data_2MI1
# 
_entry.id   2MI1 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.399 
_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   2MI1         pdb_00002mi1 10.2210/pdb2mi1/pdb 
RCSB  RCSB103638   ?            ?                   
BMRB  19663        ?            10.13018/BMR19663   
WWPDB D_1000103638 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2014-05-07 
2 'Structure model' 1 1 2019-08-28 
3 'Structure model' 1 2 2023-06-14 
4 'Structure model' 1 3 2023-11-15 
5 'Structure model' 1 4 2024-11-20 
# 
_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' 'Data collection'      
2 2 'Structure model' 'Database references'  
3 2 'Structure model' 'Derived calculations' 
4 3 'Structure model' 'Database references'  
5 3 'Structure model' Other                  
6 4 'Structure model' 'Data collection'      
7 4 'Structure model' 'Derived calculations' 
8 5 'Structure model' 'Database references'  
9 5 'Structure model' 'Structure summary'    
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1  2 'Structure model' citation                  
2  2 'Structure model' citation_author           
3  2 'Structure model' pdbx_nmr_software         
4  2 'Structure model' pdbx_nmr_spectrometer     
5  2 'Structure model' struct_conn               
6  3 'Structure model' database_2                
7  3 'Structure model' pdbx_database_status      
8  4 'Structure model' chem_comp_atom            
9  4 'Structure model' chem_comp_bond            
10 4 'Structure model' struct_conn               
11 4 'Structure model' struct_conn_type          
12 5 'Structure model' database_2                
13 5 'Structure model' pdbx_entry_details        
14 5 'Structure model' pdbx_modification_feature 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1  2 'Structure model' '_citation.journal_volume'                   
2  2 'Structure model' '_citation.page_first'                       
3  2 'Structure model' '_citation.page_last'                        
4  2 'Structure model' '_citation.pdbx_database_id_PubMed'          
5  2 'Structure model' '_citation.title'                            
6  2 'Structure model' '_citation_author.name'                      
7  2 'Structure model' '_pdbx_nmr_software.name'                    
8  2 'Structure model' '_pdbx_nmr_spectrometer.model'               
9  2 'Structure model' '_struct_conn.pdbx_leaving_atom_flag'        
10 3 'Structure model' '_database_2.pdbx_DOI'                       
11 3 'Structure model' '_database_2.pdbx_database_accession'        
12 3 'Structure model' '_pdbx_database_status.status_code_nmr_data' 
13 5 'Structure model' '_database_2.pdbx_DOI'                       
# 
_pdbx_database_status.deposit_site                    BMRB 
_pdbx_database_status.entry_id                        2MI1 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.recvd_initial_deposition_date   2013-12-08 
_pdbx_database_status.SG_entry                        ? 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_mr                  REL 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_cs                  REL 
_pdbx_database_status.pdb_format_compatible           Y 
_pdbx_database_status.status_code_nmr_data            REL 
# 
_pdbx_database_related.db_id          19663 
_pdbx_database_related.db_name        BMRB 
_pdbx_database_related.content_type   unspecified 
_pdbx_database_related.details        . 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Anoop, A.'       1 
'Ranganathan, S.' 2 
'Pratihar, S.'    3 
# 
_citation.id                        primary 
_citation.title                     
;Elucidating the role of disulfide bond on amyloid formation and fibril reversibility of somatostatin-14: relevance to its storage and secretion.
;
_citation.journal_abbrev            J.Biol.Chem. 
_citation.journal_volume            289 
_citation.page_first                16884 
_citation.page_last                 16903 
_citation.year                      2014 
_citation.journal_id_ASTM           JBCHA3 
_citation.country                   US 
_citation.journal_id_ISSN           1083-351X 
_citation.journal_id_CSD            0071 
_citation.book_publisher            ? 
_citation.pdbx_database_id_PubMed   24782311 
_citation.pdbx_database_id_DOI      10.1074/jbc.M114.548354 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Anoop, A.'        1  ? 
primary 'Ranganathan, S.'  2  ? 
primary 'Das Dhaked, B.'   3  ? 
primary 'Jha, N.N.'        4  ? 
primary 'Pratihar, S.'     5  ? 
primary 'Ghosh, S.'        6  ? 
primary 'Sahay, S.'        7  ? 
primary 'Kumar, S.'        8  ? 
primary 'Das, S.'          9  ? 
primary 'Kombrabail, M.'   10 ? 
primary 'Agarwal, K.'      11 ? 
primary 'Jacob, R.S.'      12 ? 
primary 'Singru, P.'       13 ? 
primary 'Bhaumik, P.'      14 ? 
primary 'Padinhateeri, R.' 15 ? 
primary 'Kumar, A.'        16 ? 
primary 'Maji, S.K.'       17 ? 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 syn 
_entity.pdbx_description           Somatostatin-14 
_entity.formula_weight             1641.909 
_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                   no 
_entity_poly.pdbx_seq_one_letter_code       AGCKNFFWKTFTSC 
_entity_poly.pdbx_seq_one_letter_code_can   AGCKNFFWKTFTSC 
_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  ALA n 
1 2  GLY n 
1 3  CYS n 
1 4  LYS n 
1 5  ASN n 
1 6  PHE n 
1 7  PHE n 
1 8  TRP n 
1 9  LYS n 
1 10 THR n 
1 11 PHE n 
1 12 THR n 
1 13 SER n 
1 14 CYS 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       ? 
_pdbx_entity_src_syn.pdbx_end_seq_num       ? 
_pdbx_entity_src_syn.organism_scientific    'Homo sapiens' 
_pdbx_entity_src_syn.organism_common_name   human 
_pdbx_entity_src_syn.ncbi_taxonomy_id       9606 
_pdbx_entity_src_syn.details                'The peptide was chemically synthesized.' 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE       ? 'C3 H7 N O2'     89.093  
ASN 'L-peptide linking' y ASPARAGINE    ? 'C4 H8 N2 O3'    132.118 
CYS 'L-peptide linking' y CYSTEINE      ? 'C3 H7 N O2 S'   121.158 
GLY 'peptide linking'   y GLYCINE       ? 'C2 H5 N O2'     75.067  
LYS 'L-peptide linking' y LYSINE        ? 'C6 H15 N2 O2 1' 147.195 
PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2'    165.189 
SER 'L-peptide linking' y SERINE        ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE     ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN    ? 'C11 H12 N2 O2'  204.225 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  ALA 1  1  1  ALA ALA A . n 
A 1 2  GLY 2  2  2  GLY GLY A . n 
A 1 3  CYS 3  3  3  CYS CYS A . n 
A 1 4  LYS 4  4  4  LYS LYS A . n 
A 1 5  ASN 5  5  5  ASN ASN A . n 
A 1 6  PHE 6  6  6  PHE PHE A . n 
A 1 7  PHE 7  7  7  PHE PHE A . n 
A 1 8  TRP 8  8  8  TRP TRP A . n 
A 1 9  LYS 9  9  9  LYS LYS A . n 
A 1 10 THR 10 10 10 THR THR A . n 
A 1 11 PHE 11 11 11 PHE PHE A . n 
A 1 12 THR 12 12 12 THR THR A . n 
A 1 13 SER 13 13 13 SER SER A . n 
A 1 14 CYS 14 14 14 CYS CYS A . n 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.crystals_number            ? 
_exptl.details                    ? 
_exptl.entry_id                   2MI1 
_exptl.method                     'SOLUTION NMR' 
_exptl.method_details             ? 
# 
_struct.entry_id                  2MI1 
_struct.title                     'Somatostatin-14 solution structure in 5% D-mannitol' 
_struct.pdbx_model_details        'closest to the average, model1' 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        2MI1 
_struct_keywords.pdbx_keywords   PEPTIDE 
_struct_keywords.text            hormone 
# 
_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                    SMS_HUMAN 
_struct_ref.pdbx_db_accession          P61278 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   AGCKNFFWKTFTSC 
_struct_ref.pdbx_align_begin           103 
_struct_ref.pdbx_db_isoform            ? 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              2MI1 
_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                 14 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P61278 
_struct_ref_seq.db_align_beg                  103 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  116 
_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       14 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_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_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
_struct_conn.id                            disulf1 
_struct_conn.conn_type_id                  disulf 
_struct_conn.pdbx_leaving_atom_flag        ? 
_struct_conn.pdbx_PDB_id                   ? 
_struct_conn.ptnr1_label_asym_id           A 
_struct_conn.ptnr1_label_comp_id           CYS 
_struct_conn.ptnr1_label_seq_id            3 
_struct_conn.ptnr1_label_atom_id           SG 
_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                1_555 
_struct_conn.ptnr2_label_asym_id           A 
_struct_conn.ptnr2_label_comp_id           CYS 
_struct_conn.ptnr2_label_seq_id            14 
_struct_conn.ptnr2_label_atom_id           SG 
_struct_conn.pdbx_ptnr2_label_alt_id       ? 
_struct_conn.pdbx_ptnr2_PDB_ins_code       ? 
_struct_conn.ptnr1_auth_asym_id            A 
_struct_conn.ptnr1_auth_comp_id            CYS 
_struct_conn.ptnr1_auth_seq_id             3 
_struct_conn.ptnr2_auth_asym_id            A 
_struct_conn.ptnr2_auth_comp_id            CYS 
_struct_conn.ptnr2_auth_seq_id             14 
_struct_conn.ptnr2_symmetry                1_555 
_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               2.027 
_struct_conn.pdbx_value_order              ? 
_struct_conn.pdbx_role                     ? 
# 
_struct_conn_type.id          disulf 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      CYS 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       3 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     CYS 
_pdbx_modification_feature.modified_residue_label_asym_id     A 
_pdbx_modification_feature.modified_residue_label_seq_id      14 
_pdbx_modification_feature.modified_residue_label_alt_id      ? 
_pdbx_modification_feature.auth_comp_id                       CYS 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        3 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      CYS 
_pdbx_modification_feature.modified_residue_auth_asym_id      A 
_pdbx_modification_feature.modified_residue_auth_seq_id       14 
_pdbx_modification_feature.modified_residue_PDB_ins_code      ? 
_pdbx_modification_feature.modified_residue_symmetry          1_555 
_pdbx_modification_feature.comp_id_linking_atom               SG 
_pdbx_modification_feature.modified_residue_id_linking_atom   SG 
_pdbx_modification_feature.modified_residue_id                . 
_pdbx_modification_feature.ref_pcm_id                         . 
_pdbx_modification_feature.ref_comp_id                        . 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Disulfide bridge' 
# 
_pdbx_entry_details.entry_id                   2MI1 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_ligand_of_interest     ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 5 HG A CYS 3 ? ? HG23 A THR 12 ? ? 1.33 
2 8 HG A CYS 3 ? ? OG1  A THR 12 ? ? 1.51 
# 
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  CYS A 3  ? ? 63.30   108.23  
2  1  ASN A 5  ? ? -44.87  153.10  
3  1  PHE A 6  ? ? 73.44   174.78  
4  1  TRP A 8  ? ? -156.00 -77.44  
5  1  LYS A 9  ? ? -144.73 40.04   
6  1  THR A 10 ? ? 49.25   22.67   
7  1  SER A 13 ? ? 70.57   -150.64 
8  2  ASN A 5  ? ? -41.24  161.38  
9  2  PHE A 6  ? ? 73.37   177.85  
10 2  PHE A 7  ? ? 36.84   39.79   
11 2  TRP A 8  ? ? -153.08 -77.14  
12 2  LYS A 9  ? ? -147.84 40.16   
13 2  THR A 10 ? ? 47.93   23.60   
14 2  SER A 13 ? ? 62.69   -174.46 
15 3  ASN A 5  ? ? -39.76  156.45  
16 3  PHE A 7  ? ? -156.43 43.25   
17 3  TRP A 8  ? ? -176.40 -76.58  
18 3  LYS A 9  ? ? -145.50 45.87   
19 3  THR A 10 ? ? 81.18   -49.81  
20 3  PHE A 11 ? ? -51.91  -172.97 
21 4  ASN A 5  ? ? -39.83  157.95  
22 4  PHE A 7  ? ? -156.80 43.22   
23 4  TRP A 8  ? ? -176.40 -76.50  
24 4  LYS A 9  ? ? -145.48 45.77   
25 4  THR A 10 ? ? 81.24   -49.81  
26 4  PHE A 11 ? ? -51.94  -172.98 
27 5  LYS A 4  ? ? -164.10 94.21   
28 5  ASN A 5  ? ? -44.50  167.44  
29 5  PHE A 7  ? ? -155.44 43.34   
30 5  TRP A 8  ? ? -176.48 -76.58  
31 5  LYS A 9  ? ? -147.21 46.41   
32 5  THR A 10 ? ? 80.67   -50.64  
33 5  PHE A 11 ? ? -51.41  -174.22 
34 6  CYS A 3  ? ? 64.80   171.16  
35 6  LYS A 4  ? ? -173.01 136.66  
36 6  PHE A 7  ? ? -154.64 43.69   
37 6  TRP A 8  ? ? -174.95 -75.17  
38 6  LYS A 9  ? ? -152.46 50.58   
39 6  THR A 10 ? ? 79.65   -51.80  
40 6  PHE A 11 ? ? -50.16  -177.39 
41 6  SER A 13 ? ? 57.99   -172.47 
42 7  CYS A 3  ? ? 77.45   141.11  
43 7  LYS A 4  ? ? 179.76  115.23  
44 7  ASN A 5  ? ? -39.80  158.24  
45 7  PHE A 7  ? ? -156.69 41.45   
46 7  TRP A 8  ? ? -171.65 -75.96  
47 7  LYS A 9  ? ? -145.83 42.35   
48 7  THR A 10 ? ? 82.19   -48.63  
49 7  PHE A 11 ? ? -52.73  -171.04 
50 7  SER A 13 ? ? 55.11   -174.34 
51 8  ASN A 5  ? ? -39.68  157.03  
52 8  PHE A 7  ? ? -155.01 43.62   
53 8  TRP A 8  ? ? -176.26 -76.81  
54 8  LYS A 9  ? ? -145.38 45.59   
55 8  THR A 10 ? ? 81.41   -49.84  
56 8  PHE A 11 ? ? -51.95  -172.86 
57 9  CYS A 3  ? ? 64.55   155.84  
58 9  ASN A 5  ? ? -41.74  154.15  
59 9  PHE A 6  ? ? 73.69   155.98  
60 9  TRP A 8  ? ? -161.42 -80.22  
61 9  LYS A 9  ? ? -151.27 33.03   
62 9  THR A 10 ? ? 75.93   -54.58  
63 9  PHE A 11 ? ? -51.47  -174.07 
64 9  SER A 13 ? ? 75.90   -158.35 
65 10 CYS A 3  ? ? 61.07   156.06  
66 10 LYS A 4  ? ? -174.38 127.29  
67 10 PHE A 7  ? ? -154.76 43.62   
68 10 TRP A 8  ? ? -175.83 -75.36  
69 10 LYS A 9  ? ? -152.55 51.12   
70 10 THR A 10 ? ? 79.27   -51.99  
71 10 PHE A 11 ? ? -50.06  -177.61 
# 
_pdbx_molecule_features.prd_id    PRD_001216 
_pdbx_molecule_features.name      Somatostatin-14 
_pdbx_molecule_features.type      'Cyclic peptide' 
_pdbx_molecule_features.class     Inhibitor 
_pdbx_molecule_features.details   ? 
# 
_pdbx_molecule.instance_id   1 
_pdbx_molecule.prd_id        PRD_001216 
_pdbx_molecule.asym_id       A 
# 
_pdbx_nmr_ensemble.average_constraint_violations_per_residue     ? 
_pdbx_nmr_ensemble.average_constraints_per_residue               ? 
_pdbx_nmr_ensemble.average_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.average_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.conformer_selection_criteria                  'all calculated structures submitted' 
_pdbx_nmr_ensemble.conformers_calculated_total_number            10 
_pdbx_nmr_ensemble.conformers_submitted_total_number             10 
_pdbx_nmr_ensemble.distance_constraint_violation_method          ? 
_pdbx_nmr_ensemble.entry_id                                      2MI1 
_pdbx_nmr_ensemble.maximum_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.representative_conformer                      1 
_pdbx_nmr_ensemble.torsion_angle_constraint_violation_method     ? 
# 
_pdbx_nmr_representative.conformer_id         1 
_pdbx_nmr_representative.entry_id             2MI1 
_pdbx_nmr_representative.selection_criteria   'closest to the average' 
# 
_pdbx_nmr_sample_details.contents         '90 % H2O-1, 10 % D2O-2, 5 w/v D-mannitol-3, 90% H2O/10% D2O' 
_pdbx_nmr_sample_details.solution_id      1 
_pdbx_nmr_sample_details.solvent_system   '90% H2O/10% D2O' 
# 
loop_
_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 
_pdbx_nmr_exptl_sample.solution_id 
H2O-1        90 ? %   ? 1 
D2O-2        10 ? %   ? 1 
D-mannitol-3 5  ? w/v ? 1 
# 
_pdbx_nmr_exptl_sample_conditions.conditions_id       1 
_pdbx_nmr_exptl_sample_conditions.ionic_strength      ? 
_pdbx_nmr_exptl_sample_conditions.pH                  5.6 
_pdbx_nmr_exptl_sample_conditions.pressure            ambient 
_pdbx_nmr_exptl_sample_conditions.pressure_units      ? 
_pdbx_nmr_exptl_sample_conditions.temperature         298 
_pdbx_nmr_exptl_sample_conditions.temperature_units   K 
# 
loop_
_pdbx_nmr_exptl.conditions_id 
_pdbx_nmr_exptl.experiment_id 
_pdbx_nmr_exptl.solution_id 
_pdbx_nmr_exptl.type 
1 1 1 '2D 1H-1H TOCSY' 
1 2 1 '2D 1H-1H NOESY' 
# 
_pdbx_nmr_constraints.disulfide_bond_constraints_total_count        ? 
_pdbx_nmr_constraints.entry_id                                      2MI1 
_pdbx_nmr_constraints.hydrogen_bond_constraints_total_count         ? 
_pdbx_nmr_constraints.NA_alpha-angle_constraints_total_count        ? 
_pdbx_nmr_constraints.NA_beta-angle_constraints_total_count         ? 
_pdbx_nmr_constraints.NA_chi-angle_constraints_total_count          ? 
_pdbx_nmr_constraints.NA_delta-angle_constraints_total_count        ? 
_pdbx_nmr_constraints.NA_epsilon-angle_constraints_total_count      ? 
_pdbx_nmr_constraints.NA_gamma-angle_constraints_total_count        ? 
_pdbx_nmr_constraints.NA_other-angle_constraints_total_count        ? 
_pdbx_nmr_constraints.NA_sugar_pucker_constraints_total_count       ? 
_pdbx_nmr_constraints.NOE_constraints_total                         70 
_pdbx_nmr_constraints.NOE_interentity_total_count                   ? 
_pdbx_nmr_constraints.NOE_interproton_distance_evaluation           ? 
_pdbx_nmr_constraints.NOE_intraresidue_total_count                  ? 
_pdbx_nmr_constraints.NOE_long_range_total_count                    ? 
_pdbx_nmr_constraints.NOE_medium_range_total_count                  ? 
_pdbx_nmr_constraints.NOE_motional_averaging_correction             ? 
_pdbx_nmr_constraints.NOE_pseudoatom_corrections                    ? 
_pdbx_nmr_constraints.NOE_sequential_total_count                    ? 
_pdbx_nmr_constraints.protein_chi_angle_constraints_total_count     6 
_pdbx_nmr_constraints.protein_other_angle_constraints_total_count   8 
_pdbx_nmr_constraints.protein_phi_angle_constraints_total_count     25 
_pdbx_nmr_constraints.protein_psi_angle_constraints_total_count     8 
# 
_pdbx_nmr_refine.entry_id           2MI1 
_pdbx_nmr_refine.method             'simulated annealing' 
_pdbx_nmr_refine.details            ? 
_pdbx_nmr_refine.software_ordinal   1 
# 
loop_
_pdbx_nmr_software.authors 
_pdbx_nmr_software.classification 
_pdbx_nmr_software.name 
_pdbx_nmr_software.ordinal 
_pdbx_nmr_software.version 
'Guntert, Mumenthaler and Wuthrich' 'structure solution'        CYANA  1 2.1   
Goddard                             'chemical shift assignment' Sparky 2 3.114 
?                                   refinement                  CYANA  3 ?     
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ASN N    N N N 14  
ASN CA   C N S 15  
ASN C    C N N 16  
ASN O    O N N 17  
ASN CB   C N N 18  
ASN CG   C N N 19  
ASN OD1  O N N 20  
ASN ND2  N N N 21  
ASN OXT  O N N 22  
ASN H    H N N 23  
ASN H2   H N N 24  
ASN HA   H N N 25  
ASN HB2  H N N 26  
ASN HB3  H N N 27  
ASN HD21 H N N 28  
ASN HD22 H N N 29  
ASN HXT  H N N 30  
CYS N    N N N 31  
CYS CA   C N R 32  
CYS C    C N N 33  
CYS O    O N N 34  
CYS CB   C N N 35  
CYS SG   S N N 36  
CYS OXT  O N N 37  
CYS H    H N N 38  
CYS H2   H N N 39  
CYS HA   H N N 40  
CYS HB2  H N N 41  
CYS HB3  H N N 42  
CYS HG   H N N 43  
CYS HXT  H N N 44  
GLY N    N N N 45  
GLY CA   C N N 46  
GLY C    C N N 47  
GLY O    O N N 48  
GLY OXT  O N N 49  
GLY H    H N N 50  
GLY H2   H N N 51  
GLY HA2  H N N 52  
GLY HA3  H N N 53  
GLY HXT  H N N 54  
LYS N    N N N 55  
LYS CA   C N S 56  
LYS C    C N N 57  
LYS O    O N N 58  
LYS CB   C N N 59  
LYS CG   C N N 60  
LYS CD   C N N 61  
LYS CE   C N N 62  
LYS NZ   N N N 63  
LYS OXT  O N N 64  
LYS H    H N N 65  
LYS H2   H N N 66  
LYS HA   H N N 67  
LYS HB2  H N N 68  
LYS HB3  H N N 69  
LYS HG2  H N N 70  
LYS HG3  H N N 71  
LYS HD2  H N N 72  
LYS HD3  H N N 73  
LYS HE2  H N N 74  
LYS HE3  H N N 75  
LYS HZ1  H N N 76  
LYS HZ2  H N N 77  
LYS HZ3  H N N 78  
LYS HXT  H N N 79  
PHE N    N N N 80  
PHE CA   C N S 81  
PHE C    C N N 82  
PHE O    O N N 83  
PHE CB   C N N 84  
PHE CG   C Y N 85  
PHE CD1  C Y N 86  
PHE CD2  C Y N 87  
PHE CE1  C Y N 88  
PHE CE2  C Y N 89  
PHE CZ   C Y N 90  
PHE OXT  O N N 91  
PHE H    H N N 92  
PHE H2   H N N 93  
PHE HA   H N N 94  
PHE HB2  H N N 95  
PHE HB3  H N N 96  
PHE HD1  H N N 97  
PHE HD2  H N N 98  
PHE HE1  H N N 99  
PHE HE2  H N N 100 
PHE HZ   H N N 101 
PHE HXT  H N N 102 
SER N    N N N 103 
SER CA   C N S 104 
SER C    C N N 105 
SER O    O N N 106 
SER CB   C N N 107 
SER OG   O N N 108 
SER OXT  O N N 109 
SER H    H N N 110 
SER H2   H N N 111 
SER HA   H N N 112 
SER HB2  H N N 113 
SER HB3  H N N 114 
SER HG   H N N 115 
SER HXT  H N N 116 
THR N    N N N 117 
THR CA   C N S 118 
THR C    C N N 119 
THR O    O N N 120 
THR CB   C N R 121 
THR OG1  O N N 122 
THR CG2  C N N 123 
THR OXT  O N N 124 
THR H    H N N 125 
THR H2   H N N 126 
THR HA   H N N 127 
THR HB   H N N 128 
THR HG1  H N N 129 
THR HG21 H N N 130 
THR HG22 H N N 131 
THR HG23 H N N 132 
THR HXT  H N N 133 
TRP N    N N N 134 
TRP CA   C N S 135 
TRP C    C N N 136 
TRP O    O N N 137 
TRP CB   C N N 138 
TRP CG   C Y N 139 
TRP CD1  C Y N 140 
TRP CD2  C Y N 141 
TRP NE1  N Y N 142 
TRP CE2  C Y N 143 
TRP CE3  C Y N 144 
TRP CZ2  C Y N 145 
TRP CZ3  C Y N 146 
TRP CH2  C Y N 147 
TRP OXT  O N N 148 
TRP H    H N N 149 
TRP H2   H N N 150 
TRP HA   H N N 151 
TRP HB2  H N N 152 
TRP HB3  H N N 153 
TRP HD1  H N N 154 
TRP HE1  H N N 155 
TRP HE3  H N N 156 
TRP HZ2  H N N 157 
TRP HZ3  H N N 158 
TRP HH2  H N N 159 
TRP HXT  H N N 160 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ASN N   CA   sing N N 13  
ASN N   H    sing N N 14  
ASN N   H2   sing N N 15  
ASN CA  C    sing N N 16  
ASN CA  CB   sing N N 17  
ASN CA  HA   sing N N 18  
ASN C   O    doub N N 19  
ASN C   OXT  sing N N 20  
ASN CB  CG   sing N N 21  
ASN CB  HB2  sing N N 22  
ASN CB  HB3  sing N N 23  
ASN CG  OD1  doub N N 24  
ASN CG  ND2  sing N N 25  
ASN ND2 HD21 sing N N 26  
ASN ND2 HD22 sing N N 27  
ASN OXT HXT  sing N N 28  
CYS N   CA   sing N N 29  
CYS N   H    sing N N 30  
CYS N   H2   sing N N 31  
CYS CA  C    sing N N 32  
CYS CA  CB   sing N N 33  
CYS CA  HA   sing N N 34  
CYS C   O    doub N N 35  
CYS C   OXT  sing N N 36  
CYS CB  SG   sing N N 37  
CYS CB  HB2  sing N N 38  
CYS CB  HB3  sing N N 39  
CYS SG  HG   sing N N 40  
CYS OXT HXT  sing N N 41  
GLY N   CA   sing N N 42  
GLY N   H    sing N N 43  
GLY N   H2   sing N N 44  
GLY CA  C    sing N N 45  
GLY CA  HA2  sing N N 46  
GLY CA  HA3  sing N N 47  
GLY C   O    doub N N 48  
GLY C   OXT  sing N N 49  
GLY OXT HXT  sing N N 50  
LYS N   CA   sing N N 51  
LYS N   H    sing N N 52  
LYS N   H2   sing N N 53  
LYS CA  C    sing N N 54  
LYS CA  CB   sing N N 55  
LYS CA  HA   sing N N 56  
LYS C   O    doub N N 57  
LYS C   OXT  sing N N 58  
LYS CB  CG   sing N N 59  
LYS CB  HB2  sing N N 60  
LYS CB  HB3  sing N N 61  
LYS CG  CD   sing N N 62  
LYS CG  HG2  sing N N 63  
LYS CG  HG3  sing N N 64  
LYS CD  CE   sing N N 65  
LYS CD  HD2  sing N N 66  
LYS CD  HD3  sing N N 67  
LYS CE  NZ   sing N N 68  
LYS CE  HE2  sing N N 69  
LYS CE  HE3  sing N N 70  
LYS NZ  HZ1  sing N N 71  
LYS NZ  HZ2  sing N N 72  
LYS NZ  HZ3  sing N N 73  
LYS OXT HXT  sing N N 74  
PHE N   CA   sing N N 75  
PHE N   H    sing N N 76  
PHE N   H2   sing N N 77  
PHE CA  C    sing N N 78  
PHE CA  CB   sing N N 79  
PHE CA  HA   sing N N 80  
PHE C   O    doub N N 81  
PHE C   OXT  sing N N 82  
PHE CB  CG   sing N N 83  
PHE CB  HB2  sing N N 84  
PHE CB  HB3  sing N N 85  
PHE CG  CD1  doub Y N 86  
PHE CG  CD2  sing Y N 87  
PHE CD1 CE1  sing Y N 88  
PHE CD1 HD1  sing N N 89  
PHE CD2 CE2  doub Y N 90  
PHE CD2 HD2  sing N N 91  
PHE CE1 CZ   doub Y N 92  
PHE CE1 HE1  sing N N 93  
PHE CE2 CZ   sing Y N 94  
PHE CE2 HE2  sing N N 95  
PHE CZ  HZ   sing N N 96  
PHE OXT HXT  sing N N 97  
SER N   CA   sing N N 98  
SER N   H    sing N N 99  
SER N   H2   sing N N 100 
SER CA  C    sing N N 101 
SER CA  CB   sing N N 102 
SER CA  HA   sing N N 103 
SER C   O    doub N N 104 
SER C   OXT  sing N N 105 
SER CB  OG   sing N N 106 
SER CB  HB2  sing N N 107 
SER CB  HB3  sing N N 108 
SER OG  HG   sing N N 109 
SER OXT HXT  sing N N 110 
THR N   CA   sing N N 111 
THR N   H    sing N N 112 
THR N   H2   sing N N 113 
THR CA  C    sing N N 114 
THR CA  CB   sing N N 115 
THR CA  HA   sing N N 116 
THR C   O    doub N N 117 
THR C   OXT  sing N N 118 
THR CB  OG1  sing N N 119 
THR CB  CG2  sing N N 120 
THR CB  HB   sing N N 121 
THR OG1 HG1  sing N N 122 
THR CG2 HG21 sing N N 123 
THR CG2 HG22 sing N N 124 
THR CG2 HG23 sing N N 125 
THR OXT HXT  sing N N 126 
TRP N   CA   sing N N 127 
TRP N   H    sing N N 128 
TRP N   H2   sing N N 129 
TRP CA  C    sing N N 130 
TRP CA  CB   sing N N 131 
TRP CA  HA   sing N N 132 
TRP C   O    doub N N 133 
TRP C   OXT  sing N N 134 
TRP CB  CG   sing N N 135 
TRP CB  HB2  sing N N 136 
TRP CB  HB3  sing N N 137 
TRP CG  CD1  doub Y N 138 
TRP CG  CD2  sing Y N 139 
TRP CD1 NE1  sing Y N 140 
TRP CD1 HD1  sing N N 141 
TRP CD2 CE2  doub Y N 142 
TRP CD2 CE3  sing Y N 143 
TRP NE1 CE2  sing Y N 144 
TRP NE1 HE1  sing N N 145 
TRP CE2 CZ2  sing Y N 146 
TRP CE3 CZ3  doub Y N 147 
TRP CE3 HE3  sing N N 148 
TRP CZ2 CH2  doub Y N 149 
TRP CZ2 HZ2  sing N N 150 
TRP CZ3 CH2  sing Y N 151 
TRP CZ3 HZ3  sing N N 152 
TRP CH2 HH2  sing N N 153 
TRP OXT HXT  sing N N 154 
# 
_pdbx_nmr_spectrometer.field_strength    500 
_pdbx_nmr_spectrometer.manufacturer      Bruker 
_pdbx_nmr_spectrometer.model             AVANCE 
_pdbx_nmr_spectrometer.spectrometer_id   1 
_pdbx_nmr_spectrometer.type              'Bruker Avance' 
# 
_atom_sites.entry_id                    2MI1 
_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 
# 
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    . ALA A 1 1  ? 4.368  1.480  2.522   1.00 2.41  ? 1  ALA A N    1  
ATOM 2    C CA   . ALA A 1 1  ? 3.677  2.588  3.161   1.00 71.24 ? 1  ALA A CA   1  
ATOM 3    C C    . ALA A 1 1  ? 4.477  3.874  2.946   1.00 72.13 ? 1  ALA A C    1  
ATOM 4    O O    . ALA A 1 1  ? 3.920  4.970  2.990   1.00 40.35 ? 1  ALA A O    1  
ATOM 5    C CB   . ALA A 1 1  ? 3.468  2.271  4.644   1.00 63.24 ? 1  ALA A CB   1  
ATOM 6    H H1   . ALA A 1 1  ? 3.711  0.736  2.336   1.00 0.00  ? 1  ALA A H1   1  
ATOM 7    H H2   . ALA A 1 1  ? 4.775  1.795  1.652   1.00 0.00  ? 1  ALA A H2   1  
ATOM 8    H H3   . ALA A 1 1  ? 5.098  1.141  3.132   1.00 0.00  ? 1  ALA A H3   1  
ATOM 9    H HA   . ALA A 1 1  ? 2.701  2.705  2.691   1.00 0.00  ? 1  ALA A HA   1  
ATOM 10   H HB1  . ALA A 1 1  ? 2.950  3.101  5.124   1.00 0.00  ? 1  ALA A HB1  1  
ATOM 11   H HB2  . ALA A 1 1  ? 4.435  2.120  5.123   1.00 0.00  ? 1  ALA A HB2  1  
ATOM 12   H HB3  . ALA A 1 1  ? 2.870  1.365  4.741   1.00 0.00  ? 1  ALA A HB3  1  
ATOM 13   N N    . GLY A 1 2  ? 5.770  3.698  2.719   1.00 2.50  ? 2  GLY A N    1  
ATOM 14   C CA   . GLY A 1 2  ? 6.652  4.832  2.497   1.00 10.23 ? 2  GLY A CA   1  
ATOM 15   C C    . GLY A 1 2  ? 6.814  5.116  1.002   1.00 24.53 ? 2  GLY A C    1  
ATOM 16   O O    . GLY A 1 2  ? 6.784  4.196  0.186   1.00 33.44 ? 2  GLY A O    1  
ATOM 17   H H    . GLY A 1 2  ? 6.148  2.762  2.699   1.00 0.00  ? 2  GLY A H    1  
ATOM 18   H HA2  . GLY A 1 2  ? 6.231  5.712  2.983   1.00 0.00  ? 2  GLY A HA2  1  
ATOM 19   H HA3  . GLY A 1 2  ? 7.629  4.616  2.930   1.00 0.00  ? 2  GLY A HA3  1  
ATOM 20   N N    . CYS A 1 3  ? 6.983  6.392  0.690   1.00 22.13 ? 3  CYS A N    1  
ATOM 21   C CA   . CYS A 1 3  ? 7.150  6.808  -0.692  1.00 33.13 ? 3  CYS A CA   1  
ATOM 22   C C    . CYS A 1 3  ? 5.868  6.467  -1.455  1.00 25.21 ? 3  CYS A C    1  
ATOM 23   O O    . CYS A 1 3  ? 5.591  5.297  -1.717  1.00 42.12 ? 3  CYS A O    1  
ATOM 24   C CB   . CYS A 1 3  ? 8.383  6.166  -1.331  1.00 35.35 ? 3  CYS A CB   1  
ATOM 25   S SG   . CYS A 1 3  ? 9.958  6.497  -0.460  1.00 72.24 ? 3  CYS A SG   1  
ATOM 26   H H    . CYS A 1 3  ? 6.996  7.086  1.423   1.00 0.00  ? 3  CYS A H    1  
ATOM 27   H HA   . CYS A 1 3  ? 7.281  7.890  -0.709  1.00 0.00  ? 3  CYS A HA   1  
ATOM 28   H HB2  . CYS A 1 3  ? 8.230  5.087  -1.356  1.00 0.00  ? 3  CYS A HB2  1  
ATOM 29   H HB3  . CYS A 1 3  ? 8.471  6.528  -2.355  1.00 0.00  ? 3  CYS A HB3  1  
ATOM 30   H HG   . CYS A 1 3  ? 10.791 5.467  -0.637  1.00 0.00  ? 3  CYS A HG   1  
ATOM 31   N N    . LYS A 1 4  ? 5.123  7.508  -1.791  1.00 0.25  ? 4  LYS A N    1  
ATOM 32   C CA   . LYS A 1 4  ? 3.877  7.334  -2.519  1.00 34.42 ? 4  LYS A CA   1  
ATOM 33   C C    . LYS A 1 4  ? 3.866  8.266  -3.732  1.00 54.01 ? 4  LYS A C    1  
ATOM 34   O O    . LYS A 1 4  ? 3.606  9.461  -3.599  1.00 42.43 ? 4  LYS A O    1  
ATOM 35   C CB   . LYS A 1 4  ? 2.680  7.524  -1.586  1.00 5.13  ? 4  LYS A CB   1  
ATOM 36   C CG   . LYS A 1 4  ? 2.562  8.982  -1.136  1.00 70.21 ? 4  LYS A CG   1  
ATOM 37   C CD   . LYS A 1 4  ? 2.063  9.071  0.308   1.00 31.25 ? 4  LYS A CD   1  
ATOM 38   C CE   . LYS A 1 4  ? 1.868  10.528 0.732   1.00 64.13 ? 4  LYS A CE   1  
ATOM 39   N NZ   . LYS A 1 4  ? 2.508  10.776 2.043   1.00 4.25  ? 4  LYS A NZ   1  
ATOM 40   H H    . LYS A 1 4  ? 5.424  8.438  -1.538  1.00 0.00  ? 4  LYS A H    1  
ATOM 41   H HA   . LYS A 1 4  ? 3.850  6.309  -2.888  1.00 0.00  ? 4  LYS A HA   1  
ATOM 42   H HB2  . LYS A 1 4  ? 1.770  7.239  -2.113  1.00 0.00  ? 4  LYS A HB2  1  
ATOM 43   H HB3  . LYS A 1 4  ? 2.803  6.887  -0.711  1.00 0.00  ? 4  LYS A HB3  1  
ATOM 44   H HG2  . LYS A 1 4  ? 3.541  9.457  -1.205  1.00 0.00  ? 4  LYS A HG2  1  
ATOM 45   H HG3  . LYS A 1 4  ? 1.863  9.504  -1.790  1.00 0.00  ? 4  LYS A HG3  1  
ATOM 46   H HD2  . LYS A 1 4  ? 1.114  8.543  0.393   1.00 0.00  ? 4  LYS A HD2  1  
ATOM 47   H HD3  . LYS A 1 4  ? 2.795  8.604  0.967   1.00 0.00  ? 4  LYS A HD3  1  
ATOM 48   H HE2  . LYS A 1 4  ? 2.316  11.183 -0.016  1.00 0.00  ? 4  LYS A HE2  1  
ATOM 49   H HE3  . LYS A 1 4  ? 0.802  10.742 0.806   1.00 0.00  ? 4  LYS A HE3  1  
ATOM 50   H HZ1  . LYS A 1 4  ? 2.370  11.741 2.309   1.00 0.00  ? 4  LYS A HZ1  1  
ATOM 51   H HZ2  . LYS A 1 4  ? 2.094  10.173 2.740   1.00 0.00  ? 4  LYS A HZ2  1  
ATOM 52   H HZ3  . LYS A 1 4  ? 3.498  10.584 1.977   1.00 0.00  ? 4  LYS A HZ3  1  
ATOM 53   N N    . ASN A 1 5  ? 4.150  7.684  -4.888  1.00 63.00 ? 5  ASN A N    1  
ATOM 54   C CA   . ASN A 1 5  ? 4.176  8.448  -6.124  1.00 62.44 ? 5  ASN A CA   1  
ATOM 55   C C    . ASN A 1 5  ? 2.951  9.363  -6.178  1.00 74.20 ? 5  ASN A C    1  
ATOM 56   O O    . ASN A 1 5  ? 1.920  9.063  -5.580  1.00 50.24 ? 5  ASN A O    1  
ATOM 57   C CB   . ASN A 1 5  ? 4.130  7.524  -7.343  1.00 73.21 ? 5  ASN A CB   1  
ATOM 58   C CG   . ASN A 1 5  ? 2.854  6.679  -7.342  1.00 32.34 ? 5  ASN A CG   1  
ATOM 59   O OD1  . ASN A 1 5  ? 2.242  6.433  -6.317  1.00 22.21 ? 5  ASN A OD1  1  
ATOM 60   N ND2  . ASN A 1 5  ? 2.490  6.248  -8.547  1.00 0.22  ? 5  ASN A ND2  1  
ATOM 61   H H    . ASN A 1 5  ? 4.352  6.694  -4.911  1.00 0.00  ? 5  ASN A H    1  
ATOM 62   H HA   . ASN A 1 5  ? 5.083  9.051  -6.159  1.00 0.00  ? 5  ASN A HA   1  
ATOM 63   H HB2  . ASN A 1 5  ? 4.156  8.129  -8.249  1.00 0.00  ? 5  ASN A HB2  1  
ATOM 64   H HB3  . ASN A 1 5  ? 4.998  6.865  -7.326  1.00 0.00  ? 5  ASN A HB3  1  
ATOM 65   H HD21 . ASN A 1 5  ? 3.043  6.488  -9.357  1.00 0.00  ? 5  ASN A HD21 1  
ATOM 66   H HD22 . ASN A 1 5  ? 1.660  5.682  -8.651  1.00 0.00  ? 5  ASN A HD22 1  
ATOM 67   N N    . PHE A 1 6  ? 3.106  10.462 -6.901  1.00 71.41 ? 6  PHE A N    1  
ATOM 68   C CA   . PHE A 1 6  ? 2.026  11.424 -7.042  1.00 24.14 ? 6  PHE A CA   1  
ATOM 69   C C    . PHE A 1 6  ? 1.830  12.221 -5.750  1.00 11.15 ? 6  PHE A C    1  
ATOM 70   O O    . PHE A 1 6  ? 2.476  11.944 -4.741  1.00 21.01 ? 6  PHE A O    1  
ATOM 71   C CB   . PHE A 1 6  ? 0.752  10.628 -7.333  1.00 61.31 ? 6  PHE A CB   1  
ATOM 72   C CG   . PHE A 1 6  ? -0.208 11.323 -8.299  1.00 20.04 ? 6  PHE A CG   1  
ATOM 73   C CD1  . PHE A 1 6  ? 0.225  11.713 -9.527  1.00 64.52 ? 6  PHE A CD1  1  
ATOM 74   C CD2  . PHE A 1 6  ? -1.497 11.552 -7.928  1.00 1.22  ? 6  PHE A CD2  1  
ATOM 75   C CE1  . PHE A 1 6  ? -0.668 12.358 -10.423 1.00 15.24 ? 6  PHE A CE1  1  
ATOM 76   C CE2  . PHE A 1 6  ? -2.390 12.198 -8.824  1.00 64.02 ? 6  PHE A CE2  1  
ATOM 77   C CZ   . PHE A 1 6  ? -1.956 12.587 -10.054 1.00 13.52 ? 6  PHE A CZ   1  
ATOM 78   H H    . PHE A 1 6  ? 3.988  10.634 -7.362  1.00 0.00  ? 6  PHE A H    1  
ATOM 79   H HA   . PHE A 1 6  ? 2.238  12.103 -7.868  1.00 0.00  ? 6  PHE A HA   1  
ATOM 80   H HB2  . PHE A 1 6  ? 1.039  9.669  -7.765  1.00 0.00  ? 6  PHE A HB2  1  
ATOM 81   H HB3  . PHE A 1 6  ? 0.232  10.446 -6.393  1.00 0.00  ? 6  PHE A HB3  1  
ATOM 82   H HD1  . PHE A 1 6  ? 1.248  11.531 -9.822  1.00 0.00  ? 6  PHE A HD1  1  
ATOM 83   H HD2  . PHE A 1 6  ? -1.841 11.243 -6.952  1.00 0.00  ? 6  PHE A HD2  1  
ATOM 84   H HE1  . PHE A 1 6  ? -0.324 12.668 -11.399 1.00 0.00  ? 6  PHE A HE1  1  
ATOM 85   H HE2  . PHE A 1 6  ? -3.413 12.379 -8.529  1.00 0.00  ? 6  PHE A HE2  1  
ATOM 86   H HZ   . PHE A 1 6  ? -2.635 13.077 -10.735 1.00 0.00  ? 6  PHE A HZ   1  
ATOM 87   N N    . PHE A 1 7  ? 0.937  13.196 -5.824  1.00 44.40 ? 7  PHE A N    1  
ATOM 88   C CA   . PHE A 1 7  ? 0.648  14.035 -4.673  1.00 11.11 ? 7  PHE A CA   1  
ATOM 89   C C    . PHE A 1 7  ? 1.938  14.481 -3.982  1.00 15.11 ? 7  PHE A C    1  
ATOM 90   O O    . PHE A 1 7  ? 2.003  14.532 -2.754  1.00 61.25 ? 7  PHE A O    1  
ATOM 91   C CB   . PHE A 1 7  ? -0.174 13.190 -3.699  1.00 63.34 ? 7  PHE A CB   1  
ATOM 92   C CG   . PHE A 1 7  ? -1.548 12.782 -4.233  1.00 63.22 ? 7  PHE A CG   1  
ATOM 93   C CD1  . PHE A 1 7  ? -2.418 13.733 -4.670  1.00 41.11 ? 7  PHE A CD1  1  
ATOM 94   C CD2  . PHE A 1 7  ? -1.900 11.469 -4.271  1.00 41.04 ? 7  PHE A CD2  1  
ATOM 95   C CE1  . PHE A 1 7  ? -3.693 13.353 -5.167  1.00 43.35 ? 7  PHE A CE1  1  
ATOM 96   C CE2  . PHE A 1 7  ? -3.175 11.090 -4.769  1.00 2.43  ? 7  PHE A CE2  1  
ATOM 97   C CZ   . PHE A 1 7  ? -4.045 12.041 -5.205  1.00 21.53 ? 7  PHE A CZ   1  
ATOM 98   H H    . PHE A 1 7  ? 0.449  13.359 -6.693  1.00 0.00  ? 7  PHE A H    1  
ATOM 99   H HA   . PHE A 1 7  ? 0.073  14.908 -4.985  1.00 0.00  ? 7  PHE A HA   1  
ATOM 100  H HB2  . PHE A 1 7  ? 0.388  12.284 -3.473  1.00 0.00  ? 7  PHE A HB2  1  
ATOM 101  H HB3  . PHE A 1 7  ? -0.312 13.754 -2.777  1.00 0.00  ? 7  PHE A HB3  1  
ATOM 102  H HD1  . PHE A 1 7  ? -2.138 14.776 -4.639  1.00 0.00  ? 7  PHE A HD1  1  
ATOM 103  H HD2  . PHE A 1 7  ? -1.210 10.714 -3.923  1.00 0.00  ? 7  PHE A HD2  1  
ATOM 104  H HE1  . PHE A 1 7  ? -4.383 14.108 -5.514  1.00 0.00  ? 7  PHE A HE1  1  
ATOM 105  H HE2  . PHE A 1 7  ? -3.454 10.047 -4.800  1.00 0.00  ? 7  PHE A HE2  1  
ATOM 106  H HZ   . PHE A 1 7  ? -5.015 11.753 -5.583  1.00 0.00  ? 7  PHE A HZ   1  
ATOM 107  N N    . TRP A 1 8  ? 2.933  14.791 -4.800  1.00 1.00  ? 8  TRP A N    1  
ATOM 108  C CA   . TRP A 1 8  ? 4.217  15.231 -4.282  1.00 12.31 ? 8  TRP A CA   1  
ATOM 109  C C    . TRP A 1 8  ? 4.907  16.057 -5.370  1.00 50.21 ? 8  TRP A C    1  
ATOM 110  O O    . TRP A 1 8  ? 4.926  17.284 -5.303  1.00 55.13 ? 8  TRP A O    1  
ATOM 111  C CB   . TRP A 1 8  ? 5.056  14.040 -3.813  1.00 21.45 ? 8  TRP A CB   1  
ATOM 112  C CG   . TRP A 1 8  ? 6.301  14.432 -3.015  1.00 32.32 ? 8  TRP A CG   1  
ATOM 113  C CD1  . TRP A 1 8  ? 6.396  14.673 -1.700  1.00 61.24 ? 8  TRP A CD1  1  
ATOM 114  C CD2  . TRP A 1 8  ? 7.633  14.618 -3.538  1.00 53.32 ? 8  TRP A CD2  1  
ATOM 115  N NE1  . TRP A 1 8  ? 7.687  15.000 -1.338  1.00 5.21  ? 8  TRP A NE1  1  
ATOM 116  C CE2  . TRP A 1 8  ? 8.463  14.967 -2.491  1.00 63.34 ? 8  TRP A CE2  1  
ATOM 117  C CE3  . TRP A 1 8  ? 8.121  14.498 -4.850  1.00 0.52  ? 8  TRP A CE3  1  
ATOM 118  C CZ2  . TRP A 1 8  ? 9.830  15.221 -2.649  1.00 43.13 ? 8  TRP A CZ2  1  
ATOM 119  C CZ3  . TRP A 1 8  ? 9.490  14.757 -4.991  1.00 51.11 ? 8  TRP A CZ3  1  
ATOM 120  C CH2  . TRP A 1 8  ? 10.339 15.107 -3.949  1.00 1.31  ? 8  TRP A CH2  1  
ATOM 121  H H    . TRP A 1 8  ? 2.797  14.722 -5.798  1.00 0.00  ? 8  TRP A H    1  
ATOM 122  H HA   . TRP A 1 8  ? 4.036  15.879 -3.425  1.00 0.00  ? 8  TRP A HA   1  
ATOM 123  H HB2  . TRP A 1 8  ? 4.432  13.396 -3.193  1.00 0.00  ? 8  TRP A HB2  1  
ATOM 124  H HB3  . TRP A 1 8  ? 5.374  13.478 -4.691  1.00 0.00  ? 8  TRP A HB3  1  
ATOM 125  H HD1  . TRP A 1 8  ? 5.567  14.618 -1.010  1.00 0.00  ? 8  TRP A HD1  1  
ATOM 126  H HE1  . TRP A 1 8  ? 8.009  15.223 -0.407  1.00 0.00  ? 8  TRP A HE1  1  
ATOM 127  H HE3  . TRP A 1 8  ? 7.490  14.227 -5.684  1.00 0.00  ? 8  TRP A HE3  1  
ATOM 128  H HZ2  . TRP A 1 8  ? 10.459 15.491 -1.814  1.00 0.00  ? 8  TRP A HZ2  1  
ATOM 129  H HZ3  . TRP A 1 8  ? 9.916  14.679 -5.981  1.00 0.00  ? 8  TRP A HZ3  1  
ATOM 130  H HH2  . TRP A 1 8  ? 11.386 15.291 -4.140  1.00 0.00  ? 8  TRP A HH2  1  
ATOM 131  N N    . LYS A 1 9  ? 5.457  15.350 -6.345  1.00 31.12 ? 9  LYS A N    1  
ATOM 132  C CA   . LYS A 1 9  ? 6.147  16.002 -7.445  1.00 42.41 ? 9  LYS A CA   1  
ATOM 133  C C    . LYS A 1 9  ? 5.907  15.210 -8.733  1.00 4.10  ? 9  LYS A C    1  
ATOM 134  O O    . LYS A 1 9  ? 6.819  15.046 -9.543  1.00 41.44 ? 9  LYS A O    1  
ATOM 135  C CB   . LYS A 1 9  ? 7.627  16.197 -7.110  1.00 22.33 ? 9  LYS A CB   1  
ATOM 136  C CG   . LYS A 1 9  ? 8.249  17.286 -7.985  1.00 73.14 ? 9  LYS A CG   1  
ATOM 137  C CD   . LYS A 1 9  ? 9.625  17.697 -7.457  1.00 22.54 ? 9  LYS A CD   1  
ATOM 138  C CE   . LYS A 1 9  ? 10.315 18.667 -8.418  1.00 52.34 ? 9  LYS A CE   1  
ATOM 139  N NZ   . LYS A 1 9  ? 11.651 19.042 -7.904  1.00 40.03 ? 9  LYS A NZ   1  
ATOM 140  H H    . LYS A 1 9  ? 5.397  14.342 -6.324  1.00 0.00  ? 9  LYS A H    1  
ATOM 141  H HA   . LYS A 1 9  ? 5.703  16.989 -7.576  1.00 0.00  ? 9  LYS A HA   1  
ATOM 142  H HB2  . LYS A 1 9  ? 7.720  16.486 -6.063  1.00 0.00  ? 9  LYS A HB2  1  
ATOM 143  H HB3  . LYS A 1 9  ? 8.159  15.260 -7.273  1.00 0.00  ? 9  LYS A HB3  1  
ATOM 144  H HG2  . LYS A 1 9  ? 8.356  16.909 -9.002  1.00 0.00  ? 9  LYS A HG2  1  
ATOM 145  H HG3  . LYS A 1 9  ? 7.594  18.158 -7.993  1.00 0.00  ? 9  LYS A HG3  1  
ATOM 146  H HD2  . LYS A 1 9  ? 9.505  18.180 -6.488  1.00 0.00  ? 9  LYS A HD2  1  
ATOM 147  H HD3  . LYS A 1 9  ? 10.244 16.807 -7.341  1.00 0.00  ? 9  LYS A HD3  1  
ATOM 148  H HE2  . LYS A 1 9  ? 10.424 18.192 -9.393  1.00 0.00  ? 9  LYS A HE2  1  
ATOM 149  H HE3  . LYS A 1 9  ? 9.705  19.564 -8.520  1.00 0.00  ? 9  LYS A HE3  1  
ATOM 150  H HZ1  . LYS A 1 9  ? 12.092 19.682 -8.548  1.00 0.00  ? 9  LYS A HZ1  1  
ATOM 151  H HZ2  . LYS A 1 9  ? 12.220 18.213 -7.810  1.00 0.00  ? 9  LYS A HZ2  1  
ATOM 152  H HZ3  . LYS A 1 9  ? 11.553 19.487 -7.002  1.00 0.00  ? 9  LYS A HZ3  1  
ATOM 153  N N    . THR A 1 10 ? 4.677  14.741 -8.881  1.00 11.01 ? 10 THR A N    1  
ATOM 154  C CA   . THR A 1 10 ? 4.306  13.972 -10.056 1.00 20.44 ? 10 THR A CA   1  
ATOM 155  C C    . THR A 1 10 ? 5.329  12.863 -10.311 1.00 1.24  ? 10 THR A C    1  
ATOM 156  O O    . THR A 1 10 ? 5.454  12.374 -11.433 1.00 75.41 ? 10 THR A O    1  
ATOM 157  C CB   . THR A 1 10 ? 4.158  14.942 -11.230 1.00 40.40 ? 10 THR A CB   1  
ATOM 158  O OG1  . THR A 1 10 ? 5.498  15.305 -11.552 1.00 3.30  ? 10 THR A OG1  1  
ATOM 159  C CG2  . THR A 1 10 ? 3.502  16.262 -10.819 1.00 21.11 ? 10 THR A CG2  1  
ATOM 160  H H    . THR A 1 10 ? 3.987  14.921 -8.166  1.00 0.00  ? 10 THR A H    1  
ATOM 161  H HA   . THR A 1 10 ? 3.337  13.509 -9.870  1.00 0.00  ? 10 THR A HA   1  
ATOM 162  H HB   . THR A 1 10 ? 3.647  14.481 -12.075 1.00 0.00  ? 10 THR A HB   1  
ATOM 163  H HG1  . THR A 1 10 ? 5.547  15.561 -12.476 1.00 0.00  ? 10 THR A HG1  1  
ATOM 164  H HG21 . THR A 1 10 ? 3.081  16.749 -11.698 1.00 0.00  ? 10 THR A HG21 1  
ATOM 165  H HG22 . THR A 1 10 ? 4.250  16.913 -10.367 1.00 0.00  ? 10 THR A HG22 1  
ATOM 166  H HG23 . THR A 1 10 ? 2.709  16.065 -10.098 1.00 0.00  ? 10 THR A HG23 1  
ATOM 167  N N    . PHE A 1 11 ? 6.034  12.497 -9.251  1.00 13.43 ? 11 PHE A N    1  
ATOM 168  C CA   . PHE A 1 11 ? 7.042  11.454 -9.346  1.00 1.33  ? 11 PHE A CA   1  
ATOM 169  C C    . PHE A 1 11 ? 6.922  10.468 -8.181  1.00 0.44  ? 11 PHE A C    1  
ATOM 170  O O    . PHE A 1 11 ? 5.967  10.528 -7.408  1.00 3.00  ? 11 PHE A O    1  
ATOM 171  C CB   . PHE A 1 11 ? 8.406  12.143 -9.277  1.00 33.03 ? 11 PHE A CB   1  
ATOM 172  C CG   . PHE A 1 11 ? 9.347  11.775 -10.427 1.00 72.44 ? 11 PHE A CG   1  
ATOM 173  C CD1  . PHE A 1 11 ? 9.140  12.294 -11.667 1.00 51.33 ? 11 PHE A CD1  1  
ATOM 174  C CD2  . PHE A 1 11 ? 10.390 10.931 -10.208 1.00 43.25 ? 11 PHE A CD2  1  
ATOM 175  C CE1  . PHE A 1 11 ? 10.013 11.953 -12.734 1.00 45.41 ? 11 PHE A CE1  1  
ATOM 176  C CE2  . PHE A 1 11 ? 11.263 10.590 -11.276 1.00 51.32 ? 11 PHE A CE2  1  
ATOM 177  C CZ   . PHE A 1 11 ? 11.056 11.109 -12.516 1.00 50.01 ? 11 PHE A CZ   1  
ATOM 178  H H    . PHE A 1 11 ? 5.869  12.950 -8.363  1.00 0.00  ? 11 PHE A H    1  
ATOM 179  H HA   . PHE A 1 11 ? 6.940  10.924 -10.293 1.00 0.00  ? 11 PHE A HA   1  
ATOM 180  H HB2  . PHE A 1 11 ? 8.253  13.222 -9.282  1.00 0.00  ? 11 PHE A HB2  1  
ATOM 181  H HB3  . PHE A 1 11 ? 8.885  11.862 -8.339  1.00 0.00  ? 11 PHE A HB3  1  
ATOM 182  H HD1  . PHE A 1 11 ? 8.311  12.965 -11.841 1.00 0.00  ? 11 PHE A HD1  1  
ATOM 183  H HD2  . PHE A 1 11 ? 10.555 10.519 -9.223  1.00 0.00  ? 11 PHE A HD2  1  
ATOM 184  H HE1  . PHE A 1 11 ? 9.848  12.364 -13.719 1.00 0.00  ? 11 PHE A HE1  1  
ATOM 185  H HE2  . PHE A 1 11 ? 12.091 9.919  -11.103 1.00 0.00  ? 11 PHE A HE2  1  
ATOM 186  H HZ   . PHE A 1 11 ? 11.721 10.851 -13.327 1.00 0.00  ? 11 PHE A HZ   1  
ATOM 187  N N    . THR A 1 12 ? 7.905  9.585  -8.093  1.00 41.34 ? 12 THR A N    1  
ATOM 188  C CA   . THR A 1 12 ? 7.923  8.587  -7.036  1.00 31.24 ? 12 THR A CA   1  
ATOM 189  C C    . THR A 1 12 ? 7.459  9.204  -5.714  1.00 54.44 ? 12 THR A C    1  
ATOM 190  O O    . THR A 1 12 ? 6.925  8.506  -4.854  1.00 51.34 ? 12 THR A O    1  
ATOM 191  C CB   . THR A 1 12 ? 9.330  7.993  -6.969  1.00 45.03 ? 12 THR A CB   1  
ATOM 192  O OG1  . THR A 1 12 ? 9.171  6.808  -6.196  1.00 34.15 ? 12 THR A OG1  1  
ATOM 193  C CG2  . THR A 1 12 ? 10.289 8.852  -6.141  1.00 31.50 ? 12 THR A CG2  1  
ATOM 194  H H    . THR A 1 12 ? 8.654  9.604  -8.771  1.00 0.00  ? 12 THR A H    1  
ATOM 195  H HA   . THR A 1 12 ? 7.228  7.791  -7.304  1.00 0.00  ? 12 THR A HA   1  
ATOM 196  H HB   . THR A 1 12 ? 9.729  7.781  -7.961  1.00 0.00  ? 12 THR A HB   1  
ATOM 197  H HG1  . THR A 1 12 ? 8.576  6.206  -6.650  1.00 0.00  ? 12 THR A HG1  1  
ATOM 198  H HG21 . THR A 1 12 ? 11.294 8.433  -6.199  1.00 0.00  ? 12 THR A HG21 1  
ATOM 199  H HG22 . THR A 1 12 ? 9.960  8.865  -5.102  1.00 0.00  ? 12 THR A HG22 1  
ATOM 200  H HG23 . THR A 1 12 ? 10.296 9.869  -6.533  1.00 0.00  ? 12 THR A HG23 1  
ATOM 201  N N    . SER A 1 13 ? 7.681  10.504 -5.595  1.00 20.14 ? 13 SER A N    1  
ATOM 202  C CA   . SER A 1 13 ? 7.293  11.222 -4.392  1.00 12.21 ? 13 SER A CA   1  
ATOM 203  C C    . SER A 1 13 ? 8.198  10.817 -3.226  1.00 21.42 ? 13 SER A C    1  
ATOM 204  O O    . SER A 1 13 ? 9.358  10.461 -3.430  1.00 52.02 ? 13 SER A O    1  
ATOM 205  C CB   . SER A 1 13 ? 5.828  10.960 -4.043  1.00 73.13 ? 13 SER A CB   1  
ATOM 206  O OG   . SER A 1 13 ? 4.988  11.003 -5.194  1.00 51.25 ? 13 SER A OG   1  
ATOM 207  H H    . SER A 1 13 ? 8.127  11.004 -6.351  1.00 0.00  ? 13 SER A H    1  
ATOM 208  H HA   . SER A 1 13 ? 7.419  12.290 -4.572  1.00 0.00  ? 13 SER A HA   1  
ATOM 209  H HB2  . SER A 1 13 ? 5.746  9.975  -3.584  1.00 0.00  ? 13 SER A HB2  1  
ATOM 210  H HB3  . SER A 1 13 ? 5.492  11.713 -3.330  1.00 0.00  ? 13 SER A HB3  1  
ATOM 211  H HG   . SER A 1 13 ? 4.846  11.916 -5.453  1.00 0.00  ? 13 SER A HG   1  
ATOM 212  N N    . CYS A 1 14 ? 7.633  10.886 -2.030  1.00 51.53 ? 14 CYS A N    1  
ATOM 213  C CA   . CYS A 1 14 ? 8.373  10.531 -0.831  1.00 42.13 ? 14 CYS A CA   1  
ATOM 214  C C    . CYS A 1 14 ? 9.106  11.779 -0.333  1.00 34.43 ? 14 CYS A C    1  
ATOM 215  O O    . CYS A 1 14 ? 8.820  12.278 0.755   1.00 24.33 ? 14 CYS A O    1  
ATOM 216  C CB   . CYS A 1 14 ? 9.333  9.367  -1.083  1.00 25.53 ? 14 CYS A CB   1  
ATOM 217  S SG   . CYS A 1 14 ? 9.672  8.320  0.378   1.00 23.41 ? 14 CYS A SG   1  
ATOM 218  H H    . CYS A 1 14 ? 6.673  11.190 -1.950  1.00 0.00  ? 14 CYS A H    1  
ATOM 219  H HA   . CYS A 1 14 ? 7.659  10.226 -0.066  1.00 0.00  ? 14 CYS A HA   1  
ATOM 220  H HB2  . CYS A 1 14 ? 8.903  8.735  -1.860  1.00 0.00  ? 14 CYS A HB2  1  
ATOM 221  H HB3  . CYS A 1 14 ? 10.278 9.770  -1.448  1.00 0.00  ? 14 CYS A HB3  1  
ATOM 222  H HG   . CYS A 1 14 ? 9.622  9.069  1.484   1.00 0.00  ? 14 CYS A HG   1  
ATOM 223  N N    . ALA A 1 1  ? 2.209  5.519  5.407   1.00 2.41  ? 1  ALA A N    2  
ATOM 224  C CA   . ALA A 1 1  ? 3.255  6.465  5.058   1.00 71.24 ? 1  ALA A CA   2  
ATOM 225  C C    . ALA A 1 1  ? 4.455  5.705  4.486   1.00 72.13 ? 1  ALA A C    2  
ATOM 226  O O    . ALA A 1 1  ? 4.763  4.600  4.931   1.00 40.35 ? 1  ALA A O    2  
ATOM 227  C CB   . ALA A 1 1  ? 3.624  7.297  6.288   1.00 63.24 ? 1  ALA A CB   2  
ATOM 228  H H1   . ALA A 1 1  ? 1.965  4.971  4.595   1.00 0.00  ? 1  ALA A H1   2  
ATOM 229  H H2   . ALA A 1 1  ? 1.395  6.023  5.730   1.00 0.00  ? 1  ALA A H2   2  
ATOM 230  H H3   . ALA A 1 1  ? 2.539  4.908  6.140   1.00 0.00  ? 1  ALA A H3   2  
ATOM 231  H HA   . ALA A 1 1  ? 2.873  7.137  4.289   1.00 0.00  ? 1  ALA A HA   2  
ATOM 232  H HB1  . ALA A 1 1  ? 4.409  8.006  6.026   1.00 0.00  ? 1  ALA A HB1  2  
ATOM 233  H HB2  . ALA A 1 1  ? 2.746  7.840  6.637   1.00 0.00  ? 1  ALA A HB2  2  
ATOM 234  H HB3  . ALA A 1 1  ? 3.981  6.637  7.079   1.00 0.00  ? 1  ALA A HB3  2  
ATOM 235  N N    . GLY A 1 2  ? 5.098  6.327  3.509   1.00 2.50  ? 2  GLY A N    2  
ATOM 236  C CA   . GLY A 1 2  ? 6.256  5.723  2.873   1.00 10.23 ? 2  GLY A CA   2  
ATOM 237  C C    . GLY A 1 2  ? 6.627  6.468  1.589   1.00 24.53 ? 2  GLY A C    2  
ATOM 238  O O    . GLY A 1 2  ? 6.891  7.669  1.618   1.00 33.44 ? 2  GLY A O    2  
ATOM 239  H H    . GLY A 1 2  ? 4.778  7.234  3.202   1.00 0.00  ? 2  GLY A H    2  
ATOM 240  H HA2  . GLY A 1 2  ? 7.100  5.758  3.562   1.00 0.00  ? 2  GLY A HA2  2  
ATOM 241  H HA3  . GLY A 1 2  ? 6.032  4.683  2.632   1.00 0.00  ? 2  GLY A HA3  2  
ATOM 242  N N    . CYS A 1 3  ? 6.635  5.723  0.493   1.00 22.13 ? 3  CYS A N    2  
ATOM 243  C CA   . CYS A 1 3  ? 6.969  6.298  -0.799  1.00 33.13 ? 3  CYS A CA   2  
ATOM 244  C C    . CYS A 1 3  ? 5.899  5.873  -1.806  1.00 25.21 ? 3  CYS A C    2  
ATOM 245  O O    . CYS A 1 3  ? 5.749  4.687  -2.094  1.00 42.12 ? 3  CYS A O    2  
ATOM 246  C CB   . CYS A 1 3  ? 8.373  5.891  -1.253  1.00 35.35 ? 3  CYS A CB   2  
ATOM 247  S SG   . CYS A 1 3  ? 9.049  6.882  -2.635  1.00 72.24 ? 3  CYS A SG   2  
ATOM 248  H H    . CYS A 1 3  ? 6.407  4.742  0.556   1.00 0.00  ? 3  CYS A H    2  
ATOM 249  H HA   . CYS A 1 3  ? 6.941  7.384  -0.707  1.00 0.00  ? 3  CYS A HA   2  
ATOM 250  H HB2  . CYS A 1 3  ? 9.050  5.974  -0.403  1.00 0.00  ? 3  CYS A HB2  2  
ATOM 251  H HB3  . CYS A 1 3  ? 8.338  4.849  -1.569  1.00 0.00  ? 3  CYS A HB3  2  
ATOM 252  H HG   . CYS A 1 3  ? 8.319  6.672  -3.734  1.00 0.00  ? 3  CYS A HG   2  
ATOM 253  N N    . LYS A 1 4  ? 5.181  6.866  -2.312  1.00 0.25  ? 4  LYS A N    2  
ATOM 254  C CA   . LYS A 1 4  ? 4.128  6.609  -3.280  1.00 34.42 ? 4  LYS A CA   2  
ATOM 255  C C    . LYS A 1 4  ? 4.080  7.757  -4.290  1.00 54.01 ? 4  LYS A C    2  
ATOM 256  O O    . LYS A 1 4  ? 3.762  8.891  -3.933  1.00 42.43 ? 4  LYS A O    2  
ATOM 257  C CB   . LYS A 1 4  ? 2.796  6.359  -2.569  1.00 5.13  ? 4  LYS A CB   2  
ATOM 258  C CG   . LYS A 1 4  ? 2.316  7.619  -1.846  1.00 70.21 ? 4  LYS A CG   2  
ATOM 259  C CD   . LYS A 1 4  ? 1.657  7.268  -0.511  1.00 31.25 ? 4  LYS A CD   2  
ATOM 260  C CE   . LYS A 1 4  ? 0.496  8.216  -0.205  1.00 64.13 ? 4  LYS A CE   2  
ATOM 261  N NZ   . LYS A 1 4  ? -0.793 7.594  -0.579  1.00 4.25  ? 4  LYS A NZ   2  
ATOM 262  H H    . LYS A 1 4  ? 5.368  7.815  -2.020  1.00 0.00  ? 4  LYS A H    2  
ATOM 263  H HA   . LYS A 1 4  ? 4.390  5.700  -3.822  1.00 0.00  ? 4  LYS A HA   2  
ATOM 264  H HB2  . LYS A 1 4  ? 2.049  6.065  -3.306  1.00 0.00  ? 4  LYS A HB2  2  
ATOM 265  H HB3  . LYS A 1 4  ? 2.921  5.555  -1.844  1.00 0.00  ? 4  LYS A HB3  2  
ATOM 266  H HG2  . LYS A 1 4  ? 3.169  8.272  -1.661  1.00 0.00  ? 4  LYS A HG2  2  
ATOM 267  H HG3  . LYS A 1 4  ? 1.595  8.142  -2.475  1.00 0.00  ? 4  LYS A HG3  2  
ATOM 268  H HD2  . LYS A 1 4  ? 1.283  6.245  -0.554  1.00 0.00  ? 4  LYS A HD2  2  
ATOM 269  H HD3  . LYS A 1 4  ? 2.399  7.345  0.284   1.00 0.00  ? 4  LYS A HD3  2  
ATOM 270  H HE2  . LYS A 1 4  ? 0.490  8.446  0.860   1.00 0.00  ? 4  LYS A HE2  2  
ATOM 271  H HE3  . LYS A 1 4  ? 0.627  9.138  -0.772  1.00 0.00  ? 4  LYS A HE3  2  
ATOM 272  H HZ1  . LYS A 1 4  ? -1.548 8.232  -0.371  1.00 0.00  ? 4  LYS A HZ1  2  
ATOM 273  H HZ2  . LYS A 1 4  ? -0.920 6.741  -0.053  1.00 0.00  ? 4  LYS A HZ2  2  
ATOM 274  H HZ3  . LYS A 1 4  ? -0.792 7.384  -1.567  1.00 0.00  ? 4  LYS A HZ3  2  
ATOM 275  N N    . ASN A 1 5  ? 4.400  7.423  -5.532  1.00 63.00 ? 5  ASN A N    2  
ATOM 276  C CA   . ASN A 1 5  ? 4.398  8.412  -6.597  1.00 62.44 ? 5  ASN A CA   2  
ATOM 277  C C    . ASN A 1 5  ? 3.177  9.321  -6.440  1.00 74.20 ? 5  ASN A C    2  
ATOM 278  O O    . ASN A 1 5  ? 2.220  8.968  -5.755  1.00 50.24 ? 5  ASN A O    2  
ATOM 279  C CB   . ASN A 1 5  ? 4.315  7.742  -7.970  1.00 73.21 ? 5  ASN A CB   2  
ATOM 280  C CG   . ASN A 1 5  ? 3.020  6.940  -8.111  1.00 32.34 ? 5  ASN A CG   2  
ATOM 281  O OD1  . ASN A 1 5  ? 1.982  7.287  -7.573  1.00 22.21 ? 5  ASN A OD1  2  
ATOM 282  N ND2  . ASN A 1 5  ? 3.139  5.849  -8.863  1.00 0.22  ? 5  ASN A ND2  2  
ATOM 283  H H    . ASN A 1 5  ? 4.649  6.467  -5.741  1.00 0.00  ? 5  ASN A H    2  
ATOM 284  H HA   . ASN A 1 5  ? 5.307  9.011  -6.539  1.00 0.00  ? 5  ASN A HA   2  
ATOM 285  H HB2  . ASN A 1 5  ? 4.345  8.510  -8.743  1.00 0.00  ? 5  ASN A HB2  2  
ATOM 286  H HB3  . ASN A 1 5  ? 5.167  7.074  -8.095  1.00 0.00  ? 5  ASN A HB3  2  
ATOM 287  H HD21 . ASN A 1 5  ? 4.029  5.617  -9.280  1.00 0.00  ? 5  ASN A HD21 2  
ATOM 288  H HD22 . ASN A 1 5  ? 2.339  5.252  -9.016  1.00 0.00  ? 5  ASN A HD22 2  
ATOM 289  N N    . PHE A 1 6  ? 3.252  10.475 -7.087  1.00 71.41 ? 6  PHE A N    2  
ATOM 290  C CA   . PHE A 1 6  ? 2.166  11.438 -7.028  1.00 24.14 ? 6  PHE A CA   2  
ATOM 291  C C    . PHE A 1 6  ? 2.118  12.129 -5.663  1.00 11.15 ? 6  PHE A C    2  
ATOM 292  O O    . PHE A 1 6  ? 2.910  11.812 -4.776  1.00 21.01 ? 6  PHE A O    2  
ATOM 293  C CB   . PHE A 1 6  ? 0.865  10.659 -7.237  1.00 61.31 ? 6  PHE A CB   2  
ATOM 294  C CG   . PHE A 1 6  ? -0.209 11.435 -8.001  1.00 20.04 ? 6  PHE A CG   2  
ATOM 295  C CD1  . PHE A 1 6  ? 0.055  11.914 -9.245  1.00 1.22  ? 6  PHE A CD1  2  
ATOM 296  C CD2  . PHE A 1 6  ? -1.429 11.643 -7.437  1.00 64.52 ? 6  PHE A CD2  2  
ATOM 297  C CE1  . PHE A 1 6  ? -0.942 12.634 -9.956  1.00 64.02 ? 6  PHE A CE1  2  
ATOM 298  C CE2  . PHE A 1 6  ? -2.425 12.363 -8.146  1.00 15.24 ? 6  PHE A CE2  2  
ATOM 299  C CZ   . PHE A 1 6  ? -2.161 12.843 -9.391  1.00 13.52 ? 6  PHE A CZ   2  
ATOM 300  H H    . PHE A 1 6  ? 4.077  10.688 -7.630  1.00 0.00  ? 6  PHE A H    2  
ATOM 301  H HA   . PHE A 1 6  ? 2.284  12.181 -7.816  1.00 0.00  ? 6  PHE A HA   2  
ATOM 302  H HB2  . PHE A 1 6  ? 1.095  9.752  -7.795  1.00 0.00  ? 6  PHE A HB2  2  
ATOM 303  H HB3  . PHE A 1 6  ? 0.466  10.377 -6.262  1.00 0.00  ? 6  PHE A HB3  2  
ATOM 304  H HD1  . PHE A 1 6  ? 1.023  11.748 -9.694  1.00 0.00  ? 6  PHE A HD1  2  
ATOM 305  H HD2  . PHE A 1 6  ? -1.639 11.261 -6.449  1.00 0.00  ? 6  PHE A HD2  2  
ATOM 306  H HE1  . PHE A 1 6  ? -0.733 13.016 -10.944 1.00 0.00  ? 6  PHE A HE1  2  
ATOM 307  H HE2  . PHE A 1 6  ? -3.393 12.530 -7.697  1.00 0.00  ? 6  PHE A HE2  2  
ATOM 308  H HZ   . PHE A 1 6  ? -2.920 13.391 -9.930  1.00 0.00  ? 6  PHE A HZ   2  
ATOM 309  N N    . PHE A 1 7  ? 1.182  13.058 -5.537  1.00 44.40 ? 7  PHE A N    2  
ATOM 310  C CA   . PHE A 1 7  ? 1.022  13.796 -4.296  1.00 11.11 ? 7  PHE A CA   2  
ATOM 311  C C    . PHE A 1 7  ? 2.379  14.081 -3.649  1.00 15.11 ? 7  PHE A C    2  
ATOM 312  O O    . PHE A 1 7  ? 2.518  13.997 -2.429  1.00 61.25 ? 7  PHE A O    2  
ATOM 313  C CB   . PHE A 1 7  ? 0.196  12.916 -3.357  1.00 63.34 ? 7  PHE A CB   2  
ATOM 314  C CG   . PHE A 1 7  ? -1.317 13.096 -3.505  1.00 63.22 ? 7  PHE A CG   2  
ATOM 315  C CD1  . PHE A 1 7  ? -1.883 14.311 -3.272  1.00 41.04 ? 7  PHE A CD1  2  
ATOM 316  C CD2  . PHE A 1 7  ? -2.095 12.042 -3.868  1.00 41.11 ? 7  PHE A CD2  2  
ATOM 317  C CE1  . PHE A 1 7  ? -3.286 14.478 -3.409  1.00 2.43  ? 7  PHE A CE1  2  
ATOM 318  C CE2  . PHE A 1 7  ? -3.498 12.208 -4.004  1.00 43.35 ? 7  PHE A CE2  2  
ATOM 319  C CZ   . PHE A 1 7  ? -4.064 13.424 -3.772  1.00 21.53 ? 7  PHE A CZ   2  
ATOM 320  H H    . PHE A 1 7  ? 0.571  13.257 -6.317  1.00 0.00  ? 7  PHE A H    2  
ATOM 321  H HA   . PHE A 1 7  ? 0.497  14.733 -4.486  1.00 0.00  ? 7  PHE A HA   2  
ATOM 322  H HB2  . PHE A 1 7  ? 0.439  11.874 -3.562  1.00 0.00  ? 7  PHE A HB2  2  
ATOM 323  H HB3  . PHE A 1 7  ? 0.476  13.144 -2.328  1.00 0.00  ? 7  PHE A HB3  2  
ATOM 324  H HD1  . PHE A 1 7  ? -1.264 15.149 -2.984  1.00 0.00  ? 7  PHE A HD1  2  
ATOM 325  H HD2  . PHE A 1 7  ? -1.646 11.077 -4.052  1.00 0.00  ? 7  PHE A HD2  2  
ATOM 326  H HE1  . PHE A 1 7  ? -3.736 15.443 -3.225  1.00 0.00  ? 7  PHE A HE1  2  
ATOM 327  H HE2  . PHE A 1 7  ? -4.116 11.371 -4.292  1.00 0.00  ? 7  PHE A HE2  2  
ATOM 328  H HZ   . PHE A 1 7  ? -5.132 13.551 -3.876  1.00 0.00  ? 7  PHE A HZ   2  
ATOM 329  N N    . TRP A 1 8  ? 3.344  14.411 -4.493  1.00 1.00  ? 8  TRP A N    2  
ATOM 330  C CA   . TRP A 1 8  ? 4.685  14.709 -4.018  1.00 12.31 ? 8  TRP A CA   2  
ATOM 331  C C    . TRP A 1 8  ? 5.342  15.659 -5.022  1.00 50.21 ? 8  TRP A C    2  
ATOM 332  O O    . TRP A 1 8  ? 5.442  16.859 -4.773  1.00 55.13 ? 8  TRP A O    2  
ATOM 333  C CB   . TRP A 1 8  ? 5.486  13.424 -3.796  1.00 21.45 ? 8  TRP A CB   2  
ATOM 334  C CG   . TRP A 1 8  ? 6.782  13.627 -3.010  1.00 32.32 ? 8  TRP A CG   2  
ATOM 335  C CD1  . TRP A 1 8  ? 6.951  13.615 -1.680  1.00 61.24 ? 8  TRP A CD1  2  
ATOM 336  C CD2  . TRP A 1 8  ? 8.093  13.874 -3.560  1.00 53.32 ? 8  TRP A CD2  2  
ATOM 337  N NE1  . TRP A 1 8  ? 8.269  13.835 -1.335  1.00 5.21  ? 8  TRP A NE1  2  
ATOM 338  C CE2  . TRP A 1 8  ? 8.985  13.998 -2.516  1.00 63.34 ? 8  TRP A CE2  2  
ATOM 339  C CE3  . TRP A 1 8  ? 8.510  13.989 -4.898  1.00 0.52  ? 8  TRP A CE3  2  
ATOM 340  C CZ2  . TRP A 1 8  ? 10.351 14.243 -2.699  1.00 43.13 ? 8  TRP A CZ2  2  
ATOM 341  C CZ3  . TRP A 1 8  ? 9.878  14.234 -5.065  1.00 51.11 ? 8  TRP A CZ3  2  
ATOM 342  C CH2  . TRP A 1 8  ? 10.790 14.361 -4.022  1.00 1.31  ? 8  TRP A CH2  2  
ATOM 343  H H    . TRP A 1 8  ? 3.145  14.457 -5.482  1.00 0.00  ? 8  TRP A H    2  
ATOM 344  H HA   . TRP A 1 8  ? 4.601  15.227 -3.062  1.00 0.00  ? 8  TRP A HA   2  
ATOM 345  H HB2  . TRP A 1 8  ? 4.860  12.720 -3.249  1.00 0.00  ? 8  TRP A HB2  2  
ATOM 346  H HB3  . TRP A 1 8  ? 5.731  12.993 -4.767  1.00 0.00  ? 8  TRP A HB3  2  
ATOM 347  H HD1  . TRP A 1 8  ? 6.155  13.453 -0.968  1.00 0.00  ? 8  TRP A HD1  2  
ATOM 348  H HE1  . TRP A 1 8  ? 8.643  13.871 -0.398  1.00 0.00  ? 8  TRP A HE1  2  
ATOM 349  H HE3  . TRP A 1 8  ? 7.829  13.896 -5.731  1.00 0.00  ? 8  TRP A HE3  2  
ATOM 350  H HZ2  . TRP A 1 8  ? 11.030 14.335 -1.864  1.00 0.00  ? 8  TRP A HZ2  2  
ATOM 351  H HZ3  . TRP A 1 8  ? 10.252 14.331 -6.073  1.00 0.00  ? 8  TRP A HZ3  2  
ATOM 352  H HH2  . TRP A 1 8  ? 11.832 14.551 -4.233  1.00 0.00  ? 8  TRP A HH2  2  
ATOM 353  N N    . LYS A 1 9  ? 5.775  15.084 -6.134  1.00 31.12 ? 9  LYS A N    2  
ATOM 354  C CA   . LYS A 1 9  ? 6.420  15.864 -7.176  1.00 42.41 ? 9  LYS A CA   2  
ATOM 355  C C    . LYS A 1 9  ? 6.102  15.247 -8.540  1.00 4.10  ? 9  LYS A C    2  
ATOM 356  O O    . LYS A 1 9  ? 6.968  15.176 -9.411  1.00 41.44 ? 9  LYS A O    2  
ATOM 357  C CB   . LYS A 1 9  ? 7.919  15.996 -6.897  1.00 22.33 ? 9  LYS A CB   2  
ATOM 358  C CG   . LYS A 1 9  ? 8.509  17.205 -7.626  1.00 73.14 ? 9  LYS A CG   2  
ATOM 359  C CD   . LYS A 1 9  ? 8.609  18.413 -6.692  1.00 22.54 ? 9  LYS A CD   2  
ATOM 360  C CE   . LYS A 1 9  ? 10.063 18.857 -6.525  1.00 52.34 ? 9  LYS A CE   2  
ATOM 361  N NZ   . LYS A 1 9  ? 10.256 19.513 -5.212  1.00 40.03 ? 9  LYS A NZ   2  
ATOM 362  H H    . LYS A 1 9  ? 5.655  14.089 -6.260  1.00 0.00  ? 9  LYS A H    2  
ATOM 363  H HA   . LYS A 1 9  ? 5.989  16.865 -7.156  1.00 0.00  ? 9  LYS A HA   2  
ATOM 364  H HB2  . LYS A 1 9  ? 8.075  16.112 -5.824  1.00 0.00  ? 9  LYS A HB2  2  
ATOM 365  H HB3  . LYS A 1 9  ? 8.426  15.093 -7.237  1.00 0.00  ? 9  LYS A HB3  2  
ATOM 366  H HG2  . LYS A 1 9  ? 9.505  16.951 -7.988  1.00 0.00  ? 9  LYS A HG2  2  
ATOM 367  H HG3  . LYS A 1 9  ? 7.872  17.458 -8.473  1.00 0.00  ? 9  LYS A HG3  2  
ATOM 368  H HD2  . LYS A 1 9  ? 8.027  19.236 -7.107  1.00 0.00  ? 9  LYS A HD2  2  
ATOM 369  H HD3  . LYS A 1 9  ? 8.204  18.144 -5.716  1.00 0.00  ? 9  LYS A HD3  2  
ATOM 370  H HE2  . LYS A 1 9  ? 10.714 17.986 -6.590  1.00 0.00  ? 9  LYS A HE2  2  
ATOM 371  H HE3  . LYS A 1 9  ? 10.318 19.559 -7.319  1.00 0.00  ? 9  LYS A HE3  2  
ATOM 372  H HZ1  . LYS A 1 9  ? 11.220 19.801 -5.118  1.00 0.00  ? 9  LYS A HZ1  2  
ATOM 373  H HZ2  . LYS A 1 9  ? 10.025 18.864 -4.474  1.00 0.00  ? 9  LYS A HZ2  2  
ATOM 374  H HZ3  . LYS A 1 9  ? 9.656  20.323 -5.148  1.00 0.00  ? 9  LYS A HZ3  2  
ATOM 375  N N    . THR A 1 10 ? 4.858  14.817 -8.683  1.00 11.01 ? 10 THR A N    2  
ATOM 376  C CA   . THR A 1 10 ? 4.413  14.208 -9.925  1.00 20.44 ? 10 THR A CA   2  
ATOM 377  C C    . THR A 1 10 ? 5.416  13.149 -10.388 1.00 1.24  ? 10 THR A C    2  
ATOM 378  O O    . THR A 1 10 ? 5.480  12.826 -11.573 1.00 75.41 ? 10 THR A O    2  
ATOM 379  C CB   . THR A 1 10 ? 4.195  15.326 -10.948 1.00 40.40 ? 10 THR A CB   2  
ATOM 380  O OG1  . THR A 1 10 ? 3.337  16.245 -10.278 1.00 3.30  ? 10 THR A OG1  2  
ATOM 381  C CG2  . THR A 1 10 ? 3.378  14.864 -12.155 1.00 21.11 ? 10 THR A CG2  2  
ATOM 382  H H    . THR A 1 10 ? 4.207  14.913 -7.916  1.00 0.00  ? 10 THR A H    2  
ATOM 383  H HA   . THR A 1 10 ? 3.456  13.719 -9.744  1.00 0.00  ? 10 THR A HA   2  
ATOM 384  H HB   . THR A 1 10 ? 5.134  15.791 -11.247 1.00 0.00  ? 10 THR A HB   2  
ATOM 385  H HG1  . THR A 1 10 ? 3.148  16.987 -10.858 1.00 0.00  ? 10 THR A HG1  2  
ATOM 386  H HG21 . THR A 1 10 ? 3.253  15.695 -12.849 1.00 0.00  ? 10 THR A HG21 2  
ATOM 387  H HG22 . THR A 1 10 ? 2.399  14.519 -11.821 1.00 0.00  ? 10 THR A HG22 2  
ATOM 388  H HG23 . THR A 1 10 ? 3.899  14.048 -12.656 1.00 0.00  ? 10 THR A HG23 2  
ATOM 389  N N    . PHE A 1 11 ? 6.172  12.636 -9.428  1.00 13.43 ? 11 PHE A N    2  
ATOM 390  C CA   . PHE A 1 11 ? 7.167  11.620 -9.722  1.00 1.33  ? 11 PHE A CA   2  
ATOM 391  C C    . PHE A 1 11 ? 7.097  10.474 -8.711  1.00 0.44  ? 11 PHE A C    2  
ATOM 392  O O    . PHE A 1 11 ? 6.136  10.373 -7.949  1.00 3.00  ? 11 PHE A O    2  
ATOM 393  C CB   . PHE A 1 11 ? 8.538  12.292 -9.618  1.00 33.03 ? 11 PHE A CB   2  
ATOM 394  C CG   . PHE A 1 11 ? 9.428  12.085 -10.844 1.00 72.44 ? 11 PHE A CG   2  
ATOM 395  C CD1  . PHE A 1 11 ? 8.892  12.150 -12.093 1.00 51.33 ? 11 PHE A CD1  2  
ATOM 396  C CD2  . PHE A 1 11 ? 10.755 11.835 -10.686 1.00 43.25 ? 11 PHE A CD2  2  
ATOM 397  C CE1  . PHE A 1 11 ? 9.719  11.959 -13.231 1.00 45.41 ? 11 PHE A CE1  2  
ATOM 398  C CE2  . PHE A 1 11 ? 11.583 11.642 -11.825 1.00 51.32 ? 11 PHE A CE2  2  
ATOM 399  C CZ   . PHE A 1 11 ? 11.046 11.708 -13.073 1.00 50.01 ? 11 PHE A CZ   2  
ATOM 400  H H    . PHE A 1 11 ? 6.054  12.957 -8.478  1.00 0.00  ? 11 PHE A H    2  
ATOM 401  H HA   . PHE A 1 11 ? 7.018  11.235 -10.731 1.00 0.00  ? 11 PHE A HA   2  
ATOM 402  H HB2  . PHE A 1 11 ? 8.385  13.363 -9.482  1.00 0.00  ? 11 PHE A HB2  2  
ATOM 403  H HB3  . PHE A 1 11 ? 9.054  11.899 -8.742  1.00 0.00  ? 11 PHE A HB3  2  
ATOM 404  H HD1  . PHE A 1 11 ? 7.838  12.348 -12.218 1.00 0.00  ? 11 PHE A HD1  2  
ATOM 405  H HD2  . PHE A 1 11 ? 11.181 11.784 -9.695  1.00 0.00  ? 11 PHE A HD2  2  
ATOM 406  H HE1  . PHE A 1 11 ? 9.294  12.012 -14.222 1.00 0.00  ? 11 PHE A HE1  2  
ATOM 407  H HE2  . PHE A 1 11 ? 12.637 11.443 -11.699 1.00 0.00  ? 11 PHE A HE2  2  
ATOM 408  H HZ   . PHE A 1 11 ? 11.675 11.561 -13.939 1.00 0.00  ? 11 PHE A HZ   2  
ATOM 409  N N    . THR A 1 12 ? 8.125  9.639  -8.738  1.00 41.34 ? 12 THR A N    2  
ATOM 410  C CA   . THR A 1 12 ? 8.191  8.504  -7.833  1.00 31.24 ? 12 THR A CA   2  
ATOM 411  C C    . THR A 1 12 ? 7.728  8.911  -6.432  1.00 54.44 ? 12 THR A C    2  
ATOM 412  O O    . THR A 1 12 ? 7.252  8.076  -5.665  1.00 51.34 ? 12 THR A O    2  
ATOM 413  C CB   . THR A 1 12 ? 9.619  7.956  -7.865  1.00 45.03 ? 12 THR A CB   2  
ATOM 414  O OG1  . THR A 1 12 ? 9.640  6.980  -6.828  1.00 34.15 ? 12 THR A OG1  2  
ATOM 415  C CG2  . THR A 1 12 ? 10.654 8.993  -7.423  1.00 31.50 ? 12 THR A CG2  2  
ATOM 416  H H    . THR A 1 12 ? 8.874  9.794  -9.397  1.00 0.00  ? 12 THR A H    2  
ATOM 417  H HA   . THR A 1 12 ? 7.519  7.731  -8.204  1.00 0.00  ? 12 THR A HA   2  
ATOM 418  H HB   . THR A 1 12 ? 9.866  7.524  -8.835  1.00 0.00  ? 12 THR A HB   2  
ATOM 419  H HG1  . THR A 1 12 ? 10.513 6.582  -6.781  1.00 0.00  ? 12 THR A HG1  2  
ATOM 420  H HG21 . THR A 1 12 ? 11.651 8.553  -7.464  1.00 0.00  ? 12 THR A HG21 2  
ATOM 421  H HG22 . THR A 1 12 ? 10.439 9.308  -6.402  1.00 0.00  ? 12 THR A HG22 2  
ATOM 422  H HG23 . THR A 1 12 ? 10.611 9.856  -8.086  1.00 0.00  ? 12 THR A HG23 2  
ATOM 423  N N    . SER A 1 13 ? 7.885  10.194 -6.142  1.00 20.14 ? 13 SER A N    2  
ATOM 424  C CA   . SER A 1 13 ? 7.489  10.722 -4.847  1.00 12.21 ? 13 SER A CA   2  
ATOM 425  C C    . SER A 1 13 ? 8.314  10.065 -3.739  1.00 21.42 ? 13 SER A C    2  
ATOM 426  O O    . SER A 1 13 ? 9.232  9.295  -4.018  1.00 52.02 ? 13 SER A O    2  
ATOM 427  C CB   . SER A 1 13 ? 5.995  10.505 -4.597  1.00 73.13 ? 13 SER A CB   2  
ATOM 428  O OG   . SER A 1 13 ? 5.193  11.052 -5.641  1.00 51.25 ? 13 SER A OG   2  
ATOM 429  H H    . SER A 1 13 ? 8.285  10.815 -6.831  1.00 0.00  ? 13 SER A H    2  
ATOM 430  H HA   . SER A 1 13 ? 7.688  11.794 -4.836  1.00 0.00  ? 13 SER A HA   2  
ATOM 431  H HB2  . SER A 1 13 ? 5.802  9.434  -4.529  1.00 0.00  ? 13 SER A HB2  2  
ATOM 432  H HB3  . SER A 1 13 ? 5.720  10.976 -3.653  1.00 0.00  ? 13 SER A HB3  2  
ATOM 433  H HG   . SER A 1 13 ? 5.506  11.933 -5.857  1.00 0.00  ? 13 SER A HG   2  
ATOM 434  N N    . CYS A 1 14 ? 7.955  10.390 -2.507  1.00 51.53 ? 14 CYS A N    2  
ATOM 435  C CA   . CYS A 1 14 ? 8.652  9.841  -1.355  1.00 42.13 ? 14 CYS A CA   2  
ATOM 436  C C    . CYS A 1 14 ? 8.416  10.770 -0.162  1.00 34.43 ? 14 CYS A C    2  
ATOM 437  O O    . CYS A 1 14 ? 7.294  11.218 0.067   1.00 24.33 ? 14 CYS A O    2  
ATOM 438  C CB   . CYS A 1 14 ? 10.142 9.640  -1.637  1.00 25.53 ? 14 CYS A CB   2  
ATOM 439  S SG   . CYS A 1 14 ? 10.625 7.918  -2.021  1.00 23.41 ? 14 CYS A SG   2  
ATOM 440  H H    . CYS A 1 14 ? 7.187  11.030 -2.364  1.00 0.00  ? 14 CYS A H    2  
ATOM 441  H HA   . CYS A 1 14 ? 8.214  8.870  -1.123  1.00 0.00  ? 14 CYS A HA   2  
ATOM 442  H HB2  . CYS A 1 14 ? 10.413 10.266 -2.487  1.00 0.00  ? 14 CYS A HB2  2  
ATOM 443  H HB3  . CYS A 1 14 ? 10.707 9.973  -0.767  1.00 0.00  ? 14 CYS A HB3  2  
ATOM 444  H HG   . CYS A 1 14 ? 11.933 7.761  -1.797  1.00 0.00  ? 14 CYS A HG   2  
ATOM 445  N N    . ALA A 1 1  ? 3.907  1.016  3.959   1.00 2.41  ? 1  ALA A N    3  
ATOM 446  C CA   . ALA A 1 1  ? 5.179  1.670  3.706   1.00 71.24 ? 1  ALA A CA   3  
ATOM 447  C C    . ALA A 1 1  ? 5.323  1.930  2.204   1.00 72.13 ? 1  ALA A C    3  
ATOM 448  O O    . ALA A 1 1  ? 4.464  1.536  1.417   1.00 40.35 ? 1  ALA A O    3  
ATOM 449  C CB   . ALA A 1 1  ? 6.316  0.808  4.259   1.00 63.24 ? 1  ALA A CB   3  
ATOM 450  H H1   . ALA A 1 1  ? 3.157  1.585  3.594   1.00 0.00  ? 1  ALA A H1   3  
ATOM 451  H H2   . ALA A 1 1  ? 3.896  0.113  3.506   1.00 0.00  ? 1  ALA A H2   3  
ATOM 452  H H3   . ALA A 1 1  ? 3.783  0.894  4.954   1.00 0.00  ? 1  ALA A H3   3  
ATOM 453  H HA   . ALA A 1 1  ? 5.186  2.628  4.225   1.00 0.00  ? 1  ALA A HA   3  
ATOM 454  H HB1  . ALA A 1 1  ? 7.270  1.298  4.068   1.00 0.00  ? 1  ALA A HB1  3  
ATOM 455  H HB2  . ALA A 1 1  ? 6.182  0.677  5.333   1.00 0.00  ? 1  ALA A HB2  3  
ATOM 456  H HB3  . ALA A 1 1  ? 6.304  -0.166 3.770   1.00 0.00  ? 1  ALA A HB3  3  
ATOM 457  N N    . GLY A 1 2  ? 6.415  2.592  1.853   1.00 2.50  ? 2  GLY A N    3  
ATOM 458  C CA   . GLY A 1 2  ? 6.683  2.910  0.460   1.00 10.23 ? 2  GLY A CA   3  
ATOM 459  C C    . GLY A 1 2  ? 6.454  4.397  0.184   1.00 24.53 ? 2  GLY A C    3  
ATOM 460  O O    . GLY A 1 2  ? 6.787  5.245  1.010   1.00 33.44 ? 2  GLY A O    3  
ATOM 461  H H    . GLY A 1 2  ? 7.072  2.881  2.564   1.00 0.00  ? 2  GLY A H    3  
ATOM 462  H HA2  . GLY A 1 2  ? 7.719  2.660  0.231   1.00 0.00  ? 2  GLY A HA2  3  
ATOM 463  H HA3  . GLY A 1 2  ? 6.023  2.320  -0.176  1.00 0.00  ? 2  GLY A HA3  3  
ATOM 464  N N    . CYS A 1 3  ? 5.886  4.669  -0.983  1.00 22.13 ? 3  CYS A N    3  
ATOM 465  C CA   . CYS A 1 3  ? 5.609  6.039  -1.380  1.00 33.13 ? 3  CYS A CA   3  
ATOM 466  C C    . CYS A 1 3  ? 4.251  6.070  -2.082  1.00 25.21 ? 3  CYS A C    3  
ATOM 467  O O    . CYS A 1 3  ? 3.630  5.028  -2.287  1.00 42.12 ? 3  CYS A O    3  
ATOM 468  C CB   . CYS A 1 3  ? 6.722  6.608  -2.261  1.00 35.35 ? 3  CYS A CB   3  
ATOM 469  S SG   . CYS A 1 3  ? 8.414  6.102  -1.785  1.00 72.24 ? 3  CYS A SG   3  
ATOM 470  H H    . CYS A 1 3  ? 5.642  3.911  -1.606  1.00 0.00  ? 3  CYS A H    3  
ATOM 471  H HA   . CYS A 1 3  ? 5.542  6.648  -0.478  1.00 0.00  ? 3  CYS A HA   3  
ATOM 472  H HB2  . CYS A 1 3  ? 6.543  6.297  -3.290  1.00 0.00  ? 3  CYS A HB2  3  
ATOM 473  H HB3  . CYS A 1 3  ? 6.668  7.696  -2.214  1.00 0.00  ? 3  CYS A HB3  3  
ATOM 474  H HG   . CYS A 1 3  ? 8.747  4.987  -2.443  1.00 0.00  ? 3  CYS A HG   3  
ATOM 475  N N    . LYS A 1 4  ? 3.828  7.276  -2.433  1.00 0.25  ? 4  LYS A N    3  
ATOM 476  C CA   . LYS A 1 4  ? 2.556  7.456  -3.109  1.00 34.42 ? 4  LYS A CA   3  
ATOM 477  C C    . LYS A 1 4  ? 2.745  8.391  -4.305  1.00 54.01 ? 4  LYS A C    3  
ATOM 478  O O    . LYS A 1 4  ? 2.366  9.560  -4.250  1.00 42.43 ? 4  LYS A O    3  
ATOM 479  C CB   . LYS A 1 4  ? 1.487  7.931  -2.122  1.00 5.13  ? 4  LYS A CB   3  
ATOM 480  C CG   . LYS A 1 4  ? 2.078  8.905  -1.101  1.00 70.21 ? 4  LYS A CG   3  
ATOM 481  C CD   . LYS A 1 4  ? 1.046  9.274  -0.033  1.00 31.25 ? 4  LYS A CD   3  
ATOM 482  C CE   . LYS A 1 4  ? 1.584  10.362 0.898   1.00 64.13 ? 4  LYS A CE   3  
ATOM 483  N NZ   . LYS A 1 4  ? 1.967  9.785  2.205   1.00 4.25  ? 4  LYS A NZ   3  
ATOM 484  H H    . LYS A 1 4  ? 4.401  8.083  -2.228  1.00 0.00  ? 4  LYS A H    3  
ATOM 485  H HA   . LYS A 1 4  ? 2.244  6.485  -3.493  1.00 0.00  ? 4  LYS A HA   3  
ATOM 486  H HB2  . LYS A 1 4  ? 0.691  8.432  -2.672  1.00 0.00  ? 4  LYS A HB2  3  
ATOM 487  H HB3  . LYS A 1 4  ? 1.074  7.069  -1.598  1.00 0.00  ? 4  LYS A HB3  3  
ATOM 488  H HG2  . LYS A 1 4  ? 2.938  8.439  -0.620  1.00 0.00  ? 4  LYS A HG2  3  
ATOM 489  H HG3  . LYS A 1 4  ? 2.402  9.810  -1.614  1.00 0.00  ? 4  LYS A HG3  3  
ATOM 490  H HD2  . LYS A 1 4  ? 0.139  9.633  -0.519  1.00 0.00  ? 4  LYS A HD2  3  
ATOM 491  H HD3  . LYS A 1 4  ? 0.810  8.387  0.556   1.00 0.00  ? 4  LYS A HD3  3  
ATOM 492  H HE2  . LYS A 1 4  ? 2.459  10.825 0.440   1.00 0.00  ? 4  LYS A HE2  3  
ATOM 493  H HE3  . LYS A 1 4  ? 0.814  11.119 1.049   1.00 0.00  ? 4  LYS A HE3  3  
ATOM 494  H HZ1  . LYS A 1 4  ? 2.319  10.516 2.807   1.00 0.00  ? 4  LYS A HZ1  3  
ATOM 495  H HZ2  . LYS A 1 4  ? 1.158  9.357  2.634   1.00 0.00  ? 4  LYS A HZ2  3  
ATOM 496  H HZ3  . LYS A 1 4  ? 2.683  9.086  2.068   1.00 0.00  ? 4  LYS A HZ3  3  
ATOM 497  N N    . ASN A 1 5  ? 3.333  7.841  -5.358  1.00 63.00 ? 5  ASN A N    3  
ATOM 498  C CA   . ASN A 1 5  ? 3.578  8.610  -6.565  1.00 62.44 ? 5  ASN A CA   3  
ATOM 499  C C    . ASN A 1 5  ? 2.376  9.516  -6.840  1.00 74.20 ? 5  ASN A C    3  
ATOM 500  O O    . ASN A 1 5  ? 1.267  9.236  -6.390  1.00 50.24 ? 5  ASN A O    3  
ATOM 501  C CB   . ASN A 1 5  ? 3.765  7.693  -7.775  1.00 73.21 ? 5  ASN A CB   3  
ATOM 502  C CG   . ASN A 1 5  ? 2.443  7.031  -8.170  1.00 32.34 ? 5  ASN A CG   3  
ATOM 503  O OD1  . ASN A 1 5  ? 1.801  7.398  -9.141  1.00 22.21 ? 5  ASN A OD1  3  
ATOM 504  N ND2  . ASN A 1 5  ? 2.074  6.038  -7.366  1.00 0.22  ? 5  ASN A ND2  3  
ATOM 505  H H    . ASN A 1 5  ? 3.614  6.872  -5.320  1.00 0.00  ? 5  ASN A H    3  
ATOM 506  H HA   . ASN A 1 5  ? 4.470  9.222  -6.431  1.00 0.00  ? 5  ASN A HA   3  
ATOM 507  H HB2  . ASN A 1 5  ? 4.134  8.282  -8.615  1.00 0.00  ? 5  ASN A HB2  3  
ATOM 508  H HB3  . ASN A 1 5  ? 4.494  6.921  -7.530  1.00 0.00  ? 5  ASN A HB3  3  
ATOM 509  H HD21 . ASN A 1 5  ? 2.653  5.785  -6.578  1.00 0.00  ? 5  ASN A HD21 3  
ATOM 510  H HD22 . ASN A 1 5  ? 1.215  5.538  -7.544  1.00 0.00  ? 5  ASN A HD22 3  
ATOM 511  N N    . PHE A 1 6  ? 2.638  10.585 -7.579  1.00 71.41 ? 6  PHE A N    3  
ATOM 512  C CA   . PHE A 1 6  ? 1.591  11.534 -7.919  1.00 24.14 ? 6  PHE A CA   3  
ATOM 513  C C    . PHE A 1 6  ? 1.057  12.233 -6.667  1.00 11.15 ? 6  PHE A C    3  
ATOM 514  O O    . PHE A 1 6  ? -0.154 12.367 -6.495  1.00 21.01 ? 6  PHE A O    3  
ATOM 515  C CB   . PHE A 1 6  ? 0.458  10.736 -8.566  1.00 61.31 ? 6  PHE A CB   3  
ATOM 516  C CG   . PHE A 1 6  ? -0.324 11.514 -9.627  1.00 20.04 ? 6  PHE A CG   3  
ATOM 517  C CD1  . PHE A 1 6  ? 0.335  12.107 -10.658 1.00 64.52 ? 6  PHE A CD1  3  
ATOM 518  C CD2  . PHE A 1 6  ? -1.677 11.612 -9.539  1.00 1.22  ? 6  PHE A CD2  3  
ATOM 519  C CE1  . PHE A 1 6  ? -0.390 12.829 -11.643 1.00 15.24 ? 6  PHE A CE1  3  
ATOM 520  C CE2  . PHE A 1 6  ? -2.403 12.334 -10.523 1.00 64.02 ? 6  PHE A CE2  3  
ATOM 521  C CZ   . PHE A 1 6  ? -1.744 12.927 -11.554 1.00 13.52 ? 6  PHE A CZ   3  
ATOM 522  H H    . PHE A 1 6  ? 3.579  10.741 -7.911  1.00 0.00  ? 6  PHE A H    3  
ATOM 523  H HA   . PHE A 1 6  ? 1.974  12.274 -8.623  1.00 0.00  ? 6  PHE A HA   3  
ATOM 524  H HB2  . PHE A 1 6  ? 0.887  9.851  -9.036  1.00 0.00  ? 6  PHE A HB2  3  
ATOM 525  H HB3  . PHE A 1 6  ? -0.234 10.417 -7.786  1.00 0.00  ? 6  PHE A HB3  3  
ATOM 526  H HD1  . PHE A 1 6  ? 1.410  12.029 -10.728 1.00 0.00  ? 6  PHE A HD1  3  
ATOM 527  H HD2  . PHE A 1 6  ? -2.201 11.142 -8.720  1.00 0.00  ? 6  PHE A HD2  3  
ATOM 528  H HE1  . PHE A 1 6  ? 0.133  13.300 -12.462 1.00 0.00  ? 6  PHE A HE1  3  
ATOM 529  H HE2  . PHE A 1 6  ? -3.478 12.412 -10.452 1.00 0.00  ? 6  PHE A HE2  3  
ATOM 530  H HZ   . PHE A 1 6  ? -2.296 13.476 -12.303 1.00 0.00  ? 6  PHE A HZ   3  
ATOM 531  N N    . PHE A 1 7  ? 1.986  12.663 -5.826  1.00 44.40 ? 7  PHE A N    3  
ATOM 532  C CA   . PHE A 1 7  ? 1.624  13.344 -4.595  1.00 11.11 ? 7  PHE A CA   3  
ATOM 533  C C    . PHE A 1 7  ? 2.771  14.229 -4.102  1.00 15.11 ? 7  PHE A C    3  
ATOM 534  O O    . PHE A 1 7  ? 3.073  14.251 -2.909  1.00 61.25 ? 7  PHE A O    3  
ATOM 535  C CB   . PHE A 1 7  ? 1.343  12.264 -3.550  1.00 63.34 ? 7  PHE A CB   3  
ATOM 536  C CG   . PHE A 1 7  ? 0.287  12.657 -2.517  1.00 63.22 ? 7  PHE A CG   3  
ATOM 537  C CD1  . PHE A 1 7  ? 0.209  13.942 -2.078  1.00 41.04 ? 7  PHE A CD1  3  
ATOM 538  C CD2  . PHE A 1 7  ? -0.576 11.722 -2.035  1.00 41.11 ? 7  PHE A CD2  3  
ATOM 539  C CE1  . PHE A 1 7  ? -0.771 14.307 -1.118  1.00 2.43  ? 7  PHE A CE1  3  
ATOM 540  C CE2  . PHE A 1 7  ? -1.556 12.087 -1.075  1.00 43.35 ? 7  PHE A CE2  3  
ATOM 541  C CZ   . PHE A 1 7  ? -1.634 13.372 -0.637  1.00 21.53 ? 7  PHE A CZ   3  
ATOM 542  H H    . PHE A 1 7  ? 2.961  12.514 -6.044  1.00 0.00  ? 7  PHE A H    3  
ATOM 543  H HA   . PHE A 1 7  ? 0.731  13.948 -4.754  1.00 0.00  ? 7  PHE A HA   3  
ATOM 544  H HB2  . PHE A 1 7  ? 0.999  11.368 -4.067  1.00 0.00  ? 7  PHE A HB2  3  
ATOM 545  H HB3  . PHE A 1 7  ? 2.272  12.032 -3.029  1.00 0.00  ? 7  PHE A HB3  3  
ATOM 546  H HD1  . PHE A 1 7  ? 0.893  14.686 -2.461  1.00 0.00  ? 7  PHE A HD1  3  
ATOM 547  H HD2  . PHE A 1 7  ? -0.515 10.701 -2.382  1.00 0.00  ? 7  PHE A HD2  3  
ATOM 548  H HE1  . PHE A 1 7  ? -0.832 15.327 -0.770  1.00 0.00  ? 7  PHE A HE1  3  
ATOM 549  H HE2  . PHE A 1 7  ? -2.241 11.344 -0.693  1.00 0.00  ? 7  PHE A HE2  3  
ATOM 550  H HZ   . PHE A 1 7  ? -2.380 13.650 0.093   1.00 0.00  ? 7  PHE A HZ   3  
ATOM 551  N N    . TRP A 1 8  ? 3.377  14.938 -5.043  1.00 1.00  ? 8  TRP A N    3  
ATOM 552  C CA   . TRP A 1 8  ? 4.483  15.822 -4.718  1.00 12.31 ? 8  TRP A CA   3  
ATOM 553  C C    . TRP A 1 8  ? 4.895  16.554 -5.997  1.00 50.21 ? 8  TRP A C    3  
ATOM 554  O O    . TRP A 1 8  ? 4.570  17.726 -6.177  1.00 55.13 ? 8  TRP A O    3  
ATOM 555  C CB   . TRP A 1 8  ? 5.635  15.046 -4.076  1.00 21.45 ? 8  TRP A CB   3  
ATOM 556  C CG   . TRP A 1 8  ? 6.667  15.931 -3.375  1.00 32.32 ? 8  TRP A CG   3  
ATOM 557  C CD1  . TRP A 1 8  ? 6.599  16.465 -2.148  1.00 61.24 ? 8  TRP A CD1  3  
ATOM 558  C CD2  . TRP A 1 8  ? 7.934  16.366 -3.913  1.00 53.32 ? 8  TRP A CD2  3  
ATOM 559  N NE1  . TRP A 1 8  ? 7.723  17.210 -1.856  1.00 5.21  ? 8  TRP A NE1  3  
ATOM 560  C CE2  . TRP A 1 8  ? 8.561  17.148 -2.964  1.00 63.34 ? 8  TRP A CE2  3  
ATOM 561  C CE3  . TRP A 1 8  ? 8.529  16.109 -5.160  1.00 0.52  ? 8  TRP A CE3  3  
ATOM 562  C CZ2  . TRP A 1 8  ? 9.816  17.736 -3.162  1.00 43.13 ? 8  TRP A CZ2  3  
ATOM 563  C CZ3  . TRP A 1 8  ? 9.783  16.704 -5.343  1.00 51.11 ? 8  TRP A CZ3  3  
ATOM 564  C CH2  . TRP A 1 8  ? 10.429 17.492 -4.398  1.00 1.31  ? 8  TRP A CH2  3  
ATOM 565  H H    . TRP A 1 8  ? 3.066  14.862 -6.001  1.00 0.00  ? 8  TRP A H    3  
ATOM 566  H HA   . TRP A 1 8  ? 4.128  16.562 -4.000  1.00 0.00  ? 8  TRP A HA   3  
ATOM 567  H HB2  . TRP A 1 8  ? 5.217  14.359 -3.341  1.00 0.00  ? 8  TRP A HB2  3  
ATOM 568  H HB3  . TRP A 1 8  ? 6.139  14.467 -4.849  1.00 0.00  ? 8  TRP A HB3  3  
ATOM 569  H HD1  . TRP A 1 8  ? 5.768  16.329 -1.472  1.00 0.00  ? 8  TRP A HD1  3  
ATOM 570  H HE1  . TRP A 1 8  ? 7.905  17.708 -0.996  1.00 0.00  ? 8  TRP A HE1  3  
ATOM 571  H HE3  . TRP A 1 8  ? 8.056  15.502 -5.917  1.00 0.00  ? 8  TRP A HE3  3  
ATOM 572  H HZ2  . TRP A 1 8  ? 10.286 18.344 -2.404  1.00 0.00  ? 8  TRP A HZ2  3  
ATOM 573  H HZ3  . TRP A 1 8  ? 10.285 16.537 -6.285  1.00 0.00  ? 8  TRP A HZ3  3  
ATOM 574  H HH2  . TRP A 1 8  ? 11.399 17.915 -4.616  1.00 0.00  ? 8  TRP A HH2  3  
ATOM 575  N N    . LYS A 1 9  ? 5.603  15.831 -6.852  1.00 31.12 ? 9  LYS A N    3  
ATOM 576  C CA   . LYS A 1 9  ? 6.062  16.398 -8.109  1.00 42.41 ? 9  LYS A CA   3  
ATOM 577  C C    . LYS A 1 9  ? 6.047  15.312 -9.187  1.00 4.10  ? 9  LYS A C    3  
ATOM 578  O O    . LYS A 1 9  ? 7.006  15.172 -9.945  1.00 41.44 ? 9  LYS A O    3  
ATOM 579  C CB   . LYS A 1 9  ? 7.426  17.066 -7.929  1.00 22.33 ? 9  LYS A CB   3  
ATOM 580  C CG   . LYS A 1 9  ? 7.719  18.035 -9.077  1.00 73.14 ? 9  LYS A CG   3  
ATOM 581  C CD   . LYS A 1 9  ? 7.953  19.452 -8.553  1.00 22.54 ? 9  LYS A CD   3  
ATOM 582  C CE   . LYS A 1 9  ? 9.433  19.682 -8.235  1.00 52.34 ? 9  LYS A CE   3  
ATOM 583  N NZ   . LYS A 1 9  ? 9.966  20.809 -9.032  1.00 40.03 ? 9  LYS A NZ   3  
ATOM 584  H H    . LYS A 1 9  ? 5.828  14.873 -6.627  1.00 0.00  ? 9  LYS A H    3  
ATOM 585  H HA   . LYS A 1 9  ? 5.351  17.169 -8.405  1.00 0.00  ? 9  LYS A HA   3  
ATOM 586  H HB2  . LYS A 1 9  ? 7.436  17.614 -6.986  1.00 0.00  ? 9  LYS A HB2  3  
ATOM 587  H HB3  . LYS A 1 9  ? 8.199  16.298 -7.906  1.00 0.00  ? 9  LYS A HB3  3  
ATOM 588  H HG2  . LYS A 1 9  ? 8.610  17.699 -9.608  1.00 0.00  ? 9  LYS A HG2  3  
ATOM 589  H HG3  . LYS A 1 9  ? 6.873  18.042 -9.764  1.00 0.00  ? 9  LYS A HG3  3  
ATOM 590  H HD2  . LYS A 1 9  ? 7.636  20.169 -9.311  1.00 0.00  ? 9  LYS A HD2  3  
ATOM 591  H HD3  . LYS A 1 9  ? 7.364  19.603 -7.648  1.00 0.00  ? 9  LYS A HD3  3  
ATOM 592  H HE2  . LYS A 1 9  ? 9.541  19.910 -7.174  1.00 0.00  ? 9  LYS A HE2  3  
ATOM 593  H HE3  . LYS A 1 9  ? 9.996  18.778 -8.468  1.00 0.00  ? 9  LYS A HE3  3  
ATOM 594  H HZ1  . LYS A 1 9  ? 10.941 20.947 -8.811  1.00 0.00  ? 9  LYS A HZ1  3  
ATOM 595  H HZ2  . LYS A 1 9  ? 9.870  20.600 -10.016 1.00 0.00  ? 9  LYS A HZ2  3  
ATOM 596  H HZ3  . LYS A 1 9  ? 9.449  21.649 -8.814  1.00 0.00  ? 9  LYS A HZ3  3  
ATOM 597  N N    . THR A 1 10 ? 4.949  14.573 -9.223  1.00 11.01 ? 10 THR A N    3  
ATOM 598  C CA   . THR A 1 10 ? 4.796  13.505 -10.195 1.00 20.44 ? 10 THR A CA   3  
ATOM 599  C C    . THR A 1 10 ? 5.523  12.245 -9.723  1.00 1.24  ? 10 THR A C    3  
ATOM 600  O O    . THR A 1 10 ? 4.949  11.157 -9.719  1.00 75.41 ? 10 THR A O    3  
ATOM 601  C CB   . THR A 1 10 ? 5.292  14.022 -11.547 1.00 40.40 ? 10 THR A CB   3  
ATOM 602  O OG1  . THR A 1 10 ? 4.845  15.374 -11.587 1.00 3.30  ? 10 THR A OG1  3  
ATOM 603  C CG2  . THR A 1 10 ? 4.579  13.358 -12.726 1.00 21.11 ? 10 THR A CG2  3  
ATOM 604  H H    . THR A 1 10 ? 4.206  14.755 -8.563  1.00 0.00  ? 10 THR A H    3  
ATOM 605  H HA   . THR A 1 10 ? 3.734  13.274 -10.286 1.00 0.00  ? 10 THR A HA   3  
ATOM 606  H HB   . THR A 1 10 ? 6.376  13.951 -11.635 1.00 0.00  ? 10 THR A HB   3  
ATOM 607  H HG1  . THR A 1 10 ? 5.454  15.928 -11.094 1.00 0.00  ? 10 THR A HG1  3  
ATOM 608  H HG21 . THR A 1 10 ? 4.969  13.761 -13.661 1.00 0.00  ? 10 THR A HG21 3  
ATOM 609  H HG22 . THR A 1 10 ? 4.751  12.282 -12.695 1.00 0.00  ? 10 THR A HG22 3  
ATOM 610  H HG23 . THR A 1 10 ? 3.510  13.557 -12.663 1.00 0.00  ? 10 THR A HG23 3  
ATOM 611  N N    . PHE A 1 11 ? 6.775  12.434 -9.335  1.00 13.43 ? 11 PHE A N    3  
ATOM 612  C CA   . PHE A 1 11 ? 7.587  11.325 -8.860  1.00 1.33  ? 11 PHE A CA   3  
ATOM 613  C C    . PHE A 1 11 ? 6.864  10.547 -7.760  1.00 0.44  ? 11 PHE A C    3  
ATOM 614  O O    . PHE A 1 11 ? 5.694  10.805 -7.477  1.00 3.00  ? 11 PHE A O    3  
ATOM 615  C CB   . PHE A 1 11 ? 8.871  11.926 -8.284  1.00 33.03 ? 11 PHE A CB   3  
ATOM 616  C CG   . PHE A 1 11 ? 10.116 11.064 -8.507  1.00 72.44 ? 11 PHE A CG   3  
ATOM 617  C CD1  . PHE A 1 11 ? 10.533 10.787 -9.772  1.00 51.33 ? 11 PHE A CD1  3  
ATOM 618  C CD2  . PHE A 1 11 ? 10.805 10.576 -7.441  1.00 43.25 ? 11 PHE A CD2  3  
ATOM 619  C CE1  . PHE A 1 11 ? 11.688 9.988  -9.979  1.00 45.41 ? 11 PHE A CE1  3  
ATOM 620  C CE2  . PHE A 1 11 ? 11.960 9.777  -7.648  1.00 51.32 ? 11 PHE A CE2  3  
ATOM 621  C CZ   . PHE A 1 11 ? 12.377 9.499  -8.913  1.00 50.01 ? 11 PHE A CZ   3  
ATOM 622  H H    . PHE A 1 11 ? 7.172  13.362 -9.369  1.00 0.00  ? 11 PHE A H    3  
ATOM 623  H HA   . PHE A 1 11 ? 7.828  10.659 -9.689  1.00 0.00  ? 11 PHE A HA   3  
ATOM 624  H HB2  . PHE A 1 11 ? 9.036  12.895 -8.754  1.00 0.00  ? 11 PHE A HB2  3  
ATOM 625  H HB3  . PHE A 1 11 ? 8.736  12.075 -7.213  1.00 0.00  ? 11 PHE A HB3  3  
ATOM 626  H HD1  . PHE A 1 11 ? 9.985  11.174 -10.618 1.00 0.00  ? 11 PHE A HD1  3  
ATOM 627  H HD2  . PHE A 1 11 ? 10.473 10.796 -6.437  1.00 0.00  ? 11 PHE A HD2  3  
ATOM 628  H HE1  . PHE A 1 11 ? 12.020 9.768  -10.983 1.00 0.00  ? 11 PHE A HE1  3  
ATOM 629  H HE2  . PHE A 1 11 ? 12.508 9.390  -6.802  1.00 0.00  ? 11 PHE A HE2  3  
ATOM 630  H HZ   . PHE A 1 11 ? 13.255 8.890  -9.071  1.00 0.00  ? 11 PHE A HZ   3  
ATOM 631  N N    . THR A 1 12 ? 7.589  9.609  -7.168  1.00 41.34 ? 12 THR A N    3  
ATOM 632  C CA   . THR A 1 12 ? 7.031  8.792  -6.104  1.00 31.24 ? 12 THR A CA   3  
ATOM 633  C C    . THR A 1 12 ? 6.422  9.677  -5.014  1.00 54.44 ? 12 THR A C    3  
ATOM 634  O O    . THR A 1 12 ? 5.603  9.216  -4.221  1.00 51.34 ? 12 THR A O    3  
ATOM 635  C CB   . THR A 1 12 ? 8.135  7.866  -5.590  1.00 45.03 ? 12 THR A CB   3  
ATOM 636  O OG1  . THR A 1 12 ? 9.304  8.682  -5.601  1.00 34.15 ? 12 THR A OG1  3  
ATOM 637  C CG2  . THR A 1 12 ? 8.458  6.739  -6.571  1.00 31.50 ? 12 THR A CG2  3  
ATOM 638  H H    . THR A 1 12 ? 8.544  9.460  -7.461  1.00 0.00  ? 12 THR A H    3  
ATOM 639  H HA   . THR A 1 12 ? 6.238  8.176  -6.527  1.00 0.00  ? 12 THR A HA   3  
ATOM 640  H HB   . THR A 1 12 ? 7.914  7.486  -4.592  1.00 0.00  ? 12 THR A HB   3  
ATOM 641  H HG1  . THR A 1 12 ? 9.954  8.318  -4.996  1.00 0.00  ? 12 THR A HG1  3  
ATOM 642  H HG21 . THR A 1 12 ? 9.248  6.112  -6.157  1.00 0.00  ? 12 THR A HG21 3  
ATOM 643  H HG22 . THR A 1 12 ? 8.792  7.166  -7.517  1.00 0.00  ? 12 THR A HG22 3  
ATOM 644  H HG23 . THR A 1 12 ? 7.566  6.136  -6.739  1.00 0.00  ? 12 THR A HG23 3  
ATOM 645  N N    . SER A 1 13 ? 6.847  10.932 -5.011  1.00 20.14 ? 13 SER A N    3  
ATOM 646  C CA   . SER A 1 13 ? 6.354  11.886 -4.031  1.00 12.21 ? 13 SER A CA   3  
ATOM 647  C C    . SER A 1 13 ? 6.580  11.348 -2.617  1.00 21.42 ? 13 SER A C    3  
ATOM 648  O O    . SER A 1 13 ? 5.872  11.726 -1.685  1.00 52.02 ? 13 SER A O    3  
ATOM 649  C CB   . SER A 1 13 ? 4.870  12.187 -4.255  1.00 73.13 ? 13 SER A CB   3  
ATOM 650  O OG   . SER A 1 13 ? 4.164  11.054 -4.751  1.00 51.25 ? 13 SER A OG   3  
ATOM 651  H H    . SER A 1 13 ? 7.523  11.230 -5.699  1.00 0.00  ? 13 SER A H    3  
ATOM 652  H HA   . SER A 1 13 ? 6.915  12.814 -4.141  1.00 0.00  ? 13 SER A HA   3  
ATOM 653  H HB2  . SER A 1 13 ? 4.424  12.499 -3.310  1.00 0.00  ? 13 SER A HB2  3  
ATOM 654  H HB3  . SER A 1 13 ? 4.781  13.000 -4.975  1.00 0.00  ? 13 SER A HB3  3  
ATOM 655  H HG   . SER A 1 13 ? 3.983  10.449 -4.028  1.00 0.00  ? 13 SER A HG   3  
ATOM 656  N N    . CYS A 1 14 ? 7.568  10.473 -2.502  1.00 51.53 ? 14 CYS A N    3  
ATOM 657  C CA   . CYS A 1 14 ? 7.896  9.879  -1.218  1.00 42.13 ? 14 CYS A CA   3  
ATOM 658  C C    . CYS A 1 14 ? 7.988  10.999 -0.180  1.00 34.43 ? 14 CYS A C    3  
ATOM 659  O O    . CYS A 1 14 ? 8.997  11.128 0.512   1.00 24.33 ? 14 CYS A O    3  
ATOM 660  C CB   . CYS A 1 14 ? 9.184  9.057  -1.287  1.00 25.53 ? 14 CYS A CB   3  
ATOM 661  S SG   . CYS A 1 14 ? 9.102  7.429  -0.456  1.00 23.41 ? 14 CYS A SG   3  
ATOM 662  H H    . CYS A 1 14 ? 8.101  10.215 -3.320  1.00 0.00  ? 14 CYS A H    3  
ATOM 663  H HA   . CYS A 1 14 ? 7.081  9.214  -0.931  1.00 0.00  ? 14 CYS A HA   3  
ATOM 664  H HB2  . CYS A 1 14 ? 9.424  8.890  -2.337  1.00 0.00  ? 14 CYS A HB2  3  
ATOM 665  H HB3  . CYS A 1 14 ? 9.990  9.637  -0.835  1.00 0.00  ? 14 CYS A HB3  3  
ATOM 666  H HG   . CYS A 1 14 ? 9.519  7.551  0.807   1.00 0.00  ? 14 CYS A HG   3  
ATOM 667  N N    . ALA A 1 1  ? 9.803  4.552  3.739   1.00 2.41  ? 1  ALA A N    4  
ATOM 668  C CA   . ALA A 1 1  ? 8.967  3.375  3.581   1.00 71.24 ? 1  ALA A CA   4  
ATOM 669  C C    . ALA A 1 1  ? 7.624  3.785  2.974   1.00 72.13 ? 1  ALA A C    4  
ATOM 670  O O    . ALA A 1 1  ? 6.989  4.728  3.441   1.00 40.35 ? 1  ALA A O    4  
ATOM 671  C CB   . ALA A 1 1  ? 8.806  2.678  4.935   1.00 63.24 ? 1  ALA A CB   4  
ATOM 672  H H1   . ALA A 1 1  ? 9.910  5.013  2.847   1.00 0.00  ? 1  ALA A H1   4  
ATOM 673  H H2   . ALA A 1 1  ? 9.370  5.187  4.395   1.00 0.00  ? 1  ALA A H2   4  
ATOM 674  H H3   . ALA A 1 1  ? 10.711 4.276  4.086   1.00 0.00  ? 1  ALA A H3   4  
ATOM 675  H HA   . ALA A 1 1  ? 9.462  2.688  2.895   1.00 0.00  ? 1  ALA A HA   4  
ATOM 676  H HB1  . ALA A 1 1  ? 8.178  1.795  4.817   1.00 0.00  ? 1  ALA A HB1  4  
ATOM 677  H HB2  . ALA A 1 1  ? 9.785  2.381  5.309   1.00 0.00  ? 1  ALA A HB2  4  
ATOM 678  H HB3  . ALA A 1 1  ? 8.339  3.363  5.643   1.00 0.00  ? 1  ALA A HB3  4  
ATOM 679  N N    . GLY A 1 2  ? 7.232  3.056  1.939   1.00 2.50  ? 2  GLY A N    4  
ATOM 680  C CA   . GLY A 1 2  ? 5.977  3.332  1.262   1.00 10.23 ? 2  GLY A CA   4  
ATOM 681  C C    . GLY A 1 2  ? 5.971  4.744  0.673   1.00 24.53 ? 2  GLY A C    4  
ATOM 682  O O    . GLY A 1 2  ? 6.583  5.655  1.229   1.00 33.44 ? 2  GLY A O    4  
ATOM 683  H H    . GLY A 1 2  ? 7.814  2.296  1.617   1.00 0.00  ? 2  GLY A H    4  
ATOM 684  H HA2  . GLY A 1 2  ? 5.840  2.610  0.457   1.00 0.00  ? 2  GLY A HA2  4  
ATOM 685  H HA3  . GLY A 1 2  ? 5.157  3.237  1.973   1.00 0.00  ? 2  GLY A HA3  4  
ATOM 686  N N    . CYS A 1 3  ? 5.271  4.882  -0.445  1.00 22.13 ? 3  CYS A N    4  
ATOM 687  C CA   . CYS A 1 3  ? 5.178  6.169  -1.115  1.00 33.13 ? 3  CYS A CA   4  
ATOM 688  C C    . CYS A 1 3  ? 3.851  6.217  -1.876  1.00 25.21 ? 3  CYS A C    4  
ATOM 689  O O    . CYS A 1 3  ? 3.164  5.204  -1.999  1.00 42.12 ? 3  CYS A O    4  
ATOM 690  C CB   . CYS A 1 3  ? 6.374  6.414  -2.036  1.00 35.35 ? 3  CYS A CB   4  
ATOM 691  S SG   . CYS A 1 3  ? 7.962  5.736  -1.431  1.00 72.24 ? 3  CYS A SG   4  
ATOM 692  H H    . CYS A 1 3  ? 4.797  4.081  -0.836  1.00 0.00  ? 3  CYS A H    4  
ATOM 693  H HA   . CYS A 1 3  ? 5.165  6.950  -0.355  1.00 0.00  ? 3  CYS A HA   4  
ATOM 694  H HB2  . CYS A 1 3  ? 6.157  5.958  -3.002  1.00 0.00  ? 3  CYS A HB2  4  
ATOM 695  H HB3  . CYS A 1 3  ? 6.487  7.489  -2.178  1.00 0.00  ? 3  CYS A HB3  4  
ATOM 696  H HG   . CYS A 1 3  ? 8.134  4.503  -1.915  1.00 0.00  ? 3  CYS A HG   4  
ATOM 697  N N    . LYS A 1 4  ? 3.532  7.406  -2.366  1.00 0.25  ? 4  LYS A N    4  
ATOM 698  C CA   . LYS A 1 4  ? 2.299  7.601  -3.111  1.00 34.42 ? 4  LYS A CA   4  
ATOM 699  C C    . LYS A 1 4  ? 2.551  8.583  -4.256  1.00 54.01 ? 4  LYS A C    4  
ATOM 700  O O    . LYS A 1 4  ? 2.246  9.769  -4.140  1.00 42.43 ? 4  LYS A O    4  
ATOM 701  C CB   . LYS A 1 4  ? 1.167  8.027  -2.173  1.00 5.13  ? 4  LYS A CB   4  
ATOM 702  C CG   . LYS A 1 4  ? -0.188 7.948  -2.879  1.00 70.21 ? 4  LYS A CG   4  
ATOM 703  C CD   . LYS A 1 4  ? -1.316 7.703  -1.875  1.00 31.25 ? 4  LYS A CD   4  
ATOM 704  C CE   . LYS A 1 4  ? -1.486 6.208  -1.597  1.00 64.13 ? 4  LYS A CE   4  
ATOM 705  N NZ   . LYS A 1 4  ? -2.518 5.630  -2.486  1.00 4.25  ? 4  LYS A NZ   4  
ATOM 706  H H    . LYS A 1 4  ? 4.153  8.189  -2.219  1.00 0.00  ? 4  LYS A H    4  
ATOM 707  H HA   . LYS A 1 4  ? 2.023  6.642  -3.550  1.00 0.00  ? 4  LYS A HA   4  
ATOM 708  H HB2  . LYS A 1 4  ? 1.155  7.367  -1.306  1.00 0.00  ? 4  LYS A HB2  4  
ATOM 709  H HB3  . LYS A 1 4  ? 1.341  9.051  -1.843  1.00 0.00  ? 4  LYS A HB3  4  
ATOM 710  H HG2  . LYS A 1 4  ? -0.373 8.887  -3.401  1.00 0.00  ? 4  LYS A HG2  4  
ATOM 711  H HG3  . LYS A 1 4  ? -0.169 7.134  -3.603  1.00 0.00  ? 4  LYS A HG3  4  
ATOM 712  H HD2  . LYS A 1 4  ? -1.080 8.215  -0.942  1.00 0.00  ? 4  LYS A HD2  4  
ATOM 713  H HD3  . LYS A 1 4  ? -2.247 8.102  -2.277  1.00 0.00  ? 4  LYS A HD3  4  
ATOM 714  H HE2  . LYS A 1 4  ? -0.538 5.699  -1.768  1.00 0.00  ? 4  LYS A HE2  4  
ATOM 715  H HE3  . LYS A 1 4  ? -1.788 6.068  -0.559  1.00 0.00  ? 4  LYS A HE3  4  
ATOM 716  H HZ1  . LYS A 1 4  ? -2.618 4.644  -2.291  1.00 0.00  ? 4  LYS A HZ1  4  
ATOM 717  H HZ2  . LYS A 1 4  ? -2.241 5.755  -3.450  1.00 0.00  ? 4  LYS A HZ2  4  
ATOM 718  H HZ3  . LYS A 1 4  ? -3.400 6.096  -2.327  1.00 0.00  ? 4  LYS A HZ3  4  
ATOM 719  N N    . ASN A 1 5  ? 3.104  8.053  -5.337  1.00 63.00 ? 5  ASN A N    4  
ATOM 720  C CA   . ASN A 1 5  ? 3.400  8.868  -6.503  1.00 62.44 ? 5  ASN A CA   4  
ATOM 721  C C    . ASN A 1 5  ? 2.259  9.861  -6.729  1.00 74.20 ? 5  ASN A C    4  
ATOM 722  O O    . ASN A 1 5  ? 1.139  9.640  -6.270  1.00 50.24 ? 5  ASN A O    4  
ATOM 723  C CB   . ASN A 1 5  ? 3.532  8.004  -7.759  1.00 73.21 ? 5  ASN A CB   4  
ATOM 724  C CG   . ASN A 1 5  ? 2.173  7.442  -8.184  1.00 32.34 ? 5  ASN A CG   4  
ATOM 725  O OD1  . ASN A 1 5  ? 1.251  8.166  -8.523  1.00 22.21 ? 5  ASN A OD1  4  
ATOM 726  N ND2  . ASN A 1 5  ? 2.101  6.115  -8.145  1.00 0.22  ? 5  ASN A ND2  4  
ATOM 727  H H    . ASN A 1 5  ? 3.323  7.067  -5.351  1.00 0.00  ? 5  ASN A H    4  
ATOM 728  H HA   . ASN A 1 5  ? 4.329  9.414  -6.339  1.00 0.00  ? 5  ASN A HA   4  
ATOM 729  H HB2  . ASN A 1 5  ? 3.939  8.609  -8.570  1.00 0.00  ? 5  ASN A HB2  4  
ATOM 730  H HB3  . ASN A 1 5  ? 4.211  7.177  -7.553  1.00 0.00  ? 5  ASN A HB3  4  
ATOM 731  H HD21 . ASN A 1 5  ? 2.903  5.574  -7.854  1.00 0.00  ? 5  ASN A HD21 4  
ATOM 732  H HD22 . ASN A 1 5  ? 1.245  5.647  -8.407  1.00 0.00  ? 5  ASN A HD22 4  
ATOM 733  N N    . PHE A 1 6  ? 2.581  10.933 -7.437  1.00 71.41 ? 6  PHE A N    4  
ATOM 734  C CA   . PHE A 1 6  ? 1.596  11.961 -7.730  1.00 24.14 ? 6  PHE A CA   4  
ATOM 735  C C    . PHE A 1 6  ? 1.100  12.627 -6.445  1.00 11.15 ? 6  PHE A C    4  
ATOM 736  O O    . PHE A 1 6  ? -0.102 12.814 -6.263  1.00 21.01 ? 6  PHE A O    4  
ATOM 737  C CB   . PHE A 1 6  ? 0.418  11.268 -8.419  1.00 61.31 ? 6  PHE A CB   4  
ATOM 738  C CG   . PHE A 1 6  ? -0.292 12.136 -9.459  1.00 20.04 ? 6  PHE A CG   4  
ATOM 739  C CD1  . PHE A 1 6  ? -0.153 13.489 -9.426  1.00 64.52 ? 6  PHE A CD1  4  
ATOM 740  C CD2  . PHE A 1 6  ? -1.063 11.556 -10.417 1.00 1.22  ? 6  PHE A CD2  4  
ATOM 741  C CE1  . PHE A 1 6  ? -0.812 14.295 -10.391 1.00 15.24 ? 6  PHE A CE1  4  
ATOM 742  C CE2  . PHE A 1 6  ? -1.723 12.362 -11.383 1.00 64.02 ? 6  PHE A CE2  4  
ATOM 743  C CZ   . PHE A 1 6  ? -1.583 13.715 -11.349 1.00 13.52 ? 6  PHE A CZ   4  
ATOM 744  H H    . PHE A 1 6  ? 3.526  11.038 -7.779  1.00 0.00  ? 6  PHE A H    4  
ATOM 745  H HA   . PHE A 1 6  ? 2.027  12.710 -8.394  1.00 0.00  ? 6  PHE A HA   4  
ATOM 746  H HB2  . PHE A 1 6  ? 0.791  10.373 -8.917  1.00 0.00  ? 6  PHE A HB2  4  
ATOM 747  H HB3  . PHE A 1 6  ? -0.305 10.970 -7.660  1.00 0.00  ? 6  PHE A HB3  4  
ATOM 748  H HD1  . PHE A 1 6  ? 0.460  13.949 -8.665  1.00 0.00  ? 6  PHE A HD1  4  
ATOM 749  H HD2  . PHE A 1 6  ? -1.174 10.482 -10.444 1.00 0.00  ? 6  PHE A HD2  4  
ATOM 750  H HE1  . PHE A 1 6  ? -0.701 15.369 -10.364 1.00 0.00  ? 6  PHE A HE1  4  
ATOM 751  H HE2  . PHE A 1 6  ? -2.335 11.901 -12.144 1.00 0.00  ? 6  PHE A HE2  4  
ATOM 752  H HZ   . PHE A 1 6  ? -2.085 14.328 -12.083 1.00 0.00  ? 6  PHE A HZ   4  
ATOM 753  N N    . PHE A 1 7  ? 2.051  12.965 -5.587  1.00 44.40 ? 7  PHE A N    4  
ATOM 754  C CA   . PHE A 1 7  ? 1.726  13.606 -4.325  1.00 11.11 ? 7  PHE A CA   4  
ATOM 755  C C    . PHE A 1 7  ? 2.921  14.396 -3.786  1.00 15.11 ? 7  PHE A C    4  
ATOM 756  O O    . PHE A 1 7  ? 3.220  14.342 -2.594  1.00 61.25 ? 7  PHE A O    4  
ATOM 757  C CB   . PHE A 1 7  ? 1.378  12.493 -3.333  1.00 63.34 ? 7  PHE A CB   4  
ATOM 758  C CG   . PHE A 1 7  ? 0.861  12.999 -1.986  1.00 63.22 ? 7  PHE A CG   4  
ATOM 759  C CD1  . PHE A 1 7  ? -0.283 13.731 -1.928  1.00 41.11 ? 7  PHE A CD1  4  
ATOM 760  C CD2  . PHE A 1 7  ? 1.546  12.715 -0.845  1.00 41.04 ? 7  PHE A CD2  4  
ATOM 761  C CE1  . PHE A 1 7  ? -0.763 14.200 -0.676  1.00 43.35 ? 7  PHE A CE1  4  
ATOM 762  C CE2  . PHE A 1 7  ? 1.066  13.185 0.406   1.00 2.43  ? 7  PHE A CE2  4  
ATOM 763  C CZ   . PHE A 1 7  ? -0.079 13.917 0.464   1.00 21.53 ? 7  PHE A CZ   4  
ATOM 764  H H    . PHE A 1 7  ? 3.017  12.774 -5.814  1.00 0.00  ? 7  PHE A H    4  
ATOM 765  H HA   . PHE A 1 7  ? 0.870  14.268 -4.454  1.00 0.00  ? 7  PHE A HA   4  
ATOM 766  H HB2  . PHE A 1 7  ? 0.619  11.851 -3.781  1.00 0.00  ? 7  PHE A HB2  4  
ATOM 767  H HB3  . PHE A 1 7  ? 2.276  11.901 -3.155  1.00 0.00  ? 7  PHE A HB3  4  
ATOM 768  H HD1  . PHE A 1 7  ? -0.827 13.955 -2.833  1.00 0.00  ? 7  PHE A HD1  4  
ATOM 769  H HD2  . PHE A 1 7  ? 2.455  12.133 -0.891  1.00 0.00  ? 7  PHE A HD2  4  
ATOM 770  H HE1  . PHE A 1 7  ? -1.672 14.783 -0.631  1.00 0.00  ? 7  PHE A HE1  4  
ATOM 771  H HE2  . PHE A 1 7  ? 1.610  12.961 1.312   1.00 0.00  ? 7  PHE A HE2  4  
ATOM 772  H HZ   . PHE A 1 7  ? -0.445 14.273 1.416   1.00 0.00  ? 7  PHE A HZ   4  
ATOM 773  N N    . TRP A 1 8  ? 3.572  15.112 -4.692  1.00 1.00  ? 8  TRP A N    4  
ATOM 774  C CA   . TRP A 1 8  ? 4.727  15.912 -4.323  1.00 12.31 ? 8  TRP A CA   4  
ATOM 775  C C    . TRP A 1 8  ? 5.187  16.678 -5.564  1.00 50.21 ? 8  TRP A C    4  
ATOM 776  O O    . TRP A 1 8  ? 4.933  17.876 -5.688  1.00 55.13 ? 8  TRP A O    4  
ATOM 777  C CB   . TRP A 1 8  ? 5.829  15.038 -3.719  1.00 21.45 ? 8  TRP A CB   4  
ATOM 778  C CG   . TRP A 1 8  ? 6.909  15.825 -2.974  1.00 32.32 ? 8  TRP A CG   4  
ATOM 779  C CD1  . TRP A 1 8  ? 6.866  16.303 -1.723  1.00 61.24 ? 8  TRP A CD1  4  
ATOM 780  C CD2  . TRP A 1 8  ? 8.201  16.210 -3.488  1.00 53.32 ? 8  TRP A CD2  4  
ATOM 781  N NE1  . TRP A 1 8  ? 8.033  16.964 -1.394  1.00 5.21  ? 8  TRP A NE1  4  
ATOM 782  C CE2  . TRP A 1 8  ? 8.871  16.905 -2.502  1.00 63.34 ? 8  TRP A CE2  4  
ATOM 783  C CE3  . TRP A 1 8  ? 8.786  15.977 -4.746  1.00 0.52  ? 8  TRP A CE3  4  
ATOM 784  C CZ2  . TRP A 1 8  ? 10.159 17.425 -2.670  1.00 43.13 ? 8  TRP A CZ2  4  
ATOM 785  C CZ3  . TRP A 1 8  ? 10.074 16.503 -4.898  1.00 51.11 ? 8  TRP A CZ3  4  
ATOM 786  C CH2  . TRP A 1 8  ? 10.762 17.205 -3.915  1.00 1.31  ? 8  TRP A CH2  4  
ATOM 787  H H    . TRP A 1 8  ? 3.260  15.101 -5.652  1.00 0.00  ? 8  TRP A H    4  
ATOM 788  H HA   . TRP A 1 8  ? 4.415  16.636 -3.571  1.00 0.00  ? 8  TRP A HA   4  
ATOM 789  H HB2  . TRP A 1 8  ? 5.368  14.341 -3.019  1.00 0.00  ? 8  TRP A HB2  4  
ATOM 790  H HB3  . TRP A 1 8  ? 6.301  14.469 -4.520  1.00 0.00  ? 8  TRP A HB3  4  
ATOM 791  H HD1  . TRP A 1 8  ? 6.025  16.186 -1.056  1.00 0.00  ? 8  TRP A HD1  4  
ATOM 792  H HE1  . TRP A 1 8  ? 8.239  17.409 -0.511  1.00 0.00  ? 8  TRP A HE1  4  
ATOM 793  H HE3  . TRP A 1 8  ? 8.282  15.435 -5.532  1.00 0.00  ? 8  TRP A HE3  4  
ATOM 794  H HZ2  . TRP A 1 8  ? 10.662 17.967 -1.882  1.00 0.00  ? 8  TRP A HZ2  4  
ATOM 795  H HZ3  . TRP A 1 8  ? 10.569 16.352 -5.846  1.00 0.00  ? 8  TRP A HZ3  4  
ATOM 796  H HH2  . TRP A 1 8  ? 11.756 17.580 -4.110  1.00 0.00  ? 8  TRP A HH2  4  
ATOM 797  N N    . LYS A 1 9  ? 5.853  15.958 -6.453  1.00 31.12 ? 9  LYS A N    4  
ATOM 798  C CA   . LYS A 1 9  ? 6.350  16.556 -7.681  1.00 42.41 ? 9  LYS A CA   4  
ATOM 799  C C    . LYS A 1 9  ? 6.274  15.527 -8.812  1.00 4.10  ? 9  LYS A C    4  
ATOM 800  O O    . LYS A 1 9  ? 7.226  15.366 -9.574  1.00 41.44 ? 9  LYS A O    4  
ATOM 801  C CB   . LYS A 1 9  ? 7.751  17.133 -7.468  1.00 22.33 ? 9  LYS A CB   4  
ATOM 802  C CG   . LYS A 1 9  ? 7.968  18.379 -8.328  1.00 73.14 ? 9  LYS A CG   4  
ATOM 803  C CD   . LYS A 1 9  ? 9.281  18.285 -9.109  1.00 22.54 ? 9  LYS A CD   4  
ATOM 804  C CE   . LYS A 1 9  ? 9.128  18.877 -10.512 1.00 52.34 ? 9  LYS A CE   4  
ATOM 805  N NZ   . LYS A 1 9  ? 8.929  17.802 -11.509 1.00 40.03 ? 9  LYS A NZ   4  
ATOM 806  H H    . LYS A 1 9  ? 6.020  14.978 -6.275  1.00 0.00  ? 9  LYS A H    4  
ATOM 807  H HA   . LYS A 1 9  ? 5.687  17.382 -7.939  1.00 0.00  ? 9  LYS A HA   4  
ATOM 808  H HB2  . LYS A 1 9  ? 7.870  17.400 -6.418  1.00 0.00  ? 9  LYS A HB2  4  
ATOM 809  H HB3  . LYS A 1 9  ? 8.493  16.380 -7.733  1.00 0.00  ? 9  LYS A HB3  4  
ATOM 810  H HG2  . LYS A 1 9  ? 7.141  18.474 -9.032  1.00 0.00  ? 9  LYS A HG2  4  
ATOM 811  H HG3  . LYS A 1 9  ? 7.995  19.258 -7.685  1.00 0.00  ? 9  LYS A HG3  4  
ATOM 812  H HD2  . LYS A 1 9  ? 10.054 18.835 -8.573  1.00 0.00  ? 9  LYS A HD2  4  
ATOM 813  H HD3  . LYS A 1 9  ? 9.575  17.239 -9.192  1.00 0.00  ? 9  LYS A HD3  4  
ATOM 814  H HE2  . LYS A 1 9  ? 8.268  19.547 -10.529 1.00 0.00  ? 9  LYS A HE2  4  
ATOM 815  H HE3  . LYS A 1 9  ? 10.027 19.439 -10.764 1.00 0.00  ? 9  LYS A HE3  4  
ATOM 816  H HZ1  . LYS A 1 9  ? 8.830  18.208 -12.428 1.00 0.00  ? 9  LYS A HZ1  4  
ATOM 817  H HZ2  . LYS A 1 9  ? 9.727  17.183 -11.499 1.00 0.00  ? 9  LYS A HZ2  4  
ATOM 818  H HZ3  . LYS A 1 9  ? 8.095  17.280 -11.280 1.00 0.00  ? 9  LYS A HZ3  4  
ATOM 819  N N    . THR A 1 10 ? 5.133  14.857 -8.883  1.00 11.01 ? 10 THR A N    4  
ATOM 820  C CA   . THR A 1 10 ? 4.920  13.849 -9.907  1.00 20.44 ? 10 THR A CA   4  
ATOM 821  C C    . THR A 1 10 ? 5.570  12.526 -9.496  1.00 1.24  ? 10 THR A C    4  
ATOM 822  O O    . THR A 1 10 ? 4.932  11.475 -9.546  1.00 75.41 ? 10 THR A O    4  
ATOM 823  C CB   . THR A 1 10 ? 5.453  14.400 -11.232 1.00 40.40 ? 10 THR A CB   4  
ATOM 824  O OG1  . THR A 1 10 ? 5.086  15.777 -11.207 1.00 3.30  ? 10 THR A OG1  4  
ATOM 825  C CG2  . THR A 1 10 ? 4.705  13.838 -12.443 1.00 21.11 ? 10 THR A CG2  4  
ATOM 826  H H    . THR A 1 10 ? 4.401  15.051 -8.215  1.00 0.00  ? 10 THR A H    4  
ATOM 827  H HA   . THR A 1 10 ? 3.848  13.687 -10.010 1.00 0.00  ? 10 THR A HA   4  
ATOM 828  H HB   . THR A 1 10 ? 6.531  14.269 -11.323 1.00 0.00  ? 10 THR A HB   4  
ATOM 829  H HG1  . THR A 1 10 ? 5.726  16.269 -10.687 1.00 0.00  ? 10 THR A HG1  4  
ATOM 830  H HG21 . THR A 1 10 ? 5.122  14.261 -13.357 1.00 0.00  ? 10 THR A HG21 4  
ATOM 831  H HG22 . THR A 1 10 ? 3.649  14.098 -12.371 1.00 0.00  ? 10 THR A HG22 4  
ATOM 832  H HG23 . THR A 1 10 ? 4.812  12.753 -12.464 1.00 0.00  ? 10 THR A HG23 4  
ATOM 833  N N    . PHE A 1 11 ? 6.830  12.620 -9.098  1.00 13.43 ? 11 PHE A N    4  
ATOM 834  C CA   . PHE A 1 11 ? 7.573  11.444 -8.678  1.00 1.33  ? 11 PHE A CA   4  
ATOM 835  C C    . PHE A 1 11 ? 6.800  10.658 -7.617  1.00 0.44  ? 11 PHE A C    4  
ATOM 836  O O    . PHE A 1 11 ? 5.648  10.972 -7.324  1.00 3.00  ? 11 PHE A O    4  
ATOM 837  C CB   . PHE A 1 11 ? 8.888  11.938 -8.073  1.00 33.03 ? 11 PHE A CB   4  
ATOM 838  C CG   . PHE A 1 11 ? 10.080 11.015 -8.335  1.00 72.44 ? 11 PHE A CG   4  
ATOM 839  C CD1  . PHE A 1 11 ? 10.356 10.606 -9.603  1.00 51.33 ? 11 PHE A CD1  4  
ATOM 840  C CD2  . PHE A 1 11 ? 10.862 10.604 -7.303  1.00 43.25 ? 11 PHE A CD2  4  
ATOM 841  C CE1  . PHE A 1 11 ? 11.461 9.749  -9.848  1.00 45.41 ? 11 PHE A CE1  4  
ATOM 842  C CE2  . PHE A 1 11 ? 11.969 9.747  -7.547  1.00 51.32 ? 11 PHE A CE2  4  
ATOM 843  C CZ   . PHE A 1 11 ? 12.245 9.338  -8.815  1.00 50.01 ? 11 PHE A CZ   4  
ATOM 844  H H    . PHE A 1 11 ? 7.282  13.524 -9.086  1.00 0.00  ? 11 PHE A H    4  
ATOM 845  H HA   . PHE A 1 11 ? 7.776  10.806 -9.539  1.00 0.00  ? 11 PHE A HA   4  
ATOM 846  H HB2  . PHE A 1 11 ? 9.112  12.923 -8.482  1.00 0.00  ? 11 PHE A HB2  4  
ATOM 847  H HB3  . PHE A 1 11 ? 8.756  12.029 -6.995  1.00 0.00  ? 11 PHE A HB3  4  
ATOM 848  H HD1  . PHE A 1 11 ? 9.735  10.933 -10.424 1.00 0.00  ? 11 PHE A HD1  4  
ATOM 849  H HD2  . PHE A 1 11 ? 10.643 10.929 -6.296  1.00 0.00  ? 11 PHE A HD2  4  
ATOM 850  H HE1  . PHE A 1 11 ? 11.680 9.423  -10.854 1.00 0.00  ? 11 PHE A HE1  4  
ATOM 851  H HE2  . PHE A 1 11 ? 12.590 9.420  -6.726  1.00 0.00  ? 11 PHE A HE2  4  
ATOM 852  H HZ   . PHE A 1 11 ? 13.086 8.687  -9.001  1.00 0.00  ? 11 PHE A HZ   4  
ATOM 853  N N    . THR A 1 12 ? 7.465  9.651  -7.071  1.00 41.34 ? 12 THR A N    4  
ATOM 854  C CA   . THR A 1 12 ? 6.856  8.817  -6.050  1.00 31.24 ? 12 THR A CA   4  
ATOM 855  C C    . THR A 1 12 ? 6.297  9.683  -4.918  1.00 54.44 ? 12 THR A C    4  
ATOM 856  O O    . THR A 1 12 ? 5.449  9.235  -4.149  1.00 51.34 ? 12 THR A O    4  
ATOM 857  C CB   . THR A 1 12 ? 7.902  7.805  -5.579  1.00 45.03 ? 12 THR A CB   4  
ATOM 858  O OG1  . THR A 1 12 ? 7.462  7.430  -4.277  1.00 34.15 ? 12 THR A OG1  4  
ATOM 859  C CG2  . THR A 1 12 ? 9.271  8.444  -5.341  1.00 31.50 ? 12 THR A CG2  4  
ATOM 860  H H    . THR A 1 12 ? 8.411  9.461  -7.369  1.00 0.00  ? 12 THR A H    4  
ATOM 861  H HA   . THR A 1 12 ? 6.029  8.270  -6.502  1.00 0.00  ? 12 THR A HA   4  
ATOM 862  H HB   . THR A 1 12 ? 7.966  6.946  -6.248  1.00 0.00  ? 12 THR A HB   4  
ATOM 863  H HG1  . THR A 1 12 ? 8.071  6.788  -3.904  1.00 0.00  ? 12 THR A HG1  4  
ATOM 864  H HG21 . THR A 1 12 ? 9.681  8.085  -4.397  1.00 0.00  ? 12 THR A HG21 4  
ATOM 865  H HG22 . THR A 1 12 ? 9.944  8.176  -6.155  1.00 0.00  ? 12 THR A HG22 4  
ATOM 866  H HG23 . THR A 1 12 ? 9.163  9.528  -5.301  1.00 0.00  ? 12 THR A HG23 4  
ATOM 867  N N    . SER A 1 13 ? 6.796  10.909 -4.853  1.00 20.14 ? 13 SER A N    4  
ATOM 868  C CA   . SER A 1 13 ? 6.358  11.842 -3.829  1.00 12.21 ? 13 SER A CA   4  
ATOM 869  C C    . SER A 1 13 ? 6.546  11.224 -2.442  1.00 21.42 ? 13 SER A C    4  
ATOM 870  O O    . SER A 1 13 ? 5.859  11.597 -1.493  1.00 52.02 ? 13 SER A O    4  
ATOM 871  C CB   . SER A 1 13 ? 4.896  12.242 -4.037  1.00 73.13 ? 13 SER A CB   4  
ATOM 872  O OG   . SER A 1 13 ? 4.125  11.179 -4.589  1.00 51.25 ? 13 SER A OG   4  
ATOM 873  H H    . SER A 1 13 ? 7.491  11.199 -5.525  1.00 0.00  ? 13 SER A H    4  
ATOM 874  H HA   . SER A 1 13 ? 6.974  12.739 -3.893  1.00 0.00  ? 13 SER A HA   4  
ATOM 875  H HB2  . SER A 1 13 ? 4.468  12.525 -3.075  1.00 0.00  ? 13 SER A HB2  4  
ATOM 876  H HB3  . SER A 1 13 ? 4.854  13.099 -4.710  1.00 0.00  ? 13 SER A HB3  4  
ATOM 877  H HG   . SER A 1 13 ? 3.904  10.551 -3.897  1.00 0.00  ? 13 SER A HG   4  
ATOM 878  N N    . CYS A 1 14 ? 7.480  10.287 -2.369  1.00 51.53 ? 14 CYS A N    4  
ATOM 879  C CA   . CYS A 1 14 ? 7.767  9.612  -1.114  1.00 42.13 ? 14 CYS A CA   4  
ATOM 880  C C    . CYS A 1 14 ? 7.995  10.676 -0.039  1.00 34.43 ? 14 CYS A C    4  
ATOM 881  O O    . CYS A 1 14 ? 7.126  10.911 0.801   1.00 24.33 ? 14 CYS A O    4  
ATOM 882  C CB   . CYS A 1 14 ? 8.961  8.665  -1.242  1.00 25.53 ? 14 CYS A CB   4  
ATOM 883  S SG   . CYS A 1 14 ? 8.823  7.121  -0.271  1.00 23.41 ? 14 CYS A SG   4  
ATOM 884  H H    . CYS A 1 14 ? 8.001  10.038 -3.198  1.00 0.00  ? 14 CYS A H    4  
ATOM 885  H HA   . CYS A 1 14 ? 6.893  9.025  -0.834  1.00 0.00  ? 14 CYS A HA   4  
ATOM 886  H HB2  . CYS A 1 14 ? 9.069  8.396  -2.293  1.00 0.00  ? 14 CYS A HB2  4  
ATOM 887  H HB3  . CYS A 1 14 ? 9.860  9.194  -0.926  1.00 0.00  ? 14 CYS A HB3  4  
ATOM 888  H HG   . CYS A 1 14 ? 9.327  7.315  0.951   1.00 0.00  ? 14 CYS A HG   4  
ATOM 889  N N    . ALA A 1 1  ? 6.198  8.485  4.600   1.00 2.41  ? 1  ALA A N    5  
ATOM 890  C CA   . ALA A 1 1  ? 4.964  7.744  4.800   1.00 71.24 ? 1  ALA A CA   5  
ATOM 891  C C    . ALA A 1 1  ? 4.743  6.799  3.617   1.00 72.13 ? 1  ALA A C    5  
ATOM 892  O O    . ALA A 1 1  ? 3.675  6.802  3.008   1.00 40.35 ? 1  ALA A O    5  
ATOM 893  C CB   . ALA A 1 1  ? 3.804  8.724  4.989   1.00 63.24 ? 1  ALA A CB   5  
ATOM 894  H H1   . ALA A 1 1  ? 6.963  7.839  4.475   1.00 0.00  ? 1  ALA A H1   5  
ATOM 895  H H2   . ALA A 1 1  ? 6.376  9.066  5.406   1.00 0.00  ? 1  ALA A H2   5  
ATOM 896  H H3   . ALA A 1 1  ? 6.111  9.067  3.778   1.00 0.00  ? 1  ALA A H3   5  
ATOM 897  H HA   . ALA A 1 1  ? 5.063  7.146  5.706   1.00 0.00  ? 1  ALA A HA   5  
ATOM 898  H HB1  . ALA A 1 1  ? 2.879  8.168  5.139   1.00 0.00  ? 1  ALA A HB1  5  
ATOM 899  H HB2  . ALA A 1 1  ? 3.711  9.351  4.102   1.00 0.00  ? 1  ALA A HB2  5  
ATOM 900  H HB3  . ALA A 1 1  ? 3.996  9.351  5.859   1.00 0.00  ? 1  ALA A HB3  5  
ATOM 901  N N    . GLY A 1 2  ? 5.772  6.016  3.326   1.00 2.50  ? 2  GLY A N    5  
ATOM 902  C CA   . GLY A 1 2  ? 5.703  5.069  2.226   1.00 10.23 ? 2  GLY A CA   5  
ATOM 903  C C    . GLY A 1 2  ? 5.767  5.789  0.877   1.00 24.53 ? 2  GLY A C    5  
ATOM 904  O O    . GLY A 1 2  ? 5.483  6.983  0.794   1.00 33.44 ? 2  GLY A O    5  
ATOM 905  H H    . GLY A 1 2  ? 6.616  6.079  3.877   1.00 0.00  ? 2  GLY A H    5  
ATOM 906  H HA2  . GLY A 1 2  ? 6.538  4.372  2.300   1.00 0.00  ? 2  GLY A HA2  5  
ATOM 907  H HA3  . GLY A 1 2  ? 4.767  4.515  2.291   1.00 0.00  ? 2  GLY A HA3  5  
ATOM 908  N N    . CYS A 1 3  ? 6.141  5.033  -0.144  1.00 22.13 ? 3  CYS A N    5  
ATOM 909  C CA   . CYS A 1 3  ? 6.246  5.584  -1.484  1.00 33.13 ? 3  CYS A CA   5  
ATOM 910  C C    . CYS A 1 3  ? 4.851  5.586  -2.112  1.00 25.21 ? 3  CYS A C    5  
ATOM 911  O O    . CYS A 1 3  ? 4.128  4.595  -2.031  1.00 42.12 ? 3  CYS A O    5  
ATOM 912  C CB   . CYS A 1 3  ? 7.254  4.812  -2.336  1.00 35.35 ? 3  CYS A CB   5  
ATOM 913  S SG   . CYS A 1 3  ? 8.344  5.857  -3.372  1.00 72.24 ? 3  CYS A SG   5  
ATOM 914  H H    . CYS A 1 3  ? 6.358  4.059  0.012   1.00 0.00  ? 3  CYS A H    5  
ATOM 915  H HA   . CYS A 1 3  ? 6.586  6.617  -1.403  1.00 0.00  ? 3  CYS A HA   5  
ATOM 916  H HB2  . CYS A 1 3  ? 7.883  4.224  -1.668  1.00 0.00  ? 3  CYS A HB2  5  
ATOM 917  H HB3  . CYS A 1 3  ? 6.707  4.130  -2.987  1.00 0.00  ? 3  CYS A HB3  5  
ATOM 918  H HG   . CYS A 1 3  ? 7.810  5.988  -4.590  1.00 0.00  ? 3  CYS A HG   5  
ATOM 919  N N    . LYS A 1 4  ? 4.514  6.712  -2.726  1.00 0.25  ? 4  LYS A N    5  
ATOM 920  C CA   . LYS A 1 4  ? 3.219  6.856  -3.367  1.00 34.42 ? 4  LYS A CA   5  
ATOM 921  C C    . LYS A 1 4  ? 3.253  8.061  -4.310  1.00 54.01 ? 4  LYS A C    5  
ATOM 922  O O    . LYS A 1 4  ? 3.021  9.192  -3.887  1.00 42.43 ? 4  LYS A O    5  
ATOM 923  C CB   . LYS A 1 4  ? 2.107  6.927  -2.318  1.00 5.13  ? 4  LYS A CB   5  
ATOM 924  C CG   . LYS A 1 4  ? 1.128  5.762  -2.478  1.00 70.21 ? 4  LYS A CG   5  
ATOM 925  C CD   . LYS A 1 4  ? 0.367  5.861  -3.801  1.00 31.25 ? 4  LYS A CD   5  
ATOM 926  C CE   . LYS A 1 4  ? -1.111 5.511  -3.611  1.00 64.13 ? 4  LYS A CE   5  
ATOM 927  N NZ   . LYS A 1 4  ? -1.931 6.139  -4.670  1.00 4.25  ? 4  LYS A NZ   5  
ATOM 928  H H    . LYS A 1 4  ? 5.168  7.481  -2.748  1.00 0.00  ? 4  LYS A H    5  
ATOM 929  H HA   . LYS A 1 4  ? 3.047  5.966  -3.972  1.00 0.00  ? 4  LYS A HA   5  
ATOM 930  H HB2  . LYS A 1 4  ? 2.549  6.891  -1.323  1.00 0.00  ? 4  LYS A HB2  5  
ATOM 931  H HB3  . LYS A 1 4  ? 1.565  7.866  -2.436  1.00 0.00  ? 4  LYS A HB3  5  
ATOM 932  H HG2  . LYS A 1 4  ? 1.684  4.825  -2.456  1.00 0.00  ? 4  LYS A HG2  5  
ATOM 933  H HG3  . LYS A 1 4  ? 0.416  5.777  -1.652  1.00 0.00  ? 4  LYS A HG3  5  
ATOM 934  H HD2  . LYS A 1 4  ? 0.445  6.880  -4.182  1.00 0.00  ? 4  LYS A HD2  5  
ATOM 935  H HD3  . LYS A 1 4  ? 0.809  5.174  -4.521  1.00 0.00  ? 4  LYS A HD3  5  
ATOM 936  H HE2  . LYS A 1 4  ? -1.233 4.429  -3.654  1.00 0.00  ? 4  LYS A HE2  5  
ATOM 937  H HE3  . LYS A 1 4  ? -1.444 5.873  -2.638  1.00 0.00  ? 4  LYS A HE3  5  
ATOM 938  H HZ1  . LYS A 1 4  ? -2.903 5.898  -4.531  1.00 0.00  ? 4  LYS A HZ1  5  
ATOM 939  H HZ2  . LYS A 1 4  ? -1.824 7.142  -4.629  1.00 0.00  ? 4  LYS A HZ2  5  
ATOM 940  H HZ3  . LYS A 1 4  ? -1.628 5.804  -5.574  1.00 0.00  ? 4  LYS A HZ3  5  
ATOM 941  N N    . ASN A 1 5  ? 3.545  7.776  -5.571  1.00 63.00 ? 5  ASN A N    5  
ATOM 942  C CA   . ASN A 1 5  ? 3.612  8.822  -6.578  1.00 62.44 ? 5  ASN A CA   5  
ATOM 943  C C    . ASN A 1 5  ? 2.415  9.761  -6.413  1.00 74.20 ? 5  ASN A C    5  
ATOM 944  O O    . ASN A 1 5  ? 1.469  9.445  -5.693  1.00 50.24 ? 5  ASN A O    5  
ATOM 945  C CB   . ASN A 1 5  ? 3.560  8.232  -7.989  1.00 73.21 ? 5  ASN A CB   5  
ATOM 946  C CG   . ASN A 1 5  ? 2.152  7.741  -8.326  1.00 32.34 ? 5  ASN A CG   5  
ATOM 947  O OD1  . ASN A 1 5  ? 1.693  7.818  -9.454  1.00 22.21 ? 5  ASN A OD1  5  
ATOM 948  N ND2  . ASN A 1 5  ? 1.493  7.232  -7.289  1.00 0.22  ? 5  ASN A ND2  5  
ATOM 949  H H    . ASN A 1 5  ? 3.723  6.818  -5.836  1.00 0.00  ? 5  ASN A H    5  
ATOM 950  H HA   . ASN A 1 5  ? 4.536  9.386  -6.454  1.00 0.00  ? 5  ASN A HA   5  
ATOM 951  H HB2  . ASN A 1 5  ? 3.851  8.999  -8.706  1.00 0.00  ? 5  ASN A HB2  5  
ATOM 952  H HB3  . ASN A 1 5  ? 4.257  7.397  -8.054  1.00 0.00  ? 5  ASN A HB3  5  
ATOM 953  H HD21 . ASN A 1 5  ? 1.932  7.198  -6.380  1.00 0.00  ? 5  ASN A HD21 5  
ATOM 954  H HD22 . ASN A 1 5  ? 0.554  6.880  -7.410  1.00 0.00  ? 5  ASN A HD22 5  
ATOM 955  N N    . PHE A 1 6  ? 2.495  10.895 -7.094  1.00 71.41 ? 6  PHE A N    5  
ATOM 956  C CA   . PHE A 1 6  ? 1.430  11.881 -7.032  1.00 24.14 ? 6  PHE A CA   5  
ATOM 957  C C    . PHE A 1 6  ? 1.172  12.320 -5.589  1.00 11.15 ? 6  PHE A C    5  
ATOM 958  O O    . PHE A 1 6  ? 0.022  12.426 -5.165  1.00 21.01 ? 6  PHE A O    5  
ATOM 959  C CB   . PHE A 1 6  ? 0.169  11.212 -7.582  1.00 61.31 ? 6  PHE A CB   5  
ATOM 960  C CG   . PHE A 1 6  ? -0.007 11.364 -9.095  1.00 20.04 ? 6  PHE A CG   5  
ATOM 961  C CD1  . PHE A 1 6  ? -0.024 12.604 -9.656  1.00 1.22  ? 6  PHE A CD1  5  
ATOM 962  C CD2  . PHE A 1 6  ? -0.146 10.261 -9.878  1.00 64.52 ? 6  PHE A CD2  5  
ATOM 963  C CE1  . PHE A 1 6  ? -0.187 12.745 -11.059 1.00 64.02 ? 6  PHE A CE1  5  
ATOM 964  C CE2  . PHE A 1 6  ? -0.309 10.402 -11.281 1.00 15.24 ? 6  PHE A CE2  5  
ATOM 965  C CZ   . PHE A 1 6  ? -0.326 11.641 -11.842 1.00 13.52 ? 6  PHE A CZ   5  
ATOM 966  H H    . PHE A 1 6  ? 3.308  11.077 -7.664  1.00 0.00  ? 6  PHE A H    5  
ATOM 967  H HA   . PHE A 1 6  ? 1.689  12.746 -7.642  1.00 0.00  ? 6  PHE A HA   5  
ATOM 968  H HB2  . PHE A 1 6  ? 0.215  10.149 -7.348  1.00 0.00  ? 6  PHE A HB2  5  
ATOM 969  H HB3  . PHE A 1 6  ? -0.700 11.643 -7.084  1.00 0.00  ? 6  PHE A HB3  5  
ATOM 970  H HD1  . PHE A 1 6  ? 0.086  13.480 -9.034  1.00 0.00  ? 6  PHE A HD1  5  
ATOM 971  H HD2  . PHE A 1 6  ? -0.132 9.277  -9.432  1.00 0.00  ? 6  PHE A HD2  5  
ATOM 972  H HE1  . PHE A 1 6  ? -0.200 13.728 -11.505 1.00 0.00  ? 6  PHE A HE1  5  
ATOM 973  H HE2  . PHE A 1 6  ? -0.420 9.526  -11.903 1.00 0.00  ? 6  PHE A HE2  5  
ATOM 974  H HZ   . PHE A 1 6  ? -0.450 11.749 -12.910 1.00 0.00  ? 6  PHE A HZ   5  
ATOM 975  N N    . PHE A 1 7  ? 2.261  12.562 -4.874  1.00 44.40 ? 7  PHE A N    5  
ATOM 976  C CA   . PHE A 1 7  ? 2.167  12.987 -3.488  1.00 11.11 ? 7  PHE A CA   5  
ATOM 977  C C    . PHE A 1 7  ? 3.416  13.763 -3.066  1.00 15.11 ? 7  PHE A C    5  
ATOM 978  O O    . PHE A 1 7  ? 3.945  13.550 -1.976  1.00 61.25 ? 7  PHE A O    5  
ATOM 979  C CB   . PHE A 1 7  ? 2.057  11.720 -2.638  1.00 63.34 ? 7  PHE A CB   5  
ATOM 980  C CG   . PHE A 1 7  ? 1.147  11.867 -1.417  1.00 63.22 ? 7  PHE A CG   5  
ATOM 981  C CD1  . PHE A 1 7  ? -0.112 12.362 -1.561  1.00 41.11 ? 7  PHE A CD1  5  
ATOM 982  C CD2  . PHE A 1 7  ? 1.597  11.502 -0.187  1.00 41.04 ? 7  PHE A CD2  5  
ATOM 983  C CE1  . PHE A 1 7  ? -0.955 12.499 -0.427  1.00 43.35 ? 7  PHE A CE1  5  
ATOM 984  C CE2  . PHE A 1 7  ? 0.753  11.639 0.948   1.00 2.43  ? 7  PHE A CE2  5  
ATOM 985  C CZ   . PHE A 1 7  ? -0.505 12.134 0.803   1.00 21.53 ? 7  PHE A CZ   5  
ATOM 986  H H    . PHE A 1 7  ? 3.170  12.450 -5.299  1.00 0.00  ? 7  PHE A H    5  
ATOM 987  H HA   . PHE A 1 7  ? 1.280  13.606 -3.349  1.00 0.00  ? 7  PHE A HA   5  
ATOM 988  H HB2  . PHE A 1 7  ? 1.662  10.920 -3.265  1.00 0.00  ? 7  PHE A HB2  5  
ATOM 989  H HB3  . PHE A 1 7  ? 3.054  11.439 -2.299  1.00 0.00  ? 7  PHE A HB3  5  
ATOM 990  H HD1  . PHE A 1 7  ? -0.470 12.651 -2.538  1.00 0.00  ? 7  PHE A HD1  5  
ATOM 991  H HD2  . PHE A 1 7  ? 2.596  11.108 -0.072  1.00 0.00  ? 7  PHE A HD2  5  
ATOM 992  H HE1  . PHE A 1 7  ? -1.954 12.893 -0.541  1.00 0.00  ? 7  PHE A HE1  5  
ATOM 993  H HE2  . PHE A 1 7  ? 1.110  11.349 1.925   1.00 0.00  ? 7  PHE A HE2  5  
ATOM 994  H HZ   . PHE A 1 7  ? -1.147 12.238 1.666   1.00 0.00  ? 7  PHE A HZ   5  
ATOM 995  N N    . TRP A 1 8  ? 3.852  14.647 -3.951  1.00 1.00  ? 8  TRP A N    5  
ATOM 996  C CA   . TRP A 1 8  ? 5.029  15.455 -3.685  1.00 12.31 ? 8  TRP A CA   5  
ATOM 997  C C    . TRP A 1 8  ? 5.211  16.426 -4.853  1.00 50.21 ? 8  TRP A C    5  
ATOM 998  O O    . TRP A 1 8  ? 4.899  17.610 -4.737  1.00 55.13 ? 8  TRP A O    5  
ATOM 999  C CB   . TRP A 1 8  ? 6.256  14.574 -3.444  1.00 21.45 ? 8  TRP A CB   5  
ATOM 1000 C CG   . TRP A 1 8  ? 7.421  15.300 -2.767  1.00 32.32 ? 8  TRP A CG   5  
ATOM 1001 C CD1  . TRP A 1 8  ? 7.585  15.560 -1.463  1.00 61.24 ? 8  TRP A CD1  5  
ATOM 1002 C CD2  . TRP A 1 8  ? 8.585  15.852 -3.418  1.00 53.32 ? 8  TRP A CD2  5  
ATOM 1003 N NE1  . TRP A 1 8  ? 8.765  16.237 -1.226  1.00 5.21  ? 8  TRP A NE1  5  
ATOM 1004 C CE2  . TRP A 1 8  ? 9.392  16.420 -2.454  1.00 63.34 ? 8  TRP A CE2  5  
ATOM 1005 C CE3  . TRP A 1 8  ? 8.943  15.870 -4.778  1.00 0.52  ? 8  TRP A CE3  5  
ATOM 1006 C CZ2  . TRP A 1 8  ? 10.609 17.047 -2.745  1.00 43.13 ? 8  TRP A CZ2  5  
ATOM 1007 C CZ3  . TRP A 1 8  ? 10.162 16.501 -5.052  1.00 51.11 ? 8  TRP A CZ3  5  
ATOM 1008 C CH2  . TRP A 1 8  ? 10.986 17.079 -4.093  1.00 1.31  ? 8  TRP A CH2  5  
ATOM 1009 H H    . TRP A 1 8  ? 3.358  14.761 -4.825  1.00 0.00  ? 8  TRP A H    5  
ATOM 1010 H HA   . TRP A 1 8  ? 4.845  16.038 -2.782  1.00 0.00  ? 8  TRP A HA   5  
ATOM 1011 H HB2  . TRP A 1 8  ? 5.962  13.729 -2.821  1.00 0.00  ? 8  TRP A HB2  5  
ATOM 1012 H HB3  . TRP A 1 8  ? 6.601  14.196 -4.406  1.00 0.00  ? 8  TRP A HB3  5  
ATOM 1013 H HD1  . TRP A 1 8  ? 6.883  15.276 -0.694  1.00 0.00  ? 8  TRP A HD1  5  
ATOM 1014 H HE1  . TRP A 1 8  ? 9.109  16.543 -0.327  1.00 0.00  ? 8  TRP A HE1  5  
ATOM 1015 H HE3  . TRP A 1 8  ? 8.327  15.431 -5.549  1.00 0.00  ? 8  TRP A HE3  5  
ATOM 1016 H HZ2  . TRP A 1 8  ? 11.223 17.484 -1.971  1.00 0.00  ? 8  TRP A HZ2  5  
ATOM 1017 H HZ3  . TRP A 1 8  ? 10.485 16.543 -6.082  1.00 0.00  ? 8  TRP A HZ3  5  
ATOM 1018 H HH2  . TRP A 1 8  ? 11.913 17.549 -4.386  1.00 0.00  ? 8  TRP A HH2  5  
ATOM 1019 N N    . LYS A 1 9  ? 5.716  15.888 -5.955  1.00 31.12 ? 9  LYS A N    5  
ATOM 1020 C CA   . LYS A 1 9  ? 5.943  16.692 -7.144  1.00 42.41 ? 9  LYS A CA   5  
ATOM 1021 C C    . LYS A 1 9  ? 5.725  15.828 -8.387  1.00 4.10  ? 9  LYS A C    5  
ATOM 1022 O O    . LYS A 1 9  ? 6.537  15.849 -9.312  1.00 41.44 ? 9  LYS A O    5  
ATOM 1023 C CB   . LYS A 1 9  ? 7.322  17.353 -7.087  1.00 22.33 ? 9  LYS A CB   5  
ATOM 1024 C CG   . LYS A 1 9  ? 7.457  18.431 -8.165  1.00 73.14 ? 9  LYS A CG   5  
ATOM 1025 C CD   . LYS A 1 9  ? 8.924  18.659 -8.532  1.00 22.54 ? 9  LYS A CD   5  
ATOM 1026 C CE   . LYS A 1 9  ? 9.520  19.809 -7.719  1.00 52.34 ? 9  LYS A CE   5  
ATOM 1027 N NZ   . LYS A 1 9  ? 10.230 20.757 -8.606  1.00 40.03 ? 9  LYS A NZ   5  
ATOM 1028 H H    . LYS A 1 9  ? 5.946  14.905 -5.968  1.00 0.00  ? 9  LYS A H    5  
ATOM 1029 H HA   . LYS A 1 9  ? 5.195  17.485 -7.156  1.00 0.00  ? 9  LYS A HA   5  
ATOM 1030 H HB2  . LYS A 1 9  ? 7.458  17.810 -6.107  1.00 0.00  ? 9  LYS A HB2  5  
ATOM 1031 H HB3  . LYS A 1 9  ? 8.090  16.595 -7.240  1.00 0.00  ? 9  LYS A HB3  5  
ATOM 1032 H HG2  . LYS A 1 9  ? 6.911  18.116 -9.055  1.00 0.00  ? 9  LYS A HG2  5  
ATOM 1033 H HG3  . LYS A 1 9  ? 7.031  19.364 -7.795  1.00 0.00  ? 9  LYS A HG3  5  
ATOM 1034 H HD2  . LYS A 1 9  ? 9.489  17.748 -8.334  1.00 0.00  ? 9  LYS A HD2  5  
ATOM 1035 H HD3  . LYS A 1 9  ? 8.993  18.899 -9.593  1.00 0.00  ? 9  LYS A HD3  5  
ATOM 1036 H HE2  . LYS A 1 9  ? 8.719  20.334 -7.200  1.00 0.00  ? 9  LYS A HE2  5  
ATOM 1037 H HE3  . LYS A 1 9  ? 10.221 19.407 -6.986  1.00 0.00  ? 9  LYS A HE3  5  
ATOM 1038 H HZ1  . LYS A 1 9  ? 10.618 21.510 -8.054  1.00 0.00  ? 9  LYS A HZ1  5  
ATOM 1039 H HZ2  . LYS A 1 9  ? 9.582  21.135 -9.282  1.00 0.00  ? 9  LYS A HZ2  5  
ATOM 1040 H HZ3  . LYS A 1 9  ? 10.976 20.275 -9.087  1.00 0.00  ? 9  LYS A HZ3  5  
ATOM 1041 N N    . THR A 1 10 ? 4.627  15.087 -8.369  1.00 11.01 ? 10 THR A N    5  
ATOM 1042 C CA   . THR A 1 10 ? 4.293  14.217 -9.484  1.00 20.44 ? 10 THR A CA   5  
ATOM 1043 C C    . THR A 1 10 ? 5.085  12.911 -9.397  1.00 1.24  ? 10 THR A C    5  
ATOM 1044 O O    . THR A 1 10 ? 4.513  11.825 -9.484  1.00 75.41 ? 10 THR A O    5  
ATOM 1045 C CB   . THR A 1 10 ? 4.541  14.992 -10.780 1.00 40.40 ? 10 THR A CB   5  
ATOM 1046 O OG1  . THR A 1 10 ? 4.099  16.314 -10.482 1.00 3.30  ? 10 THR A OG1  5  
ATOM 1047 C CG2  . THR A 1 10 ? 3.622  14.540 -11.917 1.00 21.11 ? 10 THR A CG2  5  
ATOM 1048 H H    . THR A 1 10 ? 4.013  15.128 -7.568  1.00 0.00  ? 10 THR A H    5  
ATOM 1049 H HA   . THR A 1 10 ? 3.231  13.978 -9.426  1.00 0.00  ? 10 THR A HA   5  
ATOM 1050 H HB   . THR A 1 10 ? 5.590  14.971 -11.073 1.00 0.00  ? 10 THR A HB   5  
ATOM 1051 H HG1  . THR A 1 10 ? 4.790  16.783 -10.010 1.00 0.00  ? 10 THR A HG1  5  
ATOM 1052 H HG21 . THR A 1 10 ? 3.838  15.122 -12.813 1.00 0.00  ? 10 THR A HG21 5  
ATOM 1053 H HG22 . THR A 1 10 ? 2.582  14.694 -11.627 1.00 0.00  ? 10 THR A HG22 5  
ATOM 1054 H HG23 . THR A 1 10 ? 3.790  13.483 -12.121 1.00 0.00  ? 10 THR A HG23 5  
ATOM 1055 N N    . PHE A 1 11 ? 6.391  13.058 -9.227  1.00 13.43 ? 11 PHE A N    5  
ATOM 1056 C CA   . PHE A 1 11 ? 7.268  11.904 -9.128  1.00 1.33  ? 11 PHE A CA   5  
ATOM 1057 C C    . PHE A 1 11 ? 6.755  10.914 -8.080  1.00 0.44  ? 11 PHE A C    5  
ATOM 1058 O O    . PHE A 1 11 ? 5.671  11.096 -7.528  1.00 3.00  ? 11 PHE A O    5  
ATOM 1059 C CB   . PHE A 1 11 ? 8.641  12.421 -8.694  1.00 33.03 ? 11 PHE A CB   5  
ATOM 1060 C CG   . PHE A 1 11 ? 9.817  11.652 -9.301  1.00 72.44 ? 11 PHE A CG   5  
ATOM 1061 C CD1  . PHE A 1 11 ? 10.124 11.807 -10.616 1.00 51.33 ? 11 PHE A CD1  5  
ATOM 1062 C CD2  . PHE A 1 11 ? 10.553 10.813 -8.524  1.00 43.25 ? 11 PHE A CD2  5  
ATOM 1063 C CE1  . PHE A 1 11 ? 11.215 11.094 -11.180 1.00 45.41 ? 11 PHE A CE1  5  
ATOM 1064 C CE2  . PHE A 1 11 ? 11.644 10.100 -9.088  1.00 51.32 ? 11 PHE A CE2  5  
ATOM 1065 C CZ   . PHE A 1 11 ? 11.951 10.255 -10.404 1.00 50.01 ? 11 PHE A CZ   5  
ATOM 1066 H H    . PHE A 1 11 ? 6.783  13.987 -9.166  1.00 0.00  ? 11 PHE A H    5  
ATOM 1067 H HA   . PHE A 1 11 ? 7.346  11.412 -10.098 1.00 0.00  ? 11 PHE A HA   5  
ATOM 1068 H HB2  . PHE A 1 11 ? 8.724  13.466 -8.992  1.00 0.00  ? 11 PHE A HB2  5  
ATOM 1069 H HB3  . PHE A 1 11 ? 8.709  12.362 -7.607  1.00 0.00  ? 11 PHE A HB3  5  
ATOM 1070 H HD1  . PHE A 1 11 ? 9.538  12.473 -11.233 1.00 0.00  ? 11 PHE A HD1  5  
ATOM 1071 H HD2  . PHE A 1 11 ? 10.308 10.689 -7.480  1.00 0.00  ? 11 PHE A HD2  5  
ATOM 1072 H HE1  . PHE A 1 11 ? 11.459 11.218 -12.225 1.00 0.00  ? 11 PHE A HE1  5  
ATOM 1073 H HE2  . PHE A 1 11 ? 12.229 9.433  -8.472  1.00 0.00  ? 11 PHE A HE2  5  
ATOM 1074 H HZ   . PHE A 1 11 ? 12.781 9.712  -10.833 1.00 0.00  ? 11 PHE A HZ   5  
ATOM 1075 N N    . THR A 1 12 ? 7.557  9.889  -7.838  1.00 41.34 ? 12 THR A N    5  
ATOM 1076 C CA   . THR A 1 12 ? 7.198  8.869  -6.868  1.00 31.24 ? 12 THR A CA   5  
ATOM 1077 C C    . THR A 1 12 ? 6.785  9.517  -5.544  1.00 54.44 ? 12 THR A C    5  
ATOM 1078 O O    . THR A 1 12 ? 6.096  8.896  -4.734  1.00 51.34 ? 12 THR A O    5  
ATOM 1079 C CB   . THR A 1 12 ? 8.381  7.908  -6.730  1.00 45.03 ? 12 THR A CB   5  
ATOM 1080 O OG1  . THR A 1 12 ? 8.876  7.775  -8.059  1.00 34.15 ? 12 THR A OG1  5  
ATOM 1081 C CG2  . THR A 1 12 ? 7.944  6.492  -6.351  1.00 31.50 ? 12 THR A CG2  5  
ATOM 1082 H H    . THR A 1 12 ? 8.433  9.814  -8.337  1.00 0.00  ? 12 THR A H    5  
ATOM 1083 H HA   . THR A 1 12 ? 6.347  8.311  -7.256  1.00 0.00  ? 12 THR A HA   5  
ATOM 1084 H HB   . THR A 1 12 ? 9.141  8.294  -6.050  1.00 0.00  ? 12 THR A HB   5  
ATOM 1085 H HG1  . THR A 1 12 ? 9.442  8.522  -8.266  1.00 0.00  ? 12 THR A HG1  5  
ATOM 1086 H HG21 . THR A 1 12 ? 7.568  5.979  -7.236  1.00 0.00  ? 12 THR A HG21 5  
ATOM 1087 H HG22 . THR A 1 12 ? 8.795  5.945  -5.948  1.00 0.00  ? 12 THR A HG22 5  
ATOM 1088 H HG23 . THR A 1 12 ? 7.156  6.544  -5.600  1.00 0.00  ? 12 THR A HG23 5  
ATOM 1089 N N    . SER A 1 13 ? 7.222  10.754 -5.365  1.00 20.14 ? 13 SER A N    5  
ATOM 1090 C CA   . SER A 1 13 ? 6.906  11.492 -4.154  1.00 12.21 ? 13 SER A CA   5  
ATOM 1091 C C    . SER A 1 13 ? 7.351  10.696 -2.925  1.00 21.42 ? 13 SER A C    5  
ATOM 1092 O O    . SER A 1 13 ? 6.811  10.878 -1.835  1.00 52.02 ? 13 SER A O    5  
ATOM 1093 C CB   . SER A 1 13 ? 5.410  11.801 -4.072  1.00 73.13 ? 13 SER A CB   5  
ATOM 1094 O OG   . SER A 1 13 ? 4.619  10.781 -4.676  1.00 51.25 ? 13 SER A OG   5  
ATOM 1095 H H    . SER A 1 13 ? 7.783  11.191 -6.082  1.00 0.00  ? 13 SER A H    5  
ATOM 1096 H HA   . SER A 1 13 ? 7.453  12.435 -4.172  1.00 0.00  ? 13 SER A HA   5  
ATOM 1097 H HB2  . SER A 1 13 ? 5.124  11.899 -3.025  1.00 0.00  ? 13 SER A HB2  5  
ATOM 1098 H HB3  . SER A 1 13 ? 5.217  12.744 -4.583  1.00 0.00  ? 13 SER A HB3  5  
ATOM 1099 H HG   . SER A 1 13 ? 3.749  11.129 -4.881  1.00 0.00  ? 13 SER A HG   5  
ATOM 1100 N N    . CYS A 1 14 ? 8.331  9.832  -3.143  1.00 51.53 ? 14 CYS A N    5  
ATOM 1101 C CA   . CYS A 1 14 ? 8.855  9.008  -2.067  1.00 42.13 ? 14 CYS A CA   5  
ATOM 1102 C C    . CYS A 1 14 ? 9.194  9.920  -0.885  1.00 34.43 ? 14 CYS A C    5  
ATOM 1103 O O    . CYS A 1 14 ? 8.955  9.562  0.267   1.00 24.33 ? 14 CYS A O    5  
ATOM 1104 C CB   . CYS A 1 14 ? 10.065 8.188  -2.520  1.00 25.53 ? 14 CYS A CB   5  
ATOM 1105 S SG   . CYS A 1 14 ? 9.922  6.387  -2.231  1.00 23.41 ? 14 CYS A SG   5  
ATOM 1106 H H    . CYS A 1 14 ? 8.721  9.745  -4.071  1.00 0.00  ? 14 CYS A H    5  
ATOM 1107 H HA   . CYS A 1 14 ? 8.072  8.318  -1.753  1.00 0.00  ? 14 CYS A HA   5  
ATOM 1108 H HB2  . CYS A 1 14 ? 10.204 8.350  -3.589  1.00 0.00  ? 14 CYS A HB2  5  
ATOM 1109 H HB3  . CYS A 1 14 ? 10.948 8.555  -1.996  1.00 0.00  ? 14 CYS A HB3  5  
ATOM 1110 H HG   . CYS A 1 14 ? 10.877 5.995  -1.382  1.00 0.00  ? 14 CYS A HG   5  
ATOM 1111 N N    . ALA A 1 1  ? 6.966  0.906  3.562   1.00 2.41  ? 1  ALA A N    6  
ATOM 1112 C CA   . ALA A 1 1  ? 7.636  2.129  3.966   1.00 71.24 ? 1  ALA A CA   6  
ATOM 1113 C C    . ALA A 1 1  ? 6.628  3.280  3.969   1.00 72.13 ? 1  ALA A C    6  
ATOM 1114 O O    . ALA A 1 1  ? 6.633  4.112  4.875   1.00 40.35 ? 1  ALA A O    6  
ATOM 1115 C CB   . ALA A 1 1  ? 8.821  2.395  3.034   1.00 63.24 ? 1  ALA A CB   6  
ATOM 1116 H H1   . ALA A 1 1  ? 6.185  0.731  4.177   1.00 0.00  ? 1  ALA A H1   6  
ATOM 1117 H H2   . ALA A 1 1  ? 6.633  1.001  2.614   1.00 0.00  ? 1  ALA A H2   6  
ATOM 1118 H H3   . ALA A 1 1  ? 7.616  0.134  3.615   1.00 0.00  ? 1  ALA A H3   6  
ATOM 1119 H HA   . ALA A 1 1  ? 8.015  1.999  4.979   1.00 0.00  ? 1  ALA A HA   6  
ATOM 1120 H HB1  . ALA A 1 1  ? 9.323  3.314  3.337   1.00 0.00  ? 1  ALA A HB1  6  
ATOM 1121 H HB2  . ALA A 1 1  ? 8.462  2.499  2.010   1.00 0.00  ? 1  ALA A HB2  6  
ATOM 1122 H HB3  . ALA A 1 1  ? 9.522  1.562  3.091   1.00 0.00  ? 1  ALA A HB3  6  
ATOM 1123 N N    . GLY A 1 2  ? 5.788  3.291  2.945   1.00 2.50  ? 2  GLY A N    6  
ATOM 1124 C CA   . GLY A 1 2  ? 4.775  4.326  2.819   1.00 10.23 ? 2  GLY A CA   6  
ATOM 1125 C C    . GLY A 1 2  ? 4.993  5.154  1.551   1.00 24.53 ? 2  GLY A C    6  
ATOM 1126 O O    . GLY A 1 2  ? 5.400  4.620  0.519   1.00 33.44 ? 2  GLY A O    6  
ATOM 1127 H H    . GLY A 1 2  ? 5.851  2.568  2.242   1.00 0.00  ? 2  GLY A H    6  
ATOM 1128 H HA2  . GLY A 1 2  ? 3.792  3.859  2.775   1.00 0.00  ? 2  GLY A HA2  6  
ATOM 1129 H HA3  . GLY A 1 2  ? 4.823  4.982  3.688   1.00 0.00  ? 2  GLY A HA3  6  
ATOM 1130 N N    . CYS A 1 3  ? 4.712  6.443  1.668   1.00 22.13 ? 3  CYS A N    6  
ATOM 1131 C CA   . CYS A 1 3  ? 4.872  7.349  0.544   1.00 33.13 ? 3  CYS A CA   6  
ATOM 1132 C C    . CYS A 1 3  ? 3.880  6.942  -0.547  1.00 25.21 ? 3  CYS A C    6  
ATOM 1133 O O    . CYS A 1 3  ? 3.241  5.895  -0.450  1.00 42.12 ? 3  CYS A O    6  
ATOM 1134 C CB   . CYS A 1 3  ? 6.313  7.363  0.029   1.00 35.35 ? 3  CYS A CB   6  
ATOM 1135 S SG   . CYS A 1 3  ? 7.481  8.342  1.042   1.00 72.24 ? 3  CYS A SG   6  
ATOM 1136 H H    . CYS A 1 3  ? 4.381  6.802  2.552   1.00 0.00  ? 3  CYS A H    6  
ATOM 1137 H HA   . CYS A 1 3  ? 4.619  8.355  0.877   1.00 0.00  ? 3  CYS A HA   6  
ATOM 1138 H HB2  . CYS A 1 3  ? 6.674  6.336  -0.020  1.00 0.00  ? 3  CYS A HB2  6  
ATOM 1139 H HB3  . CYS A 1 3  ? 6.309  7.778  -0.979  1.00 0.00  ? 3  CYS A HB3  6  
ATOM 1140 H HG   . CYS A 1 3  ? 7.080  8.335  2.316   1.00 0.00  ? 3  CYS A HG   6  
ATOM 1141 N N    . LYS A 1 4  ? 3.783  7.790  -1.560  1.00 0.25  ? 4  LYS A N    6  
ATOM 1142 C CA   . LYS A 1 4  ? 2.879  7.531  -2.669  1.00 34.42 ? 4  LYS A CA   6  
ATOM 1143 C C    . LYS A 1 4  ? 3.105  8.578  -3.761  1.00 54.01 ? 4  LYS A C    6  
ATOM 1144 O O    . LYS A 1 4  ? 3.244  9.765  -3.468  1.00 42.43 ? 4  LYS A O    6  
ATOM 1145 C CB   . LYS A 1 4  ? 1.433  7.458  -2.175  1.00 5.13  ? 4  LYS A CB   6  
ATOM 1146 C CG   . LYS A 1 4  ? 0.726  6.218  -2.728  1.00 70.21 ? 4  LYS A CG   6  
ATOM 1147 C CD   . LYS A 1 4  ? -0.735 6.176  -2.279  1.00 31.25 ? 4  LYS A CD   6  
ATOM 1148 C CE   . LYS A 1 4  ? -1.630 5.609  -3.383  1.00 64.13 ? 4  LYS A CE   6  
ATOM 1149 N NZ   . LYS A 1 4  ? -2.780 4.882  -2.797  1.00 4.25  ? 4  LYS A NZ   6  
ATOM 1150 H H    . LYS A 1 4  ? 4.346  8.628  -1.562  1.00 0.00  ? 4  LYS A H    6  
ATOM 1151 H HA   . LYS A 1 4  ? 3.137  6.557  -3.086  1.00 0.00  ? 4  LYS A HA   6  
ATOM 1152 H HB2  . LYS A 1 4  ? 1.427  7.418  -1.086  1.00 0.00  ? 4  LYS A HB2  6  
ATOM 1153 H HB3  . LYS A 1 4  ? 0.898  8.349  -2.504  1.00 0.00  ? 4  LYS A HB3  6  
ATOM 1154 H HG2  . LYS A 1 4  ? 0.765  6.242  -3.817  1.00 0.00  ? 4  LYS A HG2  6  
ATOM 1155 H HG3  . LYS A 1 4  ? 1.238  5.325  -2.370  1.00 0.00  ? 4  LYS A HG3  6  
ATOM 1156 H HD2  . LYS A 1 4  ? -0.818 5.545  -1.394  1.00 0.00  ? 4  LYS A HD2  6  
ATOM 1157 H HD3  . LYS A 1 4  ? -1.064 7.185  -2.033  1.00 0.00  ? 4  LYS A HD3  6  
ATOM 1158 H HE2  . LYS A 1 4  ? -1.999 6.426  -4.002  1.00 0.00  ? 4  LYS A HE2  6  
ATOM 1159 H HE3  . LYS A 1 4  ? -1.049 4.923  -3.999  1.00 0.00  ? 4  LYS A HE3  6  
ATOM 1160 H HZ1  . LYS A 1 4  ? -3.359 4.515  -3.538  1.00 0.00  ? 4  LYS A HZ1  6  
ATOM 1161 H HZ2  . LYS A 1 4  ? -2.441 4.121  -2.226  1.00 0.00  ? 4  LYS A HZ2  6  
ATOM 1162 H HZ3  . LYS A 1 4  ? -3.322 5.514  -2.226  1.00 0.00  ? 4  LYS A HZ3  6  
ATOM 1163 N N    . ASN A 1 5  ? 3.134  8.101  -4.996  1.00 63.00 ? 5  ASN A N    6  
ATOM 1164 C CA   . ASN A 1 5  ? 3.341  8.982  -6.134  1.00 62.44 ? 5  ASN A CA   6  
ATOM 1165 C C    . ASN A 1 5  ? 2.249  10.053 -6.149  1.00 74.20 ? 5  ASN A C    6  
ATOM 1166 O O    . ASN A 1 5  ? 1.183  9.866  -5.562  1.00 50.24 ? 5  ASN A O    6  
ATOM 1167 C CB   . ASN A 1 5  ? 3.262  8.208  -7.451  1.00 73.21 ? 5  ASN A CB   6  
ATOM 1168 C CG   . ASN A 1 5  ? 1.850  7.671  -7.688  1.00 32.34 ? 5  ASN A CG   6  
ATOM 1169 O OD1  . ASN A 1 5  ? 1.020  7.617  -6.795  1.00 22.21 ? 5  ASN A OD1  6  
ATOM 1170 N ND2  . ASN A 1 5  ? 1.622  7.279  -8.937  1.00 0.22  ? 5  ASN A ND2  6  
ATOM 1171 H H    . ASN A 1 5  ? 3.011  7.111  -5.150  1.00 0.00  ? 5  ASN A H    6  
ATOM 1172 H HA   . ASN A 1 5  ? 4.318  9.460  -6.051  1.00 0.00  ? 5  ASN A HA   6  
ATOM 1173 H HB2  . ASN A 1 5  ? 3.532  8.873  -8.272  1.00 0.00  ? 5  ASN A HB2  6  
ATOM 1174 H HB3  . ASN A 1 5  ? 3.963  7.374  -7.420  1.00 0.00  ? 5  ASN A HB3  6  
ATOM 1175 H HD21 . ASN A 1 5  ? 2.353  7.351  -9.630  1.00 0.00  ? 5  ASN A HD21 6  
ATOM 1176 H HD22 . ASN A 1 5  ? 0.718  6.909  -9.194  1.00 0.00  ? 5  ASN A HD22 6  
ATOM 1177 N N    . PHE A 1 6  ? 2.550  11.152 -6.825  1.00 71.41 ? 6  PHE A N    6  
ATOM 1178 C CA   . PHE A 1 6  ? 1.607  12.253 -6.924  1.00 24.14 ? 6  PHE A CA   6  
ATOM 1179 C C    . PHE A 1 6  ? 1.448  12.961 -5.577  1.00 11.15 ? 6  PHE A C    6  
ATOM 1180 O O    . PHE A 1 6  ? 0.334  13.293 -5.174  1.00 21.01 ? 6  PHE A O    6  
ATOM 1181 C CB   . PHE A 1 6  ? 0.261  11.653 -7.334  1.00 61.31 ? 6  PHE A CB   6  
ATOM 1182 C CG   . PHE A 1 6  ? -0.565 12.553 -8.256  1.00 20.04 ? 6  PHE A CG   6  
ATOM 1183 C CD1  . PHE A 1 6  ? -0.357 13.896 -8.260  1.00 64.52 ? 6  PHE A CD1  6  
ATOM 1184 C CD2  . PHE A 1 6  ? -1.508 12.007 -9.070  1.00 1.22  ? 6  PHE A CD2  6  
ATOM 1185 C CE1  . PHE A 1 6  ? -1.124 14.730 -9.116  1.00 15.24 ? 6  PHE A CE1  6  
ATOM 1186 C CE2  . PHE A 1 6  ? -2.275 12.841 -9.926  1.00 64.02 ? 6  PHE A CE2  6  
ATOM 1187 C CZ   . PHE A 1 6  ? -2.067 14.186 -9.930  1.00 13.52 ? 6  PHE A CZ   6  
ATOM 1188 H H    . PHE A 1 6  ? 3.450  11.226 -7.278  1.00 0.00  ? 6  PHE A H    6  
ATOM 1189 H HA   . PHE A 1 6  ? 1.943  12.963 -7.679  1.00 0.00  ? 6  PHE A HA   6  
ATOM 1190 H HB2  . PHE A 1 6  ? 0.448  10.712 -7.851  1.00 0.00  ? 6  PHE A HB2  6  
ATOM 1191 H HB3  . PHE A 1 6  ? -0.319 11.448 -6.434  1.00 0.00  ? 6  PHE A HB3  6  
ATOM 1192 H HD1  . PHE A 1 6  ? 0.391  14.329 -7.613  1.00 0.00  ? 6  PHE A HD1  6  
ATOM 1193 H HD2  . PHE A 1 6  ? -1.673 10.940 -9.066  1.00 0.00  ? 6  PHE A HD2  6  
ATOM 1194 H HE1  . PHE A 1 6  ? -0.959 15.797 -9.120  1.00 0.00  ? 6  PHE A HE1  6  
ATOM 1195 H HE2  . PHE A 1 6  ? -3.023 12.409 -10.573 1.00 0.00  ? 6  PHE A HE2  6  
ATOM 1196 H HZ   . PHE A 1 6  ? -2.651 14.820 -10.580 1.00 0.00  ? 6  PHE A HZ   6  
ATOM 1197 N N    . PHE A 1 7  ? 2.578  13.170 -4.917  1.00 44.40 ? 7  PHE A N    6  
ATOM 1198 C CA   . PHE A 1 7  ? 2.577  13.832 -3.623  1.00 11.11 ? 7  PHE A CA   6  
ATOM 1199 C C    . PHE A 1 7  ? 3.923  14.508 -3.353  1.00 15.11 ? 7  PHE A C    6  
ATOM 1200 O O    . PHE A 1 7  ? 4.458  14.415 -2.249  1.00 61.25 ? 7  PHE A O    6  
ATOM 1201 C CB   . PHE A 1 7  ? 2.342  12.750 -2.567  1.00 63.34 ? 7  PHE A CB   6  
ATOM 1202 C CG   . PHE A 1 7  ? 0.868  12.405 -2.346  1.00 63.22 ? 7  PHE A CG   6  
ATOM 1203 C CD1  . PHE A 1 7  ? 0.019  13.341 -1.843  1.00 41.11 ? 7  PHE A CD1  6  
ATOM 1204 C CD2  . PHE A 1 7  ? 0.406  11.164 -2.654  1.00 41.04 ? 7  PHE A CD2  6  
ATOM 1205 C CE1  . PHE A 1 7  ? -1.350 13.021 -1.637  1.00 43.35 ? 7  PHE A CE1  6  
ATOM 1206 C CE2  . PHE A 1 7  ? -0.962 10.844 -2.449  1.00 2.43  ? 7  PHE A CE2  6  
ATOM 1207 C CZ   . PHE A 1 7  ? -1.811 11.780 -1.946  1.00 21.53 ? 7  PHE A CZ   6  
ATOM 1208 H H    . PHE A 1 7  ? 3.453  12.865 -5.319  1.00 0.00  ? 7  PHE A H    6  
ATOM 1209 H HA   . PHE A 1 7  ? 1.776  14.570 -3.584  1.00 0.00  ? 7  PHE A HA   6  
ATOM 1210 H HB2  . PHE A 1 7  ? 2.862  11.845 -2.882  1.00 0.00  ? 7  PHE A HB2  6  
ATOM 1211 H HB3  . PHE A 1 7  ? 2.768  13.087 -1.622  1.00 0.00  ? 7  PHE A HB3  6  
ATOM 1212 H HD1  . PHE A 1 7  ? 0.385  14.327 -1.600  1.00 0.00  ? 7  PHE A HD1  6  
ATOM 1213 H HD2  . PHE A 1 7  ? 1.080  10.421 -3.055  1.00 0.00  ? 7  PHE A HD2  6  
ATOM 1214 H HE1  . PHE A 1 7  ? -2.023 13.764 -1.236  1.00 0.00  ? 7  PHE A HE1  6  
ATOM 1215 H HE2  . PHE A 1 7  ? -1.329 9.858  -2.693  1.00 0.00  ? 7  PHE A HE2  6  
ATOM 1216 H HZ   . PHE A 1 7  ? -2.851 11.537 -1.790  1.00 0.00  ? 7  PHE A HZ   6  
ATOM 1217 N N    . TRP A 1 8  ? 4.430  15.174 -4.379  1.00 1.00  ? 8  TRP A N    6  
ATOM 1218 C CA   . TRP A 1 8  ? 5.704  15.867 -4.266  1.00 12.31 ? 8  TRP A CA   6  
ATOM 1219 C C    . TRP A 1 8  ? 5.941  16.633 -5.568  1.00 50.21 ? 8  TRP A C    6  
ATOM 1220 O O    . TRP A 1 8  ? 5.797  17.853 -5.609  1.00 55.13 ? 8  TRP A O    6  
ATOM 1221 C CB   . TRP A 1 8  ? 6.831  14.888 -3.933  1.00 21.45 ? 8  TRP A CB   6  
ATOM 1222 C CG   . TRP A 1 8  ? 8.049  15.542 -3.276  1.00 32.32 ? 8  TRP A CG   6  
ATOM 1223 C CD1  . TRP A 1 8  ? 8.184  15.940 -2.004  1.00 61.24 ? 8  TRP A CD1  6  
ATOM 1224 C CD2  . TRP A 1 8  ? 9.303  15.859 -3.914  1.00 53.32 ? 8  TRP A CD2  6  
ATOM 1225 N NE1  . TRP A 1 8  ? 9.431  16.488 -1.776  1.00 5.21  ? 8  TRP A NE1  6  
ATOM 1226 C CE2  . TRP A 1 8  ? 10.132 16.438 -2.975  1.00 63.34 ? 8  TRP A CE2  6  
ATOM 1227 C CE3  . TRP A 1 8  ? 9.724  15.664 -5.242  1.00 0.52  ? 8  TRP A CE3  6  
ATOM 1228 C CZ2  . TRP A 1 8  ? 11.433 16.868 -3.262  1.00 43.13 ? 8  TRP A CZ2  6  
ATOM 1229 C CZ3  . TRP A 1 8  ? 11.027 16.100 -5.512  1.00 51.11 ? 8  TRP A CZ3  6  
ATOM 1230 C CH2  . TRP A 1 8  ? 11.873 16.684 -4.577  1.00 1.31  ? 8  TRP A CH2  6  
ATOM 1231 H H    . TRP A 1 8  ? 3.925  15.202 -5.254  1.00 0.00  ? 8  TRP A H    6  
ATOM 1232 H HA   . TRP A 1 8  ? 5.628  16.589 -3.453  1.00 0.00  ? 8  TRP A HA   6  
ATOM 1233 H HB2  . TRP A 1 8  ? 6.439  14.132 -3.253  1.00 0.00  ? 8  TRP A HB2  6  
ATOM 1234 H HB3  . TRP A 1 8  ? 7.151  14.398 -4.853  1.00 0.00  ? 8  TRP A HB3  6  
ATOM 1235 H HD1  . TRP A 1 8  ? 7.416  15.843 -1.251  1.00 0.00  ? 8  TRP A HD1  6  
ATOM 1236 H HE1  . TRP A 1 8  ? 9.770  16.858 -0.899  1.00 0.00  ? 8  TRP A HE1  6  
ATOM 1237 H HE3  . TRP A 1 8  ? 9.092  15.214 -5.993  1.00 0.00  ? 8  TRP A HE3  6  
ATOM 1238 H HZ2  . TRP A 1 8  ? 12.063 17.318 -2.509  1.00 0.00  ? 8  TRP A HZ2  6  
ATOM 1239 H HZ3  . TRP A 1 8  ? 11.400 15.974 -6.517  1.00 0.00  ? 8  TRP A HZ3  6  
ATOM 1240 H HH2  . TRP A 1 8  ? 12.867 16.994 -4.865  1.00 0.00  ? 8  TRP A HH2  6  
ATOM 1241 N N    . LYS A 1 9  ? 6.303  15.885 -6.601  1.00 31.12 ? 9  LYS A N    6  
ATOM 1242 C CA   . LYS A 1 9  ? 6.562  16.480 -7.901  1.00 42.41 ? 9  LYS A CA   6  
ATOM 1243 C C    . LYS A 1 9  ? 6.281  15.447 -8.994  1.00 4.10  ? 9  LYS A C    6  
ATOM 1244 O O    . LYS A 1 9  ? 7.112  15.224 -9.872  1.00 41.44 ? 9  LYS A O    6  
ATOM 1245 C CB   . LYS A 1 9  ? 7.979  17.058 -7.953  1.00 22.33 ? 9  LYS A CB   6  
ATOM 1246 C CG   . LYS A 1 9  ? 8.086  18.152 -9.016  1.00 73.14 ? 9  LYS A CG   6  
ATOM 1247 C CD   . LYS A 1 9  ? 9.417  18.061 -9.765  1.00 22.54 ? 9  LYS A CD   6  
ATOM 1248 C CE   . LYS A 1 9  ? 9.616  19.272 -10.678 1.00 52.34 ? 9  LYS A CE   6  
ATOM 1249 N NZ   . LYS A 1 9  ? 9.604  20.524 -9.888  1.00 40.03 ? 9  LYS A NZ   6  
ATOM 1250 H H    . LYS A 1 9  ? 6.400  14.887 -6.482  1.00 0.00  ? 9  LYS A H    6  
ATOM 1251 H HA   . LYS A 1 9  ? 5.862  17.304 -8.034  1.00 0.00  ? 9  LYS A HA   6  
ATOM 1252 H HB2  . LYS A 1 9  ? 8.227  17.481 -6.980  1.00 0.00  ? 9  LYS A HB2  6  
ATOM 1253 H HB3  . LYS A 1 9  ? 8.683  16.260 -8.187  1.00 0.00  ? 9  LYS A HB3  6  
ATOM 1254 H HG2  . LYS A 1 9  ? 7.268  18.038 -9.728  1.00 0.00  ? 9  LYS A HG2  6  
ATOM 1255 H HG3  . LYS A 1 9  ? 8.010  19.127 -8.536  1.00 0.00  ? 9  LYS A HG3  6  
ATOM 1256 H HD2  . LYS A 1 9  ? 10.231 18.022 -9.041  1.00 0.00  ? 9  LYS A HD2  6  
ATOM 1257 H HD3  . LYS A 1 9  ? 9.428  17.152 -10.367 1.00 0.00  ? 9  LYS A HD3  6  
ATOM 1258 H HE2  . LYS A 1 9  ? 10.572 19.181 -11.193 1.00 0.00  ? 9  LYS A HE2  6  
ATOM 1259 H HE3  . LYS A 1 9  ? 8.812  19.304 -11.412 1.00 0.00  ? 9  LYS A HE3  6  
ATOM 1260 H HZ1  . LYS A 1 9  ? 9.737  21.313 -10.505 1.00 0.00  ? 9  LYS A HZ1  6  
ATOM 1261 H HZ2  . LYS A 1 9  ? 10.350 20.500 -9.207  1.00 0.00  ? 9  LYS A HZ2  6  
ATOM 1262 H HZ3  . LYS A 1 9  ? 8.717  20.613 -9.413  1.00 0.00  ? 9  LYS A HZ3  6  
ATOM 1263 N N    . THR A 1 10 ? 5.103  14.845 -8.905  1.00 11.01 ? 10 THR A N    6  
ATOM 1264 C CA   . THR A 1 10 ? 4.701  13.842 -9.876  1.00 20.44 ? 10 THR A CA   6  
ATOM 1265 C C    . THR A 1 10 ? 5.353  12.495 -9.554  1.00 1.24  ? 10 THR A C    6  
ATOM 1266 O O    . THR A 1 10 ? 4.670  11.477 -9.461  1.00 75.41 ? 10 THR A O    6  
ATOM 1267 C CB   . THR A 1 10 ? 5.048  14.366 -11.270 1.00 40.40 ? 10 THR A CB   6  
ATOM 1268 O OG1  . THR A 1 10 ? 4.729  15.754 -11.208 1.00 3.30  ? 10 THR A OG1  6  
ATOM 1269 C CG2  . THR A 1 10 ? 4.115  13.818 -12.351 1.00 21.11 ? 10 THR A CG2  6  
ATOM 1270 H H    . THR A 1 10 ? 4.476  15.087 -8.151  1.00 0.00  ? 10 THR A H    6  
ATOM 1271 H HA   . THR A 1 10 ? 3.620  13.721 -9.815  1.00 0.00  ? 10 THR A HA   6  
ATOM 1272 H HB   . THR A 1 10 ? 6.097  14.201 -11.516 1.00 0.00  ? 10 THR A HB   6  
ATOM 1273 H HG1  . THR A 1 10 ? 5.454  16.231 -10.796 1.00 0.00  ? 10 THR A HG1  6  
ATOM 1274 H HG21 . THR A 1 10 ? 4.405  14.222 -13.321 1.00 0.00  ? 10 THR A HG21 6  
ATOM 1275 H HG22 . THR A 1 10 ? 3.089  14.111 -12.128 1.00 0.00  ? 10 THR A HG22 6  
ATOM 1276 H HG23 . THR A 1 10 ? 4.185  12.731 -12.375 1.00 0.00  ? 10 THR A HG23 6  
ATOM 1277 N N    . PHE A 1 11 ? 6.667  12.535 -9.390  1.00 13.43 ? 11 PHE A N    6  
ATOM 1278 C CA   . PHE A 1 11 ? 7.420  11.331 -9.079  1.00 1.33  ? 11 PHE A CA   6  
ATOM 1279 C C    . PHE A 1 11 ? 6.790  10.579 -7.905  1.00 0.44  ? 11 PHE A C    6  
ATOM 1280 O O    . PHE A 1 11 ? 5.752  10.987 -7.387  1.00 3.00  ? 11 PHE A O    6  
ATOM 1281 C CB   . PHE A 1 11 ? 8.831  11.774 -8.689  1.00 33.03 ? 11 PHE A CB   6  
ATOM 1282 C CG   . PHE A 1 11 ? 9.931  10.809 -9.133  1.00 72.44 ? 11 PHE A CG   6  
ATOM 1283 C CD1  . PHE A 1 11 ? 10.153 10.593 -10.458 1.00 43.25 ? 11 PHE A CD1  6  
ATOM 1284 C CD2  . PHE A 1 11 ? 10.687 10.165 -8.204  1.00 51.33 ? 11 PHE A CD2  6  
ATOM 1285 C CE1  . PHE A 1 11 ? 11.174 9.697  -10.870 1.00 51.32 ? 11 PHE A CE1  6  
ATOM 1286 C CE2  . PHE A 1 11 ? 11.709 9.269  -8.616  1.00 45.41 ? 11 PHE A CE2  6  
ATOM 1287 C CZ   . PHE A 1 11 ? 11.930 9.054  -9.940  1.00 50.01 ? 11 PHE A CZ   6  
ATOM 1288 H H    . PHE A 1 11 ? 7.153  13.416 -9.482  1.00 0.00  ? 11 PHE A H    6  
ATOM 1289 H HA   . PHE A 1 11 ? 7.463  10.683 -9.955  1.00 0.00  ? 11 PHE A HA   6  
ATOM 1290 H HB2  . PHE A 1 11 ? 9.025  12.752 -9.130  1.00 0.00  ? 11 PHE A HB2  6  
ATOM 1291 H HB3  . PHE A 1 11 ? 8.873  11.865 -7.604  1.00 0.00  ? 11 PHE A HB3  6  
ATOM 1292 H HD1  . PHE A 1 11 ? 9.552  11.103 -11.196 1.00 0.00  ? 11 PHE A HD1  6  
ATOM 1293 H HD2  . PHE A 1 11 ? 10.511 10.336 -7.152  1.00 0.00  ? 11 PHE A HD2  6  
ATOM 1294 H HE1  . PHE A 1 11 ? 11.350 9.526  -11.922 1.00 0.00  ? 11 PHE A HE1  6  
ATOM 1295 H HE2  . PHE A 1 11 ? 12.310 8.759  -7.878  1.00 0.00  ? 11 PHE A HE2  6  
ATOM 1296 H HZ   . PHE A 1 11 ? 12.706 8.371  -10.254 1.00 0.00  ? 11 PHE A HZ   6  
ATOM 1297 N N    . THR A 1 12 ? 7.445  9.495  -7.519  1.00 41.34 ? 12 THR A N    6  
ATOM 1298 C CA   . THR A 1 12 ? 6.964  8.682  -6.416  1.00 31.24 ? 12 THR A CA   6  
ATOM 1299 C C    . THR A 1 12 ? 6.594  9.566  -5.223  1.00 54.44 ? 12 THR A C    6  
ATOM 1300 O O    . THR A 1 12 ? 5.800  9.167  -4.373  1.00 51.34 ? 12 THR A O    6  
ATOM 1301 C CB   . THR A 1 12 ? 8.038  7.641  -6.091  1.00 45.03 ? 12 THR A CB   6  
ATOM 1302 O OG1  . THR A 1 12 ? 7.658  7.138  -4.812  1.00 34.15 ? 12 THR A OG1  6  
ATOM 1303 C CG2  . THR A 1 12 ? 9.410  8.272  -5.849  1.00 31.50 ? 12 THR A CG2  6  
ATOM 1304 H H    . THR A 1 12 ? 8.293  9.229  -7.999  1.00 0.00  ? 12 THR A H    6  
ATOM 1305 H HA   . THR A 1 12 ? 6.067  8.157  -6.744  1.00 0.00  ? 12 THR A HA   6  
ATOM 1306 H HB   . THR A 1 12 ? 8.079  6.852  -6.842  1.00 0.00  ? 12 THR A HB   6  
ATOM 1307 H HG1  . THR A 1 12 ? 6.796  6.720  -4.875  1.00 0.00  ? 12 THR A HG1  6  
ATOM 1308 H HG21 . THR A 1 12 ? 9.779  7.976  -4.867  1.00 0.00  ? 12 THR A HG21 6  
ATOM 1309 H HG22 . THR A 1 12 ? 10.106 7.931  -6.616  1.00 0.00  ? 12 THR A HG22 6  
ATOM 1310 H HG23 . THR A 1 12 ? 9.324  9.357  -5.894  1.00 0.00  ? 12 THR A HG23 6  
ATOM 1311 N N    . SER A 1 13 ? 7.188  10.750 -5.199  1.00 20.14 ? 13 SER A N    6  
ATOM 1312 C CA   . SER A 1 13 ? 6.931  11.695 -4.126  1.00 12.21 ? 13 SER A CA   6  
ATOM 1313 C C    . SER A 1 13 ? 7.281  11.063 -2.777  1.00 21.42 ? 13 SER A C    6  
ATOM 1314 O O    . SER A 1 13 ? 7.839  9.967  -2.728  1.00 52.02 ? 13 SER A O    6  
ATOM 1315 C CB   . SER A 1 13 ? 5.471  12.154 -4.134  1.00 73.13 ? 13 SER A CB   6  
ATOM 1316 O OG   . SER A 1 13 ? 4.619  11.213 -4.780  1.00 51.25 ? 13 SER A OG   6  
ATOM 1317 H H    . SER A 1 13 ? 7.829  11.000 -5.938  1.00 0.00  ? 13 SER A H    6  
ATOM 1318 H HA   . SER A 1 13 ? 7.568  12.567 -4.274  1.00 0.00  ? 13 SER A HA   6  
ATOM 1319 H HB2  . SER A 1 13 ? 5.137  12.281 -3.104  1.00 0.00  ? 13 SER A HB2  6  
ATOM 1320 H HB3  . SER A 1 13 ? 5.401  13.111 -4.651  1.00 0.00  ? 13 SER A HB3  6  
ATOM 1321 H HG   . SER A 1 13 ? 5.107  10.764 -5.475  1.00 0.00  ? 13 SER A HG   6  
ATOM 1322 N N    . CYS A 1 14 ? 6.939  11.780 -1.717  1.00 51.53 ? 14 CYS A N    6  
ATOM 1323 C CA   . CYS A 1 14 ? 7.211  11.302 -0.372  1.00 42.13 ? 14 CYS A CA   6  
ATOM 1324 C C    . CYS A 1 14 ? 6.856  12.417 0.614   1.00 34.43 ? 14 CYS A C    6  
ATOM 1325 O O    . CYS A 1 14 ? 6.120  13.341 0.273   1.00 24.33 ? 14 CYS A O    6  
ATOM 1326 C CB   . CYS A 1 14 ? 8.662  10.843 -0.217  1.00 25.53 ? 14 CYS A CB   6  
ATOM 1327 S SG   . CYS A 1 14 ? 8.895  9.028  -0.198  1.00 23.41 ? 14 CYS A SG   6  
ATOM 1328 H H    . CYS A 1 14 ? 6.483  12.672 -1.846  1.00 0.00  ? 14 CYS A H    6  
ATOM 1329 H HA   . CYS A 1 14 ? 6.561  10.451 -0.173  1.00 0.00  ? 14 CYS A HA   6  
ATOM 1330 H HB2  . CYS A 1 14 ? 9.237  11.250 -1.049  1.00 0.00  ? 14 CYS A HB2  6  
ATOM 1331 H HB3  . CYS A 1 14 ? 9.059  11.254 0.711   1.00 0.00  ? 14 CYS A HB3  6  
ATOM 1332 H HG   . CYS A 1 14 ? 9.915  8.701  -0.997  1.00 0.00  ? 14 CYS A HG   6  
ATOM 1333 N N    . ALA A 1 1  ? 7.372  5.578  6.457   1.00 2.41  ? 1  ALA A N    7  
ATOM 1334 C CA   . ALA A 1 1  ? 6.347  4.690  5.935   1.00 71.24 ? 1  ALA A CA   7  
ATOM 1335 C C    . ALA A 1 1  ? 5.344  5.501  5.113   1.00 72.13 ? 1  ALA A C    7  
ATOM 1336 O O    . ALA A 1 1  ? 4.897  6.562  5.545   1.00 40.35 ? 1  ALA A O    7  
ATOM 1337 C CB   . ALA A 1 1  ? 5.682  3.942  7.093   1.00 63.24 ? 1  ALA A CB   7  
ATOM 1338 H H1   . ALA A 1 1  ? 7.811  6.072  5.692   1.00 0.00  ? 1  ALA A H1   7  
ATOM 1339 H H2   . ALA A 1 1  ? 8.067  5.037  6.951   1.00 0.00  ? 1  ALA A H2   7  
ATOM 1340 H H3   . ALA A 1 1  ? 6.951  6.244  7.089   1.00 0.00  ? 1  ALA A H3   7  
ATOM 1341 H HA   . ALA A 1 1  ? 6.823  3.960  5.279   1.00 0.00  ? 1  ALA A HA   7  
ATOM 1342 H HB1  . ALA A 1 1  ? 4.914  3.275  6.702   1.00 0.00  ? 1  ALA A HB1  7  
ATOM 1343 H HB2  . ALA A 1 1  ? 6.432  3.358  7.626   1.00 0.00  ? 1  ALA A HB2  7  
ATOM 1344 H HB3  . ALA A 1 1  ? 5.228  4.660  7.776   1.00 0.00  ? 1  ALA A HB3  7  
ATOM 1345 N N    . GLY A 1 2  ? 5.020  4.972  3.943   1.00 2.50  ? 2  GLY A N    7  
ATOM 1346 C CA   . GLY A 1 2  ? 4.078  5.634  3.057   1.00 10.23 ? 2  GLY A CA   7  
ATOM 1347 C C    . GLY A 1 2  ? 4.641  5.742  1.639   1.00 24.53 ? 2  GLY A C    7  
ATOM 1348 O O    . GLY A 1 2  ? 5.053  4.741  1.053   1.00 33.44 ? 2  GLY A O    7  
ATOM 1349 H H    . GLY A 1 2  ? 5.434  4.095  3.663   1.00 0.00  ? 2  GLY A H    7  
ATOM 1350 H HA2  . GLY A 1 2  ? 3.149  5.064  3.031   1.00 0.00  ? 2  GLY A HA2  7  
ATOM 1351 H HA3  . GLY A 1 2  ? 3.875  6.635  3.436   1.00 0.00  ? 2  GLY A HA3  7  
ATOM 1352 N N    . CYS A 1 3  ? 4.642  6.963  1.128   1.00 22.13 ? 3  CYS A N    7  
ATOM 1353 C CA   . CYS A 1 3  ? 5.148  7.215  -0.211  1.00 33.13 ? 3  CYS A CA   7  
ATOM 1354 C C    . CYS A 1 3  ? 4.085  6.770  -1.218  1.00 25.21 ? 3  CYS A C    7  
ATOM 1355 O O    . CYS A 1 3  ? 3.428  5.750  -1.022  1.00 42.12 ? 3  CYS A O    7  
ATOM 1356 C CB   . CYS A 1 3  ? 6.488  6.516  -0.449  1.00 35.35 ? 3  CYS A CB   7  
ATOM 1357 S SG   . CYS A 1 3  ? 7.592  7.357  -1.642  1.00 72.24 ? 3  CYS A SG   7  
ATOM 1358 H H    . CYS A 1 3  ? 4.285  7.732  1.677   1.00 0.00  ? 3  CYS A H    7  
ATOM 1359 H HA   . CYS A 1 3  ? 5.298  8.288  -0.324  1.00 0.00  ? 3  CYS A HA   7  
ATOM 1360 H HB2  . CYS A 1 3  ? 7.010  6.449  0.506   1.00 0.00  ? 3  CYS A HB2  7  
ATOM 1361 H HB3  . CYS A 1 3  ? 6.294  5.506  -0.810  1.00 0.00  ? 3  CYS A HB3  7  
ATOM 1362 H HG   . CYS A 1 3  ? 7.126  7.180  -2.882  1.00 0.00  ? 3  CYS A HG   7  
ATOM 1363 N N    . LYS A 1 4  ? 3.951  7.559  -2.275  1.00 0.25  ? 4  LYS A N    7  
ATOM 1364 C CA   . LYS A 1 4  ? 2.979  7.259  -3.312  1.00 34.42 ? 4  LYS A CA   7  
ATOM 1365 C C    . LYS A 1 4  ? 3.046  8.339  -4.394  1.00 54.01 ? 4  LYS A C    7  
ATOM 1366 O O    . LYS A 1 4  ? 2.741  9.502  -4.135  1.00 42.43 ? 4  LYS A O    7  
ATOM 1367 C CB   . LYS A 1 4  ? 1.586  7.081  -2.706  1.00 5.13  ? 4  LYS A CB   7  
ATOM 1368 C CG   . LYS A 1 4  ? 1.251  5.599  -2.525  1.00 70.21 ? 4  LYS A CG   7  
ATOM 1369 C CD   . LYS A 1 4  ? 0.156  5.161  -3.499  1.00 31.25 ? 4  LYS A CD   7  
ATOM 1370 C CE   . LYS A 1 4  ? 0.550  3.874  -4.226  1.00 64.13 ? 4  LYS A CE   7  
ATOM 1371 N NZ   . LYS A 1 4  ? 1.685  4.122  -5.143  1.00 4.25  ? 4  LYS A NZ   7  
ATOM 1372 H H    . LYS A 1 4  ? 4.533  8.380  -2.360  1.00 0.00  ? 4  LYS A H    7  
ATOM 1373 H HA   . LYS A 1 4  ? 3.264  6.313  -3.770  1.00 0.00  ? 4  LYS A HA   7  
ATOM 1374 H HB2  . LYS A 1 4  ? 1.550  7.578  -1.737  1.00 0.00  ? 4  LYS A HB2  7  
ATOM 1375 H HB3  . LYS A 1 4  ? 0.848  7.535  -3.369  1.00 0.00  ? 4  LYS A HB3  7  
ATOM 1376 H HG2  . LYS A 1 4  ? 2.147  5.007  -2.707  1.00 0.00  ? 4  LYS A HG2  7  
ATOM 1377 H HG3  . LYS A 1 4  ? 0.910  5.431  -1.504  1.00 0.00  ? 4  LYS A HG3  7  
ATOM 1378 H HD2  . LYS A 1 4  ? -0.766 4.990  -2.944  1.00 0.00  ? 4  LYS A HD2  7  
ATOM 1379 H HD3  . LYS A 1 4  ? -0.008 5.951  -4.232  1.00 0.00  ? 4  LYS A HD3  7  
ATOM 1380 H HE2  . LYS A 1 4  ? 0.841  3.122  -3.491  1.00 0.00  ? 4  LYS A HE2  7  
ATOM 1381 H HE3  . LYS A 1 4  ? -0.302 3.507  -4.798  1.00 0.00  ? 4  LYS A HE3  7  
ATOM 1382 H HZ1  . LYS A 1 4  ? 1.932  3.263  -5.614  1.00 0.00  ? 4  LYS A HZ1  7  
ATOM 1383 H HZ2  . LYS A 1 4  ? 1.419  4.816  -5.827  1.00 0.00  ? 4  LYS A HZ2  7  
ATOM 1384 H HZ3  . LYS A 1 4  ? 2.478  4.457  -4.615  1.00 0.00  ? 4  LYS A HZ3  7  
ATOM 1385 N N    . ASN A 1 5  ? 3.448  7.915  -5.584  1.00 63.00 ? 5  ASN A N    7  
ATOM 1386 C CA   . ASN A 1 5  ? 3.559  8.831  -6.707  1.00 62.44 ? 5  ASN A CA   7  
ATOM 1387 C C    . ASN A 1 5  ? 2.379  9.805  -6.683  1.00 74.20 ? 5  ASN A C    7  
ATOM 1388 O O    . ASN A 1 5  ? 1.344  9.517  -6.084  1.00 50.24 ? 5  ASN A O    7  
ATOM 1389 C CB   . ASN A 1 5  ? 3.524  8.078  -8.038  1.00 73.21 ? 5  ASN A CB   7  
ATOM 1390 C CG   . ASN A 1 5  ? 2.141  7.474  -8.289  1.00 32.34 ? 5  ASN A CG   7  
ATOM 1391 O OD1  . ASN A 1 5  ? 1.485  6.966  -7.395  1.00 22.21 ? 5  ASN A OD1  7  
ATOM 1392 N ND2  . ASN A 1 5  ? 1.736  7.559  -9.554  1.00 0.22  ? 5  ASN A ND2  7  
ATOM 1393 H H    . ASN A 1 5  ? 3.680  6.940  -5.712  1.00 0.00  ? 5  ASN A H    7  
ATOM 1394 H HA   . ASN A 1 5  ? 4.492  9.389  -6.629  1.00 0.00  ? 5  ASN A HA   7  
ATOM 1395 H HB2  . ASN A 1 5  ? 3.767  8.767  -8.846  1.00 0.00  ? 5  ASN A HB2  7  
ATOM 1396 H HB3  . ASN A 1 5  ? 4.264  7.278  -8.014  1.00 0.00  ? 5  ASN A HB3  7  
ATOM 1397 H HD21 . ASN A 1 5  ? 2.329  7.993  -10.246 1.00 0.00  ? 5  ASN A HD21 7  
ATOM 1398 H HD22 . ASN A 1 5  ? 0.835  7.188  -9.821  1.00 0.00  ? 5  ASN A HD22 7  
ATOM 1399 N N    . PHE A 1 6  ? 2.575  10.938 -7.341  1.00 71.41 ? 6  PHE A N    7  
ATOM 1400 C CA   . PHE A 1 6  ? 1.540  11.956 -7.404  1.00 24.14 ? 6  PHE A CA   7  
ATOM 1401 C C    . PHE A 1 6  ? 1.236  12.514 -6.013  1.00 11.15 ? 6  PHE A C    7  
ATOM 1402 O O    . PHE A 1 6  ? 0.074  12.711 -5.659  1.00 21.01 ? 6  PHE A O    7  
ATOM 1403 C CB   . PHE A 1 6  ? 0.283  11.282 -7.956  1.00 61.31 ? 6  PHE A CB   7  
ATOM 1404 C CG   . PHE A 1 6  ? -0.406 12.070 -9.073  1.00 20.04 ? 6  PHE A CG   7  
ATOM 1405 C CD1  . PHE A 1 6  ? -0.415 13.430 -9.039  1.00 64.52 ? 6  PHE A CD1  7  
ATOM 1406 C CD2  . PHE A 1 6  ? -1.009 11.411 -10.098 1.00 1.22  ? 6  PHE A CD2  7  
ATOM 1407 C CE1  . PHE A 1 6  ? -1.056 14.161 -10.075 1.00 15.24 ? 6  PHE A CE1  7  
ATOM 1408 C CE2  . PHE A 1 6  ? -1.649 12.142 -11.134 1.00 64.02 ? 6  PHE A CE2  7  
ATOM 1409 C CZ   . PHE A 1 6  ? -1.658 13.501 -11.100 1.00 13.52 ? 6  PHE A CZ   7  
ATOM 1410 H H    . PHE A 1 6  ? 3.458  11.097 -7.806  1.00 0.00  ? 6  PHE A H    7  
ATOM 1411 H HA   . PHE A 1 6  ? 1.851  12.762 -8.068  1.00 0.00  ? 6  PHE A HA   7  
ATOM 1412 H HB2  . PHE A 1 6  ? 0.563  10.305 -8.348  1.00 0.00  ? 6  PHE A HB2  7  
ATOM 1413 H HB3  . PHE A 1 6  ? -0.425 11.142 -7.139  1.00 0.00  ? 6  PHE A HB3  7  
ATOM 1414 H HD1  . PHE A 1 6  ? 0.063  13.953 -8.225  1.00 0.00  ? 6  PHE A HD1  7  
ATOM 1415 H HD2  . PHE A 1 6  ? -1.001 10.331 -10.124 1.00 0.00  ? 6  PHE A HD2  7  
ATOM 1416 H HE1  . PHE A 1 6  ? -1.064 15.240 -10.049 1.00 0.00  ? 6  PHE A HE1  7  
ATOM 1417 H HE2  . PHE A 1 6  ? -2.127 11.618 -11.948 1.00 0.00  ? 6  PHE A HE2  7  
ATOM 1418 H HZ   . PHE A 1 6  ? -2.145 14.057 -11.888 1.00 0.00  ? 6  PHE A HZ   7  
ATOM 1419 N N    . PHE A 1 7  ? 2.299  12.754 -5.260  1.00 44.40 ? 7  PHE A N    7  
ATOM 1420 C CA   . PHE A 1 7  ? 2.160  13.286 -3.914  1.00 11.11 ? 7  PHE A CA   7  
ATOM 1421 C C    . PHE A 1 7  ? 3.439  14.001 -3.473  1.00 15.11 ? 7  PHE A C    7  
ATOM 1422 O O    . PHE A 1 7  ? 3.870  13.860 -2.330  1.00 61.25 ? 7  PHE A O    7  
ATOM 1423 C CB   . PHE A 1 7  ? 1.909  12.096 -2.987  1.00 63.34 ? 7  PHE A CB   7  
ATOM 1424 C CG   . PHE A 1 7  ? 1.050  12.429 -1.766  1.00 63.22 ? 7  PHE A CG   7  
ATOM 1425 C CD1  . PHE A 1 7  ? -0.287 12.630 -1.910  1.00 41.11 ? 7  PHE A CD1  7  
ATOM 1426 C CD2  . PHE A 1 7  ? 1.623  12.524 -0.536  1.00 41.04 ? 7  PHE A CD2  7  
ATOM 1427 C CE1  . PHE A 1 7  ? -1.085 12.940 -0.777  1.00 43.35 ? 7  PHE A CE1  7  
ATOM 1428 C CE2  . PHE A 1 7  ? 0.826  12.833 0.597   1.00 2.43  ? 7  PHE A CE2  7  
ATOM 1429 C CZ   . PHE A 1 7  ? -0.511 13.034 0.453   1.00 21.53 ? 7  PHE A CZ   7  
ATOM 1430 H H    . PHE A 1 7  ? 3.221  12.565 -5.626  1.00 0.00  ? 7  PHE A H    7  
ATOM 1431 H HA   . PHE A 1 7  ? 1.316  13.975 -3.872  1.00 0.00  ? 7  PHE A HA   7  
ATOM 1432 H HB2  . PHE A 1 7  ? 1.405  11.317 -3.559  1.00 0.00  ? 7  PHE A HB2  7  
ATOM 1433 H HB3  . PHE A 1 7  ? 2.870  11.711 -2.644  1.00 0.00  ? 7  PHE A HB3  7  
ATOM 1434 H HD1  . PHE A 1 7  ? -0.743 12.554 -2.887  1.00 0.00  ? 7  PHE A HD1  7  
ATOM 1435 H HD2  . PHE A 1 7  ? 2.685  12.364 -0.421  1.00 0.00  ? 7  PHE A HD2  7  
ATOM 1436 H HE1  . PHE A 1 7  ? -2.147 13.101 -0.892  1.00 0.00  ? 7  PHE A HE1  7  
ATOM 1437 H HE2  . PHE A 1 7  ? 1.281  12.908 1.573   1.00 0.00  ? 7  PHE A HE2  7  
ATOM 1438 H HZ   . PHE A 1 7  ? -1.118 13.269 1.315   1.00 0.00  ? 7  PHE A HZ   7  
ATOM 1439 N N    . TRP A 1 8  ? 4.009  14.753 -4.402  1.00 1.00  ? 8  TRP A N    7  
ATOM 1440 C CA   . TRP A 1 8  ? 5.230  15.491 -4.124  1.00 12.31 ? 8  TRP A CA   7  
ATOM 1441 C C    . TRP A 1 8  ? 5.509  16.411 -5.313  1.00 50.21 ? 8  TRP A C    7  
ATOM 1442 O O    . TRP A 1 8  ? 5.283  17.617 -5.236  1.00 55.13 ? 8  TRP A O    7  
ATOM 1443 C CB   . TRP A 1 8  ? 6.388  14.538 -3.819  1.00 21.45 ? 8  TRP A CB   7  
ATOM 1444 C CG   . TRP A 1 8  ? 7.588  15.211 -3.149  1.00 32.32 ? 8  TRP A CG   7  
ATOM 1445 C CD1  . TRP A 1 8  ? 7.743  15.521 -1.855  1.00 61.24 ? 8  TRP A CD1  7  
ATOM 1446 C CD2  . TRP A 1 8  ? 8.801  15.647 -3.797  1.00 53.32 ? 8  TRP A CD2  7  
ATOM 1447 N NE1  . TRP A 1 8  ? 8.963  16.123 -1.622  1.00 5.21  ? 8  TRP A NE1  7  
ATOM 1448 C CE2  . TRP A 1 8  ? 9.627  16.202 -2.841  1.00 63.34 ? 8  TRP A CE2  7  
ATOM 1449 C CE3  . TRP A 1 8  ? 9.190  15.576 -5.147  1.00 0.52  ? 8  TRP A CE3  7  
ATOM 1450 C CZ2  . TRP A 1 8  ? 10.892 16.728 -3.131  1.00 43.13 ? 8  TRP A CZ2  7  
ATOM 1451 C CZ3  . TRP A 1 8  ? 10.455 16.106 -5.420  1.00 51.11 ? 8  TRP A CZ3  7  
ATOM 1452 C CH2  . TRP A 1 8  ? 11.299 16.667 -4.470  1.00 1.31  ? 8  TRP A CH2  7  
ATOM 1453 H H    . TRP A 1 8  ? 3.589  14.814 -5.319  1.00 0.00  ? 8  TRP A H    7  
ATOM 1454 H HA   . TRP A 1 8  ? 5.060  16.112 -3.244  1.00 0.00  ? 8  TRP A HA   7  
ATOM 1455 H HB2  . TRP A 1 8  ? 6.025  13.743 -3.168  1.00 0.00  ? 8  TRP A HB2  7  
ATOM 1456 H HB3  . TRP A 1 8  ? 6.724  14.096 -4.757  1.00 0.00  ? 8  TRP A HB3  7  
ATOM 1457 H HD1  . TRP A 1 8  ? 7.007  15.325 -1.090  1.00 0.00  ? 8  TRP A HD1  7  
ATOM 1458 H HE1  . TRP A 1 8  ? 9.310  16.447 -0.731  1.00 0.00  ? 8  TRP A HE1  7  
ATOM 1459 H HE3  . TRP A 1 8  ? 8.560  15.147 -5.912  1.00 0.00  ? 8  TRP A HE3  7  
ATOM 1460 H HZ2  . TRP A 1 8  ? 11.520 17.157 -2.365  1.00 0.00  ? 8  TRP A HZ2  7  
ATOM 1461 H HZ3  . TRP A 1 8  ? 10.801 16.075 -6.443  1.00 0.00  ? 8  TRP A HZ3  7  
ATOM 1462 H HH2  . TRP A 1 8  ? 12.264 17.056 -4.762  1.00 0.00  ? 8  TRP A HH2  7  
ATOM 1463 N N    . LYS A 1 9  ? 5.996  15.806 -6.387  1.00 31.12 ? 9  LYS A N    7  
ATOM 1464 C CA   . LYS A 1 9  ? 6.308  16.555 -7.592  1.00 42.41 ? 9  LYS A CA   7  
ATOM 1465 C C    . LYS A 1 9  ? 6.021  15.686 -8.817  1.00 4.10  ? 9  LYS A C    7  
ATOM 1466 O O    . LYS A 1 9  ? 6.802  15.669 -9.767  1.00 41.44 ? 9  LYS A O    7  
ATOM 1467 C CB   . LYS A 1 9  ? 7.743  17.085 -7.536  1.00 22.33 ? 9  LYS A CB   7  
ATOM 1468 C CG   . LYS A 1 9  ? 7.909  18.313 -8.434  1.00 73.14 ? 9  LYS A CG   7  
ATOM 1469 C CD   . LYS A 1 9  ? 9.173  19.093 -8.067  1.00 22.54 ? 9  LYS A CD   7  
ATOM 1470 C CE   . LYS A 1 9  ? 8.905  20.600 -8.061  1.00 52.34 ? 9  LYS A CE   7  
ATOM 1471 N NZ   . LYS A 1 9  ? 8.388  21.039 -9.377  1.00 40.03 ? 9  LYS A NZ   7  
ATOM 1472 H H    . LYS A 1 9  ? 6.152  14.808 -6.367  1.00 0.00  ? 9  LYS A H    7  
ATOM 1473 H HA   . LYS A 1 9  ? 5.639  17.415 -7.630  1.00 0.00  ? 9  LYS A HA   7  
ATOM 1474 H HB2  . LYS A 1 9  ? 7.986  17.357 -6.509  1.00 0.00  ? 9  LYS A HB2  7  
ATOM 1475 H HB3  . LYS A 1 9  ? 8.424  16.304 -7.872  1.00 0.00  ? 9  LYS A HB3  7  
ATOM 1476 H HG2  . LYS A 1 9  ? 7.980  17.988 -9.472  1.00 0.00  ? 9  LYS A HG2  7  
ATOM 1477 H HG3  . LYS A 1 9  ? 7.041  18.962 -8.320  1.00 0.00  ? 9  LYS A HG3  7  
ATOM 1478 H HD2  . LYS A 1 9  ? 9.511  18.784 -7.078  1.00 0.00  ? 9  LYS A HD2  7  
ATOM 1479 H HD3  . LYS A 1 9  ? 9.952  18.873 -8.797  1.00 0.00  ? 9  LYS A HD3  7  
ATOM 1480 H HE2  . LYS A 1 9  ? 8.169  20.830 -7.291  1.00 0.00  ? 9  LYS A HE2  7  
ATOM 1481 H HE3  . LYS A 1 9  ? 9.832  21.130 -7.842  1.00 0.00  ? 9  LYS A HE3  7  
ATOM 1482 H HZ1  . LYS A 1 9  ? 8.646  22.002 -9.536  1.00 0.00  ? 9  LYS A HZ1  7  
ATOM 1483 H HZ2  . LYS A 1 9  ? 7.382  20.954 -9.388  1.00 0.00  ? 9  LYS A HZ2  7  
ATOM 1484 H HZ3  . LYS A 1 9  ? 8.783  20.460 -10.104 1.00 0.00  ? 9  LYS A HZ3  7  
ATOM 1485 N N    . THR A 1 10 ? 4.897  14.987 -8.756  1.00 11.01 ? 10 THR A N    7  
ATOM 1486 C CA   . THR A 1 10 ? 4.498  14.117 -9.849  1.00 20.44 ? 10 THR A CA   7  
ATOM 1487 C C    . THR A 1 10 ? 5.214  12.769 -9.749  1.00 1.24  ? 10 THR A C    7  
ATOM 1488 O O    . THR A 1 10 ? 4.583  11.718 -9.844  1.00 75.41 ? 10 THR A O    7  
ATOM 1489 C CB   . THR A 1 10 ? 4.768  14.854 -11.163 1.00 40.40 ? 10 THR A CB   7  
ATOM 1490 O OG1  . THR A 1 10 ? 3.595  14.625 -11.937 1.00 3.30  ? 10 THR A OG1  7  
ATOM 1491 C CG2  . THR A 1 10 ? 5.886  14.202 -11.979 1.00 21.11 ? 10 THR A CG2  7  
ATOM 1492 H H    . THR A 1 10 ? 4.310  15.059 -7.937  1.00 0.00  ? 10 THR A H    7  
ATOM 1493 H HA   . THR A 1 10 ? 3.425  13.940 -9.771  1.00 0.00  ? 10 THR A HA   7  
ATOM 1494 H HB   . THR A 1 10 ? 4.948  15.917 -11.003 1.00 0.00  ? 10 THR A HB   7  
ATOM 1495 H HG1  . THR A 1 10 ? 2.836  15.007 -11.490 1.00 0.00  ? 10 THR A HG1  7  
ATOM 1496 H HG21 . THR A 1 10 ? 5.855  14.577 -13.002 1.00 0.00  ? 10 THR A HG21 7  
ATOM 1497 H HG22 . THR A 1 10 ? 5.748  13.121 -11.985 1.00 0.00  ? 10 THR A HG22 7  
ATOM 1498 H HG23 . THR A 1 10 ? 6.850  14.444 -11.532 1.00 0.00  ? 10 THR A HG23 7  
ATOM 1499 N N    . PHE A 1 11 ? 6.524  12.844 -9.558  1.00 13.43 ? 11 PHE A N    7  
ATOM 1500 C CA   . PHE A 1 11 ? 7.333  11.643 -9.444  1.00 1.33  ? 11 PHE A CA   7  
ATOM 1501 C C    . PHE A 1 11 ? 6.768  10.699 -8.381  1.00 0.44  ? 11 PHE A C    7  
ATOM 1502 O O    . PHE A 1 11 ? 5.671  10.920 -7.870  1.00 3.00  ? 11 PHE A O    7  
ATOM 1503 C CB   . PHE A 1 11 ? 8.735  12.088 -9.021  1.00 33.03 ? 11 PHE A CB   7  
ATOM 1504 C CG   . PHE A 1 11 ? 9.862  11.246 -9.622  1.00 72.44 ? 11 PHE A CG   7  
ATOM 1505 C CD1  . PHE A 1 11 ? 9.970  11.119 -10.973 1.00 43.25 ? 11 PHE A CD1  7  
ATOM 1506 C CD2  . PHE A 1 11 ? 10.757 10.626 -8.807  1.00 51.33 ? 11 PHE A CD2  7  
ATOM 1507 C CE1  . PHE A 1 11 ? 11.016 10.339 -11.531 1.00 51.32 ? 11 PHE A CE1  7  
ATOM 1508 C CE2  . PHE A 1 11 ? 11.803 9.844  -9.366  1.00 45.41 ? 11 PHE A CE2  7  
ATOM 1509 C CZ   . PHE A 1 11 ? 11.911 9.717  -10.715 1.00 50.01 ? 11 PHE A CZ   7  
ATOM 1510 H H    . PHE A 1 11 ? 6.966  13.750 -9.491  1.00 0.00  ? 11 PHE A H    7  
ATOM 1511 H HA   . PHE A 1 11 ? 7.379  11.134 -10.406 1.00 0.00  ? 11 PHE A HA   7  
ATOM 1512 H HB2  . PHE A 1 11 ? 8.878  13.126 -9.319  1.00 0.00  ? 11 PHE A HB2  7  
ATOM 1513 H HB3  . PHE A 1 11 ? 8.802  12.024 -7.935  1.00 0.00  ? 11 PHE A HB3  7  
ATOM 1514 H HD1  . PHE A 1 11 ? 9.260  11.612 -11.620 1.00 0.00  ? 11 PHE A HD1  7  
ATOM 1515 H HD2  . PHE A 1 11 ? 10.672 10.727 -7.735  1.00 0.00  ? 11 PHE A HD2  7  
ATOM 1516 H HE1  . PHE A 1 11 ? 11.102 10.238 -12.602 1.00 0.00  ? 11 PHE A HE1  7  
ATOM 1517 H HE2  . PHE A 1 11 ? 12.513 9.351  -8.718  1.00 0.00  ? 11 PHE A HE2  7  
ATOM 1518 H HZ   . PHE A 1 11 ? 12.706 9.123  -11.140 1.00 0.00  ? 11 PHE A HZ   7  
ATOM 1519 N N    . THR A 1 12 ? 7.542  9.668  -8.079  1.00 41.34 ? 12 THR A N    7  
ATOM 1520 C CA   . THR A 1 12 ? 7.132  8.690  -7.086  1.00 31.24 ? 12 THR A CA   7  
ATOM 1521 C C    . THR A 1 12 ? 6.770  9.384  -5.771  1.00 54.44 ? 12 THR A C    7  
ATOM 1522 O O    . THR A 1 12 ? 6.089  8.805  -4.927  1.00 51.34 ? 12 THR A O    7  
ATOM 1523 C CB   . THR A 1 12 ? 8.258  7.664  -6.941  1.00 45.03 ? 12 THR A CB   7  
ATOM 1524 O OG1  . THR A 1 12 ? 7.990  6.708  -7.963  1.00 34.15 ? 12 THR A OG1  7  
ATOM 1525 C CG2  . THR A 1 12 ? 8.153  6.860  -5.643  1.00 31.50 ? 12 THR A CG2  7  
ATOM 1526 H H    . THR A 1 12 ? 8.431  9.559  -8.546  1.00 0.00  ? 12 THR A H    7  
ATOM 1527 H HA   . THR A 1 12 ? 6.245  8.175  -7.457  1.00 0.00  ? 12 THR A HA   7  
ATOM 1528 H HB   . THR A 1 12 ? 9.241  8.120  -7.058  1.00 0.00  ? 12 THR A HB   7  
ATOM 1529 H HG1  . THR A 1 12 ? 8.037  7.135  -8.821  1.00 0.00  ? 12 THR A HG1  7  
ATOM 1530 H HG21 . THR A 1 12 ? 8.863  6.033  -5.669  1.00 0.00  ? 12 THR A HG21 7  
ATOM 1531 H HG22 . THR A 1 12 ? 7.141  6.467  -5.540  1.00 0.00  ? 12 THR A HG22 7  
ATOM 1532 H HG23 . THR A 1 12 ? 8.379  7.507  -4.796  1.00 0.00  ? 12 THR A HG23 7  
ATOM 1533 N N    . SER A 1 13 ? 7.241  10.616 -5.641  1.00 20.14 ? 13 SER A N    7  
ATOM 1534 C CA   . SER A 1 13 ? 6.975  11.395 -4.443  1.00 12.21 ? 13 SER A CA   7  
ATOM 1535 C C    . SER A 1 13 ? 7.429  10.622 -3.204  1.00 21.42 ? 13 SER A C    7  
ATOM 1536 O O    . SER A 1 13 ? 8.030  9.554  -3.320  1.00 52.02 ? 13 SER A O    7  
ATOM 1537 C CB   . SER A 1 13 ? 5.490  11.746 -4.334  1.00 73.13 ? 13 SER A CB   7  
ATOM 1538 O OG   . SER A 1 13 ? 4.658  10.724 -4.877  1.00 51.25 ? 13 SER A OG   7  
ATOM 1539 H H    . SER A 1 13 ? 7.793  11.019 -6.384  1.00 0.00  ? 13 SER A H    7  
ATOM 1540 H HA   . SER A 1 13 ? 7.545  12.322 -4.501  1.00 0.00  ? 13 SER A HA   7  
ATOM 1541 H HB2  . SER A 1 13 ? 5.237  11.885 -3.283  1.00 0.00  ? 13 SER A HB2  7  
ATOM 1542 H HB3  . SER A 1 13 ? 5.304  12.677 -4.870  1.00 0.00  ? 13 SER A HB3  7  
ATOM 1543 H HG   . SER A 1 13 ? 3.787  11.084 -5.062  1.00 0.00  ? 13 SER A HG   7  
ATOM 1544 N N    . CYS A 1 14 ? 7.126  11.191 -2.047  1.00 51.53 ? 14 CYS A N    7  
ATOM 1545 C CA   . CYS A 1 14 ? 7.497  10.568 -0.787  1.00 42.13 ? 14 CYS A CA   7  
ATOM 1546 C C    . CYS A 1 14 ? 7.295  11.593 0.333   1.00 34.43 ? 14 CYS A C    7  
ATOM 1547 O O    . CYS A 1 14 ? 7.283  11.237 1.509   1.00 24.33 ? 14 CYS A O    7  
ATOM 1548 C CB   . CYS A 1 14 ? 8.930  10.033 -0.820  1.00 25.53 ? 14 CYS A CB   7  
ATOM 1549 S SG   . CYS A 1 14 ? 9.076  8.220  -0.620  1.00 23.41 ? 14 CYS A SG   7  
ATOM 1550 H H    . CYS A 1 14 ? 6.629  12.070 -2.040  1.00 0.00  ? 14 CYS A H    7  
ATOM 1551 H HA   . CYS A 1 14 ? 6.823  9.730  -0.609  1.00 0.00  ? 14 CYS A HA   7  
ATOM 1552 H HB2  . CYS A 1 14 ? 9.371  10.305 -1.778  1.00 0.00  ? 14 CYS A HB2  7  
ATOM 1553 H HB3  . CYS A 1 14 ? 9.499  10.517 -0.026  1.00 0.00  ? 14 CYS A HB3  7  
ATOM 1554 H HG   . CYS A 1 14 ? 10.130 7.940  0.152   1.00 0.00  ? 14 CYS A HG   7  
ATOM 1555 N N    . ALA A 1 1  ? 2.560  7.250  3.345   1.00 2.41  ? 1  ALA A N    8  
ATOM 1556 C CA   . ALA A 1 1  ? 3.743  8.031  3.667   1.00 71.24 ? 1  ALA A CA   8  
ATOM 1557 C C    . ALA A 1 1  ? 4.935  7.494  2.873   1.00 72.13 ? 1  ALA A C    8  
ATOM 1558 O O    . ALA A 1 1  ? 5.861  8.239  2.557   1.00 40.35 ? 1  ALA A O    8  
ATOM 1559 C CB   . ALA A 1 1  ? 3.983  7.993  5.178   1.00 63.24 ? 1  ALA A CB   8  
ATOM 1560 H H1   . ALA A 1 1  ? 1.734  7.810  3.498   1.00 0.00  ? 1  ALA A H1   8  
ATOM 1561 H H2   . ALA A 1 1  ? 2.599  6.965  2.377   1.00 0.00  ? 1  ALA A H2   8  
ATOM 1562 H H3   . ALA A 1 1  ? 2.526  6.432  3.936   1.00 0.00  ? 1  ALA A H3   8  
ATOM 1563 H HA   . ALA A 1 1  ? 3.566  9.065  3.371   1.00 0.00  ? 1  ALA A HA   8  
ATOM 1564 H HB1  . ALA A 1 1  ? 4.870  8.579  5.420   1.00 0.00  ? 1  ALA A HB1  8  
ATOM 1565 H HB2  . ALA A 1 1  ? 3.120  8.412  5.694   1.00 0.00  ? 1  ALA A HB2  8  
ATOM 1566 H HB3  . ALA A 1 1  ? 4.132  6.961  5.496   1.00 0.00  ? 1  ALA A HB3  8  
ATOM 1567 N N    . GLY A 1 2  ? 4.874  6.205  2.574   1.00 2.50  ? 2  GLY A N    8  
ATOM 1568 C CA   . GLY A 1 2  ? 5.938  5.559  1.823   1.00 10.23 ? 2  GLY A CA   8  
ATOM 1569 C C    . GLY A 1 2  ? 5.954  6.041  0.371   1.00 24.53 ? 2  GLY A C    8  
ATOM 1570 O O    . GLY A 1 2  ? 5.447  7.120  0.066   1.00 33.44 ? 2  GLY A O    8  
ATOM 1571 H H    . GLY A 1 2  ? 4.076  5.662  2.872   1.00 0.00  ? 2  GLY A H    8  
ATOM 1572 H HA2  . GLY A 1 2  ? 6.895  5.795  2.288   1.00 0.00  ? 2  GLY A HA2  8  
ATOM 1573 H HA3  . GLY A 1 2  ? 5.786  4.480  1.842   1.00 0.00  ? 2  GLY A HA3  8  
ATOM 1574 N N    . CYS A 1 3  ? 6.543  5.220  -0.485  1.00 22.13 ? 3  CYS A N    8  
ATOM 1575 C CA   . CYS A 1 3  ? 6.632  5.549  -1.898  1.00 33.13 ? 3  CYS A CA   8  
ATOM 1576 C C    . CYS A 1 3  ? 5.223  5.502  -2.492  1.00 25.21 ? 3  CYS A C    8  
ATOM 1577 O O    . CYS A 1 3  ? 4.641  4.427  -2.629  1.00 42.12 ? 3  CYS A O    8  
ATOM 1578 C CB   . CYS A 1 3  ? 7.595  4.618  -2.635  1.00 35.35 ? 3  CYS A CB   8  
ATOM 1579 S SG   . CYS A 1 3  ? 9.073  5.440  -3.335  1.00 72.24 ? 3  CYS A SG   8  
ATOM 1580 H H    . CYS A 1 3  ? 6.936  4.352  -0.151  1.00 0.00  ? 3  CYS A H    8  
ATOM 1581 H HA   . CYS A 1 3  ? 7.006  6.569  -1.988  1.00 0.00  ? 3  CYS A HA   8  
ATOM 1582 H HB2  . CYS A 1 3  ? 7.932  3.855  -1.934  1.00 0.00  ? 3  CYS A HB2  8  
ATOM 1583 H HB3  . CYS A 1 3  ? 7.054  4.130  -3.446  1.00 0.00  ? 3  CYS A HB3  8  
ATOM 1584 H HG   . CYS A 1 3  ? 8.749  6.034  -4.487  1.00 0.00  ? 3  CYS A HG   8  
ATOM 1585 N N    . LYS A 1 4  ? 4.717  6.679  -2.829  1.00 0.25  ? 4  LYS A N    8  
ATOM 1586 C CA   . LYS A 1 4  ? 3.387  6.783  -3.406  1.00 34.42 ? 4  LYS A CA   8  
ATOM 1587 C C    . LYS A 1 4  ? 3.379  7.897  -4.456  1.00 54.01 ? 4  LYS A C    8  
ATOM 1588 O O    . LYS A 1 4  ? 2.982  9.024  -4.169  1.00 42.43 ? 4  LYS A O    8  
ATOM 1589 C CB   . LYS A 1 4  ? 2.339  6.968  -2.307  1.00 5.13  ? 4  LYS A CB   8  
ATOM 1590 C CG   . LYS A 1 4  ? 0.941  7.134  -2.905  1.00 70.21 ? 4  LYS A CG   8  
ATOM 1591 C CD   . LYS A 1 4  ? 0.050  5.940  -2.555  1.00 31.25 ? 4  LYS A CD   8  
ATOM 1592 C CE   . LYS A 1 4  ? -1.350 6.108  -3.149  1.00 64.13 ? 4  LYS A CE   8  
ATOM 1593 N NZ   . LYS A 1 4  ? -2.055 7.237  -2.502  1.00 4.25  ? 4  LYS A NZ   8  
ATOM 1594 H H    . LYS A 1 4  ? 5.264  7.515  -2.682  1.00 0.00  ? 4  LYS A H    8  
ATOM 1595 H HA   . LYS A 1 4  ? 3.172  5.844  -3.916  1.00 0.00  ? 4  LYS A HA   8  
ATOM 1596 H HB2  . LYS A 1 4  ? 2.349  6.096  -1.652  1.00 0.00  ? 4  LYS A HB2  8  
ATOM 1597 H HB3  . LYS A 1 4  ? 2.586  7.856  -1.725  1.00 0.00  ? 4  LYS A HB3  8  
ATOM 1598 H HG2  . LYS A 1 4  ? 0.489  8.043  -2.509  1.00 0.00  ? 4  LYS A HG2  8  
ATOM 1599 H HG3  . LYS A 1 4  ? 1.022  7.216  -3.989  1.00 0.00  ? 4  LYS A HG3  8  
ATOM 1600 H HD2  . LYS A 1 4  ? 0.500  5.031  -2.954  1.00 0.00  ? 4  LYS A HD2  8  
ATOM 1601 H HD3  . LYS A 1 4  ? -0.028 5.856  -1.471  1.00 0.00  ? 4  LYS A HD3  8  
ATOM 1602 H HE2  . LYS A 1 4  ? -1.265 6.304  -4.218  1.00 0.00  ? 4  LYS A HE2  8  
ATOM 1603 H HE3  . LYS A 1 4  ? -1.919 5.191  -2.996  1.00 0.00  ? 4  LYS A HE3  8  
ATOM 1604 H HZ1  . LYS A 1 4  ? -2.976 7.334  -2.905  1.00 0.00  ? 4  LYS A HZ1  8  
ATOM 1605 H HZ2  . LYS A 1 4  ? -2.138 7.058  -1.511  1.00 0.00  ? 4  LYS A HZ2  8  
ATOM 1606 H HZ3  . LYS A 1 4  ? -1.532 8.088  -2.647  1.00 0.00  ? 4  LYS A HZ3  8  
ATOM 1607 N N    . ASN A 1 5  ? 3.822  7.540  -5.654  1.00 63.00 ? 5  ASN A N    8  
ATOM 1608 C CA   . ASN A 1 5  ? 3.870  8.494  -6.749  1.00 62.44 ? 5  ASN A CA   8  
ATOM 1609 C C    . ASN A 1 5  ? 2.620  9.374  -6.707  1.00 74.20 ? 5  ASN A C    8  
ATOM 1610 O O    . ASN A 1 5  ? 1.598  8.981  -6.147  1.00 50.24 ? 5  ASN A O    8  
ATOM 1611 C CB   . ASN A 1 5  ? 3.901  7.779  -8.100  1.00 73.21 ? 5  ASN A CB   8  
ATOM 1612 C CG   . ASN A 1 5  ? 2.556  7.115  -8.400  1.00 32.34 ? 5  ASN A CG   8  
ATOM 1613 O OD1  . ASN A 1 5  ? 1.628  7.730  -8.898  1.00 22.21 ? 5  ASN A OD1  8  
ATOM 1614 N ND2  . ASN A 1 5  ? 2.502  5.827  -8.072  1.00 0.22  ? 5  ASN A ND2  8  
ATOM 1615 H H    . ASN A 1 5  ? 4.131  6.591  -5.807  1.00 0.00  ? 5  ASN A H    8  
ATOM 1616 H HA   . ASN A 1 5  ? 4.757  9.118  -6.648  1.00 0.00  ? 5  ASN A HA   8  
ATOM 1617 H HB2  . ASN A 1 5  ? 4.122  8.505  -8.882  1.00 0.00  ? 5  ASN A HB2  8  
ATOM 1618 H HB3  . ASN A 1 5  ? 4.681  7.018  -8.086  1.00 0.00  ? 5  ASN A HB3  8  
ATOM 1619 H HD21 . ASN A 1 5  ? 3.308  5.377  -7.662  1.00 0.00  ? 5  ASN A HD21 8  
ATOM 1620 H HD22 . ASN A 1 5  ? 1.655  5.300  -8.231  1.00 0.00  ? 5  ASN A HD22 8  
ATOM 1621 N N    . PHE A 1 6  ? 2.741  10.548 -7.309  1.00 71.41 ? 6  PHE A N    8  
ATOM 1622 C CA   . PHE A 1 6  ? 1.633  11.488 -7.349  1.00 24.14 ? 6  PHE A CA   8  
ATOM 1623 C C    . PHE A 1 6  ? 1.273  11.969 -5.942  1.00 11.15 ? 6  PHE A C    8  
ATOM 1624 O O    . PHE A 1 6  ? 0.096  12.045 -5.590  1.00 21.01 ? 6  PHE A O    8  
ATOM 1625 C CB   . PHE A 1 6  ? 0.436  10.743 -7.942  1.00 61.31 ? 6  PHE A CB   8  
ATOM 1626 C CG   . PHE A 1 6  ? -0.593 11.655 -8.614  1.00 20.04 ? 6  PHE A CG   8  
ATOM 1627 C CD1  . PHE A 1 6  ? -0.193 12.563 -9.543  1.00 64.52 ? 6  PHE A CD1  8  
ATOM 1628 C CD2  . PHE A 1 6  ? -1.907 11.556 -8.281  1.00 1.22  ? 6  PHE A CD2  8  
ATOM 1629 C CE1  . PHE A 1 6  ? -1.148 13.408 -10.167 1.00 15.24 ? 6  PHE A CE1  8  
ATOM 1630 C CE2  . PHE A 1 6  ? -2.863 12.402 -8.905  1.00 64.02 ? 6  PHE A CE2  8  
ATOM 1631 C CZ   . PHE A 1 6  ? -2.462 13.310 -9.834  1.00 13.52 ? 6  PHE A CZ   8  
ATOM 1632 H H    . PHE A 1 6  ? 3.618  10.793 -7.748  1.00 0.00  ? 6  PHE A H    8  
ATOM 1633 H HA   . PHE A 1 6  ? 1.891  12.340 -7.978  1.00 0.00  ? 6  PHE A HA   8  
ATOM 1634 H HB2  . PHE A 1 6  ? 0.806  10.037 -8.686  1.00 0.00  ? 6  PHE A HB2  8  
ATOM 1635 H HB3  . PHE A 1 6  ? -0.057 10.185 -7.146  1.00 0.00  ? 6  PHE A HB3  8  
ATOM 1636 H HD1  . PHE A 1 6  ? 0.852  12.641 -9.807  1.00 0.00  ? 6  PHE A HD1  8  
ATOM 1637 H HD2  . PHE A 1 6  ? -2.225 10.834 -7.543  1.00 0.00  ? 6  PHE A HD2  8  
ATOM 1638 H HE1  . PHE A 1 6  ? -0.830 14.129 -10.906 1.00 0.00  ? 6  PHE A HE1  8  
ATOM 1639 H HE2  . PHE A 1 6  ? -3.907 12.324 -8.641  1.00 0.00  ? 6  PHE A HE2  8  
ATOM 1640 H HZ   . PHE A 1 6  ? -3.189 13.954 -10.307 1.00 0.00  ? 6  PHE A HZ   8  
ATOM 1641 N N    . PHE A 1 7  ? 2.307  12.282 -5.175  1.00 44.40 ? 7  PHE A N    8  
ATOM 1642 C CA   . PHE A 1 7  ? 2.114  12.754 -3.814  1.00 11.11 ? 7  PHE A CA   8  
ATOM 1643 C C    . PHE A 1 7  ? 3.300  13.605 -3.355  1.00 15.11 ? 7  PHE A C    8  
ATOM 1644 O O    . PHE A 1 7  ? 3.778  13.454 -2.232  1.00 61.25 ? 7  PHE A O    8  
ATOM 1645 C CB   . PHE A 1 7  ? 2.012  11.516 -2.921  1.00 63.34 ? 7  PHE A CB   8  
ATOM 1646 C CG   . PHE A 1 7  ? 1.085  11.691 -1.717  1.00 63.22 ? 7  PHE A CG   8  
ATOM 1647 C CD1  . PHE A 1 7  ? -0.232 11.972 -1.909  1.00 41.11 ? 7  PHE A CD1  8  
ATOM 1648 C CD2  . PHE A 1 7  ? 1.577  11.566 -0.456  1.00 41.04 ? 7  PHE A CD2  8  
ATOM 1649 C CE1  . PHE A 1 7  ? -1.093 12.135 -0.790  1.00 43.35 ? 7  PHE A CE1  8  
ATOM 1650 C CE2  . PHE A 1 7  ? 0.715  11.728 0.662   1.00 2.43  ? 7  PHE A CE2  8  
ATOM 1651 C CZ   . PHE A 1 7  ? -0.601 12.009 0.471   1.00 21.53 ? 7  PHE A CZ   8  
ATOM 1652 H H    . PHE A 1 7  ? 3.244  12.191 -5.541  1.00 0.00  ? 7  PHE A H    8  
ATOM 1653 H HA   . PHE A 1 7  ? 1.193  13.334 -3.750  1.00 0.00  ? 7  PHE A HA   8  
ATOM 1654 H HB2  . PHE A 1 7  ? 1.639  10.688 -3.524  1.00 0.00  ? 7  PHE A HB2  8  
ATOM 1655 H HB3  . PHE A 1 7  ? 3.009  11.263 -2.560  1.00 0.00  ? 7  PHE A HB3  8  
ATOM 1656 H HD1  . PHE A 1 7  ? -0.623 12.071 -2.911  1.00 0.00  ? 7  PHE A HD1  8  
ATOM 1657 H HD2  . PHE A 1 7  ? 2.622  11.343 -0.304  1.00 0.00  ? 7  PHE A HD2  8  
ATOM 1658 H HE1  . PHE A 1 7  ? -2.139 12.358 -0.942  1.00 0.00  ? 7  PHE A HE1  8  
ATOM 1659 H HE2  . PHE A 1 7  ? 1.106  11.628 1.664   1.00 0.00  ? 7  PHE A HE2  8  
ATOM 1660 H HZ   . PHE A 1 7  ? -1.256 12.131 1.320   1.00 0.00  ? 7  PHE A HZ   8  
ATOM 1661 N N    . TRP A 1 8  ? 3.740  14.478 -4.247  1.00 1.00  ? 8  TRP A N    8  
ATOM 1662 C CA   . TRP A 1 8  ? 4.863  15.353 -3.948  1.00 12.31 ? 8  TRP A CA   8  
ATOM 1663 C C    . TRP A 1 8  ? 5.058  16.295 -5.137  1.00 50.21 ? 8  TRP A C    8  
ATOM 1664 O O    . TRP A 1 8  ? 4.680  17.464 -5.077  1.00 55.13 ? 8  TRP A O    8  
ATOM 1665 C CB   . TRP A 1 8  ? 6.116  14.542 -3.614  1.00 21.45 ? 8  TRP A CB   8  
ATOM 1666 C CG   . TRP A 1 8  ? 7.221  15.354 -2.936  1.00 32.32 ? 8  TRP A CG   8  
ATOM 1667 C CD1  . TRP A 1 8  ? 7.327  15.681 -1.642  1.00 61.24 ? 8  TRP A CD1  8  
ATOM 1668 C CD2  . TRP A 1 8  ? 8.379  15.932 -3.575  1.00 53.32 ? 8  TRP A CD2  8  
ATOM 1669 N NE1  . TRP A 1 8  ? 8.465  16.425 -1.399  1.00 5.21  ? 8  TRP A NE1  8  
ATOM 1670 C CE2  . TRP A 1 8  ? 9.124  16.582 -2.613  1.00 63.34 ? 8  TRP A CE2  8  
ATOM 1671 C CE3  . TRP A 1 8  ? 8.783  15.906 -4.922  1.00 0.52  ? 8  TRP A CE3  8  
ATOM 1672 C CZ2  . TRP A 1 8  ? 10.319 17.255 -2.894  1.00 43.13 ? 8  TRP A CZ2  8  
ATOM 1673 C CZ3  . TRP A 1 8  ? 9.979  16.584 -5.186  1.00 51.11 ? 8  TRP A CZ3  8  
ATOM 1674 C CH2  . TRP A 1 8  ? 10.741 17.243 -4.229  1.00 1.31  ? 8  TRP A CH2  8  
ATOM 1675 H H    . TRP A 1 8  ? 3.290  14.538 -5.149  1.00 0.00  ? 8  TRP A H    8  
ATOM 1676 H HA   . TRP A 1 8  ? 4.603  15.954 -3.076  1.00 0.00  ? 8  TRP A HA   8  
ATOM 1677 H HB2  . TRP A 1 8  ? 5.834  13.718 -2.958  1.00 0.00  ? 8  TRP A HB2  8  
ATOM 1678 H HB3  . TRP A 1 8  ? 6.514  14.129 -4.541  1.00 0.00  ? 8  TRP A HB3  8  
ATOM 1679 H HD1  . TRP A 1 8  ? 6.612  15.400 -0.883  1.00 0.00  ? 8  TRP A HD1  8  
ATOM 1680 H HE1  . TRP A 1 8  ? 8.763  16.787 -0.505  1.00 0.00  ? 8  TRP A HE1  8  
ATOM 1681 H HE3  . TRP A 1 8  ? 8.215  15.403 -5.691  1.00 0.00  ? 8  TRP A HE3  8  
ATOM 1682 H HZ2  . TRP A 1 8  ? 10.885 17.757 -2.123  1.00 0.00  ? 8  TRP A HZ2  8  
ATOM 1683 H HZ3  . TRP A 1 8  ? 10.335 16.595 -6.206  1.00 0.00  ? 8  TRP A HZ3  8  
ATOM 1684 H HH2  . TRP A 1 8  ? 11.655 17.743 -4.513  1.00 0.00  ? 8  TRP A HH2  8  
ATOM 1685 N N    . LYS A 1 9  ? 5.649  15.751 -6.191  1.00 31.12 ? 9  LYS A N    8  
ATOM 1686 C CA   . LYS A 1 9  ? 5.901  16.528 -7.393  1.00 42.41 ? 9  LYS A CA   8  
ATOM 1687 C C    . LYS A 1 9  ? 5.751  15.626 -8.619  1.00 4.10  ? 9  LYS A C    8  
ATOM 1688 O O    . LYS A 1 9  ? 6.587  15.655 -9.521  1.00 41.44 ? 9  LYS A O    8  
ATOM 1689 C CB   . LYS A 1 9  ? 7.259  17.227 -7.305  1.00 22.33 ? 9  LYS A CB   8  
ATOM 1690 C CG   . LYS A 1 9  ? 7.251  18.541 -8.088  1.00 73.14 ? 9  LYS A CG   8  
ATOM 1691 C CD   . LYS A 1 9  ? 8.196  19.564 -7.454  1.00 22.54 ? 9  LYS A CD   8  
ATOM 1692 C CE   . LYS A 1 9  ? 9.345  19.911 -8.403  1.00 52.34 ? 9  LYS A CE   8  
ATOM 1693 N NZ   . LYS A 1 9  ? 10.173 18.714 -8.673  1.00 40.03 ? 9  LYS A NZ   8  
ATOM 1694 H H    . LYS A 1 9  ? 5.929  14.781 -6.159  1.00 0.00  ? 9  LYS A H    8  
ATOM 1695 H HA   . LYS A 1 9  ? 5.134  17.301 -7.454  1.00 0.00  ? 9  LYS A HA   8  
ATOM 1696 H HB2  . LYS A 1 9  ? 7.485  17.437 -6.260  1.00 0.00  ? 9  LYS A HB2  8  
ATOM 1697 H HB3  . LYS A 1 9  ? 8.027  16.570 -7.713  1.00 0.00  ? 9  LYS A HB3  8  
ATOM 1698 H HG2  . LYS A 1 9  ? 7.567  18.349 -9.114  1.00 0.00  ? 9  LYS A HG2  8  
ATOM 1699 H HG3  . LYS A 1 9  ? 6.239  18.946 -8.094  1.00 0.00  ? 9  LYS A HG3  8  
ATOM 1700 H HD2  . LYS A 1 9  ? 7.637  20.471 -7.225  1.00 0.00  ? 9  LYS A HD2  8  
ATOM 1701 H HD3  . LYS A 1 9  ? 8.604  19.151 -6.531  1.00 0.00  ? 9  LYS A HD3  8  
ATOM 1702 H HE2  . LYS A 1 9  ? 8.936  20.283 -9.341  1.00 0.00  ? 9  LYS A HE2  8  
ATOM 1703 H HE3  . LYS A 1 9  ? 9.966  20.683 -7.949  1.00 0.00  ? 9  LYS A HE3  8  
ATOM 1704 H HZ1  . LYS A 1 9  ? 10.926 18.960 -9.300  1.00 0.00  ? 9  LYS A HZ1  8  
ATOM 1705 H HZ2  . LYS A 1 9  ? 9.601  17.999 -9.099  1.00 0.00  ? 9  LYS A HZ2  8  
ATOM 1706 H HZ3  . LYS A 1 9  ? 10.557 18.367 -7.806  1.00 0.00  ? 9  LYS A HZ3  8  
ATOM 1707 N N    . THR A 1 10 ? 4.680  14.846 -8.613  1.00 11.01 ? 10 THR A N    8  
ATOM 1708 C CA   . THR A 1 10 ? 4.410  13.937 -9.714  1.00 20.44 ? 10 THR A CA   8  
ATOM 1709 C C    . THR A 1 10 ? 5.232  12.656 -9.560  1.00 1.24  ? 10 THR A C    8  
ATOM 1710 O O    . THR A 1 10 ? 4.694  11.554 -9.652  1.00 75.41 ? 10 THR A O    8  
ATOM 1711 C CB   . THR A 1 10 ? 4.685  14.683 -11.020 1.00 40.40 ? 10 THR A CB   8  
ATOM 1712 O OG1  . THR A 1 10 ? 3.570  14.357 -11.847 1.00 3.30  ? 10 THR A OG1  8  
ATOM 1713 C CG2  . THR A 1 10 ? 5.888  14.115 -11.778 1.00 21.11 ? 10 THR A CG2  8  
ATOM 1714 H H    . THR A 1 10 ? 4.042  14.883 -7.831  1.00 0.00  ? 10 THR A H    8  
ATOM 1715 H HA   . THR A 1 10 ? 3.353  13.671 -9.687  1.00 0.00  ? 10 THR A HA   8  
ATOM 1716 H HB   . THR A 1 10 ? 4.774  15.757 -10.863 1.00 0.00  ? 10 THR A HB   8  
ATOM 1717 H HG1  . THR A 1 10 ? 3.664  14.791 -12.698 1.00 0.00  ? 10 THR A HG1  8  
ATOM 1718 H HG21 . THR A 1 10 ? 5.873  14.475 -12.806 1.00 0.00  ? 10 THR A HG21 8  
ATOM 1719 H HG22 . THR A 1 10 ? 6.808  14.438 -11.293 1.00 0.00  ? 10 THR A HG22 8  
ATOM 1720 H HG23 . THR A 1 10 ? 5.838  13.026 -11.774 1.00 0.00  ? 10 THR A HG23 8  
ATOM 1721 N N    . PHE A 1 11 ? 6.524  12.843 -9.330  1.00 13.43 ? 11 PHE A N    8  
ATOM 1722 C CA   . PHE A 1 11 ? 7.426  11.716 -9.164  1.00 1.33  ? 11 PHE A CA   8  
ATOM 1723 C C    . PHE A 1 11 ? 6.896  10.740 -8.112  1.00 0.44  ? 11 PHE A C    8  
ATOM 1724 O O    . PHE A 1 11 ? 5.776  10.892 -7.627  1.00 3.00  ? 11 PHE A O    8  
ATOM 1725 C CB   . PHE A 1 11 ? 8.765  12.282 -8.689  1.00 33.03 ? 11 PHE A CB   8  
ATOM 1726 C CG   . PHE A 1 11 ? 9.985  11.528 -9.224  1.00 72.44 ? 11 PHE A CG   8  
ATOM 1727 C CD1  . PHE A 1 11 ? 10.142 11.354 -10.564 1.00 43.25 ? 11 PHE A CD1  8  
ATOM 1728 C CD2  . PHE A 1 11 ? 10.910 11.031 -8.361  1.00 51.33 ? 11 PHE A CD2  8  
ATOM 1729 C CE1  . PHE A 1 11 ? 11.273 10.655 -11.060 1.00 51.32 ? 11 PHE A CE1  8  
ATOM 1730 C CE2  . PHE A 1 11 ? 12.041 10.331 -8.857  1.00 45.41 ? 11 PHE A CE2  8  
ATOM 1731 C CZ   . PHE A 1 11 ? 12.199 10.158 -10.197 1.00 50.01 ? 11 PHE A CZ   8  
ATOM 1732 H H    . PHE A 1 11 ? 6.887  13.783 -9.270  1.00 0.00  ? 11 PHE A H    8  
ATOM 1733 H HA   . PHE A 1 11 ? 7.557  11.202 -10.116 1.00 0.00  ? 11 PHE A HA   8  
ATOM 1734 H HB2  . PHE A 1 11 ? 8.834  13.320 -9.015  1.00 0.00  ? 11 PHE A HB2  8  
ATOM 1735 H HB3  . PHE A 1 11 ? 8.789  12.257 -7.599  1.00 0.00  ? 11 PHE A HB3  8  
ATOM 1736 H HD1  . PHE A 1 11 ? 9.407  11.749 -11.250 1.00 0.00  ? 11 PHE A HD1  8  
ATOM 1737 H HD2  . PHE A 1 11 ? 10.784 11.169 -7.297  1.00 0.00  ? 11 PHE A HD2  8  
ATOM 1738 H HE1  . PHE A 1 11 ? 11.399 10.517 -12.124 1.00 0.00  ? 11 PHE A HE1  8  
ATOM 1739 H HE2  . PHE A 1 11 ? 12.775 9.935  -8.171  1.00 0.00  ? 11 PHE A HE2  8  
ATOM 1740 H HZ   . PHE A 1 11 ? 13.060 9.627  -10.575 1.00 0.00  ? 11 PHE A HZ   8  
ATOM 1741 N N    . THR A 1 12 ? 7.726  9.759  -7.789  1.00 41.34 ? 12 THR A N    8  
ATOM 1742 C CA   . THR A 1 12 ? 7.355  8.759  -6.803  1.00 31.24 ? 12 THR A CA   8  
ATOM 1743 C C    . THR A 1 12 ? 6.891  9.431  -5.510  1.00 54.44 ? 12 THR A C    8  
ATOM 1744 O O    . THR A 1 12 ? 6.211  8.812  -4.692  1.00 51.34 ? 12 THR A O    8  
ATOM 1745 C CB   . THR A 1 12 ? 8.549  7.823  -6.607  1.00 45.03 ? 12 THR A CB   8  
ATOM 1746 O OG1  . THR A 1 12 ? 8.215  7.073  -5.442  1.00 34.15 ? 12 THR A OG1  8  
ATOM 1747 C CG2  . THR A 1 12 ? 9.823  8.574  -6.214  1.00 31.50 ? 12 THR A CG2  8  
ATOM 1748 H H    . THR A 1 12 ? 8.630  9.706  -8.236  1.00 0.00  ? 12 THR A H    8  
ATOM 1749 H HA   . THR A 1 12 ? 6.525  8.176  -7.203  1.00 0.00  ? 12 THR A HA   8  
ATOM 1750 H HB   . THR A 1 12 ? 8.707  7.179  -7.473  1.00 0.00  ? 12 THR A HB   8  
ATOM 1751 H HG1  . THR A 1 12 ? 7.585  6.387  -5.672  1.00 0.00  ? 12 THR A HG1  8  
ATOM 1752 H HG21 . THR A 1 12 ? 10.197 8.185  -5.266  1.00 0.00  ? 12 THR A HG21 8  
ATOM 1753 H HG22 . THR A 1 12 ? 9.601  9.635  -6.108  1.00 0.00  ? 12 THR A HG22 8  
ATOM 1754 H HG23 . THR A 1 12 ? 10.579 8.436  -6.986  1.00 0.00  ? 12 THR A HG23 8  
ATOM 1755 N N    . SER A 1 13 ? 7.277  10.690 -5.363  1.00 20.14 ? 13 SER A N    8  
ATOM 1756 C CA   . SER A 1 13 ? 6.909  11.453 -4.183  1.00 12.21 ? 13 SER A CA   8  
ATOM 1757 C C    . SER A 1 13 ? 7.354  10.712 -2.920  1.00 21.42 ? 13 SER A C    8  
ATOM 1758 O O    . SER A 1 13 ? 6.785  10.907 -1.848  1.00 52.02 ? 13 SER A O    8  
ATOM 1759 C CB   . SER A 1 13 ? 5.403  11.713 -4.143  1.00 73.13 ? 13 SER A CB   8  
ATOM 1760 O OG   . SER A 1 13 ? 4.660  10.637 -4.709  1.00 51.25 ? 13 SER A OG   8  
ATOM 1761 H H    . SER A 1 13 ? 7.835  11.126 -6.083  1.00 0.00  ? 13 SER A H    8  
ATOM 1762 H HA   . SER A 1 13 ? 7.424  12.413 -4.219  1.00 0.00  ? 13 SER A HA   8  
ATOM 1763 H HB2  . SER A 1 13 ? 5.096  11.844 -3.105  1.00 0.00  ? 13 SER A HB2  8  
ATOM 1764 H HB3  . SER A 1 13 ? 5.184  12.626 -4.696  1.00 0.00  ? 13 SER A HB3  8  
ATOM 1765 H HG   . SER A 1 13 ? 4.603  9.918  -4.075  1.00 0.00  ? 13 SER A HG   8  
ATOM 1766 N N    . CYS A 1 14 ? 8.370  9.878  -3.089  1.00 51.53 ? 14 CYS A N    8  
ATOM 1767 C CA   . CYS A 1 14 ? 8.898  9.106  -1.978  1.00 42.13 ? 14 CYS A CA   8  
ATOM 1768 C C    . CYS A 1 14 ? 9.292  10.078 -0.863  1.00 34.43 ? 14 CYS A C    8  
ATOM 1769 O O    . CYS A 1 14 ? 9.256  9.725  0.314   1.00 24.33 ? 14 CYS A O    8  
ATOM 1770 C CB   . CYS A 1 14 ? 10.073 8.226  -2.408  1.00 25.53 ? 14 CYS A CB   8  
ATOM 1771 S SG   . CYS A 1 14 ? 9.958  6.478  -1.873  1.00 23.41 ? 14 CYS A SG   8  
ATOM 1772 H H    . CYS A 1 14 ? 8.783  9.776  -4.005  1.00 0.00  ? 14 CYS A H    8  
ATOM 1773 H HA   . CYS A 1 14 ? 8.105  8.459  -1.603  1.00 0.00  ? 14 CYS A HA   8  
ATOM 1774 H HB2  . CYS A 1 14 ? 10.130 8.244  -3.496  1.00 0.00  ? 14 CYS A HB2  8  
ATOM 1775 H HB3  . CYS A 1 14 ? 10.992 8.652  -2.005  1.00 0.00  ? 14 CYS A HB3  8  
ATOM 1776 H HG   . CYS A 1 14 ? 10.490 6.349  -0.655  1.00 0.00  ? 14 CYS A HG   8  
ATOM 1777 N N    . ALA A 1 1  ? 2.960  2.695  2.013   1.00 2.41  ? 1  ALA A N    9  
ATOM 1778 C CA   . ALA A 1 1  ? 4.383  2.477  2.206   1.00 71.24 ? 1  ALA A CA   9  
ATOM 1779 C C    . ALA A 1 1  ? 5.112  3.821  2.167   1.00 72.13 ? 1  ALA A C    9  
ATOM 1780 O O    . ALA A 1 1  ? 4.482  4.868  2.020   1.00 40.35 ? 1  ALA A O    9  
ATOM 1781 C CB   . ALA A 1 1  ? 4.899  1.502  1.145   1.00 63.24 ? 1  ALA A CB   9  
ATOM 1782 H H1   . ALA A 1 1  ? 2.619  3.338  2.713   1.00 0.00  ? 1  ALA A H1   9  
ATOM 1783 H H2   . ALA A 1 1  ? 2.471  1.815  2.097   1.00 0.00  ? 1  ALA A H2   9  
ATOM 1784 H H3   . ALA A 1 1  ? 2.801  3.082  1.094   1.00 0.00  ? 1  ALA A H3   9  
ATOM 1785 H HA   . ALA A 1 1  ? 4.534  2.030  3.189   1.00 0.00  ? 1  ALA A HA   9  
ATOM 1786 H HB1  . ALA A 1 1  ? 5.967  1.339  1.290   1.00 0.00  ? 1  ALA A HB1  9  
ATOM 1787 H HB2  . ALA A 1 1  ? 4.727  1.921  0.154   1.00 0.00  ? 1  ALA A HB2  9  
ATOM 1788 H HB3  . ALA A 1 1  ? 4.370  0.554  1.235   1.00 0.00  ? 1  ALA A HB3  9  
ATOM 1789 N N    . GLY A 1 2  ? 6.428  3.749  2.300   1.00 2.50  ? 2  GLY A N    9  
ATOM 1790 C CA   . GLY A 1 2  ? 7.249  4.948  2.281   1.00 10.23 ? 2  GLY A CA   9  
ATOM 1791 C C    . GLY A 1 2  ? 7.168  5.646  0.921   1.00 24.53 ? 2  GLY A C    9  
ATOM 1792 O O    . GLY A 1 2  ? 7.519  5.062  -0.102  1.00 33.44 ? 2  GLY A O    9  
ATOM 1793 H H    . GLY A 1 2  ? 6.867  2.847  2.416   1.00 0.00  ? 2  GLY A H    9  
ATOM 1794 H HA2  . GLY A 1 2  ? 6.899  5.632  3.054   1.00 0.00  ? 2  GLY A HA2  9  
ATOM 1795 H HA3  . GLY A 1 2  ? 8.285  4.677  2.484   1.00 0.00  ? 2  GLY A HA3  9  
ATOM 1796 N N    . CYS A 1 3  ? 6.702  6.886  0.957   1.00 22.13 ? 3  CYS A N    9  
ATOM 1797 C CA   . CYS A 1 3  ? 6.571  7.671  -0.260  1.00 33.13 ? 3  CYS A CA   9  
ATOM 1798 C C    . CYS A 1 3  ? 5.529  6.996  -1.156  1.00 25.21 ? 3  CYS A C    9  
ATOM 1799 O O    . CYS A 1 3  ? 5.292  5.795  -1.043  1.00 42.12 ? 3  CYS A O    9  
ATOM 1800 C CB   . CYS A 1 3  ? 7.914  7.839  -0.973  1.00 35.35 ? 3  CYS A CB   9  
ATOM 1801 S SG   . CYS A 1 3  ? 9.297  8.353  0.108   1.00 72.24 ? 3  CYS A SG   9  
ATOM 1802 H H    . CYS A 1 3  ? 6.434  7.292  1.842   1.00 0.00  ? 3  CYS A H    9  
ATOM 1803 H HA   . CYS A 1 3  ? 6.201  8.660  0.010   1.00 0.00  ? 3  CYS A HA   9  
ATOM 1804 H HB2  . CYS A 1 3  ? 8.177  6.892  -1.446  1.00 0.00  ? 3  CYS A HB2  9  
ATOM 1805 H HB3  . CYS A 1 3  ? 7.793  8.593  -1.750  1.00 0.00  ? 3  CYS A HB3  9  
ATOM 1806 H HG   . CYS A 1 3  ? 9.335  7.567  1.188   1.00 0.00  ? 3  CYS A HG   9  
ATOM 1807 N N    . LYS A 1 4  ? 4.936  7.800  -2.027  1.00 0.25  ? 4  LYS A N    9  
ATOM 1808 C CA   . LYS A 1 4  ? 3.926  7.296  -2.941  1.00 34.42 ? 4  LYS A CA   9  
ATOM 1809 C C    . LYS A 1 4  ? 3.791  8.257  -4.125  1.00 54.01 ? 4  LYS A C    9  
ATOM 1810 O O    . LYS A 1 4  ? 3.314  9.380  -3.966  1.00 42.43 ? 4  LYS A O    9  
ATOM 1811 C CB   . LYS A 1 4  ? 2.611  7.044  -2.201  1.00 5.13  ? 4  LYS A CB   9  
ATOM 1812 C CG   . LYS A 1 4  ? 2.168  8.290  -1.430  1.00 70.21 ? 4  LYS A CG   9  
ATOM 1813 C CD   . LYS A 1 4  ? 1.604  7.914  -0.059  1.00 31.25 ? 4  LYS A CD   9  
ATOM 1814 C CE   . LYS A 1 4  ? 1.541  9.135  0.862   1.00 64.13 ? 4  LYS A CE   9  
ATOM 1815 N NZ   . LYS A 1 4  ? 2.892  9.483  1.354   1.00 4.25  ? 4  LYS A NZ   9  
ATOM 1816 H H    . LYS A 1 4  ? 5.190  8.777  -2.055  1.00 0.00  ? 4  LYS A H    9  
ATOM 1817 H HA   . LYS A 1 4  ? 4.277  6.340  -3.329  1.00 0.00  ? 4  LYS A HA   9  
ATOM 1818 H HB2  . LYS A 1 4  ? 1.839  6.780  -2.924  1.00 0.00  ? 4  LYS A HB2  9  
ATOM 1819 H HB3  . LYS A 1 4  ? 2.745  6.219  -1.502  1.00 0.00  ? 4  LYS A HB3  9  
ATOM 1820 H HG2  . LYS A 1 4  ? 3.027  8.948  -1.295  1.00 0.00  ? 4  LYS A HG2  9  
ATOM 1821 H HG3  . LYS A 1 4  ? 1.402  8.812  -2.003  1.00 0.00  ? 4  LYS A HG3  9  
ATOM 1822 H HD2  . LYS A 1 4  ? 0.601  7.506  -0.183  1.00 0.00  ? 4  LYS A HD2  9  
ATOM 1823 H HD3  . LYS A 1 4  ? 2.245  7.159  0.396   1.00 0.00  ? 4  LYS A HD3  9  
ATOM 1824 H HE2  . LYS A 1 4  ? 1.132  9.980  0.309   1.00 0.00  ? 4  LYS A HE2  9  
ATOM 1825 H HE3  . LYS A 1 4  ? 0.894  8.913  1.711   1.00 0.00  ? 4  LYS A HE3  9  
ATOM 1826 H HZ1  . LYS A 1 4  ? 2.833  10.290 1.959   1.00 0.00  ? 4  LYS A HZ1  9  
ATOM 1827 H HZ2  . LYS A 1 4  ? 3.274  8.703  1.870   1.00 0.00  ? 4  LYS A HZ2  9  
ATOM 1828 H HZ3  . LYS A 1 4  ? 3.493  9.694  0.570   1.00 0.00  ? 4  LYS A HZ3  9  
ATOM 1829 N N    . ASN A 1 5  ? 4.220  7.780  -5.284  1.00 63.00 ? 5  ASN A N    9  
ATOM 1830 C CA   . ASN A 1 5  ? 4.154  8.583  -6.494  1.00 62.44 ? 5  ASN A CA   9  
ATOM 1831 C C    . ASN A 1 5  ? 2.816  9.325  -6.535  1.00 74.20 ? 5  ASN A C    9  
ATOM 1832 O O    . ASN A 1 5  ? 1.835  8.877  -5.945  1.00 50.24 ? 5  ASN A O    9  
ATOM 1833 C CB   . ASN A 1 5  ? 4.245  7.704  -7.743  1.00 73.21 ? 5  ASN A CB   9  
ATOM 1834 C CG   . ASN A 1 5  ? 2.949  6.918  -7.957  1.00 32.34 ? 5  ASN A CG   9  
ATOM 1835 O OD1  . ASN A 1 5  ? 2.673  5.933  -7.291  1.00 22.21 ? 5  ASN A OD1  9  
ATOM 1836 N ND2  . ASN A 1 5  ? 2.173  7.407  -8.919  1.00 0.22  ? 5  ASN A ND2  9  
ATOM 1837 H H    . ASN A 1 5  ? 4.598  6.845  -5.328  1.00 0.00  ? 5  ASN A H    9  
ATOM 1838 H HA   . ASN A 1 5  ? 4.970  9.304  -6.496  1.00 0.00  ? 5  ASN A HA   9  
ATOM 1839 H HB2  . ASN A 1 5  ? 4.425  8.337  -8.612  1.00 0.00  ? 5  ASN A HB2  9  
ATOM 1840 H HB3  . ASN A 1 5  ? 5.074  7.005  -7.631  1.00 0.00  ? 5  ASN A HB3  9  
ATOM 1841 H HD21 . ASN A 1 5  ? 2.461  8.227  -9.433  1.00 0.00  ? 5  ASN A HD21 9  
ATOM 1842 H HD22 . ASN A 1 5  ? 1.295  6.957  -9.136  1.00 0.00  ? 5  ASN A HD22 9  
ATOM 1843 N N    . PHE A 1 6  ? 2.821  10.448 -7.237  1.00 71.41 ? 6  PHE A N    9  
ATOM 1844 C CA   . PHE A 1 6  ? 1.621  11.258 -7.364  1.00 24.14 ? 6  PHE A CA   9  
ATOM 1845 C C    . PHE A 1 6  ? 1.322  12.002 -6.060  1.00 11.15 ? 6  PHE A C    9  
ATOM 1846 O O    . PHE A 1 6  ? 1.744  11.575 -4.987  1.00 21.01 ? 6  PHE A O    9  
ATOM 1847 C CB   . PHE A 1 6  ? 0.466  10.301 -7.668  1.00 61.31 ? 6  PHE A CB   9  
ATOM 1848 C CG   . PHE A 1 6  ? -0.599 10.887 -8.597  1.00 20.04 ? 6  PHE A CG   9  
ATOM 1849 C CD1  . PHE A 1 6  ? -0.327 11.061 -9.918  1.00 1.22  ? 6  PHE A CD1  9  
ATOM 1850 C CD2  . PHE A 1 6  ? -1.818 11.233 -8.101  1.00 64.52 ? 6  PHE A CD2  9  
ATOM 1851 C CE1  . PHE A 1 6  ? -1.316 11.605 -10.780 1.00 64.02 ? 6  PHE A CE1  9  
ATOM 1852 C CE2  . PHE A 1 6  ? -2.806 11.776 -8.964  1.00 15.24 ? 6  PHE A CE2  9  
ATOM 1853 C CZ   . PHE A 1 6  ? -2.535 11.950 -10.285 1.00 13.52 ? 6  PHE A CZ   9  
ATOM 1854 H H    . PHE A 1 6  ? 3.673  10.747 -7.692  1.00 0.00  ? 6  PHE A H    9  
ATOM 1855 H HA   . PHE A 1 6  ? 1.738  11.970 -8.180  1.00 0.00  ? 6  PHE A HA   9  
ATOM 1856 H HB2  . PHE A 1 6  ? 0.876  9.407  -8.138  1.00 0.00  ? 6  PHE A HB2  9  
ATOM 1857 H HB3  . PHE A 1 6  ? -0.008 10.016 -6.729  1.00 0.00  ? 6  PHE A HB3  9  
ATOM 1858 H HD1  . PHE A 1 6  ? 0.640  10.786 -10.311 1.00 0.00  ? 6  PHE A HD1  9  
ATOM 1859 H HD2  . PHE A 1 6  ? -2.033 11.095 -7.052  1.00 0.00  ? 6  PHE A HD2  9  
ATOM 1860 H HE1  . PHE A 1 6  ? -1.100 11.744 -11.829 1.00 0.00  ? 6  PHE A HE1  9  
ATOM 1861 H HE2  . PHE A 1 6  ? -3.774 12.050 -8.571  1.00 0.00  ? 6  PHE A HE2  9  
ATOM 1862 H HZ   . PHE A 1 6  ? -3.287 12.363 -10.941 1.00 0.00  ? 6  PHE A HZ   9  
ATOM 1863 N N    . PHE A 1 7  ? 0.596  13.101 -6.197  1.00 44.40 ? 7  PHE A N    9  
ATOM 1864 C CA   . PHE A 1 7  ? 0.236  13.909 -5.044  1.00 11.11 ? 7  PHE A CA   9  
ATOM 1865 C C    . PHE A 1 7  ? 1.483  14.417 -4.319  1.00 15.11 ? 7  PHE A C    9  
ATOM 1866 O O    . PHE A 1 7  ? 1.534  14.418 -3.090  1.00 61.25 ? 7  PHE A O    9  
ATOM 1867 C CB   . PHE A 1 7  ? -0.558 13.006 -4.097  1.00 63.34 ? 7  PHE A CB   9  
ATOM 1868 C CG   . PHE A 1 7  ? -1.327 13.765 -3.013  1.00 63.22 ? 7  PHE A CG   9  
ATOM 1869 C CD1  . PHE A 1 7  ? -2.388 14.544 -3.352  1.00 41.04 ? 7  PHE A CD1  9  
ATOM 1870 C CD2  . PHE A 1 7  ? -0.947 13.659 -1.711  1.00 41.11 ? 7  PHE A CD2  9  
ATOM 1871 C CE1  . PHE A 1 7  ? -3.102 15.248 -2.345  1.00 2.43  ? 7  PHE A CE1  9  
ATOM 1872 C CE2  . PHE A 1 7  ? -1.661 14.364 -0.705  1.00 43.35 ? 7  PHE A CE2  9  
ATOM 1873 C CZ   . PHE A 1 7  ? -2.722 15.143 -1.043  1.00 21.53 ? 7  PHE A CZ   9  
ATOM 1874 H H    . PHE A 1 7  ? 0.288  13.382 -7.117  1.00 0.00  ? 7  PHE A H    9  
ATOM 1875 H HA   . PHE A 1 7  ? -0.381 14.751 -5.358  1.00 0.00  ? 7  PHE A HA   9  
ATOM 1876 H HB2  . PHE A 1 7  ? -1.273 12.434 -4.688  1.00 0.00  ? 7  PHE A HB2  9  
ATOM 1877 H HB3  . PHE A 1 7  ? 0.132  12.312 -3.616  1.00 0.00  ? 7  PHE A HB3  9  
ATOM 1878 H HD1  . PHE A 1 7  ? -2.689 14.628 -4.386  1.00 0.00  ? 7  PHE A HD1  9  
ATOM 1879 H HD2  . PHE A 1 7  ? -0.104 13.040 -1.442  1.00 0.00  ? 7  PHE A HD2  9  
ATOM 1880 H HE1  . PHE A 1 7  ? -3.946 15.866 -2.614  1.00 0.00  ? 7  PHE A HE1  9  
ATOM 1881 H HE2  . PHE A 1 7  ? -1.360 14.280 0.329   1.00 0.00  ? 7  PHE A HE2  9  
ATOM 1882 H HZ   . PHE A 1 7  ? -3.264 15.678 -0.278  1.00 0.00  ? 7  PHE A HZ   9  
ATOM 1883 N N    . TRP A 1 8  ? 2.458  14.837 -5.111  1.00 1.00  ? 8  TRP A N    9  
ATOM 1884 C CA   . TRP A 1 8  ? 3.703  15.347 -4.561  1.00 12.31 ? 8  TRP A CA   9  
ATOM 1885 C C    . TRP A 1 8  ? 4.404  16.160 -5.651  1.00 50.21 ? 8  TRP A C    9  
ATOM 1886 O O    . TRP A 1 8  ? 4.331  17.388 -5.659  1.00 55.13 ? 8  TRP A O    9  
ATOM 1887 C CB   . TRP A 1 8  ? 4.567  14.209 -4.014  1.00 21.45 ? 8  TRP A CB   9  
ATOM 1888 C CG   . TRP A 1 8  ? 5.806  14.682 -3.250  1.00 32.32 ? 8  TRP A CG   9  
ATOM 1889 C CD1  . TRP A 1 8  ? 5.904  14.998 -1.951  1.00 61.24 ? 8  TRP A CD1  9  
ATOM 1890 C CD2  . TRP A 1 8  ? 7.129  14.878 -3.794  1.00 53.32 ? 8  TRP A CD2  9  
ATOM 1891 N NE1  . TRP A 1 8  ? 7.186  15.384 -1.620  1.00 5.21  ? 8  TRP A NE1  9  
ATOM 1892 C CE2  . TRP A 1 8  ? 7.955  15.308 -2.776  1.00 63.34 ? 8  TRP A CE2  9  
ATOM 1893 C CE3  . TRP A 1 8  ? 7.610  14.698 -5.102  1.00 0.52  ? 8  TRP A CE3  9  
ATOM 1894 C CZ2  . TRP A 1 8  ? 9.313  15.594 -2.960  1.00 43.13 ? 8  TRP A CZ2  9  
ATOM 1895 C CZ3  . TRP A 1 8  ? 8.969  14.989 -5.270  1.00 51.11 ? 8  TRP A CZ3  9  
ATOM 1896 C CH2  . TRP A 1 8  ? 9.815  15.422 -4.256  1.00 1.31  ? 8  TRP A CH2  9  
ATOM 1897 H H    . TRP A 1 8  ? 2.335  14.802 -6.113  1.00 0.00  ? 8  TRP A H    9  
ATOM 1898 H HA   . TRP A 1 8  ? 3.461  16.019 -3.737  1.00 0.00  ? 8  TRP A HA   9  
ATOM 1899 H HB2  . TRP A 1 8  ? 3.959  13.597 -3.348  1.00 0.00  ? 8  TRP A HB2  9  
ATOM 1900 H HB3  . TRP A 1 8  ? 4.895  13.595 -4.852  1.00 0.00  ? 8  TRP A HB3  9  
ATOM 1901 H HD1  . TRP A 1 8  ? 5.082  14.957 -1.252  1.00 0.00  ? 8  TRP A HD1  9  
ATOM 1902 H HE1  . TRP A 1 8  ? 7.508  15.669 -0.706  1.00 0.00  ? 8  TRP A HE1  9  
ATOM 1903 H HE3  . TRP A 1 8  ? 6.981  14.362 -5.914  1.00 0.00  ? 8  TRP A HE3  9  
ATOM 1904 H HZ2  . TRP A 1 8  ? 9.940  15.928 -2.147  1.00 0.00  ? 8  TRP A HZ2  9  
ATOM 1905 H HZ3  . TRP A 1 8  ? 9.390  14.868 -6.258  1.00 0.00  ? 8  TRP A HZ3  9  
ATOM 1906 H HH2  . TRP A 1 8  ? 10.855 15.626 -4.467  1.00 0.00  ? 8  TRP A HH2  9  
ATOM 1907 N N    . LYS A 1 9  ? 5.068  15.442 -6.544  1.00 31.12 ? 9  LYS A N    9  
ATOM 1908 C CA   . LYS A 1 9  ? 5.782  16.081 -7.637  1.00 42.41 ? 9  LYS A CA   9  
ATOM 1909 C C    . LYS A 1 9  ? 5.828  15.132 -8.836  1.00 4.10  ? 9  LYS A C    9  
ATOM 1910 O O    . LYS A 1 9  ? 6.796  15.130 -9.595  1.00 41.44 ? 9  LYS A O    9  
ATOM 1911 C CB   . LYS A 1 9  ? 7.162  16.552 -7.172  1.00 22.33 ? 9  LYS A CB   9  
ATOM 1912 C CG   . LYS A 1 9  ? 7.627  17.767 -7.977  1.00 73.14 ? 9  LYS A CG   9  
ATOM 1913 C CD   . LYS A 1 9  ? 9.026  18.210 -7.543  1.00 22.54 ? 9  LYS A CD   9  
ATOM 1914 C CE   . LYS A 1 9  ? 9.843  18.696 -8.742  1.00 52.34 ? 9  LYS A CE   9  
ATOM 1915 N NZ   . LYS A 1 9  ? 10.711 17.611 -9.252  1.00 40.03 ? 9  LYS A NZ   9  
ATOM 1916 H H    . LYS A 1 9  ? 5.079  14.435 -6.465  1.00 0.00  ? 9  LYS A H    9  
ATOM 1917 H HA   . LYS A 1 9  ? 5.213  16.963 -7.934  1.00 0.00  ? 9  LYS A HA   9  
ATOM 1918 H HB2  . LYS A 1 9  ? 7.110  16.821 -6.117  1.00 0.00  ? 9  LYS A HB2  9  
ATOM 1919 H HB3  . LYS A 1 9  ? 7.880  15.741 -7.301  1.00 0.00  ? 9  LYS A HB3  9  
ATOM 1920 H HG2  . LYS A 1 9  ? 7.647  17.508 -9.035  1.00 0.00  ? 9  LYS A HG2  9  
ATOM 1921 H HG3  . LYS A 1 9  ? 6.927  18.589 -7.822  1.00 0.00  ? 9  LYS A HG3  9  
ATOM 1922 H HD2  . LYS A 1 9  ? 8.938  19.018 -6.817  1.00 0.00  ? 9  LYS A HD2  9  
ATOM 1923 H HD3  . LYS A 1 9  ? 9.539  17.367 -7.081  1.00 0.00  ? 9  LYS A HD3  9  
ATOM 1924 H HE2  . LYS A 1 9  ? 9.165  19.017 -9.534  1.00 0.00  ? 9  LYS A HE2  9  
ATOM 1925 H HE3  . LYS A 1 9  ? 10.463 19.538 -8.436  1.00 0.00  ? 9  LYS A HE3  9  
ATOM 1926 H HZ1  . LYS A 1 9  ? 11.243 17.947 -10.042 1.00 0.00  ? 9  LYS A HZ1  9  
ATOM 1927 H HZ2  . LYS A 1 9  ? 11.343 17.315 -8.522  1.00 0.00  ? 9  LYS A HZ2  9  
ATOM 1928 H HZ3  . LYS A 1 9  ? 10.139 16.829 -9.539  1.00 0.00  ? 9  LYS A HZ3  9  
ATOM 1929 N N    . THR A 1 10 ? 4.768  14.348 -8.969  1.00 11.01 ? 10 THR A N    9  
ATOM 1930 C CA   . THR A 1 10 ? 4.675  13.396 -10.062 1.00 20.44 ? 10 THR A CA   9  
ATOM 1931 C C    . THR A 1 10 ? 5.568  12.183 -9.792  1.00 1.24  ? 10 THR A C    9  
ATOM 1932 O O    . THR A 1 10 ? 5.102  11.046 -9.815  1.00 75.41 ? 10 THR A O    9  
ATOM 1933 C CB   . THR A 1 10 ? 5.023  14.129 -11.359 1.00 40.40 ? 10 THR A CB   9  
ATOM 1934 O OG1  . THR A 1 10 ? 4.002  13.729 -12.270 1.00 3.30  ? 10 THR A OG1  9  
ATOM 1935 C CG2  . THR A 1 10 ? 6.314  13.611 -11.997 1.00 21.11 ? 10 THR A CG2  9  
ATOM 1936 H H    . THR A 1 10 ? 4.014  14.413 -8.301  1.00 0.00  ? 10 THR A H    9  
ATOM 1937 H HA   . THR A 1 10 ? 3.643  13.052 -10.130 1.00 0.00  ? 10 THR A HA   9  
ATOM 1938 H HB   . THR A 1 10 ? 5.044  15.210 -11.221 1.00 0.00  ? 10 THR A HB   9  
ATOM 1939 H HG1  . THR A 1 10 ? 3.148  14.018 -11.941 1.00 0.00  ? 10 THR A HG1  9  
ATOM 1940 H HG21 . THR A 1 10 ? 6.364  13.939 -13.035 1.00 0.00  ? 10 THR A HG21 9  
ATOM 1941 H HG22 . THR A 1 10 ? 6.326  12.522 -11.960 1.00 0.00  ? 10 THR A HG22 9  
ATOM 1942 H HG23 . THR A 1 10 ? 7.172  14.003 -11.451 1.00 0.00  ? 10 THR A HG23 9  
ATOM 1943 N N    . PHE A 1 11 ? 6.838  12.468 -9.541  1.00 13.43 ? 11 PHE A N    9  
ATOM 1944 C CA   . PHE A 1 11 ? 7.800  11.416 -9.266  1.00 1.33  ? 11 PHE A CA   9  
ATOM 1945 C C    . PHE A 1 11 ? 7.293  10.480 -8.167  1.00 0.44  ? 11 PHE A C    9  
ATOM 1946 O O    . PHE A 1 11 ? 6.155  10.608 -7.716  1.00 3.00  ? 11 PHE A O    9  
ATOM 1947 C CB   . PHE A 1 11 ? 9.084  12.097 -8.786  1.00 33.03 ? 11 PHE A CB   9  
ATOM 1948 C CG   . PHE A 1 11 ? 10.366 11.390 -9.227  1.00 72.44 ? 11 PHE A CG   9  
ATOM 1949 C CD1  . PHE A 1 11 ? 10.479 10.915 -10.497 1.00 43.25 ? 11 PHE A CD1  9  
ATOM 1950 C CD2  . PHE A 1 11 ? 11.394 11.234 -8.350  1.00 51.33 ? 11 PHE A CD2  9  
ATOM 1951 C CE1  . PHE A 1 11 ? 11.670 10.258 -10.907 1.00 51.32 ? 11 PHE A CE1  9  
ATOM 1952 C CE2  . PHE A 1 11 ? 12.585 10.578 -8.759  1.00 45.41 ? 11 PHE A CE2  9  
ATOM 1953 C CZ   . PHE A 1 11 ? 12.697 10.103 -10.029 1.00 50.01 ? 11 PHE A CZ   9  
ATOM 1954 H H    . PHE A 1 11 ? 7.141  13.431 -9.541  1.00 0.00  ? 11 PHE A H    9  
ATOM 1955 H HA   . PHE A 1 11 ? 7.999  10.847 -10.175 1.00 0.00  ? 11 PHE A HA   9  
ATOM 1956 H HB2  . PHE A 1 11 ? 9.100  13.113 -9.180  1.00 0.00  ? 11 PHE A HB2  9  
ATOM 1957 H HB3  . PHE A 1 11 ? 9.068  12.145 -7.697  1.00 0.00  ? 11 PHE A HB3  9  
ATOM 1958 H HD1  . PHE A 1 11 ? 9.663  11.037 -11.194 1.00 0.00  ? 11 PHE A HD1  9  
ATOM 1959 H HD2  . PHE A 1 11 ? 11.304 11.610 -7.342  1.00 0.00  ? 11 PHE A HD2  9  
ATOM 1960 H HE1  . PHE A 1 11 ? 11.760 9.882  -11.915 1.00 0.00  ? 11 PHE A HE1  9  
ATOM 1961 H HE2  . PHE A 1 11 ? 13.401 10.456 -8.063  1.00 0.00  ? 11 PHE A HE2  9  
ATOM 1962 H HZ   . PHE A 1 11 ? 13.603 9.603  -10.340 1.00 0.00  ? 11 PHE A HZ   9  
ATOM 1963 N N    . THR A 1 12 ? 8.160  9.563  -7.766  1.00 41.34 ? 12 THR A N    9  
ATOM 1964 C CA   . THR A 1 12 ? 7.813  8.607  -6.728  1.00 31.24 ? 12 THR A CA   9  
ATOM 1965 C C    . THR A 1 12 ? 7.187  9.324  -5.531  1.00 54.44 ? 12 THR A C    9  
ATOM 1966 O O    . THR A 1 12 ? 6.469  8.712  -4.742  1.00 51.34 ? 12 THR A O    9  
ATOM 1967 C CB   . THR A 1 12 ? 9.074  7.817  -6.373  1.00 45.03 ? 12 THR A CB   9  
ATOM 1968 O OG1  . THR A 1 12 ? 10.054 8.821  -6.121  1.00 34.15 ? 12 THR A OG1  9  
ATOM 1969 C CG2  . THR A 1 12 ? 9.634  7.040  -7.565  1.00 31.50 ? 12 THR A CG2  9  
ATOM 1970 H H    . THR A 1 12 ? 9.077  9.527  -8.189  1.00 0.00  ? 12 THR A H    9  
ATOM 1971 H HA   . THR A 1 12 ? 7.077  7.913  -7.134  1.00 0.00  ? 12 THR A HA   9  
ATOM 1972 H HB   . THR A 1 12 ? 8.919  7.174  -5.506  1.00 0.00  ? 12 THR A HB   9  
ATOM 1973 H HG1  . THR A 1 12 ? 9.776  9.360  -5.378  1.00 0.00  ? 12 THR A HG1  9  
ATOM 1974 H HG21 . THR A 1 12 ? 10.528 6.497  -7.258  1.00 0.00  ? 12 THR A HG21 9  
ATOM 1975 H HG22 . THR A 1 12 ? 8.885  6.333  -7.923  1.00 0.00  ? 12 THR A HG22 9  
ATOM 1976 H HG23 . THR A 1 12 ? 9.888  7.735  -8.365  1.00 0.00  ? 12 THR A HG23 9  
ATOM 1977 N N    . SER A 1 13 ? 7.482  10.612 -5.433  1.00 20.14 ? 13 SER A N    9  
ATOM 1978 C CA   . SER A 1 13 ? 6.958  11.419 -4.344  1.00 12.21 ? 13 SER A CA   9  
ATOM 1979 C C    . SER A 1 13 ? 7.720  11.115 -3.053  1.00 21.42 ? 13 SER A C    9  
ATOM 1980 O O    . SER A 1 13 ? 8.846  10.621 -3.094  1.00 52.02 ? 13 SER A O    9  
ATOM 1981 C CB   . SER A 1 13 ? 5.461  11.173 -4.148  1.00 73.13 ? 13 SER A CB   9  
ATOM 1982 O OG   . SER A 1 13 ? 4.754  11.173 -5.385  1.00 51.25 ? 13 SER A OG   9  
ATOM 1983 H H    . SER A 1 13 ? 8.081  11.039 -6.125  1.00 0.00  ? 13 SER A H    9  
ATOM 1984 H HA   . SER A 1 13 ? 7.105  12.470 -4.592  1.00 0.00  ? 13 SER A HA   9  
ATOM 1985 H HB2  . SER A 1 13 ? 5.325  10.205 -3.664  1.00 0.00  ? 13 SER A HB2  9  
ATOM 1986 H HB3  . SER A 1 13 ? 5.054  11.952 -3.504  1.00 0.00  ? 13 SER A HB3  9  
ATOM 1987 H HG   . SER A 1 13 ? 4.585  12.078 -5.657  1.00 0.00  ? 13 SER A HG   9  
ATOM 1988 N N    . CYS A 1 14 ? 7.076  11.425 -1.937  1.00 51.53 ? 14 CYS A N    9  
ATOM 1989 C CA   . CYS A 1 14 ? 7.679  11.191 -0.636  1.00 42.13 ? 14 CYS A CA   9  
ATOM 1990 C C    . CYS A 1 14 ? 6.991  12.102 0.383   1.00 34.43 ? 14 CYS A C    9  
ATOM 1991 O O    . CYS A 1 14 ? 7.540  13.132 0.771   1.00 24.33 ? 14 CYS A O    9  
ATOM 1992 C CB   . CYS A 1 14 ? 9.194  11.411 -0.666  1.00 25.53 ? 14 CYS A CB   9  
ATOM 1993 S SG   . CYS A 1 14 ? 10.189 9.878  -0.763  1.00 23.41 ? 14 CYS A SG   9  
ATOM 1994 H H    . CYS A 1 14 ? 6.152  11.829 -1.992  1.00 0.00  ? 14 CYS A H    9  
ATOM 1995 H HA   . CYS A 1 14 ? 7.489  10.156 -0.352  1.00 0.00  ? 14 CYS A HA   9  
ATOM 1996 H HB2  . CYS A 1 14 ? 9.430  12.024 -1.536  1.00 0.00  ? 14 CYS A HB2  9  
ATOM 1997 H HB3  . CYS A 1 14 ? 9.483  11.956 0.232   1.00 0.00  ? 14 CYS A HB3  9  
ATOM 1998 H HG   . CYS A 1 14 ? 11.328 10.127 -1.415  1.00 0.00  ? 14 CYS A HG   9  
ATOM 1999 N N    . ALA A 1 1  ? 6.370  0.382  3.743   1.00 2.41  ? 1  ALA A N    10 
ATOM 2000 C CA   . ALA A 1 1  ? 6.428  1.464  4.709   1.00 71.24 ? 1  ALA A CA   10 
ATOM 2001 C C    . ALA A 1 1  ? 5.312  2.468  4.414   1.00 72.13 ? 1  ALA A C    10 
ATOM 2002 O O    . ALA A 1 1  ? 4.504  2.779  5.288   1.00 40.35 ? 1  ALA A O    10 
ATOM 2003 C CB   . ALA A 1 1  ? 7.816  2.108  4.673   1.00 63.24 ? 1  ALA A CB   10 
ATOM 2004 H H1   . ALA A 1 1  ? 5.454  -0.043 3.767   1.00 0.00  ? 1  ALA A H1   10 
ATOM 2005 H H2   . ALA A 1 1  ? 6.547  0.747  2.818   1.00 0.00  ? 1  ALA A H2   10 
ATOM 2006 H H3   . ALA A 1 1  ? 7.068  -0.311 3.971   1.00 0.00  ? 1  ALA A H3   10 
ATOM 2007 H HA   . ALA A 1 1  ? 6.266  1.049  5.704   1.00 0.00  ? 1  ALA A HA   10 
ATOM 2008 H HB1  . ALA A 1 1  ? 7.860  2.920  5.398   1.00 0.00  ? 1  ALA A HB1  10 
ATOM 2009 H HB2  . ALA A 1 1  ? 8.570  1.360  4.919   1.00 0.00  ? 1  ALA A HB2  10 
ATOM 2010 H HB3  . ALA A 1 1  ? 8.008  2.501  3.674   1.00 0.00  ? 1  ALA A HB3  10 
ATOM 2011 N N    . GLY A 1 2  ? 5.303  2.947  3.179   1.00 2.50  ? 2  GLY A N    10 
ATOM 2012 C CA   . GLY A 1 2  ? 4.299  3.910  2.757   1.00 10.23 ? 2  GLY A CA   10 
ATOM 2013 C C    . GLY A 1 2  ? 4.620  4.463  1.366   1.00 24.53 ? 2  GLY A C    10 
ATOM 2014 O O    . GLY A 1 2  ? 4.504  3.752  0.369   1.00 33.44 ? 2  GLY A O    10 
ATOM 2015 H H    . GLY A 1 2  ? 6.004  2.638  2.521   1.00 0.00  ? 2  GLY A H    10 
ATOM 2016 H HA2  . GLY A 1 2  ? 3.325  3.420  2.729   1.00 0.00  ? 2  GLY A HA2  10 
ATOM 2017 H HA3  . GLY A 1 2  ? 4.267  4.732  3.472   1.00 0.00  ? 2  GLY A HA3  10 
ATOM 2018 N N    . CYS A 1 3  ? 5.017  5.726  1.345   1.00 22.13 ? 3  CYS A N    10 
ATOM 2019 C CA   . CYS A 1 3  ? 5.356  6.383  0.093   1.00 33.13 ? 3  CYS A CA   10 
ATOM 2020 C C    . CYS A 1 3  ? 4.114  6.386  -0.799  1.00 25.21 ? 3  CYS A C    10 
ATOM 2021 O O    . CYS A 1 3  ? 3.227  5.548  -0.638  1.00 42.12 ? 3  CYS A O    10 
ATOM 2022 C CB   . CYS A 1 3  ? 6.549  5.714  -0.592  1.00 35.35 ? 3  CYS A CB   10 
ATOM 2023 S SG   . CYS A 1 3  ? 7.374  6.735  -1.867  1.00 72.24 ? 3  CYS A SG   10 
ATOM 2024 H H    . CYS A 1 3  ? 5.086  6.241  2.211   1.00 0.00  ? 3  CYS A H    10 
ATOM 2025 H HA   . CYS A 1 3  ? 5.622  7.417  0.311   1.00 0.00  ? 3  CYS A HA   10 
ATOM 2026 H HB2  . CYS A 1 3  ? 7.285  5.468  0.173   1.00 0.00  ? 3  CYS A HB2  10 
ATOM 2027 H HB3  . CYS A 1 3  ? 6.208  4.789  -1.056  1.00 0.00  ? 3  CYS A HB3  10 
ATOM 2028 H HG   . CYS A 1 3  ? 7.609  5.991  -2.951  1.00 0.00  ? 3  CYS A HG   10 
ATOM 2029 N N    . LYS A 1 4  ? 4.088  7.337  -1.721  1.00 0.25  ? 4  LYS A N    10 
ATOM 2030 C CA   . LYS A 1 4  ? 2.968  7.460  -2.640  1.00 34.42 ? 4  LYS A CA   10 
ATOM 2031 C C    . LYS A 1 4  ? 3.277  8.547  -3.671  1.00 54.01 ? 4  LYS A C    10 
ATOM 2032 O O    . LYS A 1 4  ? 3.623  9.670  -3.308  1.00 42.43 ? 4  LYS A O    10 
ATOM 2033 C CB   . LYS A 1 4  ? 1.668  7.694  -1.869  1.00 5.13  ? 4  LYS A CB   10 
ATOM 2034 C CG   . LYS A 1 4  ? 0.549  6.793  -2.398  1.00 70.21 ? 4  LYS A CG   10 
ATOM 2035 C CD   . LYS A 1 4  ? -0.105 7.401  -3.640  1.00 31.25 ? 4  LYS A CD   10 
ATOM 2036 C CE   . LYS A 1 4  ? -1.562 6.952  -3.768  1.00 64.13 ? 4  LYS A CE   10 
ATOM 2037 N NZ   . LYS A 1 4  ? -1.652 5.475  -3.763  1.00 4.25  ? 4  LYS A NZ   10 
ATOM 2038 H H    . LYS A 1 4  ? 4.858  7.987  -1.786  1.00 0.00  ? 4  LYS A H    10 
ATOM 2039 H HA   . LYS A 1 4  ? 2.872  6.514  -3.174  1.00 0.00  ? 4  LYS A HA   10 
ATOM 2040 H HB2  . LYS A 1 4  ? 1.834  7.474  -0.815  1.00 0.00  ? 4  LYS A HB2  10 
ATOM 2041 H HB3  . LYS A 1 4  ? 1.370  8.736  -1.977  1.00 0.00  ? 4  LYS A HB3  10 
ATOM 2042 H HG2  . LYS A 1 4  ? 0.963  5.817  -2.652  1.00 0.00  ? 4  LYS A HG2  10 
ATOM 2043 H HG3  . LYS A 1 4  ? -0.206 6.670  -1.621  1.00 0.00  ? 4  LYS A HG3  10 
ATOM 2044 H HD2  . LYS A 1 4  ? -0.070 8.489  -3.567  1.00 0.00  ? 4  LYS A HD2  10 
ATOM 2045 H HD3  . LYS A 1 4  ? 0.445  7.083  -4.525  1.00 0.00  ? 4  LYS A HD3  10 
ATOM 2046 H HE2  . LYS A 1 4  ? -2.135 7.349  -2.929  1.00 0.00  ? 4  LYS A HE2  10 
ATOM 2047 H HE3  . LYS A 1 4  ? -1.976 7.335  -4.700  1.00 0.00  ? 4  LYS A HE3  10 
ATOM 2048 H HZ1  . LYS A 1 4  ? -2.470 5.185  -4.279  1.00 0.00  ? 4  LYS A HZ1  10 
ATOM 2049 H HZ2  . LYS A 1 4  ? -0.826 5.086  -4.195  1.00 0.00  ? 4  LYS A HZ2  10 
ATOM 2050 H HZ3  . LYS A 1 4  ? -1.720 5.145  -2.811  1.00 0.00  ? 4  LYS A HZ3  10 
ATOM 2051 N N    . ASN A 1 5  ? 3.142  8.175  -4.935  1.00 63.00 ? 5  ASN A N    10 
ATOM 2052 C CA   . ASN A 1 5  ? 3.402  9.104  -6.021  1.00 62.44 ? 5  ASN A CA   10 
ATOM 2053 C C    . ASN A 1 5  ? 2.295  10.161 -6.058  1.00 74.20 ? 5  ASN A C    10 
ATOM 2054 O O    . ASN A 1 5  ? 1.241  9.983  -5.449  1.00 50.24 ? 5  ASN A O    10 
ATOM 2055 C CB   . ASN A 1 5  ? 3.413  8.385  -7.371  1.00 73.21 ? 5  ASN A CB   10 
ATOM 2056 C CG   . ASN A 1 5  ? 2.016  7.877  -7.733  1.00 32.34 ? 5  ASN A CG   10 
ATOM 2057 O OD1  . ASN A 1 5  ? 1.077  7.960  -6.960  1.00 22.21 ? 5  ASN A OD1  10 
ATOM 2058 N ND2  . ASN A 1 5  ? 1.933  7.346  -8.950  1.00 0.22  ? 5  ASN A ND2  10 
ATOM 2059 H H    . ASN A 1 5  ? 2.853  7.230  -5.147  1.00 0.00  ? 5  ASN A H    10 
ATOM 2060 H HA   . ASN A 1 5  ? 4.364  9.591  -5.861  1.00 0.00  ? 5  ASN A HA   10 
ATOM 2061 H HB2  . ASN A 1 5  ? 3.751  9.078  -8.142  1.00 0.00  ? 5  ASN A HB2  10 
ATOM 2062 H HB3  . ASN A 1 5  ? 4.100  7.540  -7.322  1.00 0.00  ? 5  ASN A HB3  10 
ATOM 2063 H HD21 . ASN A 1 5  ? 2.750  7.307  -9.541  1.00 0.00  ? 5  ASN A HD21 10 
ATOM 2064 H HD22 . ASN A 1 5  ? 1.051  6.981  -9.282  1.00 0.00  ? 5  ASN A HD22 10 
ATOM 2065 N N    . PHE A 1 6  ? 2.573  11.238 -6.779  1.00 71.41 ? 6  PHE A N    10 
ATOM 2066 C CA   . PHE A 1 6  ? 1.615  12.323 -6.903  1.00 24.14 ? 6  PHE A CA   10 
ATOM 2067 C C    . PHE A 1 6  ? 1.410  13.030 -5.561  1.00 11.15 ? 6  PHE A C    10 
ATOM 2068 O O    . PHE A 1 6  ? 0.280  13.326 -5.178  1.00 21.01 ? 6  PHE A O    10 
ATOM 2069 C CB   . PHE A 1 6  ? 0.289  11.700 -7.346  1.00 61.31 ? 6  PHE A CB   10 
ATOM 2070 C CG   . PHE A 1 6  ? -0.435 12.490 -8.438  1.00 20.04 ? 6  PHE A CG   10 
ATOM 2071 C CD1  . PHE A 1 6  ? -0.112 12.296 -9.744  1.00 1.22  ? 6  PHE A CD1  10 
ATOM 2072 C CD2  . PHE A 1 6  ? -1.402 13.385 -8.102  1.00 64.52 ? 6  PHE A CD2  10 
ATOM 2073 C CE1  . PHE A 1 6  ? -0.784 13.028 -10.758 1.00 64.02 ? 6  PHE A CE1  10 
ATOM 2074 C CE2  . PHE A 1 6  ? -2.075 14.118 -9.115  1.00 15.24 ? 6  PHE A CE2  10 
ATOM 2075 C CZ   . PHE A 1 6  ? -1.752 13.924 -10.422 1.00 13.52 ? 6  PHE A CZ   10 
ATOM 2076 H H    . PHE A 1 6  ? 3.464  11.304 -7.249  1.00 0.00  ? 6  PHE A H    10 
ATOM 2077 H HA   . PHE A 1 6  ? 1.958  13.038 -7.651  1.00 0.00  ? 6  PHE A HA   10 
ATOM 2078 H HB2  . PHE A 1 6  ? 0.491  10.698 -7.724  1.00 0.00  ? 6  PHE A HB2  10 
ATOM 2079 H HB3  . PHE A 1 6  ? -0.366 11.621 -6.479  1.00 0.00  ? 6  PHE A HB3  10 
ATOM 2080 H HD1  . PHE A 1 6  ? 0.656  11.584 -10.011 1.00 0.00  ? 6  PHE A HD1  10 
ATOM 2081 H HD2  . PHE A 1 6  ? -1.658 13.539 -7.065  1.00 0.00  ? 6  PHE A HD2  10 
ATOM 2082 H HE1  . PHE A 1 6  ? -0.527 12.874 -11.796 1.00 0.00  ? 6  PHE A HE1  10 
ATOM 2083 H HE2  . PHE A 1 6  ? -2.843 14.829 -8.849  1.00 0.00  ? 6  PHE A HE2  10 
ATOM 2084 H HZ   . PHE A 1 6  ? -2.263 14.481 -11.193 1.00 0.00  ? 6  PHE A HZ   10 
ATOM 2085 N N    . PHE A 1 7  ? 2.522  13.279 -4.885  1.00 44.40 ? 7  PHE A N    10 
ATOM 2086 C CA   . PHE A 1 7  ? 2.478  13.947 -3.595  1.00 11.11 ? 7  PHE A CA   10 
ATOM 2087 C C    . PHE A 1 7  ? 3.797  14.666 -3.305  1.00 15.11 ? 7  PHE A C    10 
ATOM 2088 O O    . PHE A 1 7  ? 4.315  14.594 -2.192  1.00 61.25 ? 7  PHE A O    10 
ATOM 2089 C CB   . PHE A 1 7  ? 2.259  12.862 -2.539  1.00 63.34 ? 7  PHE A CB   10 
ATOM 2090 C CG   . PHE A 1 7  ? 0.787  12.545 -2.269  1.00 63.22 ? 7  PHE A CG   10 
ATOM 2091 C CD1  . PHE A 1 7  ? -0.016 13.479 -1.693  1.00 41.04 ? 7  PHE A CD1  10 
ATOM 2092 C CD2  . PHE A 1 7  ? 0.281  11.328 -2.604  1.00 41.11 ? 7  PHE A CD2  10 
ATOM 2093 C CE1  . PHE A 1 7  ? -1.382 13.185 -1.442  1.00 2.43  ? 7  PHE A CE1  10 
ATOM 2094 C CE2  . PHE A 1 7  ? -1.085 11.033 -2.354  1.00 43.35 ? 7  PHE A CE2  10 
ATOM 2095 C CZ   . PHE A 1 7  ? -1.888 11.969 -1.778  1.00 21.53 ? 7  PHE A CZ   10 
ATOM 2096 H H    . PHE A 1 7  ? 3.413  13.002 -5.272  1.00 0.00  ? 7  PHE A H    10 
ATOM 2097 H HA   . PHE A 1 7  ? 1.653  14.659 -3.572  1.00 0.00  ? 7  PHE A HA   10 
ATOM 2098 H HB2  . PHE A 1 7  ? 2.759  11.950 -2.865  1.00 0.00  ? 7  PHE A HB2  10 
ATOM 2099 H HB3  . PHE A 1 7  ? 2.715  13.195 -1.606  1.00 0.00  ? 7  PHE A HB3  10 
ATOM 2100 H HD1  . PHE A 1 7  ? 0.386  14.446 -1.427  1.00 0.00  ? 7  PHE A HD1  10 
ATOM 2101 H HD2  . PHE A 1 7  ? 0.918  10.585 -3.061  1.00 0.00  ? 7  PHE A HD2  10 
ATOM 2102 H HE1  . PHE A 1 7  ? -2.019 13.927 -0.984  1.00 0.00  ? 7  PHE A HE1  10 
ATOM 2103 H HE2  . PHE A 1 7  ? -1.487 10.066 -2.620  1.00 0.00  ? 7  PHE A HE2  10 
ATOM 2104 H HZ   . PHE A 1 7  ? -2.928 11.745 -1.588  1.00 0.00  ? 7  PHE A HZ   10 
ATOM 2105 N N    . TRP A 1 8  ? 4.303  15.342 -4.326  1.00 1.00  ? 8  TRP A N    10 
ATOM 2106 C CA   . TRP A 1 8  ? 5.551  16.073 -4.194  1.00 12.31 ? 8  TRP A CA   10 
ATOM 2107 C C    . TRP A 1 8  ? 5.801  16.822 -5.505  1.00 50.21 ? 8  TRP A C    10 
ATOM 2108 O O    . TRP A 1 8  ? 5.617  18.036 -5.575  1.00 55.13 ? 8  TRP A O    10 
ATOM 2109 C CB   . TRP A 1 8  ? 6.699  15.136 -3.815  1.00 21.45 ? 8  TRP A CB   10 
ATOM 2110 C CG   . TRP A 1 8  ? 7.877  15.837 -3.136  1.00 32.32 ? 8  TRP A CG   10 
ATOM 2111 C CD1  . TRP A 1 8  ? 7.968  16.255 -1.866  1.00 61.24 ? 8  TRP A CD1  10 
ATOM 2112 C CD2  . TRP A 1 8  ? 9.137  16.185 -3.746  1.00 53.32 ? 8  TRP A CD2  10 
ATOM 2113 N NE1  . TRP A 1 8  ? 9.190  16.846 -1.614  1.00 5.21  ? 8  TRP A NE1  10 
ATOM 2114 C CE2  . TRP A 1 8  ? 9.923  16.802 -2.795  1.00 63.34 ? 8  TRP A CE2  10 
ATOM 2115 C CE3  . TRP A 1 8  ? 9.598  15.987 -5.059  1.00 0.52  ? 8  TRP A CE3  10 
ATOM 2116 C CZ2  . TRP A 1 8  ? 11.217 17.271 -3.054  1.00 43.13 ? 8  TRP A CZ2  10 
ATOM 2117 C CZ3  . TRP A 1 8  ? 10.893 16.461 -5.304  1.00 51.11 ? 8  TRP A CZ3  10 
ATOM 2118 C CH2  . TRP A 1 8  ? 11.696 17.084 -4.356  1.00 1.31  ? 8  TRP A CH2  10 
ATOM 2119 H H    . TRP A 1 8  ? 3.813  15.349 -5.209  1.00 0.00  ? 8  TRP A H    10 
ATOM 2120 H HA   . TRP A 1 8  ? 5.434  16.808 -3.398  1.00 0.00  ? 8  TRP A HA   10 
ATOM 2121 H HB2  . TRP A 1 8  ? 6.312  14.379 -3.132  1.00 0.00  ? 8  TRP A HB2  10 
ATOM 2122 H HB3  . TRP A 1 8  ? 7.059  14.641 -4.717  1.00 0.00  ? 8  TRP A HB3  10 
ATOM 2123 H HD1  . TRP A 1 8  ? 7.184  16.143 -1.132  1.00 0.00  ? 8  TRP A HD1  10 
ATOM 2124 H HE1  . TRP A 1 8  ? 9.495  17.238 -0.735  1.00 0.00  ? 8  TRP A HE1  10 
ATOM 2125 H HE3  . TRP A 1 8  ? 9.001  15.506 -5.820  1.00 0.00  ? 8  TRP A HE3  10 
ATOM 2126 H HZ2  . TRP A 1 8  ? 11.812 17.750 -2.292  1.00 0.00  ? 8  TRP A HZ2  10 
ATOM 2127 H HZ3  . TRP A 1 8  ? 11.295 16.333 -6.298  1.00 0.00  ? 8  TRP A HZ3  10 
ATOM 2128 H HH2  . TRP A 1 8  ? 12.687 17.422 -4.623  1.00 0.00  ? 8  TRP A HH2  10 
ATOM 2129 N N    . LYS A 1 9  ? 6.215  16.068 -6.511  1.00 31.12 ? 9  LYS A N    10 
ATOM 2130 C CA   . LYS A 1 9  ? 6.492  16.644 -7.816  1.00 42.41 ? 9  LYS A CA   10 
ATOM 2131 C C    . LYS A 1 9  ? 6.278  15.582 -8.895  1.00 4.10  ? 9  LYS A C    10 
ATOM 2132 O O    . LYS A 1 9  ? 7.148  15.361 -9.736  1.00 41.44 ? 9  LYS A O    10 
ATOM 2133 C CB   . LYS A 1 9  ? 7.887  17.273 -7.839  1.00 22.33 ? 9  LYS A CB   10 
ATOM 2134 C CG   . LYS A 1 9  ? 7.873  18.611 -8.581  1.00 73.14 ? 9  LYS A CG   10 
ATOM 2135 C CD   . LYS A 1 9  ? 7.249  18.463 -9.969  1.00 22.54 ? 9  LYS A CD   10 
ATOM 2136 C CE   . LYS A 1 9  ? 7.060  19.827 -10.634 1.00 52.34 ? 9  LYS A CE   10 
ATOM 2137 N NZ   . LYS A 1 9  ? 8.008  19.991 -11.759 1.00 40.03 ? 9  LYS A NZ   10 
ATOM 2138 H H    . LYS A 1 9  ? 6.341  15.075 -6.370  1.00 0.00  ? 9  LYS A H    10 
ATOM 2139 H HA   . LYS A 1 9  ? 5.767  17.440 -7.986  1.00 0.00  ? 9  LYS A HA   10 
ATOM 2140 H HB2  . LYS A 1 9  ? 8.221  17.437 -6.815  1.00 0.00  ? 9  LYS A HB2  10 
ATOM 2141 H HB3  . LYS A 1 9  ? 8.578  16.594 -8.338  1.00 0.00  ? 9  LYS A HB3  10 
ATOM 2142 H HG2  . LYS A 1 9  ? 7.297  19.335 -8.004  1.00 0.00  ? 9  LYS A HG2  10 
ATOM 2143 H HG3  . LYS A 1 9  ? 8.897  18.970 -8.687  1.00 0.00  ? 9  LYS A HG3  10 
ATOM 2144 H HD2  . LYS A 1 9  ? 7.904  17.852 -10.590 1.00 0.00  ? 9  LYS A HD2  10 
ATOM 2145 H HD3  . LYS A 1 9  ? 6.281  17.972 -9.877  1.00 0.00  ? 9  LYS A HD3  10 
ATOM 2146 H HE2  . LYS A 1 9  ? 6.040  19.904 -11.011 1.00 0.00  ? 9  LYS A HE2  10 
ATOM 2147 H HE3  . LYS A 1 9  ? 7.233  20.614 -9.899  1.00 0.00  ? 9  LYS A HE3  10 
ATOM 2148 H HZ1  . LYS A 1 9  ? 7.871  20.896 -12.187 1.00 0.00  ? 9  LYS A HZ1  10 
ATOM 2149 H HZ2  . LYS A 1 9  ? 8.955  19.923 -11.413 1.00 0.00  ? 9  LYS A HZ2  10 
ATOM 2150 H HZ3  . LYS A 1 9  ? 7.847  19.267 -12.444 1.00 0.00  ? 9  LYS A HZ3  10 
ATOM 2151 N N    . THR A 1 10 ? 5.115  14.950 -8.836  1.00 11.01 ? 10 THR A N    10 
ATOM 2152 C CA   . THR A 1 10 ? 4.776  13.916 -9.798  1.00 20.44 ? 10 THR A CA   10 
ATOM 2153 C C    . THR A 1 10 ? 5.459  12.598 -9.427  1.00 1.24  ? 10 THR A C    10 
ATOM 2154 O O    . THR A 1 10 ? 4.804  11.560 -9.333  1.00 75.41 ? 10 THR A O    10 
ATOM 2155 C CB   . THR A 1 10 ? 5.151  14.423 -11.191 1.00 40.40 ? 10 THR A CB   10 
ATOM 2156 O OG1  . THR A 1 10 ? 4.018  14.106 -11.994 1.00 3.30  ? 10 THR A OG1  10 
ATOM 2157 C CG2  . THR A 1 10 ? 6.290  13.618 -11.821 1.00 21.11 ? 10 THR A CG2  10 
ATOM 2158 H H    . THR A 1 10 ? 4.454  15.191 -8.111  1.00 0.00  ? 10 THR A H    10 
ATOM 2159 H HA   . THR A 1 10 ? 3.697  13.762 -9.769  1.00 0.00  ? 10 THR A HA   10 
ATOM 2160 H HB   . THR A 1 10 ? 5.362  15.492 -11.190 1.00 0.00  ? 10 THR A HB   10 
ATOM 2161 H HG1  . THR A 1 10 ? 3.249  14.576 -11.662 1.00 0.00  ? 10 THR A HG1  10 
ATOM 2162 H HG21 . THR A 1 10 ? 6.325  13.815 -12.892 1.00 0.00  ? 10 THR A HG21 10 
ATOM 2163 H HG22 . THR A 1 10 ? 7.237  13.912 -11.366 1.00 0.00  ? 10 THR A HG22 10 
ATOM 2164 H HG23 . THR A 1 10 ? 6.121  12.555 -11.652 1.00 0.00  ? 10 THR A HG23 10 
ATOM 2165 N N    . PHE A 1 11 ? 6.765  12.682 -9.226  1.00 13.43 ? 11 PHE A N    10 
ATOM 2166 C CA   . PHE A 1 11 ? 7.545  11.509 -8.868  1.00 1.33  ? 11 PHE A CA   10 
ATOM 2167 C C    . PHE A 1 11 ? 6.902  10.760 -7.698  1.00 0.44  ? 11 PHE A C    10 
ATOM 2168 O O    . PHE A 1 11 ? 5.838  11.146 -7.220  1.00 3.00  ? 11 PHE A O    10 
ATOM 2169 C CB   . PHE A 1 11 ? 8.928  12.004 -8.443  1.00 33.03 ? 11 PHE A CB   10 
ATOM 2170 C CG   . PHE A 1 11 ? 10.072 11.063 -8.829  1.00 72.44 ? 11 PHE A CG   10 
ATOM 2171 C CD1  . PHE A 1 11 ? 10.314 10.788 -10.138 1.00 51.33 ? 11 PHE A CD1  10 
ATOM 2172 C CD2  . PHE A 1 11 ? 10.846 10.501 -7.861  1.00 43.25 ? 11 PHE A CD2  10 
ATOM 2173 C CE1  . PHE A 1 11 ? 11.376 9.915  -10.495 1.00 45.41 ? 11 PHE A CE1  10 
ATOM 2174 C CE2  . PHE A 1 11 ? 11.907 9.628  -8.218  1.00 51.32 ? 11 PHE A CE2  10 
ATOM 2175 C CZ   . PHE A 1 11 ? 12.149 9.353  -9.528  1.00 50.01 ? 11 PHE A CZ   10 
ATOM 2176 H H    . PHE A 1 11 ? 7.227  13.574 -9.325  1.00 0.00  ? 11 PHE A H    10 
ATOM 2177 H HA   . PHE A 1 11 ? 7.636  10.846 -9.728  1.00 0.00  ? 11 PHE A HA   10 
ATOM 2178 H HB2  . PHE A 1 11 ? 9.106  12.971 -8.914  1.00 0.00  ? 11 PHE A HB2  10 
ATOM 2179 H HB3  . PHE A 1 11 ? 8.935  12.137 -7.361  1.00 0.00  ? 11 PHE A HB3  10 
ATOM 2180 H HD1  . PHE A 1 11 ? 9.700  11.233 -10.906 1.00 0.00  ? 11 PHE A HD1  10 
ATOM 2181 H HD2  . PHE A 1 11 ? 10.653 10.719 -6.821  1.00 0.00  ? 11 PHE A HD2  10 
ATOM 2182 H HE1  . PHE A 1 11 ? 11.569 9.696  -11.535 1.00 0.00  ? 11 PHE A HE1  10 
ATOM 2183 H HE2  . PHE A 1 11 ? 12.521 9.182  -7.450  1.00 0.00  ? 11 PHE A HE2  10 
ATOM 2184 H HZ   . PHE A 1 11 ? 12.957 8.689  -9.800  1.00 0.00  ? 11 PHE A HZ   10 
ATOM 2185 N N    . THR A 1 12 ? 7.577  9.701  -7.273  1.00 41.34 ? 12 THR A N    10 
ATOM 2186 C CA   . THR A 1 12 ? 7.085  8.896  -6.169  1.00 31.24 ? 12 THR A CA   10 
ATOM 2187 C C    . THR A 1 12 ? 6.652  9.790  -5.006  1.00 54.44 ? 12 THR A C    10 
ATOM 2188 O O    . THR A 1 12 ? 5.843  9.384  -4.173  1.00 51.34 ? 12 THR A O    10 
ATOM 2189 C CB   . THR A 1 12 ? 8.179  7.894  -5.791  1.00 45.03 ? 12 THR A CB   10 
ATOM 2190 O OG1  . THR A 1 12 ? 7.700  7.295  -4.590  1.00 34.15 ? 12 THR A OG1  10 
ATOM 2191 C CG2  . THR A 1 12 ? 9.481  8.580  -5.372  1.00 31.50 ? 12 THR A CG2  10 
ATOM 2192 H H    . THR A 1 12 ? 8.445  9.451  -7.724  1.00 0.00  ? 12 THR A H    10 
ATOM 2193 H HA   . THR A 1 12 ? 6.214  8.338  -6.514  1.00 0.00  ? 12 THR A HA   10 
ATOM 2194 H HB   . THR A 1 12 ? 8.343  7.156  -6.576  1.00 0.00  ? 12 THR A HB   10 
ATOM 2195 H HG1  . THR A 1 12 ? 7.885  6.353  -4.606  1.00 0.00  ? 12 THR A HG1  10 
ATOM 2196 H HG21 . THR A 1 12 ? 10.302 8.208  -5.985  1.00 0.00  ? 12 THR A HG21 10 
ATOM 2197 H HG22 . THR A 1 12 ? 9.684  8.364  -4.323  1.00 0.00  ? 12 THR A HG22 10 
ATOM 2198 H HG23 . THR A 1 12 ? 9.384  9.657  -5.509  1.00 0.00  ? 12 THR A HG23 10 
ATOM 2199 N N    . SER A 1 13 ? 7.211  10.992 -4.987  1.00 20.14 ? 13 SER A N    10 
ATOM 2200 C CA   . SER A 1 13 ? 6.893  11.948 -3.940  1.00 12.21 ? 13 SER A CA   10 
ATOM 2201 C C    . SER A 1 13 ? 7.214  11.349 -2.569  1.00 21.42 ? 13 SER A C    10 
ATOM 2202 O O    . SER A 1 13 ? 6.629  11.745 -1.562  1.00 52.02 ? 13 SER A O    10 
ATOM 2203 C CB   . SER A 1 13 ? 5.423  12.368 -4.005  1.00 73.13 ? 13 SER A CB   10 
ATOM 2204 O OG   . SER A 1 13 ? 4.615  11.384 -4.647  1.00 51.25 ? 13 SER A OG   10 
ATOM 2205 H H    . SER A 1 13 ? 7.868  11.248 -5.710  1.00 0.00  ? 13 SER A H    10 
ATOM 2206 H HA   . SER A 1 13 ? 7.511  12.835 -4.083  1.00 0.00  ? 13 SER A HA   10 
ATOM 2207 H HB2  . SER A 1 13 ? 5.053  12.526 -2.992  1.00 0.00  ? 13 SER A HB2  10 
ATOM 2208 H HB3  . SER A 1 13 ? 5.348  13.302 -4.562  1.00 0.00  ? 13 SER A HB3  10 
ATOM 2209 H HG   . SER A 1 13 ? 4.582  11.562 -5.590  1.00 0.00  ? 13 SER A HG   10 
ATOM 2210 N N    . CYS A 1 14 ? 8.142  10.404 -2.575  1.00 51.53 ? 14 CYS A N    10 
ATOM 2211 C CA   . CYS A 1 14 ? 8.549  9.746  -1.344  1.00 42.13 ? 14 CYS A CA   10 
ATOM 2212 C C    . CYS A 1 14 ? 8.918  10.825 -0.323  1.00 34.43 ? 14 CYS A C    10 
ATOM 2213 O O    . CYS A 1 14 ? 10.097 11.055 -0.057  1.00 24.33 ? 14 CYS A O    10 
ATOM 2214 C CB   . CYS A 1 14 ? 9.699  8.766  -1.580  1.00 25.53 ? 14 CYS A CB   10 
ATOM 2215 S SG   . CYS A 1 14 ? 9.279  7.008  -1.290  1.00 23.41 ? 14 CYS A SG   10 
ATOM 2216 H H    . CYS A 1 14 ? 8.574  10.136 -3.447  1.00 0.00  ? 14 CYS A H    10 
ATOM 2217 H HA   . CYS A 1 14 ? 7.696  9.187  -0.958  1.00 0.00  ? 14 CYS A HA   10 
ATOM 2218 H HB2  . CYS A 1 14 ? 10.027 8.870  -2.614  1.00 0.00  ? 14 CYS A HB2  10 
ATOM 2219 H HB3  . CYS A 1 14 ? 10.526 9.037  -0.925  1.00 0.00  ? 14 CYS A HB3  10 
ATOM 2220 H HG   . CYS A 1 14 ? 10.338 6.375  -0.777  1.00 0.00  ? 14 CYS A HG   10 
# 
