A CG   9  
ATOM   5031 N ND1  . HIS   A 1 16 ? -5.104  1.575   5.485  1.00 0.39 ?  16 HIS   A ND1  9  
ATOM   5032 C CD2  . HIS   A 1 16 ? -5.488  3.630   4.865  1.00 0.34 ?  16 HIS   A CD2  9  
ATOM   5033 C CE1  . HIS   A 1 16 ? -6.259  1.934   6.013  1.00 0.48 ?  16 HIS   A CE1  9  
ATOM   5034 N NE2  . HIS   A 1 16 ? -6.514  3.176   5.653  1.00 0.45 ?  16 HIS   A NE2  9  
ATOM   5035 H H    . HIS   A 1 16 ? -1.340  2.380   2.362  1.00 0.13 ?  16 HIS   A H    9  
ATOM   5036 H HA   . HIS   A 1 16 ? -3.899  1.226   2.411  1.00 0.14 ?  16 HIS   A HA   9  
ATOM   5037 H HB2  . HIS   A 1 16 ? -2.684  1.780   4.469  1.00 0.22 ?  16 HIS   A HB2  9  
ATOM   5038 H HB3  . HIS   A 1 16 ? -2.793  3.494   4.088  1.00 0.15 ?  16 HIS   A HB3  9  
ATOM   5039 H HD1  . HIS   A 1 16 ? -4.672  0.705   5.625  1.00 0.44 ?  16 HIS   A HD1  9  
ATOM   5040 H HD2  . HIS   A 1 16 ? -5.405  4.613   4.423  1.00 0.35 ?  16 HIS   A HD2  9  
ATOM   5041 H HE1  . HIS   A 1 16 ? -6.892  1.311   6.628  1.00 0.59 ?  16 HIS   A HE1  9  
ATOM   5042 H HE2  . HIS   A 1 16 ? -7.246  3.728   6.010  1.00 0.54 ?  16 HIS   A HE2  9  
HETATM 5043 N N    . AIB   A 1 17 ? -3.772  4.404   1.527  1.00 0.13 ?  17 AIB   A N    9  
HETATM 5044 C CA   . AIB   A 1 17 ? -4.502  5.473   0.825  1.00 0.15 ?  17 AIB   A CA   9  
HETATM 5045 C C    . AIB   A 1 17 ? -5.109  4.906   -0.465 1.00 0.13 ?  17 AIB   A C    9  
HETATM 5046 O O    . AIB   A 1 17 ? -6.311  5.042   -0.728 1.00 0.15 ?  17 AIB   A O    9  
HETATM 5047 C CB1  . AIB   A 1 17 ? -3.552  6.606   0.484  1.00 0.18 ?  17 AIB   A CB1  9  
HETATM 5048 C CB2  . AIB   A 1 17 ? -5.584  6.041   1.722  1.00 0.19 ?  17 AIB   A CB2  9  
HETATM 5049 H H    . AIB   A 1 17 ? -2.839  4.563   1.791  1.00 0.13 ?  17 AIB   A H    9  
HETATM 5050 H HB11 . AIB   A 1 17 ? -2.751  6.232   -0.136 1.00 0.99 ?  17 AIB   A HB11 9  
HETATM 5051 H HB12 . AIB   A 1 17 ? -3.139  7.019   1.394  1.00 0.95 ?  17 AIB   A HB12 9  
HETATM 5052 H HB13 . AIB   A 1 17 ? -4.088  7.377   -0.049 1.00 1.05 ?  17 AIB   A HB13 9  
HETATM 5053 H HB21 . AIB   A 1 17 ? -5.129  6.587   2.534  1.00 1.00 ?  17 AIB   A HB21 9  
HETATM 5054 H HB22 . AIB   A 1 17 ? -6.176  5.233   2.123  1.00 1.02 ?  17 AIB   A HB22 9  
HETATM 5055 H HB23 . AIB   A 1 17 ? -6.218  6.703   1.151  1.00 0.98 ?  17 AIB   A HB23 9  
ATOM   5056 N N    . HIS   A 1 18 ? -4.260  4.251   -1.250 1.00 0.12 ?  18 HIS   A N    9  
ATOM   5057 C CA   . HIS   A 1 18 ? -4.673  3.650   -2.509 1.00 0.12 ?  18 HIS   A CA   9  
ATOM   5058 C C    . HIS   A 1 18 ? -5.821  2.669   -2.301 1.00 0.09 ?  18 HIS   A C    9  
ATOM   5059 O O    . HIS   A 1 18 ? -6.900  2.835   -2.865 1.00 0.10 ?  18 HIS   A O    9  
ATOM   5060 C CB   . HIS   A 1 18 ? -3.479  2.943   -3.168 1.00 0.15 ?  18 HIS   A CB   9  
ATOM   5061 C CG   . HIS   A 1 18 ? -3.845  2.069   -4.332 1.00 0.19 ?  18 HIS   A CG   9  
ATOM   5062 N ND1  . HIS   A 1 18 ? -4.361  2.555   -5.514 1.00 0.23 ?  18 HIS   A ND1  9  
ATOM   5063 C CD2  . HIS   A 1 18 ? -3.772  0.727   -4.479 1.00 0.23 ?  18 HIS   A CD2  9  
ATOM   5064 C CE1  . HIS   A 1 18 ? -4.590  1.550   -6.338 1.00 0.28 ?  18 HIS   A CE1  9  
ATOM   5065 N NE2  . HIS   A 1 18 ? -4.242  0.431   -5.734 1.00 0.28 ?  18 HIS   A NE2  9  
ATOM   5066 H H    . HIS   A 1 18 ? -3.321  4.166   -0.968 1.00 0.12 ?  18 HIS   A H    9  
ATOM   5067 H HA   . HIS   A 1 18 ? -5.010  4.442   -3.158 1.00 0.14 ?  18 HIS   A HA   9  
ATOM   5068 H HB2  . HIS   A 1 18 ? -2.782  3.685   -3.521 1.00 0.17 ?  18 HIS   A HB2  9  
ATOM   5069 H HB3  . HIS   A 1 18 ? -2.988  2.325   -2.432 1.00 0.15 ?  18 HIS   A HB3  9  
ATOM   5070 H HD1  . HIS   A 1 18 ? -4.532  3.502   -5.722 1.00 0.24 ?  18 HIS   A HD1  9  
ATOM   5071 H HD2  . HIS   A 1 18 ? -3.411  0.024   -3.744 1.00 0.24 ?  18 HIS   A HD2  9  
ATOM   5072 H HE1  . HIS   A 1 18 ? -4.986  1.631   -7.339 1.00 0.33 ?  18 HIS   A HE1  9  
ATOM   5073 H HE2  . HIS   A 1 18 ? -4.411  -0.475  -6.081 1.00 0.36 ?  18 HIS   A HE2  9  
ATOM   5074 N N    . CYS   A 1 19 ? -5.586  1.669   -1.468 1.00 0.09 ?  19 CYS   A N    9  
ATOM   5075 C CA   . CYS   A 1 19 ? -6.550  0.596   -1.268 1.00 0.09 ?  19 CYS   A CA   9  
ATOM   5076 C C    . CYS   A 1 19 ? -7.841  1.116   -0.645 1.00 0.09 ?  19 CYS   A C    9  
ATOM   5077 O O    . CYS   A 1 19 ? -8.925  0.637   -0.970 1.00 0.09 ?  19 CYS   A O    9  
ATOM   5078 C CB   . CYS   A 1 19 ? -5.927  -0.491  -0.401 1.00 0.11 ?  19 CYS   A CB   9  
ATOM   5079 S SG   . CYS   A 1 19 ? -4.345  -1.114  -1.053 1.00 0.12 ?  19 CYS   A SG   9  
ATOM   5080 H H    . CYS   A 1 19 ? -4.737  1.650   -0.966 1.00 0.11 ?  19 CYS   A H    9  
ATOM   5081 H HA   . CYS   A 1 19 ? -6.781  0.178   -2.238 1.00 0.10 ?  19 CYS   A HA   9  
ATOM   5082 H HB2  . CYS   A 1 19 ? -5.745  -0.097  0.588  1.00 0.13 ?  19 CYS   A HB2  9  
ATOM   5083 H HB3  . CYS   A 1 19 ? -6.608  -1.327  -0.333 1.00 0.13 ?  19 CYS   A HB3  9  
HETATM 5084 N N    . A1BEB A 1 20 ? -7.710  2.110   0.234  1.00 0.11 ?  20 A1BEB A N    9  
HETATM 5085 C CA   . A1BEB A 1 20 ? -8.854  2.757   0.886  1.00 0.14 ?  20 A1BEB A CA   9  
HETATM 5086 C C    . A1BEB A 1 20 ? -9.759  3.381   -0.180 1.00 0.16 ?  20 A1BEB A C    9  
HETATM 5087 O O    . A1BEB A 1 20 ? -10.979 3.423   -0.032 1.00 0.18 ?  20 A1BEB A O    9  
HETATM 5088 C CB   . A1BEB A 1 20 ? -8.331  3.838   1.817  1.00 0.21 ?  20 A1BEB A CB   9  
HETATM 5089 C CB2  . A1BEB A 1 20 ? -9.623  1.747   1.721  1.00 0.15 ?  20 A1BEB A CB2  9  
HETATM 5090 C CG   . A1BEB A 1 20 ? -9.446  4.614   2.490  1.00 0.36 ?  20 A1BEB A CG   9  
HETATM 5091 C CD   . A1BEB A 1 20 ? -8.883  5.787   3.273  1.00 0.44 ?  20 A1BEB A CD   9  
HETATM 5092 C CE   . A1BEB A 1 20 ? -9.970  6.563   3.993  1.00 0.72 ?  20 A1BEB A CE   9  
HETATM 5093 N NZ   . A1BEB A 1 20 ? -10.650 5.743   5.027  1.00 1.38 ?  20 A1BEB A NZ   9  
HETATM 5094 H H    . A1BEB A 1 20 ? -6.808  2.423   0.461  1.00 0.12 ?  20 A1BEB A H    9  
HETATM 5095 H HB2  . A1BEB A 1 20 ? -7.728  4.532   1.249  1.00 0.19 ?  20 A1BEB A HB2  9  
HETATM 5096 H HB3  . A1BEB A 1 20 ? -7.722  3.383   2.584  1.00 0.23 ?  20 A1BEB A HB3  9  
HETATM 5097 H HB23 . A1BEB A 1 20 ? -9.912  0.913   1.097  1.00 0.84 ?  20 A1BEB A HB23 9  
HETATM 5098 H HB21 . A1BEB A 1 20 ? -10.506 2.213   2.130  1.00 0.80 ?  20 A1BEB A HB21 9  
HETATM 5099 H HB22 . A1BEB A 1 20 ? -8.996  1.394   2.527  1.00 0.82 ?  20 A1BEB A HB22 9  
HETATM 5100 H HG3  . A1BEB A 1 20 ? -9.972  3.962   3.166  1.00 0.42 ?  20 A1BEB A HG3  9  
HETATM 5101 H HG2  . A1BEB A 1 20 ? -10.124 4.981   1.734  1.00 0.40 ?  20 A1BEB A HG2  9  
HETATM 5102 H HD3  . A1BEB A 1 20 ? -8.179  5.414   4.001  1.00 0.93 ?  20 A1BEB A HD3  9  
HETATM 5103 H HD2  . A1BEB A 1 20 ? -8.374  6.450   2.588  1.00 0.84 ?  20 A1BEB A HD2  9  
HETATM 5104 H HE3  . A1BEB A 1 20 ? -9.523  7.423   4.467  1.00 1.49 ?  20 A1BEB A HE3  9  
HETATM 5105 H HE2  . A1BEB A 1 20 ? -10.699 6.892   3.269  1.00 1.41 ?  20 A1BEB A HE2  9  
HETATM 5106 H HZ1  . A1BEB A 1 20 ? -9.974  5.454   5.761  1.00 1.93 ?  20 A1BEB A HZ1  9  
HETATM 5107 H HZ2  . A1BEB A 1 20 ? -11.057 4.889   4.599  1.00 1.93 ?  20 A1BEB A HZ2  9  
HETATM 5108 H HZ3  . A1BEB A 1 20 ? -11.415 6.290   5.472  1.00 1.84 ?  20 A1BEB A HZ3  9  
ATOM   5109 N N    . SER   A 1 21 ? -9.152  3.861   -1.259 1.00 0.18 ?  21 SER   A N    9  
ATOM   5110 C CA   . SER   A 1 21 ? -9.902  4.503   -2.323 1.00 0.23 ?  21 SER   A CA   9  
ATOM   5111 C C    . SER   A 1 21 ? -10.632 3.475   -3.189 1.00 0.23 ?  21 SER   A C    9  
ATOM   5112 O O    . SER   A 1 21 ? -11.493 3.831   -3.998 1.00 0.31 ?  21 SER   A O    9  
ATOM   5113 C CB   . SER   A 1 21 ? -8.964  5.349   -3.171 1.00 0.33 ?  21 SER   A CB   9  
ATOM   5114 O OG   . SER   A 1 21 ? -8.256  6.276   -2.361 1.00 1.18 ?  21 SER   A OG   9  
ATOM   5115 H H    . SER   A 1 21 ? -8.174  3.783   -1.340 1.00 0.17 ?  21 SER   A H    9  
ATOM   5116 H HA   . SER   A 1 21 ? -10.631 5.148   -1.866 1.00 0.26 ?  21 SER   A HA   9  
ATOM   5117 H HB2  . SER   A 1 21 ? -8.257  4.710   -3.672 1.00 1.01 ?  21 SER   A HB2  9  
ATOM   5118 H HB3  . SER   A 1 21 ? -9.536  5.894   -3.902 1.00 1.21 ?  21 SER   A HB3  9  
ATOM   5119 H HG   . SER   A 1 21 ? -7.444  5.860   -2.033 1.00 1.82 ?  21 SER   A HG   9  
ATOM   5120 N N    . ILE   A 1 22 ? -10.299 2.204   -3.008 1.00 0.19 ?  22 ILE   A N    9  
ATOM   5121 C CA   . ILE   A 1 22 ? -10.920 1.136   -3.769 1.00 0.20 ?  22 ILE   A CA   9  
ATOM   5122 C C    . ILE   A 1 22 ? -12.011 0.453   -2.946 1.00 0.17 ?  22 ILE   A C    9  
ATOM   5123 O O    . ILE   A 1 22 ? -11.749 -0.069  -1.855 1.00 0.14 ?  22 ILE   A O    9  
ATOM   5124 C CB   . ILE   A 1 22 ? -9.888  0.080   -4.195 1.00 0.21 ?  22 ILE   A CB   9  
ATOM   5125 C CG1  . ILE   A 1 22 ? -8.715  0.739   -4.918 1.00 0.24 ?  22 ILE   A CG1  9  
ATOM   5126 C CG2  . ILE   A 1 22 ? -10.549 -0.963  -5.086 1.00 0.24 ?  22 ILE   A CG2  9  
ATOM   5127 C CD1  . ILE   A 1 22 ? -7.616  -0.229  -5.297 1.00 0.26 ?  22 ILE   A CD1  9  
ATOM   5128 H H    . ILE   A 1 22 ? -9.622  1.975   -2.337 1.00 0.19 ?  22 ILE   A H    9  
ATOM   5129 H HA   . ILE   A 1 22 ? -11.355 1.565   -4.656 1.00 0.25 ?  22 ILE   A HA   9  
ATOM   5130 H HB   . ILE   A 1 22 ? -9.524  -0.409  -3.306 1.00 0.18 ?  22 ILE   A HB   9  
ATOM   5131 H HG12 . ILE   A 1 22 ? -9.074  1.203   -5.824 1.00 0.28 ?  22 ILE   A HG12 9  
ATOM   5132 H HG13 . ILE   A 1 22 ? -8.287  1.496   -4.278 1.00 0.24 ?  22 ILE   A HG13 9  
ATOM   5133 H HG21 . ILE   A 1 22 ? -11.361 -1.431  -4.550 1.00 0.99 ?  22 ILE   A HG21 9  
ATOM   5134 H HG22 . ILE   A 1 22 ? -9.825  -1.711  -5.369 1.00 0.98 ?  22 ILE   A HG22 9  
ATOM   5135 H HG23 . ILE   A 1 22 ? -10.935 -0.483  -5.973 1.00 0.97 ?  22 ILE   A HG23 9  
ATOM   5136 H HD11 . ILE   A 1 22 ? -6.787  0.315   -5.722 1.00 1.05 ?  22 ILE   A HD11 9  
ATOM   5137 H HD12 . ILE   A 1 22 ? -7.991  -0.934  -6.023 1.00 1.05 ?  22 ILE   A HD12 9  
ATOM   5138 H HD13 . ILE   A 1 22 ? -7.283  -0.760  -4.418 1.00 0.99 ?  22 ILE   A HD13 9  
ATOM   5139 N N    . PRO   A 1 23 ? -13.253 0.459   -3.450 1.00 0.19 ?  23 PRO   A N    9  
ATOM   5140 C CA   . PRO   A 1 23 ? -14.377 -0.192  -2.778 1.00 0.19 ?  23 PRO   A CA   9  
ATOM   5141 C C    . PRO   A 1 23 ? -14.105 -1.670  -2.516 1.00 0.18 ?  23 PRO   A C    9  
ATOM   5142 O O    . PRO   A 1 23 ? -13.514 -2.361  -3.348 1.00 0.21 ?  23 PRO   A O    9  
ATOM   5143 C CB   . PRO   A 1 23 ? -15.535 -0.026  -3.765 1.00 0.25 ?  23 PRO   A CB   9  
ATOM   5144 C CG   . PRO   A 1 23 ? -15.160 1.148   -4.592 1.00 0.29 ?  23 PRO   A CG   9  
ATOM   5145 C CD   . PRO   A 1 23 ? -13.665 1.099   -4.710 1.00 0.26 ?  23 PRO   A CD   9  
ATOM   5146 H HA   . PRO   A 1 23 ? -14.618 0.298   -1.849 1.00 0.19 ?  23 PRO   A HA   9  
ATOM   5147 H HB2  . PRO   A 1 23 ? -15.627 -0.916  -4.367 1.00 0.28 ?  23 PRO   A HB2  9  
ATOM   5148 H HB3  . PRO   A 1 23 ? -16.454 0.150   -3.223 1.00 0.28 ?  23 PRO   A HB3  9  
ATOM   5149 H HG2  . PRO   A 1 23 ? -15.617 1.070   -5.564 1.00 0.34 ?  23 PRO   A HG2  9  
ATOM   5150 H HG3  . PRO   A 1 23 ? -15.468 2.059   -4.101 1.00 0.30 ?  23 PRO   A HG3  9  
ATOM   5151 H HD2  . PRO   A 1 23 ? -13.373 0.501   -5.561 1.00 0.30 ?  23 PRO   A HD2  9  
ATOM   5152 H HD3  . PRO   A 1 23 ? -13.261 2.096   -4.788 1.00 0.28 ?  23 PRO   A HD3  9  
HETATM 5153 N N    . DPR   A 1 24 ? -14.532 -2.170  -1.352 1.00 0.19 ?  24 DPR   A N    9  
HETATM 5154 C CA   . DPR   A 1 24 ? -14.315 -3.558  -0.947 1.00 0.23 ?  24 DPR   A CA   9  
HETATM 5155 C CB   . DPR   A 1 24 ? -15.501 -3.799  -0.025 1.00 0.30 ?  24 DPR   A CB   9  
HETATM 5156 C CG   . DPR   A 1 24 ? -15.672 -2.491  0.674  1.00 0.29 ?  24 DPR   A CG   9  
HETATM 5157 C CD   . DPR   A 1 24 ? -15.301 -1.429  -0.334 1.00 0.23 ?  24 DPR   A CD   9  
HETATM 5158 C C    . DPR   A 1 24 ? -13.004 -3.750  -0.183 1.00 0.22 ?  24 DPR   A C    9  
HETATM 5159 O O    . DPR   A 1 24 ? -12.797 -4.781  0.458  1.00 0.31 ?  24 DPR   A O    9  
HETATM 5160 H HA   . DPR   A 1 24 ? -14.363 -4.240  -1.779 1.00 0.27 ?  24 DPR   A HA   9  
HETATM 5161 H HB2  . DPR   A 1 24 ? -15.270 -4.592  0.669  1.00 0.34 ?  24 DPR   A HB2  9  
HETATM 5162 H HB3  . DPR   A 1 24 ? -16.374 -4.058  -0.607 1.00 0.33 ?  24 DPR   A HB3  9  
HETATM 5163 H HG2  . DPR   A 1 24 ? -15.011 -2.442  1.526  1.00 0.31 ?  24 DPR   A HG2  9  
HETATM 5164 H HG3  . DPR   A 1 24 ? -16.699 -2.369  0.985  1.00 0.35 ?  24 DPR   A HG3  9  
HETATM 5165 H HD2  . DPR   A 1 24 ? -14.693 -0.665  0.126  1.00 0.23 ?  24 DPR   A HD2  9  
HETATM 5166 H HD3  . DPR   A 1 24 ? -16.190 -0.995  -0.767 1.00 0.24 ?  24 DPR   A HD3  9  
ATOM   5167 N N    . TYR   A 1 25 ? -12.123 -2.763  -0.242 1.00 0.15 ?  25 TYR   A N    9  
ATOM   5168 C CA   . TYR   A 1 25 ? -10.907 -2.803  0.549  1.00 0.14 ?  25 TYR   A CA   9  
ATOM   5169 C C    . TYR   A 1 25 ? -10.990 -1.792  1.682  1.00 0.15 ?  25 TYR   A C    9  
ATOM   5170 O O    . TYR   A 1 25 ? -11.712 -0.800  1.586  1.00 0.17 ?  25 TYR   A O    9  
ATOM   5171 C CB   . TYR   A 1 25 ? -9.677  -2.532  -0.317 1.00 0.12 ?  25 TYR   A CB   9  
ATOM   5172 C CG   . TYR   A 1 25 ? -9.368  -3.637  -1.309 1.00 0.15 ?  25 TYR   A CG   9  
ATOM   5173 C CD1  . TYR   A 1 25 ? -9.344  -3.387  -2.674 1.00 0.18 ?  25 TYR   A CD1  9  
ATOM   5174 C CD2  . TYR   A 1 25 ? -9.093  -4.929  -0.879 1.00 0.21 ?  25 TYR   A CD2  9  
ATOM   5175 C CE1  . TYR   A 1 25 ? -9.055  -4.388  -3.581 1.00 0.24 ?  25 TYR   A CE1  9  
ATOM   5176 C CE2  . TYR   A 1 25 ? -8.806  -5.937  -1.779 1.00 0.26 ?  25 TYR   A CE2  9  
ATOM   5177 C CZ   . TYR   A 1 25 ? -8.786  -5.660  -3.129 1.00 0.26 ?  25 TYR   A CZ   9  
ATOM   5178 O OH   . TYR   A 1 25 ? -8.492  -6.656  -4.031 1.00 0.32 ?  25 TYR   A OH   9  
ATOM   5179 H H    . TYR   A 1 25 ? -12.298 -1.987  -0.823 1.00 0.14 ?  25 TYR   A H    9  
ATOM   5180 H HA   . TYR   A 1 25 ? -10.826 -3.791  0.976  1.00 0.16 ?  25 TYR   A HA   9  
ATOM   5181 H HB2  . TYR   A 1 25 ? -9.835  -1.621  -0.872 1.00 0.11 ?  25 TYR   A HB2  9  
ATOM   5182 H HB3  . TYR   A 1 25 ? -8.818  -2.411  0.324  1.00 0.12 ?  25 TYR   A HB3  9  
ATOM   5183 H HD1  . TYR   A 1 25 ? -9.553  -2.394  -3.026 1.00 0.20 ?  25 TYR   A HD1  9  
ATOM   5184 H HD2  . TYR   A 1 25 ? -9.108  -5.143  0.178  1.00 0.25 ?  25 TYR   A HD2  9  
ATOM   5185 H HE1  . TYR   A 1 25 ? -9.042  -4.172  -4.639 1.00 0.29 ?  25 TYR   A HE1  9  
ATOM   5186 H HE2  . TYR   A 1 25 ? -8.595  -6.934  -1.423 1.00 0.32 ?  25 TYR   A HE2  9  
ATOM   5187 H HH   . TYR   A 1 25 ? -9.015  -7.440  -3.826 1.00 0.97 ?  25 TYR   A HH   9  
ATOM   5188 N N    . LYS   A 1 26 ? -10.262 -2.055  2.754  1.00 0.16 ?  26 LYS   A N    9  
ATOM   5189 C CA   . LYS   A 1 26 ? -10.282 -1.186  3.925  1.00 0.21 ?  26 LYS   A CA   9  
ATOM   5190 C C    . LYS   A 1 26 ? -8.867  -0.799  4.343  1.00 0.24 ?  26 LYS   A C    9  
ATOM   5191 O O    . LYS   A 1 26 ? -8.667  -0.104  5.337  1.00 0.46 ?  26 LYS   A O    9  
ATOM   5192 C CB   . LYS   A 1 26 ? -11.012 -1.867  5.089  1.00 0.27 ?  26 LYS   A CB   9  
ATOM   5193 C CG   . LYS   A 1 26 ? -10.402 -3.197  5.511  1.00 0.30 ?  26 LYS   A CG   9  
ATOM   5194 C CD   . LYS   A 1 26 ? -11.158 -3.824  6.673  1.00 0.43 ?  26 LYS   A CD   9  
ATOM   5195 C CE   . LYS   A 1 26 ? -12.616 -4.074  6.323  1.00 1.65 ?  26 LYS   A CE   9  
ATOM   5196 N NZ   . LYS   A 1 26 ? -13.345 -4.764  7.419  1.00 1.94 1  26 LYS   A NZ   9  
ATOM   5197 H H    . LYS   A 1 26 ? -9.695  -2.857  2.760  1.00 0.16 ?  26 LYS   A H    9  
ATOM   5198 H HA   . LYS   A 1 26 ? -10.817 -0.288  3.653  1.00 0.22 ?  26 LYS   A HA   9  
ATOM   5199 H HB2  . LYS   A 1 26 ? -10.997 -1.206  5.943  1.00 0.31 ?  26 LYS   A HB2  9  
ATOM   5200 H HB3  . LYS   A 1 26 ? -12.038 -2.044  4.801  1.00 0.32 ?  26 LYS   A HB3  9  
ATOM   5201 H HG2  . LYS   A 1 26 ? -10.432 -3.877  4.674  1.00 0.34 ?  26 LYS   A HG2  9  
ATOM   5202 H HG3  . LYS   A 1 26 ? -9.378  -3.033  5.809  1.00 0.36 ?  26 LYS   A HG3  9  
ATOM   5203 H HD2  . LYS   A 1 26 ? -10.693 -4.765  6.925  1.00 1.07 ?  26 LYS   A HD2  9  
ATOM   5204 H HD3  . LYS   A 1 26 ? -11.109 -3.157  7.520  1.00 0.96 ?  26 LYS   A HD3  9  
ATOM   5205 H HE2  . LYS   A 1 26 ? -13.095 -3.125  6.129  1.00 2.28 ?  26 LYS   A HE2  9  
ATOM   5206 H HE3  . LYS   A 1 26 ? -12.660 -4.685  5.432  1.00 2.30 ?  26 LYS   A HE3  9  
ATOM   5207 H HZ1  . LYS   A 1 26 ? -14.352 -4.856  7.177  1.00 2.33 ?  26 LYS   A HZ1  9  
ATOM   5208 H HZ2  . LYS   A 1 26 ? -13.260 -4.224  8.302  1.00 2.04 ?  26 LYS   A HZ2  9  
ATOM   5209 H HZ3  . LYS   A 1 26 ? -12.951 -5.714  7.568  1.00 2.40 ?  26 LYS   A HZ3  9  
ATOM   5210 N N    . GLY   A 1 27 ? -7.890  -1.252  3.576  1.00 0.14 ?  27 GLY   A N    9  
ATOM   5211 C CA   . GLY   A 1 27 ? -6.513  -0.936  3.870  1.00 0.13 ?  27 GLY   A CA   9  
ATOM   5212 C C    . GLY   A 1 27 ? -5.567  -1.616  2.911  1.00 0.12 ?  27 GLY   A C    9  
ATOM   5213 O O    . GLY   A 1 27 ? -6.003  -2.369  2.040  1.00 0.15 ?  27 GLY   A O    9  
ATOM   5214 H H    . GLY   A 1 27 ? -8.103  -1.812  2.804  1.00 0.25 ?  27 GLY   A H    9  
ATOM   5215 H HA2  . GLY   A 1 27 ? -6.376  0.133   3.804  1.00 0.14 ?  27 GLY   A HA2  9  
ATOM   5216 H HA3  . GLY   A 1 27 ? -6.285  -1.258  4.875  1.00 0.17 ?  27 GLY   A HA3  9  
ATOM   5217 N N    . GLY   A 1 28 ? -4.280  -1.358  3.070  1.00 0.13 ?  28 GLY   A N    9  
ATOM   5218 C CA   . GLY   A 1 28 ? -3.289  -1.963  2.209  1.00 0.13 ?  28 GLY   A CA   9  
ATOM   5219 C C    . GLY   A 1 28 ? -1.897  -1.851  2.785  1.00 0.16 ?  28 GLY   A C    9  
ATOM   5220 O O    . GLY   A 1 28 ? -1.389  -0.749  2.996  1.00 0.20 ?  28 GLY   A O    9  
ATOM   5221 H H    . GLY   A 1 28 ? -3.993  -0.758  3.791  1.00 0.15 ?  28 GLY   A H    9  
ATOM   5222 H HA2  . GLY   A 1 28 ? -3.530  -3.008  2.085  1.00 0.14 ?  28 GLY   A HA2  9  
ATOM   5223 H HA3  . GLY   A 1 28 ? -3.314  -1.479  1.247  1.00 0.15 ?  28 GLY   A HA3  9  
ATOM   5224 N N    . TYR   A 1 29 ? -1.305  -2.991  3.092  1.00 0.17 ?  29 TYR   A N    9  
ATOM   5225 C CA   . TYR   A 1 29 ? 0.035   -3.029  3.658  1.00 0.22 ?  29 TYR   A CA   9  
ATOM   5226 C C    . TYR   A 1 29 ? 1.079   -3.249  2.567  1.00 0.20 ?  29 TYR   A C    9  
ATOM   5227 O O    . TYR   A 1 29 ? 0.810   -3.919  1.566  1.00 0.17 ?  29 TYR   A O    9  
ATOM   5228 C CB   . TYR   A 1 29 ? 0.139   -4.110  4.745  1.00 0.28 ?  29 TYR   A CB   9  
ATOM   5229 C CG   . TYR   A 1 29 ? -0.026  -5.529  4.250  1.00 0.33 ?  29 TYR   A CG   9  
ATOM   5230 C CD1  . TYR   A 1 29 ? 1.078   -6.320  3.960  1.00 0.46 ?  29 TYR   A CD1  9  
ATOM   5231 C CD2  . TYR   A 1 29 ? -1.290  -6.072  4.056  1.00 0.44 ?  29 TYR   A CD2  9  
ATOM   5232 C CE1  . TYR   A 1 29 ? 0.926   -7.612  3.495  1.00 0.58 ?  29 TYR   A CE1  9  
ATOM   5233 C CE2  . TYR   A 1 29 ? -1.450  -7.361  3.594  1.00 0.55 ?  29 TYR   A CE2  9  
ATOM   5234 C CZ   . TYR   A 1 29 ? -0.318  -8.149  3.369  1.00 0.60 ?  29 TYR   A CZ   9  
ATOM   5235 O OH   . TYR   A 1 29 ? -0.499  -9.414  2.854  1.00 0.73 ?  29 TYR   A OH   9  
ATOM   5236 H H    . TYR   A 1 29 ? -1.760  -3.835  2.878  1.00 0.17 ?  29 TYR   A H    9  
ATOM   5237 H HA   . TYR   A 1 29 ? 0.217   -2.067  4.111  1.00 0.26 ?  29 TYR   A HA   9  
ATOM   5238 H HB2  . TYR   A 1 29 ? 1.107   -4.039  5.211  1.00 0.35 ?  29 TYR   A HB2  9  
ATOM   5239 H HB3  . TYR   A 1 29 ? -0.620  -3.929  5.491  1.00 0.30 ?  29 TYR   A HB3  9  
ATOM   5240 H HD1  . TYR   A 1 29 ? 2.068   -5.915  4.106  1.00 0.55 ?  29 TYR   A HD1  9  
ATOM   5241 H HD2  . TYR   A 1 29 ? -2.159  -5.470  4.277  1.00 0.53 ?  29 TYR   A HD2  9  
ATOM   5242 H HE1  . TYR   A 1 29 ? 1.797   -8.212  3.275  1.00 0.72 ?  29 TYR   A HE1  9  
ATOM   5243 H HE2  . TYR   A 1 29 ? -2.441  -7.763  3.449  1.00 0.69 ?  29 TYR   A HE2  9  
ATOM   5244 H HH   . TYR   A 1 29 ? -1.184  -9.426  2.172  1.00 1.12 ?  29 TYR   A HH   9  
ATOM   5245 N N    . CYS   A 1 30 ? 2.264   -2.693  2.761  1.00 0.22 ?  30 CYS   A N    9  
ATOM   5246 C CA   . CYS   A 1 30 ? 3.369   -2.936  1.849  1.00 0.19 ?  30 CYS   A CA   9  
ATOM   5247 C C    . CYS   A 1 30 ? 3.943   -4.328  2.088  1.00 0.20 ?  30 CYS   A C    9  
ATOM   5248 O O    . CYS   A 1 30 ? 4.301   -4.682  3.215  1.00 0.32 ?  30 CYS   A O    9  
ATOM   5249 C CB   . CYS   A 1 30 ? 4.459   -1.876  2.015  1.00 0.27 ?  30 CYS   A CB   9  
ATOM   5250 S SG   . CYS   A 1 30 ? 4.012   -0.229  1.372  1.00 0.86 ?  30 CYS   A SG   9  
ATOM   5251 H H    . CYS   A 1 30 ? 2.402   -2.102  3.542  1.00 0.27 ?  30 CYS   A H    9  
ATOM   5252 H HA   . CYS   A 1 30 ? 2.981   -2.888  0.843  1.00 0.21 ?  30 CYS   A HA   9  
ATOM   5253 H HB2  . CYS   A 1 30 ? 4.683   -1.766  3.065  1.00 0.76 ?  30 CYS   A HB2  9  
ATOM   5254 H HB3  . CYS   A 1 30 ? 5.346   -2.202  1.495  1.00 0.88 ?  30 CYS   A HB3  9  
ATOM   5255 N N    . ALA   A 1 31 ? 4.020   -5.113  1.029  1.00 0.19 ?  31 ALA   A N    9  
ATOM   5256 C CA   . ALA   A 1 31 ? 4.464   -6.494  1.115  1.00 0.28 ?  31 ALA   A CA   9  
ATOM   5257 C C    . ALA   A 1 31 ? 5.651   -6.744  0.193  1.00 0.22 ?  31 ALA   A C    9  
ATOM   5258 O O    . ALA   A 1 31 ? 5.980   -5.899  -0.644 1.00 0.16 ?  31 ALA   A O    9  
ATOM   5259 C CB   . ALA   A 1 31 ? 3.321   -7.429  0.752  1.00 0.42 ?  31 ALA   A CB   9  
ATOM   5260 H H    . ALA   A 1 31 ? 3.768   -4.750  0.150  1.00 0.20 ?  31 ALA   A H    9  
ATOM   5261 H HA   . ALA   A 1 31 ? 4.754   -6.695  2.135  1.00 0.36 ?  31 ALA   A HA   9  
ATOM   5262 H HB1  . ALA   A 1 31 ? 3.611   -8.450  0.954  1.00 1.01 ?  31 ALA   A HB1  9  
ATOM   5263 H HB2  . ALA   A 1 31 ? 3.090   -7.322  -0.298 1.00 1.08 ?  31 ALA   A HB2  9  
ATOM   5264 H HB3  . ALA   A 1 31 ? 2.449   -7.177  1.336  1.00 1.16 ?  31 ALA   A HB3  9  
ATOM   5265 N N    . LYS   A 1 32 ? 6.283   -7.906  0.359  1.00 0.28 ?  32 LYS   A N    9  
ATOM   5266 C CA   . LYS   A 1 32 ? 7.386   -8.340  -0.495 1.00 0.26 ?  32 LYS   A CA   9  
ATOM   5267 C C    . LYS   A 1 32 ? 8.478   -7.279  -0.580 1.00 0.26 ?  32 LYS   A C    9  
ATOM   5268 O O    . LYS   A 1 32 ? 8.591   -6.566  -1.583 1.00 0.24 ?  32 LYS   A O    9  
ATOM   5269 C CB   . LYS   A 1 32 ? 6.869   -8.691  -1.892 1.00 0.25 ?  32 LYS   A CB   9  
ATOM   5270 C CG   . LYS   A 1 32 ? 5.871   -9.843  -1.903 1.00 1.09 ?  32 LYS   A CG   9  
ATOM   5271 C CD   . LYS   A 1 32 ? 5.374   -10.145 -3.305 1.00 1.62 ?  32 LYS   A CD   9  
ATOM   5272 C CE   . LYS   A 1 32 ? 6.499   -10.602 -4.226 1.00 2.37 ?  32 LYS   A CE   9  
ATOM   5273 N NZ   . LYS   A 1 32 ? 7.040   -11.929 -3.831 1.00 2.43 1  32 LYS   A NZ   9  
ATOM   5274 H H    . LYS   A 1 32 ? 6.001   -8.495  1.090  1.00 0.37 ?  32 LYS   A H    9  
ATOM   5275 H HA   . LYS   A 1 32 ? 7.809   -9.225  -0.048 1.00 0.32 ?  32 LYS   A HA   9  
ATOM   5276 H HB2  . LYS   A 1 32 ? 6.386   -7.820  -2.309 1.00 0.88 ?  32 LYS   A HB2  9  
ATOM   5277 H HB3  . LYS   A 1 32 ? 7.705   -8.960  -2.515 1.00 0.84 ?  32 LYS   A HB3  9  
ATOM   5278 H HG2  . LYS   A 1 32 ? 6.348   -10.724 -1.505 1.00 1.65 ?  32 LYS   A HG2  9  
ATOM   5279 H HG3  . LYS   A 1 32 ? 5.027   -9.579  -1.284 1.00 1.76 ?  32 LYS   A HG3  9  
ATOM   5280 H HD2  . LYS   A 1 32 ? 4.631   -10.926 -3.249 1.00 2.05 ?  32 LYS   A HD2  9  
ATOM   5281 H HD3  . LYS   A 1 32 ? 4.926   -9.253  -3.712 1.00 1.80 ?  32 LYS   A HD3  9  
ATOM   5282 H HE2  . LYS   A 1 32 ? 6.117   -10.667 -5.233 1.00 2.75 ?  32 LYS   A HE2  9  
ATOM   5283 H HE3  . LYS   A 1 32 ? 7.294   -9.873  -4.192 1.00 3.09 ?  32 LYS   A HE3  9  
ATOM   5284 H HZ1  . LYS   A 1 32 ? 7.350   -11.913 -2.838 1.00 2.11 ?  32 LYS   A HZ1  9  
ATOM   5285 H HZ2  . LYS   A 1 32 ? 7.853   -12.175 -4.429 1.00 3.00 ?  32 LYS   A HZ2  9  
ATOM   5286 H HZ3  . LYS   A 1 32 ? 6.311   -12.662 -3.944 1.00 2.96 ?  32 LYS   A HZ3  9  
HETATM 5287 N N    . DPR   A 1 33 ? 9.297   -7.162  0.479  1.00 0.37 ?  33 DPR   A N    9  
HETATM 5288 C CA   . DPR   A 1 33 ? 10.359  -6.152  0.559  1.00 0.44 ?  33 DPR   A CA   9  
HETATM 5289 C CB   . DPR   A 1 33 ? 10.958  -6.351  1.954  1.00 0.59 ?  33 DPR   A CB   9  
HETATM 5290 C CG   . DPR   A 1 33 ? 10.574  -7.730  2.353  1.00 0.61 ?  33 DPR   A CG   9  
HETATM 5291 C CD   . DPR   A 1 33 ? 9.260   -8.017  1.677  1.00 0.47 ?  33 DPR   A CD   9  
HETATM 5292 C C    . DPR   A 1 33 ? 9.807   -4.739  0.415  1.00 0.39 ?  33 DPR   A C    9  
HETATM 5293 O O    . DPR   A 1 33 ? 10.513  -3.826  -0.009 1.00 0.47 ?  33 DPR   A O    9  
HETATM 5294 H HA   . DPR   A 1 33 ? 11.122  -6.320  -0.182 1.00 0.48 ?  33 DPR   A HA   9  
HETATM 5295 H HB2  . DPR   A 1 33 ? 10.546  -5.621  2.632  1.00 0.61 ?  33 DPR   A HB2  9  
HETATM 5296 H HB3  . DPR   A 1 33 ? 12.032  -6.240  1.907  1.00 0.67 ?  33 DPR   A HB3  9  
HETATM 5297 H HG2  . DPR   A 1 33 ? 10.461  -7.779  3.425  1.00 0.70 ?  33 DPR   A HG2  9  
HETATM 5298 H HG3  . DPR   A 1 33 ? 11.326  -8.431  2.022  1.00 0.65 ?  33 DPR   A HG3  9  
HETATM 5299 H HD2  . DPR   A 1 33 ? 8.434   -7.747  2.318  1.00 0.49 ?  33 DPR   A HD2  9  
HETATM 5300 H HD3  . DPR   A 1 33 ? 9.198   -9.059  1.402  1.00 0.47 ?  33 DPR   A HD3  9  
ATOM   5301 N N    . GLY   A 1 34 ? 8.534   -4.577  0.759  1.00 0.32 ?  34 GLY   A N    9  
ATOM   5302 C CA   . GLY   A 1 34 ? 7.889   -3.286  0.670  1.00 0.30 ?  34 GLY   A CA   9  
ATOM   5303 C C    . GLY   A 1 34 ? 7.731   -2.804  -0.758 1.00 0.25 ?  34 GLY   A C    9  
ATOM   5304 O O    . GLY   A 1 34 ? 7.695   -1.600  -1.005 1.00 0.30 ?  34 GLY   A O    9  
ATOM   5305 H H    . GLY   A 1 34 ? 8.028   -5.350  1.085  1.00 0.32 ?  34 GLY   A H    9  
ATOM   5306 H HA2  . GLY   A 1 34 ? 6.911   -3.352  1.125  1.00 0.31 ?  34 GLY   A HA2  9  
ATOM   5307 H HA3  . GLY   A 1 34 ? 8.478   -2.567  1.217  1.00 0.36 ?  34 GLY   A HA3  9  
ATOM   5308 N N    . PHE   A 1 35 ? 7.637   -3.732  -1.702 1.00 0.19 ?  35 PHE   A N    9  
ATOM   5309 C CA   . PHE   A 1 35 ? 7.493   -3.369  -3.107 1.00 0.20 ?  35 PHE   A CA   9  
ATOM   5310 C C    . PHE   A 1 35 ? 6.054   -3.516  -3.584 1.00 0.17 ?  35 PHE   A C    9  
ATOM   5311 O O    . PHE   A 1 35 ? 5.595   -2.763  -4.443 1.00 0.29 ?  35 PHE   A O    9  
ATOM   5312 C CB   . PHE   A 1 35 ? 8.409   -4.222  -3.985 1.00 0.23 ?  35 PHE   A CB   9  
ATOM   5313 C CG   . PHE   A 1 35 ? 9.852   -3.806  -3.945 1.00 0.31 ?  35 PHE   A CG   9  
ATOM   5314 C CD1  . PHE   A 1 35 ? 10.767  -4.493  -3.165 1.00 0.40 ?  35 PHE   A CD1  9  
ATOM   5315 C CD2  . PHE   A 1 35 ? 10.292  -2.728  -4.697 1.00 0.37 ?  35 PHE   A CD2  9  
ATOM   5316 C CE1  . PHE   A 1 35 ? 12.095  -4.113  -3.134 1.00 0.49 ?  35 PHE   A CE1  9  
ATOM   5317 C CE2  . PHE   A 1 35 ? 11.619  -2.343  -4.669 1.00 0.46 ?  35 PHE   A CE2  9  
ATOM   5318 C CZ   . PHE   A 1 35 ? 12.522  -3.037  -3.887 1.00 0.51 ?  35 PHE   A CZ   9  
ATOM   5319 H H    . PHE   A 1 35 ? 7.677   -4.685  -1.450 1.00 0.19 ?  35 PHE   A H    9  
ATOM   5320 H HA   . PHE   A 1 35 ? 7.783   -2.335  -3.209 1.00 0.24 ?  35 PHE   A HA   9  
ATOM   5321 H HB2  . PHE   A 1 35 ? 8.351   -5.250  -3.657 1.00 0.24 ?  35 PHE   A HB2  9  
ATOM   5322 H HB3  . PHE   A 1 35 ? 8.071   -4.158  -5.009 1.00 0.27 ?  35 PHE   A HB3  9  
ATOM   5323 H HD1  . PHE   A 1 35 ? 10.434  -5.334  -2.576 1.00 0.45 ?  35 PHE   A HD1  9  
ATOM   5324 H HD2  . PHE   A 1 35 ? 9.585   -2.183  -5.306 1.00 0.40 ?  35 PHE   A HD2  9  
ATOM   5325 H HE1  . PHE   A 1 35 ? 12.799  -4.656  -2.521 1.00 0.59 ?  35 PHE   A HE1  9  
ATOM   5326 H HE2  . PHE   A 1 35 ? 11.948  -1.501  -5.257 1.00 0.54 ?  35 PHE   A HE2  9  
ATOM   5327 H HZ   . PHE   A 1 35 ? 13.560  -2.737  -3.865 1.00 0.60 ?  35 PHE   A HZ   9  
ATOM   5328 N N    . VAL   A 1 36 ? 5.339   -4.474  -3.025 1.00 0.12 ?  36 VAL   A N    9  
ATOM   5329 C CA   . VAL   A 1 36 ? 4.001   -4.775  -3.492 1.00 0.17 ?  36 VAL   A CA   9  
ATOM   5330 C C    . VAL   A 1 36 ? 2.949   -4.243  -2.533 1.00 0.15 ?  36 VAL   A C    9  
ATOM   5331 O O    . VAL   A 1 36 ? 2.932   -4.592  -1.359 1.00 0.17 ?  36 VAL   A O    9  
ATOM   5332 C CB   . VAL   A 1 36 ? 3.811   -6.293  -3.687 1.00 0.23 ?  36 VAL   A CB   9  
ATOM   5333 C CG1  . VAL   A 1 36 ? 2.387   -6.618  -4.112 1.00 0.32 ?  36 VAL   A CG1  9  
ATOM   5334 C CG2  . VAL   A 1 36 ? 4.804   -6.820  -4.709 1.00 0.25 ?  36 VAL   A CG2  9  
ATOM   5335 H H    . VAL   A 1 36 ? 5.711   -4.984  -2.273 1.00 0.17 ?  36 VAL   A H    9  
ATOM   5336 H HA   . VAL   A 1 36 ? 3.871   -4.295  -4.449 1.00 0.20 ?  36 VAL   A HA   9  
ATOM   5337 H HB   . VAL   A 1 36 ? 4.005   -6.780  -2.744 1.00 0.24 ?  36 VAL   A HB   9  
ATOM   5338 H HG11 . VAL   A 1 36 ? 2.291   -7.684  -4.253 1.00 1.12 ?  36 VAL   A HG11 9  
ATOM   5339 H HG12 . VAL   A 1 36 ? 2.162   -6.111  -5.039 1.00 1.04 ?  36 VAL   A HG12 9  
ATOM   5340 H HG13 . VAL   A 1 36 ? 1.698   -6.291  -3.346 1.00 1.00 ?  36 VAL   A HG13 9  
ATOM   5341 H HG21 . VAL   A 1 36 ? 5.807   -6.738  -4.317 1.00 1.04 ?  36 VAL   A HG21 9  
ATOM   5342 H HG22 . VAL   A 1 36 ? 4.724   -6.241  -5.615 1.00 0.94 ?  36 VAL   A HG22 9  
ATOM   5343 H HG23 . VAL   A 1 36 ? 4.583   -7.853  -4.925 1.00 1.08 ?  36 VAL   A HG23 9  
ATOM   5344 N N    . CYS   A 1 37 ? 2.083   -3.393  -3.044 1.00 0.15 ?  37 CYS   A N    9  
ATOM   5345 C CA   . CYS   A 1 37 ? 0.985   -2.854  -2.260 1.00 0.14 ?  37 CYS   A CA   9  
ATOM   5346 C C    . CYS   A 1 37 ? -0.139  -3.883  -2.195 1.00 0.12 ?  37 CYS   A C    9  
ATOM   5347 O O    . CYS   A 1 37 ? -0.789  -4.173  -3.205 1.00 0.18 ?  37 CYS   A O    9  
ATOM   5348 C CB   . CYS   A 1 37 ? 0.498   -1.543  -2.893 1.00 0.16 ?  37 CYS   A CB   9  
ATOM   5349 S SG   . CYS   A 1 37 ? -0.910  -0.750  -2.047 1.00 0.14 ?  37 CYS   A SG   9  
ATOM   5350 H H    . CYS   A 1 37 ? 2.174   -3.126  -3.983 1.00 0.16 ?  37 CYS   A H    9  
ATOM   5351 H HA   . CYS   A 1 37 ? 1.348   -2.659  -1.261 1.00 0.14 ?  37 CYS   A HA   9  
ATOM   5352 H HB2  . CYS   A 1 37 ? 1.312   -0.832  -2.897 1.00 0.20 ?  37 CYS   A HB2  9  
ATOM   5353 H HB3  . CYS   A 1 37 ? 0.199   -1.739  -3.912 1.00 0.18 ?  37 CYS   A HB3  9  
ATOM   5354 N N    . LYS   A 1 38 ? -0.343  -4.463  -1.019 1.00 0.10 ?  38 LYS   A N    9  
ATOM   5355 C CA   . LYS   A 1 38 ? -1.345  -5.504  -0.855 1.00 0.11 ?  38 LYS   A CA   9  
ATOM   5356 C C    . LYS   A 1 38 ? -2.558  -4.970  -0.111 1.00 0.11 ?  38 LYS   A C    9  
ATOM   5357 O O    . LYS   A 1 38 ? -2.489  -4.668  1.082  1.00 0.12 ?  38 LYS   A O    9  
ATOM   5358 C CB   . LYS   A 1 38 ? -0.763  -6.709  -0.112 1.00 0.15 ?  38 LYS   A CB   9  
ATOM   5359 C CG   . LYS   A 1 38 ? -1.770  -7.831  0.092  1.00 0.26 ?  38 LYS   A CG   9  
ATOM   5360 C CD   . LYS   A 1 38 ? -2.290  -8.399  -1.222 1.00 0.70 ?  38 LYS   A CD   9  
ATOM   5361 C CE   . LYS   A 1 38 ? -1.225  -9.184  -1.974 1.00 1.19 ?  38 LYS   A CE   9  
ATOM   5362 N NZ   . LYS   A 1 38 ? -1.751  -9.742  -3.247 1.00 2.16 1  38 LYS   A NZ   9  
ATOM   5363 H H    . LYS   A 1 38 ? 0.180   -4.170  -0.236 1.00 0.13 ?  38 LYS   A H    9  
ATOM   5364 H HA   . LYS   A 1 38 ? -1.656  -5.817  -1.839 1.00 0.12 ?  38 LYS   A HA   9  
ATOM   5365 H HB2  . LYS   A 1 38 ? 0.078   -7.097  -0.667 1.00 0.14 ?  38 LYS   A HB2  9  
ATOM   5366 H HB3  . LYS   A 1 38 ? -0.422  -6.384  0.860  1.00 0.19 ?  38 LYS   A HB3  9  
ATOM   5367 H HG2  . LYS   A 1 38 ? -1.305  -8.624  0.654  1.00 0.63 ?  38 LYS   A HG2  9  
ATOM   5368 H HG3  . LYS   A 1 38 ? -2.600  -7.439  0.652  1.00 0.69 ?  38 LYS   A HG3  9  
ATOM   5369 H HD2  . LYS   A 1 38 ? -3.120  -9.058  -1.011 1.00 1.20 ?  38 LYS   A HD2  9  
ATOM   5370 H HD3  . LYS   A 1 38 ? -2.630  -7.585  -1.844 1.00 1.36 ?  38 LYS   A HD3  9  
ATOM   5371 H HE2  . LYS   A 1 38 ? -0.398  -8.527  -2.197 1.00 1.63 ?  38 LYS   A HE2  9  
ATOM   5372 H HE3  . LYS   A 1 38 ? -0.882  -9.995  -1.349 1.00 1.57 ?  38 LYS   A HE3  9  
ATOM   5373 H HZ1  . LYS   A 1 38 ? -2.590  -10.329 -3.061 1.00 2.60 ?  38 LYS   A HZ1  9  
ATOM   5374 H HZ2  . LYS   A 1 38 ? -1.028  -10.332 -3.705 1.00 2.57 ?  38 LYS   A HZ2  9  
ATOM   5375 H HZ3  . LYS   A 1 38 ? -2.013  -8.973  -3.895 1.00 2.71 ?  38 LYS   A HZ3  9  
ATOM   5376 N N    . CYS   A 1 39 ? -3.666  -4.876  -0.822 1.00 0.12 ?  39 CYS   A N    9  
ATOM   5377 C CA   . CYS   A 1 39 ? -4.895  -4.366  -0.252 1.00 0.12 ?  39 CYS   A CA   9  
ATOM   5378 C C    . CYS   A 1 39 ? -5.657  -5.474  0.453  1.00 0.15 ?  39 CYS   A C    9  
ATOM   5379 O O    . CYS   A 1 39 ? -5.587  -6.640  0.059  1.00 0.19 ?  39 CYS   A O    9  
ATOM   5380 C CB   . CYS   A 1 39 ? -5.767  -3.757  -1.348 1.00 0.13 ?  39 CYS   A CB   9  
ATOM   5381 S SG   . CYS   A 1 39 ? -4.906  -2.534  -2.385 1.00 0.14 ?  39 CYS   A SG   9  
ATOM   5382 H H    . CYS   A 1 39 ? -3.660  -5.163  -1.758 1.00 0.16 ?  39 CYS   A H    9  
ATOM   5383 H HA   . CYS   A 1 39 ? -4.643  -3.601  0.464  1.00 0.11 ?  39 CYS   A HA   9  
ATOM   5384 H HB2  . CYS   A 1 39 ? -6.121  -4.546  -1.992 1.00 0.15 ?  39 CYS   A HB2  9  
ATOM   5385 H HB3  . CYS   A 1 39 ? -6.613  -3.263  -0.889 1.00 0.15 ?  39 CYS   A HB3  9  
ATOM   5386 N N    . TYR   A 1 40 ? -6.378  -5.108  1.496  1.00 0.18 ?  40 TYR   A N    9  
ATOM   5387 C CA   . TYR   A 1 40 ? -7.189  -6.055  2.239  1.00 0.25 ?  40 TYR   A CA   9  
ATOM   5388 C C    . TYR   A 1 40 ? -8.509  -5.411  2.638  1.00 0.32 ?  40 TYR   A C    9  
ATOM   5389 O O    . TYR   A 1 40 ? -8.556  -4.231  2.989  1.00 0.88 ?  40 TYR   A O    9  
ATOM   5390 C CB   . TYR   A 1 40 ? -6.436  -6.572  3.472  1.00 0.27 ?  40 TYR   A CB   9  
ATOM   5391 C CG   . TYR   A 1 40 ? -6.039  -5.497  4.457  1.00 0.25 ?  40 TYR   A CG   9  
ATOM   5392 C CD1  . TYR   A 1 40 ? -4.817  -4.848  4.349  1.00 0.22 ?  40 TYR   A CD1  9  
ATOM   5393 C CD2  . TYR   A 1 40 ? -6.883  -5.141  5.502  1.00 0.32 ?  40 TYR   A CD2  9  
ATOM   5394 C CE1  . TYR   A 1 40 ? -4.448  -3.873  5.252  1.00 0.25 ?  40 TYR   A CE1  9  
ATOM   5395 C CE2  . TYR   A 1 40 ? -6.521  -4.164  6.408  1.00 0.35 ?  40 TYR   A CE2  9  
ATOM   5396 C CZ   . TYR   A 1 40 ? -5.304  -3.534  6.278  1.00 0.31 ?  40 TYR   A CZ   9  
ATOM   5397 O OH   . TYR   A 1 40 ? -4.940  -2.558  7.178  1.00 0.37 ?  40 TYR   A OH   9  
ATOM   5398 H H    . TYR   A 1 40 ? -6.364  -4.165  1.779  1.00 0.18 ?  40 TYR   A H    9  
ATOM   5399 H HA   . TYR   A 1 40 ? -7.396  -6.888  1.584  1.00 0.31 ?  40 TYR   A HA   9  
ATOM   5400 H HB2  . TYR   A 1 40 ? -7.063  -7.280  3.996  1.00 0.32 ?  40 TYR   A HB2  9  
ATOM   5401 H HB3  . TYR   A 1 40 ? -5.536  -7.073  3.148  1.00 0.28 ?  40 TYR   A HB3  9  
ATOM   5402 H HD1  . TYR   A 1 40 ? -4.152  -5.111  3.539  1.00 0.22 ?  40 TYR   A HD1  9  
ATOM   5403 H HD2  . TYR   A 1 40 ? -7.839  -5.637  5.597  1.00 0.36 ?  40 TYR   A HD2  9  
ATOM   5404 H HE1  . TYR   A 1 40 ? -3.493  -3.378  5.150  1.00 0.26 ?  40 TYR   A HE1  9  
ATOM   5405 H HE2  . TYR   A 1 40 ? -7.193  -3.899  7.210  1.00 0.41 ?  40 TYR   A HE2  9  
ATOM   5406 H HH   . TYR   A 1 40 ? -5.116  -2.871  8.074  1.00 1.13 ?  40 TYR   A HH   9  
HETATM 5407 N N    . NH2   A 1 41 ? -9.582  -6.171  2.558  1.00 0.59 ?  41 NH2   A N    9  
HETATM 5408 H HN1  . NH2   A 1 41 ? -9.469  -7.104  2.269  1.00 1.06 ?  41 NH2   A HN1  9  
HETATM 5409 H HN2  . NH2   A 1 41 ? -10.450 -5.781  2.800  1.00 0.56 ?  41 NH2   A HN2  9  
ATOM   5410 N N    . GLY   A 1 1  ? 4.803   -0.616  -5.874 1.00 1.74 ?  1  GLY   A N    10 
ATOM   5411 C CA   . GLY   A 1 1  ? 4.082   0.582   -6.361 1.00 0.89 ?  1  GLY   A CA   10 
ATOM   5412 C C    . GLY   A 1 1  ? 3.117   1.129   -5.334 1.00 0.90 ?  1  GLY   A C    10 
ATOM   5413 O O    . GLY   A 1 1  ? 2.995   0.578   -4.238 1.00 1.76 ?  1  GLY   A O    10 
ATOM   5414 H H1   . GLY   A 1 1  ? 4.127   -1.370  -5.643 1.00 2.34 ?  1  GLY   A H1   10 
ATOM   5415 H H2   . GLY   A 1 1  ? 5.348   -0.383  -5.017 1.00 1.93 ?  1  GLY   A H2   10 
ATOM   5416 H H3   . GLY   A 1 1  ? 5.457   -0.960  -6.603 1.00 2.29 ?  1  GLY   A H3   10 
ATOM   5417 H HA2  . GLY   A 1 1  ? 4.801   1.347   -6.607 1.00 0.93 ?  1  GLY   A HA2  10 
ATOM   5418 H HA3  . GLY   A 1 1  ? 3.532   0.319   -7.253 1.00 1.19 ?  1  GLY   A HA3  10 
ATOM   5419 N N    . PHE   A 1 2  ? 2.448   2.227   -5.691 1.00 0.43 ?  2  PHE   A N    10 
ATOM   5420 C CA   . PHE   A 1 2  ? 1.437   2.862   -4.849 1.00 0.24 ?  2  PHE   A CA   10 
ATOM   5421 C C    . PHE   A 1 2  ? 1.979   3.180   -3.459 1.00 0.22 ?  2  PHE   A C    10 
ATOM   5422 O O    . PHE   A 1 2  ? 1.285   3.020   -2.457 1.00 0.35 ?  2  PHE   A O    10 
ATOM   5423 C CB   . PHE   A 1 2  ? 0.196   1.974   -4.760 1.00 0.16 ?  2  PHE   A CB   10 
ATOM   5424 C CG   . PHE   A 1 2  ? -0.397  1.666   -6.104 1.00 0.18 ?  2  PHE   A CG   10 
ATOM   5425 C CD1  . PHE   A 1 2  ? -0.261  0.405   -6.656 1.00 0.25 ?  2  PHE   A CD1  10 
ATOM   5426 C CD2  . PHE   A 1 2  ? -1.098  2.631   -6.809 1.00 0.22 ?  2  PHE   A CD2  10 
ATOM   5427 C CE1  . PHE   A 1 2  ? -0.812  0.111   -7.888 1.00 0.30 ?  2  PHE   A CE1  10 
ATOM   5428 C CE2  . PHE   A 1 2  ? -1.650  2.343   -8.043 1.00 0.28 ?  2  PHE   A CE2  10 
ATOM   5429 C CZ   . PHE   A 1 2  ? -1.480  1.110   -8.601 1.00 0.29 ?  2  PHE   A CZ   10 
ATOM   5430 H H    . PHE   A 1 2  ? 2.641   2.627   -6.566 1.00 1.00 ?  2  PHE   A H    10 
ATOM   5431 H HA   . PHE   A 1 2  ? 1.160   3.791   -5.326 1.00 0.34 ?  2  PHE   A HA   10 
ATOM   5432 H HB2  . PHE   A 1 2  ? 0.461   1.041   -4.288 1.00 0.26 ?  2  PHE   A HB2  10 
ATOM   5433 H HB3  . PHE   A 1 2  ? -0.558  2.472   -4.167 1.00 0.20 ?  2  PHE   A HB3  10 
ATOM   5434 H HD1  . PHE   A 1 2  ? 0.283   -0.353  -6.114 1.00 0.32 ?  2  PHE   A HD1  10 
ATOM   5435 H HD2  . PHE   A 1 2  ? -1.211  3.617   -6.386 1.00 0.27 ?  2  PHE   A HD2  10 
ATOM   5436 H HE1  . PHE   A 1 2  ? -0.699  -0.877  -8.306 1.00 0.37 ?  2  PHE   A HE1  10 
ATOM   5437 H HE2  . PHE   A 1 2  ? -2.193  3.104   -8.583 1.00 0.36 ?  2  PHE   A HE2  10 
ATOM   5438 H HZ   . PHE   A 1 2  ? -1.902  0.894   -9.571 1.00 0.34 ?  2  PHE   A HZ   10 
ATOM   5439 N N    . GLY   A 1 3  ? 3.221   3.636   -3.408 1.00 0.18 ?  3  GLY   A N    10 
ATOM   5440 C CA   . GLY   A 1 3  ? 3.827   3.988   -2.143 1.00 0.20 ?  3  GLY   A CA   10 
ATOM   5441 C C    . GLY   A 1 3  ? 4.853   2.974   -1.689 1.00 0.19 ?  3  GLY   A C    10 
ATOM   5442 O O    . GLY   A 1 3  ? 5.804   3.311   -0.988 1.00 0.21 ?  3  GLY   A O    10 
ATOM   5443 H H    . GLY   A 1 3  ? 3.730   3.737   -4.241 1.00 0.21 ?  3  GLY   A H    10 
ATOM   5444 H HA2  . GLY   A 1 3  ? 4.307   4.948   -2.241 1.00 0.23 ?  3  GLY   A HA2  10 
ATOM   5445 H HA3  . GLY   A 1 3  ? 3.053   4.058   -1.394 1.00 0.24 ?  3  GLY   A HA3  10 
ATOM   5446 N N    . CYS   A 1 4  ? 4.665   1.730   -2.085 1.00 0.25 ?  4  CYS   A N    10 
ATOM   5447 C CA   . CYS   A 1 4  ? 5.581   0.668   -1.708 1.00 0.27 ?  4  CYS   A CA   10 
ATOM   5448 C C    . CYS   A 1 4  ? 6.684   0.530   -2.752 1.00 0.29 ?  4  CYS   A C    10 
ATOM   5449 O O    . CYS   A 1 4  ? 6.464   -0.026  -3.825 1.00 0.30 ?  4  CYS   A O    10 
ATOM   5450 C CB   . CYS   A 1 4  ? 4.816   -0.646  -1.570 1.00 0.28 ?  4  CYS   A CB   10 
ATOM   5451 S SG   . CYS   A 1 4  ? 3.305   -0.521  -0.559 1.00 0.39 ?  4  CYS   A SG   10 
ATOM   5452 H H    . CYS   A 1 4  ? 3.885   1.516   -2.642 1.00 0.30 ?  4  CYS   A H    10 
ATOM   5453 H HA   . CYS   A 1 4  ? 6.022   0.925   -0.758 1.00 0.30 ?  4  CYS   A HA   10 
ATOM   5454 H HB2  . CYS   A 1 4  ? 4.526   -0.988  -2.552 1.00 0.21 ?  4  CYS   A HB2  10 
ATOM   5455 H HB3  . CYS   A 1 4  ? 5.459   -1.384  -1.114 1.00 0.42 ?  4  CYS   A HB3  10 
ATOM   5456 N N    . ASN   A 1 5  ? 7.863   1.064   -2.452 1.00 0.34 ?  5  ASN   A N    10 
ATOM   5457 C CA   . ASN   A 1 5  ? 8.978   1.008   -3.393 1.00 0.40 ?  5  ASN   A CA   10 
ATOM   5458 C C    . ASN   A 1 5  ? 10.237  0.443   -2.743 1.00 0.40 ?  5  ASN   A C    10 
ATOM   5459 O O    . ASN   A 1 5  ? 11.353  0.808   -3.113 1.00 0.47 ?  5  ASN   A O    10 
ATOM   5460 C CB   . ASN   A 1 5  ? 9.275   2.398   -3.961 1.00 0.49 ?  5  ASN   A CB   10 
ATOM   5461 C CG   . ASN   A 1 5  ? 8.137   2.959   -4.789 1.00 0.49 ?  5  ASN   A CG   10 
ATOM   5462 O OD1  . ASN   A 1 5  ? 8.055   2.726   -5.995 1.00 0.65 ?  5  ASN   A OD1  10 
ATOM   5463 N ND2  . ASN   A 1 5  ? 7.256   3.715   -4.152 1.00 0.56 ?  5  ASN   A ND2  10 
ATOM   5464 H H    . ASN   A 1 5  ? 7.983   1.525   -1.592 1.00 0.36 ?  5  ASN   A H    10 
ATOM   5465 H HA   . ASN   A 1 5  ? 8.689   0.357   -4.203 1.00 0.43 ?  5  ASN   A HA   10 
ATOM   5466 H HB2  . ASN   A 1 5  ? 9.460   3.074   -3.144 1.00 0.51 ?  5  ASN   A HB2  10 
ATOM   5467 H HB3  . ASN   A 1 5  ? 10.157  2.344   -4.582 1.00 0.57 ?  5  ASN   A HB3  10 
ATOM   5468 H HD21 . ASN   A 1 5  ? 7.383   3.868   -3.192 1.00 0.70 ?  5  ASN   A HD21 10 
ATOM   5469 H HD22 . ASN   A 1 5  ? 6.512   4.095   -4.666 1.00 0.61 ?  5  ASN   A HD22 10 
ATOM   5470 N N    . GLY   A 1 6  ? 10.063  -0.438  -1.771 1.00 0.36 ?  6  GLY   A N    10 
ATOM   5471 C CA   . GLY   A 1 6  ? 11.203  -1.114  -1.179 1.00 0.38 ?  6  GLY   A CA   10 
ATOM   5472 C C    . GLY   A 1 6  ? 11.771  -0.399  0.030  1.00 0.37 ?  6  GLY   A C    10 
ATOM   5473 O O    . GLY   A 1 6  ? 11.116  0.468   0.611  1.00 0.36 ?  6  GLY   A O    10 
ATOM   5474 H H    . GLY   A 1 6  ? 9.155   -0.638  -1.453 1.00 0.34 ?  6  GLY   A H    10 
ATOM   5475 H HA2  . GLY   A 1 6  ? 10.900  -2.107  -0.881 1.00 0.48 ?  6  GLY   A HA2  10 
ATOM   5476 H HA3  . GLY   A 1 6  ? 11.977  -1.199  -1.929 1.00 0.44 ?  6  GLY   A HA3  10 
HETATM 5477 C C2   . 6ZS   A 1 7  ? 15.194  -2.254  1.526  1.00 1.49 ?  7  6ZS   A C2   10 
HETATM 5478 N N    . 6ZS   A 1 7  ? 13.007  -0.759  0.386  1.00 0.47 ?  7  6ZS   A N    10 
HETATM 5479 C CA   . 6ZS   A 1 7  ? 13.666  -0.272  1.608  1.00 0.61 ?  7  6ZS   A CA   10 
HETATM 5480 C CB1  . 6ZS   A 1 7  ? 12.961  -0.839  2.832  1.00 0.71 ?  7  6ZS   A CB1  10 
HETATM 5481 C C    . 6ZS   A 1 7  ? 13.667  1.261   1.646  1.00 0.59 ?  7  6ZS   A C    10 
HETATM 5482 O O    . 6ZS   A 1 7  ? 14.162  1.908   0.722  1.00 1.09 ?  7  6ZS   A O    10 
HETATM 5483 C CB   . 6ZS   A 1 7  ? 15.111  -0.747  1.643  1.00 0.75 ?  7  6ZS   A CB   10 
HETATM 5484 H H1   . 6ZS   A 1 7  ? 14.801  -2.709  2.424  1.00 2.14 ?  7  6ZS   A H1   10 
HETATM 5485 H H4   . 6ZS   A 1 7  ? 14.616  -2.583  0.676  1.00 1.94 ?  7  6ZS   A H4   10 
HETATM 5486 H H3   . 6ZS   A 1 7  ? 16.224  -2.549  1.397  1.00 2.00 ?  7  6ZS   A H3   10 
HETATM 5487 H H    . 6ZS   A 1 7  ? 13.499  -1.373  -0.196 1.00 0.49 ?  7  6ZS   A H    10 
HETATM 5488 H H7   . 6ZS   A 1 7  ? 11.965  -0.426  2.898  1.00 1.10 ?  7  6ZS   A H7   10 
HETATM 5489 H H8   . 6ZS   A 1 7  ? 13.518  -0.583  3.720  1.00 1.35 ?  7  6ZS   A H8   10 
HETATM 5490 H H9   . 6ZS   A 1 7  ? 12.896  -1.912  2.745  1.00 1.26 ?  7  6ZS   A H9   10 
HETATM 5491 H H10  . 6ZS   A 1 7  ? 15.658  -0.310  0.818  1.00 1.09 ?  7  6ZS   A H10  10 
HETATM 5492 H H11  . 6ZS   A 1 7  ? 15.566  -0.453  2.580  1.00 1.38 ?  7  6ZS   A H11  10 
ATOM   5493 N N    . TRP   A 1 8  ? 13.090  1.820   2.714  1.00 0.64 ?  8  TRP   A N    10 
ATOM   5494 C CA   . TRP   A 1 8  ? 13.094  3.269   2.970  1.00 0.67 ?  8  TRP   A CA   10 
ATOM   5495 C C    . TRP   A 1 8  ? 12.320  4.042   1.904  1.00 0.49 ?  8  TRP   A C    10 
ATOM   5496 O O    . TRP   A 1 8  ? 12.261  5.269   1.927  1.00 0.58 ?  8  TRP   A O    10 
ATOM   5497 C CB   . TRP   A 1 8  ? 14.527  3.793   3.076  1.00 0.87 ?  8  TRP   A CB   10 
ATOM   5498 C CG   . TRP   A 1 8  ? 15.306  3.146   4.179  1.00 1.12 ?  8  TRP   A CG   10 
ATOM   5499 C CD1  . TRP   A 1 8  ? 16.198  2.126   4.054  1.00 1.27 ?  8  TRP   A CD1  10 
ATOM   5500 C CD2  . TRP   A 1 8  ? 15.250  3.463   5.574  1.00 1.31 ?  8  TRP   A CD2  10 
ATOM   5501 N NE1  . TRP   A 1 8  ? 16.710  1.792   5.281  1.00 1.50 ?  8  TRP   A NE1  10 
ATOM   5502 C CE2  . TRP   A 1 8  ? 16.144  2.597   6.234  1.00 1.52 ?  8  TRP   A CE2  10 
ATOM   5503 C CE3  . TRP   A 1 8  ? 14.535  4.394   6.329  1.00 1.37 ?  8  TRP   A CE3  10 
ATOM   5504 C CZ2  . TRP   A 1 8  ? 16.339  2.639   7.612  1.00 1.76 ?  8  TRP   A CZ2  10 
ATOM   5505 C CZ3  . TRP   A 1 8  ? 14.728  4.434   7.695  1.00 1.63 ?  8  TRP   A CZ3  10 
ATOM   5506 C CH2  . TRP   A 1 8  ? 15.624  3.561   8.325  1.00 1.80 ?  8  TRP   A CH2  10 
ATOM   5507 H H    . TRP   A 1 8  ? 12.642  1.232   3.359  1.00 1.04 ?  8  TRP   A H    10 
ATOM   5508 H HA   . TRP   A 1 8  ? 12.605  3.431   3.921  1.00 0.76 ?  8  TRP   A HA   10 
ATOM   5509 H HB2  . TRP   A 1 8  ? 15.040  3.600   2.149  1.00 0.85 ?  8  TRP   A HB2  10 
ATOM   5510 H HB3  . TRP   A 1 8  ? 14.506  4.856   3.257  1.00 0.91 ?  8  TRP   A HB3  10 
ATOM   5511 H HD1  . TRP   A 1 8  ? 16.455  1.660   3.116  1.00 1.25 ?  8  TRP   A HD1  10 
ATOM   5512 H HE1  . TRP   A 1 8  ? 17.375  1.087   5.449  1.00 1.65 ?  8  TRP   A HE1  10 
ATOM   5513 H HE3  . TRP   A 1 8  ? 13.840  5.075   5.861  1.00 1.26 ?  8  TRP   A HE3  10 
ATOM   5514 H HZ2  . TRP   A 1 8  ? 17.025  1.975   8.115  1.00 1.93 ?  8  TRP   A HZ2  10 
ATOM   5515 H HZ3  . TRP   A 1 8  ? 14.182  5.148   8.294  1.00 1.73 ?  8  TRP   A HZ3  10 
ATOM   5516 H HH2  . TRP   A 1 8  ? 15.744  3.626   9.395  1.00 2.00 ?  8  TRP   A HH2  10 
ATOM   5517 N N    . ASN   A 1 9  ? 11.735  3.312   0.971  1.00 0.33 ?  9  ASN   A N    10 
ATOM   5518 C CA   . ASN   A 1 9  ? 10.861  3.891   -0.033 1.00 0.29 ?  9  ASN   A CA   10 
ATOM   5519 C C    . ASN   A 1 9  ? 9.498   3.241   0.102  1.00 0.25 ?  9  ASN   A C    10 
ATOM   5520 O O    . ASN   A 1 9  ? 8.701   3.194   -0.834 1.00 0.36 ?  9  ASN   A O    10 
ATOM   5521 C CB   . ASN   A 1 9  ? 11.427  3.673   -1.439 1.00 0.46 ?  9  ASN   A CB   10 
ATOM   5522 C CG   . ASN   A 1 9  ? 12.745  4.386   -1.661 1.00 1.31 ?  9  ASN   A CG   10 
ATOM   5523 O OD1  . ASN   A 1 9  ? 12.993  5.452   -1.098 1.00 2.05 ?  9  ASN   A OD1  10 
ATOM   5524 N ND2  . ASN   A 1 9  ? 13.600  3.803   -2.484 1.00 1.88 ?  9  ASN   A ND2  10 
ATOM   5525 H H    . ASN   A 1 9  ? 11.904  2.343   0.951  1.00 0.35 ?  9  ASN   A H    10 
ATOM   5526 H HA   . ASN   A 1 9  ? 10.773  4.948   0.166  1.00 0.37 ?  9  ASN   A HA   10 
ATOM   5527 H HB2  . ASN   A 1 9  ? 11.582  2.616   -1.596 1.00 1.10 ?  9  ASN   A HB2  10 
ATOM   5528 H HB3  . ASN   A 1 9  ? 10.719  4.038   -2.165 1.00 0.63 ?  9  ASN   A HB3  10 
ATOM   5529 H HD21 . ASN   A 1 9  ? 13.340  2.952   -2.899 1.00 2.03 ?  9  ASN   A HD21 10 
ATOM   5530 H HD22 . ASN   A 1 9  ? 14.456  4.248   -2.652 1.00 2.48 ?  9  ASN   A HD22 10 
ATOM   5531 N N    . GLU   A 1 10 ? 9.263   2.742   1.300  1.00 0.23 ?  10 GLU   A N    10 
ATOM   5532 C CA   . GLU   A 1 10 ? 8.066   2.003   1.635  1.00 0.26 ?  10 GLU   A CA   10 
ATOM   5533 C C    . GLU   A 1 10 ? 7.119   2.882   2.437  1.00 0.28 ?  10 GLU   A C    10 
ATOM   5534 O O    . GLU   A 1 10 ? 7.397   3.219   3.591  1.00 0.49 ?  10 GLU   A O    10 
ATOM   5535 C CB   . GLU   A 1 10 ? 8.462   0.771   2.447  1.00 0.39 ?  10 GLU   A CB   10 
ATOM   5536 C CG   . GLU   A 1 10 ? 7.298   0.022   3.053  1.00 0.45 ?  10 GLU   A CG   10 
ATOM   5537 C CD   . GLU   A 1 10 ? 7.744   -0.962  4.112  1.00 0.68 ?  10 GLU   A CD   10 
ATOM   5538 O OE1  . GLU   A 1 10 ? 8.513   -0.559  5.018  1.00 0.95 ?  10 GLU   A OE1  10 
ATOM   5539 O OE2  . GLU   A 1 10 ? 7.322   -2.134  4.061  1.00 0.78 -1 10 GLU   A OE2  10 
ATOM   5540 H H    . GLU   A 1 10 ? 9.926   2.889   2.001  1.00 0.28 ?  10 GLU   A H    10 
ATOM   5541 H HA   . GLU   A 1 10 ? 7.584   1.694   0.720  1.00 0.27 ?  10 GLU   A HA   10 
ATOM   5542 H HB2  . GLU   A 1 10 ? 9.002   0.090   1.806  1.00 0.43 ?  10 GLU   A HB2  10 
ATOM   5543 H HB3  . GLU   A 1 10 ? 9.112   1.082   3.248  1.00 0.48 ?  10 GLU   A HB3  10 
ATOM   5544 H HG2  . GLU   A 1 10 ? 6.622   0.731   3.499  1.00 0.47 ?  10 GLU   A HG2  10 
ATOM   5545 H HG3  . GLU   A 1 10 ? 6.788   -0.517  2.272  1.00 0.40 ?  10 GLU   A HG3  10 
ATOM   5546 N N    . ASP   A 1 11 ? 6.026   3.281   1.819  1.00 0.23 ?  11 ASP   A N    10 
ATOM   5547 C CA   . ASP   A 1 11 ? 5.033   4.104   2.489  1.00 0.30 ?  11 ASP   A CA   10 
ATOM   5548 C C    . ASP   A 1 11 ? 3.708   3.368   2.589  1.00 0.23 ?  11 ASP   A C    10 
ATOM   5549 O O    . ASP   A 1 11 ? 2.840   3.503   1.720  1.00 0.20 ?  11 ASP   A O    10 
ATOM   5550 C CB   . ASP   A 1 11 ? 4.846   5.440   1.762  1.00 0.38 ?  11 ASP   A CB   10 
ATOM   5551 C CG   . ASP   A 1 11 ? 6.049   6.353   1.901  1.00 0.99 ?  11 ASP   A CG   10 
ATOM   5552 O OD1  . ASP   A 1 11 ? 6.919   6.337   1.006  1.00 1.86 ?  11 ASP   A OD1  10 
ATOM   5553 O OD2  . ASP   A 1 11 ? 6.132   7.092   2.903  1.00 1.32 -1 11 ASP   A OD2  10 
ATOM   5554 H H    . ASP   A 1 11 ? 5.881   3.023   0.881  1.00 0.30 ?  11 ASP   A H    10 
ATOM   5555 H HA   . ASP   A 1 11 ? 5.392   4.299   3.488  1.00 0.38 ?  11 ASP   A HA   10 
ATOM   5556 H HB2  . ASP   A 1 11 ? 4.684   5.250   0.712  1.00 0.94 ?  11 ASP   A HB2  10 
ATOM   5557 H HB3  . ASP   A 1 11 ? 3.983   5.947   2.169  1.00 0.78 ?  11 ASP   A HB3  10 
ATOM   5558 N N    . ASP   A 1 12 ? 3.561   2.586   3.656  1.00 0.25 ?  12 ASP   A N    10 
ATOM   5559 C CA   . ASP   A 1 12 ? 2.323   1.851   3.916  1.00 0.26 ?  12 ASP   A CA   10 
ATOM   5560 C C    . ASP   A 1 12 ? 1.132   2.795   3.932  1.00 0.18 ?  12 ASP   A C    10 
ATOM   5561 O O    . ASP   A 1 12 ? 0.038   2.429   3.510  1.00 0.18 ?  12 ASP   A O    10 
ATOM   5562 C CB   . ASP   A 1 12 ? 2.393   1.105   5.251  1.00 0.39 ?  12 ASP   A CB   10 
ATOM   5563 C CG   . ASP   A 1 12 ? 3.333   -0.086  5.228  1.00 0.82 ?  12 ASP   A CG   10 
ATOM   5564 O OD1  . ASP   A 1 12 ? 4.540   0.098   5.482  1.00 1.45 ?  12 ASP   A OD1  10 
ATOM   5565 O OD2  . ASP   A 1 12 ? 2.860   -1.220  4.985  1.00 1.50 -1 12 ASP   A OD2  10 
ATOM   5566 H H    . ASP   A 1 12 ? 4.308   2.492   4.284  1.00 0.31 ?  12 ASP   A H    10 
ATOM   5567 H HA   . ASP   A 1 12 ? 2.189   1.135   3.118  1.00 0.27 ?  12 ASP   A HA   10 
ATOM   5568 H HB2  . ASP   A 1 12 ? 2.732   1.785   6.016  1.00 1.12 ?  12 ASP   A HB2  10 
ATOM   5569 H HB3  . ASP   A 1 12 ? 1.407   0.757   5.506  1.00 1.15 ?  12 ASP   A HB3  10 
HETATM 5570 N N    . 2ML   A 1 13 ? 1.366   4.016   4.416  1.00 0.18 ?  13 2ML   A N    10 
HETATM 5571 C CA   . 2ML   A 1 13 ? 0.344   5.065   4.458  1.00 0.19 ?  13 2ML   A CA   10 
HETATM 5572 C CB1  . 2ML   A 1 13 ? 0.990   6.354   4.972  1.00 0.24 ?  13 2ML   A CB1  10 
HETATM 5573 C CB2  . 2ML   A 1 13 ? -0.761  4.667   5.426  1.00 0.25 ?  13 2ML   A CB2  10 
HETATM 5574 C CG   . 2ML   A 1 13 ? -0.056  7.453   5.242  1.00 0.33 ?  13 2ML   A CG   10 
HETATM 5575 C CD1  . 2ML   A 1 13 ? 0.449   8.410   6.311  1.00 0.57 ?  13 2ML   A CD1  10 
HETATM 5576 C CD2  . 2ML   A 1 13 ? -0.373  8.238   3.975  1.00 0.54 ?  13 2ML   A CD2  10 
HETATM 5577 C C    . 2ML   A 1 13 ? -0.215  5.263   3.038  1.00 0.16 ?  13 2ML   A C    10 
HETATM 5578 O O    . 2ML   A 1 13 ? -1.427  5.365   2.842  1.00 0.17 ?  13 2ML   A O    10 
HETATM 5579 H H    . 2ML   A 1 13 ? 2.259   4.218   4.771  1.00 0.20 ?  13 2ML   A H    10 
HETATM 5580 H HB11 . 2ML   A 1 13 ? 1.687   6.715   4.235  1.00 0.28 ?  13 2ML   A HB11 10 
HETATM 5581 H HB12 . 2ML   A 1 13 ? 1.525   6.140   5.888  1.00 0.32 ?  13 2ML   A HB12 10 
HETATM 5582 H HB21 . 2ML   A 1 13 ? -0.421  4.808   6.440  1.00 0.92 ?  13 2ML   A HB21 10 
HETATM 5583 H HB22 . 2ML   A 1 13 ? -1.005  3.626   5.275  1.00 0.95 ?  13 2ML   A HB22 10 
HETATM 5584 H HB23 . 2ML   A 1 13 ? -1.637  5.271   5.248  1.00 1.02 ?  13 2ML   A HB23 10 
HETATM 5585 H HG   . 2ML   A 1 13 ? -0.968  7.001   5.598  1.00 0.64 ?  13 2ML   A HG   10 
HETATM 5586 H HD11 . 2ML   A 1 13 ? -0.291  9.177   6.485  1.00 1.31 ?  13 2ML   A HD11 10 
HETATM 5587 H HD12 . 2ML   A 1 13 ? 1.369   8.868   5.978  1.00 0.88 ?  13 2ML   A HD12 10 
HETATM 5588 H HD13 . 2ML   A 1 13 ? 0.628   7.868   7.228  1.00 1.28 ?  13 2ML   A HD13 10 
HETATM 5589 H HD21 . 2ML   A 1 13 ? 0.522   8.725   3.620  1.00 1.20 ?  13 2ML   A HD21 10 
HETATM 5590 H HD22 . 2ML   A 1 13 ? -1.127  8.980   4.190  1.00 1.15 ?  13 2ML   A HD22 10 
HETATM 5591 H HD23 . 2ML   A 1 13 ? -0.739  7.562   3.216  1.00 1.05 ?  13 2ML   A HD23 10 
ATOM   5592 N N    . ARG   A 1 14 ? 0.680   5.285   2.055  1.00 0.14 ?  14 ARG   A N    10 
ATOM   5593 C CA   . ARG   A 1 14 ? 0.298   5.566   0.673  1.00 0.16 ?  14 ARG   A CA   10 
ATOM   5594 C C    . ARG   A 1 14 ? -0.401  4.369   0.044  1.00 0.12 ?  14 ARG   A C    10 
ATOM   5595 O O    . ARG   A 1 14 ? -1.345  4.529   -0.735 1.00 0.14 ?  14 ARG   A O    10 
ATOM   5596 C CB   . ARG   A 1 14 ? 1.515   5.963   -0.166 1.00 0.21 ?  14 ARG   A CB   10 
ATOM   5597 C CG   . ARG   A 1 14 ? 2.054   7.346   0.161  1.00 1.03 ?  14 ARG   A CG   10 
ATOM   5598 C CD   . ARG   A 1 14 ? 3.251   7.698   -0.712 1.00 1.04 ?  14 ARG   A CD   10 
ATOM   5599 N NE   . ARG   A 1 14 ? 3.805   9.012   -0.377 1.00 1.37 ?  14 ARG   A NE   10 
ATOM   5600 C CZ   . ARG   A 1 14 ? 4.990   9.456   -0.799 1.00 1.63 ?  14 ARG   A CZ   10 
ATOM   5601 N NH1  . ARG   A 1 14 ? 5.748   8.702   -1.590 1.00 1.31 1  14 ARG   A NH1  10 
ATOM   5602 N NH2  . ARG   A 1 14 ? 5.414   10.658  -0.429 1.00 2.60 ?  14 ARG   A NH2  10 
ATOM   5603 H H    . ARG   A 1 14 ? 1.616   5.074   2.261  1.00 0.17 ?  14 ARG   A H    10 
ATOM   5604 H HA   . ARG   A 1 14 ? -0.392  6.393   0.689  1.00 0.20 ?  14 ARG   A HA   10 
ATOM   5605 H HB2  . ARG   A 1 14 ? 2.301   5.246   0.002  1.00 0.88 ?  14 ARG   A HB2  10 
ATOM   5606 H HB3  . ARG   A 1 14 ? 1.239   5.945   -1.207 1.00 0.69 ?  14 ARG   A HB3  10 
ATOM   5607 H HG2  . ARG   A 1 14 ? 1.273   8.073   -0.004 1.00 1.51 ?  14 ARG   A HG2  10 
ATOM   5608 H HG3  . ARG   A 1 14 ? 2.356   7.370   1.198  1.00 1.60 ?  14 ARG   A HG3  10 
ATOM   5609 H HD2  . ARG   A 1 14 ? 4.017   6.948   -0.574 1.00 1.51 ?  14 ARG   A HD2  10 
ATOM   5610 H HD3  . ARG   A 1 14 ? 2.936   7.704   -1.746 1.00 1.55 ?  14 ARG   A HD3  10 
ATOM   5611 H HE   . ARG   A 1 14 ? 3.260   9.593   0.205  1.00 1.89 ?  14 ARG   A HE   10 
ATOM   5612 H HH11 . ARG   A 1 14 ? 6.640   9.038   -1.906 1.00 1.53 ?  14 ARG   A HH11 10 
ATOM   5613 H HH12 . ARG   A 1 14 ? 5.431   7.795   -1.878 1.00 1.40 ?  14 ARG   A HH12 10 
ATOM   5614 H HH21 . ARG   A 1 14 ? 6.305   10.998  -0.742 1.00 2.84 ?  14 ARG   A HH21 10 
ATOM   5615 H HH22 . ARG   A 1 14 ? 4.848   11.231  0.168  1.00 3.21 ?  14 ARG   A HH22 10 
ATOM   5616 N N    . CYS   A 1 15 ? 0.056   3.174   0.385  1.00 0.11 ?  15 CYS   A N    10 
ATOM   5617 C CA   . CYS   A 1 15 ? -0.597  1.955   -0.082 1.00 0.10 ?  15 CYS   A CA   10 
ATOM   5618 C C    . CYS   A 1 15 ? -2.001  1.873   0.508  1.00 0.09 ?  15 CYS   A C    10 
ATOM   5619 O O    . CYS   A 1 15 ? -2.968  1.544   -0.185 1.00 0.09 ?  15 CYS   A O    10 
ATOM   5620 C CB   . CYS   A 1 15 ? 0.221   0.720   0.310  1.00 0.13 ?  15 CYS   A CB   10 
ATOM   5621 S SG   . CYS   A 1 15 ? -0.515  -0.862  -0.216 1.00 0.13 ?  15 CYS   A SG   10 
ATOM   5622 H H    . CYS   A 1 15 ? 0.853   3.107   0.958  1.00 0.12 ?  15 CYS   A H    10 
ATOM   5623 H HA   . CYS   A 1 15 ? -0.674  2.006   -1.161 1.00 0.11 ?  15 CYS   A HA   10 
ATOM   5624 H HB2  . CYS   A 1 15 ? 1.202   0.788   -0.141 1.00 0.15 ?  15 CYS   A HB2  10 
ATOM   5625 H HB3  . CYS   A 1 15 ? 0.325   0.694   1.384  1.00 0.15 ?  15 CYS   A HB3  10 
ATOM   5626 N N    . HIS   A 1 16 ? -2.111  2.213   1.788  1.00 0.11 ?  16 HIS   A N    10 
ATOM   5627 C CA   . HIS   A 1 16 ? -3.397  2.249   2.462  1.00 0.13 ?  16 HIS   A CA   10 
ATOM   5628 C C    . HIS   A 1 16 ? -4.303  3.267   1.791  1.00 0.13 ?  16 HIS   A C    10 
ATOM   5629 O O    . HIS   A 1 16 ? -5.468  2.981   1.538  1.00 0.15 ?  16 HIS   A O    10 
ATOM   5630 C CB   . HIS   A 1 16 ? -3.222  2.594   3.947  1.00 0.17 ?  16 HIS   A CB   10 
ATOM   5631 C CG   . HIS   A 1 16 ? -4.502  2.608   4.734  1.00 0.27 ?  16 HIS   A CG   10 
ATOM   5632 N ND1  . HIS   A 1 16 ? -4.928  1.543   5.494  1.00 0.39 ?  16 HIS   A ND1  10 
ATOM   5633 C CD2  . HIS   A 1 16 ? -5.452  3.564   4.869  1.00 0.34 ?  16 HIS   A CD2  10 
ATOM   5634 C CE1  . HIS   A 1 16 ? -6.083  1.840   6.056  1.00 0.48 ?  16 HIS   A CE1  10 
ATOM   5635 N NE2  . HIS   A 1 16 ? -6.424  3.063   5.696  1.00 0.45 ?  16 HIS   A NE2  10 
ATOM   5636 H H    . HIS   A 1 16 ? -1.298  2.438   2.296  1.00 0.13 ?  16 HIS   A H    10 
ATOM   5637 H HA   . HIS   A 1 16 ? -3.846  1.270   2.374  1.00 0.14 ?  16 HIS   A HA   10 
ATOM   5638 H HB2  . HIS   A 1 16 ? -2.567  1.867   4.400  1.00 0.22 ?  16 HIS   A HB2  10 
ATOM   5639 H HB3  . HIS   A 1 16 ? -2.773  3.572   4.027  1.00 0.15 ?  16 HIS   A HB3  10 
ATOM   5640 H HD1  . HIS   A 1 16 ? -4.435  0.703   5.634  1.00 0.44 ?  16 HIS   A HD1  10 
ATOM   5641 H HD2  . HIS   A 1 16 ? -5.442  4.543   4.412  1.00 0.35 ?  16 HIS   A HD2  10 
ATOM   5642 H HE1  . HIS   A 1 16 ? -6.659  1.185   6.692  1.00 0.59 ?  16 HIS   A HE1  10 
ATOM   5643 H HE2  . HIS   A 1 16 ? -7.123  3.598   6.134  1.00 0.54 ?  16 HIS   A HE2  10 
HETATM 5644 N N    . AIB   A 1 17 ? -3.753  4.452   1.514  1.00 0.13 ?  17 AIB   A N    10 
HETATM 5645 C CA   . AIB   A 1 17 ? -4.482  5.519   0.815  1.00 0.15 ?  17 AIB   A CA   10 
HETATM 5646 C C    . AIB   A 1 17 ? -5.079  4.952   -0.479 1.00 0.13 ?  17 AIB   A C    10 
HETATM 5647 O O    . AIB   A 1 17 ? -6.276  5.103   -0.758 1.00 0.15 ?  17 AIB   A O    10 
HETATM 5648 C CB1  . AIB   A 1 17 ? -3.534  6.659   0.484  1.00 0.18 ?  17 AIB   A CB1  10 
HETATM 5649 C CB2  . AIB   A 1 17 ? -5.568  6.075   1.715  1.00 0.19 ?  17 AIB   A CB2  10 
HETATM 5650 H H    . AIB   A 1 17 ? -2.826  4.619   1.793  1.00 0.13 ?  17 AIB   A H    10 
HETATM 5651 H HB11 . AIB   A 1 17 ? -4.079  7.445   -0.017 1.00 0.99 ?  17 AIB   A HB11 10 
HETATM 5652 H HB12 . AIB   A 1 17 ? -2.749  6.299   -0.165 1.00 0.95 ?  17 AIB   A HB12 10 
HETATM 5653 H HB13 . AIB   A 1 17 ? -3.101  7.046   1.394  1.00 1.05 ?  17 AIB   A HB13 10 
HETATM 5654 H HB21 . AIB   A 1 17 ? -5.114  6.575   2.557  1.00 1.00 ?  17 AIB   A HB21 10 
HETATM 5655 H HB22 . AIB   A 1 17 ? -6.187  5.268   2.070  1.00 1.02 ?  17 AIB   A HB22 10 
HETATM 5656 H HB23 . AIB   A 1 17 ? -6.172  6.778   1.160  1.00 0.98 ?  17 AIB   A HB23 10 
ATOM   5657 N N    . HIS   A 1 18 ? -4.226  4.277   -1.245 1.00 0.12 ?  18 HIS   A N    10 
ATOM   5658 C CA   . HIS   A 1 18 ? -4.619  3.665   -2.507 1.00 0.12 ?  18 HIS   A CA   10 
ATOM   5659 C C    . HIS   A 1 18 ? -5.765  2.676   -2.311 1.00 0.09 ?  18 HIS   A C    10 
ATOM   5660 O O    . HIS   A 1 18 ? -6.843  2.840   -2.879 1.00 0.10 ?  18 HIS   A O    10 
ATOM   5661 C CB   . HIS   A 1 18 ? -3.409  2.961   -3.139 1.00 0.15 ?  18 HIS   A CB   10 
ATOM   5662 C CG   . HIS   A 1 18 ? -3.746  2.088   -4.311 1.00 0.19 ?  18 HIS   A CG   10 
ATOM   5663 N ND1  . HIS   A 1 18 ? -4.234  2.576   -5.503 1.00 0.23 ?  18 HIS   A ND1  10 
ATOM   5664 C CD2  . HIS   A 1 18 ? -3.668  0.745   -4.459 1.00 0.23 ?  18 HIS   A CD2  10 
ATOM   5665 C CE1  . HIS   A 1 18 ? -4.443  1.572   -6.334 1.00 0.28 ?  18 HIS   A CE1  10 
ATOM   5666 N NE2  . HIS   A 1 18 ? -4.108  0.453   -5.725 1.00 0.28 ?  18 HIS   A NE2  10 
ATOM   5667 H H    . HIS   A 1 18 ? -3.293  4.185   -0.945 1.00 0.12 ?  18 HIS   A H    10 
ATOM   5668 H HA   . HIS   A 1 18 ? -4.949  4.452   -3.167 1.00 0.14 ?  18 HIS   A HA   10 
ATOM   5669 H HB2  . HIS   A 1 18 ? -2.706  3.704   -3.477 1.00 0.17 ?  18 HIS   A HB2  10 
ATOM   5670 H HB3  . HIS   A 1 18 ? -2.934  2.342   -2.392 1.00 0.15 ?  18 HIS   A HB3  10 
ATOM   5671 H HD1  . HIS   A 1 18 ? -4.410  3.522   -5.710 1.00 0.24 ?  18 HIS   A HD1  10 
ATOM   5672 H HD2  . HIS   A 1 18 ? -3.320  0.040   -3.719 1.00 0.24 ?  18 HIS   A HD2  10 
ATOM   5673 H HE1  . HIS   A 1 18 ? -4.820  1.655   -7.342 1.00 0.33 ?  18 HIS   A HE1  10 
ATOM   5674 H HE2  . HIS   A 1 18 ? -4.124  -0.444  -6.131 1.00 0.36 ?  18 HIS   A HE2  10 
ATOM   5675 N N    . CYS   A 1 19 ? -5.530  1.668   -1.489 1.00 0.09 ?  19 CYS   A N    10 
ATOM   5676 C CA   . CYS   A 1 19 ? -6.484  0.583   -1.315 1.00 0.09 ?  19 CYS   A CA   10 
ATOM   5677 C C    . CYS   A 1 19 ? -7.782  1.073   -0.686 1.00 0.09 ?  19 CYS   A C    10 
ATOM   5678 O O    . CYS   A 1 19 ? -8.858  0.595   -1.036 1.00 0.09 ?  19 CYS   A O    10 
ATOM   5679 C CB   . CYS   A 1 19 ? -5.858  -0.518  -0.471 1.00 0.11 ?  19 CYS   A CB   10 
ATOM   5680 S SG   . CYS   A 1 19 ? -4.313  -1.173  -1.177 1.00 0.12 ?  19 CYS   A SG   10 
ATOM   5681 H H    . CYS   A 1 19 ? -4.686  1.650   -0.981 1.00 0.11 ?  19 CYS   A H    10 
ATOM   5682 H HA   . CYS   A 1 19 ? -6.709  0.183   -2.294 1.00 0.10 ?  19 CYS   A HA   10 
ATOM   5683 H HB2  . CYS   A 1 19 ? -5.635  -0.129  0.512  1.00 0.13 ?  19 CYS   A HB2  10 
ATOM   5684 H HB3  . CYS   A 1 19 ? -6.555  -1.340  -0.380 1.00 0.13 ?  19 CYS   A HB3  10 
HETATM 5685 N N    . A1BEB A 1 20 ? -7.668  2.040   0.225  1.00 0.11 ?  20 A1BEB A N    10 
HETATM 5686 C CA   . A1BEB A 1 20 ? -8.829  2.654   0.882  1.00 0.14 ?  20 A1BEB A CA   10 
HETATM 5687 C C    . A1BEB A 1 20 ? -9.717  3.318   -0.180 1.00 0.16 ?  20 A1BEB A C    10 
HETATM 5688 O O    . A1BEB A 1 20 ? -10.944 3.362   -0.042 1.00 0.18 ?  20 A1BEB A O    10 
HETATM 5689 C CB   . A1BEB A 1 20 ? -8.339  3.697   1.871  1.00 0.21 ?  20 A1BEB A CB   10 
HETATM 5690 C CB2  . A1BEB A 1 20 ? -9.608  1.604   1.659  1.00 0.15 ?  20 A1BEB A CB2  10 
HETATM 5691 C CG   . A1BEB A 1 20 ? -9.486  4.439   2.527  1.00 0.36 ?  20 A1BEB A CG   10 
HETATM 5692 C CD   . A1BEB A 1 20 ? -8.970  5.557   3.409  1.00 0.44 ?  20 A1BEB A CD   10 
HETATM 5693 C CE   . A1BEB A 1 20 ? -10.097 6.436   3.918  1.00 0.72 ?  20 A1BEB A CE   10 
HETATM 5694 N NZ   . A1BEB A 1 20 ? -9.605  7.504   4.824  1.00 1.38 ?  20 A1BEB A NZ   10 
HETATM 5695 H H    . A1BEB A 1 20 ? -6.772  2.354   0.472  1.00 0.12 ?  20 A1BEB A H    10 
HETATM 5696 H HB2  . A1BEB A 1 20 ? -7.720  4.416   1.352  1.00 0.19 ?  20 A1BEB A HB2  10 
HETATM 5697 H HB3  . A1BEB A 1 20 ? -7.756  3.215   2.640  1.00 0.23 ?  20 A1BEB A HB3  10 
HETATM 5698 H HB23 . A1BEB A 1 20 ? -9.864  0.786   1.001  1.00 0.84 ?  20 A1BEB A HB23 10 
HETATM 5699 H HB21 . A1BEB A 1 20 ? -10.511 2.042   2.054  1.00 0.80 ?  20 A1BEB A HB21 10 
HETATM 5700 H HB22 . A1BEB A 1 20 ? -9.001  1.234   2.472  1.00 0.82 ?  20 A1BEB A HB22 10 
HETATM 5701 H HG3  . A1BEB A 1 20 ? -10.045 3.750   3.135  1.00 0.42 ?  20 A1BEB A HG3  10 
HETATM 5702 H HG2  . A1BEB A 1 20 ? -10.122 4.852   1.760  1.00 0.40 ?  20 A1BEB A HG2  10 
HETATM 5703 H HD3  . A1BEB A 1 20 ? -8.458  5.122   4.252  1.00 0.93 ?  20 A1BEB A HD3  10 
HETATM 5704 H HD2  . A1BEB A 1 20 ? -8.280  6.162   2.840  1.00 0.84 ?  20 A1BEB A HD2  10 
HETATM 5705 H HE3  . A1BEB A 1 20 ? -10.589 6.894   3.073  1.00 1.49 ?  20 A1BEB A HE3  10 
HETATM 5706 H HE2  . A1BEB A 1 20 ? -10.804 5.820   4.453  1.00 1.41 ?  20 A1BEB A HE2  10 
HETATM 5707 H HZ1  . A1BEB A 1 20 ? -10.380 8.161   5.055  1.00 1.93 ?  20 A1BEB A HZ1  10 
HETATM 5708 H HZ2  . A1BEB A 1 20 ? -8.839  8.038   4.370  1.00 1.93 ?  20 A1BEB A HZ2  10 
HETATM 5709 H HZ3  . A1BEB A 1 20 ? -9.247  7.090   5.708  1.00 1.84 ?  20 A1BEB A HZ3  10 
ATOM   5710 N N    . SER   A 1 21 ? -9.090  3.826   -1.238 1.00 0.18 ?  21 SER   A N    10 
ATOM   5711 C CA   . SER   A 1 21 ? -9.822  4.479   -2.312 1.00 0.23 ?  21 SER   A CA   10 
ATOM   5712 C C    . SER   A 1 21 ? -10.605 3.453   -3.127 1.00 0.23 ?  21 SER   A C    10 
ATOM   5713 O O    . SER   A 1 21 ? -11.517 3.803   -3.875 1.00 0.31 ?  21 SER   A O    10 
ATOM   5714 C CB   . SER   A 1 21 ? -8.856  5.253   -3.220 1.00 0.33 ?  21 SER   A CB   10 
ATOM   5715 O OG   . SER   A 1 21 ? -9.553  6.047   -4.167 1.00 1.18 ?  21 SER   A OG   10 
ATOM   5716 H H    . SER   A 1 21 ? -8.109  3.756   -1.299 1.00 0.17 ?  21 SER   A H    10 
ATOM   5717 H HA   . SER   A 1 21 ? -10.517 5.174   -1.865 1.00 0.26 ?  21 SER   A HA   10 
ATOM   5718 H HB2  . SER   A 1 21 ? -8.239  5.898   -2.618 1.00 1.01 ?  21 SER   A HB2  10 
ATOM   5719 H HB3  . SER   A 1 21 ? -8.228  4.553   -3.752 1.00 1.21 ?  21 SER   A HB3  10 
ATOM   5720 H HG   . SER   A 1 21 ? -10.484 6.095   -3.918 1.00 1.82 ?  21 SER   A HG   10 
ATOM   5721 N N    . ILE   A 1 22 ? -10.250 2.185   -2.975 1.00 0.19 ?  22 ILE   A N    10 
ATOM   5722 C CA   . ILE   A 1 22 ? -10.896 1.120   -3.713 1.00 0.20 ?  22 ILE   A CA   10 
ATOM   5723 C C    . ILE   A 1 22 ? -11.953 0.423   -2.856 1.00 0.17 ?  22 ILE   A C    10 
ATOM   5724 O O    . ILE   A 1 22 ? -11.647 -0.137  -1.794 1.00 0.14 ?  22 ILE   A O    10 
ATOM   5725 C CB   . ILE   A 1 22 ? -9.873  0.080   -4.197 1.00 0.21 ?  22 ILE   A CB   10 
ATOM   5726 C CG1  . ILE   A 1 22 ? -8.752  0.765   -4.982 1.00 0.24 ?  22 ILE   A CG1  10 
ATOM   5727 C CG2  . ILE   A 1 22 ? -10.562 -0.972  -5.057 1.00 0.24 ?  22 ILE   A CG2  10 
ATOM   5728 C CD1  . ILE   A 1 22 ? -7.660  -0.180  -5.440 1.00 0.26 ?  22 ILE   A CD1  10 
ATOM   5729 H H    . ILE   A 1 22 ? -9.538  1.957   -2.341 1.00 0.19 ?  22 ILE   A H    10 
ATOM   5730 H HA   . ILE   A 1 22 ? -11.370 1.554   -4.577 1.00 0.25 ?  22 ILE   A HA   10 
ATOM   5731 H HB   . ILE   A 1 22 ? -9.453  -0.404  -3.332 1.00 0.18 ?  22 ILE   A HB   10 
ATOM   5732 H HG12 . ILE   A 1 22 ? -9.172  1.233   -5.858 1.00 0.28 ?  22 ILE   A HG12 10 
ATOM   5733 H HG13 . ILE   A 1 22 ? -8.300  1.521   -4.358 1.00 0.24 ?  22 ILE   A HG13 10 
ATOM   5734 H HG21 . ILE   A 1 22 ? -10.999 -0.496  -5.922 1.00 0.99 ?  22 ILE   A HG21 10 
ATOM   5735 H HG22 . ILE   A 1 22 ? -11.340 -1.453  -4.482 1.00 0.98 ?  22 ILE   A HG22 10 
ATOM   5736 H HG23 . ILE   A 1 22 ? -9.841  -1.708  -5.376 1.00 0.97 ?  22 ILE   A HG23 10 
ATOM   5737 H HD11 . ILE   A 1 22 ? -6.877  0.385   -5.925 1.00 1.05 ?  22 ILE   A HD11 10 
ATOM   5738 H HD12 . ILE   A 1 22 ? -8.069  -0.895  -6.135 1.00 1.05 ?  22 ILE   A HD12 10 
ATOM   5739 H HD13 . ILE   A 1 22 ? -7.251  -0.701  -4.587 1.00 0.99 ?  22 ILE   A HD13 10 
ATOM   5740 N N    . PRO   A 1 23 ? -13.216 0.459   -3.304 1.00 0.19 ?  23 PRO   A N    10 
ATOM   5741 C CA   . PRO   A 1 23 ? -14.320 -0.210  -2.616 1.00 0.19 ?  23 PRO   A CA   10 
ATOM   5742 C C    . PRO   A 1 23 ? -14.044 -1.696  -2.406 1.00 0.18 ?  23 PRO   A C    10 
ATOM   5743 O O    . PRO   A 1 23 ? -13.418 -2.347  -3.246 1.00 0.21 ?  23 PRO   A O    10 
ATOM   5744 C CB   . PRO   A 1 23 ? -15.506 -0.013  -3.563 1.00 0.25 ?  23 PRO   A CB   10 
ATOM   5745 C CG   . PRO   A 1 23 ? -15.160 1.198   -4.349 1.00 0.29 ?  23 PRO   A CG   10 
ATOM   5746 C CD   . PRO   A 1 23 ? -13.670 1.160   -4.517 1.00 0.26 ?  23 PRO   A CD   10 
ATOM   5747 H HA   . PRO   A 1 23 ? -14.533 0.254   -1.665 1.00 0.19 ?  23 PRO   A HA   10 
ATOM   5748 H HB2  . PRO   A 1 23 ? -15.609 -0.878  -4.199 1.00 0.28 ?  23 PRO   A HB2  10 
ATOM   5749 H HB3  . PRO   A 1 23 ? -16.410 0.132   -2.990 1.00 0.28 ?  23 PRO   A HB3  10 
ATOM   5750 H HG2  . PRO   A 1 23 ? -15.647 1.161   -5.309 1.00 0.34 ?  23 PRO   A HG2  10 
ATOM   5751 H HG3  . PRO   A 1 23 ? -15.453 2.085   -3.809 1.00 0.30 ?  23 PRO   A HG3  10 
ATOM   5752 H HD2  . PRO   A 1 23 ? -13.404 0.605   -5.405 1.00 0.30 ?  23 PRO   A HD2  10 
ATOM   5753 H HD3  . PRO   A 1 23 ? -13.270 2.160   -4.558 1.00 0.28 ?  23 PRO   A HD3  10 
HETATM 5754 N N    . DPR   A 1 24 ? -14.504 -2.250  -1.279 1.00 0.19 ?  24 DPR   A N    10 
HETATM 5755 C CA   . DPR   A 1 24 ? -14.275 -3.649  -0.930 1.00 0.23 ?  24 DPR   A CA   10 
HETATM 5756 C CB   . DPR   A 1 24 ? -15.467 -3.950  -0.035 1.00 0.30 ?  24 DPR   A CB   10 
HETATM 5757 C CG   . DPR   A 1 24 ? -15.690 -2.674  0.701  1.00 0.29 ?  24 DPR   A CG   10 
HETATM 5758 C CD   . DPR   A 1 24 ? -15.325 -1.566  -0.259 1.00 0.23 ?  24 DPR   A CD   10 
HETATM 5759 C C    . DPR   A 1 24 ? -12.969 -3.854  -0.163 1.00 0.22 ?  24 DPR   A C    10 
HETATM 5760 O O    . DPR   A 1 24 ? -12.725 -4.927  0.393  1.00 0.31 ?  24 DPR   A O    10 
HETATM 5761 H HA   . DPR   A 1 24 ? -14.301 -4.293  -1.791 1.00 0.27 ?  24 DPR   A HA   10 
HETATM 5762 H HB2  . DPR   A 1 24 ? -15.223 -4.758  0.637  1.00 0.34 ?  24 DPR   A HB2  10 
HETATM 5763 H HB3  . DPR   A 1 24 ? -16.321 -4.216  -0.641 1.00 0.33 ?  24 DPR   A HB3  10 
HETATM 5764 H HG2  . DPR   A 1 24 ? -15.050 -2.639  1.571  1.00 0.31 ?  24 DPR   A HG2  10 
HETATM 5765 H HG3  . DPR   A 1 24 ? -16.726 -2.592  0.993  1.00 0.35 ?  24 DPR   A HG3  10 
HETATM 5766 H HD2  . DPR   A 1 24 ? -14.755 -0.801  0.245  1.00 0.23 ?  24 DPR   A HD2  10 
HETATM 5767 H HD3  . DPR   A 1 24 ? -16.215 -1.145  -0.701 1.00 0.24 ?  24 DPR   A HD3  10 
ATOM   5768 N N    . TYR   A 1 25 ? -12.128 -2.831  -0.130 1.00 0.15 ?  25 TYR   A N    10 
ATOM   5769 C CA   . TYR   A 1 25 ? -10.910 -2.883  0.659  1.00 0.14 ?  25 TYR   A CA   10 
ATOM   5770 C C    . TYR   A 1 25 ? -10.995 -1.906  1.818  1.00 0.15 ?  25 TYR   A C    10 
ATOM   5771 O O    . TYR   A 1 25 ? -11.704 -0.905  1.741  1.00 0.17 ?  25 TYR   A O    10 
ATOM   5772 C CB   . TYR   A 1 25 ? -9.688  -2.576  -0.203 1.00 0.12 ?  25 TYR   A CB   10 
ATOM   5773 C CG   . TYR   A 1 25 ? -9.391  -3.647  -1.230 1.00 0.15 ?  25 TYR   A CG   10 
ATOM   5774 C CD1  . TYR   A 1 25 ? -9.387  -3.357  -2.586 1.00 0.18 ?  25 TYR   A CD1  10 
ATOM   5775 C CD2  . TYR   A 1 25 ? -9.112  -4.951  -0.840 1.00 0.21 ?  25 TYR   A CD2  10 
ATOM   5776 C CE1  . TYR   A 1 25 ? -9.114  -4.331  -3.524 1.00 0.24 ?  25 TYR   A CE1  10 
ATOM   5777 C CE2  . TYR   A 1 25 ? -8.840  -5.932  -1.772 1.00 0.26 ?  25 TYR   A CE2  10 
ATOM   5778 C CZ   . TYR   A 1 25 ? -8.841  -5.615  -3.112 1.00 0.26 ?  25 TYR   A CZ   10 
ATOM   5779 O OH   . TYR   A 1 25 ? -8.564  -6.587  -4.045 1.00 0.32 ?  25 TYR   A OH   10 
ATOM   5780 H H    . TYR   A 1 25 ? -12.330 -2.020  -0.652 1.00 0.14 ?  25 TYR   A H    10 
ATOM   5781 H HA   . TYR   A 1 25 ? -10.817 -3.884  1.057  1.00 0.16 ?  25 TYR   A HA   10 
ATOM   5782 H HB2  . TYR   A 1 25 ? -9.853  -1.647  -0.726 1.00 0.11 ?  25 TYR   A HB2  10 
ATOM   5783 H HB3  . TYR   A 1 25 ? -8.824  -2.475  0.436  1.00 0.12 ?  25 TYR   A HB3  10 
ATOM   5784 H HD1  . TYR   A 1 25 ? -9.598  -2.352  -2.904 1.00 0.20 ?  25 TYR   A HD1  10 
ATOM   5785 H HD2  . TYR   A 1 25 ? -9.111  -5.196  0.211  1.00 0.25 ?  25 TYR   A HD2  10 
ATOM   5786 H HE1  . TYR   A 1 25 ? -9.116  -4.084  -4.576 1.00 0.29 ?  25 TYR   A HE1  10 
ATOM   5787 H HE2  . TYR   A 1 25 ? -8.625  -6.939  -1.448 1.00 0.32 ?  25 TYR   A HE2  10 
ATOM   5788 H HH   . TYR   A 1 25 ? -9.085  -7.379  -3.847 1.00 0.97 ?  25 TYR   A HH   10 
ATOM   5789 N N    . LYS   A 1 26 ? -10.289 -2.212  2.894  1.00 0.16 ?  26 LYS   A N    10 
ATOM   5790 C CA   . LYS   A 1 26 ? -10.288 -1.353  4.072  1.00 0.21 ?  26 LYS   A CA   10 
ATOM   5791 C C    . LYS   A 1 26 ? -8.886  -0.821  4.348  1.00 0.24 ?  26 LYS   A C    10 
ATOM   5792 O O    . LYS   A 1 26 ? -8.697  0.071   5.173  1.00 0.46 ?  26 LYS   A O    10 
ATOM   5793 C CB   . LYS   A 1 26 ? -10.818 -2.110  5.298  1.00 0.27 ?  26 LYS   A CB   10 
ATOM   5794 C CG   . LYS   A 1 26 ? -9.905  -3.226  5.783  1.00 0.30 ?  26 LYS   A CG   10 
ATOM   5795 C CD   . LYS   A 1 26 ? -10.484 -3.961  6.985  1.00 0.43 ?  26 LYS   A CD   10 
ATOM   5796 C CE   . LYS   A 1 26 ? -11.443 -5.076  6.582  1.00 1.65 ?  26 LYS   A CE   10 
ATOM   5797 N NZ   . LYS   A 1 26 ? -12.689 -4.567  5.949  1.00 1.94 1  26 LYS   A NZ   10 
ATOM   5798 H H    . LYS   A 1 26 ? -9.758  -3.039  2.898  1.00 0.16 ?  26 LYS   A H    10 
ATOM   5799 H HA   . LYS   A 1 26 ? -10.938 -0.516  3.865  1.00 0.22 ?  26 LYS   A HA   10 
ATOM   5800 H HB2  . LYS   A 1 26 ? -10.949 -1.409  6.110  1.00 0.31 ?  26 LYS   A HB2  10 
ATOM   5801 H HB3  . LYS   A 1 26 ? -11.776 -2.542  5.051  1.00 0.32 ?  26 LYS   A HB3  10 
ATOM   5802 H HG2  . LYS   A 1 26 ? -9.763  -3.934  4.982  1.00 0.34 ?  26 LYS   A HG2  10 
ATOM   5803 H HG3  . LYS   A 1 26 ? -8.952  -2.799  6.060  1.00 0.36 ?  26 LYS   A HG3  10 
ATOM   5804 H HD2  . LYS   A 1 26 ? -9.675  -4.391  7.553  1.00 1.07 ?  26 LYS   A HD2  10 
ATOM   5805 H HD3  . LYS   A 1 26 ? -11.016 -3.250  7.600  1.00 0.96 ?  26 LYS   A HD3  10 
ATOM   5806 H HE2  . LYS   A 1 26 ? -10.940 -5.727  5.882  1.00 2.28 ?  26 LYS   A HE2  10 
ATOM   5807 H HE3  . LYS   A 1 26 ? -11.706 -5.640  7.465  1.00 2.30 ?  26 LYS   A HE3  10 
ATOM   5808 H HZ1  . LYS   A 1 26 ? -13.341 -5.355  5.761  1.00 2.33 ?  26 LYS   A HZ1  10 
ATOM   5809 H HZ2  . LYS   A 1 26 ? -12.469 -4.095  5.050  1.00 2.04 ?  26 LYS   A HZ2  10 
ATOM   5810 H HZ3  . LYS   A 1 26 ? -13.158 -3.886  6.578  1.00 2.40 ?  26 LYS   A HZ3  10 
ATOM   5811 N N    . GLY   A 1 27 ? -7.906  -1.375  3.649  1.00 0.14 ?  27 GLY   A N    10 
ATOM   5812 C CA   . GLY   A 1 27 ? -6.537  -0.955  3.825  1.00 0.13 ?  27 GLY   A CA   10 
ATOM   5813 C C    . GLY   A 1 27 ? -5.617  -1.652  2.852  1.00 0.12 ?  27 GLY   A C    10 
ATOM   5814 O O    . GLY   A 1 27 ? -6.075  -2.442  2.026  1.00 0.15 ?  27 GLY   A O    10 
ATOM   5815 H H    . GLY   A 1 27 ? -8.115  -2.082  3.005  1.00 0.25 ?  27 GLY   A H    10 
ATOM   5816 H HA2  . GLY   A 1 27 ? -6.472  0.113   3.673  1.00 0.14 ?  27 GLY   A HA2  10 
ATOM   5817 H HA3  . GLY   A 1 27 ? -6.225  -1.187  4.831  1.00 0.17 ?  27 GLY   A HA3  10 
ATOM   5818 N N    . GLY   A 1 28 ? -4.330  -1.365  2.948  1.00 0.13 ?  28 GLY   A N    10 
ATOM   5819 C CA   . GLY   A 1 28 ? -3.350  -2.001  2.091  1.00 0.13 ?  28 GLY   A CA   10 
ATOM   5820 C C    . GLY   A 1 28 ? -1.949  -1.829  2.630  1.00 0.16 ?  28 GLY   A C    10 
ATOM   5821 O O    . GLY   A 1 28 ? -1.474  -0.703  2.785  1.00 0.20 ?  28 GLY   A O    10 
ATOM   5822 H H    . GLY   A 1 28 ? -4.034  -0.717  3.619  1.00 0.15 ?  28 GLY   A H    10 
ATOM   5823 H HA2  . GLY   A 1 28 ? -3.575  -3.055  2.026  1.00 0.14 ?  28 GLY   A HA2  10 
ATOM   5824 H HA3  . GLY   A 1 28 ? -3.404  -1.567  1.106  1.00 0.15 ?  28 GLY   A HA3  10 
ATOM   5825 N N    . TYR   A 1 29 ? -1.317  -2.934  2.985  1.00 0.17 ?  29 TYR   A N    10 
ATOM   5826 C CA   . TYR   A 1 29 ? 0.027   -2.889  3.542  1.00 0.22 ?  29 TYR   A CA   10 
ATOM   5827 C C    . TYR   A 1 29 ? 1.072   -3.125  2.461  1.00 0.20 ?  29 TYR   A C    10 
ATOM   5828 O O    . TYR   A 1 29 ? 0.798   -3.773  1.447  1.00 0.17 ?  29 TYR   A O    10 
ATOM   5829 C CB   . TYR   A 1 29 ? 0.194   -3.890  4.694  1.00 0.28 ?  29 TYR   A CB   10 
ATOM   5830 C CG   . TYR   A 1 29 ? 0.188   -5.353  4.297  1.00 0.33 ?  29 TYR   A CG   10 
ATOM   5831 C CD1  . TYR   A 1 29 ? 1.361   -6.099  4.330  1.00 0.46 ?  29 TYR   A CD1  10 
ATOM   5832 C CD2  . TYR   A 1 29 ? -0.983  -5.992  3.912  1.00 0.44 ?  29 TYR   A CD2  10 
ATOM   5833 C CE1  . TYR   A 1 29 ? 1.366   -7.437  3.993  1.00 0.58 ?  29 TYR   A CE1  10 
ATOM   5834 C CE2  . TYR   A 1 29 ? -0.985  -7.331  3.568  1.00 0.55 ?  29 TYR   A CE2  10 
ATOM   5835 C CZ   . TYR   A 1 29 ? 0.194   -8.049  3.612  1.00 0.60 ?  29 TYR   A CZ   10 
ATOM   5836 O OH   . TYR   A 1 29 ? 0.203   -9.385  3.278  1.00 0.73 ?  29 TYR   A OH   10 
ATOM   5837 H H    . TYR   A 1 29 ? -1.738  -3.804  2.810  1.00 0.17 ?  29 TYR   A H    10 
ATOM   5838 H HA   . TYR   A 1 29 ? 0.172   -1.892  3.932  1.00 0.26 ?  29 TYR   A HA   10 
ATOM   5839 H HB2  . TYR   A 1 29 ? 1.134   -3.694  5.183  1.00 0.35 ?  29 TYR   A HB2  10 
ATOM   5840 H HB3  . TYR   A 1 29 ? -0.601  -3.738  5.405  1.00 0.30 ?  29 TYR   A HB3  10 
ATOM   5841 H HD1  . TYR   A 1 29 ? 2.280   -5.618  4.627  1.00 0.55 ?  29 TYR   A HD1  10 
ATOM   5842 H HD2  . TYR   A 1 29 ? -1.903  -5.429  3.877  1.00 0.53 ?  29 TYR   A HD2  10 
ATOM   5843 H HE1  . TYR   A 1 29 ? 2.289   -7.997  4.026  1.00 0.72 ?  29 TYR   A HE1  10 
ATOM   5844 H HE2  . TYR   A 1 29 ? -1.906  -7.811  3.270  1.00 0.69 ?  29 TYR   A HE2  10 
ATOM   5845 H HH   . TYR   A 1 29 ? 0.542   -9.894  4.025  1.00 1.12 ?  29 TYR   A HH   10 
ATOM   5846 N N    . CYS   A 1 30 ? 2.268   -2.608  2.687  1.00 0.22 ?  30 CYS   A N    10 
ATOM   5847 C CA   . CYS   A 1 30 ? 3.377   -2.845  1.782  1.00 0.19 ?  30 CYS   A CA   10 
ATOM   5848 C C    . CYS   A 1 30 ? 3.962   -4.229  2.028  1.00 0.20 ?  30 CYS   A C    10 
ATOM   5849 O O    . CYS   A 1 30 ? 4.485   -4.517  3.105  1.00 0.32 ?  30 CYS   A O    10 
ATOM   5850 C CB   . CYS   A 1 30 ? 4.453   -1.776  1.951  1.00 0.27 ?  30 CYS   A CB   10 
ATOM   5851 S SG   . CYS   A 1 30 ? 3.981   -0.134  1.316  1.00 0.86 ?  30 CYS   A SG   10 
ATOM   5852 H H    . CYS   A 1 30 ? 2.411   -2.054  3.490  1.00 0.27 ?  30 CYS   A H    10 
ATOM   5853 H HA   . CYS   A 1 30 ? 2.994   -2.803  0.773  1.00 0.21 ?  30 CYS   A HA   10 
ATOM   5854 H HB2  . CYS   A 1 30 ? 4.677   -1.668  3.001  1.00 0.76 ?  30 CYS   A HB2  10 
ATOM   5855 H HB3  . CYS   A 1 30 ? 5.343   -2.089  1.428  1.00 0.88 ?  30 CYS   A HB3  10 
ATOM   5856 N N    . ALA   A 1 31 ? 3.865   -5.076  1.020  1.00 0.19 ?  31 ALA   A N    10 
ATOM   5857 C CA   . ALA   A 1 31 ? 4.265   -6.467  1.129  1.00 0.28 ?  31 ALA   A CA   10 
ATOM   5858 C C    . ALA   A 1 31 ? 5.442   -6.767  0.209  1.00 0.22 ?  31 ALA   A C    10 
ATOM   5859 O O    . ALA   A 1 31 ? 5.835   -5.919  -0.597 1.00 0.16 ?  31 ALA   A O    10 
ATOM   5860 C CB   . ALA   A 1 31 ? 3.088   -7.365  0.789  1.00 0.42 ?  31 ALA   A CB   10 
ATOM   5861 H H    . ALA   A 1 31 ? 3.520   -4.748  0.160  1.00 0.20 ?  31 ALA   A H    10 
ATOM   5862 H HA   . ALA   A 1 31 ? 4.554   -6.658  2.152  1.00 0.36 ?  31 ALA   A HA   10 
ATOM   5863 H HB1  . ALA   A 1 31 ? 3.365   -8.394  0.946  1.00 1.01 ?  31 ALA   A HB1  10 
ATOM   5864 H HB2  . ALA   A 1 31 ? 2.811   -7.220  -0.245 1.00 1.08 ?  31 ALA   A HB2  10 
ATOM   5865 H HB3  . ALA   A 1 31 ? 2.250   -7.117  1.424  1.00 1.16 ?  31 ALA   A HB3  10 
ATOM   5866 N N    . LYS   A 1 32 ? 5.993   -7.971  0.337  1.00 0.28 ?  32 LYS   A N    10 
ATOM   5867 C CA   . LYS   A 1 32 ? 7.120   -8.416  -0.483 1.00 0.26 ?  32 LYS   A CA   10 
ATOM   5868 C C    . LYS   A 1 32 ? 8.278   -7.415  -0.402 1.00 0.26 ?  32 LYS   A C    10 
ATOM   5869 O O    . LYS   A 1 32 ? 8.527   -6.654  -1.341 1.00 0.24 ?  32 LYS   A O    10 
ATOM   5870 C CB   . LYS   A 1 32 ? 6.681   -8.621  -1.939 1.00 0.25 ?  32 LYS   A CB   10 
ATOM   5871 C CG   . LYS   A 1 32 ? 7.771   -9.178  -2.844 1.00 1.09 ?  32 LYS   A CG   10 
ATOM   5872 C CD   . LYS   A 1 32 ? 7.276   -9.379  -4.264 1.00 1.62 ?  32 LYS   A CD   10 
ATOM   5873 C CE   . LYS   A 1 32 ? 8.385   -9.887  -5.173 1.00 2.37 ?  32 LYS   A CE   10 
ATOM   5874 N NZ   . LYS   A 1 32 ? 8.900   -11.213 -4.741 1.00 2.43 1  32 LYS   A NZ   10 
ATOM   5875 H H    . LYS   A 1 32 ? 5.635   -8.583  1.013  1.00 0.37 ?  32 LYS   A H    10 
ATOM   5876 H HA   . LYS   A 1 32 ? 7.455   -9.361  -0.082 1.00 0.32 ?  32 LYS   A HA   10 
ATOM   5877 H HB2  . LYS   A 1 32 ? 5.846   -9.304  -1.960 1.00 0.88 ?  32 LYS   A HB2  10 
ATOM   5878 H HB3  . LYS   A 1 32 ? 6.364   -7.670  -2.339 1.00 0.84 ?  32 LYS   A HB3  10 
ATOM   5879 H HG2  . LYS   A 1 32 ? 8.596   -8.485  -2.864 1.00 1.65 ?  32 LYS   A HG2  10 
ATOM   5880 H HG3  . LYS   A 1 32 ? 8.102   -10.125 -2.450 1.00 1.76 ?  32 LYS   A HG3  10 
ATOM   5881 H HD2  . LYS   A 1 32 ? 6.473   -10.099 -4.256 1.00 2.05 ?  32 LYS   A HD2  10 
ATOM   5882 H HD3  . LYS   A 1 32 ? 6.917   -8.436  -4.643 1.00 1.80 ?  32 LYS   A HD3  10 
ATOM   5883 H HE2  . LYS   A 1 32 ? 7.999   -9.971  -6.177 1.00 2.75 ?  32 LYS   A HE2  10 
ATOM   5884 H HE3  . LYS   A 1 32 ? 9.197   -9.175  -5.159 1.00 3.09 ?  32 LYS   A HE3  10 
ATOM   5885 H HZ1  . LYS   A 1 32 ? 9.686   -11.510 -5.356 1.00 2.11 ?  32 LYS   A HZ1  10 
ATOM   5886 H HZ2  . LYS   A 1 32 ? 8.145   -11.927 -4.799 1.00 3.00 ?  32 LYS   A HZ2  10 
ATOM   5887 H HZ3  . LYS   A 1 32 ? 9.240   -11.167 -3.761 1.00 2.96 ?  32 LYS   A HZ3  10 
HETATM 5888 N N    . DPR   A 1 33 ? 8.986   -7.395  0.738  1.00 0.37 ?  33 DPR   A N    10 
HETATM 5889 C CA   . DPR   A 1 33 ? 10.092  -6.453  0.982  1.00 0.44 ?  33 DPR   A CA   10 
HETATM 5890 C CB   . DPR   A 1 33 ? 10.553  -6.789  2.404  1.00 0.59 ?  33 DPR   A CB   10 
HETATM 5891 C CG   . DPR   A 1 33 ? 10.049  -8.160  2.670  1.00 0.61 ?  33 DPR   A CG   10 
HETATM 5892 C CD   . DPR   A 1 33 ? 8.784   -8.309  1.874  1.00 0.47 ?  33 DPR   A CD   10 
HETATM 5893 C C    . DPR   A 1 33 ? 9.644   -4.990  0.901  1.00 0.39 ?  33 DPR   A C    10 
HETATM 5894 O O    . DPR   A 1 33 ? 10.470  -4.079  0.810  1.00 0.47 ?  33 DPR   A O    10 
HETATM 5895 H HA   . DPR   A 1 33 ? 10.908  -6.617  0.298  1.00 0.48 ?  33 DPR   A HA   10 
HETATM 5896 H HB2  . DPR   A 1 33 ? 10.130  -6.077  3.097  1.00 0.61 ?  33 DPR   A HB2  10 
HETATM 5897 H HB3  . DPR   A 1 33 ? 11.631  -6.751  2.455  1.00 0.67 ?  33 DPR   A HB3  10 
HETATM 5898 H HG2  . DPR   A 1 33 ? 9.843   -8.272  3.724  1.00 0.70 ?  33 DPR   A HG2  10 
HETATM 5899 H HG3  . DPR   A 1 33 ? 10.781  -8.886  2.350  1.00 0.65 ?  33 DPR   A HG3  10 
HETATM 5900 H HD2  . DPR   A 1 33 ? 7.928   -8.012  2.459  1.00 0.49 ?  33 DPR   A HD2  10 
HETATM 5901 H HD3  . DPR   A 1 33 ? 8.674   -9.326  1.533  1.00 0.47 ?  33 DPR   A HD3  10 
ATOM   5902 N N    . GLY   A 1 34 ? 8.337   -4.774  0.941  1.00 0.32 ?  34 GLY   A N    10 
ATOM   5903 C CA   . GLY   A 1 34 ? 7.797   -3.432  0.880  1.00 0.30 ?  34 GLY   A CA   10 
ATOM   5904 C C    . GLY   A 1 34 ? 7.681   -2.912  -0.540 1.00 0.25 ?  34 GLY   A C    10 
ATOM   5905 O O    . GLY   A 1 34 ? 7.727   -1.703  -0.769 1.00 0.30 ?  34 GLY   A O    10 
ATOM   5906 H H    . GLY   A 1 34 ? 7.730   -5.540  1.019  1.00 0.32 ?  34 GLY   A H    10 
ATOM   5907 H HA2  . GLY   A 1 34 ? 6.819   -3.429  1.335  1.00 0.31 ?  34 GLY   A HA2  10 
ATOM   5908 H HA3  . GLY   A 1 34 ? 8.444   -2.773  1.440  1.00 0.36 ?  34 GLY   A HA3  10 
ATOM   5909 N N    . PHE   A 1 35 ? 7.536   -3.820  -1.501 1.00 0.19 ?  35 PHE   A N    10 
ATOM   5910 C CA   . PHE   A 1 35 ? 7.418   -3.430  -2.903 1.00 0.20 ?  35 PHE   A CA   10 
ATOM   5911 C C    . PHE   A 1 35 ? 5.984   -3.541  -3.410 1.00 0.17 ?  35 PHE   A C    10 
ATOM   5912 O O    . PHE   A 1 35 ? 5.530   -2.709  -4.193 1.00 0.29 ?  35 PHE   A O    10 
ATOM   5913 C CB   . PHE   A 1 35 ? 8.330   -4.287  -3.778 1.00 0.23 ?  35 PHE   A CB   10 
ATOM   5914 C CG   . PHE   A 1 35 ? 9.786   -3.939  -3.662 1.00 0.31 ?  35 PHE   A CG   10 
ATOM   5915 C CD1  . PHE   A 1 35 ? 10.608  -4.624  -2.784 1.00 0.40 ?  35 PHE   A CD1  10 
ATOM   5916 C CD2  . PHE   A 1 35 ? 10.332  -2.929  -4.436 1.00 0.37 ?  35 PHE   A CD2  10 
ATOM   5917 C CE1  . PHE   A 1 35 ? 11.949  -4.312  -2.681 1.00 0.49 ?  35 PHE   A CE1  10 
ATOM   5918 C CE2  . PHE   A 1 35 ? 11.672  -2.610  -4.338 1.00 0.46 ?  35 PHE   A CE2  10 
ATOM   5919 C CZ   . PHE   A 1 35 ? 12.481  -3.303  -3.459 1.00 0.51 ?  35 PHE   A CZ   10 
ATOM   5920 H H    . PHE   A 1 35 ? 7.520   -4.776  -1.261 1.00 0.19 ?  35 PHE   A H    10 
ATOM   5921 H HA   . PHE   A 1 35 ? 7.731   -2.402  -2.984 1.00 0.24 ?  35 PHE   A HA   10 
ATOM   5922 H HB2  . PHE   A 1 35 ? 8.214   -5.324  -3.498 1.00 0.24 ?  35 PHE   A HB2  10 
ATOM   5923 H HB3  . PHE   A 1 35 ? 8.040   -4.166  -4.810 1.00 0.27 ?  35 PHE   A HB3  10 
ATOM   5924 H HD1  . PHE   A 1 35 ? 10.191  -5.414  -2.176 1.00 0.45 ?  35 PHE   A HD1  10 
ATOM   5925 H HD2  . PHE   A 1 35 ? 9.698   -2.384  -5.121 1.00 0.40 ?  35 PHE   A HD2  10 
ATOM   5926 H HE1  . PHE   A 1 35 ? 12.578  -4.853  -1.992 1.00 0.59 ?  35 PHE   A HE1  10 
ATOM   5927 H HE2  . PHE   A 1 35 ? 12.087  -1.820  -4.945 1.00 0.54 ?  35 PHE   A HE2  10 
ATOM   5928 H HZ   . PHE   A 1 35 ? 13.528  -3.057  -3.381 1.00 0.60 ?  35 PHE   A HZ   10 
ATOM   5929 N N    . VAL   A 1 36 ? 5.271   -4.560  -2.966 1.00 0.12 ?  36 VAL   A N    10 
ATOM   5930 C CA   . VAL   A 1 36 ? 3.934   -4.818  -3.466 1.00 0.17 ?  36 VAL   A CA   10 
ATOM   5931 C C    . VAL   A 1 36 ? 2.884   -4.219  -2.546 1.00 0.15 ?  36 VAL   A C    10 
ATOM   5932 O O    . VAL   A 1 36 ? 2.823   -4.545  -1.368 1.00 0.17 ?  36 VAL   A O    10 
ATOM   5933 C CB   . VAL   A 1 36 ? 3.676   -6.332  -3.619 1.00 0.23 ?  36 VAL   A CB   10 
ATOM   5934 C CG1  . VAL   A 1 36 ? 2.237   -6.602  -4.039 1.00 0.32 ?  36 VAL   A CG1  10 
ATOM   5935 C CG2  . VAL   A 1 36 ? 4.638   -6.937  -4.627 1.00 0.25 ?  36 VAL   A CG2  10 
ATOM   5936 H H    . VAL   A 1 36 ? 5.642   -5.143  -2.270 1.00 0.17 ?  36 VAL   A H    10 
ATOM   5937 H HA   . VAL   A 1 36 ? 3.848   -4.360  -4.438 1.00 0.20 ?  36 VAL   A HA   10 
ATOM   5938 H HB   . VAL   A 1 36 ? 3.847   -6.803  -2.663 1.00 0.24 ?  36 VAL   A HB   10 
ATOM   5939 H HG11 . VAL   A 1 36 ? 2.044   -6.121  -4.986 1.00 1.12 ?  36 VAL   A HG11 10 
ATOM   5940 H HG12 . VAL   A 1 36 ? 1.563   -6.209  -3.291 1.00 1.04 ?  36 VAL   A HG12 10 
ATOM   5941 H HG13 . VAL   A 1 36 ? 2.085   -7.665  -4.139 1.00 1.00 ?  36 VAL   A HG13 10 
ATOM   5942 H HG21 . VAL   A 1 36 ? 5.651   -6.685  -4.353 1.00 1.04 ?  36 VAL   A HG21 10 
ATOM   5943 H HG22 . VAL   A 1 36 ? 4.421   -6.547  -5.609 1.00 0.94 ?  36 VAL   A HG22 10 
ATOM   5944 H HG23 . VAL   A 1 36 ? 4.523   -8.011  -4.632 1.00 1.08 ?  36 VAL   A HG23 10 
ATOM   5945 N N    . CYS   A 1 37 ? 2.068   -3.341  -3.089 1.00 0.15 ?  37 CYS   A N    10 
ATOM   5946 C CA   . CYS   A 1 37 ? 0.975   -2.750  -2.336 1.00 0.14 ?  37 CYS   A CA   10 
ATOM   5947 C C    . CYS   A 1 37 ? -0.185  -3.738  -2.281 1.00 0.12 ?  37 CYS   A C    10 
ATOM   5948 O O    . CYS   A 1 37 ? -0.904  -3.922  -3.268 1.00 0.18 ?  37 CYS   A O    10 
ATOM   5949 C CB   . CYS   A 1 37 ? 0.542   -1.436  -2.995 1.00 0.16 ?  37 CYS   A CB   10 
ATOM   5950 S SG   . CYS   A 1 37 ? -0.869  -0.607  -2.196 1.00 0.14 ?  37 CYS   A SG   10 
ATOM   5951 H H    . CYS   A 1 37 ? 2.194   -3.086  -4.028 1.00 0.16 ?  37 CYS   A H    10 
ATOM   5952 H HA   . CYS   A 1 37 ? 1.322   -2.555  -1.333 1.00 0.14 ?  37 CYS   A HA   10 
ATOM   5953 H HB2  . CYS   A 1 37 ? 1.374   -0.747  -2.983 1.00 0.20 ?  37 CYS   A HB2  10 
ATOM   5954 H HB3  . CYS   A 1 37 ? 0.264   -1.638  -4.020 1.00 0.18 ?  37 CYS   A HB3  10 
ATOM   5955 N N    . LYS   A 1 38 ? -0.349  -4.396  -1.139 1.00 0.10 ?  38 LYS   A N    10 
ATOM   5956 C CA   . LYS   A 1 38 ? -1.345  -5.444  -1.019 1.00 0.11 ?  38 LYS   A CA   10 
ATOM   5957 C C    . LYS   A 1 38 ? -2.559  -4.952  -0.251 1.00 0.11 ?  38 LYS   A C    10 
ATOM   5958 O O    . LYS   A 1 38 ? -2.483  -4.670  0.948  1.00 0.12 ?  38 LYS   A O    10 
ATOM   5959 C CB   . LYS   A 1 38 ? -0.767  -6.680  -0.331 1.00 0.15 ?  38 LYS   A CB   10 
ATOM   5960 C CG   . LYS   A 1 38 ? -1.699  -7.879  -0.404 1.00 0.26 ?  38 LYS   A CG   10 
ATOM   5961 C CD   . LYS   A 1 38 ? -1.207  -9.054  0.426  1.00 0.70 ?  38 LYS   A CD   10 
ATOM   5962 C CE   . LYS   A 1 38 ? 0.120   -9.601  -0.076 1.00 1.19 ?  38 LYS   A CE   10 
ATOM   5963 N NZ   . LYS   A 1 38 ? 0.559   -10.775 0.722  1.00 2.16 1  38 LYS   A NZ   10 
ATOM   5964 H H    . LYS   A 1 38 ? 0.194   -4.150  -0.354 1.00 0.13 ?  38 LYS   A H    10 
ATOM   5965 H HA   . LYS   A 1 38 ? -1.657  -5.714  -2.016 1.00 0.12 ?  38 LYS   A HA   10 
ATOM   5966 H HB2  . LYS   A 1 38 ? 0.171   -6.940  -0.798 1.00 0.14 ?  38 LYS   A HB2  10 
ATOM   5967 H HB3  . LYS   A 1 38 ? -0.595  -6.450  0.711  1.00 0.19 ?  38 LYS   A HB3  10 
ATOM   5968 H HG2  . LYS   A 1 38 ? -2.665  -7.580  -0.039 1.00 0.63 ?  38 LYS   A HG2  10 
ATOM   5969 H HG3  . LYS   A 1 38 ? -1.789  -8.190  -1.433 1.00 0.69 ?  38 LYS   A HG3  10 
ATOM   5970 H HD2  . LYS   A 1 38 ? -1.084  -8.729  1.448  1.00 1.20 ?  38 LYS   A HD2  10 
ATOM   5971 H HD3  . LYS   A 1 38 ? -1.947  -9.840  0.387  1.00 1.36 ?  38 LYS   A HD3  10 
ATOM   5972 H HE2  . LYS   A 1 38 ? 0.008   -9.896  -1.108 1.00 1.63 ?  38 LYS   A HE2  10 
ATOM   5973 H HE3  . LYS   A 1 38 ? 0.868   -8.827  -0.002 1.00 1.57 ?  38 LYS   A HE3  10 
ATOM   5974 H HZ1  . LYS   A 1 38 ? 0.607   -10.523 1.732  1.00 2.60 ?  38 LYS   A HZ1  10 
ATOM   5975 H HZ2  . LYS   A 1 38 ? 1.499   -11.090 0.412  1.00 2.57 ?  38 LYS   A HZ2  10 
ATOM   5976 H HZ3  . LYS   A 1 38 ? -0.112  -11.560 0.606  1.00 2.71 ?  38 LYS   A HZ3  10 
ATOM   5977 N N    . CYS   A 1 39 ? -3.677  -4.878  -0.944 1.00 0.12 ?  39 CYS   A N    10 
ATOM   5978 C CA   . CYS   A 1 39 ? -4.906  -4.387  -0.359 1.00 0.12 ?  39 CYS   A CA   10 
ATOM   5979 C C    . CYS   A 1 39 ? -5.642  -5.508  0.357  1.00 0.15 ?  39 CYS   A C    10 
ATOM   5980 O O    . CYS   A 1 39 ? -5.603  -6.665  -0.068 1.00 0.19 ?  39 CYS   A O    10 
ATOM   5981 C CB   . CYS   A 1 39 ? -5.796  -3.783  -1.440 1.00 0.13 ?  39 CYS   A CB   10 
ATOM   5982 S SG   . CYS   A 1 39 ? -4.950  -2.568  -2.499 1.00 0.14 ?  39 CYS   A SG   10 
ATOM   5983 H H    . CYS   A 1 39 ? -3.676  -5.171  -1.879 1.00 0.16 ?  39 CYS   A H    10 
ATOM   5984 H HA   . CYS   A 1 39 ? -4.653  -3.623  0.357  1.00 0.11 ?  39 CYS   A HA   10 
ATOM   5985 H HB2  . CYS   A 1 39 ? -6.168  -4.573  -2.075 1.00 0.15 ?  39 CYS   A HB2  10 
ATOM   5986 H HB3  . CYS   A 1 39 ? -6.631  -3.280  -0.968 1.00 0.15 ?  39 CYS   A HB3  10 
ATOM   5987 N N    . TYR   A 1 40 ? -6.310  -5.162  1.441  1.00 0.18 ?  40 TYR   A N    10 
ATOM   5988 C CA   . TYR   A 1 40 ? -7.060  -6.130  2.221  1.00 0.25 ?  40 TYR   A CA   10 
ATOM   5989 C C    . TYR   A 1 40 ? -8.379  -5.521  2.684  1.00 0.32 ?  40 TYR   A C    10 
ATOM   5990 O O    . TYR   A 1 40 ? -8.439  -4.350  3.066  1.00 0.88 ?  40 TYR   A O    10 
ATOM   5991 C CB   . TYR   A 1 40 ? -6.234  -6.631  3.415  1.00 0.27 ?  40 TYR   A CB   10 
ATOM   5992 C CG   . TYR   A 1 40 ? -5.792  -5.552  4.381  1.00 0.25 ?  40 TYR   A CG   10 
ATOM   5993 C CD1  . TYR   A 1 40 ? -4.597  -4.871  4.189  1.00 0.22 ?  40 TYR   A CD1  10 
ATOM   5994 C CD2  . TYR   A 1 40 ? -6.562  -5.225  5.490  1.00 0.32 ?  40 TYR   A CD2  10 
ATOM   5995 C CE1  . TYR   A 1 40 ? -4.184  -3.895  5.075  1.00 0.25 ?  40 TYR   A CE1  10 
ATOM   5996 C CE2  . TYR   A 1 40 ? -6.156  -4.248  6.379  1.00 0.35 ?  40 TYR   A CE2  10 
ATOM   5997 C CZ   . TYR   A 1 40 ? -4.965  -3.587  6.167  1.00 0.31 ?  40 TYR   A CZ   10 
ATOM   5998 O OH   . TYR   A 1 40 ? -4.554  -2.615  7.050  1.00 0.37 ?  40 TYR   A OH   10 
ATOM   5999 H H    . TYR   A 1 40 ? -6.302  -4.220  1.729  1.00 0.18 ?  40 TYR   A H    10 
ATOM   6000 H HA   . TYR   A 1 40 ? -7.278  -6.966  1.575  1.00 0.31 ?  40 TYR   A HA   10 
ATOM   6001 H HB2  . TYR   A 1 40 ? -6.821  -7.345  3.973  1.00 0.32 ?  40 TYR   A HB2  10 
ATOM   6002 H HB3  . TYR   A 1 40 ? -5.346  -7.123  3.043  1.00 0.28 ?  40 TYR   A HB3  10 
ATOM   6003 H HD1  . TYR   A 1 40 ? -3.989  -5.111  3.330  1.00 0.22 ?  40 TYR   A HD1  10 
ATOM   6004 H HD2  . TYR   A 1 40 ? -7.497  -5.746  5.651  1.00 0.36 ?  40 TYR   A HD2  10 
ATOM   6005 H HE1  . TYR   A 1 40 ? -3.252  -3.377  4.908  1.00 0.26 ?  40 TYR   A HE1  10 
ATOM   6006 H HE2  . TYR   A 1 40 ? -6.768  -4.008  7.234  1.00 0.41 ?  40 TYR   A HE2  10 
ATOM   6007 H HH   . TYR   A 1 40 ? -4.697  -2.926  7.954  1.00 1.13 ?  40 TYR   A HH   10 
HETATM 6008 N N    . NH2   A 1 41 ? -9.439  -6.301  2.619  1.00 0.59 ?  41 NH2   A N    10 
HETATM 6009 H HN1  . NH2   A 1 41 ? -9.316  -7.224  2.302  1.00 1.06 ?  41 NH2   A HN1  10 
HETATM 6010 H HN2  . NH2   A 1 41 ? -10.303 -5.934  2.899  1.00 0.56 ?  41 NH2   A HN2  10 
# 
