data_1CHL
# 
_entry.id   1CHL 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.398 
_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   1CHL         pdb_00001chl 10.2210/pdb1chl/pdb 
WWPDB D_1000172330 ?            ?                   
# 
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 1995-02-07 
2 'Structure model' 1 1 2008-03-24 
3 'Structure model' 1 2 2011-07-13 
4 'Structure model' 1 3 2017-11-29 
5 'Structure model' 1 4 2024-11-13 
# 
_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' 'Version format compliance' 
2 3 'Structure model' 'Version format compliance' 
3 4 'Structure model' 'Derived calculations'      
4 4 'Structure model' Other                       
5 5 'Structure model' 'Data collection'           
6 5 'Structure model' 'Database references'       
7 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  4 'Structure model' pdbx_database_status      
2  4 'Structure model' pdbx_struct_assembly      
3  4 'Structure model' pdbx_struct_oper_list     
4  4 'Structure model' struct_conf               
5  4 'Structure model' struct_conf_type          
6  5 'Structure model' chem_comp_atom            
7  5 'Structure model' chem_comp_bond            
8  5 'Structure model' database_2                
9  5 'Structure model' pdbx_entry_details        
10 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 4 'Structure model' '_pdbx_database_status.process_site'  
2 5 'Structure model' '_database_2.pdbx_DOI'                
3 5 'Structure model' '_database_2.pdbx_database_accession' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.entry_id                        1CHL 
_pdbx_database_status.recvd_initial_deposition_date   1994-11-09 
_pdbx_database_status.deposit_site                    ? 
_pdbx_database_status.process_site                    BNL 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_mr                  REL 
_pdbx_database_status.SG_entry                        ? 
_pdbx_database_status.pdb_format_compatible           Y 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.status_code_nmr_data            ? 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Lippens, G.' 1 
'Najib, J.'   2 
'Wodak, S.J.' 3 
'Tartar, A.'  4 
# 
loop_
_citation.id 
_citation.title 
_citation.journal_abbrev 
_citation.journal_volume 
_citation.page_first 
_citation.page_last 
_citation.year 
_citation.journal_id_ASTM 
_citation.country 
_citation.journal_id_ISSN 
_citation.journal_id_CSD 
_citation.book_publisher 
_citation.pdbx_database_id_PubMed 
_citation.pdbx_database_id_DOI 
primary 'NMR sequential assignments and solution structure of chlorotoxin, a small scorpion toxin that blocks chloride channels.' 
Biochemistry  34  13   21 1995 BICHAW US 0006-2960 0033 ? 7819188 10.1021/bi00001a003 
1       
;Purification and Characterization of Chloraphyllin, a Chloride Channel Ligand from the Venom of the Scorpion Leiurus Quinquestriatus Quinquestriatus
;
Am.J.Physiol. 264 C361 ?  1993 AJPHAP US 0002-9513 2054 ? ?       ?                   
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Lippens, G.'      1 ? 
primary 'Najib, J.'        2 ? 
primary 'Wodak, S.J.'      3 ? 
primary 'Tartar, A.'       4 ? 
1       'Debin, J.A.'      5 ? 
1       'Maggio, J.E.'     6 ? 
1       'Strichartz, G.R.' 7 ? 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 man 
_entity.pdbx_description           CHLOROTOXIN 
_entity.formula_weight             4011.813 
_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       MCMPCFTTDHQMARKCDDCCGGKGRGKCYGPQCLCR 
_entity_poly.pdbx_seq_one_letter_code_can   MCMPCFTTDHQMARKCDDCCGGKGRGKCYGPQCLCR 
_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  MET n 
1 2  CYS n 
1 3  MET n 
1 4  PRO n 
1 5  CYS n 
1 6  PHE n 
1 7  THR n 
1 8  THR n 
1 9  ASP n 
1 10 HIS n 
1 11 GLN n 
1 12 MET n 
1 13 ALA n 
1 14 ARG n 
1 15 LYS n 
1 16 CYS n 
1 17 ASP n 
1 18 ASP n 
1 19 CYS n 
1 20 CYS n 
1 21 GLY n 
1 22 GLY n 
1 23 LYS n 
1 24 GLY n 
1 25 ARG n 
1 26 GLY n 
1 27 LYS n 
1 28 CYS n 
1 29 TYR n 
1 30 GLY n 
1 31 PRO n 
1 32 GLN n 
1 33 CYS n 
1 34 LEU n 
1 35 CYS n 
1 36 ARG n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      ? 
_entity_src_gen.pdbx_beg_seq_num                   ? 
_entity_src_gen.pdbx_end_seq_num                   ? 
_entity_src_gen.gene_src_common_name               'Egyptian scorpion' 
_entity_src_gen.gene_src_genus                     Leiurus 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Leiurus quinquestriatus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     6883 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      ? 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     ? 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ? 'C5 H10 N2 O3'   146.144 
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
LEU 'L-peptide linking' y LEUCINE         ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
THR 'L-peptide linking' y THREONINE       ? 'C4 H9 N O3'     119.119 
TYR 'L-peptide linking' y TYROSINE        ? 'C9 H11 N O3'    181.189 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  MET 1  1  1  MET MET A . n 
A 1 2  CYS 2  2  2  CYS CYS A . n 
A 1 3  MET 3  3  3  MET MET A . n 
A 1 4  PRO 4  4  4  PRO PRO A . n 
A 1 5  CYS 5  5  5  CYS CYS A . n 
A 1 6  PHE 6  6  6  PHE PHE A . n 
A 1 7  THR 7  7  7  THR THR A . n 
A 1 8  THR 8  8  8  THR THR A . n 
A 1 9  ASP 9  9  9  ASP ASP A . n 
A 1 10 HIS 10 10 10 HIS HIS A . n 
A 1 11 GLN 11 11 11 GLN GLN A . n 
A 1 12 MET 12 12 12 MET MET A . n 
A 1 13 ALA 13 13 13 ALA ALA A . n 
A 1 14 ARG 14 14 14 ARG ARG A . n 
A 1 15 LYS 15 15 15 LYS LYS A . n 
A 1 16 CYS 16 16 16 CYS CYS A . n 
A 1 17 ASP 17 17 17 ASP ASP A . n 
A 1 18 ASP 18 18 18 ASP ASP A . n 
A 1 19 CYS 19 19 19 CYS CYS A . n 
A 1 20 CYS 20 20 20 CYS CYS A . n 
A 1 21 GLY 21 21 21 GLY GLY A . n 
A 1 22 GLY 22 22 22 GLY GLY A . n 
A 1 23 LYS 23 23 23 LYS LYS A . n 
A 1 24 GLY 24 24 24 GLY GLY A . n 
A 1 25 ARG 25 25 25 ARG ARG A . n 
A 1 26 GLY 26 26 26 GLY GLY A . n 
A 1 27 LYS 27 27 27 LYS LYS A . n 
A 1 28 CYS 28 28 28 CYS CYS A . n 
A 1 29 TYR 29 29 29 TYR TYR A . n 
A 1 30 GLY 30 30 30 GLY GLY A . n 
A 1 31 PRO 31 31 31 PRO PRO A . n 
A 1 32 GLN 32 32 32 GLN GLN A . n 
A 1 33 CYS 33 33 33 CYS CYS A . n 
A 1 34 LEU 34 34 34 LEU LEU A . n 
A 1 35 CYS 35 35 35 CYS CYS A . n 
A 1 36 ARG 36 36 36 ARG ARG A . n 
# 
loop_
_software.name 
_software.classification 
_software.version 
_software.citation_id 
_software.pdbx_ordinal 
X-PLOR 'model building' . ? 1 
X-PLOR refinement       . ? 2 
X-PLOR phasing          . ? 3 
# 
_cell.entry_id           1CHL 
_cell.length_a           1.000 
_cell.length_b           1.000 
_cell.length_c           1.000 
_cell.angle_alpha        90.00 
_cell.angle_beta         90.00 
_cell.angle_gamma        90.00 
_cell.Z_PDB              1 
_cell.pdbx_unique_axis   ? 
# 
_symmetry.entry_id                         1CHL 
_symmetry.space_group_name_H-M             'P 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                1 
# 
_exptl.entry_id          1CHL 
_exptl.method            'SOLUTION NMR' 
_exptl.crystals_number   ? 
# 
_database_PDB_matrix.entry_id          1CHL 
_database_PDB_matrix.origx[1][1]       1.000000 
_database_PDB_matrix.origx[1][2]       0.000000 
_database_PDB_matrix.origx[1][3]       0.000000 
_database_PDB_matrix.origx[2][1]       0.000000 
_database_PDB_matrix.origx[2][2]       1.000000 
_database_PDB_matrix.origx[2][3]       0.000000 
_database_PDB_matrix.origx[3][1]       0.000000 
_database_PDB_matrix.origx[3][2]       0.000000 
_database_PDB_matrix.origx[3][3]       1.000000 
_database_PDB_matrix.origx_vector[1]   0.00000 
_database_PDB_matrix.origx_vector[2]   0.00000 
_database_PDB_matrix.origx_vector[3]   0.00000 
# 
_struct.entry_id                  1CHL 
_struct.title                     
'NMR SEQUENTIAL ASSIGNMENTS AND SOLUTION STRUCTURE OF CHLOROTOXIN, A SMALL SCORPION TOXIN THAT BLOCKS CHLORIDE CHANNELS' 
_struct.pdbx_model_details        ? 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        1CHL 
_struct_keywords.pdbx_keywords   NEUROTOXIN 
_struct_keywords.text            NEUROTOXIN 
# 
_struct_asym.id                            A 
_struct_asym.pdbx_blank_PDB_chainid_flag   Y 
_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                    SCXL_LEIQU 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_db_accession          P45639 
_struct_ref.pdbx_align_begin           1 
_struct_ref.pdbx_seq_one_letter_code   MCMPCFTTDHQMARKCDDCCGGKGRGKCYGPQCLCR 
_struct_ref.pdbx_db_isoform            ? 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              1CHL 
_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                 36 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P45639 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  36 
_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       36 
# 
_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   ? 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
_struct_biol.id   1 
# 
_struct_conf.conf_type_id            HELX_P 
_struct_conf.id                      HELX_P1 
_struct_conf.pdbx_PDB_helix_id       H1 
_struct_conf.beg_label_comp_id       GLN 
_struct_conf.beg_label_asym_id       A 
_struct_conf.beg_label_seq_id        11 
_struct_conf.pdbx_beg_PDB_ins_code   ? 
_struct_conf.end_label_comp_id       GLY 
_struct_conf.end_label_asym_id       A 
_struct_conf.end_label_seq_id        21 
_struct_conf.pdbx_end_PDB_ins_code   ? 
_struct_conf.beg_auth_comp_id        GLN 
_struct_conf.beg_auth_asym_id        A 
_struct_conf.beg_auth_seq_id         11 
_struct_conf.end_auth_comp_id        GLY 
_struct_conf.end_auth_asym_id        A 
_struct_conf.end_auth_seq_id         21 
_struct_conf.pdbx_PDB_helix_class    1 
_struct_conf.details                 ? 
_struct_conf.pdbx_PDB_helix_length   11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ? ? A CYS 2  SG ? ? ? 1_555 A CYS 19 SG ? ? A CYS 2  A CYS 19 1_555 ? ? ? ? ? ? ? 2.020 ? ? 
disulf2 disulf ? ? A CYS 5  SG ? ? ? 1_555 A CYS 28 SG ? ? A CYS 5  A CYS 28 1_555 ? ? ? ? ? ? ? 2.019 ? ? 
disulf3 disulf ? ? A CYS 16 SG ? ? ? 1_555 A CYS 33 SG ? ? A CYS 16 A CYS 33 1_555 ? ? ? ? ? ? ? 2.020 ? ? 
disulf4 disulf ? ? A CYS 20 SG ? ? ? 1_555 A CYS 35 SG ? ? A CYS 20 A CYS 35 1_555 ? ? ? ? ? ? ? 2.018 ? ? 
# 
_struct_conn_type.id          disulf 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 CYS A 2  ? CYS A 19 ? CYS A 2  ? 1_555 CYS A 19 ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS A 5  ? CYS A 28 ? CYS A 5  ? 1_555 CYS A 28 ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS A 16 ? CYS A 33 ? CYS A 16 ? 1_555 CYS A 33 ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS A 20 ? CYS A 35 ? CYS A 20 ? 1_555 CYS A 35 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
_struct_sheet.id               S1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   3 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
S1 1 2 ? anti-parallel 
S1 2 3 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
S1 1 MET A 1  ? PRO A 4  ? MET A 1  PRO A 4  
S1 2 GLN A 32 ? ARG A 36 ? GLN A 32 ARG A 36 
S1 3 GLY A 26 ? TYR A 29 ? GLY A 26 TYR A 29 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
S1 1 2 N CYS A 2  ? N CYS A 2  O CYS A 33 ? O CYS A 33 
S1 2 3 N LEU A 34 ? N LEU A 34 O LYS A 27 ? O LYS A 27 
# 
_pdbx_entry_details.entry_id                   1CHL 
_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 
# 
_pdbx_validate_rmsd_angle.id                         1 
_pdbx_validate_rmsd_angle.PDB_model_num              4 
_pdbx_validate_rmsd_angle.auth_atom_id_1             C 
_pdbx_validate_rmsd_angle.auth_asym_id_1             A 
_pdbx_validate_rmsd_angle.auth_comp_id_1             MET 
_pdbx_validate_rmsd_angle.auth_seq_id_1              3 
_pdbx_validate_rmsd_angle.PDB_ins_code_1             ? 
_pdbx_validate_rmsd_angle.label_alt_id_1             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_2             N 
_pdbx_validate_rmsd_angle.auth_asym_id_2             A 
_pdbx_validate_rmsd_angle.auth_comp_id_2             PRO 
_pdbx_validate_rmsd_angle.auth_seq_id_2              4 
_pdbx_validate_rmsd_angle.PDB_ins_code_2             ? 
_pdbx_validate_rmsd_angle.label_alt_id_2             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_3             CD 
_pdbx_validate_rmsd_angle.auth_asym_id_3             A 
_pdbx_validate_rmsd_angle.auth_comp_id_3             PRO 
_pdbx_validate_rmsd_angle.auth_seq_id_3              4 
_pdbx_validate_rmsd_angle.PDB_ins_code_3             ? 
_pdbx_validate_rmsd_angle.label_alt_id_3             ? 
_pdbx_validate_rmsd_angle.angle_value                114.36 
_pdbx_validate_rmsd_angle.angle_target_value         128.40 
_pdbx_validate_rmsd_angle.angle_deviation            -14.04 
_pdbx_validate_rmsd_angle.angle_standard_deviation   2.10 
_pdbx_validate_rmsd_angle.linker_flag                Y 
# 
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 MET A 3  ? ? -44.77  155.45  
2  1 PRO A 4  ? ? -57.53  -162.59 
3  1 PHE A 6  ? ? -150.85 40.85   
4  1 THR A 8  ? ? 49.91   -160.91 
5  1 ASP A 9  ? ? -157.00 -44.35  
6  1 GLN A 11 ? ? -154.96 58.06   
7  1 PRO A 31 ? ? -97.80  40.44   
8  2 MET A 3  ? ? -177.00 -172.30 
9  2 THR A 8  ? ? 67.30   171.98  
10 2 MET A 12 ? ? -120.45 -58.30  
11 2 ARG A 25 ? ? -148.65 37.09   
12 2 LYS A 27 ? ? 171.44  -169.82 
13 2 GLN A 32 ? ? -145.24 -159.39 
14 3 CYS A 2  ? ? -112.23 -120.02 
15 3 MET A 3  ? ? -102.52 -154.77 
16 3 PRO A 4  ? ? -109.07 -160.72 
17 3 PHE A 6  ? ? -112.43 -164.62 
18 3 ASP A 9  ? ? 72.22   160.75  
19 3 ARG A 25 ? ? -149.19 38.36   
20 3 PRO A 31 ? ? -87.39  35.37   
21 3 LEU A 34 ? ? -122.90 -164.71 
22 4 MET A 3  ? ? 60.14   168.93  
23 4 CYS A 5  ? ? -50.53  177.82  
24 4 PHE A 6  ? ? 53.26   -174.24 
25 4 THR A 8  ? ? 178.15  175.66  
26 4 ASP A 9  ? ? -167.26 75.39   
27 4 HIS A 10 ? ? -159.89 56.98   
28 4 GLN A 11 ? ? 76.28   65.25   
29 4 MET A 12 ? ? -127.68 -56.55  
30 4 LYS A 23 ? ? -44.25  98.50   
31 4 ARG A 25 ? ? -146.99 40.39   
32 4 LEU A 34 ? ? -123.25 -161.30 
33 5 MET A 3  ? ? 56.61   163.78  
34 5 PRO A 4  ? ? -109.98 -159.91 
35 5 THR A 7  ? ? 37.98   -132.10 
36 5 THR A 8  ? ? 48.87   -94.33  
37 5 ASP A 9  ? ? 73.62   73.69   
38 5 HIS A 10 ? ? -139.56 -54.91  
39 5 GLN A 11 ? ? -145.14 14.70   
40 5 LYS A 23 ? ? 67.98   -83.84  
41 5 LYS A 27 ? ? -151.68 -159.21 
42 5 LEU A 34 ? ? -113.67 -166.84 
43 5 CYS A 35 ? ? -117.25 -166.69 
44 6 MET A 3  ? ? 84.47   178.65  
45 6 PHE A 6  ? ? -151.64 84.12   
46 6 THR A 7  ? ? -126.91 -78.13  
47 6 HIS A 10 ? ? -153.76 59.46   
48 6 ARG A 25 ? ? -146.90 39.96   
49 7 CYS A 2  ? ? -104.66 -65.95  
50 7 PHE A 6  ? ? -156.80 62.19   
51 7 THR A 7  ? ? -140.39 -69.81  
52 7 HIS A 10 ? ? 49.10   23.31   
53 7 GLN A 11 ? ? -169.81 42.63   
54 7 LYS A 27 ? ? -178.23 143.20  
55 7 CYS A 28 ? ? -59.11  87.56   
# 
loop_
_pdbx_validate_planes.id 
_pdbx_validate_planes.PDB_model_num 
_pdbx_validate_planes.auth_comp_id 
_pdbx_validate_planes.auth_asym_id 
_pdbx_validate_planes.auth_seq_id 
_pdbx_validate_planes.PDB_ins_code 
_pdbx_validate_planes.label_alt_id 
_pdbx_validate_planes.rmsd 
_pdbx_validate_planes.type 
1  1 ARG A 14 ? ? 0.309 'SIDE CHAIN' 
2  1 ARG A 25 ? ? 0.250 'SIDE CHAIN' 
3  1 ARG A 36 ? ? 0.317 'SIDE CHAIN' 
4  2 ARG A 14 ? ? 0.293 'SIDE CHAIN' 
5  2 ARG A 25 ? ? 0.181 'SIDE CHAIN' 
6  2 ARG A 36 ? ? 0.304 'SIDE CHAIN' 
7  3 ARG A 14 ? ? 0.315 'SIDE CHAIN' 
8  3 ARG A 25 ? ? 0.231 'SIDE CHAIN' 
9  3 ARG A 36 ? ? 0.234 'SIDE CHAIN' 
10 4 ARG A 14 ? ? 0.217 'SIDE CHAIN' 
11 4 ARG A 25 ? ? 0.250 'SIDE CHAIN' 
12 4 ARG A 36 ? ? 0.111 'SIDE CHAIN' 
13 5 ARG A 14 ? ? 0.185 'SIDE CHAIN' 
14 5 ARG A 25 ? ? 0.296 'SIDE CHAIN' 
15 5 ARG A 36 ? ? 0.164 'SIDE CHAIN' 
16 6 ARG A 14 ? ? 0.293 'SIDE CHAIN' 
17 6 ARG A 25 ? ? 0.305 'SIDE CHAIN' 
18 6 ARG A 36 ? ? 0.208 'SIDE CHAIN' 
19 7 ARG A 14 ? ? 0.307 'SIDE CHAIN' 
20 7 ARG A 25 ? ? 0.197 'SIDE CHAIN' 
21 7 ARG A 36 ? ? 0.262 'SIDE CHAIN' 
# 
_pdbx_nmr_ensemble.entry_id                             1CHL 
_pdbx_nmr_ensemble.conformers_calculated_total_number   ? 
_pdbx_nmr_ensemble.conformers_submitted_total_number    7 
_pdbx_nmr_ensemble.conformer_selection_criteria         ? 
# 
_pdbx_nmr_software.classification   refinement 
_pdbx_nmr_software.name             X-PLOR 
_pdbx_nmr_software.version          ? 
_pdbx_nmr_software.authors          BRUNGER 
_pdbx_nmr_software.ordinal          1 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASP N    N N N 41  
ASP CA   C N S 42  
ASP C    C N N 43  
ASP O    O N N 44  
ASP CB   C N N 45  
ASP CG   C N N 46  
ASP OD1  O N N 47  
ASP OD2  O N N 48  
ASP OXT  O N N 49  
ASP H    H N N 50  
ASP H2   H N N 51  
ASP HA   H N N 52  
ASP HB2  H N N 53  
ASP HB3  H N N 54  
ASP HD2  H N N 55  
ASP HXT  H N N 56  
CYS N    N N N 57  
CYS CA   C N R 58  
CYS C    C N N 59  
CYS O    O N N 60  
CYS CB   C N N 61  
CYS SG   S N N 62  
CYS OXT  O N N 63  
CYS H    H N N 64  
CYS H2   H N N 65  
CYS HA   H N N 66  
CYS HB2  H N N 67  
CYS HB3  H N N 68  
CYS HG   H N N 69  
CYS HXT  H N N 70  
GLN N    N N N 71  
GLN CA   C N S 72  
GLN C    C N N 73  
GLN O    O N N 74  
GLN CB   C N N 75  
GLN CG   C N N 76  
GLN CD   C N N 77  
GLN OE1  O N N 78  
GLN NE2  N N N 79  
GLN OXT  O N N 80  
GLN H    H N N 81  
GLN H2   H N N 82  
GLN HA   H N N 83  
GLN HB2  H N N 84  
GLN HB3  H N N 85  
GLN HG2  H N N 86  
GLN HG3  H N N 87  
GLN HE21 H N N 88  
GLN HE22 H N N 89  
GLN HXT  H N N 90  
GLY N    N N N 91  
GLY CA   C N N 92  
GLY C    C N N 93  
GLY O    O N N 94  
GLY OXT  O N N 95  
GLY H    H N N 96  
GLY H2   H N N 97  
GLY HA2  H N N 98  
GLY HA3  H N N 99  
GLY HXT  H N N 100 
HIS N    N N N 101 
HIS CA   C N S 102 
HIS C    C N N 103 
HIS O    O N N 104 
HIS CB   C N N 105 
HIS CG   C Y N 106 
HIS ND1  N Y N 107 
HIS CD2  C Y N 108 
HIS CE1  C Y N 109 
HIS NE2  N Y N 110 
HIS OXT  O N N 111 
HIS H    H N N 112 
HIS H2   H N N 113 
HIS HA   H N N 114 
HIS HB2  H N N 115 
HIS HB3  H N N 116 
HIS HD1  H N N 117 
HIS HD2  H N N 118 
HIS HE1  H N N 119 
HIS HE2  H N N 120 
HIS HXT  H N N 121 
LEU N    N N N 122 
LEU CA   C N S 123 
LEU C    C N N 124 
LEU O    O N N 125 
LEU CB   C N N 126 
LEU CG   C N N 127 
LEU CD1  C N N 128 
LEU CD2  C N N 129 
LEU OXT  O N N 130 
LEU H    H N N 131 
LEU H2   H N N 132 
LEU HA   H N N 133 
LEU HB2  H N N 134 
LEU HB3  H N N 135 
LEU HG   H N N 136 
LEU HD11 H N N 137 
LEU HD12 H N N 138 
LEU HD13 H N N 139 
LEU HD21 H N N 140 
LEU HD22 H N N 141 
LEU HD23 H N N 142 
LEU HXT  H N N 143 
LYS N    N N N 144 
LYS CA   C N S 145 
LYS C    C N N 146 
LYS O    O N N 147 
LYS CB   C N N 148 
LYS CG   C N N 149 
LYS CD   C N N 150 
LYS CE   C N N 151 
LYS NZ   N N N 152 
LYS OXT  O N N 153 
LYS H    H N N 154 
LYS H2   H N N 155 
LYS HA   H N N 156 
LYS HB2  H N N 157 
LYS HB3  H N N 158 
LYS HG2  H N N 159 
LYS HG3  H N N 160 
LYS HD2  H N N 161 
LYS HD3  H N N 162 
LYS HE2  H N N 163 
LYS HE3  H N N 164 
LYS HZ1  H N N 165 
LYS HZ2  H N N 166 
LYS HZ3  H N N 167 
LYS HXT  H N N 168 
MET N    N N N 169 
MET CA   C N S 170 
MET C    C N N 171 
MET O    O N N 172 
MET CB   C N N 173 
MET CG   C N N 174 
MET SD   S N N 175 
MET CE   C N N 176 
MET OXT  O N N 177 
MET H    H N N 178 
MET H2   H N N 179 
MET HA   H N N 180 
MET HB2  H N N 181 
MET HB3  H N N 182 
MET HG2  H N N 183 
MET HG3  H N N 184 
MET HE1  H N N 185 
MET HE2  H N N 186 
MET HE3  H N N 187 
MET HXT  H N N 188 
PHE N    N N N 189 
PHE CA   C N S 190 
PHE C    C N N 191 
PHE O    O N N 192 
PHE CB   C N N 193 
PHE CG   C Y N 194 
PHE CD1  C Y N 195 
PHE CD2  C Y N 196 
PHE CE1  C Y N 197 
PHE CE2  C Y N 198 
PHE CZ   C Y N 199 
PHE OXT  O N N 200 
PHE H    H N N 201 
PHE H2   H N N 202 
PHE HA   H N N 203 
PHE HB2  H N N 204 
PHE HB3  H N N 205 
PHE HD1  H N N 206 
PHE HD2  H N N 207 
PHE HE1  H N N 208 
PHE HE2  H N N 209 
PHE HZ   H N N 210 
PHE HXT  H N N 211 
PRO N    N N N 212 
PRO CA   C N S 213 
PRO C    C N N 214 
PRO O    O N N 215 
PRO CB   C N N 216 
PRO CG   C N N 217 
PRO CD   C N N 218 
PRO OXT  O N N 219 
PRO H    H N N 220 
PRO HA   H N N 221 
PRO HB2  H N N 222 
PRO HB3  H N N 223 
PRO HG2  H N N 224 
PRO HG3  H N N 225 
PRO HD2  H N N 226 
PRO HD3  H N N 227 
PRO HXT  H N N 228 
THR N    N N N 229 
THR CA   C N S 230 
THR C    C N N 231 
THR O    O N N 232 
THR CB   C N R 233 
THR OG1  O N N 234 
THR CG2  C N N 235 
THR OXT  O N N 236 
THR H    H N N 237 
THR H2   H N N 238 
THR HA   H N N 239 
THR HB   H N N 240 
THR HG1  H N N 241 
THR HG21 H N N 242 
THR HG22 H N N 243 
THR HG23 H N N 244 
THR HXT  H N N 245 
TYR N    N N N 246 
TYR CA   C N S 247 
TYR C    C N N 248 
TYR O    O N N 249 
TYR CB   C N N 250 
TYR CG   C Y N 251 
TYR CD1  C Y N 252 
TYR CD2  C Y N 253 
TYR CE1  C Y N 254 
TYR CE2  C Y N 255 
TYR CZ   C Y N 256 
TYR OH   O N N 257 
TYR OXT  O N N 258 
TYR H    H N N 259 
TYR H2   H N N 260 
TYR HA   H N N 261 
TYR HB2  H N N 262 
TYR HB3  H N N 263 
TYR HD1  H N N 264 
TYR HD2  H N N 265 
TYR HE1  H N N 266 
TYR HE2  H N N 267 
TYR HH   H N N 268 
TYR HXT  H N N 269 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASP N   CA   sing N N 39  
ASP N   H    sing N N 40  
ASP N   H2   sing N N 41  
ASP CA  C    sing N N 42  
ASP CA  CB   sing N N 43  
ASP CA  HA   sing N N 44  
ASP C   O    doub N N 45  
ASP C   OXT  sing N N 46  
ASP CB  CG   sing N N 47  
ASP CB  HB2  sing N N 48  
ASP CB  HB3  sing N N 49  
ASP CG  OD1  doub N N 50  
ASP CG  OD2  sing N N 51  
ASP OD2 HD2  sing N N 52  
ASP OXT HXT  sing N N 53  
CYS N   CA   sing N N 54  
CYS N   H    sing N N 55  
CYS N   H2   sing N N 56  
CYS CA  C    sing N N 57  
CYS CA  CB   sing N N 58  
CYS CA  HA   sing N N 59  
CYS C   O    doub N N 60  
CYS C   OXT  sing N N 61  
CYS CB  SG   sing N N 62  
CYS CB  HB2  sing N N 63  
CYS CB  HB3  sing N N 64  
CYS SG  HG   sing N N 65  
CYS OXT HXT  sing N N 66  
GLN N   CA   sing N N 67  
GLN N   H    sing N N 68  
GLN N   H2   sing N N 69  
GLN CA  C    sing N N 70  
GLN CA  CB   sing N N 71  
GLN CA  HA   sing N N 72  
GLN C   O    doub N N 73  
GLN C   OXT  sing N N 74  
GLN CB  CG   sing N N 75  
GLN CB  HB2  sing N N 76  
GLN CB  HB3  sing N N 77  
GLN CG  CD   sing N N 78  
GLN CG  HG2  sing N N 79  
GLN CG  HG3  sing N N 80  
GLN CD  OE1  doub N N 81  
GLN CD  NE2  sing N N 82  
GLN NE2 HE21 sing N N 83  
GLN NE2 HE22 sing N N 84  
GLN OXT HXT  sing N N 85  
GLY N   CA   sing N N 86  
GLY N   H    sing N N 87  
GLY N   H2   sing N N 88  
GLY CA  C    sing N N 89  
GLY CA  HA2  sing N N 90  
GLY CA  HA3  sing N N 91  
GLY C   O    doub N N 92  
GLY C   OXT  sing N N 93  
GLY OXT HXT  sing N N 94  
HIS N   CA   sing N N 95  
HIS N   H    sing N N 96  
HIS N   H2   sing N N 97  
HIS CA  C    sing N N 98  
HIS CA  CB   sing N N 99  
HIS CA  HA   sing N N 100 
HIS C   O    doub N N 101 
HIS C   OXT  sing N N 102 
HIS CB  CG   sing N N 103 
HIS CB  HB2  sing N N 104 
HIS CB  HB3  sing N N 105 
HIS CG  ND1  sing Y N 106 
HIS CG  CD2  doub Y N 107 
HIS ND1 CE1  doub Y N 108 
HIS ND1 HD1  sing N N 109 
HIS CD2 NE2  sing Y N 110 
HIS CD2 HD2  sing N N 111 
HIS CE1 NE2  sing Y N 112 
HIS CE1 HE1  sing N N 113 
HIS NE2 HE2  sing N N 114 
HIS OXT HXT  sing N N 115 
LEU N   CA   sing N N 116 
LEU N   H    sing N N 117 
LEU N   H2   sing N N 118 
LEU CA  C    sing N N 119 
LEU CA  CB   sing N N 120 
LEU CA  HA   sing N N 121 
LEU C   O    doub N N 122 
LEU C   OXT  sing N N 123 
LEU CB  CG   sing N N 124 
LEU CB  HB2  sing N N 125 
LEU CB  HB3  sing N N 126 
LEU CG  CD1  sing N N 127 
LEU CG  CD2  sing N N 128 
LEU CG  HG   sing N N 129 
LEU CD1 HD11 sing N N 130 
LEU CD1 HD12 sing N N 131 
LEU CD1 HD13 sing N N 132 
LEU CD2 HD21 sing N N 133 
LEU CD2 HD22 sing N N 134 
LEU CD2 HD23 sing N N 135 
LEU OXT HXT  sing N N 136 
LYS N   CA   sing N N 137 
LYS N   H    sing N N 138 
LYS N   H2   sing N N 139 
LYS CA  C    sing N N 140 
LYS CA  CB   sing N N 141 
LYS CA  HA   sing N N 142 
LYS C   O    doub N N 143 
LYS C   OXT  sing N N 144 
LYS CB  CG   sing N N 145 
LYS CB  HB2  sing N N 146 
LYS CB  HB3  sing N N 147 
LYS CG  CD   sing N N 148 
LYS CG  HG2  sing N N 149 
LYS CG  HG3  sing N N 150 
LYS CD  CE   sing N N 151 
LYS CD  HD2  sing N N 152 
LYS CD  HD3  sing N N 153 
LYS CE  NZ   sing N N 154 
LYS CE  HE2  sing N N 155 
LYS CE  HE3  sing N N 156 
LYS NZ  HZ1  sing N N 157 
LYS NZ  HZ2  sing N N 158 
LYS NZ  HZ3  sing N N 159 
LYS OXT HXT  sing N N 160 
MET N   CA   sing N N 161 
MET N   H    sing N N 162 
MET N   H2   sing N N 163 
MET CA  C    sing N N 164 
MET CA  CB   sing N N 165 
MET CA  HA   sing N N 166 
MET C   O    doub N N 167 
MET C   OXT  sing N N 168 
MET CB  CG   sing N N 169 
MET CB  HB2  sing N N 170 
MET CB  HB3  sing N N 171 
MET CG  SD   sing N N 172 
MET CG  HG2  sing N N 173 
MET CG  HG3  sing N N 174 
MET SD  CE   sing N N 175 
MET CE  HE1  sing N N 176 
MET CE  HE2  sing N N 177 
MET CE  HE3  sing N N 178 
MET OXT HXT  sing N N 179 
PHE N   CA   sing N N 180 
PHE N   H    sing N N 181 
PHE N   H2   sing N N 182 
PHE CA  C    sing N N 183 
PHE CA  CB   sing N N 184 
PHE CA  HA   sing N N 185 
PHE C   O    doub N N 186 
PHE C   OXT  sing N N 187 
PHE CB  CG   sing N N 188 
PHE CB  HB2  sing N N 189 
PHE CB  HB3  sing N N 190 
PHE CG  CD1  doub Y N 191 
PHE CG  CD2  sing Y N 192 
PHE CD1 CE1  sing Y N 193 
PHE CD1 HD1  sing N N 194 
PHE CD2 CE2  doub Y N 195 
PHE CD2 HD2  sing N N 196 
PHE CE1 CZ   doub Y N 197 
PHE CE1 HE1  sing N N 198 
PHE CE2 CZ   sing Y N 199 
PHE CE2 HE2  sing N N 200 
PHE CZ  HZ   sing N N 201 
PHE OXT HXT  sing N N 202 
PRO N   CA   sing N N 203 
PRO N   CD   sing N N 204 
PRO N   H    sing N N 205 
PRO CA  C    sing N N 206 
PRO CA  CB   sing N N 207 
PRO CA  HA   sing N N 208 
PRO C   O    doub N N 209 
PRO C   OXT  sing N N 210 
PRO CB  CG   sing N N 211 
PRO CB  HB2  sing N N 212 
PRO CB  HB3  sing N N 213 
PRO CG  CD   sing N N 214 
PRO CG  HG2  sing N N 215 
PRO CG  HG3  sing N N 216 
PRO CD  HD2  sing N N 217 
PRO CD  HD3  sing N N 218 
PRO OXT HXT  sing N N 219 
THR N   CA   sing N N 220 
THR N   H    sing N N 221 
THR N   H2   sing N N 222 
THR CA  C    sing N N 223 
THR CA  CB   sing N N 224 
THR CA  HA   sing N N 225 
THR C   O    doub N N 226 
THR C   OXT  sing N N 227 
THR CB  OG1  sing N N 228 
THR CB  CG2  sing N N 229 
THR CB  HB   sing N N 230 
THR OG1 HG1  sing N N 231 
THR CG2 HG21 sing N N 232 
THR CG2 HG22 sing N N 233 
THR CG2 HG23 sing N N 234 
THR OXT HXT  sing N N 235 
TYR N   CA   sing N N 236 
TYR N   H    sing N N 237 
TYR N   H2   sing N N 238 
TYR CA  C    sing N N 239 
TYR CA  CB   sing N N 240 
TYR CA  HA   sing N N 241 
TYR C   O    doub N N 242 
TYR C   OXT  sing N N 243 
TYR CB  CG   sing N N 244 
TYR CB  HB2  sing N N 245 
TYR CB  HB3  sing N N 246 
TYR CG  CD1  doub Y N 247 
TYR CG  CD2  sing Y N 248 
TYR CD1 CE1  sing Y N 249 
TYR CD1 HD1  sing N N 250 
TYR CD2 CE2  doub Y N 251 
TYR CD2 HD2  sing N N 252 
TYR CE1 CZ   doub Y N 253 
TYR CE1 HE1  sing N N 254 
TYR CE2 CZ   sing Y N 255 
TYR CE2 HE2  sing N N 256 
TYR CZ  OH   sing N N 257 
TYR OH  HH   sing N N 258 
TYR OXT HXT  sing N N 259 
# 
_atom_sites.entry_id                    1CHL 
_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    . MET A 1 1  ? -5.490  -0.049  8.648   1.00 0.00 ? 1  MET A N    1 
ATOM 2    C CA   . MET A 1 1  ? -4.494  0.525   7.699   1.00 0.00 ? 1  MET A CA   1 
ATOM 3    C C    . MET A 1 1  ? -3.180  -0.251  7.810   1.00 0.00 ? 1  MET A C    1 
ATOM 4    O O    . MET A 1 1  ? -2.903  -0.881  8.811   1.00 0.00 ? 1  MET A O    1 
ATOM 5    C CB   . MET A 1 1  ? -4.251  1.997   8.040   1.00 0.00 ? 1  MET A CB   1 
ATOM 6    C CG   . MET A 1 1  ? -3.734  2.113   9.475   1.00 0.00 ? 1  MET A CG   1 
ATOM 7    S SD   . MET A 1 1  ? -2.953  3.729   9.703   1.00 0.00 ? 1  MET A SD   1 
ATOM 8    C CE   . MET A 1 1  ? -4.225  4.445   10.773  1.00 0.00 ? 1  MET A CE   1 
ATOM 9    H H1   . MET A 1 1  ? -4.995  -0.555  9.408   1.00 0.00 ? 1  MET A H1   1 
ATOM 10   H H2   . MET A 1 1  ? -6.062  0.719   9.056   1.00 0.00 ? 1  MET A H2   1 
ATOM 11   H H3   . MET A 1 1  ? -6.111  -0.711  8.140   1.00 0.00 ? 1  MET A H3   1 
ATOM 12   H HA   . MET A 1 1  ? -4.872  0.447   6.691   1.00 0.00 ? 1  MET A HA   1 
ATOM 13   H HB2  . MET A 1 1  ? -3.520  2.408   7.359   1.00 0.00 ? 1  MET A HB2  1 
ATOM 14   H HB3  . MET A 1 1  ? -5.176  2.545   7.948   1.00 0.00 ? 1  MET A HB3  1 
ATOM 15   H HG2  . MET A 1 1  ? -4.559  2.012   10.164  1.00 0.00 ? 1  MET A HG2  1 
ATOM 16   H HG3  . MET A 1 1  ? -3.010  1.334   9.662   1.00 0.00 ? 1  MET A HG3  1 
ATOM 17   H HE1  . MET A 1 1  ? -5.170  3.954   10.584  1.00 0.00 ? 1  MET A HE1  1 
ATOM 18   H HE2  . MET A 1 1  ? -3.942  4.308   11.807  1.00 0.00 ? 1  MET A HE2  1 
ATOM 19   H HE3  . MET A 1 1  ? -4.321  5.498   10.565  1.00 0.00 ? 1  MET A HE3  1 
ATOM 20   N N    . CYS A 1 2  ? -2.369  -0.211  6.789   1.00 0.00 ? 2  CYS A N    1 
ATOM 21   C CA   . CYS A 1 2  ? -1.074  -0.949  6.836   1.00 0.00 ? 2  CYS A CA   1 
ATOM 22   C C    . CYS A 1 2  ? 0.081   0.051   6.918   1.00 0.00 ? 2  CYS A C    1 
ATOM 23   O O    . CYS A 1 2  ? -0.125  1.248   6.966   1.00 0.00 ? 2  CYS A O    1 
ATOM 24   C CB   . CYS A 1 2  ? -0.925  -1.799  5.573   1.00 0.00 ? 2  CYS A CB   1 
ATOM 25   S SG   . CYS A 1 2  ? 0.077   -3.262  5.941   1.00 0.00 ? 2  CYS A SG   1 
ATOM 26   H H    . CYS A 1 2  ? -2.612  0.302   5.990   1.00 0.00 ? 2  CYS A H    1 
ATOM 27   H HA   . CYS A 1 2  ? -1.058  -1.590  7.706   1.00 0.00 ? 2  CYS A HA   1 
ATOM 28   H HB2  . CYS A 1 2  ? -1.901  -2.109  5.230   1.00 0.00 ? 2  CYS A HB2  1 
ATOM 29   H HB3  . CYS A 1 2  ? -0.442  -1.217  4.802   1.00 0.00 ? 2  CYS A HB3  1 
ATOM 30   N N    . MET A 1 3  ? 1.295   -0.428  6.937   1.00 0.00 ? 3  MET A N    1 
ATOM 31   C CA   . MET A 1 3  ? 2.458   0.497   7.016   1.00 0.00 ? 3  MET A CA   1 
ATOM 32   C C    . MET A 1 3  ? 2.249   1.661   6.040   1.00 0.00 ? 3  MET A C    1 
ATOM 33   O O    . MET A 1 3  ? 1.533   1.534   5.066   1.00 0.00 ? 3  MET A O    1 
ATOM 34   C CB   . MET A 1 3  ? 3.745   -0.268  6.666   1.00 0.00 ? 3  MET A CB   1 
ATOM 35   C CG   . MET A 1 3  ? 3.928   -0.328  5.146   1.00 0.00 ? 3  MET A CG   1 
ATOM 36   S SD   . MET A 1 3  ? 5.416   -1.279  4.753   1.00 0.00 ? 3  MET A SD   1 
ATOM 37   C CE   . MET A 1 3  ? 6.148   -0.083  3.611   1.00 0.00 ? 3  MET A CE   1 
ATOM 38   H H    . MET A 1 3  ? 1.441   -1.396  6.900   1.00 0.00 ? 3  MET A H    1 
ATOM 39   H HA   . MET A 1 3  ? 2.536   0.886   8.021   1.00 0.00 ? 3  MET A HA   1 
ATOM 40   H HB2  . MET A 1 3  ? 4.592   0.231   7.110   1.00 0.00 ? 3  MET A HB2  1 
ATOM 41   H HB3  . MET A 1 3  ? 3.680   -1.273  7.056   1.00 0.00 ? 3  MET A HB3  1 
ATOM 42   H HG2  . MET A 1 3  ? 3.068   -0.802  4.699   1.00 0.00 ? 3  MET A HG2  1 
ATOM 43   H HG3  . MET A 1 3  ? 4.029   0.675   4.757   1.00 0.00 ? 3  MET A HG3  1 
ATOM 44   H HE1  . MET A 1 3  ? 5.378   0.585   3.248   1.00 0.00 ? 3  MET A HE1  1 
ATOM 45   H HE2  . MET A 1 3  ? 6.905   0.490   4.123   1.00 0.00 ? 3  MET A HE2  1 
ATOM 46   H HE3  . MET A 1 3  ? 6.597   -0.608  2.779   1.00 0.00 ? 3  MET A HE3  1 
ATOM 47   N N    . PRO A 1 4  ? 2.887   2.758   6.339   1.00 0.00 ? 4  PRO A N    1 
ATOM 48   C CA   . PRO A 1 4  ? 2.747   3.936   5.458   1.00 0.00 ? 4  PRO A CA   1 
ATOM 49   C C    . PRO A 1 4  ? 3.174   3.583   4.031   1.00 0.00 ? 4  PRO A C    1 
ATOM 50   O O    . PRO A 1 4  ? 3.263   2.427   3.667   1.00 0.00 ? 4  PRO A O    1 
ATOM 51   C CB   . PRO A 1 4  ? 3.692   4.976   6.062   1.00 0.00 ? 4  PRO A CB   1 
ATOM 52   C CG   . PRO A 1 4  ? 4.732   4.190   6.884   1.00 0.00 ? 4  PRO A CG   1 
ATOM 53   C CD   . PRO A 1 4  ? 4.123   2.804   7.153   1.00 0.00 ? 4  PRO A CD   1 
ATOM 54   H HA   . PRO A 1 4  ? 1.734   4.304   5.472   1.00 0.00 ? 4  PRO A HA   1 
ATOM 55   H HB2  . PRO A 1 4  ? 4.181   5.534   5.274   1.00 0.00 ? 4  PRO A HB2  1 
ATOM 56   H HB3  . PRO A 1 4  ? 3.145   5.644   6.709   1.00 0.00 ? 4  PRO A HB3  1 
ATOM 57   H HG2  . PRO A 1 4  ? 5.651   4.092   6.322   1.00 0.00 ? 4  PRO A HG2  1 
ATOM 58   H HG3  . PRO A 1 4  ? 4.921   4.691   7.820   1.00 0.00 ? 4  PRO A HG3  1 
ATOM 59   H HD2  . PRO A 1 4  ? 4.810   2.031   6.839   1.00 0.00 ? 4  PRO A HD2  1 
ATOM 60   H HD3  . PRO A 1 4  ? 3.883   2.694   8.198   1.00 0.00 ? 4  PRO A HD3  1 
ATOM 61   N N    . CYS A 1 5  ? 3.442   4.571   3.221   1.00 0.00 ? 5  CYS A N    1 
ATOM 62   C CA   . CYS A 1 5  ? 3.864   4.296   1.826   1.00 0.00 ? 5  CYS A CA   1 
ATOM 63   C C    . CYS A 1 5  ? 5.068   5.171   1.472   1.00 0.00 ? 5  CYS A C    1 
ATOM 64   O O    . CYS A 1 5  ? 4.967   6.097   0.692   1.00 0.00 ? 5  CYS A O    1 
ATOM 65   C CB   . CYS A 1 5  ? 2.709   4.600   0.871   1.00 0.00 ? 5  CYS A CB   1 
ATOM 66   S SG   . CYS A 1 5  ? 1.877   3.055   0.427   1.00 0.00 ? 5  CYS A SG   1 
ATOM 67   H H    . CYS A 1 5  ? 3.368   5.489   3.532   1.00 0.00 ? 5  CYS A H    1 
ATOM 68   H HA   . CYS A 1 5  ? 4.137   3.262   1.742   1.00 0.00 ? 5  CYS A HA   1 
ATOM 69   H HB2  . CYS A 1 5  ? 2.007   5.263   1.353   1.00 0.00 ? 5  CYS A HB2  1 
ATOM 70   H HB3  . CYS A 1 5  ? 3.094   5.070   -0.022  1.00 0.00 ? 5  CYS A HB3  1 
ATOM 71   N N    . PHE A 1 6  ? 6.207   4.881   2.038   1.00 0.00 ? 6  PHE A N    1 
ATOM 72   C CA   . PHE A 1 6  ? 7.419   5.692   1.734   1.00 0.00 ? 6  PHE A CA   1 
ATOM 73   C C    . PHE A 1 6  ? 8.662   4.814   1.879   1.00 0.00 ? 6  PHE A C    1 
ATOM 74   O O    . PHE A 1 6  ? 9.675   5.235   2.400   1.00 0.00 ? 6  PHE A O    1 
ATOM 75   C CB   . PHE A 1 6  ? 7.508   6.866   2.711   1.00 0.00 ? 6  PHE A CB   1 
ATOM 76   C CG   . PHE A 1 6  ? 6.642   7.999   2.216   1.00 0.00 ? 6  PHE A CG   1 
ATOM 77   C CD1  . PHE A 1 6  ? 5.267   7.999   2.486   1.00 0.00 ? 6  PHE A CD1  1 
ATOM 78   C CD2  . PHE A 1 6  ? 7.212   9.049   1.485   1.00 0.00 ? 6  PHE A CD2  1 
ATOM 79   C CE1  . PHE A 1 6  ? 4.464   9.048   2.025   1.00 0.00 ? 6  PHE A CE1  1 
ATOM 80   C CE2  . PHE A 1 6  ? 6.408   10.098  1.025   1.00 0.00 ? 6  PHE A CE2  1 
ATOM 81   C CZ   . PHE A 1 6  ? 5.034   10.098  1.295   1.00 0.00 ? 6  PHE A CZ   1 
ATOM 82   H H    . PHE A 1 6  ? 6.265   4.128   2.662   1.00 0.00 ? 6  PHE A H    1 
ATOM 83   H HA   . PHE A 1 6  ? 7.357   6.067   0.723   1.00 0.00 ? 6  PHE A HA   1 
ATOM 84   H HB2  . PHE A 1 6  ? 7.166   6.549   3.686   1.00 0.00 ? 6  PHE A HB2  1 
ATOM 85   H HB3  . PHE A 1 6  ? 8.532   7.200   2.780   1.00 0.00 ? 6  PHE A HB3  1 
ATOM 86   H HD1  . PHE A 1 6  ? 4.827   7.189   3.049   1.00 0.00 ? 6  PHE A HD1  1 
ATOM 87   H HD2  . PHE A 1 6  ? 8.273   9.049   1.277   1.00 0.00 ? 6  PHE A HD2  1 
ATOM 88   H HE1  . PHE A 1 6  ? 3.404   9.049   2.234   1.00 0.00 ? 6  PHE A HE1  1 
ATOM 89   H HE2  . PHE A 1 6  ? 6.847   10.908  0.461   1.00 0.00 ? 6  PHE A HE2  1 
ATOM 90   H HZ   . PHE A 1 6  ? 4.414   10.907  0.940   1.00 0.00 ? 6  PHE A HZ   1 
ATOM 91   N N    . THR A 1 7  ? 8.591   3.593   1.424   1.00 0.00 ? 7  THR A N    1 
ATOM 92   C CA   . THR A 1 7  ? 9.767   2.687   1.538   1.00 0.00 ? 7  THR A CA   1 
ATOM 93   C C    . THR A 1 7  ? 10.080  2.081   0.169   1.00 0.00 ? 7  THR A C    1 
ATOM 94   O O    . THR A 1 7  ? 9.200   1.861   -0.639  1.00 0.00 ? 7  THR A O    1 
ATOM 95   C CB   . THR A 1 7  ? 9.450   1.567   2.533   1.00 0.00 ? 7  THR A CB   1 
ATOM 96   O OG1  . THR A 1 7  ? 8.313   1.931   3.304   1.00 0.00 ? 7  THR A OG1  1 
ATOM 97   C CG2  . THR A 1 7  ? 10.648  1.349   3.459   1.00 0.00 ? 7  THR A CG2  1 
ATOM 98   H H    . THR A 1 7  ? 7.764   3.271   1.008   1.00 0.00 ? 7  THR A H    1 
ATOM 99   H HA   . THR A 1 7  ? 10.621  3.247   1.887   1.00 0.00 ? 7  THR A HA   1 
ATOM 100  H HB   . THR A 1 7  ? 9.244   0.655   1.996   1.00 0.00 ? 7  THR A HB   1 
ATOM 101  H HG1  . THR A 1 7  ? 8.562   2.665   3.871   1.00 0.00 ? 7  THR A HG1  1 
ATOM 102  H HG21 . THR A 1 7  ? 11.543  1.720   2.982   1.00 0.00 ? 7  THR A HG21 1 
ATOM 103  H HG22 . THR A 1 7  ? 10.488  1.878   4.386   1.00 0.00 ? 7  THR A HG22 1 
ATOM 104  H HG23 . THR A 1 7  ? 10.760  0.294   3.661   1.00 0.00 ? 7  THR A HG23 1 
ATOM 105  N N    . THR A 1 8  ? 11.327  1.808   -0.096  1.00 0.00 ? 8  THR A N    1 
ATOM 106  C CA   . THR A 1 8  ? 11.698  1.215   -1.411  1.00 0.00 ? 8  THR A CA   1 
ATOM 107  C C    . THR A 1 8  ? 11.068  2.030   -2.541  1.00 0.00 ? 8  THR A C    1 
ATOM 108  O O    . THR A 1 8  ? 10.678  3.167   -2.361  1.00 0.00 ? 8  THR A O    1 
ATOM 109  C CB   . THR A 1 8  ? 11.187  -0.225  -1.482  1.00 0.00 ? 8  THR A CB   1 
ATOM 110  O OG1  . THR A 1 8  ? 9.789   -0.216  -1.736  1.00 0.00 ? 8  THR A OG1  1 
ATOM 111  C CG2  . THR A 1 8  ? 11.463  -0.931  -0.154  1.00 0.00 ? 8  THR A CG2  1 
ATOM 112  H H    . THR A 1 8  ? 12.022  1.992   0.571   1.00 0.00 ? 8  THR A H    1 
ATOM 113  H HA   . THR A 1 8  ? 12.772  1.221   -1.520  1.00 0.00 ? 8  THR A HA   1 
ATOM 114  H HB   . THR A 1 8  ? 11.695  -0.749  -2.277  1.00 0.00 ? 8  THR A HB   1 
ATOM 115  H HG1  . THR A 1 8  ? 9.660   -0.208  -2.687  1.00 0.00 ? 8  THR A HG1  1 
ATOM 116  H HG21 . THR A 1 8  ? 12.507  -0.825  0.099   1.00 0.00 ? 8  THR A HG21 1 
ATOM 117  H HG22 . THR A 1 8  ? 10.857  -0.487  0.622   1.00 0.00 ? 8  THR A HG22 1 
ATOM 118  H HG23 . THR A 1 8  ? 11.219  -1.979  -0.246  1.00 0.00 ? 8  THR A HG23 1 
ATOM 119  N N    . ASP A 1 9  ? 10.966  1.454   -3.707  1.00 0.00 ? 9  ASP A N    1 
ATOM 120  C CA   . ASP A 1 9  ? 10.364  2.187   -4.855  1.00 0.00 ? 9  ASP A CA   1 
ATOM 121  C C    . ASP A 1 9  ? 9.844   1.179   -5.879  1.00 0.00 ? 9  ASP A C    1 
ATOM 122  O O    . ASP A 1 9  ? 8.756   1.312   -6.403  1.00 0.00 ? 9  ASP A O    1 
ATOM 123  C CB   . ASP A 1 9  ? 11.426  3.074   -5.508  1.00 0.00 ? 9  ASP A CB   1 
ATOM 124  C CG   . ASP A 1 9  ? 11.245  4.519   -5.040  1.00 0.00 ? 9  ASP A CG   1 
ATOM 125  O OD1  . ASP A 1 9  ? 11.781  4.855   -3.997  1.00 0.00 ? 9  ASP A OD1  1 
ATOM 126  O OD2  . ASP A 1 9  ? 10.573  5.266   -5.733  1.00 0.00 ? 9  ASP A OD2  1 
ATOM 127  H H    . ASP A 1 9  ? 11.287  0.536   -3.827  1.00 0.00 ? 9  ASP A H    1 
ATOM 128  H HA   . ASP A 1 9  ? 9.548   2.797   -4.505  1.00 0.00 ? 9  ASP A HA   1 
ATOM 129  H HB2  . ASP A 1 9  ? 12.409  2.724   -5.227  1.00 0.00 ? 9  ASP A HB2  1 
ATOM 130  H HB3  . ASP A 1 9  ? 11.321  3.029   -6.581  1.00 0.00 ? 9  ASP A HB3  1 
ATOM 131  N N    . HIS A 1 10 ? 10.617  0.172   -6.167  1.00 0.00 ? 10 HIS A N    1 
ATOM 132  C CA   . HIS A 1 10 ? 10.176  -0.850  -7.158  1.00 0.00 ? 10 HIS A CA   1 
ATOM 133  C C    . HIS A 1 10 ? 9.398   -1.956  -6.441  1.00 0.00 ? 10 HIS A C    1 
ATOM 134  O O    . HIS A 1 10 ? 8.997   -2.933  -7.041  1.00 0.00 ? 10 HIS A O    1 
ATOM 135  C CB   . HIS A 1 10 ? 11.403  -1.451  -7.847  1.00 0.00 ? 10 HIS A CB   1 
ATOM 136  C CG   . HIS A 1 10 ? 12.340  -0.344  -8.245  1.00 0.00 ? 10 HIS A CG   1 
ATOM 137  N ND1  . HIS A 1 10 ? 13.678  -0.571  -8.526  1.00 0.00 ? 10 HIS A ND1  1 
ATOM 138  C CD2  . HIS A 1 10 ? 12.145  1.005   -8.413  1.00 0.00 ? 10 HIS A CD2  1 
ATOM 139  C CE1  . HIS A 1 10 ? 14.232  0.613   -8.846  1.00 0.00 ? 10 HIS A CE1  1 
ATOM 140  N NE2  . HIS A 1 10 ? 13.341  1.607   -8.793  1.00 0.00 ? 10 HIS A NE2  1 
ATOM 141  H H    . HIS A 1 10 ? 11.490  0.088   -5.731  1.00 0.00 ? 10 HIS A H    1 
ATOM 142  H HA   . HIS A 1 10 ? 9.540   -0.385  -7.897  1.00 0.00 ? 10 HIS A HA   1 
ATOM 143  H HB2  . HIS A 1 10 ? 11.905  -2.124  -7.168  1.00 0.00 ? 10 HIS A HB2  1 
ATOM 144  H HB3  . HIS A 1 10 ? 11.092  -1.993  -8.728  1.00 0.00 ? 10 HIS A HB3  1 
ATOM 145  H HD1  . HIS A 1 10 ? 14.137  -1.436  -8.498  1.00 0.00 ? 10 HIS A HD1  1 
ATOM 146  H HD2  . HIS A 1 10 ? 11.207  1.520   -8.271  1.00 0.00 ? 10 HIS A HD2  1 
ATOM 147  H HE1  . HIS A 1 10 ? 15.269  0.744   -9.114  1.00 0.00 ? 10 HIS A HE1  1 
ATOM 148  N N    . GLN A 1 11 ? 9.179   -1.810  -5.162  1.00 0.00 ? 11 GLN A N    1 
ATOM 149  C CA   . GLN A 1 11 ? 8.425   -2.853  -4.412  1.00 0.00 ? 11 GLN A CA   1 
ATOM 150  C C    . GLN A 1 11 ? 7.770   -2.226  -3.177  1.00 0.00 ? 11 GLN A C    1 
ATOM 151  O O    . GLN A 1 11 ? 8.007   -2.639  -2.059  1.00 0.00 ? 11 GLN A O    1 
ATOM 152  C CB   . GLN A 1 11 ? 9.385   -3.963  -3.975  1.00 0.00 ? 11 GLN A CB   1 
ATOM 153  C CG   . GLN A 1 11 ? 9.780   -4.807  -5.190  1.00 0.00 ? 11 GLN A CG   1 
ATOM 154  C CD   . GLN A 1 11 ? 10.295  -6.169  -4.721  1.00 0.00 ? 11 GLN A CD   1 
ATOM 155  O OE1  . GLN A 1 11 ? 10.261  -6.472  -3.544  1.00 0.00 ? 11 GLN A OE1  1 
ATOM 156  N NE2  . GLN A 1 11 ? 10.775  -7.009  -5.597  1.00 0.00 ? 11 GLN A NE2  1 
ATOM 157  H H    . GLN A 1 11 ? 9.509   -1.013  -4.695  1.00 0.00 ? 11 GLN A H    1 
ATOM 158  H HA   . GLN A 1 11 ? 7.660   -3.271  -5.050  1.00 0.00 ? 11 GLN A HA   1 
ATOM 159  H HB2  . GLN A 1 11 ? 10.269  -3.523  -3.538  1.00 0.00 ? 11 GLN A HB2  1 
ATOM 160  H HB3  . GLN A 1 11 ? 8.898   -4.593  -3.245  1.00 0.00 ? 11 GLN A HB3  1 
ATOM 161  H HG2  . GLN A 1 11 ? 8.917   -4.947  -5.826  1.00 0.00 ? 11 GLN A HG2  1 
ATOM 162  H HG3  . GLN A 1 11 ? 10.557  -4.301  -5.742  1.00 0.00 ? 11 GLN A HG3  1 
ATOM 163  H HE21 . GLN A 1 11 ? 10.803  -6.766  -6.545  1.00 0.00 ? 11 GLN A HE21 1 
ATOM 164  H HE22 . GLN A 1 11 ? 11.108  -7.884  -5.305  1.00 0.00 ? 11 GLN A HE22 1 
ATOM 165  N N    . MET A 1 12 ? 6.944   -1.233  -3.372  1.00 0.00 ? 12 MET A N    1 
ATOM 166  C CA   . MET A 1 12 ? 6.270   -0.581  -2.212  1.00 0.00 ? 12 MET A CA   1 
ATOM 167  C C    . MET A 1 12 ? 4.778   -0.907  -2.250  1.00 0.00 ? 12 MET A C    1 
ATOM 168  O O    . MET A 1 12 ? 4.212   -1.400  -1.294  1.00 0.00 ? 12 MET A O    1 
ATOM 169  C CB   . MET A 1 12 ? 6.451   0.935   -2.301  1.00 0.00 ? 12 MET A CB   1 
ATOM 170  C CG   . MET A 1 12 ? 6.481   1.531   -0.892  1.00 0.00 ? 12 MET A CG   1 
ATOM 171  S SD   . MET A 1 12 ? 4.790   1.878   -0.346  1.00 0.00 ? 12 MET A SD   1 
ATOM 172  C CE   . MET A 1 12 ? 4.698   0.602   0.934   1.00 0.00 ? 12 MET A CE   1 
ATOM 173  H H    . MET A 1 12 ? 6.764   -0.918  -4.282  1.00 0.00 ? 12 MET A H    1 
ATOM 174  H HA   . MET A 1 12 ? 6.699   -0.945  -1.290  1.00 0.00 ? 12 MET A HA   1 
ATOM 175  H HB2  . MET A 1 12 ? 7.376   1.156   -2.809  1.00 0.00 ? 12 MET A HB2  1 
ATOM 176  H HB3  . MET A 1 12 ? 5.627   1.363   -2.851  1.00 0.00 ? 12 MET A HB3  1 
ATOM 177  H HG2  . MET A 1 12 ? 6.941   0.827   -0.214  1.00 0.00 ? 12 MET A HG2  1 
ATOM 178  H HG3  . MET A 1 12 ? 7.052   2.448   -0.901  1.00 0.00 ? 12 MET A HG3  1 
ATOM 179  H HE1  . MET A 1 12 ? 5.699   0.308   1.221   1.00 0.00 ? 12 MET A HE1  1 
ATOM 180  H HE2  . MET A 1 12 ? 4.179   0.989   1.795   1.00 0.00 ? 12 MET A HE2  1 
ATOM 181  H HE3  . MET A 1 12 ? 4.163   -0.255  0.548   1.00 0.00 ? 12 MET A HE3  1 
ATOM 182  N N    . ALA A 1 13 ? 4.139   -0.634  -3.353  1.00 0.00 ? 13 ALA A N    1 
ATOM 183  C CA   . ALA A 1 13 ? 2.681   -0.923  -3.465  1.00 0.00 ? 13 ALA A CA   1 
ATOM 184  C C    . ALA A 1 13 ? 2.472   -2.410  -3.767  1.00 0.00 ? 13 ALA A C    1 
ATOM 185  O O    . ALA A 1 13 ? 1.370   -2.849  -4.031  1.00 0.00 ? 13 ALA A O    1 
ATOM 186  C CB   . ALA A 1 13 ? 2.081   -0.084  -4.596  1.00 0.00 ? 13 ALA A CB   1 
ATOM 187  H H    . ALA A 1 13 ? 4.619   -0.235  -4.109  1.00 0.00 ? 13 ALA A H    1 
ATOM 188  H HA   . ALA A 1 13 ? 2.192   -0.673  -2.535  1.00 0.00 ? 13 ALA A HA   1 
ATOM 189  H HB1  . ALA A 1 13 ? 2.442   0.931   -4.522  1.00 0.00 ? 13 ALA A HB1  1 
ATOM 190  H HB2  . ALA A 1 13 ? 2.374   -0.501  -5.549  1.00 0.00 ? 13 ALA A HB2  1 
ATOM 191  H HB3  . ALA A 1 13 ? 1.004   -0.090  -4.516  1.00 0.00 ? 13 ALA A HB3  1 
ATOM 192  N N    . ARG A 1 14 ? 3.518   -3.188  -3.732  1.00 0.00 ? 14 ARG A N    1 
ATOM 193  C CA   . ARG A 1 14 ? 3.373   -4.643  -4.017  1.00 0.00 ? 14 ARG A CA   1 
ATOM 194  C C    . ARG A 1 14 ? 2.846   -5.360  -2.771  1.00 0.00 ? 14 ARG A C    1 
ATOM 195  O O    . ARG A 1 14 ? 2.440   -6.503  -2.829  1.00 0.00 ? 14 ARG A O    1 
ATOM 196  C CB   . ARG A 1 14 ? 4.735   -5.224  -4.405  1.00 0.00 ? 14 ARG A CB   1 
ATOM 197  C CG   . ARG A 1 14 ? 4.761   -5.507  -5.909  1.00 0.00 ? 14 ARG A CG   1 
ATOM 198  C CD   . ARG A 1 14 ? 4.840   -4.187  -6.679  1.00 0.00 ? 14 ARG A CD   1 
ATOM 199  N NE   . ARG A 1 14 ? 6.257   -3.912  -7.049  1.00 0.00 ? 14 ARG A NE   1 
ATOM 200  C CZ   . ARG A 1 14 ? 6.527   -3.157  -8.079  1.00 0.00 ? 14 ARG A CZ   1 
ATOM 201  N NH1  . ARG A 1 14 ? 6.415   -3.636  -9.287  1.00 0.00 ? 14 ARG A NH1  1 
ATOM 202  N NH2  . ARG A 1 14 ? 6.908   -1.921  -7.901  1.00 0.00 ? 14 ARG A NH2  1 
ATOM 203  H H    . ARG A 1 14 ? 4.399   -2.818  -3.518  1.00 0.00 ? 14 ARG A H    1 
ATOM 204  H HA   . ARG A 1 14 ? 2.678   -4.781  -4.832  1.00 0.00 ? 14 ARG A HA   1 
ATOM 205  H HB2  . ARG A 1 14 ? 5.512   -4.515  -4.158  1.00 0.00 ? 14 ARG A HB2  1 
ATOM 206  H HB3  . ARG A 1 14 ? 4.902   -6.144  -3.865  1.00 0.00 ? 14 ARG A HB3  1 
ATOM 207  H HG2  . ARG A 1 14 ? 5.622   -6.115  -6.146  1.00 0.00 ? 14 ARG A HG2  1 
ATOM 208  H HG3  . ARG A 1 14 ? 3.861   -6.032  -6.193  1.00 0.00 ? 14 ARG A HG3  1 
ATOM 209  H HD2  . ARG A 1 14 ? 4.242   -4.256  -7.575  1.00 0.00 ? 14 ARG A HD2  1 
ATOM 210  H HD3  . ARG A 1 14 ? 4.467   -3.386  -6.058  1.00 0.00 ? 14 ARG A HD3  1 
ATOM 211  H HE   . ARG A 1 14 ? 6.985   -4.297  -6.518  1.00 0.00 ? 14 ARG A HE   1 
ATOM 212  H HH11 . ARG A 1 14 ? 6.122   -4.582  -9.425  1.00 0.00 ? 14 ARG A HH11 1 
ATOM 213  H HH12 . ARG A 1 14 ? 6.625   -3.059  -10.076 1.00 0.00 ? 14 ARG A HH12 1 
ATOM 214  H HH21 . ARG A 1 14 ? 6.993   -1.552  -6.976  1.00 0.00 ? 14 ARG A HH21 1 
ATOM 215  H HH22 . ARG A 1 14 ? 7.116   -1.344  -8.691  1.00 0.00 ? 14 ARG A HH22 1 
ATOM 216  N N    . LYS A 1 15 ? 2.851   -4.702  -1.643  1.00 0.00 ? 15 LYS A N    1 
ATOM 217  C CA   . LYS A 1 15 ? 2.352   -5.359  -0.399  1.00 0.00 ? 15 LYS A CA   1 
ATOM 218  C C    . LYS A 1 15 ? 1.326   -4.461  0.299   1.00 0.00 ? 15 LYS A C    1 
ATOM 219  O O    . LYS A 1 15 ? 0.625   -4.893  1.192   1.00 0.00 ? 15 LYS A O    1 
ATOM 220  C CB   . LYS A 1 15 ? 3.516   -5.636  0.564   1.00 0.00 ? 15 LYS A CB   1 
ATOM 221  C CG   . LYS A 1 15 ? 4.775   -4.884  0.118   1.00 0.00 ? 15 LYS A CG   1 
ATOM 222  C CD   . LYS A 1 15 ? 5.667   -4.622  1.332   1.00 0.00 ? 15 LYS A CD   1 
ATOM 223  C CE   . LYS A 1 15 ? 6.025   -5.949  2.004   1.00 0.00 ? 15 LYS A CE   1 
ATOM 224  N NZ   . LYS A 1 15 ? 5.401   -6.005  3.357   1.00 0.00 ? 15 LYS A NZ   1 
ATOM 225  H H    . LYS A 1 15 ? 3.186   -3.782  -1.612  1.00 0.00 ? 15 LYS A H    1 
ATOM 226  H HA   . LYS A 1 15 ? 1.878   -6.293  -0.661  1.00 0.00 ? 15 LYS A HA   1 
ATOM 227  H HB2  . LYS A 1 15 ? 3.241   -5.310  1.555   1.00 0.00 ? 15 LYS A HB2  1 
ATOM 228  H HB3  . LYS A 1 15 ? 3.722   -6.696  0.580   1.00 0.00 ? 15 LYS A HB3  1 
ATOM 229  H HG2  . LYS A 1 15 ? 5.314   -5.479  -0.606  1.00 0.00 ? 15 LYS A HG2  1 
ATOM 230  H HG3  . LYS A 1 15 ? 4.494   -3.942  -0.327  1.00 0.00 ? 15 LYS A HG3  1 
ATOM 231  H HD2  . LYS A 1 15 ? 6.571   -4.123  1.013   1.00 0.00 ? 15 LYS A HD2  1 
ATOM 232  H HD3  . LYS A 1 15 ? 5.140   -3.995  2.036   1.00 0.00 ? 15 LYS A HD3  1 
ATOM 233  H HE2  . LYS A 1 15 ? 5.657   -6.768  1.403   1.00 0.00 ? 15 LYS A HE2  1 
ATOM 234  H HE3  . LYS A 1 15 ? 7.098   -6.027  2.099   1.00 0.00 ? 15 LYS A HE3  1 
ATOM 235  H HZ1  . LYS A 1 15 ? 4.596   -5.347  3.395   1.00 0.00 ? 15 LYS A HZ1  1 
ATOM 236  H HZ2  . LYS A 1 15 ? 5.068   -6.972  3.546   1.00 0.00 ? 15 LYS A HZ2  1 
ATOM 237  H HZ3  . LYS A 1 15 ? 6.104   -5.737  4.074   1.00 0.00 ? 15 LYS A HZ3  1 
ATOM 238  N N    . CYS A 1 16 ? 1.225   -3.221  -0.094  1.00 0.00 ? 16 CYS A N    1 
ATOM 239  C CA   . CYS A 1 16 ? 0.235   -2.317  0.558   1.00 0.00 ? 16 CYS A CA   1 
ATOM 240  C C    . CYS A 1 16 ? -1.177  -2.762  0.174   1.00 0.00 ? 16 CYS A C    1 
ATOM 241  O O    . CYS A 1 16 ? -1.962  -3.161  1.010   1.00 0.00 ? 16 CYS A O    1 
ATOM 242  C CB   . CYS A 1 16 ? 0.465   -0.879  0.087   1.00 0.00 ? 16 CYS A CB   1 
ATOM 243  S SG   . CYS A 1 16 ? 0.776   0.183   1.520   1.00 0.00 ? 16 CYS A SG   1 
ATOM 244  H H    . CYS A 1 16 ? 1.795   -2.885  -0.816  1.00 0.00 ? 16 CYS A H    1 
ATOM 245  H HA   . CYS A 1 16 ? 0.349   -2.369  1.631   1.00 0.00 ? 16 CYS A HA   1 
ATOM 246  H HB2  . CYS A 1 16 ? 1.319   -0.849  -0.575  1.00 0.00 ? 16 CYS A HB2  1 
ATOM 247  H HB3  . CYS A 1 16 ? -0.410  -0.526  -0.439  1.00 0.00 ? 16 CYS A HB3  1 
ATOM 248  N N    . ASP A 1 17 ? -1.502  -2.700  -1.087  1.00 0.00 ? 17 ASP A N    1 
ATOM 249  C CA   . ASP A 1 17 ? -2.860  -3.123  -1.530  1.00 0.00 ? 17 ASP A CA   1 
ATOM 250  C C    . ASP A 1 17 ? -3.180  -4.497  -0.942  1.00 0.00 ? 17 ASP A C    1 
ATOM 251  O O    . ASP A 1 17 ? -4.254  -4.727  -0.426  1.00 0.00 ? 17 ASP A O    1 
ATOM 252  C CB   . ASP A 1 17 ? -2.882  -3.222  -3.056  1.00 0.00 ? 17 ASP A CB   1 
ATOM 253  C CG   . ASP A 1 17 ? -4.326  -3.155  -3.556  1.00 0.00 ? 17 ASP A CG   1 
ATOM 254  O OD1  . ASP A 1 17 ? -5.180  -3.758  -2.927  1.00 0.00 ? 17 ASP A OD1  1 
ATOM 255  O OD2  . ASP A 1 17 ? -4.554  -2.501  -4.560  1.00 0.00 ? 17 ASP A OD2  1 
ATOM 256  H H    . ASP A 1 17 ? -0.851  -2.378  -1.745  1.00 0.00 ? 17 ASP A H    1 
ATOM 257  H HA   . ASP A 1 17 ? -3.595  -2.398  -1.201  1.00 0.00 ? 17 ASP A HA   1 
ATOM 258  H HB2  . ASP A 1 17 ? -2.312  -2.409  -3.475  1.00 0.00 ? 17 ASP A HB2  1 
ATOM 259  H HB3  . ASP A 1 17 ? -2.443  -4.161  -3.359  1.00 0.00 ? 17 ASP A HB3  1 
ATOM 260  N N    . ASP A 1 18 ? -2.256  -5.415  -1.030  1.00 0.00 ? 18 ASP A N    1 
ATOM 261  C CA   . ASP A 1 18 ? -2.505  -6.783  -0.490  1.00 0.00 ? 18 ASP A CA   1 
ATOM 262  C C    . ASP A 1 18 ? -2.771  -6.712  1.016   1.00 0.00 ? 18 ASP A C    1 
ATOM 263  O O    . ASP A 1 18 ? -3.593  -7.435  1.543   1.00 0.00 ? 18 ASP A O    1 
ATOM 264  C CB   . ASP A 1 18 ? -1.282  -7.663  -0.750  1.00 0.00 ? 18 ASP A CB   1 
ATOM 265  C CG   . ASP A 1 18 ? -1.260  -8.079  -2.222  1.00 0.00 ? 18 ASP A CG   1 
ATOM 266  O OD1  . ASP A 1 18 ? -2.321  -8.110  -2.823  1.00 0.00 ? 18 ASP A OD1  1 
ATOM 267  O OD2  . ASP A 1 18 ? -0.183  -8.358  -2.723  1.00 0.00 ? 18 ASP A OD2  1 
ATOM 268  H H    . ASP A 1 18 ? -1.399  -5.206  -1.462  1.00 0.00 ? 18 ASP A H    1 
ATOM 269  H HA   . ASP A 1 18 ? -3.365  -7.211  -0.984  1.00 0.00 ? 18 ASP A HA   1 
ATOM 270  H HB2  . ASP A 1 18 ? -0.383  -7.110  -0.517  1.00 0.00 ? 18 ASP A HB2  1 
ATOM 271  H HB3  . ASP A 1 18 ? -1.334  -8.545  -0.130  1.00 0.00 ? 18 ASP A HB3  1 
ATOM 272  N N    . CYS A 1 19 ? -2.085  -5.850  1.715   1.00 0.00 ? 19 CYS A N    1 
ATOM 273  C CA   . CYS A 1 19 ? -2.307  -5.746  3.185   1.00 0.00 ? 19 CYS A CA   1 
ATOM 274  C C    . CYS A 1 19 ? -3.801  -5.589  3.458   1.00 0.00 ? 19 CYS A C    1 
ATOM 275  O O    . CYS A 1 19 ? -4.343  -6.177  4.373   1.00 0.00 ? 19 CYS A O    1 
ATOM 276  C CB   . CYS A 1 19 ? -1.564  -4.525  3.732   1.00 0.00 ? 19 CYS A CB   1 
ATOM 277  S SG   . CYS A 1 19 ? -1.117  -4.819  5.462   1.00 0.00 ? 19 CYS A SG   1 
ATOM 278  H H    . CYS A 1 19 ? -1.427  -5.274  1.276   1.00 0.00 ? 19 CYS A H    1 
ATOM 279  H HA   . CYS A 1 19 ? -1.943  -6.639  3.671   1.00 0.00 ? 19 CYS A HA   1 
ATOM 280  H HB2  . CYS A 1 19 ? -0.672  -4.357  3.151   1.00 0.00 ? 19 CYS A HB2  1 
ATOM 281  H HB3  . CYS A 1 19 ? -2.203  -3.657  3.668   1.00 0.00 ? 19 CYS A HB3  1 
ATOM 282  N N    . CYS A 1 20 ? -4.467  -4.792  2.673   1.00 0.00 ? 20 CYS A N    1 
ATOM 283  C CA   . CYS A 1 20 ? -5.926  -4.584  2.885   1.00 0.00 ? 20 CYS A CA   1 
ATOM 284  C C    . CYS A 1 20 ? -6.717  -5.746  2.279   1.00 0.00 ? 20 CYS A C    1 
ATOM 285  O O    . CYS A 1 20 ? -7.740  -6.146  2.797   1.00 0.00 ? 20 CYS A O    1 
ATOM 286  C CB   . CYS A 1 20 ? -6.350  -3.274  2.222   1.00 0.00 ? 20 CYS A CB   1 
ATOM 287  S SG   . CYS A 1 20 ? -6.198  -1.924  3.418   1.00 0.00 ? 20 CYS A SG   1 
ATOM 288  H H    . CYS A 1 20 ? -4.003  -4.325  1.946   1.00 0.00 ? 20 CYS A H    1 
ATOM 289  H HA   . CYS A 1 20 ? -6.129  -4.529  3.945   1.00 0.00 ? 20 CYS A HA   1 
ATOM 290  H HB2  . CYS A 1 20 ? -5.711  -3.077  1.374   1.00 0.00 ? 20 CYS A HB2  1 
ATOM 291  H HB3  . CYS A 1 20 ? -7.375  -3.350  1.892   1.00 0.00 ? 20 CYS A HB3  1 
ATOM 292  N N    . GLY A 1 21 ? -6.257  -6.292  1.188   1.00 0.00 ? 21 GLY A N    1 
ATOM 293  C CA   . GLY A 1 21 ? -6.992  -7.426  0.559   1.00 0.00 ? 21 GLY A CA   1 
ATOM 294  C C    . GLY A 1 21 ? -6.379  -7.742  -0.806  1.00 0.00 ? 21 GLY A C    1 
ATOM 295  O O    . GLY A 1 21 ? -6.027  -8.869  -1.092  1.00 0.00 ? 21 GLY A O    1 
ATOM 296  H H    . GLY A 1 21 ? -5.431  -5.958  0.783   1.00 0.00 ? 21 GLY A H    1 
ATOM 297  H HA2  . GLY A 1 21 ? -6.923  -8.296  1.196   1.00 0.00 ? 21 GLY A HA2  1 
ATOM 298  H HA3  . GLY A 1 21 ? -8.029  -7.156  0.429   1.00 0.00 ? 21 GLY A HA3  1 
ATOM 299  N N    . GLY A 1 22 ? -6.245  -6.757  -1.651  1.00 0.00 ? 22 GLY A N    1 
ATOM 300  C CA   . GLY A 1 22 ? -5.656  -7.000  -2.990  1.00 0.00 ? 22 GLY A CA   1 
ATOM 301  C C    . GLY A 1 22 ? -6.707  -6.744  -4.070  1.00 0.00 ? 22 GLY A C    1 
ATOM 302  O O    . GLY A 1 22 ? -7.875  -6.566  -3.785  1.00 0.00 ? 22 GLY A O    1 
ATOM 303  H H    . GLY A 1 22 ? -6.531  -5.861  -1.404  1.00 0.00 ? 22 GLY A H    1 
ATOM 304  H HA2  . GLY A 1 22 ? -4.813  -6.339  -3.138  1.00 0.00 ? 22 GLY A HA2  1 
ATOM 305  H HA3  . GLY A 1 22 ? -5.328  -8.019  -3.048  1.00 0.00 ? 22 GLY A HA3  1 
ATOM 306  N N    . LYS A 1 23 ? -6.301  -6.724  -5.310  1.00 0.00 ? 23 LYS A N    1 
ATOM 307  C CA   . LYS A 1 23 ? -7.275  -6.480  -6.410  1.00 0.00 ? 23 LYS A CA   1 
ATOM 308  C C    . LYS A 1 23 ? -7.722  -5.017  -6.386  1.00 0.00 ? 23 LYS A C    1 
ATOM 309  O O    . LYS A 1 23 ? -8.818  -4.687  -6.792  1.00 0.00 ? 23 LYS A O    1 
ATOM 310  C CB   . LYS A 1 23 ? -8.492  -7.387  -6.224  1.00 0.00 ? 23 LYS A CB   1 
ATOM 311  C CG   . LYS A 1 23 ? -9.146  -7.650  -7.581  1.00 0.00 ? 23 LYS A CG   1 
ATOM 312  C CD   . LYS A 1 23 ? -9.436  -9.145  -7.727  1.00 0.00 ? 23 LYS A CD   1 
ATOM 313  C CE   . LYS A 1 23 ? -10.078 -9.411  -9.090  1.00 0.00 ? 23 LYS A CE   1 
ATOM 314  N NZ   . LYS A 1 23 ? -10.138 -10.880 -9.330  1.00 0.00 ? 23 LYS A NZ   1 
ATOM 315  H H    . LYS A 1 23 ? -5.354  -6.870  -5.517  1.00 0.00 ? 23 LYS A H    1 
ATOM 316  H HA   . LYS A 1 23 ? -6.807  -6.697  -7.359  1.00 0.00 ? 23 LYS A HA   1 
ATOM 317  H HB2  . LYS A 1 23 ? -8.179  -8.324  -5.786  1.00 0.00 ? 23 LYS A HB2  1 
ATOM 318  H HB3  . LYS A 1 23 ? -9.204  -6.905  -5.571  1.00 0.00 ? 23 LYS A HB3  1 
ATOM 319  H HG2  . LYS A 1 23 ? -10.071 -7.095  -7.648  1.00 0.00 ? 23 LYS A HG2  1 
ATOM 320  H HG3  . LYS A 1 23 ? -8.479  -7.336  -8.370  1.00 0.00 ? 23 LYS A HG3  1 
ATOM 321  H HD2  . LYS A 1 23 ? -8.512  -9.699  -7.648  1.00 0.00 ? 23 LYS A HD2  1 
ATOM 322  H HD3  . LYS A 1 23 ? -10.113 -9.458  -6.946  1.00 0.00 ? 23 LYS A HD3  1 
ATOM 323  H HE2  . LYS A 1 23 ? -11.078 -9.002  -9.103  1.00 0.00 ? 23 LYS A HE2  1 
ATOM 324  H HE3  . LYS A 1 23 ? -9.487  -8.944  -9.864  1.00 0.00 ? 23 LYS A HE3  1 
ATOM 325  H HZ1  . LYS A 1 23 ? -9.985  -11.385 -8.434  1.00 0.00 ? 23 LYS A HZ1  1 
ATOM 326  H HZ2  . LYS A 1 23 ? -11.072 -11.130 -9.714  1.00 0.00 ? 23 LYS A HZ2  1 
ATOM 327  H HZ3  . LYS A 1 23 ? -9.399  -11.151 -10.008 1.00 0.00 ? 23 LYS A HZ3  1 
ATOM 328  N N    . GLY A 1 24 ? -6.882  -4.137  -5.914  1.00 0.00 ? 24 GLY A N    1 
ATOM 329  C CA   . GLY A 1 24 ? -7.262  -2.697  -5.868  1.00 0.00 ? 24 GLY A CA   1 
ATOM 330  C C    . GLY A 1 24 ? -7.964  -2.393  -4.544  1.00 0.00 ? 24 GLY A C    1 
ATOM 331  O O    . GLY A 1 24 ? -8.683  -1.421  -4.424  1.00 0.00 ? 24 GLY A O    1 
ATOM 332  H H    . GLY A 1 24 ? -6.002  -4.423  -5.593  1.00 0.00 ? 24 GLY A H    1 
ATOM 333  H HA2  . GLY A 1 24 ? -6.373  -2.088  -5.954  1.00 0.00 ? 24 GLY A HA2  1 
ATOM 334  H HA3  . GLY A 1 24 ? -7.931  -2.475  -6.685  1.00 0.00 ? 24 GLY A HA3  1 
ATOM 335  N N    . ARG A 1 25 ? -7.763  -3.214  -3.547  1.00 0.00 ? 25 ARG A N    1 
ATOM 336  C CA   . ARG A 1 25 ? -8.423  -2.963  -2.234  1.00 0.00 ? 25 ARG A CA   1 
ATOM 337  C C    . ARG A 1 25 ? -7.403  -2.392  -1.252  1.00 0.00 ? 25 ARG A C    1 
ATOM 338  O O    . ARG A 1 25 ? -7.455  -2.642  -0.066  1.00 0.00 ? 25 ARG A O    1 
ATOM 339  C CB   . ARG A 1 25 ? -8.991  -4.274  -1.684  1.00 0.00 ? 25 ARG A CB   1 
ATOM 340  C CG   . ARG A 1 25 ? -10.213 -4.685  -2.508  1.00 0.00 ? 25 ARG A CG   1 
ATOM 341  C CD   . ARG A 1 25 ? -10.219 -6.205  -2.690  1.00 0.00 ? 25 ARG A CD   1 
ATOM 342  N NE   . ARG A 1 25 ? -11.449 -6.775  -2.071  1.00 0.00 ? 25 ARG A NE   1 
ATOM 343  C CZ   . ARG A 1 25 ? -11.373 -7.857  -1.347  1.00 0.00 ? 25 ARG A CZ   1 
ATOM 344  N NH1  . ARG A 1 25 ? -10.799 -8.926  -1.828  1.00 0.00 ? 25 ARG A NH1  1 
ATOM 345  N NH2  . ARG A 1 25 ? -11.869 -7.870  -0.140  1.00 0.00 ? 25 ARG A NH2  1 
ATOM 346  H H    . ARG A 1 25 ? -7.179  -3.991  -3.662  1.00 0.00 ? 25 ARG A H    1 
ATOM 347  H HA   . ARG A 1 25 ? -9.221  -2.253  -2.368  1.00 0.00 ? 25 ARG A HA   1 
ATOM 348  H HB2  . ARG A 1 25 ? -8.238  -5.046  -1.743  1.00 0.00 ? 25 ARG A HB2  1 
ATOM 349  H HB3  . ARG A 1 25 ? -9.285  -4.135  -0.655  1.00 0.00 ? 25 ARG A HB3  1 
ATOM 350  H HG2  . ARG A 1 25 ? -11.112 -4.379  -1.994  1.00 0.00 ? 25 ARG A HG2  1 
ATOM 351  H HG3  . ARG A 1 25 ? -10.171 -4.209  -3.476  1.00 0.00 ? 25 ARG A HG3  1 
ATOM 352  H HD2  . ARG A 1 25 ? -10.205 -6.442  -3.744  1.00 0.00 ? 25 ARG A HD2  1 
ATOM 353  H HD3  . ARG A 1 25 ? -9.348  -6.629  -2.214  1.00 0.00 ? 25 ARG A HD3  1 
ATOM 354  H HE   . ARG A 1 25 ? -12.315 -6.336  -2.208  1.00 0.00 ? 25 ARG A HE   1 
ATOM 355  H HH11 . ARG A 1 25 ? -10.418 -8.915  -2.753  1.00 0.00 ? 25 ARG A HH11 1 
ATOM 356  H HH12 . ARG A 1 25 ? -10.743 -9.757  -1.274  1.00 0.00 ? 25 ARG A HH12 1 
ATOM 357  H HH21 . ARG A 1 25 ? -12.310 -7.052  0.229   1.00 0.00 ? 25 ARG A HH21 1 
ATOM 358  H HH22 . ARG A 1 25 ? -11.808 -8.698  0.417   1.00 0.00 ? 25 ARG A HH22 1 
ATOM 359  N N    . GLY A 1 26 ? -6.478  -1.622  -1.744  1.00 0.00 ? 26 GLY A N    1 
ATOM 360  C CA   . GLY A 1 26 ? -5.443  -1.023  -0.857  1.00 0.00 ? 26 GLY A CA   1 
ATOM 361  C C    . GLY A 1 26 ? -4.409  -0.277  -1.703  1.00 0.00 ? 26 GLY A C    1 
ATOM 362  O O    . GLY A 1 26 ? -3.848  -0.817  -2.635  1.00 0.00 ? 26 GLY A O    1 
ATOM 363  H H    . GLY A 1 26 ? -6.465  -1.439  -2.701  1.00 0.00 ? 26 GLY A H    1 
ATOM 364  H HA2  . GLY A 1 26 ? -5.904  -0.337  -0.180  1.00 0.00 ? 26 GLY A HA2  1 
ATOM 365  H HA3  . GLY A 1 26 ? -4.959  -1.799  -0.297  1.00 0.00 ? 26 GLY A HA3  1 
ATOM 366  N N    . LYS A 1 27 ? -4.156  0.966   -1.390  1.00 0.00 ? 27 LYS A N    1 
ATOM 367  C CA   . LYS A 1 27 ? -3.162  1.741   -2.185  1.00 0.00 ? 27 LYS A CA   1 
ATOM 368  C C    . LYS A 1 27 ? -2.418  2.724   -1.278  1.00 0.00 ? 27 LYS A C    1 
ATOM 369  O O    . LYS A 1 27 ? -2.603  2.746   -0.076  1.00 0.00 ? 27 LYS A O    1 
ATOM 370  C CB   . LYS A 1 27 ? -3.886  2.514   -3.289  1.00 0.00 ? 27 LYS A CB   1 
ATOM 371  C CG   . LYS A 1 27 ? -3.037  2.502   -4.562  1.00 0.00 ? 27 LYS A CG   1 
ATOM 372  C CD   . LYS A 1 27 ? -3.316  3.769   -5.375  1.00 0.00 ? 27 LYS A CD   1 
ATOM 373  C CE   . LYS A 1 27 ? -3.219  3.450   -6.868  1.00 0.00 ? 27 LYS A CE   1 
ATOM 374  N NZ   . LYS A 1 27 ? -4.108  4.370   -7.633  1.00 0.00 ? 27 LYS A NZ   1 
ATOM 375  H H    . LYS A 1 27 ? -4.620  1.389   -0.638  1.00 0.00 ? 27 LYS A H    1 
ATOM 376  H HA   . LYS A 1 27 ? -2.453  1.060   -2.633  1.00 0.00 ? 27 LYS A HA   1 
ATOM 377  H HB2  . LYS A 1 27 ? -4.841  2.049   -3.487  1.00 0.00 ? 27 LYS A HB2  1 
ATOM 378  H HB3  . LYS A 1 27 ? -4.041  3.535   -2.971  1.00 0.00 ? 27 LYS A HB3  1 
ATOM 379  H HG2  . LYS A 1 27 ? -1.990  2.466   -4.296  1.00 0.00 ? 27 LYS A HG2  1 
ATOM 380  H HG3  . LYS A 1 27 ? -3.288  1.635   -5.154  1.00 0.00 ? 27 LYS A HG3  1 
ATOM 381  H HD2  . LYS A 1 27 ? -4.307  4.132   -5.146  1.00 0.00 ? 27 LYS A HD2  1 
ATOM 382  H HD3  . LYS A 1 27 ? -2.588  4.525   -5.123  1.00 0.00 ? 27 LYS A HD3  1 
ATOM 383  H HE2  . LYS A 1 27 ? -2.199  3.580   -7.198  1.00 0.00 ? 27 LYS A HE2  1 
ATOM 384  H HE3  . LYS A 1 27 ? -3.525  2.429   -7.039  1.00 0.00 ? 27 LYS A HE3  1 
ATOM 385  H HZ1  . LYS A 1 27 ? -5.083  4.280   -7.285  1.00 0.00 ? 27 LYS A HZ1  1 
ATOM 386  H HZ2  . LYS A 1 27 ? -3.783  5.350   -7.506  1.00 0.00 ? 27 LYS A HZ2  1 
ATOM 387  H HZ3  . LYS A 1 27 ? -4.078  4.122   -8.642  1.00 0.00 ? 27 LYS A HZ3  1 
ATOM 388  N N    . CYS A 1 28 ? -1.572  3.536   -1.854  1.00 0.00 ? 28 CYS A N    1 
ATOM 389  C CA   . CYS A 1 28 ? -0.799  4.521   -1.047  1.00 0.00 ? 28 CYS A CA   1 
ATOM 390  C C    . CYS A 1 28 ? -1.553  5.859   -1.000  1.00 0.00 ? 28 CYS A C    1 
ATOM 391  O O    . CYS A 1 28 ? -1.472  6.650   -1.919  1.00 0.00 ? 28 CYS A O    1 
ATOM 392  C CB   . CYS A 1 28 ? 0.565   4.740   -1.705  1.00 0.00 ? 28 CYS A CB   1 
ATOM 393  S SG   . CYS A 1 28 ? 1.549   3.230   -1.557  1.00 0.00 ? 28 CYS A SG   1 
ATOM 394  H H    . CYS A 1 28 ? -1.442  3.494   -2.825  1.00 0.00 ? 28 CYS A H    1 
ATOM 395  H HA   . CYS A 1 28 ? -0.654  4.137   -0.049  1.00 0.00 ? 28 CYS A HA   1 
ATOM 396  H HB2  . CYS A 1 28 ? 0.428   4.981   -2.749  1.00 0.00 ? 28 CYS A HB2  1 
ATOM 397  H HB3  . CYS A 1 28 ? 1.077   5.553   -1.211  1.00 0.00 ? 28 CYS A HB3  1 
ATOM 398  N N    . TYR A 1 29 ? -2.285  6.131   0.053   1.00 0.00 ? 29 TYR A N    1 
ATOM 399  C CA   . TYR A 1 29 ? -3.024  7.422   0.122   1.00 0.00 ? 29 TYR A CA   1 
ATOM 400  C C    . TYR A 1 29 ? -2.191  8.448   0.890   1.00 0.00 ? 29 TYR A C    1 
ATOM 401  O O    . TYR A 1 29 ? -2.161  8.452   2.104   1.00 0.00 ? 29 TYR A O    1 
ATOM 402  C CB   . TYR A 1 29 ? -4.358  7.207   0.839   1.00 0.00 ? 29 TYR A CB   1 
ATOM 403  C CG   . TYR A 1 29 ? -5.313  6.507   -0.093  1.00 0.00 ? 29 TYR A CG   1 
ATOM 404  C CD1  . TYR A 1 29 ? -5.512  6.999   -1.387  1.00 0.00 ? 29 TYR A CD1  1 
ATOM 405  C CD2  . TYR A 1 29 ? -5.997  5.364   0.336   1.00 0.00 ? 29 TYR A CD2  1 
ATOM 406  C CE1  . TYR A 1 29 ? -6.396  6.347   -2.254  1.00 0.00 ? 29 TYR A CE1  1 
ATOM 407  C CE2  . TYR A 1 29 ? -6.882  4.712   -0.531  1.00 0.00 ? 29 TYR A CE2  1 
ATOM 408  C CZ   . TYR A 1 29 ? -7.081  5.204   -1.827  1.00 0.00 ? 29 TYR A CZ   1 
ATOM 409  O OH   . TYR A 1 29 ? -7.952  4.561   -2.682  1.00 0.00 ? 29 TYR A OH   1 
ATOM 410  H H    . TYR A 1 29 ? -2.351  5.494   0.794   1.00 0.00 ? 29 TYR A H    1 
ATOM 411  H HA   . TYR A 1 29 ? -3.209  7.784   -0.878  1.00 0.00 ? 29 TYR A HA   1 
ATOM 412  H HB2  . TYR A 1 29 ? -4.200  6.601   1.719   1.00 0.00 ? 29 TYR A HB2  1 
ATOM 413  H HB3  . TYR A 1 29 ? -4.771  8.162   1.127   1.00 0.00 ? 29 TYR A HB3  1 
ATOM 414  H HD1  . TYR A 1 29 ? -4.984  7.881   -1.717  1.00 0.00 ? 29 TYR A HD1  1 
ATOM 415  H HD2  . TYR A 1 29 ? -5.842  4.986   1.334   1.00 0.00 ? 29 TYR A HD2  1 
ATOM 416  H HE1  . TYR A 1 29 ? -6.550  6.727   -3.253  1.00 0.00 ? 29 TYR A HE1  1 
ATOM 417  H HE2  . TYR A 1 29 ? -7.410  3.829   -0.201  1.00 0.00 ? 29 TYR A HE2  1 
ATOM 418  H HH   . TYR A 1 29 ? -8.032  5.093   -3.477  1.00 0.00 ? 29 TYR A HH   1 
ATOM 419  N N    . GLY A 1 30 ? -1.515  9.320   0.193   1.00 0.00 ? 30 GLY A N    1 
ATOM 420  C CA   . GLY A 1 30 ? -0.689  10.343  0.889   1.00 0.00 ? 30 GLY A CA   1 
ATOM 421  C C    . GLY A 1 30 ? 0.300   9.649   1.825   1.00 0.00 ? 30 GLY A C    1 
ATOM 422  O O    . GLY A 1 30 ? 1.026   8.763   1.421   1.00 0.00 ? 30 GLY A O    1 
ATOM 423  H H    . GLY A 1 30 ? -1.552  9.302   -0.785  1.00 0.00 ? 30 GLY A H    1 
ATOM 424  H HA2  . GLY A 1 30 ? -0.150  10.931  0.164   1.00 0.00 ? 30 GLY A HA2  1 
ATOM 425  H HA3  . GLY A 1 30 ? -1.332  10.988  1.466   1.00 0.00 ? 30 GLY A HA3  1 
ATOM 426  N N    . PRO A 1 31 ? 0.286   10.081  3.052   1.00 0.00 ? 31 PRO A N    1 
ATOM 427  C CA   . PRO A 1 31 ? 1.197   9.481   4.052   1.00 0.00 ? 31 PRO A CA   1 
ATOM 428  C C    . PRO A 1 31 ? 0.458   8.421   4.876   1.00 0.00 ? 31 PRO A C    1 
ATOM 429  O O    . PRO A 1 31 ? 0.636   8.317   6.073   1.00 0.00 ? 31 PRO A O    1 
ATOM 430  C CB   . PRO A 1 31 ? 1.621   10.658  4.934   1.00 0.00 ? 31 PRO A CB   1 
ATOM 431  C CG   . PRO A 1 31 ? 0.530   11.733  4.768   1.00 0.00 ? 31 PRO A CG   1 
ATOM 432  C CD   . PRO A 1 31 ? -0.159  11.442  3.425   1.00 0.00 ? 31 PRO A CD   1 
ATOM 433  H HA   . PRO A 1 31 ? 2.060   9.053   3.569   1.00 0.00 ? 31 PRO A HA   1 
ATOM 434  H HB2  . PRO A 1 31 ? 1.686   10.343  5.967   1.00 0.00 ? 31 PRO A HB2  1 
ATOM 435  H HB3  . PRO A 1 31 ? 2.570   11.048  4.603   1.00 0.00 ? 31 PRO A HB3  1 
ATOM 436  H HG2  . PRO A 1 31 ? -0.183  11.664  5.579   1.00 0.00 ? 31 PRO A HG2  1 
ATOM 437  H HG3  . PRO A 1 31 ? 0.975   12.715  4.745   1.00 0.00 ? 31 PRO A HG3  1 
ATOM 438  H HD2  . PRO A 1 31 ? -1.233  11.471  3.534   1.00 0.00 ? 31 PRO A HD2  1 
ATOM 439  H HD3  . PRO A 1 31 ? 0.162   12.151  2.679   1.00 0.00 ? 31 PRO A HD3  1 
ATOM 440  N N    . GLN A 1 32 ? -0.369  7.633   4.243   1.00 0.00 ? 32 GLN A N    1 
ATOM 441  C CA   . GLN A 1 32 ? -1.114  6.581   4.993   1.00 0.00 ? 32 GLN A CA   1 
ATOM 442  C C    . GLN A 1 32 ? -1.615  5.509   4.022   1.00 0.00 ? 32 GLN A C    1 
ATOM 443  O O    . GLN A 1 32 ? -2.323  5.795   3.077   1.00 0.00 ? 32 GLN A O    1 
ATOM 444  C CB   . GLN A 1 32 ? -2.309  7.214   5.710   1.00 0.00 ? 32 GLN A CB   1 
ATOM 445  C CG   . GLN A 1 32 ? -2.829  6.251   6.780   1.00 0.00 ? 32 GLN A CG   1 
ATOM 446  C CD   . GLN A 1 32 ? -3.672  7.023   7.797   1.00 0.00 ? 32 GLN A CD   1 
ATOM 447  O OE1  . GLN A 1 32 ? -3.436  6.942   8.986   1.00 0.00 ? 32 GLN A OE1  1 
ATOM 448  N NE2  . GLN A 1 32 ? -4.654  7.774   7.378   1.00 0.00 ? 32 GLN A NE2  1 
ATOM 449  H H    . GLN A 1 32 ? -0.498  7.731   3.277   1.00 0.00 ? 32 GLN A H    1 
ATOM 450  H HA   . GLN A 1 32 ? -0.458  6.127   5.721   1.00 0.00 ? 32 GLN A HA   1 
ATOM 451  H HB2  . GLN A 1 32 ? -2.002  8.139   6.176   1.00 0.00 ? 32 GLN A HB2  1 
ATOM 452  H HB3  . GLN A 1 32 ? -3.094  7.413   4.996   1.00 0.00 ? 32 GLN A HB3  1 
ATOM 453  H HG2  . GLN A 1 32 ? -3.436  5.488   6.314   1.00 0.00 ? 32 GLN A HG2  1 
ATOM 454  H HG3  . GLN A 1 32 ? -1.994  5.790   7.285   1.00 0.00 ? 32 GLN A HG3  1 
ATOM 455  H HE21 . GLN A 1 32 ? -4.846  7.840   6.419   1.00 0.00 ? 32 GLN A HE21 1 
ATOM 456  H HE22 . GLN A 1 32 ? -5.199  8.272   8.022   1.00 0.00 ? 32 GLN A HE22 1 
ATOM 457  N N    . CYS A 1 33 ? -1.261  4.274   4.255   1.00 0.00 ? 33 CYS A N    1 
ATOM 458  C CA   . CYS A 1 33 ? -1.724  3.180   3.355   1.00 0.00 ? 33 CYS A CA   1 
ATOM 459  C C    . CYS A 1 33 ? -3.090  2.687   3.839   1.00 0.00 ? 33 CYS A C    1 
ATOM 460  O O    . CYS A 1 33 ? -3.247  2.297   4.979   1.00 0.00 ? 33 CYS A O    1 
ATOM 461  C CB   . CYS A 1 33 ? -0.720  2.026   3.395   1.00 0.00 ? 33 CYS A CB   1 
ATOM 462  S SG   . CYS A 1 33 ? -1.048  0.893   2.020   1.00 0.00 ? 33 CYS A SG   1 
ATOM 463  H H    . CYS A 1 33 ? -0.695  4.066   5.027   1.00 0.00 ? 33 CYS A H    1 
ATOM 464  H HA   . CYS A 1 33 ? -1.810  3.553   2.345   1.00 0.00 ? 33 CYS A HA   1 
ATOM 465  H HB2  . CYS A 1 33 ? 0.283   2.417   3.308   1.00 0.00 ? 33 CYS A HB2  1 
ATOM 466  H HB3  . CYS A 1 33 ? -0.819  1.496   4.330   1.00 0.00 ? 33 CYS A HB3  1 
ATOM 467  N N    . LEU A 1 34 ? -4.085  2.709   2.992   1.00 0.00 ? 34 LEU A N    1 
ATOM 468  C CA   . LEU A 1 34 ? -5.435  2.249   3.430   1.00 0.00 ? 34 LEU A CA   1 
ATOM 469  C C    . LEU A 1 34 ? -6.039  1.316   2.378   1.00 0.00 ? 34 LEU A C    1 
ATOM 470  O O    . LEU A 1 34 ? -5.432  1.021   1.369   1.00 0.00 ? 34 LEU A O    1 
ATOM 471  C CB   . LEU A 1 34 ? -6.351  3.462   3.615   1.00 0.00 ? 34 LEU A CB   1 
ATOM 472  C CG   . LEU A 1 34 ? -5.665  4.493   4.514   1.00 0.00 ? 34 LEU A CG   1 
ATOM 473  C CD1  . LEU A 1 34 ? -5.969  5.903   4.004   1.00 0.00 ? 34 LEU A CD1  1 
ATOM 474  C CD2  . LEU A 1 34 ? -6.188  4.351   5.944   1.00 0.00 ? 34 LEU A CD2  1 
ATOM 475  H H    . LEU A 1 34 ? -3.946  3.034   2.076   1.00 0.00 ? 34 LEU A H    1 
ATOM 476  H HA   . LEU A 1 34 ? -5.347  1.722   4.368   1.00 0.00 ? 34 LEU A HA   1 
ATOM 477  H HB2  . LEU A 1 34 ? -6.559  3.903   2.652   1.00 0.00 ? 34 LEU A HB2  1 
ATOM 478  H HB3  . LEU A 1 34 ? -7.277  3.147   4.073   1.00 0.00 ? 34 LEU A HB3  1 
ATOM 479  H HG   . LEU A 1 34 ? -4.599  4.329   4.501   1.00 0.00 ? 34 LEU A HG   1 
ATOM 480  H HD11 . LEU A 1 34 ? -6.443  5.843   3.036   1.00 0.00 ? 34 LEU A HD11 1 
ATOM 481  H HD12 . LEU A 1 34 ? -6.630  6.401   4.698   1.00 0.00 ? 34 LEU A HD12 1 
ATOM 482  H HD13 . LEU A 1 34 ? -5.049  6.462   3.921   1.00 0.00 ? 34 LEU A HD13 1 
ATOM 483  H HD21 . LEU A 1 34 ? -6.021  3.341   6.289   1.00 0.00 ? 34 LEU A HD21 1 
ATOM 484  H HD22 . LEU A 1 34 ? -5.667  5.043   6.588   1.00 0.00 ? 34 LEU A HD22 1 
ATOM 485  H HD23 . LEU A 1 34 ? -7.246  4.567   5.963   1.00 0.00 ? 34 LEU A HD23 1 
ATOM 486  N N    . CYS A 1 35 ? -7.238  0.852   2.613   1.00 0.00 ? 35 CYS A N    1 
ATOM 487  C CA   . CYS A 1 35 ? -7.897  -0.061  1.637   1.00 0.00 ? 35 CYS A CA   1 
ATOM 488  C C    . CYS A 1 35 ? -8.669  0.768   0.608   1.00 0.00 ? 35 CYS A C    1 
ATOM 489  O O    . CYS A 1 35 ? -8.738  1.978   0.699   1.00 0.00 ? 35 CYS A O    1 
ATOM 490  C CB   . CYS A 1 35 ? -8.868  -0.979  2.384   1.00 0.00 ? 35 CYS A CB   1 
ATOM 491  S SG   . CYS A 1 35 ? -8.106  -1.515  3.934   1.00 0.00 ? 35 CYS A SG   1 
ATOM 492  H H    . CYS A 1 35 ? -7.706  1.106   3.436   1.00 0.00 ? 35 CYS A H    1 
ATOM 493  H HA   . CYS A 1 35 ? -7.149  -0.660  1.135   1.00 0.00 ? 35 CYS A HA   1 
ATOM 494  H HB2  . CYS A 1 35 ? -9.780  -0.441  2.597   1.00 0.00 ? 35 CYS A HB2  1 
ATOM 495  H HB3  . CYS A 1 35 ? -9.091  -1.842  1.774   1.00 0.00 ? 35 CYS A HB3  1 
ATOM 496  N N    . ARG A 1 36 ? -9.252  0.130   -0.370  1.00 0.00 ? 36 ARG A N    1 
ATOM 497  C CA   . ARG A 1 36 ? -10.018 0.888   -1.398  1.00 0.00 ? 36 ARG A CA   1 
ATOM 498  C C    . ARG A 1 36 ? -11.106 1.719   -0.715  1.00 0.00 ? 36 ARG A C    1 
ATOM 499  O O    . ARG A 1 36 ? -11.762 1.190   0.166   1.00 0.00 ? 36 ARG A O    1 
ATOM 500  C CB   . ARG A 1 36 ? -10.666 -0.088  -2.381  1.00 0.00 ? 36 ARG A CB   1 
ATOM 501  C CG   . ARG A 1 36 ? -11.533 0.688   -3.374  1.00 0.00 ? 36 ARG A CG   1 
ATOM 502  C CD   . ARG A 1 36 ? -12.953 0.821   -2.819  1.00 0.00 ? 36 ARG A CD   1 
ATOM 503  N NE   . ARG A 1 36 ? -13.925 0.280   -3.811  1.00 0.00 ? 36 ARG A NE   1 
ATOM 504  C CZ   . ARG A 1 36 ? -15.173 0.095   -3.471  1.00 0.00 ? 36 ARG A CZ   1 
ATOM 505  N NH1  . ARG A 1 36 ? -16.034 1.067   -3.597  1.00 0.00 ? 36 ARG A NH1  1 
ATOM 506  N NH2  . ARG A 1 36 ? -15.558 -1.063  -3.007  1.00 0.00 ? 36 ARG A NH2  1 
ATOM 507  O OXT  . ARG A 1 36 ? -11.264 2.870   -1.086  1.00 0.00 ? 36 ARG A OXT  1 
ATOM 508  H H    . ARG A 1 36 ? -9.186  -0.846  -0.428  1.00 0.00 ? 36 ARG A H    1 
ATOM 509  H HA   . ARG A 1 36 ? -9.347  1.543   -1.933  1.00 0.00 ? 36 ARG A HA   1 
ATOM 510  H HB2  . ARG A 1 36 ? -9.896  -0.621  -2.917  1.00 0.00 ? 36 ARG A HB2  1 
ATOM 511  H HB3  . ARG A 1 36 ? -11.282 -0.790  -1.840  1.00 0.00 ? 36 ARG A HB3  1 
ATOM 512  H HG2  . ARG A 1 36 ? -11.112 1.671   -3.527  1.00 0.00 ? 36 ARG A HG2  1 
ATOM 513  H HG3  . ARG A 1 36 ? -11.565 0.159   -4.314  1.00 0.00 ? 36 ARG A HG3  1 
ATOM 514  H HD2  . ARG A 1 36 ? -13.032 0.266   -1.896  1.00 0.00 ? 36 ARG A HD2  1 
ATOM 515  H HD3  . ARG A 1 36 ? -13.171 1.863   -2.632  1.00 0.00 ? 36 ARG A HD3  1 
ATOM 516  H HE   . ARG A 1 36 ? -13.628 0.062   -4.719  1.00 0.00 ? 36 ARG A HE   1 
ATOM 517  H HH11 . ARG A 1 36 ? -15.739 1.953   -3.953  1.00 0.00 ? 36 ARG A HH11 1 
ATOM 518  H HH12 . ARG A 1 36 ? -16.990 0.925   -3.338  1.00 0.00 ? 36 ARG A HH12 1 
ATOM 519  H HH21 . ARG A 1 36 ? -14.899 -1.808  -2.912  1.00 0.00 ? 36 ARG A HH21 1 
ATOM 520  H HH22 . ARG A 1 36 ? -16.513 -1.204  -2.747  1.00 0.00 ? 36 ARG A HH22 1 
ATOM 521  N N    . MET A 1 1  ? -5.497  0.320   6.833   1.00 0.00 ? 1  MET A N    2 
ATOM 522  C CA   . MET A 1 1  ? -4.082  0.650   6.502   1.00 0.00 ? 1  MET A CA   2 
ATOM 523  C C    . MET A 1 1  ? -3.169  -0.478  6.982   1.00 0.00 ? 1  MET A C    2 
ATOM 524  O O    . MET A 1 1  ? -3.462  -1.159  7.946   1.00 0.00 ? 1  MET A O    2 
ATOM 525  C CB   . MET A 1 1  ? -3.685  1.952   7.198   1.00 0.00 ? 1  MET A CB   2 
ATOM 526  C CG   . MET A 1 1  ? -4.014  1.854   8.690   1.00 0.00 ? 1  MET A CG   2 
ATOM 527  S SD   . MET A 1 1  ? -2.479  1.881   9.648   1.00 0.00 ? 1  MET A SD   2 
ATOM 528  C CE   . MET A 1 1  ? -2.975  3.155   10.835  1.00 0.00 ? 1  MET A CE   2 
ATOM 529  H H1   . MET A 1 1  ? -5.528  -0.248  7.703   1.00 0.00 ? 1  MET A H1   2 
ATOM 530  H H2   . MET A 1 1  ? -6.035  1.198   6.976   1.00 0.00 ? 1  MET A H2   2 
ATOM 531  H H3   . MET A 1 1  ? -5.919  -0.222  6.050   1.00 0.00 ? 1  MET A H3   2 
ATOM 532  H HA   . MET A 1 1  ? -3.979  0.767   5.433   1.00 0.00 ? 1  MET A HA   2 
ATOM 533  H HB2  . MET A 1 1  ? -2.624  2.116   7.072   1.00 0.00 ? 1  MET A HB2  2 
ATOM 534  H HB3  . MET A 1 1  ? -4.232  2.775   6.763   1.00 0.00 ? 1  MET A HB3  2 
ATOM 535  H HG2  . MET A 1 1  ? -4.633  2.690   8.978   1.00 0.00 ? 1  MET A HG2  2 
ATOM 536  H HG3  . MET A 1 1  ? -4.541  0.932   8.882   1.00 0.00 ? 1  MET A HG3  2 
ATOM 537  H HE1  . MET A 1 1  ? -3.833  3.689   10.450  1.00 0.00 ? 1  MET A HE1  2 
ATOM 538  H HE2  . MET A 1 1  ? -3.227  2.689   11.777  1.00 0.00 ? 1  MET A HE2  2 
ATOM 539  H HE3  . MET A 1 1  ? -2.161  3.845   10.985  1.00 0.00 ? 1  MET A HE3  2 
ATOM 540  N N    . CYS A 1 2  ? -2.065  -0.685  6.319   1.00 0.00 ? 2  CYS A N    2 
ATOM 541  C CA   . CYS A 1 2  ? -1.138  -1.772  6.741   1.00 0.00 ? 2  CYS A CA   2 
ATOM 542  C C    . CYS A 1 2  ? 0.234   -1.184  7.078   1.00 0.00 ? 2  CYS A C    2 
ATOM 543  O O    . CYS A 1 2  ? 0.945   -1.691  7.924   1.00 0.00 ? 2  CYS A O    2 
ATOM 544  C CB   . CYS A 1 2  ? -0.992  -2.783  5.606   1.00 0.00 ? 2  CYS A CB   2 
ATOM 545  S SG   . CYS A 1 2  ? -0.408  -4.359  6.282   1.00 0.00 ? 2  CYS A SG   2 
ATOM 546  H H    . CYS A 1 2  ? -1.848  -0.127  5.543   1.00 0.00 ? 2  CYS A H    2 
ATOM 547  H HA   . CYS A 1 2  ? -1.539  -2.267  7.613   1.00 0.00 ? 2  CYS A HA   2 
ATOM 548  H HB2  . CYS A 1 2  ? -1.948  -2.924  5.126   1.00 0.00 ? 2  CYS A HB2  2 
ATOM 549  H HB3  . CYS A 1 2  ? -0.277  -2.415  4.884   1.00 0.00 ? 2  CYS A HB3  2 
ATOM 550  N N    . MET A 1 3  ? 0.616   -0.124  6.421   1.00 0.00 ? 3  MET A N    2 
ATOM 551  C CA   . MET A 1 3  ? 1.945   0.487   6.703   1.00 0.00 ? 3  MET A CA   2 
ATOM 552  C C    . MET A 1 3  ? 2.111   1.753   5.854   1.00 0.00 ? 3  MET A C    2 
ATOM 553  O O    . MET A 1 3  ? 1.178   2.194   5.211   1.00 0.00 ? 3  MET A O    2 
ATOM 554  C CB   . MET A 1 3  ? 3.045   -0.536  6.375   1.00 0.00 ? 3  MET A CB   2 
ATOM 555  C CG   . MET A 1 3  ? 3.400   -0.479  4.885   1.00 0.00 ? 3  MET A CG   2 
ATOM 556  S SD   . MET A 1 3  ? 3.779   -2.146  4.291   1.00 0.00 ? 3  MET A SD   2 
ATOM 557  C CE   . MET A 1 3  ? 4.838   -2.640  5.672   1.00 0.00 ? 3  MET A CE   2 
ATOM 558  H H    . MET A 1 3  ? 0.031   0.268   5.739   1.00 0.00 ? 3  MET A H    2 
ATOM 559  H HA   . MET A 1 3  ? 2.006   0.753   7.748   1.00 0.00 ? 3  MET A HA   2 
ATOM 560  H HB2  . MET A 1 3  ? 3.923   -0.321  6.963   1.00 0.00 ? 3  MET A HB2  2 
ATOM 561  H HB3  . MET A 1 3  ? 2.692   -1.527  6.617   1.00 0.00 ? 3  MET A HB3  2 
ATOM 562  H HG2  . MET A 1 3  ? 2.561   -0.082  4.332   1.00 0.00 ? 3  MET A HG2  2 
ATOM 563  H HG3  . MET A 1 3  ? 4.260   0.158   4.743   1.00 0.00 ? 3  MET A HG3  2 
ATOM 564  H HE1  . MET A 1 3  ? 5.567   -1.865  5.859   1.00 0.00 ? 3  MET A HE1  2 
ATOM 565  H HE2  . MET A 1 3  ? 4.230   -2.792  6.553   1.00 0.00 ? 3  MET A HE2  2 
ATOM 566  H HE3  . MET A 1 3  ? 5.346   -3.559  5.426   1.00 0.00 ? 3  MET A HE3  2 
ATOM 567  N N    . PRO A 1 4  ? 3.294   2.301   5.887   1.00 0.00 ? 4  PRO A N    2 
ATOM 568  C CA   . PRO A 1 4  ? 3.532   3.529   5.102   1.00 0.00 ? 4  PRO A CA   2 
ATOM 569  C C    . PRO A 1 4  ? 3.907   3.166   3.661   1.00 0.00 ? 4  PRO A C    2 
ATOM 570  O O    . PRO A 1 4  ? 3.710   2.050   3.225   1.00 0.00 ? 4  PRO A O    2 
ATOM 571  C CB   . PRO A 1 4  ? 4.691   4.220   5.819   1.00 0.00 ? 4  PRO A CB   2 
ATOM 572  C CG   . PRO A 1 4  ? 5.428   3.123   6.612   1.00 0.00 ? 4  PRO A CG   2 
ATOM 573  C CD   . PRO A 1 4  ? 4.469   1.927   6.708   1.00 0.00 ? 4  PRO A CD   2 
ATOM 574  H HA   . PRO A 1 4  ? 2.659   4.161   5.117   1.00 0.00 ? 4  PRO A HA   2 
ATOM 575  H HB2  . PRO A 1 4  ? 5.357   4.672   5.096   1.00 0.00 ? 4  PRO A HB2  2 
ATOM 576  H HB3  . PRO A 1 4  ? 4.315   4.968   6.497   1.00 0.00 ? 4  PRO A HB3  2 
ATOM 577  H HG2  . PRO A 1 4  ? 6.334   2.835   6.096   1.00 0.00 ? 4  PRO A HG2  2 
ATOM 578  H HG3  . PRO A 1 4  ? 5.662   3.477   7.603   1.00 0.00 ? 4  PRO A HG3  2 
ATOM 579  H HD2  . PRO A 1 4  ? 4.943   1.042   6.308   1.00 0.00 ? 4  PRO A HD2  2 
ATOM 580  H HD3  . PRO A 1 4  ? 4.170   1.766   7.733   1.00 0.00 ? 4  PRO A HD3  2 
ATOM 581  N N    . CYS A 1 5  ? 4.439   4.097   2.918   1.00 0.00 ? 5  CYS A N    2 
ATOM 582  C CA   . CYS A 1 5  ? 4.815   3.795   1.514   1.00 0.00 ? 5  CYS A CA   2 
ATOM 583  C C    . CYS A 1 5  ? 6.225   4.314   1.229   1.00 0.00 ? 5  CYS A C    2 
ATOM 584  O O    . CYS A 1 5  ? 6.869   4.895   2.080   1.00 0.00 ? 5  CYS A O    2 
ATOM 585  C CB   . CYS A 1 5  ? 3.820   4.463   0.563   1.00 0.00 ? 5  CYS A CB   2 
ATOM 586  S SG   . CYS A 1 5  ? 2.544   3.268   0.097   1.00 0.00 ? 5  CYS A SG   2 
ATOM 587  H H    . CYS A 1 5  ? 4.588   4.987   3.280   1.00 0.00 ? 5  CYS A H    2 
ATOM 588  H HA   . CYS A 1 5  ? 4.790   2.732   1.368   1.00 0.00 ? 5  CYS A HA   2 
ATOM 589  H HB2  . CYS A 1 5  ? 3.362   5.307   1.056   1.00 0.00 ? 5  CYS A HB2  2 
ATOM 590  H HB3  . CYS A 1 5  ? 4.339   4.800   -0.322  1.00 0.00 ? 5  CYS A HB3  2 
ATOM 591  N N    . PHE A 1 6  ? 6.708   4.107   0.033   1.00 0.00 ? 6  PHE A N    2 
ATOM 592  C CA   . PHE A 1 6  ? 8.076   4.583   -0.315  1.00 0.00 ? 6  PHE A CA   2 
ATOM 593  C C    . PHE A 1 6  ? 8.131   4.928   -1.805  1.00 0.00 ? 6  PHE A C    2 
ATOM 594  O O    . PHE A 1 6  ? 7.119   4.999   -2.472  1.00 0.00 ? 6  PHE A O    2 
ATOM 595  C CB   . PHE A 1 6  ? 9.091   3.481   -0.005  1.00 0.00 ? 6  PHE A CB   2 
ATOM 596  C CG   . PHE A 1 6  ? 9.231   3.336   1.490   1.00 0.00 ? 6  PHE A CG   2 
ATOM 597  C CD1  . PHE A 1 6  ? 9.574   4.446   2.272   1.00 0.00 ? 6  PHE A CD1  2 
ATOM 598  C CD2  . PHE A 1 6  ? 9.018   2.092   2.097   1.00 0.00 ? 6  PHE A CD2  2 
ATOM 599  C CE1  . PHE A 1 6  ? 9.701   4.311   3.660   1.00 0.00 ? 6  PHE A CE1  2 
ATOM 600  C CE2  . PHE A 1 6  ? 9.146   1.958   3.484   1.00 0.00 ? 6  PHE A CE2  2 
ATOM 601  C CZ   . PHE A 1 6  ? 9.488   3.067   4.266   1.00 0.00 ? 6  PHE A CZ   2 
ATOM 602  H H    . PHE A 1 6  ? 6.170   3.634   -0.636  1.00 0.00 ? 6  PHE A H    2 
ATOM 603  H HA   . PHE A 1 6  ? 8.310   5.462   0.268   1.00 0.00 ? 6  PHE A HA   2 
ATOM 604  H HB2  . PHE A 1 6  ? 8.748   2.547   -0.427  1.00 0.00 ? 6  PHE A HB2  2 
ATOM 605  H HB3  . PHE A 1 6  ? 10.048  3.741   -0.432  1.00 0.00 ? 6  PHE A HB3  2 
ATOM 606  H HD1  . PHE A 1 6  ? 9.738   5.405   1.805   1.00 0.00 ? 6  PHE A HD1  2 
ATOM 607  H HD2  . PHE A 1 6  ? 8.754   1.237   1.494   1.00 0.00 ? 6  PHE A HD2  2 
ATOM 608  H HE1  . PHE A 1 6  ? 9.965   5.167   4.263   1.00 0.00 ? 6  PHE A HE1  2 
ATOM 609  H HE2  . PHE A 1 6  ? 8.980   0.998   3.951   1.00 0.00 ? 6  PHE A HE2  2 
ATOM 610  H HZ   . PHE A 1 6  ? 9.586   2.964   5.336   1.00 0.00 ? 6  PHE A HZ   2 
ATOM 611  N N    . THR A 1 7  ? 9.306   5.145   -2.332  1.00 0.00 ? 7  THR A N    2 
ATOM 612  C CA   . THR A 1 7  ? 9.419   5.489   -3.779  1.00 0.00 ? 7  THR A CA   2 
ATOM 613  C C    . THR A 1 7  ? 10.440  4.567   -4.451  1.00 0.00 ? 7  THR A C    2 
ATOM 614  O O    . THR A 1 7  ? 10.915  3.616   -3.863  1.00 0.00 ? 7  THR A O    2 
ATOM 615  C CB   . THR A 1 7  ? 9.877   6.942   -3.922  1.00 0.00 ? 7  THR A CB   2 
ATOM 616  O OG1  . THR A 1 7  ? 10.094  7.499   -2.633  1.00 0.00 ? 7  THR A OG1  2 
ATOM 617  C CG2  . THR A 1 7  ? 8.803   7.748   -4.656  1.00 0.00 ? 7  THR A CG2  2 
ATOM 618  H H    . THR A 1 7  ? 10.111  5.086   -1.777  1.00 0.00 ? 7  THR A H    2 
ATOM 619  H HA   . THR A 1 7  ? 8.457   5.367   -4.253  1.00 0.00 ? 7  THR A HA   2 
ATOM 620  H HB   . THR A 1 7  ? 10.795  6.977   -4.490  1.00 0.00 ? 7  THR A HB   2 
ATOM 621  H HG1  . THR A 1 7  ? 11.028  7.704   -2.553  1.00 0.00 ? 7  THR A HG1  2 
ATOM 622  H HG21 . THR A 1 7  ? 8.155   7.075   -5.197  1.00 0.00 ? 7  THR A HG21 2 
ATOM 623  H HG22 . THR A 1 7  ? 8.221   8.308   -3.938  1.00 0.00 ? 7  THR A HG22 2 
ATOM 624  H HG23 . THR A 1 7  ? 9.273   8.430   -5.348  1.00 0.00 ? 7  THR A HG23 2 
ATOM 625  N N    . THR A 1 8  ? 10.779  4.843   -5.682  1.00 0.00 ? 8  THR A N    2 
ATOM 626  C CA   . THR A 1 8  ? 11.768  3.986   -6.397  1.00 0.00 ? 8  THR A CA   2 
ATOM 627  C C    . THR A 1 8  ? 11.164  2.601   -6.635  1.00 0.00 ? 8  THR A C    2 
ATOM 628  O O    . THR A 1 8  ? 10.103  2.283   -6.138  1.00 0.00 ? 8  THR A O    2 
ATOM 629  C CB   . THR A 1 8  ? 13.038  3.850   -5.551  1.00 0.00 ? 8  THR A CB   2 
ATOM 630  O OG1  . THR A 1 8  ? 12.910  2.731   -4.684  1.00 0.00 ? 8  THR A OG1  2 
ATOM 631  C CG2  . THR A 1 8  ? 13.246  5.118   -4.722  1.00 0.00 ? 8  THR A CG2  2 
ATOM 632  H H    . THR A 1 8  ? 10.382  5.615   -6.136  1.00 0.00 ? 8  THR A H    2 
ATOM 633  H HA   . THR A 1 8  ? 12.014  4.438   -7.346  1.00 0.00 ? 8  THR A HA   2 
ATOM 634  H HB   . THR A 1 8  ? 13.889  3.707   -6.200  1.00 0.00 ? 8  THR A HB   2 
ATOM 635  H HG1  . THR A 1 8  ? 13.566  2.080   -4.941  1.00 0.00 ? 8  THR A HG1  2 
ATOM 636  H HG21 . THR A 1 8  ? 12.844  5.968   -5.255  1.00 0.00 ? 8  THR A HG21 2 
ATOM 637  H HG22 . THR A 1 8  ? 12.739  5.015   -3.774  1.00 0.00 ? 8  THR A HG22 2 
ATOM 638  H HG23 . THR A 1 8  ? 14.302  5.269   -4.552  1.00 0.00 ? 8  THR A HG23 2 
ATOM 639  N N    . ASP A 1 9  ? 11.833  1.774   -7.390  1.00 0.00 ? 9  ASP A N    2 
ATOM 640  C CA   . ASP A 1 9  ? 11.297  0.409   -7.657  1.00 0.00 ? 9  ASP A CA   2 
ATOM 641  C C    . ASP A 1 9  ? 11.806  -0.557  -6.586  1.00 0.00 ? 9  ASP A C    2 
ATOM 642  O O    . ASP A 1 9  ? 12.893  -1.094  -6.685  1.00 0.00 ? 9  ASP A O    2 
ATOM 643  C CB   . ASP A 1 9  ? 11.764  -0.063  -9.035  1.00 0.00 ? 9  ASP A CB   2 
ATOM 644  C CG   . ASP A 1 9  ? 10.553  -0.233  -9.956  1.00 0.00 ? 9  ASP A CG   2 
ATOM 645  O OD1  . ASP A 1 9  ? 10.068  0.769   -10.455 1.00 0.00 ? 9  ASP A OD1  2 
ATOM 646  O OD2  . ASP A 1 9  ? 10.132  -1.362  -10.145 1.00 0.00 ? 9  ASP A OD2  2 
ATOM 647  H H    . ASP A 1 9  ? 12.689  2.049   -7.781  1.00 0.00 ? 9  ASP A H    2 
ATOM 648  H HA   . ASP A 1 9  ? 10.218  0.435   -7.634  1.00 0.00 ? 9  ASP A HA   2 
ATOM 649  H HB2  . ASP A 1 9  ? 12.439  0.669   -9.456  1.00 0.00 ? 9  ASP A HB2  2 
ATOM 650  H HB3  . ASP A 1 9  ? 12.273  -1.009  -8.937  1.00 0.00 ? 9  ASP A HB3  2 
ATOM 651  N N    . HIS A 1 10 ? 11.031  -0.782  -5.560  1.00 0.00 ? 10 HIS A N    2 
ATOM 652  C CA   . HIS A 1 10 ? 11.471  -1.711  -4.482  1.00 0.00 ? 10 HIS A CA   2 
ATOM 653  C C    . HIS A 1 10 ? 10.396  -2.777  -4.253  1.00 0.00 ? 10 HIS A C    2 
ATOM 654  O O    . HIS A 1 10 ? 10.572  -3.689  -3.470  1.00 0.00 ? 10 HIS A O    2 
ATOM 655  C CB   . HIS A 1 10 ? 11.691  -0.919  -3.190  1.00 0.00 ? 10 HIS A CB   2 
ATOM 656  C CG   . HIS A 1 10 ? 13.114  -0.433  -3.134  1.00 0.00 ? 10 HIS A CG   2 
ATOM 657  N ND1  . HIS A 1 10 ? 13.434  0.884   -2.840  1.00 0.00 ? 10 HIS A ND1  2 
ATOM 658  C CD2  . HIS A 1 10 ? 14.311  -1.074  -3.328  1.00 0.00 ? 10 HIS A CD2  2 
ATOM 659  C CE1  . HIS A 1 10 ? 14.776  0.990   -2.866  1.00 0.00 ? 10 HIS A CE1  2 
ATOM 660  N NE2  . HIS A 1 10 ? 15.360  -0.175  -3.158  1.00 0.00 ? 10 HIS A NE2  2 
ATOM 661  H H    . HIS A 1 10 ? 10.159  -0.339  -5.499  1.00 0.00 ? 10 HIS A H    2 
ATOM 662  H HA   . HIS A 1 10 ? 12.395  -2.188  -4.773  1.00 0.00 ? 10 HIS A HA   2 
ATOM 663  H HB2  . HIS A 1 10 ? 11.022  -0.072  -3.169  1.00 0.00 ? 10 HIS A HB2  2 
ATOM 664  H HB3  . HIS A 1 10 ? 11.496  -1.554  -2.339  1.00 0.00 ? 10 HIS A HB3  2 
ATOM 665  H HD1  . HIS A 1 10 ? 12.799  1.606   -2.648  1.00 0.00 ? 10 HIS A HD1  2 
ATOM 666  H HD2  . HIS A 1 10 ? 14.423  -2.119  -3.577  1.00 0.00 ? 10 HIS A HD2  2 
ATOM 667  H HE1  . HIS A 1 10 ? 15.314  1.907   -2.673  1.00 0.00 ? 10 HIS A HE1  2 
ATOM 668  N N    . GLN A 1 11 ? 9.283   -2.670  -4.928  1.00 0.00 ? 11 GLN A N    2 
ATOM 669  C CA   . GLN A 1 11 ? 8.198   -3.678  -4.746  1.00 0.00 ? 11 GLN A CA   2 
ATOM 670  C C    . GLN A 1 11 ? 7.689   -3.626  -3.305  1.00 0.00 ? 11 GLN A C    2 
ATOM 671  O O    . GLN A 1 11 ? 7.662   -4.621  -2.610  1.00 0.00 ? 11 GLN A O    2 
ATOM 672  C CB   . GLN A 1 11 ? 8.740   -5.078  -5.046  1.00 0.00 ? 11 GLN A CB   2 
ATOM 673  C CG   . GLN A 1 11 ? 8.559   -5.388  -6.535  1.00 0.00 ? 11 GLN A CG   2 
ATOM 674  C CD   . GLN A 1 11 ? 9.309   -6.674  -6.885  1.00 0.00 ? 11 GLN A CD   2 
ATOM 675  O OE1  . GLN A 1 11 ? 10.511  -6.751  -6.726  1.00 0.00 ? 11 GLN A OE1  2 
ATOM 676  N NE2  . GLN A 1 11 ? 8.647   -7.692  -7.361  1.00 0.00 ? 11 GLN A NE2  2 
ATOM 677  H H    . GLN A 1 11 ? 9.159   -1.926  -5.553  1.00 0.00 ? 11 GLN A H    2 
ATOM 678  H HA   . GLN A 1 11 ? 7.385   -3.455  -5.422  1.00 0.00 ? 11 GLN A HA   2 
ATOM 679  H HB2  . GLN A 1 11 ? 9.789   -5.120  -4.793  1.00 0.00 ? 11 GLN A HB2  2 
ATOM 680  H HB3  . GLN A 1 11 ? 8.198   -5.806  -4.461  1.00 0.00 ? 11 GLN A HB3  2 
ATOM 681  H HG2  . GLN A 1 11 ? 7.507   -5.512  -6.751  1.00 0.00 ? 11 GLN A HG2  2 
ATOM 682  H HG3  . GLN A 1 11 ? 8.953   -4.572  -7.122  1.00 0.00 ? 11 GLN A HG3  2 
ATOM 683  H HE21 . GLN A 1 11 ? 7.677   -7.630  -7.492  1.00 0.00 ? 11 GLN A HE21 2 
ATOM 684  H HE22 . GLN A 1 11 ? 9.118   -8.520  -7.589  1.00 0.00 ? 11 GLN A HE22 2 
ATOM 685  N N    . MET A 1 12 ? 7.287   -2.470  -2.852  1.00 0.00 ? 12 MET A N    2 
ATOM 686  C CA   . MET A 1 12 ? 6.779   -2.351  -1.456  1.00 0.00 ? 12 MET A CA   2 
ATOM 687  C C    . MET A 1 12 ? 5.336   -1.840  -1.481  1.00 0.00 ? 12 MET A C    2 
ATOM 688  O O    . MET A 1 12 ? 4.431   -2.477  -0.978  1.00 0.00 ? 12 MET A O    2 
ATOM 689  C CB   . MET A 1 12 ? 7.652   -1.359  -0.682  1.00 0.00 ? 12 MET A CB   2 
ATOM 690  C CG   . MET A 1 12 ? 7.690   -1.744  0.800   1.00 0.00 ? 12 MET A CG   2 
ATOM 691  S SD   . MET A 1 12 ? 6.004   -1.999  1.409   1.00 0.00 ? 12 MET A SD   2 
ATOM 692  C CE   . MET A 1 12 ? 5.436   -0.288  1.243   1.00 0.00 ? 12 MET A CE   2 
ATOM 693  H H    . MET A 1 12 ? 7.319   -1.680  -3.432  1.00 0.00 ? 12 MET A H    2 
ATOM 694  H HA   . MET A 1 12 ? 6.814   -3.316  -0.974  1.00 0.00 ? 12 MET A HA   2 
ATOM 695  H HB2  . MET A 1 12 ? 8.654   -1.376  -1.084  1.00 0.00 ? 12 MET A HB2  2 
ATOM 696  H HB3  . MET A 1 12 ? 7.243   -0.366  -0.783  1.00 0.00 ? 12 MET A HB3  2 
ATOM 697  H HG2  . MET A 1 12 ? 8.256   -2.657  0.919   1.00 0.00 ? 12 MET A HG2  2 
ATOM 698  H HG3  . MET A 1 12 ? 8.161   -0.953  1.363   1.00 0.00 ? 12 MET A HG3  2 
ATOM 699  H HE1  . MET A 1 12 ? 5.854   0.147   0.349   1.00 0.00 ? 12 MET A HE1  2 
ATOM 700  H HE2  . MET A 1 12 ? 4.356   -0.274  1.177   1.00 0.00 ? 12 MET A HE2  2 
ATOM 701  H HE3  . MET A 1 12 ? 5.757   0.283   2.104   1.00 0.00 ? 12 MET A HE3  2 
ATOM 702  N N    . ALA A 1 13 ? 5.118   -0.691  -2.059  1.00 0.00 ? 13 ALA A N    2 
ATOM 703  C CA   . ALA A 1 13 ? 3.737   -0.129  -2.113  1.00 0.00 ? 13 ALA A CA   2 
ATOM 704  C C    . ALA A 1 13 ? 2.817   -1.069  -2.901  1.00 0.00 ? 13 ALA A C    2 
ATOM 705  O O    . ALA A 1 13 ? 1.612   -0.912  -2.900  1.00 0.00 ? 13 ALA A O    2 
ATOM 706  C CB   . ALA A 1 13 ? 3.773   1.239   -2.800  1.00 0.00 ? 13 ALA A CB   2 
ATOM 707  H H    . ALA A 1 13 ? 5.865   -0.194  -2.453  1.00 0.00 ? 13 ALA A H    2 
ATOM 708  H HA   . ALA A 1 13 ? 3.357   -0.014  -1.109  1.00 0.00 ? 13 ALA A HA   2 
ATOM 709  H HB1  . ALA A 1 13 ? 4.629   1.289   -3.457  1.00 0.00 ? 13 ALA A HB1  2 
ATOM 710  H HB2  . ALA A 1 13 ? 2.869   1.378   -3.374  1.00 0.00 ? 13 ALA A HB2  2 
ATOM 711  H HB3  . ALA A 1 13 ? 3.848   2.014   -2.052  1.00 0.00 ? 13 ALA A HB3  2 
ATOM 712  N N    . ARG A 1 14 ? 3.370   -2.042  -3.574  1.00 0.00 ? 14 ARG A N    2 
ATOM 713  C CA   . ARG A 1 14 ? 2.517   -2.978  -4.359  1.00 0.00 ? 14 ARG A CA   2 
ATOM 714  C C    . ARG A 1 14 ? 1.986   -4.090  -3.449  1.00 0.00 ? 14 ARG A C    2 
ATOM 715  O O    . ARG A 1 14 ? 0.938   -4.654  -3.694  1.00 0.00 ? 14 ARG A O    2 
ATOM 716  C CB   . ARG A 1 14 ? 3.341   -3.596  -5.491  1.00 0.00 ? 14 ARG A CB   2 
ATOM 717  C CG   . ARG A 1 14 ? 2.531   -4.706  -6.166  1.00 0.00 ? 14 ARG A CG   2 
ATOM 718  C CD   . ARG A 1 14 ? 3.007   -6.067  -5.657  1.00 0.00 ? 14 ARG A CD   2 
ATOM 719  N NE   . ARG A 1 14 ? 4.303   -6.412  -6.306  1.00 0.00 ? 14 ARG A NE   2 
ATOM 720  C CZ   . ARG A 1 14 ? 4.491   -7.609  -6.788  1.00 0.00 ? 14 ARG A CZ   2 
ATOM 721  N NH1  . ARG A 1 14 ? 4.576   -8.632  -5.982  1.00 0.00 ? 14 ARG A NH1  2 
ATOM 722  N NH2  . ARG A 1 14 ? 4.593   -7.784  -8.078  1.00 0.00 ? 14 ARG A NH2  2 
ATOM 723  H H    . ARG A 1 14 ? 4.343   -2.153  -3.568  1.00 0.00 ? 14 ARG A H    2 
ATOM 724  H HA   . ARG A 1 14 ? 1.684   -2.434  -4.780  1.00 0.00 ? 14 ARG A HA   2 
ATOM 725  H HB2  . ARG A 1 14 ? 3.583   -2.834  -6.216  1.00 0.00 ? 14 ARG A HB2  2 
ATOM 726  H HB3  . ARG A 1 14 ? 4.252   -4.014  -5.087  1.00 0.00 ? 14 ARG A HB3  2 
ATOM 727  H HG2  . ARG A 1 14 ? 1.483   -4.579  -5.934  1.00 0.00 ? 14 ARG A HG2  2 
ATOM 728  H HG3  . ARG A 1 14 ? 2.672   -4.655  -7.236  1.00 0.00 ? 14 ARG A HG3  2 
ATOM 729  H HD2  . ARG A 1 14 ? 3.139   -6.025  -4.586  1.00 0.00 ? 14 ARG A HD2  2 
ATOM 730  H HD3  . ARG A 1 14 ? 2.271   -6.819  -5.899  1.00 0.00 ? 14 ARG A HD3  2 
ATOM 731  H HE   . ARG A 1 14 ? 5.013   -5.741  -6.371  1.00 0.00 ? 14 ARG A HE   2 
ATOM 732  H HH11 . ARG A 1 14 ? 4.498   -8.497  -4.994  1.00 0.00 ? 14 ARG A HH11 2 
ATOM 733  H HH12 . ARG A 1 14 ? 4.720   -9.549  -6.351  1.00 0.00 ? 14 ARG A HH12 2 
ATOM 734  H HH21 . ARG A 1 14 ? 4.527   -7.001  -8.695  1.00 0.00 ? 14 ARG A HH21 2 
ATOM 735  H HH22 . ARG A 1 14 ? 4.736   -8.702  -8.447  1.00 0.00 ? 14 ARG A HH22 2 
ATOM 736  N N    . LYS A 1 15 ? 2.698   -4.418  -2.403  1.00 0.00 ? 15 LYS A N    2 
ATOM 737  C CA   . LYS A 1 15 ? 2.230   -5.491  -1.494  1.00 0.00 ? 15 LYS A CA   2 
ATOM 738  C C    . LYS A 1 15 ? 1.253   -4.910  -0.468  1.00 0.00 ? 15 LYS A C    2 
ATOM 739  O O    . LYS A 1 15 ? 0.331   -5.569  -0.033  1.00 0.00 ? 15 LYS A O    2 
ATOM 740  C CB   . LYS A 1 15 ? 3.436   -6.085  -0.771  1.00 0.00 ? 15 LYS A CB   2 
ATOM 741  C CG   . LYS A 1 15 ? 4.260   -4.962  -0.141  1.00 0.00 ? 15 LYS A CG   2 
ATOM 742  C CD   . LYS A 1 15 ? 5.089   -5.528  1.014   1.00 0.00 ? 15 LYS A CD   2 
ATOM 743  C CE   . LYS A 1 15 ? 4.156   -6.003  2.131   1.00 0.00 ? 15 LYS A CE   2 
ATOM 744  N NZ   . LYS A 1 15 ? 3.176   -4.928  2.456   1.00 0.00 ? 15 LYS A NZ   2 
ATOM 745  H H    . LYS A 1 15 ? 3.542   -3.963  -2.218  1.00 0.00 ? 15 LYS A H    2 
ATOM 746  H HA   . LYS A 1 15 ? 1.737   -6.263  -2.067  1.00 0.00 ? 15 LYS A HA   2 
ATOM 747  H HB2  . LYS A 1 15 ? 3.094   -6.750  -0.003  1.00 0.00 ? 15 LYS A HB2  2 
ATOM 748  H HB3  . LYS A 1 15 ? 4.048   -6.629  -1.475  1.00 0.00 ? 15 LYS A HB3  2 
ATOM 749  H HG2  . LYS A 1 15 ? 4.918   -4.539  -0.885  1.00 0.00 ? 15 LYS A HG2  2 
ATOM 750  H HG3  . LYS A 1 15 ? 3.600   -4.196  0.234   1.00 0.00 ? 15 LYS A HG3  2 
ATOM 751  H HD2  . LYS A 1 15 ? 5.677   -6.361  0.657   1.00 0.00 ? 15 LYS A HD2  2 
ATOM 752  H HD3  . LYS A 1 15 ? 5.744   -4.761  1.396   1.00 0.00 ? 15 LYS A HD3  2 
ATOM 753  H HE2  . LYS A 1 15 ? 3.626   -6.887  1.807   1.00 0.00 ? 15 LYS A HE2  2 
ATOM 754  H HE3  . LYS A 1 15 ? 4.738   -6.236  3.010   1.00 0.00 ? 15 LYS A HE3  2 
ATOM 755  H HZ1  . LYS A 1 15 ? 3.652   -4.005  2.434   1.00 0.00 ? 15 LYS A HZ1  2 
ATOM 756  H HZ2  . LYS A 1 15 ? 2.404   -4.939  1.758   1.00 0.00 ? 15 LYS A HZ2  2 
ATOM 757  H HZ3  . LYS A 1 15 ? 2.786   -5.090  3.406   1.00 0.00 ? 15 LYS A HZ3  2 
ATOM 758  N N    . CYS A 1 16 ? 1.451   -3.681  -0.077  1.00 0.00 ? 16 CYS A N    2 
ATOM 759  C CA   . CYS A 1 16 ? 0.537   -3.057  0.922   1.00 0.00 ? 16 CYS A CA   2 
ATOM 760  C C    . CYS A 1 16 ? -0.918  -3.318  0.521   1.00 0.00 ? 16 CYS A C    2 
ATOM 761  O O    . CYS A 1 16 ? -1.703  -3.832  1.293   1.00 0.00 ? 16 CYS A O    2 
ATOM 762  C CB   . CYS A 1 16 ? 0.795   -1.552  0.967   1.00 0.00 ? 16 CYS A CB   2 
ATOM 763  S SG   . CYS A 1 16 ? -0.400  -0.764  2.073   1.00 0.00 ? 16 CYS A SG   2 
ATOM 764  H H    . CYS A 1 16 ? 2.203   -3.167  -0.440  1.00 0.00 ? 16 CYS A H    2 
ATOM 765  H HA   . CYS A 1 16 ? 0.724   -3.484  1.896   1.00 0.00 ? 16 CYS A HA   2 
ATOM 766  H HB2  . CYS A 1 16 ? 1.796   -1.369  1.329   1.00 0.00 ? 16 CYS A HB2  2 
ATOM 767  H HB3  . CYS A 1 16 ? 0.691   -1.140  -0.027  1.00 0.00 ? 16 CYS A HB3  2 
ATOM 768  N N    . ASP A 1 17 ? -1.283  -2.973  -0.684  1.00 0.00 ? 17 ASP A N    2 
ATOM 769  C CA   . ASP A 1 17 ? -2.684  -3.208  -1.139  1.00 0.00 ? 17 ASP A CA   2 
ATOM 770  C C    . ASP A 1 17 ? -3.123  -4.611  -0.716  1.00 0.00 ? 17 ASP A C    2 
ATOM 771  O O    . ASP A 1 17 ? -4.153  -4.798  -0.099  1.00 0.00 ? 17 ASP A O    2 
ATOM 772  C CB   . ASP A 1 17 ? -2.738  -3.125  -2.662  1.00 0.00 ? 17 ASP A CB   2 
ATOM 773  C CG   . ASP A 1 17 ? -4.196  -3.090  -3.121  1.00 0.00 ? 17 ASP A CG   2 
ATOM 774  O OD1  . ASP A 1 17 ? -5.045  -3.514  -2.356  1.00 0.00 ? 17 ASP A OD1  2 
ATOM 775  O OD2  . ASP A 1 17 ? -4.437  -2.633  -4.224  1.00 0.00 ? 17 ASP A OD2  2 
ATOM 776  H H    . ASP A 1 17 ? -0.633  -2.564  -1.293  1.00 0.00 ? 17 ASP A H    2 
ATOM 777  H HA   . ASP A 1 17 ? -3.346  -2.461  -0.708  1.00 0.00 ? 17 ASP A HA   2 
ATOM 778  H HB2  . ASP A 1 17 ? -2.231  -2.232  -2.992  1.00 0.00 ? 17 ASP A HB2  2 
ATOM 779  H HB3  . ASP A 1 17 ? -2.253  -3.990  -3.086  1.00 0.00 ? 17 ASP A HB3  2 
ATOM 780  N N    . ASP A 1 18 ? -2.344  -5.603  -1.059  1.00 0.00 ? 18 ASP A N    2 
ATOM 781  C CA   . ASP A 1 18 ? -2.698  -7.005  -0.696  1.00 0.00 ? 18 ASP A CA   2 
ATOM 782  C C    . ASP A 1 18 ? -3.063  -7.068  0.784   1.00 0.00 ? 18 ASP A C    2 
ATOM 783  O O    . ASP A 1 18 ? -4.027  -7.697  1.172   1.00 0.00 ? 18 ASP A O    2 
ATOM 784  C CB   . ASP A 1 18 ? -1.503  -7.922  -0.962  1.00 0.00 ? 18 ASP A CB   2 
ATOM 785  C CG   . ASP A 1 18 ? -1.904  -9.010  -1.960  1.00 0.00 ? 18 ASP A CG   2 
ATOM 786  O OD1  . ASP A 1 18 ? -2.797  -8.760  -2.752  1.00 0.00 ? 18 ASP A OD1  2 
ATOM 787  O OD2  . ASP A 1 18 ? -1.310  -10.075 -1.914  1.00 0.00 ? 18 ASP A OD2  2 
ATOM 788  H H    . ASP A 1 18 ? -1.522  -5.421  -1.560  1.00 0.00 ? 18 ASP A H    2 
ATOM 789  H HA   . ASP A 1 18 ? -3.541  -7.328  -1.289  1.00 0.00 ? 18 ASP A HA   2 
ATOM 790  H HB2  . ASP A 1 18 ? -0.688  -7.341  -1.369  1.00 0.00 ? 18 ASP A HB2  2 
ATOM 791  H HB3  . ASP A 1 18 ? -1.190  -8.383  -0.037  1.00 0.00 ? 18 ASP A HB3  2 
ATOM 792  N N    . CYS A 1 19 ? -2.300  -6.417  1.613   1.00 0.00 ? 19 CYS A N    2 
ATOM 793  C CA   . CYS A 1 19 ? -2.605  -6.429  3.070   1.00 0.00 ? 19 CYS A CA   2 
ATOM 794  C C    . CYS A 1 19 ? -4.078  -6.087  3.258   1.00 0.00 ? 19 CYS A C    2 
ATOM 795  O O    . CYS A 1 19 ? -4.794  -6.723  4.006   1.00 0.00 ? 19 CYS A O    2 
ATOM 796  C CB   . CYS A 1 19 ? -1.749  -5.377  3.775   1.00 0.00 ? 19 CYS A CB   2 
ATOM 797  S SG   . CYS A 1 19 ? -1.695  -5.730  5.548   1.00 0.00 ? 19 CYS A SG   2 
ATOM 798  H H    . CYS A 1 19 ? -1.529  -5.912  1.274   1.00 0.00 ? 19 CYS A H    2 
ATOM 799  H HA   . CYS A 1 19 ? -2.399  -7.406  3.481   1.00 0.00 ? 19 CYS A HA   2 
ATOM 800  H HB2  . CYS A 1 19 ? -0.749  -5.399  3.370   1.00 0.00 ? 19 CYS A HB2  2 
ATOM 801  H HB3  . CYS A 1 19 ? -2.178  -4.399  3.615   1.00 0.00 ? 19 CYS A HB3  2 
ATOM 802  N N    . CYS A 1 20 ? -4.526  -5.079  2.572   1.00 0.00 ? 20 CYS A N    2 
ATOM 803  C CA   . CYS A 1 20 ? -5.950  -4.662  2.680   1.00 0.00 ? 20 CYS A CA   2 
ATOM 804  C C    . CYS A 1 20 ? -6.860  -5.833  2.296   1.00 0.00 ? 20 CYS A C    2 
ATOM 805  O O    . CYS A 1 20 ? -7.898  -6.045  2.892   1.00 0.00 ? 20 CYS A O    2 
ATOM 806  C CB   . CYS A 1 20 ? -6.185  -3.487  1.733   1.00 0.00 ? 20 CYS A CB   2 
ATOM 807  S SG   . CYS A 1 20 ? -5.470  -1.993  2.460   1.00 0.00 ? 20 CYS A SG   2 
ATOM 808  H H    . CYS A 1 20 ? -3.918  -4.589  1.978   1.00 0.00 ? 20 CYS A H    2 
ATOM 809  H HA   . CYS A 1 20 ? -6.161  -4.357  3.693   1.00 0.00 ? 20 CYS A HA   2 
ATOM 810  H HB2  . CYS A 1 20 ? -5.709  -3.688  0.784   1.00 0.00 ? 20 CYS A HB2  2 
ATOM 811  H HB3  . CYS A 1 20 ? -7.244  -3.344  1.582   1.00 0.00 ? 20 CYS A HB3  2 
ATOM 812  N N    . GLY A 1 21 ? -6.481  -6.596  1.306   1.00 0.00 ? 21 GLY A N    2 
ATOM 813  C CA   . GLY A 1 21 ? -7.327  -7.753  0.890   1.00 0.00 ? 21 GLY A CA   2 
ATOM 814  C C    . GLY A 1 21 ? -6.865  -8.257  -0.477  1.00 0.00 ? 21 GLY A C    2 
ATOM 815  O O    . GLY A 1 21 ? -6.729  -9.444  -0.702  1.00 0.00 ? 21 GLY A O    2 
ATOM 816  H H    . GLY A 1 21 ? -5.642  -6.410  0.838   1.00 0.00 ? 21 GLY A H    2 
ATOM 817  H HA2  . GLY A 1 21 ? -7.236  -8.546  1.618   1.00 0.00 ? 21 GLY A HA2  2 
ATOM 818  H HA3  . GLY A 1 21 ? -8.358  -7.440  0.824   1.00 0.00 ? 21 GLY A HA3  2 
ATOM 819  N N    . GLY A 1 22 ? -6.622  -7.360  -1.392  1.00 0.00 ? 22 GLY A N    2 
ATOM 820  C CA   . GLY A 1 22 ? -6.167  -7.770  -2.748  1.00 0.00 ? 22 GLY A CA   2 
ATOM 821  C C    . GLY A 1 22 ? -5.910  -6.518  -3.585  1.00 0.00 ? 22 GLY A C    2 
ATOM 822  O O    . GLY A 1 22 ? -6.131  -5.411  -3.140  1.00 0.00 ? 22 GLY A O    2 
ATOM 823  H H    . GLY A 1 22 ? -6.737  -6.413  -1.186  1.00 0.00 ? 22 GLY A H    2 
ATOM 824  H HA2  . GLY A 1 22 ? -5.258  -8.346  -2.662  1.00 0.00 ? 22 GLY A HA2  2 
ATOM 825  H HA3  . GLY A 1 22 ? -6.931  -8.366  -3.221  1.00 0.00 ? 22 GLY A HA3  2 
ATOM 826  N N    . LYS A 1 23 ? -5.439  -6.673  -4.793  1.00 0.00 ? 23 LYS A N    2 
ATOM 827  C CA   . LYS A 1 23 ? -5.171  -5.476  -5.636  1.00 0.00 ? 23 LYS A CA   2 
ATOM 828  C C    . LYS A 1 23 ? -6.473  -4.696  -5.843  1.00 0.00 ? 23 LYS A C    2 
ATOM 829  O O    . LYS A 1 23 ? -7.549  -5.261  -5.873  1.00 0.00 ? 23 LYS A O    2 
ATOM 830  C CB   . LYS A 1 23 ? -4.590  -5.910  -6.991  1.00 0.00 ? 23 LYS A CB   2 
ATOM 831  C CG   . LYS A 1 23 ? -5.712  -6.323  -7.949  1.00 0.00 ? 23 LYS A CG   2 
ATOM 832  C CD   . LYS A 1 23 ? -5.121  -6.601  -9.332  1.00 0.00 ? 23 LYS A CD   2 
ATOM 833  C CE   . LYS A 1 23 ? -6.250  -6.860  -10.328 1.00 0.00 ? 23 LYS A CE   2 
ATOM 834  N NZ   . LYS A 1 23 ? -6.273  -8.306  -10.682 1.00 0.00 ? 23 LYS A NZ   2 
ATOM 835  H H    . LYS A 1 23 ? -5.261  -7.569  -5.140  1.00 0.00 ? 23 LYS A H    2 
ATOM 836  H HA   . LYS A 1 23 ? -4.458  -4.844  -5.130  1.00 0.00 ? 23 LYS A HA   2 
ATOM 837  H HB2  . LYS A 1 23 ? -4.039  -5.086  -7.421  1.00 0.00 ? 23 LYS A HB2  2 
ATOM 838  H HB3  . LYS A 1 23 ? -3.923  -6.746  -6.841  1.00 0.00 ? 23 LYS A HB3  2 
ATOM 839  H HG2  . LYS A 1 23 ? -6.196  -7.215  -7.576  1.00 0.00 ? 23 LYS A HG2  2 
ATOM 840  H HG3  . LYS A 1 23 ? -6.435  -5.524  -8.025  1.00 0.00 ? 23 LYS A HG3  2 
ATOM 841  H HD2  . LYS A 1 23 ? -4.543  -5.746  -9.654  1.00 0.00 ? 23 LYS A HD2  2 
ATOM 842  H HD3  . LYS A 1 23 ? -4.481  -7.470  -9.281  1.00 0.00 ? 23 LYS A HD3  2 
ATOM 843  H HE2  . LYS A 1 23 ? -7.194  -6.583  -9.883  1.00 0.00 ? 23 LYS A HE2  2 
ATOM 844  H HE3  . LYS A 1 23 ? -6.086  -6.273  -11.221 1.00 0.00 ? 23 LYS A HE3  2 
ATOM 845  H HZ1  . LYS A 1 23 ? -5.323  -8.601  -10.988 1.00 0.00 ? 23 LYS A HZ1  2 
ATOM 846  H HZ2  . LYS A 1 23 ? -6.559  -8.862  -9.851  1.00 0.00 ? 23 LYS A HZ2  2 
ATOM 847  H HZ3  . LYS A 1 23 ? -6.951  -8.465  -11.453 1.00 0.00 ? 23 LYS A HZ3  2 
ATOM 848  N N    . GLY A 1 24 ? -6.381  -3.403  -5.991  1.00 0.00 ? 24 GLY A N    2 
ATOM 849  C CA   . GLY A 1 24 ? -7.608  -2.585  -6.201  1.00 0.00 ? 24 GLY A CA   2 
ATOM 850  C C    . GLY A 1 24 ? -8.298  -2.317  -4.861  1.00 0.00 ? 24 GLY A C    2 
ATOM 851  O O    . GLY A 1 24 ? -9.425  -1.866  -4.817  1.00 0.00 ? 24 GLY A O    2 
ATOM 852  H H    . GLY A 1 24 ? -5.503  -2.971  -5.968  1.00 0.00 ? 24 GLY A H    2 
ATOM 853  H HA2  . GLY A 1 24 ? -7.335  -1.645  -6.659  1.00 0.00 ? 24 GLY A HA2  2 
ATOM 854  H HA3  . GLY A 1 24 ? -8.287  -3.117  -6.850  1.00 0.00 ? 24 GLY A HA3  2 
ATOM 855  N N    . ARG A 1 25 ? -7.640  -2.587  -3.764  1.00 0.00 ? 25 ARG A N    2 
ATOM 856  C CA   . ARG A 1 25 ? -8.284  -2.339  -2.439  1.00 0.00 ? 25 ARG A CA   2 
ATOM 857  C C    . ARG A 1 25 ? -7.220  -1.965  -1.407  1.00 0.00 ? 25 ARG A C    2 
ATOM 858  O O    . ARG A 1 25 ? -7.306  -2.338  -0.257  1.00 0.00 ? 25 ARG A O    2 
ATOM 859  C CB   . ARG A 1 25 ? -9.025  -3.598  -1.961  1.00 0.00 ? 25 ARG A CB   2 
ATOM 860  C CG   . ARG A 1 25 ? -9.114  -4.628  -3.091  1.00 0.00 ? 25 ARG A CG   2 
ATOM 861  C CD   . ARG A 1 25 ? -9.724  -5.924  -2.554  1.00 0.00 ? 25 ARG A CD   2 
ATOM 862  N NE   . ARG A 1 25 ? -11.210 -5.818  -2.586  1.00 0.00 ? 25 ARG A NE   2 
ATOM 863  C CZ   . ARG A 1 25 ? -11.922 -6.310  -1.608  1.00 0.00 ? 25 ARG A CZ   2 
ATOM 864  N NH1  . ARG A 1 25 ? -11.547 -7.411  -1.017  1.00 0.00 ? 25 ARG A NH1  2 
ATOM 865  N NH2  . ARG A 1 25 ? -13.010 -5.701  -1.224  1.00 0.00 ? 25 ARG A NH2  2 
ATOM 866  H H    . ARG A 1 25 ? -6.732  -2.951  -3.811  1.00 0.00 ? 25 ARG A H    2 
ATOM 867  H HA   . ARG A 1 25 ? -8.984  -1.526  -2.534  1.00 0.00 ? 25 ARG A HA   2 
ATOM 868  H HB2  . ARG A 1 25 ? -8.492  -4.029  -1.126  1.00 0.00 ? 25 ARG A HB2  2 
ATOM 869  H HB3  . ARG A 1 25 ? -10.022 -3.327  -1.646  1.00 0.00 ? 25 ARG A HB3  2 
ATOM 870  H HG2  . ARG A 1 25 ? -9.736  -4.239  -3.884  1.00 0.00 ? 25 ARG A HG2  2 
ATOM 871  H HG3  . ARG A 1 25 ? -8.125  -4.830  -3.475  1.00 0.00 ? 25 ARG A HG3  2 
ATOM 872  H HD2  . ARG A 1 25 ? -9.408  -6.753  -3.168  1.00 0.00 ? 25 ARG A HD2  2 
ATOM 873  H HD3  . ARG A 1 25 ? -9.396  -6.082  -1.538  1.00 0.00 ? 25 ARG A HD3  2 
ATOM 874  H HE   . ARG A 1 25 ? -11.653 -5.377  -3.341  1.00 0.00 ? 25 ARG A HE   2 
ATOM 875  H HH11 . ARG A 1 25 ? -10.713 -7.877  -1.310  1.00 0.00 ? 25 ARG A HH11 2 
ATOM 876  H HH12 . ARG A 1 25 ? -12.094 -7.787  -0.269  1.00 0.00 ? 25 ARG A HH12 2 
ATOM 877  H HH21 . ARG A 1 25 ? -13.297 -4.856  -1.677  1.00 0.00 ? 25 ARG A HH21 2 
ATOM 878  H HH22 . ARG A 1 25 ? -13.556 -6.077  -0.476  1.00 0.00 ? 25 ARG A HH22 2 
ATOM 879  N N    . GLY A 1 26 ? -6.223  -1.226  -1.805  1.00 0.00 ? 26 GLY A N    2 
ATOM 880  C CA   . GLY A 1 26 ? -5.162  -0.831  -0.836  1.00 0.00 ? 26 GLY A CA   2 
ATOM 881  C C    . GLY A 1 26 ? -3.959  -0.241  -1.576  1.00 0.00 ? 26 GLY A C    2 
ATOM 882  O O    . GLY A 1 26 ? -3.597  -0.675  -2.649  1.00 0.00 ? 26 GLY A O    2 
ATOM 883  H H    . GLY A 1 26 ? -6.175  -0.933  -2.730  1.00 0.00 ? 26 GLY A H    2 
ATOM 884  H HA2  . GLY A 1 26 ? -5.549  -0.100  -0.161  1.00 0.00 ? 26 GLY A HA2  2 
ATOM 885  H HA3  . GLY A 1 26 ? -4.859  -1.690  -0.278  1.00 0.00 ? 26 GLY A HA3  2 
ATOM 886  N N    . LYS A 1 27 ? -3.338  0.755   -1.007  1.00 0.00 ? 27 LYS A N    2 
ATOM 887  C CA   . LYS A 1 27 ? -2.160  1.380   -1.672  1.00 0.00 ? 27 LYS A CA   2 
ATOM 888  C C    . LYS A 1 27 ? -1.759  2.643   -0.909  1.00 0.00 ? 27 LYS A C    2 
ATOM 889  O O    . LYS A 1 27 ? -2.246  2.907   0.172   1.00 0.00 ? 27 LYS A O    2 
ATOM 890  C CB   . LYS A 1 27 ? -2.518  1.749   -3.112  1.00 0.00 ? 27 LYS A CB   2 
ATOM 891  C CG   . LYS A 1 27 ? -1.415  1.257   -4.051  1.00 0.00 ? 27 LYS A CG   2 
ATOM 892  C CD   . LYS A 1 27 ? -2.037  0.753   -5.355  1.00 0.00 ? 27 LYS A CD   2 
ATOM 893  C CE   . LYS A 1 27 ? -1.352  -0.547  -5.776  1.00 0.00 ? 27 LYS A CE   2 
ATOM 894  N NZ   . LYS A 1 27 ? 0.085   -0.279  -6.063  1.00 0.00 ? 27 LYS A NZ   2 
ATOM 895  H H    . LYS A 1 27 ? -3.648  1.094   -0.142  1.00 0.00 ? 27 LYS A H    2 
ATOM 896  H HA   . LYS A 1 27 ? -1.334  0.683   -1.673  1.00 0.00 ? 27 LYS A HA   2 
ATOM 897  H HB2  . LYS A 1 27 ? -3.456  1.287   -3.383  1.00 0.00 ? 27 LYS A HB2  2 
ATOM 898  H HB3  . LYS A 1 27 ? -2.607  2.822   -3.198  1.00 0.00 ? 27 LYS A HB3  2 
ATOM 899  H HG2  . LYS A 1 27 ? -0.736  2.070   -4.267  1.00 0.00 ? 27 LYS A HG2  2 
ATOM 900  H HG3  . LYS A 1 27 ? -0.873  0.451   -3.578  1.00 0.00 ? 27 LYS A HG3  2 
ATOM 901  H HD2  . LYS A 1 27 ? -3.093  0.574   -5.204  1.00 0.00 ? 27 LYS A HD2  2 
ATOM 902  H HD3  . LYS A 1 27 ? -1.904  1.495   -6.128  1.00 0.00 ? 27 LYS A HD3  2 
ATOM 903  H HE2  . LYS A 1 27 ? -1.431  -1.271  -4.978  1.00 0.00 ? 27 LYS A HE2  2 
ATOM 904  H HE3  . LYS A 1 27 ? -1.830  -0.935  -6.663  1.00 0.00 ? 27 LYS A HE3  2 
ATOM 905  H HZ1  . LYS A 1 27 ? 0.443   0.441   -5.403  1.00 0.00 ? 27 LYS A HZ1  2 
ATOM 906  H HZ2  . LYS A 1 27 ? 0.633   -1.155  -5.946  1.00 0.00 ? 27 LYS A HZ2  2 
ATOM 907  H HZ3  . LYS A 1 27 ? 0.186   0.064   -7.040  1.00 0.00 ? 27 LYS A HZ3  2 
ATOM 908  N N    . CYS A 1 28 ? -0.876  3.428   -1.465  1.00 0.00 ? 28 CYS A N    2 
ATOM 909  C CA   . CYS A 1 28 ? -0.447  4.675   -0.773  1.00 0.00 ? 28 CYS A CA   2 
ATOM 910  C C    . CYS A 1 28 ? -1.558  5.725   -0.875  1.00 0.00 ? 28 CYS A C    2 
ATOM 911  O O    . CYS A 1 28 ? -1.504  6.615   -1.699  1.00 0.00 ? 28 CYS A O    2 
ATOM 912  C CB   . CYS A 1 28 ? 0.820   5.217   -1.438  1.00 0.00 ? 28 CYS A CB   2 
ATOM 913  S SG   . CYS A 1 28 ? 1.969   3.854   -1.747  1.00 0.00 ? 28 CYS A SG   2 
ATOM 914  H H    . CYS A 1 28 ? -0.497  3.197   -2.338  1.00 0.00 ? 28 CYS A H    2 
ATOM 915  H HA   . CYS A 1 28 ? -0.241  4.459   0.266   1.00 0.00 ? 28 CYS A HA   2 
ATOM 916  H HB2  . CYS A 1 28 ? 0.562   5.691   -2.374  1.00 0.00 ? 28 CYS A HB2  2 
ATOM 917  H HB3  . CYS A 1 28 ? 1.288   5.941   -0.786  1.00 0.00 ? 28 CYS A HB3  2 
ATOM 918  N N    . TYR A 1 29 ? -2.566  5.635   -0.046  1.00 0.00 ? 29 TYR A N    2 
ATOM 919  C CA   . TYR A 1 29 ? -3.666  6.635   -0.107  1.00 0.00 ? 29 TYR A CA   2 
ATOM 920  C C    . TYR A 1 29 ? -3.434  7.696   0.968   1.00 0.00 ? 29 TYR A C    2 
ATOM 921  O O    . TYR A 1 29 ? -3.042  7.393   2.078   1.00 0.00 ? 29 TYR A O    2 
ATOM 922  C CB   . TYR A 1 29 ? -5.005  5.939   0.137   1.00 0.00 ? 29 TYR A CB   2 
ATOM 923  C CG   . TYR A 1 29 ? -5.324  5.034   -1.028  1.00 0.00 ? 29 TYR A CG   2 
ATOM 924  C CD1  . TYR A 1 29 ? -5.712  5.584   -2.255  1.00 0.00 ? 29 TYR A CD1  2 
ATOM 925  C CD2  . TYR A 1 29 ? -5.229  3.644   -0.884  1.00 0.00 ? 29 TYR A CD2  2 
ATOM 926  C CE1  . TYR A 1 29 ? -6.007  4.746   -3.338  1.00 0.00 ? 29 TYR A CE1  2 
ATOM 927  C CE2  . TYR A 1 29 ? -5.524  2.806   -1.966  1.00 0.00 ? 29 TYR A CE2  2 
ATOM 928  C CZ   . TYR A 1 29 ? -5.913  3.357   -3.192  1.00 0.00 ? 29 TYR A CZ   2 
ATOM 929  O OH   . TYR A 1 29 ? -6.203  2.532   -4.260  1.00 0.00 ? 29 TYR A OH   2 
ATOM 930  H H    . TYR A 1 29 ? -2.598  4.915   0.617   1.00 0.00 ? 29 TYR A H    2 
ATOM 931  H HA   . TYR A 1 29 ? -3.674  7.104   -1.080  1.00 0.00 ? 29 TYR A HA   2 
ATOM 932  H HB2  . TYR A 1 29 ? -4.948  5.354   1.043   1.00 0.00 ? 29 TYR A HB2  2 
ATOM 933  H HB3  . TYR A 1 29 ? -5.783  6.682   0.238   1.00 0.00 ? 29 TYR A HB3  2 
ATOM 934  H HD1  . TYR A 1 29 ? -5.786  6.655   -2.368  1.00 0.00 ? 29 TYR A HD1  2 
ATOM 935  H HD2  . TYR A 1 29 ? -4.929  3.219   0.062   1.00 0.00 ? 29 TYR A HD2  2 
ATOM 936  H HE1  . TYR A 1 29 ? -6.308  5.170   -4.284  1.00 0.00 ? 29 TYR A HE1  2 
ATOM 937  H HE2  . TYR A 1 29 ? -5.450  1.734   -1.855  1.00 0.00 ? 29 TYR A HE2  2 
ATOM 938  H HH   . TYR A 1 29 ? -6.636  3.061   -4.935  1.00 0.00 ? 29 TYR A HH   2 
ATOM 939  N N    . GLY A 1 30 ? -3.665  8.941   0.652   1.00 0.00 ? 30 GLY A N    2 
ATOM 940  C CA   . GLY A 1 30 ? -3.448  10.011  1.659   1.00 0.00 ? 30 GLY A CA   2 
ATOM 941  C C    . GLY A 1 30 ? -1.949  10.157  1.922   1.00 0.00 ? 30 GLY A C    2 
ATOM 942  O O    . GLY A 1 30 ? -1.150  10.113  1.007   1.00 0.00 ? 30 GLY A O    2 
ATOM 943  H H    . GLY A 1 30 ? -3.976  9.170   -0.245  1.00 0.00 ? 30 GLY A H    2 
ATOM 944  H HA2  . GLY A 1 30 ? -3.845  10.945  1.289   1.00 0.00 ? 30 GLY A HA2  2 
ATOM 945  H HA3  . GLY A 1 30 ? -3.946  9.745   2.575   1.00 0.00 ? 30 GLY A HA3  2 
ATOM 946  N N    . PRO A 1 31 ? -1.617  10.319  3.170   1.00 0.00 ? 31 PRO A N    2 
ATOM 947  C CA   . PRO A 1 31 ? -0.190  10.462  3.529   1.00 0.00 ? 31 PRO A CA   2 
ATOM 948  C C    . PRO A 1 31 ? 0.397   9.104   3.927   1.00 0.00 ? 31 PRO A C    2 
ATOM 949  O O    . PRO A 1 31 ? 1.544   9.003   4.314   1.00 0.00 ? 31 PRO A O    2 
ATOM 950  C CB   . PRO A 1 31 ? -0.190  11.422  4.720   1.00 0.00 ? 31 PRO A CB   2 
ATOM 951  C CG   . PRO A 1 31 ? -1.598  11.339  5.339   1.00 0.00 ? 31 PRO A CG   2 
ATOM 952  C CD   . PRO A 1 31 ? -2.525  10.796  4.238   1.00 0.00 ? 31 PRO A CD   2 
ATOM 953  H HA   . PRO A 1 31 ? 0.365   10.890  2.711   1.00 0.00 ? 31 PRO A HA   2 
ATOM 954  H HB2  . PRO A 1 31 ? 0.556   11.116  5.441   1.00 0.00 ? 31 PRO A HB2  2 
ATOM 955  H HB3  . PRO A 1 31 ? 0.002   12.430  4.387   1.00 0.00 ? 31 PRO A HB3  2 
ATOM 956  H HG2  . PRO A 1 31 ? -1.590  10.669  6.187   1.00 0.00 ? 31 PRO A HG2  2 
ATOM 957  H HG3  . PRO A 1 31 ? -1.928  12.320  5.642   1.00 0.00 ? 31 PRO A HG3  2 
ATOM 958  H HD2  . PRO A 1 31 ? -3.123  9.980   4.619   1.00 0.00 ? 31 PRO A HD2  2 
ATOM 959  H HD3  . PRO A 1 31 ? -3.159  11.583  3.860   1.00 0.00 ? 31 PRO A HD3  2 
ATOM 960  N N    . GLN A 1 32 ? -0.381  8.060   3.834   1.00 0.00 ? 32 GLN A N    2 
ATOM 961  C CA   . GLN A 1 32 ? 0.133   6.710   4.207   1.00 0.00 ? 32 GLN A CA   2 
ATOM 962  C C    . GLN A 1 32 ? -0.490  5.651   3.293   1.00 0.00 ? 32 GLN A C    2 
ATOM 963  O O    . GLN A 1 32 ? -0.965  5.949   2.215   1.00 0.00 ? 32 GLN A O    2 
ATOM 964  C CB   . GLN A 1 32 ? -0.236  6.413   5.662   1.00 0.00 ? 32 GLN A CB   2 
ATOM 965  C CG   . GLN A 1 32 ? 0.102   7.628   6.527   1.00 0.00 ? 32 GLN A CG   2 
ATOM 966  C CD   . GLN A 1 32 ? 0.367   7.178   7.965   1.00 0.00 ? 32 GLN A CD   2 
ATOM 967  O OE1  . GLN A 1 32 ? -0.538  7.123   8.774   1.00 0.00 ? 32 GLN A OE1  2 
ATOM 968  N NE2  . GLN A 1 32 ? 1.580   6.852   8.322   1.00 0.00 ? 32 GLN A NE2  2 
ATOM 969  H H    . GLN A 1 32 ? -1.303  8.163   3.520   1.00 0.00 ? 32 GLN A H    2 
ATOM 970  H HA   . GLN A 1 32 ? 1.207   6.693   4.097   1.00 0.00 ? 32 GLN A HA   2 
ATOM 971  H HB2  . GLN A 1 32 ? -1.294  6.203   5.729   1.00 0.00 ? 32 GLN A HB2  2 
ATOM 972  H HB3  . GLN A 1 32 ? 0.325   5.558   6.009   1.00 0.00 ? 32 GLN A HB3  2 
ATOM 973  H HG2  . GLN A 1 32 ? 0.982   8.116   6.134   1.00 0.00 ? 32 GLN A HG2  2 
ATOM 974  H HG3  . GLN A 1 32 ? -0.727  8.319   6.517   1.00 0.00 ? 32 GLN A HG3  2 
ATOM 975  H HE21 . GLN A 1 32 ? 2.311   6.896   7.669   1.00 0.00 ? 32 GLN A HE21 2 
ATOM 976  H HE22 . GLN A 1 32 ? 1.761   6.565   9.241   1.00 0.00 ? 32 GLN A HE22 2 
ATOM 977  N N    . CYS A 1 33 ? -0.490  4.413   3.715   1.00 0.00 ? 33 CYS A N    2 
ATOM 978  C CA   . CYS A 1 33 ? -1.079  3.335   2.870   1.00 0.00 ? 33 CYS A CA   2 
ATOM 979  C C    . CYS A 1 33 ? -2.390  2.850   3.493   1.00 0.00 ? 33 CYS A C    2 
ATOM 980  O O    . CYS A 1 33 ? -2.396  2.117   4.464   1.00 0.00 ? 33 CYS A O    2 
ATOM 981  C CB   . CYS A 1 33 ? -0.098  2.164   2.775   1.00 0.00 ? 33 CYS A CB   2 
ATOM 982  S SG   . CYS A 1 33 ? -0.545  1.122   1.365   1.00 0.00 ? 33 CYS A SG   2 
ATOM 983  H H    . CYS A 1 33 ? -0.099  4.194   4.587   1.00 0.00 ? 33 CYS A H    2 
ATOM 984  H HA   . CYS A 1 33 ? -1.272  3.721   1.880   1.00 0.00 ? 33 CYS A HA   2 
ATOM 985  H HB2  . CYS A 1 33 ? 0.904   2.544   2.639   1.00 0.00 ? 33 CYS A HB2  2 
ATOM 986  H HB3  . CYS A 1 33 ? -0.142  1.581   3.683   1.00 0.00 ? 33 CYS A HB3  2 
ATOM 987  N N    . LEU A 1 34 ? -3.502  3.254   2.939   1.00 0.00 ? 34 LEU A N    2 
ATOM 988  C CA   . LEU A 1 34 ? -4.812  2.818   3.497   1.00 0.00 ? 34 LEU A CA   2 
ATOM 989  C C    . LEU A 1 34 ? -5.474  1.827   2.535   1.00 0.00 ? 34 LEU A C    2 
ATOM 990  O O    . LEU A 1 34 ? -4.881  1.393   1.567   1.00 0.00 ? 34 LEU A O    2 
ATOM 991  C CB   . LEU A 1 34 ? -5.725  4.035   3.674   1.00 0.00 ? 34 LEU A CB   2 
ATOM 992  C CG   . LEU A 1 34 ? -4.902  5.236   4.144   1.00 0.00 ? 34 LEU A CG   2 
ATOM 993  C CD1  . LEU A 1 34 ? -5.728  6.514   3.982   1.00 0.00 ? 34 LEU A CD1  2 
ATOM 994  C CD2  . LEU A 1 34 ? -4.529  5.055   5.618   1.00 0.00 ? 34 LEU A CD2  2 
ATOM 995  H H    . LEU A 1 34 ? -3.475  3.843   2.156   1.00 0.00 ? 34 LEU A H    2 
ATOM 996  H HA   . LEU A 1 34 ? -4.657  2.343   4.454   1.00 0.00 ? 34 LEU A HA   2 
ATOM 997  H HB2  . LEU A 1 34 ? -6.195  4.270   2.731   1.00 0.00 ? 34 LEU A HB2  2 
ATOM 998  H HB3  . LEU A 1 34 ? -6.483  3.812   4.409   1.00 0.00 ? 34 LEU A HB3  2 
ATOM 999  H HG   . LEU A 1 34 ? -4.002  5.311   3.550   1.00 0.00 ? 34 LEU A HG   2 
ATOM 1000 H HD11 . LEU A 1 34 ? -6.476  6.364   3.217   1.00 0.00 ? 34 LEU A HD11 2 
ATOM 1001 H HD12 . LEU A 1 34 ? -6.212  6.751   4.918   1.00 0.00 ? 34 LEU A HD12 2 
ATOM 1002 H HD13 . LEU A 1 34 ? -5.078  7.329   3.696   1.00 0.00 ? 34 LEU A HD13 2 
ATOM 1003 H HD21 . LEU A 1 34 ? -5.411  4.785   6.182   1.00 0.00 ? 34 LEU A HD21 2 
ATOM 1004 H HD22 . LEU A 1 34 ? -3.790  4.273   5.710   1.00 0.00 ? 34 LEU A HD22 2 
ATOM 1005 H HD23 . LEU A 1 34 ? -4.125  5.980   6.002   1.00 0.00 ? 34 LEU A HD23 2 
ATOM 1006 N N    . CYS A 1 35 ? -6.701  1.466   2.797   1.00 0.00 ? 35 CYS A N    2 
ATOM 1007 C CA   . CYS A 1 35 ? -7.408  0.506   1.903   1.00 0.00 ? 35 CYS A CA   2 
ATOM 1008 C C    . CYS A 1 35 ? -8.457  1.255   1.078   1.00 0.00 ? 35 CYS A C    2 
ATOM 1009 O O    . CYS A 1 35 ? -8.736  2.413   1.319   1.00 0.00 ? 35 CYS A O    2 
ATOM 1010 C CB   . CYS A 1 35 ? -8.100  -0.556  2.758   1.00 0.00 ? 35 CYS A CB   2 
ATOM 1011 S SG   . CYS A 1 35 ? -6.865  -1.386  3.786   1.00 0.00 ? 35 CYS A SG   2 
ATOM 1012 H H    . CYS A 1 35 ? -7.158  1.831   3.584   1.00 0.00 ? 35 CYS A H    2 
ATOM 1013 H HA   . CYS A 1 35 ? -6.694  0.026   1.243   1.00 0.00 ? 35 CYS A HA   2 
ATOM 1014 H HB2  . CYS A 1 35 ? -8.838  -0.085  3.390   1.00 0.00 ? 35 CYS A HB2  2 
ATOM 1015 H HB3  . CYS A 1 35 ? -8.581  -1.279  2.116   1.00 0.00 ? 35 CYS A HB3  2 
ATOM 1016 N N    . ARG A 1 36 ? -9.043  0.605   0.109   1.00 0.00 ? 36 ARG A N    2 
ATOM 1017 C CA   . ARG A 1 36 ? -10.075 1.282   -0.727  1.00 0.00 ? 36 ARG A CA   2 
ATOM 1018 C C    . ARG A 1 36 ? -9.517  2.599   -1.267  1.00 0.00 ? 36 ARG A C    2 
ATOM 1019 O O    . ARG A 1 36 ? -9.537  3.574   -0.534  1.00 0.00 ? 36 ARG A O    2 
ATOM 1020 C CB   . ARG A 1 36 ? -11.317 1.562   0.124   1.00 0.00 ? 36 ARG A CB   2 
ATOM 1021 C CG   . ARG A 1 36 ? -12.215 0.324   0.135   1.00 0.00 ? 36 ARG A CG   2 
ATOM 1022 C CD   . ARG A 1 36 ? -12.653 0.019   1.570   1.00 0.00 ? 36 ARG A CD   2 
ATOM 1023 N NE   . ARG A 1 36 ? -14.030 0.545   1.793   1.00 0.00 ? 36 ARG A NE   2 
ATOM 1024 C CZ   . ARG A 1 36 ? -15.065 -0.200  1.518   1.00 0.00 ? 36 ARG A CZ   2 
ATOM 1025 N NH1  . ARG A 1 36 ? -15.375 -1.201  2.296   1.00 0.00 ? 36 ARG A NH1  2 
ATOM 1026 N NH2  . ARG A 1 36 ? -15.791 0.057   0.465   1.00 0.00 ? 36 ARG A NH2  2 
ATOM 1027 O OXT  . ARG A 1 36 ? -9.077  2.612   -2.405  1.00 0.00 ? 36 ARG A OXT  2 
ATOM 1028 H H    . ARG A 1 36 ? -8.804  -0.330  -0.068  1.00 0.00 ? 36 ARG A H    2 
ATOM 1029 H HA   . ARG A 1 36 ? -10.345 0.640   -1.554  1.00 0.00 ? 36 ARG A HA   2 
ATOM 1030 H HB2  . ARG A 1 36 ? -11.015 1.799   1.134   1.00 0.00 ? 36 ARG A HB2  2 
ATOM 1031 H HB3  . ARG A 1 36 ? -11.861 2.396   -0.295  1.00 0.00 ? 36 ARG A HB3  2 
ATOM 1032 H HG2  . ARG A 1 36 ? -13.087 0.506   -0.477  1.00 0.00 ? 36 ARG A HG2  2 
ATOM 1033 H HG3  . ARG A 1 36 ? -11.670 -0.520  -0.259  1.00 0.00 ? 36 ARG A HG3  2 
ATOM 1034 H HD2  . ARG A 1 36 ? -12.647 -1.049  1.728   1.00 0.00 ? 36 ARG A HD2  2 
ATOM 1035 H HD3  . ARG A 1 36 ? -11.971 0.490   2.262   1.00 0.00 ? 36 ARG A HD3  2 
ATOM 1036 H HE   . ARG A 1 36 ? -14.157 1.451   2.145   1.00 0.00 ? 36 ARG A HE   2 
ATOM 1037 H HH11 . ARG A 1 36 ? -14.820 -1.396  3.104   1.00 0.00 ? 36 ARG A HH11 2 
ATOM 1038 H HH12 . ARG A 1 36 ? -16.170 -1.771  2.085   1.00 0.00 ? 36 ARG A HH12 2 
ATOM 1039 H HH21 . ARG A 1 36 ? -15.554 0.824   -0.130  1.00 0.00 ? 36 ARG A HH21 2 
ATOM 1040 H HH22 . ARG A 1 36 ? -16.582 -0.516  0.251   1.00 0.00 ? 36 ARG A HH22 2 
ATOM 1041 N N    . MET A 1 1  ? -5.802  0.632   8.623   1.00 0.00 ? 1  MET A N    3 
ATOM 1042 C CA   . MET A 1 1  ? -4.576  1.185   7.982   1.00 0.00 ? 1  MET A CA   3 
ATOM 1043 C C    . MET A 1 1  ? -3.428  0.184   8.127   1.00 0.00 ? 1  MET A C    3 
ATOM 1044 O O    . MET A 1 1  ? -3.387  -0.599  9.055   1.00 0.00 ? 1  MET A O    3 
ATOM 1045 C CB   . MET A 1 1  ? -4.194  2.501   8.664   1.00 0.00 ? 1  MET A CB   3 
ATOM 1046 C CG   . MET A 1 1  ? -3.877  2.238   10.138  1.00 0.00 ? 1  MET A CG   3 
ATOM 1047 S SD   . MET A 1 1  ? -5.093  3.085   11.178  1.00 0.00 ? 1  MET A SD   3 
ATOM 1048 C CE   . MET A 1 1  ? -4.739  2.191   12.712  1.00 0.00 ? 1  MET A CE   3 
ATOM 1049 H H1   . MET A 1 1  ? -5.532  -0.105  9.307   1.00 0.00 ? 1  MET A H1   3 
ATOM 1050 H H2   . MET A 1 1  ? -6.311  1.393   9.115   1.00 0.00 ? 1  MET A H2   3 
ATOM 1051 H H3   . MET A 1 1  ? -6.420  0.220   7.895   1.00 0.00 ? 1  MET A H3   3 
ATOM 1052 H HA   . MET A 1 1  ? -4.768  1.365   6.934   1.00 0.00 ? 1  MET A HA   3 
ATOM 1053 H HB2  . MET A 1 1  ? -3.325  2.919   8.178   1.00 0.00 ? 1  MET A HB2  3 
ATOM 1054 H HB3  . MET A 1 1  ? -5.016  3.197   8.594   1.00 0.00 ? 1  MET A HB3  3 
ATOM 1055 H HG2  . MET A 1 1  ? -3.917  1.175   10.330  1.00 0.00 ? 1  MET A HG2  3 
ATOM 1056 H HG3  . MET A 1 1  ? -2.889  2.608   10.365  1.00 0.00 ? 1  MET A HG3  3 
ATOM 1057 H HE1  . MET A 1 1  ? -3.760  1.738   12.646  1.00 0.00 ? 1  MET A HE1  3 
ATOM 1058 H HE2  . MET A 1 1  ? -4.770  2.880   13.544  1.00 0.00 ? 1  MET A HE2  3 
ATOM 1059 H HE3  . MET A 1 1  ? -5.480  1.420   12.859  1.00 0.00 ? 1  MET A HE3  3 
ATOM 1060 N N    . CYS A 1 2  ? -2.493  0.201   7.215   1.00 0.00 ? 2  CYS A N    3 
ATOM 1061 C CA   . CYS A 1 2  ? -1.350  -0.750  7.300   1.00 0.00 ? 2  CYS A CA   3 
ATOM 1062 C C    . CYS A 1 2  ? -0.056  0.028   7.593   1.00 0.00 ? 2  CYS A C    3 
ATOM 1063 O O    . CYS A 1 2  ? 0.054   0.690   8.606   1.00 0.00 ? 2  CYS A O    3 
ATOM 1064 C CB   . CYS A 1 2  ? -1.237  -1.514  5.978   1.00 0.00 ? 2  CYS A CB   3 
ATOM 1065 S SG   . CYS A 1 2  ? -0.164  -2.955  6.199   1.00 0.00 ? 2  CYS A SG   3 
ATOM 1066 H H    . CYS A 1 2  ? -2.545  0.838   6.472   1.00 0.00 ? 2  CYS A H    3 
ATOM 1067 H HA   . CYS A 1 2  ? -1.530  -1.451  8.103   1.00 0.00 ? 2  CYS A HA   3 
ATOM 1068 H HB2  . CYS A 1 2  ? -2.218  -1.841  5.670   1.00 0.00 ? 2  CYS A HB2  3 
ATOM 1069 H HB3  . CYS A 1 2  ? -0.822  -0.867  5.219   1.00 0.00 ? 2  CYS A HB3  3 
ATOM 1070 N N    . MET A 1 3  ? 0.927   -0.044  6.731   1.00 0.00 ? 3  MET A N    3 
ATOM 1071 C CA   . MET A 1 3  ? 2.194   0.695   6.990   1.00 0.00 ? 3  MET A CA   3 
ATOM 1072 C C    . MET A 1 3  ? 2.229   1.965   6.125   1.00 0.00 ? 3  MET A C    3 
ATOM 1073 O O    . MET A 1 3  ? 1.195   2.478   5.744   1.00 0.00 ? 3  MET A O    3 
ATOM 1074 C CB   . MET A 1 3  ? 3.379   -0.229  6.661   1.00 0.00 ? 3  MET A CB   3 
ATOM 1075 C CG   . MET A 1 3  ? 3.739   -0.125  5.176   1.00 0.00 ? 3  MET A CG   3 
ATOM 1076 S SD   . MET A 1 3  ? 4.419   -1.700  4.610   1.00 0.00 ? 3  MET A SD   3 
ATOM 1077 C CE   . MET A 1 3  ? 3.658   -1.679  2.970   1.00 0.00 ? 3  MET A CE   3 
ATOM 1078 H H    . MET A 1 3  ? 0.838   -0.581  5.919   1.00 0.00 ? 3  MET A H    3 
ATOM 1079 H HA   . MET A 1 3  ? 2.236   0.973   8.033   1.00 0.00 ? 3  MET A HA   3 
ATOM 1080 H HB2  . MET A 1 3  ? 4.231   0.052   7.260   1.00 0.00 ? 3  MET A HB2  3 
ATOM 1081 H HB3  . MET A 1 3  ? 3.106   -1.248  6.888   1.00 0.00 ? 3  MET A HB3  3 
ATOM 1082 H HG2  . MET A 1 3  ? 2.851   0.109   4.606   1.00 0.00 ? 3  MET A HG2  3 
ATOM 1083 H HG3  . MET A 1 3  ? 4.472   0.653   5.033   1.00 0.00 ? 3  MET A HG3  3 
ATOM 1084 H HE1  . MET A 1 3  ? 3.899   -0.750  2.474   1.00 0.00 ? 3  MET A HE1  3 
ATOM 1085 H HE2  . MET A 1 3  ? 4.033   -2.512  2.390   1.00 0.00 ? 3  MET A HE2  3 
ATOM 1086 H HE3  . MET A 1 3  ? 2.587   -1.766  3.067   1.00 0.00 ? 3  MET A HE3  3 
ATOM 1087 N N    . PRO A 1 4  ? 3.419   2.432   5.842   1.00 0.00 ? 4  PRO A N    3 
ATOM 1088 C CA   . PRO A 1 4  ? 3.520   3.653   5.012   1.00 0.00 ? 4  PRO A CA   3 
ATOM 1089 C C    . PRO A 1 4  ? 4.057   3.311   3.621   1.00 0.00 ? 4  PRO A C    3 
ATOM 1090 O O    . PRO A 1 4  ? 4.012   2.175   3.188   1.00 0.00 ? 4  PRO A O    3 
ATOM 1091 C CB   . PRO A 1 4  ? 4.507   4.548   5.764   1.00 0.00 ? 4  PRO A CB   3 
ATOM 1092 C CG   . PRO A 1 4  ? 5.350   3.611   6.650   1.00 0.00 ? 4  PRO A CG   3 
ATOM 1093 C CD   . PRO A 1 4  ? 4.555   2.303   6.788   1.00 0.00 ? 4  PRO A CD   3 
ATOM 1094 H HA   . PRO A 1 4  ? 2.563   4.143   4.939   1.00 0.00 ? 4  PRO A HA   3 
ATOM 1095 H HB2  . PRO A 1 4  ? 5.142   5.072   5.062   1.00 0.00 ? 4  PRO A HB2  3 
ATOM 1096 H HB3  . PRO A 1 4  ? 3.975   5.253   6.384   1.00 0.00 ? 4  PRO A HB3  3 
ATOM 1097 H HG2  . PRO A 1 4  ? 6.305   3.420   6.179   1.00 0.00 ? 4  PRO A HG2  3 
ATOM 1098 H HG3  . PRO A 1 4  ? 5.495   4.053   7.622   1.00 0.00 ? 4  PRO A HG3  3 
ATOM 1099 H HD2  . PRO A 1 4  ? 5.178   1.461   6.520   1.00 0.00 ? 4  PRO A HD2  3 
ATOM 1100 H HD3  . PRO A 1 4  ? 4.187   2.192   7.797   1.00 0.00 ? 4  PRO A HD3  3 
ATOM 1101 N N    . CYS A 1 5  ? 4.562   4.286   2.915   1.00 0.00 ? 5  CYS A N    3 
ATOM 1102 C CA   . CYS A 1 5  ? 5.099   4.022   1.556   1.00 0.00 ? 5  CYS A CA   3 
ATOM 1103 C C    . CYS A 1 5  ? 6.079   5.130   1.166   1.00 0.00 ? 5  CYS A C    3 
ATOM 1104 O O    . CYS A 1 5  ? 6.301   6.066   1.909   1.00 0.00 ? 5  CYS A O    3 
ATOM 1105 C CB   . CYS A 1 5  ? 3.949   3.989   0.549   1.00 0.00 ? 5  CYS A CB   3 
ATOM 1106 S SG   . CYS A 1 5  ? 3.371   2.288   0.343   1.00 0.00 ? 5  CYS A SG   3 
ATOM 1107 H H    . CYS A 1 5  ? 4.589   5.188   3.281   1.00 0.00 ? 5  CYS A H    3 
ATOM 1108 H HA   . CYS A 1 5  ? 5.608   3.074   1.554   1.00 0.00 ? 5  CYS A HA   3 
ATOM 1109 H HB2  . CYS A 1 5  ? 3.139   4.604   0.912   1.00 0.00 ? 5  CYS A HB2  3 
ATOM 1110 H HB3  . CYS A 1 5  ? 4.292   4.370   -0.401  1.00 0.00 ? 5  CYS A HB3  3 
ATOM 1111 N N    . PHE A 1 6  ? 6.660   5.033   0.001   1.00 0.00 ? 6  PHE A N    3 
ATOM 1112 C CA   . PHE A 1 6  ? 7.620   6.082   -0.445  1.00 0.00 ? 6  PHE A CA   3 
ATOM 1113 C C    . PHE A 1 6  ? 7.017   6.845   -1.626  1.00 0.00 ? 6  PHE A C    3 
ATOM 1114 O O    . PHE A 1 6  ? 5.836   6.760   -1.896  1.00 0.00 ? 6  PHE A O    3 
ATOM 1115 C CB   . PHE A 1 6  ? 8.931   5.427   -0.884  1.00 0.00 ? 6  PHE A CB   3 
ATOM 1116 C CG   . PHE A 1 6  ? 9.473   4.566   0.232   1.00 0.00 ? 6  PHE A CG   3 
ATOM 1117 C CD1  . PHE A 1 6  ? 9.889   5.153   1.432   1.00 0.00 ? 6  PHE A CD1  3 
ATOM 1118 C CD2  . PHE A 1 6  ? 9.564   3.180   0.062   1.00 0.00 ? 6  PHE A CD2  3 
ATOM 1119 C CE1  . PHE A 1 6  ? 10.394  4.353   2.465   1.00 0.00 ? 6  PHE A CE1  3 
ATOM 1120 C CE2  . PHE A 1 6  ? 10.071  2.380   1.094   1.00 0.00 ? 6  PHE A CE2  3 
ATOM 1121 C CZ   . PHE A 1 6  ? 10.485  2.967   2.295   1.00 0.00 ? 6  PHE A CZ   3 
ATOM 1122 H H    . PHE A 1 6  ? 6.461   4.272   -0.583  1.00 0.00 ? 6  PHE A H    3 
ATOM 1123 H HA   . PHE A 1 6  ? 7.811   6.766   0.369   1.00 0.00 ? 6  PHE A HA   3 
ATOM 1124 H HB2  . PHE A 1 6  ? 8.752   4.815   -1.756  1.00 0.00 ? 6  PHE A HB2  3 
ATOM 1125 H HB3  . PHE A 1 6  ? 9.651   6.194   -1.126  1.00 0.00 ? 6  PHE A HB3  3 
ATOM 1126 H HD1  . PHE A 1 6  ? 9.818   6.223   1.564   1.00 0.00 ? 6  PHE A HD1  3 
ATOM 1127 H HD2  . PHE A 1 6  ? 9.246   2.726   -0.864  1.00 0.00 ? 6  PHE A HD2  3 
ATOM 1128 H HE1  . PHE A 1 6  ? 10.714  4.807   3.391   1.00 0.00 ? 6  PHE A HE1  3 
ATOM 1129 H HE2  . PHE A 1 6  ? 10.142  1.311   0.963   1.00 0.00 ? 6  PHE A HE2  3 
ATOM 1130 H HZ   . PHE A 1 6  ? 10.876  2.350   3.091   1.00 0.00 ? 6  PHE A HZ   3 
ATOM 1131 N N    . THR A 1 7  ? 7.824   7.583   -2.338  1.00 0.00 ? 7  THR A N    3 
ATOM 1132 C CA   . THR A 1 7  ? 7.301   8.345   -3.508  1.00 0.00 ? 7  THR A CA   3 
ATOM 1133 C C    . THR A 1 7  ? 7.873   7.745   -4.793  1.00 0.00 ? 7  THR A C    3 
ATOM 1134 O O    . THR A 1 7  ? 7.860   8.363   -5.840  1.00 0.00 ? 7  THR A O    3 
ATOM 1135 C CB   . THR A 1 7  ? 7.727   9.811   -3.396  1.00 0.00 ? 7  THR A CB   3 
ATOM 1136 O OG1  . THR A 1 7  ? 7.793   10.178  -2.025  1.00 0.00 ? 7  THR A OG1  3 
ATOM 1137 C CG2  . THR A 1 7  ? 6.712   10.699  -4.119  1.00 0.00 ? 7  THR A CG2  3 
ATOM 1138 H H    . THR A 1 7  ? 8.775   7.634   -2.106  1.00 0.00 ? 7  THR A H    3 
ATOM 1139 H HA   . THR A 1 7  ? 6.223   8.282   -3.528  1.00 0.00 ? 7  THR A HA   3 
ATOM 1140 H HB   . THR A 1 7  ? 8.698   9.939   -3.850  1.00 0.00 ? 7  THR A HB   3 
ATOM 1141 H HG1  . THR A 1 7  ? 6.894   10.243  -1.691  1.00 0.00 ? 7  THR A HG1  3 
ATOM 1142 H HG21 . THR A 1 7  ? 6.242   10.137  -4.912  1.00 0.00 ? 7  THR A HG21 3 
ATOM 1143 H HG22 . THR A 1 7  ? 5.960   11.030  -3.418  1.00 0.00 ? 7  THR A HG22 3 
ATOM 1144 H HG23 . THR A 1 7  ? 7.216   11.557  -4.536  1.00 0.00 ? 7  THR A HG23 3 
ATOM 1145 N N    . THR A 1 8  ? 8.380   6.545   -4.720  1.00 0.00 ? 8  THR A N    3 
ATOM 1146 C CA   . THR A 1 8  ? 8.960   5.900   -5.932  1.00 0.00 ? 8  THR A CA   3 
ATOM 1147 C C    . THR A 1 8  ? 8.902   4.378   -5.773  1.00 0.00 ? 8  THR A C    3 
ATOM 1148 O O    . THR A 1 8  ? 8.222   3.863   -4.908  1.00 0.00 ? 8  THR A O    3 
ATOM 1149 C CB   . THR A 1 8  ? 10.417  6.348   -6.090  1.00 0.00 ? 8  THR A CB   3 
ATOM 1150 O OG1  . THR A 1 8  ? 11.009  6.484   -4.807  1.00 0.00 ? 8  THR A OG1  3 
ATOM 1151 C CG2  . THR A 1 8  ? 10.467  7.691   -6.821  1.00 0.00 ? 8  THR A CG2  3 
ATOM 1152 H H    . THR A 1 8  ? 8.383   6.067   -3.864  1.00 0.00 ? 8  THR A H    3 
ATOM 1153 H HA   . THR A 1 8  ? 8.396   6.195   -6.804  1.00 0.00 ? 8  THR A HA   3 
ATOM 1154 H HB   . THR A 1 8  ? 10.963  5.613   -6.662  1.00 0.00 ? 8  THR A HB   3 
ATOM 1155 H HG1  . THR A 1 8  ? 11.873  6.886   -4.919  1.00 0.00 ? 8  THR A HG1  3 
ATOM 1156 H HG21 . THR A 1 8  ? 9.799   7.665   -7.669  1.00 0.00 ? 8  THR A HG21 3 
ATOM 1157 H HG22 . THR A 1 8  ? 10.164  8.478   -6.147  1.00 0.00 ? 8  THR A HG22 3 
ATOM 1158 H HG23 . THR A 1 8  ? 11.475  7.878   -7.162  1.00 0.00 ? 8  THR A HG23 3 
ATOM 1159 N N    . ASP A 1 9  ? 9.608   3.652   -6.598  1.00 0.00 ? 9  ASP A N    3 
ATOM 1160 C CA   . ASP A 1 9  ? 9.588   2.165   -6.489  1.00 0.00 ? 9  ASP A CA   3 
ATOM 1161 C C    . ASP A 1 9  ? 8.240   1.633   -6.978  1.00 0.00 ? 9  ASP A C    3 
ATOM 1162 O O    . ASP A 1 9  ? 7.267   2.357   -7.052  1.00 0.00 ? 9  ASP A O    3 
ATOM 1163 C CB   . ASP A 1 9  ? 9.801   1.752   -5.031  1.00 0.00 ? 9  ASP A CB   3 
ATOM 1164 C CG   . ASP A 1 9  ? 11.112  0.976   -4.906  1.00 0.00 ? 9  ASP A CG   3 
ATOM 1165 O OD1  . ASP A 1 9  ? 11.280  0.014   -5.639  1.00 0.00 ? 9  ASP A OD1  3 
ATOM 1166 O OD2  . ASP A 1 9  ? 11.926  1.355   -4.080  1.00 0.00 ? 9  ASP A OD2  3 
ATOM 1167 H H    . ASP A 1 9  ? 10.148  4.084   -7.291  1.00 0.00 ? 9  ASP A H    3 
ATOM 1168 H HA   . ASP A 1 9  ? 10.378  1.750   -7.096  1.00 0.00 ? 9  ASP A HA   3 
ATOM 1169 H HB2  . ASP A 1 9  ? 9.844   2.634   -4.408  1.00 0.00 ? 9  ASP A HB2  3 
ATOM 1170 H HB3  . ASP A 1 9  ? 8.982   1.125   -4.713  1.00 0.00 ? 9  ASP A HB3  3 
ATOM 1171 N N    . HIS A 1 10 ? 8.174   0.374   -7.316  1.00 0.00 ? 10 HIS A N    3 
ATOM 1172 C CA   . HIS A 1 10 ? 6.888   -0.199  -7.802  1.00 0.00 ? 10 HIS A CA   3 
ATOM 1173 C C    . HIS A 1 10 ? 6.464   -1.357  -6.894  1.00 0.00 ? 10 HIS A C    3 
ATOM 1174 O O    . HIS A 1 10 ? 5.296   -1.672  -6.780  1.00 0.00 ? 10 HIS A O    3 
ATOM 1175 C CB   . HIS A 1 10 ? 7.066   -0.710  -9.234  1.00 0.00 ? 10 HIS A CB   3 
ATOM 1176 C CG   . HIS A 1 10 ? 7.763   0.338   -10.058 1.00 0.00 ? 10 HIS A CG   3 
ATOM 1177 N ND1  . HIS A 1 10 ? 9.135   0.527   -10.008 1.00 0.00 ? 10 HIS A ND1  3 
ATOM 1178 C CD2  . HIS A 1 10 ? 7.291   1.260   -10.960 1.00 0.00 ? 10 HIS A CD2  3 
ATOM 1179 C CE1  . HIS A 1 10 ? 9.440   1.526   -10.857 1.00 0.00 ? 10 HIS A CE1  3 
ATOM 1180 N NE2  . HIS A 1 10 ? 8.351   2.009   -11.464 1.00 0.00 ? 10 HIS A NE2  3 
ATOM 1181 H H    . HIS A 1 10 ? 8.971   -0.193  -7.252  1.00 0.00 ? 10 HIS A H    3 
ATOM 1182 H HA   . HIS A 1 10 ? 6.125   0.566   -7.786  1.00 0.00 ? 10 HIS A HA   3 
ATOM 1183 H HB2  . HIS A 1 10 ? 7.660   -1.612  -9.222  1.00 0.00 ? 10 HIS A HB2  3 
ATOM 1184 H HB3  . HIS A 1 10 ? 6.099   -0.921  -9.664  1.00 0.00 ? 10 HIS A HB3  3 
ATOM 1185 H HD1  . HIS A 1 10 ? 9.769   0.025   -9.453  1.00 0.00 ? 10 HIS A HD1  3 
ATOM 1186 H HD2  . HIS A 1 10 ? 6.255   1.385   -11.238 1.00 0.00 ? 10 HIS A HD2  3 
ATOM 1187 H HE1  . HIS A 1 10 ? 10.442  1.890   -11.030 1.00 0.00 ? 10 HIS A HE1  3 
ATOM 1188 N N    . GLN A 1 11 ? 7.402   -1.994  -6.247  1.00 0.00 ? 11 GLN A N    3 
ATOM 1189 C CA   . GLN A 1 11 ? 7.047   -3.129  -5.349  1.00 0.00 ? 11 GLN A CA   3 
ATOM 1190 C C    . GLN A 1 11 ? 6.683   -2.591  -3.964  1.00 0.00 ? 11 GLN A C    3 
ATOM 1191 O O    . GLN A 1 11 ? 6.577   -3.332  -3.007  1.00 0.00 ? 11 GLN A O    3 
ATOM 1192 C CB   . GLN A 1 11 ? 8.239   -4.081  -5.229  1.00 0.00 ? 11 GLN A CB   3 
ATOM 1193 C CG   . GLN A 1 11 ? 7.953   -5.358  -6.019  1.00 0.00 ? 11 GLN A CG   3 
ATOM 1194 C CD   . GLN A 1 11 ? 8.174   -6.576  -5.119  1.00 0.00 ? 11 GLN A CD   3 
ATOM 1195 O OE1  . GLN A 1 11 ? 9.024   -7.400  -5.391  1.00 0.00 ? 11 GLN A OE1  3 
ATOM 1196 N NE2  . GLN A 1 11 ? 7.440   -6.724  -4.051  1.00 0.00 ? 11 GLN A NE2  3 
ATOM 1197 H H    . GLN A 1 11 ? 8.339   -1.725  -6.352  1.00 0.00 ? 11 GLN A H    3 
ATOM 1198 H HA   . GLN A 1 11 ? 6.202   -3.661  -5.761  1.00 0.00 ? 11 GLN A HA   3 
ATOM 1199 H HB2  . GLN A 1 11 ? 9.124   -3.602  -5.625  1.00 0.00 ? 11 GLN A HB2  3 
ATOM 1200 H HB3  . GLN A 1 11 ? 8.398   -4.330  -4.190  1.00 0.00 ? 11 GLN A HB3  3 
ATOM 1201 H HG2  . GLN A 1 11 ? 6.928   -5.345  -6.363  1.00 0.00 ? 11 GLN A HG2  3 
ATOM 1202 H HG3  . GLN A 1 11 ? 8.618   -5.414  -6.868  1.00 0.00 ? 11 GLN A HG3  3 
ATOM 1203 H HE21 . GLN A 1 11 ? 6.754   -6.058  -3.831  1.00 0.00 ? 11 GLN A HE21 3 
ATOM 1204 H HE22 . GLN A 1 11 ? 7.574   -7.500  -3.468  1.00 0.00 ? 11 GLN A HE22 3 
ATOM 1205 N N    . MET A 1 12 ? 6.489   -1.307  -3.849  1.00 0.00 ? 12 MET A N    3 
ATOM 1206 C CA   . MET A 1 12 ? 6.131   -0.724  -2.527  1.00 0.00 ? 12 MET A CA   3 
ATOM 1207 C C    . MET A 1 12 ? 4.641   -0.933  -2.271  1.00 0.00 ? 12 MET A C    3 
ATOM 1208 O O    . MET A 1 12 ? 4.245   -1.665  -1.386  1.00 0.00 ? 12 MET A O    3 
ATOM 1209 C CB   . MET A 1 12 ? 6.431   0.776   -2.537  1.00 0.00 ? 12 MET A CB   3 
ATOM 1210 C CG   . MET A 1 12 ? 6.413   1.323   -1.106  1.00 0.00 ? 12 MET A CG   3 
ATOM 1211 S SD   . MET A 1 12 ? 7.596   0.411   -0.082  1.00 0.00 ? 12 MET A SD   3 
ATOM 1212 C CE   . MET A 1 12 ? 6.424   -0.122  1.191   1.00 0.00 ? 12 MET A CE   3 
ATOM 1213 H H    . MET A 1 12 ? 6.578   -0.726  -4.634  1.00 0.00 ? 12 MET A H    3 
ATOM 1214 H HA   . MET A 1 12 ? 6.704   -1.206  -1.751  1.00 0.00 ? 12 MET A HA   3 
ATOM 1215 H HB2  . MET A 1 12 ? 7.400   0.944   -2.978  1.00 0.00 ? 12 MET A HB2  3 
ATOM 1216 H HB3  . MET A 1 12 ? 5.681   1.286   -3.122  1.00 0.00 ? 12 MET A HB3  3 
ATOM 1217 H HG2  . MET A 1 12 ? 6.682   2.369   -1.118  1.00 0.00 ? 12 MET A HG2  3 
ATOM 1218 H HG3  . MET A 1 12 ? 5.421   1.214   -0.692  1.00 0.00 ? 12 MET A HG3  3 
ATOM 1219 H HE1  . MET A 1 12 ? 5.894   0.733   1.576   1.00 0.00 ? 12 MET A HE1  3 
ATOM 1220 H HE2  . MET A 1 12 ? 5.717   -0.818  0.760   1.00 0.00 ? 12 MET A HE2  3 
ATOM 1221 H HE3  . MET A 1 12 ? 6.963   -0.602  1.997   1.00 0.00 ? 12 MET A HE3  3 
ATOM 1222 N N    . ALA A 1 13 ? 3.815   -0.284  -3.040  1.00 0.00 ? 13 ALA A N    3 
ATOM 1223 C CA   . ALA A 1 13 ? 2.343   -0.427  -2.853  1.00 0.00 ? 13 ALA A CA   3 
ATOM 1224 C C    . ALA A 1 13 ? 1.916   -1.869  -3.147  1.00 0.00 ? 13 ALA A C    3 
ATOM 1225 O O    . ALA A 1 13 ? 0.789   -2.249  -2.905  1.00 0.00 ? 13 ALA A O    3 
ATOM 1226 C CB   . ALA A 1 13 ? 1.617   0.521   -3.808  1.00 0.00 ? 13 ALA A CB   3 
ATOM 1227 H H    . ALA A 1 13 ? 4.167   0.305   -3.742  1.00 0.00 ? 13 ALA A H    3 
ATOM 1228 H HA   . ALA A 1 13 ? 2.086   -0.176  -1.835  1.00 0.00 ? 13 ALA A HA   3 
ATOM 1229 H HB1  . ALA A 1 13 ? 2.184   1.435   -3.907  1.00 0.00 ? 13 ALA A HB1  3 
ATOM 1230 H HB2  . ALA A 1 13 ? 1.520   0.051   -4.776  1.00 0.00 ? 13 ALA A HB2  3 
ATOM 1231 H HB3  . ALA A 1 13 ? 0.636   0.746   -3.417  1.00 0.00 ? 13 ALA A HB3  3 
ATOM 1232 N N    . ARG A 1 14 ? 2.798   -2.675  -3.670  1.00 0.00 ? 14 ARG A N    3 
ATOM 1233 C CA   . ARG A 1 14 ? 2.419   -4.084  -3.975  1.00 0.00 ? 14 ARG A CA   3 
ATOM 1234 C C    . ARG A 1 14 ? 2.187   -4.850  -2.669  1.00 0.00 ? 14 ARG A C    3 
ATOM 1235 O O    . ARG A 1 14 ? 1.420   -5.792  -2.620  1.00 0.00 ? 14 ARG A O    3 
ATOM 1236 C CB   . ARG A 1 14 ? 3.537   -4.759  -4.770  1.00 0.00 ? 14 ARG A CB   3 
ATOM 1237 C CG   . ARG A 1 14 ? 2.972   -5.973  -5.508  1.00 0.00 ? 14 ARG A CG   3 
ATOM 1238 C CD   . ARG A 1 14 ? 3.505   -7.255  -4.866  1.00 0.00 ? 14 ARG A CD   3 
ATOM 1239 N NE   . ARG A 1 14 ? 4.580   -7.829  -5.724  1.00 0.00 ? 14 ARG A NE   3 
ATOM 1240 C CZ   . ARG A 1 14 ? 4.277   -8.403  -6.855  1.00 0.00 ? 14 ARG A CZ   3 
ATOM 1241 N NH1  . ARG A 1 14 ? 3.892   -9.650  -6.870  1.00 0.00 ? 14 ARG A NH1  3 
ATOM 1242 N NH2  . ARG A 1 14 ? 4.358   -7.730  -7.970  1.00 0.00 ? 14 ARG A NH2  3 
ATOM 1243 H H    . ARG A 1 14 ? 3.704   -2.357  -3.865  1.00 0.00 ? 14 ARG A H    3 
ATOM 1244 H HA   . ARG A 1 14 ? 1.511   -4.092  -4.559  1.00 0.00 ? 14 ARG A HA   3 
ATOM 1245 H HB2  . ARG A 1 14 ? 3.944   -4.059  -5.485  1.00 0.00 ? 14 ARG A HB2  3 
ATOM 1246 H HB3  . ARG A 1 14 ? 4.316   -5.082  -4.096  1.00 0.00 ? 14 ARG A HB3  3 
ATOM 1247 H HG2  . ARG A 1 14 ? 1.892   -5.960  -5.445  1.00 0.00 ? 14 ARG A HG2  3 
ATOM 1248 H HG3  . ARG A 1 14 ? 3.273   -5.938  -6.545  1.00 0.00 ? 14 ARG A HG3  3 
ATOM 1249 H HD2  . ARG A 1 14 ? 3.907   -7.027  -3.890  1.00 0.00 ? 14 ARG A HD2  3 
ATOM 1250 H HD3  . ARG A 1 14 ? 2.702   -7.969  -4.768  1.00 0.00 ? 14 ARG A HD3  3 
ATOM 1251 H HE   . ARG A 1 14 ? 5.516   -7.775  -5.438  1.00 0.00 ? 14 ARG A HE   3 
ATOM 1252 H HH11 . ARG A 1 14 ? 3.831   -10.165 -6.015  1.00 0.00 ? 14 ARG A HH11 3 
ATOM 1253 H HH12 . ARG A 1 14 ? 3.662   -10.092 -7.737  1.00 0.00 ? 14 ARG A HH12 3 
ATOM 1254 H HH21 . ARG A 1 14 ? 4.653   -6.775  -7.958  1.00 0.00 ? 14 ARG A HH21 3 
ATOM 1255 H HH22 . ARG A 1 14 ? 4.123   -8.170  -8.838  1.00 0.00 ? 14 ARG A HH22 3 
ATOM 1256 N N    . LYS A 1 15 ? 2.840   -4.455  -1.611  1.00 0.00 ? 15 LYS A N    3 
ATOM 1257 C CA   . LYS A 1 15 ? 2.649   -5.167  -0.313  1.00 0.00 ? 15 LYS A CA   3 
ATOM 1258 C C    . LYS A 1 15 ? 1.589   -4.436  0.512   1.00 0.00 ? 15 LYS A C    3 
ATOM 1259 O O    . LYS A 1 15 ? 0.745   -5.048  1.136   1.00 0.00 ? 15 LYS A O    3 
ATOM 1260 C CB   . LYS A 1 15 ? 3.968   -5.213  0.483   1.00 0.00 ? 15 LYS A CB   3 
ATOM 1261 C CG   . LYS A 1 15 ? 5.123   -4.634  -0.345  1.00 0.00 ? 15 LYS A CG   3 
ATOM 1262 C CD   . LYS A 1 15 ? 6.431   -4.762  0.440   1.00 0.00 ? 15 LYS A CD   3 
ATOM 1263 C CE   . LYS A 1 15 ? 6.996   -3.367  0.725   1.00 0.00 ? 15 LYS A CE   3 
ATOM 1264 N NZ   . LYS A 1 15 ? 8.196   -3.487  1.602   1.00 0.00 ? 15 LYS A NZ   3 
ATOM 1265 H H    . LYS A 1 15 ? 3.452   -3.693  -1.669  1.00 0.00 ? 15 LYS A H    3 
ATOM 1266 H HA   . LYS A 1 15 ? 2.310   -6.174  -0.508  1.00 0.00 ? 15 LYS A HA   3 
ATOM 1267 H HB2  . LYS A 1 15 ? 3.856   -4.637  1.389   1.00 0.00 ? 15 LYS A HB2  3 
ATOM 1268 H HB3  . LYS A 1 15 ? 4.192   -6.238  0.737   1.00 0.00 ? 15 LYS A HB3  3 
ATOM 1269 H HG2  . LYS A 1 15 ? 5.207   -5.177  -1.275  1.00 0.00 ? 15 LYS A HG2  3 
ATOM 1270 H HG3  . LYS A 1 15 ? 4.932   -3.592  -0.552  1.00 0.00 ? 15 LYS A HG3  3 
ATOM 1271 H HD2  . LYS A 1 15 ? 6.243   -5.271  1.374   1.00 0.00 ? 15 LYS A HD2  3 
ATOM 1272 H HD3  . LYS A 1 15 ? 7.146   -5.325  -0.139  1.00 0.00 ? 15 LYS A HD3  3 
ATOM 1273 H HE2  . LYS A 1 15 ? 7.276   -2.895  -0.205  1.00 0.00 ? 15 LYS A HE2  3 
ATOM 1274 H HE3  . LYS A 1 15 ? 6.247   -2.769  1.222   1.00 0.00 ? 15 LYS A HE3  3 
ATOM 1275 H HZ1  . LYS A 1 15 ? 7.983   -4.121  2.396   1.00 0.00 ? 15 LYS A HZ1  3 
ATOM 1276 H HZ2  . LYS A 1 15 ? 8.989   -3.876  1.053   1.00 0.00 ? 15 LYS A HZ2  3 
ATOM 1277 H HZ3  . LYS A 1 15 ? 8.454   -2.546  1.965   1.00 0.00 ? 15 LYS A HZ3  3 
ATOM 1278 N N    . CYS A 1 16 ? 1.621   -3.133  0.517   1.00 0.00 ? 16 CYS A N    3 
ATOM 1279 C CA   . CYS A 1 16 ? 0.610   -2.368  1.297   1.00 0.00 ? 16 CYS A CA   3 
ATOM 1280 C C    . CYS A 1 16 ? -0.787  -2.714  0.775   1.00 0.00 ? 16 CYS A C    3 
ATOM 1281 O O    . CYS A 1 16 ? -1.670  -3.075  1.527   1.00 0.00 ? 16 CYS A O    3 
ATOM 1282 C CB   . CYS A 1 16 ? 0.868   -0.870  1.130   1.00 0.00 ? 16 CYS A CB   3 
ATOM 1283 S SG   . CYS A 1 16 ? 0.677   -0.046  2.728   1.00 0.00 ? 16 CYS A SG   3 
ATOM 1284 H H    . CYS A 1 16 ? 2.308   -2.657  0.004   1.00 0.00 ? 16 CYS A H    3 
ATOM 1285 H HA   . CYS A 1 16 ? 0.682   -2.636  2.342   1.00 0.00 ? 16 CYS A HA   3 
ATOM 1286 H HB2  . CYS A 1 16 ? 1.873   -0.717  0.764   1.00 0.00 ? 16 CYS A HB2  3 
ATOM 1287 H HB3  . CYS A 1 16 ? 0.162   -0.459  0.425   1.00 0.00 ? 16 CYS A HB3  3 
ATOM 1288 N N    . ASP A 1 17 ? -0.985  -2.620  -0.511  1.00 0.00 ? 17 ASP A N    3 
ATOM 1289 C CA   . ASP A 1 17 ? -2.315  -2.957  -1.090  1.00 0.00 ? 17 ASP A CA   3 
ATOM 1290 C C    . ASP A 1 17 ? -2.742  -4.330  -0.574  1.00 0.00 ? 17 ASP A C    3 
ATOM 1291 O O    . ASP A 1 17 ? -3.816  -4.498  -0.035  1.00 0.00 ? 17 ASP A O    3 
ATOM 1292 C CB   . ASP A 1 17 ? -2.205  -3.014  -2.613  1.00 0.00 ? 17 ASP A CB   3 
ATOM 1293 C CG   . ASP A 1 17 ? -3.600  -3.144  -3.222  1.00 0.00 ? 17 ASP A CG   3 
ATOM 1294 O OD1  . ASP A 1 17 ? -4.516  -3.476  -2.487  1.00 0.00 ? 17 ASP A OD1  3 
ATOM 1295 O OD2  . ASP A 1 17 ? -3.732  -2.910  -4.412  1.00 0.00 ? 17 ASP A OD2  3 
ATOM 1296 H H    . ASP A 1 17 ? -0.254  -2.337  -1.098  1.00 0.00 ? 17 ASP A H    3 
ATOM 1297 H HA   . ASP A 1 17 ? -3.046  -2.208  -0.801  1.00 0.00 ? 17 ASP A HA   3 
ATOM 1298 H HB2  . ASP A 1 17 ? -1.734  -2.114  -2.971  1.00 0.00 ? 17 ASP A HB2  3 
ATOM 1299 H HB3  . ASP A 1 17 ? -1.609  -3.869  -2.898  1.00 0.00 ? 17 ASP A HB3  3 
ATOM 1300 N N    . ASP A 1 18 ? -1.900  -5.313  -0.737  1.00 0.00 ? 18 ASP A N    3 
ATOM 1301 C CA   . ASP A 1 18 ? -2.251  -6.677  -0.253  1.00 0.00 ? 18 ASP A CA   3 
ATOM 1302 C C    . ASP A 1 18 ? -2.642  -6.592  1.223   1.00 0.00 ? 18 ASP A C    3 
ATOM 1303 O O    . ASP A 1 18 ? -3.511  -7.302  1.688   1.00 0.00 ? 18 ASP A O    3 
ATOM 1304 C CB   . ASP A 1 18 ? -1.045  -7.606  -0.409  1.00 0.00 ? 18 ASP A CB   3 
ATOM 1305 C CG   . ASP A 1 18 ? -1.145  -8.359  -1.736  1.00 0.00 ? 18 ASP A CG   3 
ATOM 1306 O OD1  . ASP A 1 18 ? -1.731  -7.818  -2.660  1.00 0.00 ? 18 ASP A OD1  3 
ATOM 1307 O OD2  . ASP A 1 18 ? -0.634  -9.464  -1.807  1.00 0.00 ? 18 ASP A OD2  3 
ATOM 1308 H H    . ASP A 1 18 ? -1.036  -5.150  -1.179  1.00 0.00 ? 18 ASP A H    3 
ATOM 1309 H HA   . ASP A 1 18 ? -3.081  -7.061  -0.826  1.00 0.00 ? 18 ASP A HA   3 
ATOM 1310 H HB2  . ASP A 1 18 ? -0.135  -7.021  -0.393  1.00 0.00 ? 18 ASP A HB2  3 
ATOM 1311 H HB3  . ASP A 1 18 ? -1.030  -8.315  0.405   1.00 0.00 ? 18 ASP A HB3  3 
ATOM 1312 N N    . CYS A 1 19 ? -2.010  -5.720  1.960   1.00 0.00 ? 19 CYS A N    3 
ATOM 1313 C CA   . CYS A 1 19 ? -2.348  -5.577  3.402   1.00 0.00 ? 19 CYS A CA   3 
ATOM 1314 C C    . CYS A 1 19 ? -3.864  -5.440  3.541   1.00 0.00 ? 19 CYS A C    3 
ATOM 1315 O O    . CYS A 1 19 ? -4.483  -6.042  4.397   1.00 0.00 ? 19 CYS A O    3 
ATOM 1316 C CB   . CYS A 1 19 ? -1.665  -4.323  3.958   1.00 0.00 ? 19 CYS A CB   3 
ATOM 1317 S SG   . CYS A 1 19 ? -1.341  -4.530  5.726   1.00 0.00 ? 19 CYS A SG   3 
ATOM 1318 H H    . CYS A 1 19 ? -1.320  -5.151  1.561   1.00 0.00 ? 19 CYS A H    3 
ATOM 1319 H HA   . CYS A 1 19 ? -2.009  -6.448  3.945   1.00 0.00 ? 19 CYS A HA   3 
ATOM 1320 H HB2  . CYS A 1 19 ? -0.731  -4.164  3.439   1.00 0.00 ? 19 CYS A HB2  3 
ATOM 1321 H HB3  . CYS A 1 19 ? -2.308  -3.468  3.809   1.00 0.00 ? 19 CYS A HB3  3 
ATOM 1322 N N    . CYS A 1 20 ? -4.463  -4.648  2.696   1.00 0.00 ? 20 CYS A N    3 
ATOM 1323 C CA   . CYS A 1 20 ? -5.938  -4.458  2.755   1.00 0.00 ? 20 CYS A CA   3 
ATOM 1324 C C    . CYS A 1 20 ? -6.648  -5.638  2.088   1.00 0.00 ? 20 CYS A C    3 
ATOM 1325 O O    . CYS A 1 20 ? -7.735  -6.016  2.478   1.00 0.00 ? 20 CYS A O    3 
ATOM 1326 C CB   . CYS A 1 20 ? -6.305  -3.162  2.030   1.00 0.00 ? 20 CYS A CB   3 
ATOM 1327 S SG   . CYS A 1 20 ? -6.318  -1.795  3.215   1.00 0.00 ? 20 CYS A SG   3 
ATOM 1328 H H    . CYS A 1 20 ? -3.936  -4.178  2.017   1.00 0.00 ? 20 CYS A H    3 
ATOM 1329 H HA   . CYS A 1 20 ? -6.249  -4.390  3.787   1.00 0.00 ? 20 CYS A HA   3 
ATOM 1330 H HB2  . CYS A 1 20 ? -5.574  -2.963  1.260   1.00 0.00 ? 20 CYS A HB2  3 
ATOM 1331 H HB3  . CYS A 1 20 ? -7.283  -3.261  1.581   1.00 0.00 ? 20 CYS A HB3  3 
ATOM 1332 N N    . GLY A 1 21 ? -6.050  -6.227  1.087   1.00 0.00 ? 21 GLY A N    3 
ATOM 1333 C CA   . GLY A 1 21 ? -6.709  -7.380  0.409   1.00 0.00 ? 21 GLY A CA   3 
ATOM 1334 C C    . GLY A 1 21 ? -5.861  -7.845  -0.776  1.00 0.00 ? 21 GLY A C    3 
ATOM 1335 O O    . GLY A 1 21 ? -5.323  -8.935  -0.774  1.00 0.00 ? 21 GLY A O    3 
ATOM 1336 H H    . GLY A 1 21 ? -5.175  -5.913  0.784   1.00 0.00 ? 21 GLY A H    3 
ATOM 1337 H HA2  . GLY A 1 21 ? -6.820  -8.190  1.113   1.00 0.00 ? 21 GLY A HA2  3 
ATOM 1338 H HA3  . GLY A 1 21 ? -7.682  -7.078  0.053   1.00 0.00 ? 21 GLY A HA3  3 
ATOM 1339 N N    . GLY A 1 22 ? -5.740  -7.035  -1.793  1.00 0.00 ? 22 GLY A N    3 
ATOM 1340 C CA   . GLY A 1 22 ? -4.930  -7.438  -2.973  1.00 0.00 ? 22 GLY A CA   3 
ATOM 1341 C C    . GLY A 1 22 ? -4.926  -6.310  -4.005  1.00 0.00 ? 22 GLY A C    3 
ATOM 1342 O O    . GLY A 1 22 ? -5.394  -5.218  -3.747  1.00 0.00 ? 22 GLY A O    3 
ATOM 1343 H H    . GLY A 1 22 ? -6.182  -6.163  -1.780  1.00 0.00 ? 22 GLY A H    3 
ATOM 1344 H HA2  . GLY A 1 22 ? -3.919  -7.644  -2.658  1.00 0.00 ? 22 GLY A HA2  3 
ATOM 1345 H HA3  . GLY A 1 22 ? -5.358  -8.324  -3.415  1.00 0.00 ? 22 GLY A HA3  3 
ATOM 1346 N N    . LYS A 1 23 ? -4.399  -6.563  -5.171  1.00 0.00 ? 23 LYS A N    3 
ATOM 1347 C CA   . LYS A 1 23 ? -4.362  -5.504  -6.218  1.00 0.00 ? 23 LYS A CA   3 
ATOM 1348 C C    . LYS A 1 23 ? -5.776  -4.978  -6.467  1.00 0.00 ? 23 LYS A C    3 
ATOM 1349 O O    . LYS A 1 23 ? -6.668  -5.716  -6.835  1.00 0.00 ? 23 LYS A O    3 
ATOM 1350 C CB   . LYS A 1 23 ? -3.799  -6.090  -7.514  1.00 0.00 ? 23 LYS A CB   3 
ATOM 1351 C CG   . LYS A 1 23 ? -2.420  -6.697  -7.245  1.00 0.00 ? 23 LYS A CG   3 
ATOM 1352 C CD   . LYS A 1 23 ? -2.076  -7.697  -8.351  1.00 0.00 ? 23 LYS A CD   3 
ATOM 1353 C CE   . LYS A 1 23 ? -2.903  -8.971  -8.164  1.00 0.00 ? 23 LYS A CE   3 
ATOM 1354 N NZ   . LYS A 1 23 ? -2.906  -9.752  -9.434  1.00 0.00 ? 23 LYS A NZ   3 
ATOM 1355 H H    . LYS A 1 23 ? -4.027  -7.449  -5.358  1.00 0.00 ? 23 LYS A H    3 
ATOM 1356 H HA   . LYS A 1 23 ? -3.731  -4.694  -5.886  1.00 0.00 ? 23 LYS A HA   3 
ATOM 1357 H HB2  . LYS A 1 23 ? -4.467  -6.856  -7.881  1.00 0.00 ? 23 LYS A HB2  3 
ATOM 1358 H HB3  . LYS A 1 23 ? -3.708  -5.307  -8.253  1.00 0.00 ? 23 LYS A HB3  3 
ATOM 1359 H HG2  . LYS A 1 23 ? -1.679  -5.912  -7.225  1.00 0.00 ? 23 LYS A HG2  3 
ATOM 1360 H HG3  . LYS A 1 23 ? -2.432  -7.206  -6.294  1.00 0.00 ? 23 LYS A HG3  3 
ATOM 1361 H HD2  . LYS A 1 23 ? -2.298  -7.261  -9.314  1.00 0.00 ? 23 LYS A HD2  3 
ATOM 1362 H HD3  . LYS A 1 23 ? -1.026  -7.942  -8.301  1.00 0.00 ? 23 LYS A HD3  3 
ATOM 1363 H HE2  . LYS A 1 23 ? -2.470  -9.569  -7.375  1.00 0.00 ? 23 LYS A HE2  3 
ATOM 1364 H HE3  . LYS A 1 23 ? -3.916  -8.708  -7.900  1.00 0.00 ? 23 LYS A HE3  3 
ATOM 1365 H HZ1  . LYS A 1 23 ? -2.536  -9.161  -10.205 1.00 0.00 ? 23 LYS A HZ1  3 
ATOM 1366 H HZ2  . LYS A 1 23 ? -2.307  -10.595 -9.323  1.00 0.00 ? 23 LYS A HZ2  3 
ATOM 1367 H HZ3  . LYS A 1 23 ? -3.879  -10.043 -9.659  1.00 0.00 ? 23 LYS A HZ3  3 
ATOM 1368 N N    . GLY A 1 24 ? -5.990  -3.705  -6.271  1.00 0.00 ? 24 GLY A N    3 
ATOM 1369 C CA   . GLY A 1 24 ? -7.347  -3.132  -6.501  1.00 0.00 ? 24 GLY A CA   3 
ATOM 1370 C C    . GLY A 1 24 ? -8.097  -3.032  -5.172  1.00 0.00 ? 24 GLY A C    3 
ATOM 1371 O O    . GLY A 1 24 ? -9.286  -2.787  -5.138  1.00 0.00 ? 24 GLY A O    3 
ATOM 1372 H H    . GLY A 1 24 ? -5.257  -3.124  -5.977  1.00 0.00 ? 24 GLY A H    3 
ATOM 1373 H HA2  . GLY A 1 24 ? -7.252  -2.147  -6.938  1.00 0.00 ? 24 GLY A HA2  3 
ATOM 1374 H HA3  . GLY A 1 24 ? -7.898  -3.772  -7.173  1.00 0.00 ? 24 GLY A HA3  3 
ATOM 1375 N N    . ARG A 1 25 ? -7.413  -3.215  -4.074  1.00 0.00 ? 25 ARG A N    3 
ATOM 1376 C CA   . ARG A 1 25 ? -8.094  -3.125  -2.750  1.00 0.00 ? 25 ARG A CA   3 
ATOM 1377 C C    . ARG A 1 25 ? -7.107  -2.615  -1.700  1.00 0.00 ? 25 ARG A C    3 
ATOM 1378 O O    . ARG A 1 25 ? -7.109  -3.057  -0.569  1.00 0.00 ? 25 ARG A O    3 
ATOM 1379 C CB   . ARG A 1 25 ? -8.601  -4.509  -2.334  1.00 0.00 ? 25 ARG A CB   3 
ATOM 1380 C CG   . ARG A 1 25 ? -9.697  -4.975  -3.295  1.00 0.00 ? 25 ARG A CG   3 
ATOM 1381 C CD   . ARG A 1 25 ? -9.979  -6.462  -3.059  1.00 0.00 ? 25 ARG A CD   3 
ATOM 1382 N NE   . ARG A 1 25 ? -11.156 -6.885  -3.871  1.00 0.00 ? 25 ARG A NE   3 
ATOM 1383 C CZ   . ARG A 1 25 ? -11.900 -7.880  -3.472  1.00 0.00 ? 25 ARG A CZ   3 
ATOM 1384 N NH1  . ARG A 1 25 ? -11.345 -8.994  -3.082  1.00 0.00 ? 25 ARG A NH1  3 
ATOM 1385 N NH2  . ARG A 1 25 ? -13.200 -7.760  -3.463  1.00 0.00 ? 25 ARG A NH2  3 
ATOM 1386 H H    . ARG A 1 25 ? -6.454  -3.409  -4.121  1.00 0.00 ? 25 ARG A H    3 
ATOM 1387 H HA   . ARG A 1 25 ? -8.924  -2.441  -2.822  1.00 0.00 ? 25 ARG A HA   3 
ATOM 1388 H HB2  . ARG A 1 25 ? -7.781  -5.212  -2.356  1.00 0.00 ? 25 ARG A HB2  3 
ATOM 1389 H HB3  . ARG A 1 25 ? -9.002  -4.457  -1.333  1.00 0.00 ? 25 ARG A HB3  3 
ATOM 1390 H HG2  . ARG A 1 25 ? -10.597 -4.402  -3.119  1.00 0.00 ? 25 ARG A HG2  3 
ATOM 1391 H HG3  . ARG A 1 25 ? -9.370  -4.830  -4.314  1.00 0.00 ? 25 ARG A HG3  3 
ATOM 1392 H HD2  . ARG A 1 25 ? -9.115  -7.041  -3.349  1.00 0.00 ? 25 ARG A HD2  3 
ATOM 1393 H HD3  . ARG A 1 25 ? -10.187 -6.626  -2.011  1.00 0.00 ? 25 ARG A HD3  3 
ATOM 1394 H HE   . ARG A 1 25 ? -11.369 -6.416  -4.706  1.00 0.00 ? 25 ARG A HE   3 
ATOM 1395 H HH11 . ARG A 1 25 ? -10.350 -9.087  -3.087  1.00 0.00 ? 25 ARG A HH11 3 
ATOM 1396 H HH12 . ARG A 1 25 ? -11.916 -9.757  -2.777  1.00 0.00 ? 25 ARG A HH12 3 
ATOM 1397 H HH21 . ARG A 1 25 ? -13.624 -6.904  -3.762  1.00 0.00 ? 25 ARG A HH21 3 
ATOM 1398 H HH22 . ARG A 1 25 ? -13.770 -8.522  -3.158  1.00 0.00 ? 25 ARG A HH22 3 
ATOM 1399 N N    . GLY A 1 26 ? -6.265  -1.690  -2.064  1.00 0.00 ? 26 GLY A N    3 
ATOM 1400 C CA   . GLY A 1 26 ? -5.278  -1.157  -1.086  1.00 0.00 ? 26 GLY A CA   3 
ATOM 1401 C C    . GLY A 1 26 ? -4.248  -0.276  -1.793  1.00 0.00 ? 26 GLY A C    3 
ATOM 1402 O O    . GLY A 1 26 ? -3.719  -0.621  -2.830  1.00 0.00 ? 26 GLY A O    3 
ATOM 1403 H H    . GLY A 1 26 ? -6.282  -1.350  -2.977  1.00 0.00 ? 26 GLY A H    3 
ATOM 1404 H HA2  . GLY A 1 26 ? -5.785  -0.572  -0.349  1.00 0.00 ? 26 GLY A HA2  3 
ATOM 1405 H HA3  . GLY A 1 26 ? -4.785  -1.973  -0.602  1.00 0.00 ? 26 GLY A HA3  3 
ATOM 1406 N N    . LYS A 1 27 ? -3.964  0.869   -1.231  1.00 0.00 ? 27 LYS A N    3 
ATOM 1407 C CA   . LYS A 1 27 ? -2.973  1.789   -1.852  1.00 0.00 ? 27 LYS A CA   3 
ATOM 1408 C C    . LYS A 1 27 ? -2.437  2.744   -0.784  1.00 0.00 ? 27 LYS A C    3 
ATOM 1409 O O    . LYS A 1 27 ? -3.127  3.089   0.154   1.00 0.00 ? 27 LYS A O    3 
ATOM 1410 C CB   . LYS A 1 27 ? -3.650  2.596   -2.963  1.00 0.00 ? 27 LYS A CB   3 
ATOM 1411 C CG   . LYS A 1 27 ? -2.669  3.634   -3.511  1.00 0.00 ? 27 LYS A CG   3 
ATOM 1412 C CD   . LYS A 1 27 ? -3.291  4.336   -4.720  1.00 0.00 ? 27 LYS A CD   3 
ATOM 1413 C CE   . LYS A 1 27 ? -2.413  5.518   -5.135  1.00 0.00 ? 27 LYS A CE   3 
ATOM 1414 N NZ   . LYS A 1 27 ? -1.334  5.039   -6.044  1.00 0.00 ? 27 LYS A NZ   3 
ATOM 1415 H H    . LYS A 1 27 ? -4.407  1.124   -0.394  1.00 0.00 ? 27 LYS A H    3 
ATOM 1416 H HA   . LYS A 1 27 ? -2.157  1.215   -2.267  1.00 0.00 ? 27 LYS A HA   3 
ATOM 1417 H HB2  . LYS A 1 27 ? -3.952  1.928   -3.758  1.00 0.00 ? 27 LYS A HB2  3 
ATOM 1418 H HB3  . LYS A 1 27 ? -4.519  3.099   -2.564  1.00 0.00 ? 27 LYS A HB3  3 
ATOM 1419 H HG2  . LYS A 1 27 ? -2.449  4.362   -2.744  1.00 0.00 ? 27 LYS A HG2  3 
ATOM 1420 H HG3  . LYS A 1 27 ? -1.756  3.142   -3.814  1.00 0.00 ? 27 LYS A HG3  3 
ATOM 1421 H HD2  . LYS A 1 27 ? -3.369  3.638   -5.540  1.00 0.00 ? 27 LYS A HD2  3 
ATOM 1422 H HD3  . LYS A 1 27 ? -4.275  4.696   -4.460  1.00 0.00 ? 27 LYS A HD3  3 
ATOM 1423 H HE2  . LYS A 1 27 ? -3.016  6.252   -5.647  1.00 0.00 ? 27 LYS A HE2  3 
ATOM 1424 H HE3  . LYS A 1 27 ? -1.972  5.964   -4.256  1.00 0.00 ? 27 LYS A HE3  3 
ATOM 1425 H HZ1  . LYS A 1 27 ? -1.481  4.033   -6.259  1.00 0.00 ? 27 LYS A HZ1  3 
ATOM 1426 H HZ2  . LYS A 1 27 ? -1.357  5.590   -6.928  1.00 0.00 ? 27 LYS A HZ2  3 
ATOM 1427 H HZ3  . LYS A 1 27 ? -0.411  5.161   -5.582  1.00 0.00 ? 27 LYS A HZ3  3 
ATOM 1428 N N    . CYS A 1 28 ? -1.211  3.172   -0.914  1.00 0.00 ? 28 CYS A N    3 
ATOM 1429 C CA   . CYS A 1 28 ? -0.638  4.101   0.098   1.00 0.00 ? 28 CYS A CA   3 
ATOM 1430 C C    . CYS A 1 28 ? -1.065  5.537   -0.222  1.00 0.00 ? 28 CYS A C    3 
ATOM 1431 O O    . CYS A 1 28 ? -0.300  6.319   -0.750  1.00 0.00 ? 28 CYS A O    3 
ATOM 1432 C CB   . CYS A 1 28 ? 0.887   4.002   0.074   1.00 0.00 ? 28 CYS A CB   3 
ATOM 1433 S SG   . CYS A 1 28 ? 1.391   2.391   0.730   1.00 0.00 ? 28 CYS A SG   3 
ATOM 1434 H H    . CYS A 1 28 ? -0.668  2.881   -1.677  1.00 0.00 ? 28 CYS A H    3 
ATOM 1435 H HA   . CYS A 1 28 ? -0.996  3.829   1.079   1.00 0.00 ? 28 CYS A HA   3 
ATOM 1436 H HB2  . CYS A 1 28 ? 1.240   4.104   -0.942  1.00 0.00 ? 28 CYS A HB2  3 
ATOM 1437 H HB3  . CYS A 1 28 ? 1.308   4.787   0.683   1.00 0.00 ? 28 CYS A HB3  3 
ATOM 1438 N N    . TYR A 1 29 ? -2.284  5.894   0.093   1.00 0.00 ? 29 TYR A N    3 
ATOM 1439 C CA   . TYR A 1 29 ? -2.755  7.279   -0.196  1.00 0.00 ? 29 TYR A CA   3 
ATOM 1440 C C    . TYR A 1 29 ? -1.944  8.272   0.636   1.00 0.00 ? 29 TYR A C    3 
ATOM 1441 O O    . TYR A 1 29 ? -2.031  8.296   1.847   1.00 0.00 ? 29 TYR A O    3 
ATOM 1442 C CB   . TYR A 1 29 ? -4.234  7.401   0.174   1.00 0.00 ? 29 TYR A CB   3 
ATOM 1443 C CG   . TYR A 1 29 ? -5.058  6.524   -0.737  1.00 0.00 ? 29 TYR A CG   3 
ATOM 1444 C CD1  . TYR A 1 29 ? -4.948  6.658   -2.126  1.00 0.00 ? 29 TYR A CD1  3 
ATOM 1445 C CD2  . TYR A 1 29 ? -5.933  5.577   -0.192  1.00 0.00 ? 29 TYR A CD2  3 
ATOM 1446 C CE1  . TYR A 1 29 ? -5.712  5.846   -2.971  1.00 0.00 ? 29 TYR A CE1  3 
ATOM 1447 C CE2  . TYR A 1 29 ? -6.697  4.763   -1.037  1.00 0.00 ? 29 TYR A CE2  3 
ATOM 1448 C CZ   . TYR A 1 29 ? -6.587  4.897   -2.426  1.00 0.00 ? 29 TYR A CZ   3 
ATOM 1449 O OH   . TYR A 1 29 ? -7.340  4.094   -3.259  1.00 0.00 ? 29 TYR A OH   3 
ATOM 1450 H H    . TYR A 1 29 ? -2.890  5.253   0.519   1.00 0.00 ? 29 TYR A H    3 
ATOM 1451 H HA   . TYR A 1 29 ? -2.625  7.494   -1.246  1.00 0.00 ? 29 TYR A HA   3 
ATOM 1452 H HB2  . TYR A 1 29 ? -4.376  7.088   1.199   1.00 0.00 ? 29 TYR A HB2  3 
ATOM 1453 H HB3  . TYR A 1 29 ? -4.549  8.428   0.065   1.00 0.00 ? 29 TYR A HB3  3 
ATOM 1454 H HD1  . TYR A 1 29 ? -4.272  7.390   -2.546  1.00 0.00 ? 29 TYR A HD1  3 
ATOM 1455 H HD2  . TYR A 1 29 ? -6.017  5.473   0.880   1.00 0.00 ? 29 TYR A HD2  3 
ATOM 1456 H HE1  . TYR A 1 29 ? -5.628  5.949   -4.042  1.00 0.00 ? 29 TYR A HE1  3 
ATOM 1457 H HE2  . TYR A 1 29 ? -7.372  4.032   -0.617  1.00 0.00 ? 29 TYR A HE2  3 
ATOM 1458 H HH   . TYR A 1 29 ? -8.247  4.412   -3.237  1.00 0.00 ? 29 TYR A HH   3 
ATOM 1459 N N    . GLY A 1 30 ? -1.158  9.096   -0.002  1.00 0.00 ? 30 GLY A N    3 
ATOM 1460 C CA   . GLY A 1 30 ? -0.347  10.086  0.761   1.00 0.00 ? 30 GLY A CA   3 
ATOM 1461 C C    . GLY A 1 30 ? 0.490   9.356   1.810   1.00 0.00 ? 30 GLY A C    3 
ATOM 1462 O O    . GLY A 1 30 ? 1.018   8.292   1.556   1.00 0.00 ? 30 GLY A O    3 
ATOM 1463 H H    . GLY A 1 30 ? -1.101  9.065   -0.978  1.00 0.00 ? 30 GLY A H    3 
ATOM 1464 H HA2  . GLY A 1 30 ? 0.303   10.619  0.086   1.00 0.00 ? 30 GLY A HA2  3 
ATOM 1465 H HA3  . GLY A 1 30 ? -1.004  10.784  1.254   1.00 0.00 ? 30 GLY A HA3  3 
ATOM 1466 N N    . PRO A 1 31 ? 0.576   9.956   2.964   1.00 0.00 ? 31 PRO A N    3 
ATOM 1467 C CA   . PRO A 1 31 ? 1.359   9.328   4.050   1.00 0.00 ? 31 PRO A CA   3 
ATOM 1468 C C    . PRO A 1 31 ? 0.479   8.361   4.847   1.00 0.00 ? 31 PRO A C    3 
ATOM 1469 O O    . PRO A 1 31 ? 0.620   8.223   6.046   1.00 0.00 ? 31 PRO A O    3 
ATOM 1470 C CB   . PRO A 1 31 ? 1.803   10.500  4.927   1.00 0.00 ? 31 PRO A CB   3 
ATOM 1471 C CG   . PRO A 1 31 ? 0.808   11.643  4.649   1.00 0.00 ? 31 PRO A CG   3 
ATOM 1472 C CD   . PRO A 1 31 ? 0.184   11.350  3.275   1.00 0.00 ? 31 PRO A CD   3 
ATOM 1473 H HA   . PRO A 1 31 ? 2.221   8.819   3.651   1.00 0.00 ? 31 PRO A HA   3 
ATOM 1474 H HB2  . PRO A 1 31 ? 1.770   10.216  5.971   1.00 0.00 ? 31 PRO A HB2  3 
ATOM 1475 H HB3  . PRO A 1 31 ? 2.800   10.811  4.656   1.00 0.00 ? 31 PRO A HB3  3 
ATOM 1476 H HG2  . PRO A 1 31 ? 0.043   11.659  5.413   1.00 0.00 ? 31 PRO A HG2  3 
ATOM 1477 H HG3  . PRO A 1 31 ? 1.327   12.588  4.621   1.00 0.00 ? 31 PRO A HG3  3 
ATOM 1478 H HD2  . PRO A 1 31 ? -0.891  11.439  3.323   1.00 0.00 ? 31 PRO A HD2  3 
ATOM 1479 H HD3  . PRO A 1 31 ? 0.586   12.021  2.531   1.00 0.00 ? 31 PRO A HD3  3 
ATOM 1480 N N    . GLN A 1 32 ? -0.427  7.689   4.191   1.00 0.00 ? 32 GLN A N    3 
ATOM 1481 C CA   . GLN A 1 32 ? -1.312  6.733   4.914   1.00 0.00 ? 32 GLN A CA   3 
ATOM 1482 C C    . GLN A 1 32 ? -1.691  5.580   3.983   1.00 0.00 ? 32 GLN A C    3 
ATOM 1483 O O    . GLN A 1 32 ? -1.971  5.771   2.815   1.00 0.00 ? 32 GLN A O    3 
ATOM 1484 C CB   . GLN A 1 32 ? -2.578  7.458   5.373   1.00 0.00 ? 32 GLN A CB   3 
ATOM 1485 C CG   . GLN A 1 32 ? -2.429  7.854   6.843   1.00 0.00 ? 32 GLN A CG   3 
ATOM 1486 C CD   . GLN A 1 32 ? -3.053  9.233   7.068   1.00 0.00 ? 32 GLN A CD   3 
ATOM 1487 O OE1  . GLN A 1 32 ? -2.370  10.170  7.429   1.00 0.00 ? 32 GLN A OE1  3 
ATOM 1488 N NE2  . GLN A 1 32 ? -4.333  9.398   6.869   1.00 0.00 ? 32 GLN A NE2  3 
ATOM 1489 H H    . GLN A 1 32 ? -0.525  7.811   3.224   1.00 0.00 ? 32 GLN A H    3 
ATOM 1490 H HA   . GLN A 1 32 ? -0.790  6.343   5.774   1.00 0.00 ? 32 GLN A HA   3 
ATOM 1491 H HB2  . GLN A 1 32 ? -2.724  8.344   4.772   1.00 0.00 ? 32 GLN A HB2  3 
ATOM 1492 H HB3  . GLN A 1 32 ? -3.428  6.803   5.263   1.00 0.00 ? 32 GLN A HB3  3 
ATOM 1493 H HG2  . GLN A 1 32 ? -2.930  7.125   7.463   1.00 0.00 ? 32 GLN A HG2  3 
ATOM 1494 H HG3  . GLN A 1 32 ? -1.381  7.889   7.101   1.00 0.00 ? 32 GLN A HG3  3 
ATOM 1495 H HE21 . GLN A 1 32 ? -4.884  8.643   6.576   1.00 0.00 ? 32 GLN A HE21 3 
ATOM 1496 H HE22 . GLN A 1 32 ? -4.740  10.277  7.011   1.00 0.00 ? 32 GLN A HE22 3 
ATOM 1497 N N    . CYS A 1 33 ? -1.698  4.379   4.494   1.00 0.00 ? 33 CYS A N    3 
ATOM 1498 C CA   . CYS A 1 33 ? -2.053  3.209   3.647   1.00 0.00 ? 33 CYS A CA   3 
ATOM 1499 C C    . CYS A 1 33 ? -3.494  2.786   3.936   1.00 0.00 ? 33 CYS A C    3 
ATOM 1500 O O    . CYS A 1 33 ? -3.842  2.449   5.050   1.00 0.00 ? 33 CYS A O    3 
ATOM 1501 C CB   . CYS A 1 33 ? -1.105  2.053   3.963   1.00 0.00 ? 33 CYS A CB   3 
ATOM 1502 S SG   . CYS A 1 33 ? -1.123  0.862   2.603   1.00 0.00 ? 33 CYS A SG   3 
ATOM 1503 H H    . CYS A 1 33 ? -1.467  4.248   5.438   1.00 0.00 ? 33 CYS A H    3 
ATOM 1504 H HA   . CYS A 1 33 ? -1.960  3.476   2.607   1.00 0.00 ? 33 CYS A HA   3 
ATOM 1505 H HB2  . CYS A 1 33 ? -0.103  2.436   4.091   1.00 0.00 ? 33 CYS A HB2  3 
ATOM 1506 H HB3  . CYS A 1 33 ? -1.423  1.565   4.873   1.00 0.00 ? 33 CYS A HB3  3 
ATOM 1507 N N    . LEU A 1 34 ? -4.337  2.805   2.939   1.00 0.00 ? 34 LEU A N    3 
ATOM 1508 C CA   . LEU A 1 34 ? -5.756  2.407   3.157   1.00 0.00 ? 34 LEU A CA   3 
ATOM 1509 C C    . LEU A 1 34 ? -6.121  1.254   2.216   1.00 0.00 ? 34 LEU A C    3 
ATOM 1510 O O    . LEU A 1 34 ? -5.265  0.610   1.644   1.00 0.00 ? 34 LEU A O    3 
ATOM 1511 C CB   . LEU A 1 34 ? -6.664  3.606   2.874   1.00 0.00 ? 34 LEU A CB   3 
ATOM 1512 C CG   . LEU A 1 34 ? -6.244  4.784   3.756   1.00 0.00 ? 34 LEU A CG   3 
ATOM 1513 C CD1  . LEU A 1 34 ? -6.967  6.054   3.299   1.00 0.00 ? 34 LEU A CD1  3 
ATOM 1514 C CD2  . LEU A 1 34 ? -6.608  4.485   5.212   1.00 0.00 ? 34 LEU A CD2  3 
ATOM 1515 H H    . LEU A 1 34 ? -4.037  3.082   2.048   1.00 0.00 ? 34 LEU A H    3 
ATOM 1516 H HA   . LEU A 1 34 ? -5.887  2.091   4.181   1.00 0.00 ? 34 LEU A HA   3 
ATOM 1517 H HB2  . LEU A 1 34 ? -6.578  3.885   1.833   1.00 0.00 ? 34 LEU A HB2  3 
ATOM 1518 H HB3  . LEU A 1 34 ? -7.688  3.342   3.093   1.00 0.00 ? 34 LEU A HB3  3 
ATOM 1519 H HG   . LEU A 1 34 ? -5.176  4.931   3.674   1.00 0.00 ? 34 LEU A HG   3 
ATOM 1520 H HD11 . LEU A 1 34 ? -7.415  5.885   2.331   1.00 0.00 ? 34 LEU A HD11 3 
ATOM 1521 H HD12 . LEU A 1 34 ? -7.737  6.305   4.013   1.00 0.00 ? 34 LEU A HD12 3 
ATOM 1522 H HD13 . LEU A 1 34 ? -6.259  6.866   3.232   1.00 0.00 ? 34 LEU A HD13 3 
ATOM 1523 H HD21 . LEU A 1 34 ? -7.374  3.723   5.242   1.00 0.00 ? 34 LEU A HD21 3 
ATOM 1524 H HD22 . LEU A 1 34 ? -5.732  4.136   5.737   1.00 0.00 ? 34 LEU A HD22 3 
ATOM 1525 H HD23 . LEU A 1 34 ? -6.977  5.384   5.683   1.00 0.00 ? 34 LEU A HD23 3 
ATOM 1526 N N    . CYS A 1 35 ? -7.390  0.991   2.058   1.00 0.00 ? 35 CYS A N    3 
ATOM 1527 C CA   . CYS A 1 35 ? -7.822  -0.119  1.160   1.00 0.00 ? 35 CYS A CA   3 
ATOM 1528 C C    . CYS A 1 35 ? -8.412  0.466   -0.125  1.00 0.00 ? 35 CYS A C    3 
ATOM 1529 O O    . CYS A 1 35 ? -8.407  1.664   -0.332  1.00 0.00 ? 35 CYS A O    3 
ATOM 1530 C CB   . CYS A 1 35 ? -8.886  -0.956  1.872   1.00 0.00 ? 35 CYS A CB   3 
ATOM 1531 S SG   . CYS A 1 35 ? -8.282  -1.426  3.511   1.00 0.00 ? 35 CYS A SG   3 
ATOM 1532 H H    . CYS A 1 35 ? -8.062  1.524   2.533   1.00 0.00 ? 35 CYS A H    3 
ATOM 1533 H HA   . CYS A 1 35 ? -6.973  -0.746  0.921   1.00 0.00 ? 35 CYS A HA   3 
ATOM 1534 H HB2  . CYS A 1 35 ? -9.792  -0.376  1.974   1.00 0.00 ? 35 CYS A HB2  3 
ATOM 1535 H HB3  . CYS A 1 35 ? -9.091  -1.845  1.295   1.00 0.00 ? 35 CYS A HB3  3 
ATOM 1536 N N    . ARG A 1 36 ? -8.929  -0.367  -0.987  1.00 0.00 ? 36 ARG A N    3 
ATOM 1537 C CA   . ARG A 1 36 ? -9.525  0.141   -2.249  1.00 0.00 ? 36 ARG A CA   3 
ATOM 1538 C C    . ARG A 1 36 ? -10.644 -0.798  -2.703  1.00 0.00 ? 36 ARG A C    3 
ATOM 1539 O O    . ARG A 1 36 ? -10.868 -1.792  -2.031  1.00 0.00 ? 36 ARG A O    3 
ATOM 1540 C CB   . ARG A 1 36 ? -8.448  0.218   -3.331  1.00 0.00 ? 36 ARG A CB   3 
ATOM 1541 C CG   . ARG A 1 36 ? -9.039  0.843   -4.597  1.00 0.00 ? 36 ARG A CG   3 
ATOM 1542 C CD   . ARG A 1 36 ? -9.767  2.139   -4.235  1.00 0.00 ? 36 ARG A CD   3 
ATOM 1543 N NE   . ARG A 1 36 ? -9.888  2.996   -5.447  1.00 0.00 ? 36 ARG A NE   3 
ATOM 1544 C CZ   . ARG A 1 36 ? -10.770 3.957   -5.481  1.00 0.00 ? 36 ARG A CZ   3 
ATOM 1545 N NH1  . ARG A 1 36 ? -12.005 3.725   -5.129  1.00 0.00 ? 36 ARG A NH1  3 
ATOM 1546 N NH2  . ARG A 1 36 ? -10.415 5.153   -5.866  1.00 0.00 ? 36 ARG A NH2  3 
ATOM 1547 O OXT  . ARG A 1 36 ? -11.262 -0.507  -3.715  1.00 0.00 ? 36 ARG A OXT  3 
ATOM 1548 H H    . ARG A 1 36 ? -8.929  -1.324  -0.802  1.00 0.00 ? 36 ARG A H    3 
ATOM 1549 H HA   . ARG A 1 36 ? -9.930  1.121   -2.075  1.00 0.00 ? 36 ARG A HA   3 
ATOM 1550 H HB2  . ARG A 1 36 ? -7.627  0.823   -2.977  1.00 0.00 ? 36 ARG A HB2  3 
ATOM 1551 H HB3  . ARG A 1 36 ? -8.092  -0.777  -3.557  1.00 0.00 ? 36 ARG A HB3  3 
ATOM 1552 H HG2  . ARG A 1 36 ? -8.245  1.058   -5.296  1.00 0.00 ? 36 ARG A HG2  3 
ATOM 1553 H HG3  . ARG A 1 36 ? -9.739  0.155   -5.046  1.00 0.00 ? 36 ARG A HG3  3 
ATOM 1554 H HD2  . ARG A 1 36 ? -10.752 1.906   -3.857  1.00 0.00 ? 36 ARG A HD2  3 
ATOM 1555 H HD3  . ARG A 1 36 ? -9.207  2.666   -3.476  1.00 0.00 ? 36 ARG A HD3  3 
ATOM 1556 H HE   . ARG A 1 36 ? -9.305  2.838   -6.219  1.00 0.00 ? 36 ARG A HE   3 
ATOM 1557 H HH11 . ARG A 1 36 ? -12.277 2.810   -4.832  1.00 0.00 ? 36 ARG A HH11 3 
ATOM 1558 H HH12 . ARG A 1 36 ? -12.679 4.463   -5.156  1.00 0.00 ? 36 ARG A HH12 3 
ATOM 1559 H HH21 . ARG A 1 36 ? -9.468  5.333   -6.133  1.00 0.00 ? 36 ARG A HH21 3 
ATOM 1560 H HH22 . ARG A 1 36 ? -11.091 5.890   -5.896  1.00 0.00 ? 36 ARG A HH22 3 
ATOM 1561 N N    . MET A 1 1  ? -1.748  2.232   9.709   1.00 0.00 ? 1  MET A N    4 
ATOM 1562 C CA   . MET A 1 1  ? -1.816  1.867   8.264   1.00 0.00 ? 1  MET A CA   4 
ATOM 1563 C C    . MET A 1 1  ? -0.879  0.687   7.994   1.00 0.00 ? 1  MET A C    4 
ATOM 1564 O O    . MET A 1 1  ? -0.177  0.226   8.872   1.00 0.00 ? 1  MET A O    4 
ATOM 1565 C CB   . MET A 1 1  ? -1.389  3.067   7.415   1.00 0.00 ? 1  MET A CB   4 
ATOM 1566 C CG   . MET A 1 1  ? 0.111   3.314   7.593   1.00 0.00 ? 1  MET A CG   4 
ATOM 1567 S SD   . MET A 1 1  ? 0.438   5.095   7.568   1.00 0.00 ? 1  MET A SD   4 
ATOM 1568 C CE   . MET A 1 1  ? 2.206   5.001   7.189   1.00 0.00 ? 1  MET A CE   4 
ATOM 1569 H H1   . MET A 1 1  ? -0.759  2.412   9.974   1.00 0.00 ? 1  MET A H1   4 
ATOM 1570 H H2   . MET A 1 1  ? -2.314  3.087   9.878   1.00 0.00 ? 1  MET A H2   4 
ATOM 1571 H H3   . MET A 1 1  ? -2.126  1.450   10.282  1.00 0.00 ? 1  MET A H3   4 
ATOM 1572 H HA   . MET A 1 1  ? -2.828  1.588   8.011   1.00 0.00 ? 1  MET A HA   4 
ATOM 1573 H HB2  . MET A 1 1  ? -1.601  2.864   6.376   1.00 0.00 ? 1  MET A HB2  4 
ATOM 1574 H HB3  . MET A 1 1  ? -1.936  3.943   7.730   1.00 0.00 ? 1  MET A HB3  4 
ATOM 1575 H HG2  . MET A 1 1  ? 0.434   2.901   8.537   1.00 0.00 ? 1  MET A HG2  4 
ATOM 1576 H HG3  . MET A 1 1  ? 0.651   2.838   6.788   1.00 0.00 ? 1  MET A HG3  4 
ATOM 1577 H HE1  . MET A 1 1  ? 2.504   3.968   7.108   1.00 0.00 ? 1  MET A HE1  4 
ATOM 1578 H HE2  . MET A 1 1  ? 2.400   5.504   6.252   1.00 0.00 ? 1  MET A HE2  4 
ATOM 1579 H HE3  . MET A 1 1  ? 2.769   5.475   7.982   1.00 0.00 ? 1  MET A HE3  4 
ATOM 1580 N N    . CYS A 1 2  ? -0.859  0.193   6.784   1.00 0.00 ? 2  CYS A N    4 
ATOM 1581 C CA   . CYS A 1 2  ? 0.034   -0.956  6.463   1.00 0.00 ? 2  CYS A CA   4 
ATOM 1582 C C    . CYS A 1 2  ? 1.226   -0.463  5.640   1.00 0.00 ? 2  CYS A C    4 
ATOM 1583 O O    . CYS A 1 2  ? 1.068   0.077   4.563   1.00 0.00 ? 2  CYS A O    4 
ATOM 1584 C CB   . CYS A 1 2  ? -0.744  -2.002  5.657   1.00 0.00 ? 2  CYS A CB   4 
ATOM 1585 S SG   . CYS A 1 2  ? 0.013   -3.631  5.885   1.00 0.00 ? 2  CYS A SG   4 
ATOM 1586 H H    . CYS A 1 2  ? -1.432  0.578   6.088   1.00 0.00 ? 2  CYS A H    4 
ATOM 1587 H HA   . CYS A 1 2  ? 0.391   -1.402  7.379   1.00 0.00 ? 2  CYS A HA   4 
ATOM 1588 H HB2  . CYS A 1 2  ? -1.768  -2.030  5.998   1.00 0.00 ? 2  CYS A HB2  4 
ATOM 1589 H HB3  . CYS A 1 2  ? -0.721  -1.738  4.610   1.00 0.00 ? 2  CYS A HB3  4 
ATOM 1590 N N    . MET A 1 3  ? 2.420   -0.646  6.137   1.00 0.00 ? 3  MET A N    4 
ATOM 1591 C CA   . MET A 1 3  ? 3.622   -0.189  5.384   1.00 0.00 ? 3  MET A CA   4 
ATOM 1592 C C    . MET A 1 3  ? 3.550   1.325   5.165   1.00 0.00 ? 3  MET A C    4 
ATOM 1593 O O    . MET A 1 3  ? 2.525   1.937   5.390   1.00 0.00 ? 3  MET A O    4 
ATOM 1594 C CB   . MET A 1 3  ? 3.669   -0.882  4.020   1.00 0.00 ? 3  MET A CB   4 
ATOM 1595 C CG   . MET A 1 3  ? 5.118   -1.149  3.603   1.00 0.00 ? 3  MET A CG   4 
ATOM 1596 S SD   . MET A 1 3  ? 5.958   -2.133  4.869   1.00 0.00 ? 3  MET A SD   4 
ATOM 1597 C CE   . MET A 1 3  ? 7.648   -1.853  4.283   1.00 0.00 ? 3  MET A CE   4 
ATOM 1598 H H    . MET A 1 3  ? 2.525   -1.085  7.007   1.00 0.00 ? 3  MET A H    4 
ATOM 1599 H HA   . MET A 1 3  ? 4.509   -0.432  5.944   1.00 0.00 ? 3  MET A HA   4 
ATOM 1600 H HB2  . MET A 1 3  ? 3.129   -1.816  4.071   1.00 0.00 ? 3  MET A HB2  4 
ATOM 1601 H HB3  . MET A 1 3  ? 3.209   -0.240  3.288   1.00 0.00 ? 3  MET A HB3  4 
ATOM 1602 H HG2  . MET A 1 3  ? 5.126   -1.690  2.669   1.00 0.00 ? 3  MET A HG2  4 
ATOM 1603 H HG3  . MET A 1 3  ? 5.632   -0.208  3.473   1.00 0.00 ? 3  MET A HG3  4 
ATOM 1604 H HE1  . MET A 1 3  ? 7.648   -1.045  3.564   1.00 0.00 ? 3  MET A HE1  4 
ATOM 1605 H HE2  . MET A 1 3  ? 8.280   -1.591  5.117   1.00 0.00 ? 3  MET A HE2  4 
ATOM 1606 H HE3  . MET A 1 3  ? 8.021   -2.756  3.820   1.00 0.00 ? 3  MET A HE3  4 
ATOM 1607 N N    . PRO A 1 4  ? 4.648   1.874   4.718   1.00 0.00 ? 4  PRO A N    4 
ATOM 1608 C CA   . PRO A 1 4  ? 4.675   3.330   4.457   1.00 0.00 ? 4  PRO A CA   4 
ATOM 1609 C C    . PRO A 1 4  ? 4.985   3.602   2.983   1.00 0.00 ? 4  PRO A C    4 
ATOM 1610 O O    . PRO A 1 4  ? 6.129   3.754   2.599   1.00 0.00 ? 4  PRO A O    4 
ATOM 1611 C CB   . PRO A 1 4  ? 5.803   3.858   5.340   1.00 0.00 ? 4  PRO A CB   4 
ATOM 1612 C CG   . PRO A 1 4  ? 6.728   2.663   5.617   1.00 0.00 ? 4  PRO A CG   4 
ATOM 1613 C CD   . PRO A 1 4  ? 5.886   1.401   5.388   1.00 0.00 ? 4  PRO A CD   4 
ATOM 1614 H HA   . PRO A 1 4  ? 3.740   3.785   4.740   1.00 0.00 ? 4  PRO A HA   4 
ATOM 1615 H HB2  . PRO A 1 4  ? 6.344   4.633   4.817   1.00 0.00 ? 4  PRO A HB2  4 
ATOM 1616 H HB3  . PRO A 1 4  ? 5.406   4.238   6.268   1.00 0.00 ? 4  PRO A HB3  4 
ATOM 1617 H HG2  . PRO A 1 4  ? 7.570   2.680   4.938   1.00 0.00 ? 4  PRO A HG2  4 
ATOM 1618 H HG3  . PRO A 1 4  ? 7.073   2.689   6.639   1.00 0.00 ? 4  PRO A HG3  4 
ATOM 1619 H HD2  . PRO A 1 4  ? 6.413   0.705   4.755   1.00 0.00 ? 4  PRO A HD2  4 
ATOM 1620 H HD3  . PRO A 1 4  ? 5.643   0.941   6.333   1.00 0.00 ? 4  PRO A HD3  4 
ATOM 1621 N N    . CYS A 1 5  ? 3.982   3.670   2.152   1.00 0.00 ? 5  CYS A N    4 
ATOM 1622 C CA   . CYS A 1 5  ? 4.230   3.937   0.707   1.00 0.00 ? 5  CYS A CA   4 
ATOM 1623 C C    . CYS A 1 5  ? 5.136   5.164   0.568   1.00 0.00 ? 5  CYS A C    4 
ATOM 1624 O O    . CYS A 1 5  ? 5.508   5.787   1.543   1.00 0.00 ? 5  CYS A O    4 
ATOM 1625 C CB   . CYS A 1 5  ? 2.897   4.197   0.003   1.00 0.00 ? 5  CYS A CB   4 
ATOM 1626 S SG   . CYS A 1 5  ? 1.910   2.679   0.011   1.00 0.00 ? 5  CYS A SG   4 
ATOM 1627 H H    . CYS A 1 5  ? 3.066   3.547   2.480   1.00 0.00 ? 5  CYS A H    4 
ATOM 1628 H HA   . CYS A 1 5  ? 4.713   3.080   0.261   1.00 0.00 ? 5  CYS A HA   4 
ATOM 1629 H HB2  . CYS A 1 5  ? 2.361   4.978   0.521   1.00 0.00 ? 5  CYS A HB2  4 
ATOM 1630 H HB3  . CYS A 1 5  ? 3.081   4.502   -1.017  1.00 0.00 ? 5  CYS A HB3  4 
ATOM 1631 N N    . PHE A 1 6  ? 5.494   5.518   -0.637  1.00 0.00 ? 6  PHE A N    4 
ATOM 1632 C CA   . PHE A 1 6  ? 6.376   6.705   -0.836  1.00 0.00 ? 6  PHE A CA   4 
ATOM 1633 C C    . PHE A 1 6  ? 7.632   6.558   0.027   1.00 0.00 ? 6  PHE A C    4 
ATOM 1634 O O    . PHE A 1 6  ? 7.851   5.542   0.655   1.00 0.00 ? 6  PHE A O    4 
ATOM 1635 C CB   . PHE A 1 6  ? 5.620   7.972   -0.433  1.00 0.00 ? 6  PHE A CB   4 
ATOM 1636 C CG   . PHE A 1 6  ? 4.756   8.432   -1.584  1.00 0.00 ? 6  PHE A CG   4 
ATOM 1637 C CD1  . PHE A 1 6  ? 5.341   9.057   -2.692  1.00 0.00 ? 6  PHE A CD1  4 
ATOM 1638 C CD2  . PHE A 1 6  ? 3.372   8.230   -1.545  1.00 0.00 ? 6  PHE A CD2  4 
ATOM 1639 C CE1  . PHE A 1 6  ? 4.541   9.482   -3.759  1.00 0.00 ? 6  PHE A CE1  4 
ATOM 1640 C CE2  . PHE A 1 6  ? 2.572   8.655   -2.613  1.00 0.00 ? 6  PHE A CE2  4 
ATOM 1641 C CZ   . PHE A 1 6  ? 3.156   9.280   -3.719  1.00 0.00 ? 6  PHE A CZ   4 
ATOM 1642 H H    . PHE A 1 6  ? 5.184   5.004   -1.411  1.00 0.00 ? 6  PHE A H    4 
ATOM 1643 H HA   . PHE A 1 6  ? 6.660   6.771   -1.876  1.00 0.00 ? 6  PHE A HA   4 
ATOM 1644 H HB2  . PHE A 1 6  ? 4.996   7.761   0.424   1.00 0.00 ? 6  PHE A HB2  4 
ATOM 1645 H HB3  . PHE A 1 6  ? 6.327   8.749   -0.181  1.00 0.00 ? 6  PHE A HB3  4 
ATOM 1646 H HD1  . PHE A 1 6  ? 6.409   9.213   -2.722  1.00 0.00 ? 6  PHE A HD1  4 
ATOM 1647 H HD2  . PHE A 1 6  ? 2.920   7.747   -0.691  1.00 0.00 ? 6  PHE A HD2  4 
ATOM 1648 H HE1  . PHE A 1 6  ? 4.991   9.964   -4.613  1.00 0.00 ? 6  PHE A HE1  4 
ATOM 1649 H HE2  . PHE A 1 6  ? 1.503   8.499   -2.582  1.00 0.00 ? 6  PHE A HE2  4 
ATOM 1650 H HZ   . PHE A 1 6  ? 2.540   9.607   -4.543  1.00 0.00 ? 6  PHE A HZ   4 
ATOM 1651 N N    . THR A 1 7  ? 8.461   7.567   0.061   1.00 0.00 ? 7  THR A N    4 
ATOM 1652 C CA   . THR A 1 7  ? 9.706   7.479   0.887   1.00 0.00 ? 7  THR A CA   4 
ATOM 1653 C C    . THR A 1 7  ? 10.569  6.319   0.385   1.00 0.00 ? 7  THR A C    4 
ATOM 1654 O O    . THR A 1 7  ? 11.495  5.889   1.045   1.00 0.00 ? 7  THR A O    4 
ATOM 1655 C CB   . THR A 1 7  ? 9.322   7.233   2.347   1.00 0.00 ? 7  THR A CB   4 
ATOM 1656 O OG1  . THR A 1 7  ? 8.630   8.367   2.848   1.00 0.00 ? 7  THR A OG1  4 
ATOM 1657 C CG2  . THR A 1 7  ? 10.583  6.995   3.178   1.00 0.00 ? 7  THR A CG2  4 
ATOM 1658 H H    . THR A 1 7  ? 8.263   8.378   -0.455  1.00 0.00 ? 7  THR A H    4 
ATOM 1659 H HA   . THR A 1 7  ? 10.267  8.403   0.812   1.00 0.00 ? 7  THR A HA   4 
ATOM 1660 H HB   . THR A 1 7  ? 8.685   6.365   2.409   1.00 0.00 ? 7  THR A HB   4 
ATOM 1661 H HG1  . THR A 1 7  ? 7.693   8.162   2.860   1.00 0.00 ? 7  THR A HG1  4 
ATOM 1662 H HG21 . THR A 1 7  ? 11.410  7.537   2.743   1.00 0.00 ? 7  THR A HG21 4 
ATOM 1663 H HG22 . THR A 1 7  ? 10.420  7.339   4.188   1.00 0.00 ? 7  THR A HG22 4 
ATOM 1664 H HG23 . THR A 1 7  ? 10.812  5.939   3.190   1.00 0.00 ? 7  THR A HG23 4 
ATOM 1665 N N    . THR A 1 8  ? 10.274  5.810   -0.780  1.00 0.00 ? 8  THR A N    4 
ATOM 1666 C CA   . THR A 1 8  ? 11.078  4.678   -1.325  1.00 0.00 ? 8  THR A CA   4 
ATOM 1667 C C    . THR A 1 8  ? 10.500  4.242   -2.673  1.00 0.00 ? 8  THR A C    4 
ATOM 1668 O O    . THR A 1 8  ? 9.486   4.742   -3.116  1.00 0.00 ? 8  THR A O    4 
ATOM 1669 C CB   . THR A 1 8  ? 11.045  3.496   -0.348  1.00 0.00 ? 8  THR A CB   4 
ATOM 1670 O OG1  . THR A 1 8  ? 11.093  2.279   -1.082  1.00 0.00 ? 8  THR A OG1  4 
ATOM 1671 C CG2  . THR A 1 8  ? 9.762   3.542   0.485   1.00 0.00 ? 8  THR A CG2  4 
ATOM 1672 H H    . THR A 1 8  ? 9.525   6.171   -1.296  1.00 0.00 ? 8  THR A H    4 
ATOM 1673 H HA   . THR A 1 8  ? 12.099  5.001   -1.462  1.00 0.00 ? 8  THR A HA   4 
ATOM 1674 H HB   . THR A 1 8  ? 11.899  3.552   0.310   1.00 0.00 ? 8  THR A HB   4 
ATOM 1675 H HG1  . THR A 1 8  ? 12.014  2.077   -1.260  1.00 0.00 ? 8  THR A HG1  4 
ATOM 1676 H HG21 . THR A 1 8  ? 8.952   3.918   -0.123  1.00 0.00 ? 8  THR A HG21 4 
ATOM 1677 H HG22 . THR A 1 8  ? 9.522   2.549   0.831   1.00 0.00 ? 8  THR A HG22 4 
ATOM 1678 H HG23 . THR A 1 8  ? 9.908   4.194   1.334   1.00 0.00 ? 8  THR A HG23 4 
ATOM 1679 N N    . ASP A 1 9  ? 11.143  3.313   -3.330  1.00 0.00 ? 9  ASP A N    4 
ATOM 1680 C CA   . ASP A 1 9  ? 10.634  2.845   -4.650  1.00 0.00 ? 9  ASP A CA   4 
ATOM 1681 C C    . ASP A 1 9  ? 11.364  1.561   -5.053  1.00 0.00 ? 9  ASP A C    4 
ATOM 1682 O O    . ASP A 1 9  ? 12.228  1.570   -5.907  1.00 0.00 ? 9  ASP A O    4 
ATOM 1683 C CB   . ASP A 1 9  ? 10.889  3.924   -5.704  1.00 0.00 ? 9  ASP A CB   4 
ATOM 1684 C CG   . ASP A 1 9  ? 9.554   4.457   -6.226  1.00 0.00 ? 9  ASP A CG   4 
ATOM 1685 O OD1  . ASP A 1 9  ? 8.753   3.655   -6.677  1.00 0.00 ? 9  ASP A OD1  4 
ATOM 1686 O OD2  . ASP A 1 9  ? 9.355   5.659   -6.167  1.00 0.00 ? 9  ASP A OD2  4 
ATOM 1687 H H    . ASP A 1 9  ? 11.961  2.925   -2.954  1.00 0.00 ? 9  ASP A H    4 
ATOM 1688 H HA   . ASP A 1 9  ? 9.576   2.651   -4.583  1.00 0.00 ? 9  ASP A HA   4 
ATOM 1689 H HB2  . ASP A 1 9  ? 11.454  4.733   -5.262  1.00 0.00 ? 9  ASP A HB2  4 
ATOM 1690 H HB3  . ASP A 1 9  ? 11.450  3.499   -6.523  1.00 0.00 ? 9  ASP A HB3  4 
ATOM 1691 N N    . HIS A 1 10 ? 11.023  0.457   -4.447  1.00 0.00 ? 10 HIS A N    4 
ATOM 1692 C CA   . HIS A 1 10 ? 11.701  -0.823  -4.800  1.00 0.00 ? 10 HIS A CA   4 
ATOM 1693 C C    . HIS A 1 10 ? 10.831  -2.003  -4.361  1.00 0.00 ? 10 HIS A C    4 
ATOM 1694 O O    . HIS A 1 10 ? 11.258  -2.853  -3.604  1.00 0.00 ? 10 HIS A O    4 
ATOM 1695 C CB   . HIS A 1 10 ? 13.053  -0.896  -4.090  1.00 0.00 ? 10 HIS A CB   4 
ATOM 1696 C CG   . HIS A 1 10 ? 13.971  0.159   -4.647  1.00 0.00 ? 10 HIS A CG   4 
ATOM 1697 N ND1  . HIS A 1 10 ? 14.011  1.447   -4.139  1.00 0.00 ? 10 HIS A ND1  4 
ATOM 1698 C CD2  . HIS A 1 10 ? 14.886  0.131   -5.671  1.00 0.00 ? 10 HIS A CD2  4 
ATOM 1699 C CE1  . HIS A 1 10 ? 14.921  2.136   -4.850  1.00 0.00 ? 10 HIS A CE1  4 
ATOM 1700 N NE2  . HIS A 1 10 ? 15.485  1.380   -5.796  1.00 0.00 ? 10 HIS A NE2  4 
ATOM 1701 H H    . HIS A 1 10 ? 10.324  0.469   -3.761  1.00 0.00 ? 10 HIS A H    4 
ATOM 1702 H HA   . HIS A 1 10 ? 11.853  -0.867  -5.867  1.00 0.00 ? 10 HIS A HA   4 
ATOM 1703 H HB2  . HIS A 1 10 ? 12.913  -0.728  -3.032  1.00 0.00 ? 10 HIS A HB2  4 
ATOM 1704 H HB3  . HIS A 1 10 ? 13.490  -1.870  -4.246  1.00 0.00 ? 10 HIS A HB3  4 
ATOM 1705 H HD1  . HIS A 1 10 ? 13.472  1.794   -3.396  1.00 0.00 ? 10 HIS A HD1  4 
ATOM 1706 H HD2  . HIS A 1 10 ? 15.108  -0.730  -6.283  1.00 0.00 ? 10 HIS A HD2  4 
ATOM 1707 H HE1  . HIS A 1 10 ? 15.168  3.173   -4.677  1.00 0.00 ? 10 HIS A HE1  4 
ATOM 1708 N N    . GLN A 1 11 ? 9.613   -2.063  -4.829  1.00 0.00 ? 11 GLN A N    4 
ATOM 1709 C CA   . GLN A 1 11 ? 8.717   -3.188  -4.438  1.00 0.00 ? 11 GLN A CA   4 
ATOM 1710 C C    . GLN A 1 11 ? 8.205   -2.955  -3.015  1.00 0.00 ? 11 GLN A C    4 
ATOM 1711 O O    . GLN A 1 11 ? 8.512   -3.700  -2.106  1.00 0.00 ? 11 GLN A O    4 
ATOM 1712 C CB   . GLN A 1 11 ? 9.496   -4.503  -4.493  1.00 0.00 ? 11 GLN A CB   4 
ATOM 1713 C CG   . GLN A 1 11 ? 8.704   -5.533  -5.302  1.00 0.00 ? 11 GLN A CG   4 
ATOM 1714 C CD   . GLN A 1 11 ? 8.544   -6.816  -4.484  1.00 0.00 ? 11 GLN A CD   4 
ATOM 1715 O OE1  . GLN A 1 11 ? 7.593   -6.962  -3.743  1.00 0.00 ? 11 GLN A OE1  4 
ATOM 1716 N NE2  . GLN A 1 11 ? 9.441   -7.758  -4.590  1.00 0.00 ? 11 GLN A NE2  4 
ATOM 1717 H H    . GLN A 1 11 ? 9.288   -1.367  -5.438  1.00 0.00 ? 11 GLN A H    4 
ATOM 1718 H HA   . GLN A 1 11 ? 7.881   -3.235  -5.120  1.00 0.00 ? 11 GLN A HA   4 
ATOM 1719 H HB2  . GLN A 1 11 ? 10.455  -4.334  -4.963  1.00 0.00 ? 11 GLN A HB2  4 
ATOM 1720 H HB3  . GLN A 1 11 ? 9.647   -4.875  -3.491  1.00 0.00 ? 11 GLN A HB3  4 
ATOM 1721 H HG2  . GLN A 1 11 ? 7.730   -5.131  -5.539  1.00 0.00 ? 11 GLN A HG2  4 
ATOM 1722 H HG3  . GLN A 1 11 ? 9.234   -5.756  -6.217  1.00 0.00 ? 11 GLN A HG3  4 
ATOM 1723 H HE21 . GLN A 1 11 ? 10.208  -7.639  -5.188  1.00 0.00 ? 11 GLN A HE21 4 
ATOM 1724 H HE22 . GLN A 1 11 ? 9.347   -8.583  -4.071  1.00 0.00 ? 11 GLN A HE22 4 
ATOM 1725 N N    . MET A 1 12 ? 7.429   -1.926  -2.812  1.00 0.00 ? 12 MET A N    4 
ATOM 1726 C CA   . MET A 1 12 ? 6.902   -1.646  -1.446  1.00 0.00 ? 12 MET A CA   4 
ATOM 1727 C C    . MET A 1 12 ? 5.383   -1.489  -1.507  1.00 0.00 ? 12 MET A C    4 
ATOM 1728 O O    . MET A 1 12 ? 4.647   -2.177  -0.828  1.00 0.00 ? 12 MET A O    4 
ATOM 1729 C CB   . MET A 1 12 ? 7.524   -0.350  -0.920  1.00 0.00 ? 12 MET A CB   4 
ATOM 1730 C CG   . MET A 1 12 ? 7.650   -0.423  0.603   1.00 0.00 ? 12 MET A CG   4 
ATOM 1731 S SD   . MET A 1 12 ? 6.721   0.936   1.355   1.00 0.00 ? 12 MET A SD   4 
ATOM 1732 C CE   . MET A 1 12 ? 5.068   0.366   0.890   1.00 0.00 ? 12 MET A CE   4 
ATOM 1733 H H    . MET A 1 12 ? 7.196   -1.334  -3.560  1.00 0.00 ? 12 MET A H    4 
ATOM 1734 H HA   . MET A 1 12 ? 7.156   -2.462  -0.786  1.00 0.00 ? 12 MET A HA   4 
ATOM 1735 H HB2  . MET A 1 12 ? 8.500   -0.216  -1.360  1.00 0.00 ? 12 MET A HB2  4 
ATOM 1736 H HB3  . MET A 1 12 ? 6.892   0.485   -1.186  1.00 0.00 ? 12 MET A HB3  4 
ATOM 1737 H HG2  . MET A 1 12 ? 7.256   -1.366  0.953   1.00 0.00 ? 12 MET A HG2  4 
ATOM 1738 H HG3  . MET A 1 12 ? 8.692   -0.344  0.881   1.00 0.00 ? 12 MET A HG3  4 
ATOM 1739 H HE1  . MET A 1 12 ? 5.066   -0.709  0.810   1.00 0.00 ? 12 MET A HE1  4 
ATOM 1740 H HE2  . MET A 1 12 ? 4.357   0.671   1.645   1.00 0.00 ? 12 MET A HE2  4 
ATOM 1741 H HE3  . MET A 1 12 ? 4.796   0.796   -0.063  1.00 0.00 ? 12 MET A HE3  4 
ATOM 1742 N N    . ALA A 1 13 ? 4.909   -0.583  -2.315  1.00 0.00 ? 13 ALA A N    4 
ATOM 1743 C CA   . ALA A 1 13 ? 3.437   -0.372  -2.422  1.00 0.00 ? 13 ALA A CA   4 
ATOM 1744 C C    . ALA A 1 13 ? 2.781   -1.595  -3.068  1.00 0.00 ? 13 ALA A C    4 
ATOM 1745 O O    . ALA A 1 13 ? 1.572   -1.713  -3.104  1.00 0.00 ? 13 ALA A O    4 
ATOM 1746 C CB   . ALA A 1 13 ? 3.163   0.865   -3.280  1.00 0.00 ? 13 ALA A CB   4 
ATOM 1747 H H    . ALA A 1 13 ? 5.523   -0.037  -2.851  1.00 0.00 ? 13 ALA A H    4 
ATOM 1748 H HA   . ALA A 1 13 ? 3.025   -0.222  -1.435  1.00 0.00 ? 13 ALA A HA   4 
ATOM 1749 H HB1  . ALA A 1 13 ? 3.889   0.919   -4.076  1.00 0.00 ? 13 ALA A HB1  4 
ATOM 1750 H HB2  . ALA A 1 13 ? 2.172   0.795   -3.702  1.00 0.00 ? 13 ALA A HB2  4 
ATOM 1751 H HB3  . ALA A 1 13 ? 3.232   1.750   -2.667  1.00 0.00 ? 13 ALA A HB3  4 
ATOM 1752 N N    . ARG A 1 14 ? 3.564   -2.506  -3.580  1.00 0.00 ? 14 ARG A N    4 
ATOM 1753 C CA   . ARG A 1 14 ? 2.973   -3.715  -4.223  1.00 0.00 ? 14 ARG A CA   4 
ATOM 1754 C C    . ARG A 1 14 ? 2.297   -4.582  -3.159  1.00 0.00 ? 14 ARG A C    4 
ATOM 1755 O O    . ARG A 1 14 ? 1.299   -5.227  -3.413  1.00 0.00 ? 14 ARG A O    4 
ATOM 1756 C CB   . ARG A 1 14 ? 4.077   -4.521  -4.908  1.00 0.00 ? 14 ARG A CB   4 
ATOM 1757 C CG   . ARG A 1 14 ? 4.038   -4.262  -6.415  1.00 0.00 ? 14 ARG A CG   4 
ATOM 1758 C CD   . ARG A 1 14 ? 5.288   -4.855  -7.070  1.00 0.00 ? 14 ARG A CD   4 
ATOM 1759 N NE   . ARG A 1 14 ? 5.096   -6.319  -7.276  1.00 0.00 ? 14 ARG A NE   4 
ATOM 1760 C CZ   . ARG A 1 14 ? 5.497   -6.880  -8.384  1.00 0.00 ? 14 ARG A CZ   4 
ATOM 1761 N NH1  . ARG A 1 14 ? 5.260   -6.302  -9.531  1.00 0.00 ? 14 ARG A NH1  4 
ATOM 1762 N NH2  . ARG A 1 14 ? 6.136   -8.018  -8.346  1.00 0.00 ? 14 ARG A NH2  4 
ATOM 1763 H H    . ARG A 1 14 ? 4.536   -2.394  -3.545  1.00 0.00 ? 14 ARG A H    4 
ATOM 1764 H HA   . ARG A 1 14 ? 2.242   -3.410  -4.957  1.00 0.00 ? 14 ARG A HA   4 
ATOM 1765 H HB2  . ARG A 1 14 ? 5.038   -4.223  -4.516  1.00 0.00 ? 14 ARG A HB2  4 
ATOM 1766 H HB3  . ARG A 1 14 ? 3.923   -5.574  -4.723  1.00 0.00 ? 14 ARG A HB3  4 
ATOM 1767 H HG2  . ARG A 1 14 ? 3.156   -4.721  -6.838  1.00 0.00 ? 14 ARG A HG2  4 
ATOM 1768 H HG3  . ARG A 1 14 ? 4.012   -3.197  -6.597  1.00 0.00 ? 14 ARG A HG3  4 
ATOM 1769 H HD2  . ARG A 1 14 ? 5.456   -4.376  -8.023  1.00 0.00 ? 14 ARG A HD2  4 
ATOM 1770 H HD3  . ARG A 1 14 ? 6.142   -4.690  -6.430  1.00 0.00 ? 14 ARG A HD3  4 
ATOM 1771 H HE   . ARG A 1 14 ? 4.669   -6.859  -6.579  1.00 0.00 ? 14 ARG A HE   4 
ATOM 1772 H HH11 . ARG A 1 14 ? 4.774   -5.430  -9.560  1.00 0.00 ? 14 ARG A HH11 4 
ATOM 1773 H HH12 . ARG A 1 14 ? 5.566   -6.733  -10.380 1.00 0.00 ? 14 ARG A HH12 4 
ATOM 1774 H HH21 . ARG A 1 14 ? 6.319   -8.458  -7.468  1.00 0.00 ? 14 ARG A HH21 4 
ATOM 1775 H HH22 . ARG A 1 14 ? 6.440   -8.450  -9.195  1.00 0.00 ? 14 ARG A HH22 4 
ATOM 1776 N N    . LYS A 1 15 ? 2.835   -4.609  -1.970  1.00 0.00 ? 15 LYS A N    4 
ATOM 1777 C CA   . LYS A 1 15 ? 2.232   -5.436  -0.894  1.00 0.00 ? 15 LYS A CA   4 
ATOM 1778 C C    . LYS A 1 15 ? 1.268   -4.585  -0.061  1.00 0.00 ? 15 LYS A C    4 
ATOM 1779 O O    . LYS A 1 15 ? 0.384   -5.097  0.595   1.00 0.00 ? 15 LYS A O    4 
ATOM 1780 C CB   . LYS A 1 15 ? 3.348   -5.967  0.003   1.00 0.00 ? 15 LYS A CB   4 
ATOM 1781 C CG   . LYS A 1 15 ? 4.344   -4.846  0.298   1.00 0.00 ? 15 LYS A CG   4 
ATOM 1782 C CD   . LYS A 1 15 ? 4.902   -5.019  1.712   1.00 0.00 ? 15 LYS A CD   4 
ATOM 1783 C CE   . LYS A 1 15 ? 6.367   -5.451  1.633   1.00 0.00 ? 15 LYS A CE   4 
ATOM 1784 N NZ   . LYS A 1 15 ? 6.978   -5.387  2.990   1.00 0.00 ? 15 LYS A NZ   4 
ATOM 1785 H H    . LYS A 1 15 ? 3.642   -4.090  -1.784  1.00 0.00 ? 15 LYS A H    4 
ATOM 1786 H HA   . LYS A 1 15 ? 1.697   -6.266  -1.331  1.00 0.00 ? 15 LYS A HA   4 
ATOM 1787 H HB2  . LYS A 1 15 ? 2.924   -6.318  0.925   1.00 0.00 ? 15 LYS A HB2  4 
ATOM 1788 H HB3  . LYS A 1 15 ? 3.857   -6.778  -0.495  1.00 0.00 ? 15 LYS A HB3  4 
ATOM 1789 H HG2  . LYS A 1 15 ? 5.154   -4.886  -0.417  1.00 0.00 ? 15 LYS A HG2  4 
ATOM 1790 H HG3  . LYS A 1 15 ? 3.844   -3.891  0.224   1.00 0.00 ? 15 LYS A HG3  4 
ATOM 1791 H HD2  . LYS A 1 15 ? 4.828   -4.082  2.245   1.00 0.00 ? 15 LYS A HD2  4 
ATOM 1792 H HD3  . LYS A 1 15 ? 4.333   -5.775  2.233   1.00 0.00 ? 15 LYS A HD3  4 
ATOM 1793 H HE2  . LYS A 1 15 ? 6.424   -6.464  1.260   1.00 0.00 ? 15 LYS A HE2  4 
ATOM 1794 H HE3  . LYS A 1 15 ? 6.901   -4.791  0.965   1.00 0.00 ? 15 LYS A HE3  4 
ATOM 1795 H HZ1  . LYS A 1 15 ? 6.288   -4.992  3.662   1.00 0.00 ? 15 LYS A HZ1  4 
ATOM 1796 H HZ2  . LYS A 1 15 ? 7.249   -6.343  3.294   1.00 0.00 ? 15 LYS A HZ2  4 
ATOM 1797 H HZ3  . LYS A 1 15 ? 7.822   -4.782  2.962   1.00 0.00 ? 15 LYS A HZ3  4 
ATOM 1798 N N    . CYS A 1 16 ? 1.433   -3.290  -0.080  1.00 0.00 ? 16 CYS A N    4 
ATOM 1799 C CA   . CYS A 1 16 ? 0.526   -2.408  0.714   1.00 0.00 ? 16 CYS A CA   4 
ATOM 1800 C C    . CYS A 1 16 ? -0.930  -2.776  0.423   1.00 0.00 ? 16 CYS A C    4 
ATOM 1801 O O    . CYS A 1 16 ? -1.677  -3.133  1.313   1.00 0.00 ? 16 CYS A O    4 
ATOM 1802 C CB   . CYS A 1 16 ? 0.773   -0.948  0.326   1.00 0.00 ? 16 CYS A CB   4 
ATOM 1803 S SG   . CYS A 1 16 ? 1.083   0.033   1.816   1.00 0.00 ? 16 CYS A SG   4 
ATOM 1804 H H    . CYS A 1 16 ? 2.154   -2.895  -0.614  1.00 0.00 ? 16 CYS A H    4 
ATOM 1805 H HA   . CYS A 1 16 ? 0.724   -2.540  1.769   1.00 0.00 ? 16 CYS A HA   4 
ATOM 1806 H HB2  . CYS A 1 16 ? 1.631   -0.888  -0.327  1.00 0.00 ? 16 CYS A HB2  4 
ATOM 1807 H HB3  . CYS A 1 16 ? -0.096  -0.559  -0.186  1.00 0.00 ? 16 CYS A HB3  4 
ATOM 1808 N N    . ASP A 1 17 ? -1.340  -2.694  -0.811  1.00 0.00 ? 17 ASP A N    4 
ATOM 1809 C CA   . ASP A 1 17 ? -2.748  -3.043  -1.152  1.00 0.00 ? 17 ASP A CA   4 
ATOM 1810 C C    . ASP A 1 17 ? -3.030  -4.479  -0.711  1.00 0.00 ? 17 ASP A C    4 
ATOM 1811 O O    . ASP A 1 17 ? -3.979  -4.748  -0.003  1.00 0.00 ? 17 ASP A O    4 
ATOM 1812 C CB   . ASP A 1 17 ? -2.946  -2.931  -2.665  1.00 0.00 ? 17 ASP A CB   4 
ATOM 1813 C CG   . ASP A 1 17 ? -4.438  -2.821  -2.982  1.00 0.00 ? 17 ASP A CG   4 
ATOM 1814 O OD1  . ASP A 1 17 ? -5.179  -3.692  -2.558  1.00 0.00 ? 17 ASP A OD1  4 
ATOM 1815 O OD2  . ASP A 1 17 ? -4.816  -1.869  -3.643  1.00 0.00 ? 17 ASP A OD2  4 
ATOM 1816 H H    . ASP A 1 17 ? -0.722  -2.405  -1.515  1.00 0.00 ? 17 ASP A H    4 
ATOM 1817 H HA   . ASP A 1 17 ? -3.424  -2.368  -0.643  1.00 0.00 ? 17 ASP A HA   4 
ATOM 1818 H HB2  . ASP A 1 17 ? -2.435  -2.053  -3.030  1.00 0.00 ? 17 ASP A HB2  4 
ATOM 1819 H HB3  . ASP A 1 17 ? -2.542  -3.809  -3.147  1.00 0.00 ? 17 ASP A HB3  4 
ATOM 1820 N N    . ASP A 1 18 ? -2.206  -5.405  -1.121  1.00 0.00 ? 18 ASP A N    4 
ATOM 1821 C CA   . ASP A 1 18 ? -2.423  -6.823  -0.720  1.00 0.00 ? 18 ASP A CA   4 
ATOM 1822 C C    . ASP A 1 18 ? -2.674  -6.883  0.787   1.00 0.00 ? 18 ASP A C    4 
ATOM 1823 O O    . ASP A 1 18 ? -3.332  -7.775  1.284   1.00 0.00 ? 18 ASP A O    4 
ATOM 1824 C CB   . ASP A 1 18 ? -1.183  -7.650  -1.067  1.00 0.00 ? 18 ASP A CB   4 
ATOM 1825 C CG   . ASP A 1 18 ? -1.527  -8.645  -2.178  1.00 0.00 ? 18 ASP A CG   4 
ATOM 1826 O OD1  . ASP A 1 18 ? -2.113  -8.225  -3.162  1.00 0.00 ? 18 ASP A OD1  4 
ATOM 1827 O OD2  . ASP A 1 18 ? -1.199  -9.810  -2.025  1.00 0.00 ? 18 ASP A OD2  4 
ATOM 1828 H H    . ASP A 1 18 ? -1.444  -5.165  -1.690  1.00 0.00 ? 18 ASP A H    4 
ATOM 1829 H HA   . ASP A 1 18 ? -3.280  -7.218  -1.246  1.00 0.00 ? 18 ASP A HA   4 
ATOM 1830 H HB2  . ASP A 1 18 ? -0.394  -6.993  -1.404  1.00 0.00 ? 18 ASP A HB2  4 
ATOM 1831 H HB3  . ASP A 1 18 ? -0.853  -8.190  -0.193  1.00 0.00 ? 18 ASP A HB3  4 
ATOM 1832 N N    . CYS A 1 19 ? -2.160  -5.930  1.515   1.00 0.00 ? 19 CYS A N    4 
ATOM 1833 C CA   . CYS A 1 19 ? -2.370  -5.914  2.988   1.00 0.00 ? 19 CYS A CA   4 
ATOM 1834 C C    . CYS A 1 19 ? -3.865  -5.784  3.270   1.00 0.00 ? 19 CYS A C    4 
ATOM 1835 O O    . CYS A 1 19 ? -4.437  -6.537  4.033   1.00 0.00 ? 19 CYS A O    4 
ATOM 1836 C CB   . CYS A 1 19 ? -1.625  -4.716  3.584   1.00 0.00 ? 19 CYS A CB   4 
ATOM 1837 S SG   . CYS A 1 19 ? -1.446  -4.935  5.372   1.00 0.00 ? 19 CYS A SG   4 
ATOM 1838 H H    . CYS A 1 19 ? -1.642  -5.217  1.088   1.00 0.00 ? 19 CYS A H    4 
ATOM 1839 H HA   . CYS A 1 19 ? -1.995  -6.830  3.420   1.00 0.00 ? 19 CYS A HA   4 
ATOM 1840 H HB2  . CYS A 1 19 ? -0.651  -4.643  3.131   1.00 0.00 ? 19 CYS A HB2  4 
ATOM 1841 H HB3  . CYS A 1 19 ? -2.179  -3.810  3.386   1.00 0.00 ? 19 CYS A HB3  4 
ATOM 1842 N N    . CYS A 1 20 ? -4.498  -4.833  2.646   1.00 0.00 ? 20 CYS A N    4 
ATOM 1843 C CA   . CYS A 1 20 ? -5.960  -4.635  2.850   1.00 0.00 ? 20 CYS A CA   4 
ATOM 1844 C C    . CYS A 1 20 ? -6.743  -5.797  2.236   1.00 0.00 ? 20 CYS A C    4 
ATOM 1845 O O    . CYS A 1 20 ? -7.805  -6.157  2.707   1.00 0.00 ? 20 CYS A O    4 
ATOM 1846 C CB   . CYS A 1 20 ? -6.381  -3.317  2.198   1.00 0.00 ? 20 CYS A CB   4 
ATOM 1847 S SG   . CYS A 1 20 ? -6.313  -2.003  3.438   1.00 0.00 ? 20 CYS A SG   4 
ATOM 1848 H H    . CYS A 1 20 ? -4.008  -4.245  2.033   1.00 0.00 ? 20 CYS A H    4 
ATOM 1849 H HA   . CYS A 1 20 ? -6.168  -4.588  3.909   1.00 0.00 ? 20 CYS A HA   4 
ATOM 1850 H HB2  . CYS A 1 20 ? -5.700  -3.085  1.391   1.00 0.00 ? 20 CYS A HB2  4 
ATOM 1851 H HB3  . CYS A 1 20 ? -7.385  -3.398  1.806   1.00 0.00 ? 20 CYS A HB3  4 
ATOM 1852 N N    . GLY A 1 21 ? -6.235  -6.390  1.195   1.00 0.00 ? 21 GLY A N    4 
ATOM 1853 C CA   . GLY A 1 21 ? -6.960  -7.530  0.566   1.00 0.00 ? 21 GLY A CA   4 
ATOM 1854 C C    . GLY A 1 21 ? -6.192  -8.013  -0.663  1.00 0.00 ? 21 GLY A C    4 
ATOM 1855 O O    . GLY A 1 21 ? -5.635  -9.092  -0.676  1.00 0.00 ? 21 GLY A O    4 
ATOM 1856 H H    . GLY A 1 21 ? -5.378  -6.092  0.828   1.00 0.00 ? 21 GLY A H    4 
ATOM 1857 H HA2  . GLY A 1 21 ? -7.043  -8.335  1.280   1.00 0.00 ? 21 GLY A HA2  4 
ATOM 1858 H HA3  . GLY A 1 21 ? -7.946  -7.208  0.268   1.00 0.00 ? 21 GLY A HA3  4 
ATOM 1859 N N    . GLY A 1 22 ? -6.161  -7.223  -1.700  1.00 0.00 ? 22 GLY A N    4 
ATOM 1860 C CA   . GLY A 1 22 ? -5.434  -7.635  -2.928  1.00 0.00 ? 22 GLY A CA   4 
ATOM 1861 C C    . GLY A 1 22 ? -5.621  -6.573  -4.011  1.00 0.00 ? 22 GLY A C    4 
ATOM 1862 O O    . GLY A 1 22 ? -6.298  -5.584  -3.812  1.00 0.00 ? 22 GLY A O    4 
ATOM 1863 H H    . GLY A 1 22 ? -6.619  -6.360  -1.672  1.00 0.00 ? 22 GLY A H    4 
ATOM 1864 H HA2  . GLY A 1 22 ? -4.383  -7.744  -2.704  1.00 0.00 ? 22 GLY A HA2  4 
ATOM 1865 H HA3  . GLY A 1 22 ? -5.828  -8.574  -3.279  1.00 0.00 ? 22 GLY A HA3  4 
ATOM 1866 N N    . LYS A 1 23 ? -5.026  -6.767  -5.154  1.00 0.00 ? 23 LYS A N    4 
ATOM 1867 C CA   . LYS A 1 23 ? -5.174  -5.767  -6.248  1.00 0.00 ? 23 LYS A CA   4 
ATOM 1868 C C    . LYS A 1 23 ? -6.639  -5.338  -6.353  1.00 0.00 ? 23 LYS A C    4 
ATOM 1869 O O    . LYS A 1 23 ? -7.449  -6.013  -6.956  1.00 0.00 ? 23 LYS A O    4 
ATOM 1870 C CB   . LYS A 1 23 ? -4.729  -6.391  -7.574  1.00 0.00 ? 23 LYS A CB   4 
ATOM 1871 C CG   . LYS A 1 23 ? -3.233  -6.705  -7.516  1.00 0.00 ? 23 LYS A CG   4 
ATOM 1872 C CD   . LYS A 1 23 ? -2.669  -6.771  -8.936  1.00 0.00 ? 23 LYS A CD   4 
ATOM 1873 C CE   . LYS A 1 23 ? -2.957  -8.148  -9.536  1.00 0.00 ? 23 LYS A CE   4 
ATOM 1874 N NZ   . LYS A 1 23 ? -2.336  -9.199  -8.681  1.00 0.00 ? 23 LYS A NZ   4 
ATOM 1875 H H    . LYS A 1 23 ? -4.485  -7.573  -5.295  1.00 0.00 ? 23 LYS A H    4 
ATOM 1876 H HA   . LYS A 1 23 ? -4.560  -4.905  -6.032  1.00 0.00 ? 23 LYS A HA   4 
ATOM 1877 H HB2  . LYS A 1 23 ? -5.283  -7.302  -7.747  1.00 0.00 ? 23 LYS A HB2  4 
ATOM 1878 H HB3  . LYS A 1 23 ? -4.917  -5.697  -8.379  1.00 0.00 ? 23 LYS A HB3  4 
ATOM 1879 H HG2  . LYS A 1 23 ? -2.725  -5.931  -6.960  1.00 0.00 ? 23 LYS A HG2  4 
ATOM 1880 H HG3  . LYS A 1 23 ? -3.083  -7.657  -7.027  1.00 0.00 ? 23 LYS A HG3  4 
ATOM 1881 H HD2  . LYS A 1 23 ? -3.136  -6.008  -9.544  1.00 0.00 ? 23 LYS A HD2  4 
ATOM 1882 H HD3  . LYS A 1 23 ? -1.602  -6.607  -8.909  1.00 0.00 ? 23 LYS A HD3  4 
ATOM 1883 H HE2  . LYS A 1 23 ? -4.025  -8.306  -9.582  1.00 0.00 ? 23 LYS A HE2  4 
ATOM 1884 H HE3  . LYS A 1 23 ? -2.542  -8.202  -10.533 1.00 0.00 ? 23 LYS A HE3  4 
ATOM 1885 H HZ1  . LYS A 1 23 ? -1.409  -8.868  -8.343  1.00 0.00 ? 23 LYS A HZ1  4 
ATOM 1886 H HZ2  . LYS A 1 23 ? -2.953  -9.394  -7.868  1.00 0.00 ? 23 LYS A HZ2  4 
ATOM 1887 H HZ3  . LYS A 1 23 ? -2.212  -10.070 -9.236  1.00 0.00 ? 23 LYS A HZ3  4 
ATOM 1888 N N    . GLY A 1 24 ? -6.986  -4.219  -5.778  1.00 0.00 ? 24 GLY A N    4 
ATOM 1889 C CA   . GLY A 1 24 ? -8.400  -3.752  -5.857  1.00 0.00 ? 24 GLY A CA   4 
ATOM 1890 C C    . GLY A 1 24 ? -8.928  -3.427  -4.457  1.00 0.00 ? 24 GLY A C    4 
ATOM 1891 O O    . GLY A 1 24 ? -10.099 -3.160  -4.276  1.00 0.00 ? 24 GLY A O    4 
ATOM 1892 H H    . GLY A 1 24 ? -6.318  -3.684  -5.300  1.00 0.00 ? 24 GLY A H    4 
ATOM 1893 H HA2  . GLY A 1 24 ? -8.450  -2.866  -6.473  1.00 0.00 ? 24 GLY A HA2  4 
ATOM 1894 H HA3  . GLY A 1 24 ? -9.010  -4.528  -6.295  1.00 0.00 ? 24 GLY A HA3  4 
ATOM 1895 N N    . ARG A 1 25 ? -8.080  -3.441  -3.466  1.00 0.00 ? 25 ARG A N    4 
ATOM 1896 C CA   . ARG A 1 25 ? -8.550  -3.128  -2.086  1.00 0.00 ? 25 ARG A CA   4 
ATOM 1897 C C    . ARG A 1 25 ? -7.436  -2.420  -1.314  1.00 0.00 ? 25 ARG A C    4 
ATOM 1898 O O    . ARG A 1 25 ? -7.218  -2.671  -0.148  1.00 0.00 ? 25 ARG A O    4 
ATOM 1899 C CB   . ARG A 1 25 ? -8.927  -4.426  -1.363  1.00 0.00 ? 25 ARG A CB   4 
ATOM 1900 C CG   . ARG A 1 25 ? -9.452  -5.449  -2.377  1.00 0.00 ? 25 ARG A CG   4 
ATOM 1901 C CD   . ARG A 1 25 ? -10.150 -6.592  -1.637  1.00 0.00 ? 25 ARG A CD   4 
ATOM 1902 N NE   . ARG A 1 25 ? -11.040 -7.326  -2.581  1.00 0.00 ? 25 ARG A NE   4 
ATOM 1903 C CZ   . ARG A 1 25 ? -12.050 -8.015  -2.123  1.00 0.00 ? 25 ARG A CZ   4 
ATOM 1904 N NH1  . ARG A 1 25 ? -11.861 -8.904  -1.186  1.00 0.00 ? 25 ARG A NH1  4 
ATOM 1905 N NH2  . ARG A 1 25 ? -13.249 -7.813  -2.599  1.00 0.00 ? 25 ARG A NH2  4 
ATOM 1906 H H    . ARG A 1 25 ? -7.139  -3.657  -3.627  1.00 0.00 ? 25 ARG A H    4 
ATOM 1907 H HA   . ARG A 1 25 ? -9.414  -2.483  -2.140  1.00 0.00 ? 25 ARG A HA   4 
ATOM 1908 H HB2  . ARG A 1 25 ? -8.055  -4.826  -0.866  1.00 0.00 ? 25 ARG A HB2  4 
ATOM 1909 H HB3  . ARG A 1 25 ? -9.694  -4.220  -0.633  1.00 0.00 ? 25 ARG A HB3  4 
ATOM 1910 H HG2  . ARG A 1 25 ? -10.152 -4.969  -3.043  1.00 0.00 ? 25 ARG A HG2  4 
ATOM 1911 H HG3  . ARG A 1 25 ? -8.625  -5.846  -2.949  1.00 0.00 ? 25 ARG A HG3  4 
ATOM 1912 H HD2  . ARG A 1 25 ? -9.410  -7.272  -1.241  1.00 0.00 ? 25 ARG A HD2  4 
ATOM 1913 H HD3  . ARG A 1 25 ? -10.740 -6.191  -0.826  1.00 0.00 ? 25 ARG A HD3  4 
ATOM 1914 H HE   . ARG A 1 25 ? -10.867 -7.293  -3.545  1.00 0.00 ? 25 ARG A HE   4 
ATOM 1915 H HH11 . ARG A 1 25 ? -10.943 -9.057  -0.821  1.00 0.00 ? 25 ARG A HH11 4 
ATOM 1916 H HH12 . ARG A 1 25 ? -12.634 -9.432  -0.835  1.00 0.00 ? 25 ARG A HH12 4 
ATOM 1917 H HH21 . ARG A 1 25 ? -13.395 -7.129  -3.315  1.00 0.00 ? 25 ARG A HH21 4 
ATOM 1918 H HH22 . ARG A 1 25 ? -14.022 -8.343  -2.249  1.00 0.00 ? 25 ARG A HH22 4 
ATOM 1919 N N    . GLY A 1 26 ? -6.735  -1.532  -1.958  1.00 0.00 ? 26 GLY A N    4 
ATOM 1920 C CA   . GLY A 1 26 ? -5.634  -0.802  -1.272  1.00 0.00 ? 26 GLY A CA   4 
ATOM 1921 C C    . GLY A 1 26 ? -5.183  0.394   -2.112  1.00 0.00 ? 26 GLY A C    4 
ATOM 1922 O O    . GLY A 1 26 ? -5.280  0.393   -3.324  1.00 0.00 ? 26 GLY A O    4 
ATOM 1923 H H    . GLY A 1 26 ? -6.933  -1.343  -2.889  1.00 0.00 ? 26 GLY A H    4 
ATOM 1924 H HA2  . GLY A 1 26 ? -5.975  -0.456  -0.324  1.00 0.00 ? 26 GLY A HA2  4 
ATOM 1925 H HA3  . GLY A 1 26 ? -4.813  -1.462  -1.121  1.00 0.00 ? 26 GLY A HA3  4 
ATOM 1926 N N    . LYS A 1 27 ? -4.696  1.420   -1.468  1.00 0.00 ? 27 LYS A N    4 
ATOM 1927 C CA   . LYS A 1 27 ? -4.238  2.627   -2.207  1.00 0.00 ? 27 LYS A CA   4 
ATOM 1928 C C    . LYS A 1 27 ? -3.343  3.467   -1.295  1.00 0.00 ? 27 LYS A C    4 
ATOM 1929 O O    . LYS A 1 27 ? -3.687  3.747   -0.164  1.00 0.00 ? 27 LYS A O    4 
ATOM 1930 C CB   . LYS A 1 27 ? -5.454  3.458   -2.625  1.00 0.00 ? 27 LYS A CB   4 
ATOM 1931 C CG   . LYS A 1 27 ? -5.324  3.851   -4.095  1.00 0.00 ? 27 LYS A CG   4 
ATOM 1932 C CD   . LYS A 1 27 ? -6.718  4.027   -4.698  1.00 0.00 ? 27 LYS A CD   4 
ATOM 1933 C CE   . LYS A 1 27 ? -6.648  3.820   -6.211  1.00 0.00 ? 27 LYS A CE   4 
ATOM 1934 N NZ   . LYS A 1 27 ? -5.536  4.639   -6.770  1.00 0.00 ? 27 LYS A NZ   4 
ATOM 1935 H H    . LYS A 1 27 ? -4.635  1.395   -0.491  1.00 0.00 ? 27 LYS A H    4 
ATOM 1936 H HA   . LYS A 1 27 ? -3.685  2.329   -3.086  1.00 0.00 ? 27 LYS A HA   4 
ATOM 1937 H HB2  . LYS A 1 27 ? -6.352  2.874   -2.484  1.00 0.00 ? 27 LYS A HB2  4 
ATOM 1938 H HB3  . LYS A 1 27 ? -5.504  4.350   -2.019  1.00 0.00 ? 27 LYS A HB3  4 
ATOM 1939 H HG2  . LYS A 1 27 ? -4.777  4.780   -4.173  1.00 0.00 ? 27 LYS A HG2  4 
ATOM 1940 H HG3  . LYS A 1 27 ? -4.798  3.076   -4.631  1.00 0.00 ? 27 LYS A HG3  4 
ATOM 1941 H HD2  . LYS A 1 27 ? -7.390  3.299   -4.265  1.00 0.00 ? 27 LYS A HD2  4 
ATOM 1942 H HD3  . LYS A 1 27 ? -7.078  5.022   -4.488  1.00 0.00 ? 27 LYS A HD3  4 
ATOM 1943 H HE2  . LYS A 1 27 ? -6.469  2.777   -6.424  1.00 0.00 ? 27 LYS A HE2  4 
ATOM 1944 H HE3  . LYS A 1 27 ? -7.581  4.126   -6.659  1.00 0.00 ? 27 LYS A HE3  4 
ATOM 1945 H HZ1  . LYS A 1 27 ? -5.559  5.590   -6.350  1.00 0.00 ? 27 LYS A HZ1  4 
ATOM 1946 H HZ2  . LYS A 1 27 ? -4.626  4.184   -6.550  1.00 0.00 ? 27 LYS A HZ2  4 
ATOM 1947 H HZ3  . LYS A 1 27 ? -5.646  4.715   -7.801  1.00 0.00 ? 27 LYS A HZ3  4 
ATOM 1948 N N    . CYS A 1 28 ? -2.198  3.869   -1.773  1.00 0.00 ? 28 CYS A N    4 
ATOM 1949 C CA   . CYS A 1 28 ? -1.285  4.689   -0.929  1.00 0.00 ? 28 CYS A CA   4 
ATOM 1950 C C    . CYS A 1 28 ? -1.751  6.151   -0.941  1.00 0.00 ? 28 CYS A C    4 
ATOM 1951 O O    . CYS A 1 28 ? -1.236  6.963   -1.684  1.00 0.00 ? 28 CYS A O    4 
ATOM 1952 C CB   . CYS A 1 28 ? 0.136   4.611   -1.494  1.00 0.00 ? 28 CYS A CB   4 
ATOM 1953 S SG   . CYS A 1 28 ? 0.665   2.883   -1.567  1.00 0.00 ? 28 CYS A SG   4 
ATOM 1954 H H    . CYS A 1 28 ? -1.940  3.633   -2.688  1.00 0.00 ? 28 CYS A H    4 
ATOM 1955 H HA   . CYS A 1 28 ? -1.290  4.310   0.083   1.00 0.00 ? 28 CYS A HA   4 
ATOM 1956 H HB2  . CYS A 1 28 ? 0.153   5.035   -2.487  1.00 0.00 ? 28 CYS A HB2  4 
ATOM 1957 H HB3  . CYS A 1 28 ? 0.807   5.165   -0.855  1.00 0.00 ? 28 CYS A HB3  4 
ATOM 1958 N N    . TYR A 1 29 ? -2.713  6.502   -0.125  1.00 0.00 ? 29 TYR A N    4 
ATOM 1959 C CA   . TYR A 1 29 ? -3.184  7.917   -0.106  1.00 0.00 ? 29 TYR A CA   4 
ATOM 1960 C C    . TYR A 1 29 ? -2.223  8.743   0.744   1.00 0.00 ? 29 TYR A C    4 
ATOM 1961 O O    . TYR A 1 29 ? -2.106  8.536   1.934   1.00 0.00 ? 29 TYR A O    4 
ATOM 1962 C CB   . TYR A 1 29 ? -4.585  7.991   0.507   1.00 0.00 ? 29 TYR A CB   4 
ATOM 1963 C CG   . TYR A 1 29 ? -5.627  7.820   -0.573  1.00 0.00 ? 29 TYR A CG   4 
ATOM 1964 C CD1  . TYR A 1 29 ? -5.666  8.705   -1.656  1.00 0.00 ? 29 TYR A CD1  4 
ATOM 1965 C CD2  . TYR A 1 29 ? -6.560  6.778   -0.486  1.00 0.00 ? 29 TYR A CD2  4 
ATOM 1966 C CE1  . TYR A 1 29 ? -6.636  8.549   -2.653  1.00 0.00 ? 29 TYR A CE1  4 
ATOM 1967 C CE2  . TYR A 1 29 ? -7.530  6.622   -1.483  1.00 0.00 ? 29 TYR A CE2  4 
ATOM 1968 C CZ   . TYR A 1 29 ? -7.568  7.508   -2.566  1.00 0.00 ? 29 TYR A CZ   4 
ATOM 1969 O OH   . TYR A 1 29 ? -8.526  7.356   -3.549  1.00 0.00 ? 29 TYR A OH   4 
ATOM 1970 H H    . TYR A 1 29 ? -3.119  5.843   0.479   1.00 0.00 ? 29 TYR A H    4 
ATOM 1971 H HA   . TYR A 1 29 ? -3.205  8.307   -1.113  1.00 0.00 ? 29 TYR A HA   4 
ATOM 1972 H HB2  . TYR A 1 29 ? -4.697  7.210   1.243   1.00 0.00 ? 29 TYR A HB2  4 
ATOM 1973 H HB3  . TYR A 1 29 ? -4.716  8.953   0.982   1.00 0.00 ? 29 TYR A HB3  4 
ATOM 1974 H HD1  . TYR A 1 29 ? -4.948  9.509   -1.723  1.00 0.00 ? 29 TYR A HD1  4 
ATOM 1975 H HD2  . TYR A 1 29 ? -6.530  6.095   0.350   1.00 0.00 ? 29 TYR A HD2  4 
ATOM 1976 H HE1  . TYR A 1 29 ? -6.666  9.232   -3.489  1.00 0.00 ? 29 TYR A HE1  4 
ATOM 1977 H HE2  . TYR A 1 29 ? -8.249  5.819   -1.416  1.00 0.00 ? 29 TYR A HE2  4 
ATOM 1978 H HH   . TYR A 1 29 ? -8.341  6.540   -4.018  1.00 0.00 ? 29 TYR A HH   4 
ATOM 1979 N N    . GLY A 1 30 ? -1.525  9.671   0.152   1.00 0.00 ? 30 GLY A N    4 
ATOM 1980 C CA   . GLY A 1 30 ? -0.572  10.489  0.950   1.00 0.00 ? 30 GLY A CA   4 
ATOM 1981 C C    . GLY A 1 30 ? 0.415   9.558   1.652   1.00 0.00 ? 30 GLY A C    4 
ATOM 1982 O O    . GLY A 1 30 ? 0.983   8.675   1.042   1.00 0.00 ? 30 GLY A O    4 
ATOM 1983 H H    . GLY A 1 30 ? -1.624  9.826   -0.809  1.00 0.00 ? 30 GLY A H    4 
ATOM 1984 H HA2  . GLY A 1 30 ? -0.038  11.164  0.300   1.00 0.00 ? 30 GLY A HA2  4 
ATOM 1985 H HA3  . GLY A 1 30 ? -1.115  11.055  1.689   1.00 0.00 ? 30 GLY A HA3  4 
ATOM 1986 N N    . PRO A 1 31 ? 0.576   9.788   2.922   1.00 0.00 ? 31 PRO A N    4 
ATOM 1987 C CA   . PRO A 1 31 ? 1.503   8.942   3.706   1.00 0.00 ? 31 PRO A CA   4 
ATOM 1988 C C    . PRO A 1 31 ? 0.736   7.815   4.404   1.00 0.00 ? 31 PRO A C    4 
ATOM 1989 O O    . PRO A 1 31 ? 1.310   6.987   5.083   1.00 0.00 ? 31 PRO A O    4 
ATOM 1990 C CB   . PRO A 1 31 ? 2.110   9.897   4.735   1.00 0.00 ? 31 PRO A CB   4 
ATOM 1991 C CG   . PRO A 1 31 ? 1.120   11.069  4.871   1.00 0.00 ? 31 PRO A CG   4 
ATOM 1992 C CD   . PRO A 1 31 ? 0.289   11.083  3.577   1.00 0.00 ? 31 PRO A CD   4 
ATOM 1993 H HA   . PRO A 1 31 ? 2.278   8.540   3.074   1.00 0.00 ? 31 PRO A HA   4 
ATOM 1994 H HB2  . PRO A 1 31 ? 2.225   9.392   5.685   1.00 0.00 ? 31 PRO A HB2  4 
ATOM 1995 H HB3  . PRO A 1 31 ? 3.063   10.263  4.388   1.00 0.00 ? 31 PRO A HB3  4 
ATOM 1996 H HG2  . PRO A 1 31 ? 0.478   10.915  5.727   1.00 0.00 ? 31 PRO A HG2  4 
ATOM 1997 H HG3  . PRO A 1 31 ? 1.657   12.000  4.969   1.00 0.00 ? 31 PRO A HG3  4 
ATOM 1998 H HD2  . PRO A 1 31 ? -0.765  11.167  3.802   1.00 0.00 ? 31 PRO A HD2  4 
ATOM 1999 H HD3  . PRO A 1 31 ? 0.601   11.896  2.939   1.00 0.00 ? 31 PRO A HD3  4 
ATOM 2000 N N    . GLN A 1 32 ? -0.560  7.782   4.249   1.00 0.00 ? 32 GLN A N    4 
ATOM 2001 C CA   . GLN A 1 32 ? -1.362  6.715   4.913   1.00 0.00 ? 32 GLN A CA   4 
ATOM 2002 C C    . GLN A 1 32 ? -1.688  5.596   3.918   1.00 0.00 ? 32 GLN A C    4 
ATOM 2003 O O    . GLN A 1 32 ? -2.376  5.801   2.934   1.00 0.00 ? 32 GLN A O    4 
ATOM 2004 C CB   . GLN A 1 32 ? -2.666  7.318   5.438   1.00 0.00 ? 32 GLN A CB   4 
ATOM 2005 C CG   . GLN A 1 32 ? -2.350  8.365   6.508   1.00 0.00 ? 32 GLN A CG   4 
ATOM 2006 C CD   . GLN A 1 32 ? -3.641  9.067   6.930   1.00 0.00 ? 32 GLN A CD   4 
ATOM 2007 O OE1  . GLN A 1 32 ? -4.142  9.920   6.225   1.00 0.00 ? 32 GLN A OE1  4 
ATOM 2008 N NE2  . GLN A 1 32 ? -4.206  8.744   8.062   1.00 0.00 ? 32 GLN A NE2  4 
ATOM 2009 H H    . GLN A 1 32 ? -1.005  8.462   3.705   1.00 0.00 ? 32 GLN A H    4 
ATOM 2010 H HA   . GLN A 1 32 ? -0.800  6.307   5.740   1.00 0.00 ? 32 GLN A HA   4 
ATOM 2011 H HB2  . GLN A 1 32 ? -3.200  7.785   4.623   1.00 0.00 ? 32 GLN A HB2  4 
ATOM 2012 H HB3  . GLN A 1 32 ? -3.276  6.539   5.869   1.00 0.00 ? 32 GLN A HB3  4 
ATOM 2013 H HG2  . GLN A 1 32 ? -1.905  7.881   7.365   1.00 0.00 ? 32 GLN A HG2  4 
ATOM 2014 H HG3  . GLN A 1 32 ? -1.661  9.093   6.107   1.00 0.00 ? 32 GLN A HG3  4 
ATOM 2015 H HE21 . GLN A 1 32 ? -3.801  8.056   8.632   1.00 0.00 ? 32 GLN A HE21 4 
ATOM 2016 H HE22 . GLN A 1 32 ? -5.034  9.187   8.342   1.00 0.00 ? 32 GLN A HE22 4 
ATOM 2017 N N    . CYS A 1 33 ? -1.207  4.409   4.177   1.00 0.00 ? 33 CYS A N    4 
ATOM 2018 C CA   . CYS A 1 33 ? -1.494  3.267   3.265   1.00 0.00 ? 33 CYS A CA   4 
ATOM 2019 C C    . CYS A 1 33 ? -2.742  2.537   3.764   1.00 0.00 ? 33 CYS A C    4 
ATOM 2020 O O    . CYS A 1 33 ? -2.709  1.848   4.765   1.00 0.00 ? 33 CYS A O    4 
ATOM 2021 C CB   . CYS A 1 33 ? -0.309  2.301   3.267   1.00 0.00 ? 33 CYS A CB   4 
ATOM 2022 S SG   . CYS A 1 33 ? -0.709  0.863   2.241   1.00 0.00 ? 33 CYS A SG   4 
ATOM 2023 H H    . CYS A 1 33 ? -0.662  4.267   4.978   1.00 0.00 ? 33 CYS A H    4 
ATOM 2024 H HA   . CYS A 1 33 ? -1.664  3.635   2.265   1.00 0.00 ? 33 CYS A HA   4 
ATOM 2025 H HB2  . CYS A 1 33 ? 0.562   2.800   2.872   1.00 0.00 ? 33 CYS A HB2  4 
ATOM 2026 H HB3  . CYS A 1 33 ? -0.111  1.977   4.279   1.00 0.00 ? 33 CYS A HB3  4 
ATOM 2027 N N    . LEU A 1 34 ? -3.843  2.685   3.083   1.00 0.00 ? 34 LEU A N    4 
ATOM 2028 C CA   . LEU A 1 34 ? -5.086  2.002   3.532   1.00 0.00 ? 34 LEU A CA   4 
ATOM 2029 C C    . LEU A 1 34 ? -5.625  1.116   2.409   1.00 0.00 ? 34 LEU A C    4 
ATOM 2030 O O    . LEU A 1 34 ? -4.919  0.762   1.487   1.00 0.00 ? 34 LEU A O    4 
ATOM 2031 C CB   . LEU A 1 34 ? -6.134  3.052   3.908   1.00 0.00 ? 34 LEU A CB   4 
ATOM 2032 C CG   . LEU A 1 34 ? -5.501  4.098   4.827   1.00 0.00 ? 34 LEU A CG   4 
ATOM 2033 C CD1  . LEU A 1 34 ? -6.194  5.447   4.621   1.00 0.00 ? 34 LEU A CD1  4 
ATOM 2034 C CD2  . LEU A 1 34 ? -5.664  3.661   6.285   1.00 0.00 ? 34 LEU A CD2  4 
ATOM 2035 H H    . LEU A 1 34 ? -3.854  3.248   2.281   1.00 0.00 ? 34 LEU A H    4 
ATOM 2036 H HA   . LEU A 1 34 ? -4.868  1.392   4.395   1.00 0.00 ? 34 LEU A HA   4 
ATOM 2037 H HB2  . LEU A 1 34 ? -6.499  3.532   3.011   1.00 0.00 ? 34 LEU A HB2  4 
ATOM 2038 H HB3  . LEU A 1 34 ? -6.954  2.574   4.421   1.00 0.00 ? 34 LEU A HB3  4 
ATOM 2039 H HG   . LEU A 1 34 ? -4.450  4.194   4.594   1.00 0.00 ? 34 LEU A HG   4 
ATOM 2040 H HD11 . LEU A 1 34 ? -7.007  5.331   3.921   1.00 0.00 ? 34 LEU A HD11 4 
ATOM 2041 H HD12 . LEU A 1 34 ? -6.579  5.802   5.566   1.00 0.00 ? 34 LEU A HD12 4 
ATOM 2042 H HD13 . LEU A 1 34 ? -5.482  6.160   4.232   1.00 0.00 ? 34 LEU A HD13 4 
ATOM 2043 H HD21 . LEU A 1 34 ? -6.637  3.214   6.421   1.00 0.00 ? 34 LEU A HD21 4 
ATOM 2044 H HD22 . LEU A 1 34 ? -4.899  2.938   6.530   1.00 0.00 ? 34 LEU A HD22 4 
ATOM 2045 H HD23 . LEU A 1 34 ? -5.568  4.521   6.932   1.00 0.00 ? 34 LEU A HD23 4 
ATOM 2046 N N    . CYS A 1 35 ? -6.873  0.750   2.489   1.00 0.00 ? 35 CYS A N    4 
ATOM 2047 C CA   . CYS A 1 35 ? -7.472  -0.123  1.438   1.00 0.00 ? 35 CYS A CA   4 
ATOM 2048 C C    . CYS A 1 35 ? -7.907  0.728   0.245   1.00 0.00 ? 35 CYS A C    4 
ATOM 2049 O O    . CYS A 1 35 ? -7.580  1.893   0.145   1.00 0.00 ? 35 CYS A O    4 
ATOM 2050 C CB   . CYS A 1 35 ? -8.686  -0.838  2.028   1.00 0.00 ? 35 CYS A CB   4 
ATOM 2051 S SG   . CYS A 1 35 ? -8.245  -1.468  3.662   1.00 0.00 ? 35 CYS A SG   4 
ATOM 2052 H H    . CYS A 1 35 ? -7.419  1.045   3.246   1.00 0.00 ? 35 CYS A H    4 
ATOM 2053 H HA   . CYS A 1 35 ? -6.742  -0.859  1.117   1.00 0.00 ? 35 CYS A HA   4 
ATOM 2054 H HB2  . CYS A 1 35 ? -9.510  -0.144  2.115   1.00 0.00 ? 35 CYS A HB2  4 
ATOM 2055 H HB3  . CYS A 1 35 ? -8.970  -1.660  1.387   1.00 0.00 ? 35 CYS A HB3  4 
ATOM 2056 N N    . ARG A 1 36 ? -8.646  0.152   -0.662  1.00 0.00 ? 36 ARG A N    4 
ATOM 2057 C CA   . ARG A 1 36 ? -9.105  0.919   -1.850  1.00 0.00 ? 36 ARG A CA   4 
ATOM 2058 C C    . ARG A 1 36 ? -10.109 1.987   -1.409  1.00 0.00 ? 36 ARG A C    4 
ATOM 2059 O O    . ARG A 1 36 ? -9.673  3.056   -1.016  1.00 0.00 ? 36 ARG A O    4 
ATOM 2060 C CB   . ARG A 1 36 ? -9.772  -0.031  -2.846  1.00 0.00 ? 36 ARG A CB   4 
ATOM 2061 C CG   . ARG A 1 36 ? -10.365 0.776   -4.002  1.00 0.00 ? 36 ARG A CG   4 
ATOM 2062 C CD   . ARG A 1 36 ? -11.307 -0.114  -4.817  1.00 0.00 ? 36 ARG A CD   4 
ATOM 2063 N NE   . ARG A 1 36 ? -11.982 0.702   -5.866  1.00 0.00 ? 36 ARG A NE   4 
ATOM 2064 C CZ   . ARG A 1 36 ? -12.785 1.673   -5.523  1.00 0.00 ? 36 ARG A CZ   4 
ATOM 2065 N NH1  . ARG A 1 36 ? -13.325 1.686   -4.335  1.00 0.00 ? 36 ARG A NH1  4 
ATOM 2066 N NH2  . ARG A 1 36 ? -13.050 2.631   -6.370  1.00 0.00 ? 36 ARG A NH2  4 
ATOM 2067 O OXT  . ARG A 1 36 ? -11.297 1.715   -1.468  1.00 0.00 ? 36 ARG A OXT  4 
ATOM 2068 H H    . ARG A 1 36 ? -8.897  -0.788  -0.563  1.00 0.00 ? 36 ARG A H    4 
ATOM 2069 H HA   . ARG A 1 36 ? -8.257  1.393   -2.317  1.00 0.00 ? 36 ARG A HA   4 
ATOM 2070 H HB2  . ARG A 1 36 ? -9.037  -0.723  -3.229  1.00 0.00 ? 36 ARG A HB2  4 
ATOM 2071 H HB3  . ARG A 1 36 ? -10.558 -0.578  -2.350  1.00 0.00 ? 36 ARG A HB3  4 
ATOM 2072 H HG2  . ARG A 1 36 ? -10.916 1.618   -3.607  1.00 0.00 ? 36 ARG A HG2  4 
ATOM 2073 H HG3  . ARG A 1 36 ? -9.570  1.133   -4.640  1.00 0.00 ? 36 ARG A HG3  4 
ATOM 2074 H HD2  . ARG A 1 36 ? -10.739 -0.903  -5.286  1.00 0.00 ? 36 ARG A HD2  4 
ATOM 2075 H HD3  . ARG A 1 36 ? -12.050 -0.545  -4.163  1.00 0.00 ? 36 ARG A HD3  4 
ATOM 2076 H HE   . ARG A 1 36 ? -11.825 0.509   -6.813  1.00 0.00 ? 36 ARG A HE   4 
ATOM 2077 H HH11 . ARG A 1 36 ? -13.123 0.953   -3.685  1.00 0.00 ? 36 ARG A HH11 4 
ATOM 2078 H HH12 . ARG A 1 36 ? -13.941 2.430   -4.073  1.00 0.00 ? 36 ARG A HH12 4 
ATOM 2079 H HH21 . ARG A 1 36 ? -12.637 2.622   -7.281  1.00 0.00 ? 36 ARG A HH21 4 
ATOM 2080 H HH22 . ARG A 1 36 ? -13.665 3.375   -6.108  1.00 0.00 ? 36 ARG A HH22 4 
ATOM 2081 N N    . MET A 1 1  ? -5.351  1.637   8.634   1.00 0.00 ? 1  MET A N    5 
ATOM 2082 C CA   . MET A 1 1  ? -4.316  1.712   7.564   1.00 0.00 ? 1  MET A CA   5 
ATOM 2083 C C    . MET A 1 1  ? -3.309  0.571   7.741   1.00 0.00 ? 1  MET A C    5 
ATOM 2084 O O    . MET A 1 1  ? -3.103  0.075   8.831   1.00 0.00 ? 1  MET A O    5 
ATOM 2085 C CB   . MET A 1 1  ? -3.587  3.055   7.653   1.00 0.00 ? 1  MET A CB   5 
ATOM 2086 C CG   . MET A 1 1  ? -3.427  3.456   9.121   1.00 0.00 ? 1  MET A CG   5 
ATOM 2087 S SD   . MET A 1 1  ? -2.168  2.415   9.897   1.00 0.00 ? 1  MET A SD   5 
ATOM 2088 C CE   . MET A 1 1  ? -2.129  3.256   11.497  1.00 0.00 ? 1  MET A CE   5 
ATOM 2089 H H1   . MET A 1 1  ? -4.888  1.473   9.553   1.00 0.00 ? 1  MET A H1   5 
ATOM 2090 H H2   . MET A 1 1  ? -5.881  2.530   8.668   1.00 0.00 ? 1  MET A H2   5 
ATOM 2091 H H3   . MET A 1 1  ? -6.005  0.857   8.430   1.00 0.00 ? 1  MET A H3   5 
ATOM 2092 H HA   . MET A 1 1  ? -4.792  1.624   6.598   1.00 0.00 ? 1  MET A HA   5 
ATOM 2093 H HB2  . MET A 1 1  ? -2.613  2.967   7.195   1.00 0.00 ? 1  MET A HB2  5 
ATOM 2094 H HB3  . MET A 1 1  ? -4.160  3.811   7.136   1.00 0.00 ? 1  MET A HB3  5 
ATOM 2095 H HG2  . MET A 1 1  ? -3.125  4.491   9.180   1.00 0.00 ? 1  MET A HG2  5 
ATOM 2096 H HG3  . MET A 1 1  ? -4.369  3.327   9.634   1.00 0.00 ? 1  MET A HG3  5 
ATOM 2097 H HE1  . MET A 1 1  ? -3.131  3.308   11.901  1.00 0.00 ? 1  MET A HE1  5 
ATOM 2098 H HE2  . MET A 1 1  ? -1.489  2.707   12.176  1.00 0.00 ? 1  MET A HE2  5 
ATOM 2099 H HE3  . MET A 1 1  ? -1.742  4.254   11.371  1.00 0.00 ? 1  MET A HE3  5 
ATOM 2100 N N    . CYS A 1 2  ? -2.684  0.148   6.675   1.00 0.00 ? 2  CYS A N    5 
ATOM 2101 C CA   . CYS A 1 2  ? -1.694  -0.961  6.783   1.00 0.00 ? 2  CYS A CA   5 
ATOM 2102 C C    . CYS A 1 2  ? -0.328  -0.488  6.279   1.00 0.00 ? 2  CYS A C    5 
ATOM 2103 O O    . CYS A 1 2  ? -0.170  -0.128  5.129   1.00 0.00 ? 2  CYS A O    5 
ATOM 2104 C CB   . CYS A 1 2  ? -2.164  -2.141  5.935   1.00 0.00 ? 2  CYS A CB   5 
ATOM 2105 S SG   . CYS A 1 2  ? -1.376  -3.658  6.526   1.00 0.00 ? 2  CYS A SG   5 
ATOM 2106 H H    . CYS A 1 2  ? -2.867  0.556   5.804   1.00 0.00 ? 2  CYS A H    5 
ATOM 2107 H HA   . CYS A 1 2  ? -1.611  -1.270  7.814   1.00 0.00 ? 2  CYS A HA   5 
ATOM 2108 H HB2  . CYS A 1 2  ? -3.236  -2.233  6.013   1.00 0.00 ? 2  CYS A HB2  5 
ATOM 2109 H HB3  . CYS A 1 2  ? -1.892  -1.972  4.903   1.00 0.00 ? 2  CYS A HB3  5 
ATOM 2110 N N    . MET A 1 3  ? 0.663   -0.492  7.131   1.00 0.00 ? 3  MET A N    5 
ATOM 2111 C CA   . MET A 1 3  ? 2.020   -0.048  6.701   1.00 0.00 ? 3  MET A CA   5 
ATOM 2112 C C    . MET A 1 3  ? 1.942   1.373   6.141   1.00 0.00 ? 3  MET A C    5 
ATOM 2113 O O    . MET A 1 3  ? 0.877   1.857   5.815   1.00 0.00 ? 3  MET A O    5 
ATOM 2114 C CB   . MET A 1 3  ? 2.543   -0.992  5.610   1.00 0.00 ? 3  MET A CB   5 
ATOM 2115 C CG   . MET A 1 3  ? 4.061   -1.165  5.728   1.00 0.00 ? 3  MET A CG   5 
ATOM 2116 S SD   . MET A 1 3  ? 4.498   -1.732  7.393   1.00 0.00 ? 3  MET A SD   5 
ATOM 2117 C CE   . MET A 1 3  ? 5.084   -3.378  6.926   1.00 0.00 ? 3  MET A CE   5 
ATOM 2118 H H    . MET A 1 3  ? 0.514   -0.790  8.052   1.00 0.00 ? 3  MET A H    5 
ATOM 2119 H HA   . MET A 1 3  ? 2.687   -0.064  7.548   1.00 0.00 ? 3  MET A HA   5 
ATOM 2120 H HB2  . MET A 1 3  ? 2.063   -1.955  5.707   1.00 0.00 ? 3  MET A HB2  5 
ATOM 2121 H HB3  . MET A 1 3  ? 2.314   -0.572  4.645   1.00 0.00 ? 3  MET A HB3  5 
ATOM 2122 H HG2  . MET A 1 3  ? 4.393   -1.895  5.005   1.00 0.00 ? 3  MET A HG2  5 
ATOM 2123 H HG3  . MET A 1 3  ? 4.545   -0.220  5.526   1.00 0.00 ? 3  MET A HG3  5 
ATOM 2124 H HE1  . MET A 1 3  ? 4.353   -3.857  6.295   1.00 0.00 ? 3  MET A HE1  5 
ATOM 2125 H HE2  . MET A 1 3  ? 6.018   -3.288  6.388   1.00 0.00 ? 3  MET A HE2  5 
ATOM 2126 H HE3  . MET A 1 3  ? 5.232   -3.973  7.818   1.00 0.00 ? 3  MET A HE3  5 
ATOM 2127 N N    . PRO A 1 4  ? 3.088   1.989   6.042   1.00 0.00 ? 4  PRO A N    5 
ATOM 2128 C CA   . PRO A 1 4  ? 3.131   3.365   5.501   1.00 0.00 ? 4  PRO A CA   5 
ATOM 2129 C C    . PRO A 1 4  ? 3.792   3.368   4.121   1.00 0.00 ? 4  PRO A C    5 
ATOM 2130 O O    . PRO A 1 4  ? 3.874   2.352   3.459   1.00 0.00 ? 4  PRO A O    5 
ATOM 2131 C CB   . PRO A 1 4  ? 3.980   4.143   6.507   1.00 0.00 ? 4  PRO A CB   5 
ATOM 2132 C CG   . PRO A 1 4  ? 4.837   3.102   7.246   1.00 0.00 ? 4  PRO A CG   5 
ATOM 2133 C CD   . PRO A 1 4  ? 4.121   1.754   7.079   1.00 0.00 ? 4  PRO A CD   5 
ATOM 2134 H HA   . PRO A 1 4  ? 2.141   3.786   5.450   1.00 0.00 ? 4  PRO A HA   5 
ATOM 2135 H HB2  . PRO A 1 4  ? 4.616   4.841   5.984   1.00 0.00 ? 4  PRO A HB2  5 
ATOM 2136 H HB3  . PRO A 1 4  ? 3.347   4.663   7.208   1.00 0.00 ? 4  PRO A HB3  5 
ATOM 2137 H HG2  . PRO A 1 4  ? 5.825   3.060   6.809   1.00 0.00 ? 4  PRO A HG2  5 
ATOM 2138 H HG3  . PRO A 1 4  ? 4.903   3.353   8.293   1.00 0.00 ? 4  PRO A HG3  5 
ATOM 2139 H HD2  . PRO A 1 4  ? 4.817   1.000   6.750   1.00 0.00 ? 4  PRO A HD2  5 
ATOM 2140 H HD3  . PRO A 1 4  ? 3.654   1.460   8.006   1.00 0.00 ? 4  PRO A HD3  5 
ATOM 2141 N N    . CYS A 1 5  ? 4.268   4.501   3.685   1.00 0.00 ? 5  CYS A N    5 
ATOM 2142 C CA   . CYS A 1 5  ? 4.925   4.570   2.357   1.00 0.00 ? 5  CYS A CA   5 
ATOM 2143 C C    . CYS A 1 5  ? 6.031   5.626   2.389   1.00 0.00 ? 5  CYS A C    5 
ATOM 2144 O O    . CYS A 1 5  ? 5.834   6.733   2.854   1.00 0.00 ? 5  CYS A O    5 
ATOM 2145 C CB   . CYS A 1 5  ? 3.892   4.937   1.290   1.00 0.00 ? 5  CYS A CB   5 
ATOM 2146 S SG   . CYS A 1 5  ? 3.592   3.503   0.228   1.00 0.00 ? 5  CYS A SG   5 
ATOM 2147 H H    . CYS A 1 5  ? 4.196   5.303   4.232   1.00 0.00 ? 5  CYS A H    5 
ATOM 2148 H HA   . CYS A 1 5  ? 5.354   3.613   2.128   1.00 0.00 ? 5  CYS A HA   5 
ATOM 2149 H HB2  . CYS A 1 5  ? 2.969   5.230   1.769   1.00 0.00 ? 5  CYS A HB2  5 
ATOM 2150 H HB3  . CYS A 1 5  ? 4.264   5.756   0.694   1.00 0.00 ? 5  CYS A HB3  5 
ATOM 2151 N N    . PHE A 1 6  ? 7.196   5.293   1.905   1.00 0.00 ? 6  PHE A N    5 
ATOM 2152 C CA   . PHE A 1 6  ? 8.316   6.275   1.911   1.00 0.00 ? 6  PHE A CA   5 
ATOM 2153 C C    . PHE A 1 6  ? 8.572   6.770   0.487   1.00 0.00 ? 6  PHE A C    5 
ATOM 2154 O O    . PHE A 1 6  ? 9.413   6.249   -0.217  1.00 0.00 ? 6  PHE A O    5 
ATOM 2155 C CB   . PHE A 1 6  ? 9.577   5.602   2.456   1.00 0.00 ? 6  PHE A CB   5 
ATOM 2156 C CG   . PHE A 1 6  ? 9.365   5.245   3.907   1.00 0.00 ? 6  PHE A CG   5 
ATOM 2157 C CD1  . PHE A 1 6  ? 9.665   6.176   4.909   1.00 0.00 ? 6  PHE A CD1  5 
ATOM 2158 C CD2  . PHE A 1 6  ? 8.865   3.983   4.250   1.00 0.00 ? 6  PHE A CD2  5 
ATOM 2159 C CE1  . PHE A 1 6  ? 9.467   5.845   6.254   1.00 0.00 ? 6  PHE A CE1  5 
ATOM 2160 C CE2  . PHE A 1 6  ? 8.666   3.652   5.597   1.00 0.00 ? 6  PHE A CE2  5 
ATOM 2161 C CZ   . PHE A 1 6  ? 8.967   4.583   6.598   1.00 0.00 ? 6  PHE A CZ   5 
ATOM 2162 H H    . PHE A 1 6  ? 7.335   4.395   1.538   1.00 0.00 ? 6  PHE A H    5 
ATOM 2163 H HA   . PHE A 1 6  ? 8.056   7.113   2.542   1.00 0.00 ? 6  PHE A HA   5 
ATOM 2164 H HB2  . PHE A 1 6  ? 9.780   4.706   1.889   1.00 0.00 ? 6  PHE A HB2  5 
ATOM 2165 H HB3  . PHE A 1 6  ? 10.413  6.280   2.371   1.00 0.00 ? 6  PHE A HB3  5 
ATOM 2166 H HD1  . PHE A 1 6  ? 10.051  7.148   4.644   1.00 0.00 ? 6  PHE A HD1  5 
ATOM 2167 H HD2  . PHE A 1 6  ? 8.633   3.265   3.478   1.00 0.00 ? 6  PHE A HD2  5 
ATOM 2168 H HE1  . PHE A 1 6  ? 9.700   6.563   7.027   1.00 0.00 ? 6  PHE A HE1  5 
ATOM 2169 H HE2  . PHE A 1 6  ? 8.280   2.679   5.862   1.00 0.00 ? 6  PHE A HE2  5 
ATOM 2170 H HZ   . PHE A 1 6  ? 8.813   4.329   7.637   1.00 0.00 ? 6  PHE A HZ   5 
ATOM 2171 N N    . THR A 1 7  ? 7.857   7.783   0.070   1.00 0.00 ? 7  THR A N    5 
ATOM 2172 C CA   . THR A 1 7  ? 8.051   8.333   -1.308  1.00 0.00 ? 7  THR A CA   5 
ATOM 2173 C C    . THR A 1 7  ? 8.313   7.184   -2.295  1.00 0.00 ? 7  THR A C    5 
ATOM 2174 O O    . THR A 1 7  ? 7.606   6.197   -2.305  1.00 0.00 ? 7  THR A O    5 
ATOM 2175 C CB   . THR A 1 7  ? 9.237   9.296   -1.287  1.00 0.00 ? 7  THR A CB   5 
ATOM 2176 O OG1  . THR A 1 7  ? 9.196   10.070  -0.095  1.00 0.00 ? 7  THR A OG1  5 
ATOM 2177 C CG2  . THR A 1 7  ? 9.168   10.223  -2.502  1.00 0.00 ? 7  THR A CG2  5 
ATOM 2178 H H    . THR A 1 7  ? 7.198   8.188   0.668   1.00 0.00 ? 7  THR A H    5 
ATOM 2179 H HA   . THR A 1 7  ? 7.162   8.869   -1.616  1.00 0.00 ? 7  THR A HA   5 
ATOM 2180 H HB   . THR A 1 7  ? 10.153  8.734   -1.316  1.00 0.00 ? 7  THR A HB   5 
ATOM 2181 H HG1  . THR A 1 7  ? 8.280   10.145  0.179   1.00 0.00 ? 7  THR A HG1  5 
ATOM 2182 H HG21 . THR A 1 7  ? 8.281   9.998   -3.076  1.00 0.00 ? 7  THR A HG21 5 
ATOM 2183 H HG22 . THR A 1 7  ? 9.132   11.249  -2.171  1.00 0.00 ? 7  THR A HG22 5 
ATOM 2184 H HG23 . THR A 1 7  ? 10.042  10.073  -3.119  1.00 0.00 ? 7  THR A HG23 5 
ATOM 2185 N N    . THR A 1 8  ? 9.319   7.297   -3.127  1.00 0.00 ? 8  THR A N    5 
ATOM 2186 C CA   . THR A 1 8  ? 9.606   6.206   -4.101  1.00 0.00 ? 8  THR A CA   5 
ATOM 2187 C C    . THR A 1 8  ? 8.314   5.812   -4.824  1.00 0.00 ? 8  THR A C    5 
ATOM 2188 O O    . THR A 1 8  ? 7.941   6.407   -5.814  1.00 0.00 ? 8  THR A O    5 
ATOM 2189 C CB   . THR A 1 8  ? 10.174  4.990   -3.362  1.00 0.00 ? 8  THR A CB   5 
ATOM 2190 O OG1  . THR A 1 8  ? 9.501   4.835   -2.120  1.00 0.00 ? 8  THR A OG1  5 
ATOM 2191 C CG2  . THR A 1 8  ? 11.670  5.191   -3.112  1.00 0.00 ? 8  THR A CG2  5 
ATOM 2192 H H    . THR A 1 8  ? 9.884   8.094   -3.114  1.00 0.00 ? 8  THR A H    5 
ATOM 2193 H HA   . THR A 1 8  ? 10.329  6.555   -4.824  1.00 0.00 ? 8  THR A HA   5 
ATOM 2194 H HB   . THR A 1 8  ? 10.030  4.105   -3.961  1.00 0.00 ? 8  THR A HB   5 
ATOM 2195 H HG1  . THR A 1 8  ? 10.133  4.495   -1.482  1.00 0.00 ? 8  THR A HG1  5 
ATOM 2196 H HG21 . THR A 1 8  ? 12.043  5.964   -3.766  1.00 0.00 ? 8  THR A HG21 5 
ATOM 2197 H HG22 . THR A 1 8  ? 11.826  5.482   -2.083  1.00 0.00 ? 8  THR A HG22 5 
ATOM 2198 H HG23 . THR A 1 8  ? 12.195  4.267   -3.308  1.00 0.00 ? 8  THR A HG23 5 
ATOM 2199 N N    . ASP A 1 9  ? 7.630   4.810   -4.339  1.00 0.00 ? 9  ASP A N    5 
ATOM 2200 C CA   . ASP A 1 9  ? 6.365   4.381   -5.002  1.00 0.00 ? 9  ASP A CA   5 
ATOM 2201 C C    . ASP A 1 9  ? 6.693   3.652   -6.306  1.00 0.00 ? 9  ASP A C    5 
ATOM 2202 O O    . ASP A 1 9  ? 6.511   4.177   -7.387  1.00 0.00 ? 9  ASP A O    5 
ATOM 2203 C CB   . ASP A 1 9  ? 5.503   5.606   -5.305  1.00 0.00 ? 9  ASP A CB   5 
ATOM 2204 C CG   . ASP A 1 9  ? 4.152   5.463   -4.601  1.00 0.00 ? 9  ASP A CG   5 
ATOM 2205 O OD1  . ASP A 1 9  ? 3.582   4.386   -4.669  1.00 0.00 ? 9  ASP A OD1  5 
ATOM 2206 O OD2  . ASP A 1 9  ? 3.709   6.433   -4.007  1.00 0.00 ? 9  ASP A OD2  5 
ATOM 2207 H H    . ASP A 1 9  ? 7.946   4.341   -3.538  1.00 0.00 ? 9  ASP A H    5 
ATOM 2208 H HA   . ASP A 1 9  ? 5.825   3.717   -4.347  1.00 0.00 ? 9  ASP A HA   5 
ATOM 2209 H HB2  . ASP A 1 9  ? 6.003   6.497   -4.952  1.00 0.00 ? 9  ASP A HB2  5 
ATOM 2210 H HB3  . ASP A 1 9  ? 5.346   5.677   -6.368  1.00 0.00 ? 9  ASP A HB3  5 
ATOM 2211 N N    . HIS A 1 10 ? 7.179   2.444   -6.214  1.00 0.00 ? 10 HIS A N    5 
ATOM 2212 C CA   . HIS A 1 10 ? 7.519   1.680   -7.446  1.00 0.00 ? 10 HIS A CA   5 
ATOM 2213 C C    . HIS A 1 10 ? 7.095   0.220   -7.273  1.00 0.00 ? 10 HIS A C    5 
ATOM 2214 O O    . HIS A 1 10 ? 6.358   -0.322  -8.073  1.00 0.00 ? 10 HIS A O    5 
ATOM 2215 C CB   . HIS A 1 10 ? 9.029   1.745   -7.680  1.00 0.00 ? 10 HIS A CB   5 
ATOM 2216 C CG   . HIS A 1 10 ? 9.359   2.958   -8.506  1.00 0.00 ? 10 HIS A CG   5 
ATOM 2217 N ND1  . HIS A 1 10 ? 9.829   4.131   -7.937  1.00 0.00 ? 10 HIS A ND1  5 
ATOM 2218 C CD2  . HIS A 1 10 ? 9.299   3.195   -9.856  1.00 0.00 ? 10 HIS A CD2  5 
ATOM 2219 C CE1  . HIS A 1 10 ? 10.030  5.013   -8.933  1.00 0.00 ? 10 HIS A CE1  5 
ATOM 2220 N NE2  . HIS A 1 10 ? 9.722   4.493   -10.124 1.00 0.00 ? 10 HIS A NE2  5 
ATOM 2221 H H    . HIS A 1 10 ? 7.319   2.039   -5.332  1.00 0.00 ? 10 HIS A H    5 
ATOM 2222 H HA   . HIS A 1 10 ? 7.003   2.109   -8.292  1.00 0.00 ? 10 HIS A HA   5 
ATOM 2223 H HB2  . HIS A 1 10 ? 9.537   1.809   -6.729  1.00 0.00 ? 10 HIS A HB2  5 
ATOM 2224 H HB3  . HIS A 1 10 ? 9.351   0.857   -8.202  1.00 0.00 ? 10 HIS A HB3  5 
ATOM 2225 H HD1  . HIS A 1 10 ? 9.985   4.291   -6.982  1.00 0.00 ? 10 HIS A HD1  5 
ATOM 2226 H HD2  . HIS A 1 10 ? 8.974   2.481   -10.599 1.00 0.00 ? 10 HIS A HD2  5 
ATOM 2227 H HE1  . HIS A 1 10 ? 10.398  6.017   -8.787  1.00 0.00 ? 10 HIS A HE1  5 
ATOM 2228 N N    . GLN A 1 11 ? 7.554   -0.420  -6.232  1.00 0.00 ? 11 GLN A N    5 
ATOM 2229 C CA   . GLN A 1 11 ? 7.178   -1.845  -6.008  1.00 0.00 ? 11 GLN A CA   5 
ATOM 2230 C C    . GLN A 1 11 ? 7.047   -2.106  -4.504  1.00 0.00 ? 11 GLN A C    5 
ATOM 2231 O O    . GLN A 1 11 ? 7.010   -3.238  -4.063  1.00 0.00 ? 11 GLN A O    5 
ATOM 2232 C CB   . GLN A 1 11 ? 8.264   -2.754  -6.589  1.00 0.00 ? 11 GLN A CB   5 
ATOM 2233 C CG   . GLN A 1 11 ? 7.612   -3.938  -7.303  1.00 0.00 ? 11 GLN A CG   5 
ATOM 2234 C CD   . GLN A 1 11 ? 8.497   -5.176  -7.148  1.00 0.00 ? 11 GLN A CD   5 
ATOM 2235 O OE1  . GLN A 1 11 ? 9.017   -5.691  -8.118  1.00 0.00 ? 11 GLN A OE1  5 
ATOM 2236 N NE2  . GLN A 1 11 ? 8.694   -5.679  -5.959  1.00 0.00 ? 11 GLN A NE2  5 
ATOM 2237 H H    . GLN A 1 11 ? 8.147   0.036   -5.599  1.00 0.00 ? 11 GLN A H    5 
ATOM 2238 H HA   . GLN A 1 11 ? 6.237   -2.050  -6.494  1.00 0.00 ? 11 GLN A HA   5 
ATOM 2239 H HB2  . GLN A 1 11 ? 8.864   -2.194  -7.291  1.00 0.00 ? 11 GLN A HB2  5 
ATOM 2240 H HB3  . GLN A 1 11 ? 8.892   -3.119  -5.790  1.00 0.00 ? 11 GLN A HB3  5 
ATOM 2241 H HG2  . GLN A 1 11 ? 6.643   -4.132  -6.867  1.00 0.00 ? 11 GLN A HG2  5 
ATOM 2242 H HG3  . GLN A 1 11 ? 7.498   -3.709  -8.351  1.00 0.00 ? 11 GLN A HG3  5 
ATOM 2243 H HE21 . GLN A 1 11 ? 8.275   -5.264  -5.177  1.00 0.00 ? 11 GLN A HE21 5 
ATOM 2244 H HE22 . GLN A 1 11 ? 9.260   -6.472  -5.850  1.00 0.00 ? 11 GLN A HE22 5 
ATOM 2245 N N    . MET A 1 12 ? 6.977   -1.070  -3.716  1.00 0.00 ? 12 MET A N    5 
ATOM 2246 C CA   . MET A 1 12 ? 6.851   -1.261  -2.242  1.00 0.00 ? 12 MET A CA   5 
ATOM 2247 C C    . MET A 1 12 ? 5.374   -1.395  -1.874  1.00 0.00 ? 12 MET A C    5 
ATOM 2248 O O    . MET A 1 12 ? 4.965   -2.336  -1.221  1.00 0.00 ? 12 MET A O    5 
ATOM 2249 C CB   . MET A 1 12 ? 7.440   -0.048  -1.523  1.00 0.00 ? 12 MET A CB   5 
ATOM 2250 C CG   . MET A 1 12 ? 8.020   -0.482  -0.175  1.00 0.00 ? 12 MET A CG   5 
ATOM 2251 S SD   . MET A 1 12 ? 6.682   -1.049  0.903   1.00 0.00 ? 12 MET A SD   5 
ATOM 2252 C CE   . MET A 1 12 ? 5.641   0.425   0.764   1.00 0.00 ? 12 MET A CE   5 
ATOM 2253 H H    . MET A 1 12 ? 7.010   -0.166  -4.091  1.00 0.00 ? 12 MET A H    5 
ATOM 2254 H HA   . MET A 1 12 ? 7.382   -2.152  -1.945  1.00 0.00 ? 12 MET A HA   5 
ATOM 2255 H HB2  . MET A 1 12 ? 8.219   0.386   -2.131  1.00 0.00 ? 12 MET A HB2  5 
ATOM 2256 H HB3  . MET A 1 12 ? 6.663   0.684   -1.358  1.00 0.00 ? 12 MET A HB3  5 
ATOM 2257 H HG2  . MET A 1 12 ? 8.725   -1.285  -0.329  1.00 0.00 ? 12 MET A HG2  5 
ATOM 2258 H HG3  . MET A 1 12 ? 8.524   0.355   0.286   1.00 0.00 ? 12 MET A HG3  5 
ATOM 2259 H HE1  . MET A 1 12 ? 6.250   1.308   0.904   1.00 0.00 ? 12 MET A HE1  5 
ATOM 2260 H HE2  . MET A 1 12 ? 5.187   0.455   -0.212  1.00 0.00 ? 12 MET A HE2  5 
ATOM 2261 H HE3  . MET A 1 12 ? 4.869   0.391   1.520   1.00 0.00 ? 12 MET A HE3  5 
ATOM 2262 N N    . ALA A 1 13 ? 4.572   -0.456  -2.291  1.00 0.00 ? 13 ALA A N    5 
ATOM 2263 C CA   . ALA A 1 13 ? 3.117   -0.514  -1.972  1.00 0.00 ? 13 ALA A CA   5 
ATOM 2264 C C    . ALA A 1 13 ? 2.509   -1.795  -2.551  1.00 0.00 ? 13 ALA A C    5 
ATOM 2265 O O    . ALA A 1 13 ? 1.402   -2.170  -2.219  1.00 0.00 ? 13 ALA A O    5 
ATOM 2266 C CB   . ALA A 1 13 ? 2.416   0.702   -2.582  1.00 0.00 ? 13 ALA A CB   5 
ATOM 2267 H H    . ALA A 1 13 ? 4.931   0.292   -2.814  1.00 0.00 ? 13 ALA A H    5 
ATOM 2268 H HA   . ALA A 1 13 ? 2.983   -0.505  -0.901  1.00 0.00 ? 13 ALA A HA   5 
ATOM 2269 H HB1  . ALA A 1 13 ? 3.038   1.126   -3.356  1.00 0.00 ? 13 ALA A HB1  5 
ATOM 2270 H HB2  . ALA A 1 13 ? 1.470   0.396   -3.006  1.00 0.00 ? 13 ALA A HB2  5 
ATOM 2271 H HB3  . ALA A 1 13 ? 2.243   1.440   -1.813  1.00 0.00 ? 13 ALA A HB3  5 
ATOM 2272 N N    . ARG A 1 14 ? 3.221   -2.468  -3.413  1.00 0.00 ? 14 ARG A N    5 
ATOM 2273 C CA   . ARG A 1 14 ? 2.679   -3.722  -4.006  1.00 0.00 ? 14 ARG A CA   5 
ATOM 2274 C C    . ARG A 1 14 ? 2.102   -4.600  -2.894  1.00 0.00 ? 14 ARG A C    5 
ATOM 2275 O O    . ARG A 1 14 ? 1.142   -5.319  -3.091  1.00 0.00 ? 14 ARG A O    5 
ATOM 2276 C CB   . ARG A 1 14 ? 3.805   -4.478  -4.717  1.00 0.00 ? 14 ARG A CB   5 
ATOM 2277 C CG   . ARG A 1 14 ? 3.338   -4.900  -6.112  1.00 0.00 ? 14 ARG A CG   5 
ATOM 2278 C CD   . ARG A 1 14 ? 3.882   -3.920  -7.153  1.00 0.00 ? 14 ARG A CD   5 
ATOM 2279 N NE   . ARG A 1 14 ? 2.860   -2.872  -7.428  1.00 0.00 ? 14 ARG A NE   5 
ATOM 2280 C CZ   . ARG A 1 14 ? 3.186   -1.609  -7.367  1.00 0.00 ? 14 ARG A CZ   5 
ATOM 2281 N NH1  . ARG A 1 14 ? 4.032   -1.196  -6.464  1.00 0.00 ? 14 ARG A NH1  5 
ATOM 2282 N NH2  . ARG A 1 14 ? 2.664   -0.760  -8.210  1.00 0.00 ? 14 ARG A NH2  5 
ATOM 2283 H H    . ARG A 1 14 ? 4.110   -2.152  -3.669  1.00 0.00 ? 14 ARG A H    5 
ATOM 2284 H HA   . ARG A 1 14 ? 1.901   -3.481  -4.716  1.00 0.00 ? 14 ARG A HA   5 
ATOM 2285 H HB2  . ARG A 1 14 ? 4.669   -3.837  -4.805  1.00 0.00 ? 14 ARG A HB2  5 
ATOM 2286 H HB3  . ARG A 1 14 ? 4.065   -5.357  -4.146  1.00 0.00 ? 14 ARG A HB3  5 
ATOM 2287 H HG2  . ARG A 1 14 ? 3.702   -5.894  -6.327  1.00 0.00 ? 14 ARG A HG2  5 
ATOM 2288 H HG3  . ARG A 1 14 ? 2.259   -4.896  -6.147  1.00 0.00 ? 14 ARG A HG3  5 
ATOM 2289 H HD2  . ARG A 1 14 ? 4.783   -3.456  -6.775  1.00 0.00 ? 14 ARG A HD2  5 
ATOM 2290 H HD3  . ARG A 1 14 ? 4.107   -4.451  -8.066  1.00 0.00 ? 14 ARG A HD3  5 
ATOM 2291 H HE   . ARG A 1 14 ? 1.942   -3.131  -7.651  1.00 0.00 ? 14 ARG A HE   5 
ATOM 2292 H HH11 . ARG A 1 14 ? 4.431   -1.845  -5.817  1.00 0.00 ? 14 ARG A HH11 5 
ATOM 2293 H HH12 . ARG A 1 14 ? 4.282   -0.228  -6.421  1.00 0.00 ? 14 ARG A HH12 5 
ATOM 2294 H HH21 . ARG A 1 14 ? 2.014   -1.075  -8.901  1.00 0.00 ? 14 ARG A HH21 5 
ATOM 2295 H HH22 . ARG A 1 14 ? 2.912   0.208   -8.161  1.00 0.00 ? 14 ARG A HH22 5 
ATOM 2296 N N    . LYS A 1 15 ? 2.685   -4.550  -1.727  1.00 0.00 ? 15 LYS A N    5 
ATOM 2297 C CA   . LYS A 1 15 ? 2.179   -5.381  -0.606  1.00 0.00 ? 15 LYS A CA   5 
ATOM 2298 C C    . LYS A 1 15 ? 1.107   -4.613  0.174   1.00 0.00 ? 15 LYS A C    5 
ATOM 2299 O O    . LYS A 1 15 ? 0.160   -5.189  0.672   1.00 0.00 ? 15 LYS A O    5 
ATOM 2300 C CB   . LYS A 1 15 ? 3.342   -5.724  0.326   1.00 0.00 ? 15 LYS A CB   5 
ATOM 2301 C CG   . LYS A 1 15 ? 4.180   -4.474  0.598   1.00 0.00 ? 15 LYS A CG   5 
ATOM 2302 C CD   . LYS A 1 15 ? 4.374   -4.311  2.108   1.00 0.00 ? 15 LYS A CD   5 
ATOM 2303 C CE   . LYS A 1 15 ? 5.742   -3.686  2.384   1.00 0.00 ? 15 LYS A CE   5 
ATOM 2304 N NZ   . LYS A 1 15 ? 6.553   -4.617  3.217   1.00 0.00 ? 15 LYS A NZ   5 
ATOM 2305 H H    . LYS A 1 15 ? 3.459   -3.971  -1.588  1.00 0.00 ? 15 LYS A H    5 
ATOM 2306 H HA   . LYS A 1 15 ? 1.754   -6.294  -0.998  1.00 0.00 ? 15 LYS A HA   5 
ATOM 2307 H HB2  . LYS A 1 15 ? 2.950   -6.098  1.252   1.00 0.00 ? 15 LYS A HB2  5 
ATOM 2308 H HB3  . LYS A 1 15 ? 3.962   -6.479  -0.135  1.00 0.00 ? 15 LYS A HB3  5 
ATOM 2309 H HG2  . LYS A 1 15 ? 5.144   -4.576  0.119   1.00 0.00 ? 15 LYS A HG2  5 
ATOM 2310 H HG3  . LYS A 1 15 ? 3.674   -3.606  0.209   1.00 0.00 ? 15 LYS A HG3  5 
ATOM 2311 H HD2  . LYS A 1 15 ? 3.598   -3.671  2.503   1.00 0.00 ? 15 LYS A HD2  5 
ATOM 2312 H HD3  . LYS A 1 15 ? 4.321   -5.278  2.583   1.00 0.00 ? 15 LYS A HD3  5 
ATOM 2313 H HE2  . LYS A 1 15 ? 6.250   -3.503  1.448   1.00 0.00 ? 15 LYS A HE2  5 
ATOM 2314 H HE3  . LYS A 1 15 ? 5.611   -2.752  2.911   1.00 0.00 ? 15 LYS A HE3  5 
ATOM 2315 H HZ1  . LYS A 1 15 ? 6.343   -5.598  2.944   1.00 0.00 ? 15 LYS A HZ1  5 
ATOM 2316 H HZ2  . LYS A 1 15 ? 7.564   -4.427  3.066   1.00 0.00 ? 15 LYS A HZ2  5 
ATOM 2317 H HZ3  . LYS A 1 15 ? 6.319   -4.477  4.220   1.00 0.00 ? 15 LYS A HZ3  5 
ATOM 2318 N N    . CYS A 1 16 ? 1.243   -3.319  0.285   1.00 0.00 ? 16 CYS A N    5 
ATOM 2319 C CA   . CYS A 1 16 ? 0.227   -2.525  1.034   1.00 0.00 ? 16 CYS A CA   5 
ATOM 2320 C C    . CYS A 1 16 ? -1.169  -2.924  0.557   1.00 0.00 ? 16 CYS A C    5 
ATOM 2321 O O    . CYS A 1 16 ? -2.063  -3.165  1.344   1.00 0.00 ? 16 CYS A O    5 
ATOM 2322 C CB   . CYS A 1 16 ? 0.450   -1.033  0.774   1.00 0.00 ? 16 CYS A CB   5 
ATOM 2323 S SG   . CYS A 1 16 ? 0.493   -0.146  2.351   1.00 0.00 ? 16 CYS A SG   5 
ATOM 2324 H H    . CYS A 1 16 ? 2.012   -2.869  -0.123  1.00 0.00 ? 16 CYS A H    5 
ATOM 2325 H HA   . CYS A 1 16 ? 0.316   -2.726  2.092   1.00 0.00 ? 16 CYS A HA   5 
ATOM 2326 H HB2  . CYS A 1 16 ? 1.389   -0.896  0.258   1.00 0.00 ? 16 CYS A HB2  5 
ATOM 2327 H HB3  . CYS A 1 16 ? -0.354  -0.649  0.166   1.00 0.00 ? 16 CYS A HB3  5 
ATOM 2328 N N    . ASP A 1 17 ? -1.356  -3.002  -0.729  1.00 0.00 ? 17 ASP A N    5 
ATOM 2329 C CA   . ASP A 1 17 ? -2.685  -3.391  -1.274  1.00 0.00 ? 17 ASP A CA   5 
ATOM 2330 C C    . ASP A 1 17 ? -3.044  -4.793  -0.775  1.00 0.00 ? 17 ASP A C    5 
ATOM 2331 O O    . ASP A 1 17 ? -4.133  -5.038  -0.294  1.00 0.00 ? 17 ASP A O    5 
ATOM 2332 C CB   . ASP A 1 17 ? -2.604  -3.417  -2.798  1.00 0.00 ? 17 ASP A CB   5 
ATOM 2333 C CG   . ASP A 1 17 ? -4.011  -3.330  -3.385  1.00 0.00 ? 17 ASP A CG   5 
ATOM 2334 O OD1  . ASP A 1 17 ? -4.948  -3.637  -2.666  1.00 0.00 ? 17 ASP A OD1  5 
ATOM 2335 O OD2  . ASP A 1 17 ? -4.127  -2.958  -4.539  1.00 0.00 ? 17 ASP A OD2  5 
ATOM 2336 H H    . ASP A 1 17 ? -0.617  -2.807  -1.342  1.00 0.00 ? 17 ASP A H    5 
ATOM 2337 H HA   . ASP A 1 17 ? -3.439  -2.678  -0.959  1.00 0.00 ? 17 ASP A HA   5 
ATOM 2338 H HB2  . ASP A 1 17 ? -2.016  -2.580  -3.141  1.00 0.00 ? 17 ASP A HB2  5 
ATOM 2339 H HB3  . ASP A 1 17 ? -2.140  -4.338  -3.119  1.00 0.00 ? 17 ASP A HB3  5 
ATOM 2340 N N    . ASP A 1 18 ? -2.131  -5.716  -0.902  1.00 0.00 ? 18 ASP A N    5 
ATOM 2341 C CA   . ASP A 1 18 ? -2.396  -7.113  -0.456  1.00 0.00 ? 18 ASP A CA   5 
ATOM 2342 C C    . ASP A 1 18 ? -2.882  -7.120  0.994   1.00 0.00 ? 18 ASP A C    5 
ATOM 2343 O O    . ASP A 1 18 ? -3.669  -7.958  1.389   1.00 0.00 ? 18 ASP A O    5 
ATOM 2344 C CB   . ASP A 1 18 ? -1.107  -7.927  -0.565  1.00 0.00 ? 18 ASP A CB   5 
ATOM 2345 C CG   . ASP A 1 18 ? -1.301  -9.061  -1.572  1.00 0.00 ? 18 ASP A CG   5 
ATOM 2346 O OD1  . ASP A 1 18 ? -2.442  -9.410  -1.828  1.00 0.00 ? 18 ASP A OD1  5 
ATOM 2347 O OD2  . ASP A 1 18 ? -0.307  -9.562  -2.071  1.00 0.00 ? 18 ASP A OD2  5 
ATOM 2348 H H    . ASP A 1 18 ? -1.266  -5.488  -1.302  1.00 0.00 ? 18 ASP A H    5 
ATOM 2349 H HA   . ASP A 1 18 ? -3.152  -7.555  -1.089  1.00 0.00 ? 18 ASP A HA   5 
ATOM 2350 H HB2  . ASP A 1 18 ? -0.304  -7.284  -0.897  1.00 0.00 ? 18 ASP A HB2  5 
ATOM 2351 H HB3  . ASP A 1 18 ? -0.859  -8.342  0.400   1.00 0.00 ? 18 ASP A HB3  5 
ATOM 2352 N N    . CYS A 1 19 ? -2.421  -6.200  1.792   1.00 0.00 ? 19 CYS A N    5 
ATOM 2353 C CA   . CYS A 1 19 ? -2.862  -6.166  3.215   1.00 0.00 ? 19 CYS A CA   5 
ATOM 2354 C C    . CYS A 1 19 ? -4.375  -5.979  3.265   1.00 0.00 ? 19 CYS A C    5 
ATOM 2355 O O    . CYS A 1 19 ? -5.092  -6.760  3.859   1.00 0.00 ? 19 CYS A O    5 
ATOM 2356 C CB   . CYS A 1 19 ? -2.184  -4.999  3.933   1.00 0.00 ? 19 CYS A CB   5 
ATOM 2357 S SG   . CYS A 1 19 ? -2.481  -5.142  5.714   1.00 0.00 ? 19 CYS A SG   5 
ATOM 2358 H H    . CYS A 1 19 ? -1.788  -5.530  1.459   1.00 0.00 ? 19 CYS A H    5 
ATOM 2359 H HA   . CYS A 1 19 ? -2.595  -7.093  3.698   1.00 0.00 ? 19 CYS A HA   5 
ATOM 2360 H HB2  . CYS A 1 19 ? -1.124  -5.026  3.738   1.00 0.00 ? 19 CYS A HB2  5 
ATOM 2361 H HB3  . CYS A 1 19 ? -2.590  -4.066  3.572   1.00 0.00 ? 19 CYS A HB3  5 
ATOM 2362 N N    . CYS A 1 20 ? -4.864  -4.946  2.644   1.00 0.00 ? 20 CYS A N    5 
ATOM 2363 C CA   . CYS A 1 20 ? -6.332  -4.695  2.650   1.00 0.00 ? 20 CYS A CA   5 
ATOM 2364 C C    . CYS A 1 20 ? -7.068  -5.931  2.130   1.00 0.00 ? 20 CYS A C    5 
ATOM 2365 O O    . CYS A 1 20 ? -8.236  -6.128  2.398   1.00 0.00 ? 20 CYS A O    5 
ATOM 2366 C CB   . CYS A 1 20 ? -6.649  -3.498  1.752   1.00 0.00 ? 20 CYS A CB   5 
ATOM 2367 S SG   . CYS A 1 20 ? -6.131  -1.977  2.584   1.00 0.00 ? 20 CYS A SG   5 
ATOM 2368 H H    . CYS A 1 20 ? -4.259  -4.331  2.174   1.00 0.00 ? 20 CYS A H    5 
ATOM 2369 H HA   . CYS A 1 20 ? -6.657  -4.483  3.659   1.00 0.00 ? 20 CYS A HA   5 
ATOM 2370 H HB2  . CYS A 1 20 ? -6.122  -3.598  0.815   1.00 0.00 ? 20 CYS A HB2  5 
ATOM 2371 H HB3  . CYS A 1 20 ? -7.710  -3.459  1.560   1.00 0.00 ? 20 CYS A HB3  5 
ATOM 2372 N N    . GLY A 1 21 ? -6.393  -6.764  1.389   1.00 0.00 ? 21 GLY A N    5 
ATOM 2373 C CA   . GLY A 1 21 ? -7.055  -7.985  0.852   1.00 0.00 ? 21 GLY A CA   5 
ATOM 2374 C C    . GLY A 1 21 ? -6.272  -8.497  -0.358  1.00 0.00 ? 21 GLY A C    5 
ATOM 2375 O O    . GLY A 1 21 ? -5.822  -9.625  -0.387  1.00 0.00 ? 21 GLY A O    5 
ATOM 2376 H H    . GLY A 1 21 ? -5.452  -6.587  1.183   1.00 0.00 ? 21 GLY A H    5 
ATOM 2377 H HA2  . GLY A 1 21 ? -7.079  -8.749  1.618   1.00 0.00 ? 21 GLY A HA2  5 
ATOM 2378 H HA3  . GLY A 1 21 ? -8.063  -7.746  0.549   1.00 0.00 ? 21 GLY A HA3  5 
ATOM 2379 N N    . GLY A 1 22 ? -6.106  -7.676  -1.357  1.00 0.00 ? 22 GLY A N    5 
ATOM 2380 C CA   . GLY A 1 22 ? -5.356  -8.111  -2.560  1.00 0.00 ? 22 GLY A CA   5 
ATOM 2381 C C    . GLY A 1 22 ? -6.059  -7.600  -3.817  1.00 0.00 ? 22 GLY A C    5 
ATOM 2382 O O    . GLY A 1 22 ? -7.050  -6.902  -3.744  1.00 0.00 ? 22 GLY A O    5 
ATOM 2383 H H    . GLY A 1 22 ? -6.475  -6.776  -1.317  1.00 0.00 ? 22 GLY A H    5 
ATOM 2384 H HA2  . GLY A 1 22 ? -4.351  -7.718  -2.520  1.00 0.00 ? 22 GLY A HA2  5 
ATOM 2385 H HA3  . GLY A 1 22 ? -5.324  -9.183  -2.582  1.00 0.00 ? 22 GLY A HA3  5 
ATOM 2386 N N    . LYS A 1 23 ? -5.555  -7.947  -4.969  1.00 0.00 ? 23 LYS A N    5 
ATOM 2387 C CA   . LYS A 1 23 ? -6.190  -7.488  -6.237  1.00 0.00 ? 23 LYS A CA   5 
ATOM 2388 C C    . LYS A 1 23 ? -6.016  -5.971  -6.386  1.00 0.00 ? 23 LYS A C    5 
ATOM 2389 O O    . LYS A 1 23 ? -5.109  -5.509  -7.051  1.00 0.00 ? 23 LYS A O    5 
ATOM 2390 C CB   . LYS A 1 23 ? -7.678  -7.848  -6.228  1.00 0.00 ? 23 LYS A CB   5 
ATOM 2391 C CG   . LYS A 1 23 ? -8.287  -7.521  -7.593  1.00 0.00 ? 23 LYS A CG   5 
ATOM 2392 C CD   . LYS A 1 23 ? -8.258  -8.770  -8.477  1.00 0.00 ? 23 LYS A CD   5 
ATOM 2393 C CE   . LYS A 1 23 ? -8.403  -8.361  -9.943  1.00 0.00 ? 23 LYS A CE   5 
ATOM 2394 N NZ   . LYS A 1 23 ? -7.156  -8.709  -10.680 1.00 0.00 ? 23 LYS A NZ   5 
ATOM 2395 H H    . LYS A 1 23 ? -4.756  -8.514  -5.001  1.00 0.00 ? 23 LYS A H    5 
ATOM 2396 H HA   . LYS A 1 23 ? -5.711  -7.980  -7.070  1.00 0.00 ? 23 LYS A HA   5 
ATOM 2397 H HB2  . LYS A 1 23 ? -7.790  -8.904  -6.028  1.00 0.00 ? 23 LYS A HB2  5 
ATOM 2398 H HB3  . LYS A 1 23 ? -8.186  -7.282  -5.465  1.00 0.00 ? 23 LYS A HB3  5 
ATOM 2399 H HG2  . LYS A 1 23 ? -9.309  -7.195  -7.462  1.00 0.00 ? 23 LYS A HG2  5 
ATOM 2400 H HG3  . LYS A 1 23 ? -7.715  -6.736  -8.064  1.00 0.00 ? 23 LYS A HG3  5 
ATOM 2401 H HD2  . LYS A 1 23 ? -7.320  -9.288  -8.338  1.00 0.00 ? 23 LYS A HD2  5 
ATOM 2402 H HD3  . LYS A 1 23 ? -9.073  -9.424  -8.204  1.00 0.00 ? 23 LYS A HD3  5 
ATOM 2403 H HE2  . LYS A 1 23 ? -9.239  -8.888  -10.382 1.00 0.00 ? 23 LYS A HE2  5 
ATOM 2404 H HE3  . LYS A 1 23 ? -8.575  -7.297  -10.005 1.00 0.00 ? 23 LYS A HE3  5 
ATOM 2405 H HZ1  . LYS A 1 23 ? -6.355  -8.728  -10.018 1.00 0.00 ? 23 LYS A HZ1  5 
ATOM 2406 H HZ2  . LYS A 1 23 ? -7.264  -9.644  -11.123 1.00 0.00 ? 23 LYS A HZ2  5 
ATOM 2407 H HZ3  . LYS A 1 23 ? -6.977  -7.996  -11.416 1.00 0.00 ? 23 LYS A HZ3  5 
ATOM 2408 N N    . GLY A 1 24 ? -6.873  -5.187  -5.783  1.00 0.00 ? 24 GLY A N    5 
ATOM 2409 C CA   . GLY A 1 24 ? -6.735  -3.706  -5.910  1.00 0.00 ? 24 GLY A CA   5 
ATOM 2410 C C    . GLY A 1 24 ? -7.547  -3.001  -4.818  1.00 0.00 ? 24 GLY A C    5 
ATOM 2411 O O    . GLY A 1 24 ? -8.283  -2.072  -5.087  1.00 0.00 ? 24 GLY A O    5 
ATOM 2412 H H    . GLY A 1 24 ? -7.602  -5.566  -5.252  1.00 0.00 ? 24 GLY A H    5 
ATOM 2413 H HA2  . GLY A 1 24 ? -5.695  -3.436  -5.817  1.00 0.00 ? 24 GLY A HA2  5 
ATOM 2414 H HA3  . GLY A 1 24 ? -7.099  -3.397  -6.878  1.00 0.00 ? 24 GLY A HA3  5 
ATOM 2415 N N    . ARG A 1 25 ? -7.424  -3.426  -3.588  1.00 0.00 ? 25 ARG A N    5 
ATOM 2416 C CA   . ARG A 1 25 ? -8.197  -2.763  -2.498  1.00 0.00 ? 25 ARG A CA   5 
ATOM 2417 C C    . ARG A 1 25 ? -7.243  -2.197  -1.446  1.00 0.00 ? 25 ARG A C    5 
ATOM 2418 O O    . ARG A 1 25 ? -7.524  -2.223  -0.266  1.00 0.00 ? 25 ARG A O    5 
ATOM 2419 C CB   . ARG A 1 25 ? -9.128  -3.778  -1.834  1.00 0.00 ? 25 ARG A CB   5 
ATOM 2420 C CG   . ARG A 1 25 ? -8.424  -5.131  -1.732  1.00 0.00 ? 25 ARG A CG   5 
ATOM 2421 C CD   . ARG A 1 25 ? -9.299  -6.102  -0.939  1.00 0.00 ? 25 ARG A CD   5 
ATOM 2422 N NE   . ARG A 1 25 ? -9.239  -7.453  -1.566  1.00 0.00 ? 25 ARG A NE   5 
ATOM 2423 C CZ   . ARG A 1 25 ? -10.340 -8.117  -1.793  1.00 0.00 ? 25 ARG A CZ   5 
ATOM 2424 N NH1  . ARG A 1 25 ? -11.170 -7.706  -2.712  1.00 0.00 ? 25 ARG A NH1  5 
ATOM 2425 N NH2  . ARG A 1 25 ? -10.611 -9.189  -1.099  1.00 0.00 ? 25 ARG A NH2  5 
ATOM 2426 H H    . ARG A 1 25 ? -6.828  -4.176  -3.384  1.00 0.00 ? 25 ARG A H    5 
ATOM 2427 H HA   . ARG A 1 25 ? -8.781  -1.958  -2.914  1.00 0.00 ? 25 ARG A HA   5 
ATOM 2428 H HB2  . ARG A 1 25 ? -9.390  -3.432  -0.845  1.00 0.00 ? 25 ARG A HB2  5 
ATOM 2429 H HB3  . ARG A 1 25 ? -10.020 -3.883  -2.424  1.00 0.00 ? 25 ARG A HB3  5 
ATOM 2430 H HG2  . ARG A 1 25 ? -8.257  -5.524  -2.724  1.00 0.00 ? 25 ARG A HG2  5 
ATOM 2431 H HG3  . ARG A 1 25 ? -7.476  -5.008  -1.228  1.00 0.00 ? 25 ARG A HG3  5 
ATOM 2432 H HD2  . ARG A 1 25 ? -8.941  -6.161  0.079   1.00 0.00 ? 25 ARG A HD2  5 
ATOM 2433 H HD3  . ARG A 1 25 ? -10.320 -5.750  -0.941  1.00 0.00 ? 25 ARG A HD3  5 
ATOM 2434 H HE   . ARG A 1 25 ? -8.373  -7.841  -1.810  1.00 0.00 ? 25 ARG A HE   5 
ATOM 2435 H HH11 . ARG A 1 25 ? -10.964 -6.884  -3.241  1.00 0.00 ? 25 ARG A HH11 5 
ATOM 2436 H HH12 . ARG A 1 25 ? -12.013 -8.216  -2.888  1.00 0.00 ? 25 ARG A HH12 5 
ATOM 2437 H HH21 . ARG A 1 25 ? -9.976  -9.502  -0.393  1.00 0.00 ? 25 ARG A HH21 5 
ATOM 2438 H HH22 . ARG A 1 25 ? -11.453 -9.699  -1.276  1.00 0.00 ? 25 ARG A HH22 5 
ATOM 2439 N N    . GLY A 1 26 ? -6.125  -1.679  -1.860  1.00 0.00 ? 26 GLY A N    5 
ATOM 2440 C CA   . GLY A 1 26 ? -5.162  -1.109  -0.879  1.00 0.00 ? 26 GLY A CA   5 
ATOM 2441 C C    . GLY A 1 26 ? -3.996  -0.440  -1.604  1.00 0.00 ? 26 GLY A C    5 
ATOM 2442 O O    . GLY A 1 26 ? -3.392  -1.002  -2.494  1.00 0.00 ? 26 GLY A O    5 
ATOM 2443 H H    . GLY A 1 26 ? -5.923  -1.661  -2.813  1.00 0.00 ? 26 GLY A H    5 
ATOM 2444 H HA2  . GLY A 1 26 ? -5.659  -0.380  -0.286  1.00 0.00 ? 26 GLY A HA2  5 
ATOM 2445 H HA3  . GLY A 1 26 ? -4.794  -1.887  -0.238  1.00 0.00 ? 26 GLY A HA3  5 
ATOM 2446 N N    . LYS A 1 27 ? -3.684  0.769   -1.225  1.00 0.00 ? 27 LYS A N    5 
ATOM 2447 C CA   . LYS A 1 27 ? -2.565  1.498   -1.880  1.00 0.00 ? 27 LYS A CA   5 
ATOM 2448 C C    . LYS A 1 27 ? -1.957  2.489   -0.883  1.00 0.00 ? 27 LYS A C    5 
ATOM 2449 O O    . LYS A 1 27 ? -2.109  2.351   0.315   1.00 0.00 ? 27 LYS A O    5 
ATOM 2450 C CB   . LYS A 1 27 ? -3.093  2.255   -3.100  1.00 0.00 ? 27 LYS A CB   5 
ATOM 2451 C CG   . LYS A 1 27 ? -2.290  1.851   -4.338  1.00 0.00 ? 27 LYS A CG   5 
ATOM 2452 C CD   . LYS A 1 27 ? -3.247  1.402   -5.444  1.00 0.00 ? 27 LYS A CD   5 
ATOM 2453 C CE   . LYS A 1 27 ? -3.315  2.478   -6.529  1.00 0.00 ? 27 LYS A CE   5 
ATOM 2454 N NZ   . LYS A 1 27 ? -3.161  1.843   -7.868  1.00 0.00 ? 27 LYS A NZ   5 
ATOM 2455 H H    . LYS A 1 27 ? -4.192  1.200   -0.505  1.00 0.00 ? 27 LYS A H    5 
ATOM 2456 H HA   . LYS A 1 27 ? -1.810  0.793   -2.193  1.00 0.00 ? 27 LYS A HA   5 
ATOM 2457 H HB2  . LYS A 1 27 ? -4.134  2.011   -3.249  1.00 0.00 ? 27 LYS A HB2  5 
ATOM 2458 H HB3  . LYS A 1 27 ? -2.991  3.317   -2.937  1.00 0.00 ? 27 LYS A HB3  5 
ATOM 2459 H HG2  . LYS A 1 27 ? -1.712  2.696   -4.681  1.00 0.00 ? 27 LYS A HG2  5 
ATOM 2460 H HG3  . LYS A 1 27 ? -1.626  1.038   -4.087  1.00 0.00 ? 27 LYS A HG3  5 
ATOM 2461 H HD2  . LYS A 1 27 ? -2.889  0.477   -5.875  1.00 0.00 ? 27 LYS A HD2  5 
ATOM 2462 H HD3  . LYS A 1 27 ? -4.231  1.249   -5.029  1.00 0.00 ? 27 LYS A HD3  5 
ATOM 2463 H HE2  . LYS A 1 27 ? -4.269  2.982   -6.476  1.00 0.00 ? 27 LYS A HE2  5 
ATOM 2464 H HE3  . LYS A 1 27 ? -2.521  3.194   -6.375  1.00 0.00 ? 27 LYS A HE3  5 
ATOM 2465 H HZ1  . LYS A 1 27 ? -3.480  0.855   -7.822  1.00 0.00 ? 27 LYS A HZ1  5 
ATOM 2466 H HZ2  . LYS A 1 27 ? -3.733  2.359   -8.565  1.00 0.00 ? 27 LYS A HZ2  5 
ATOM 2467 H HZ3  . LYS A 1 27 ? -2.159  1.872   -8.151  1.00 0.00 ? 27 LYS A HZ3  5 
ATOM 2468 N N    . CYS A 1 28 ? -1.268  3.486   -1.367  1.00 0.00 ? 28 CYS A N    5 
ATOM 2469 C CA   . CYS A 1 28 ? -0.649  4.481   -0.445  1.00 0.00 ? 28 CYS A CA   5 
ATOM 2470 C C    . CYS A 1 28 ? -1.186  5.885   -0.761  1.00 0.00 ? 28 CYS A C    5 
ATOM 2471 O O    . CYS A 1 28 ? -0.663  6.573   -1.614  1.00 0.00 ? 28 CYS A O    5 
ATOM 2472 C CB   . CYS A 1 28 ? 0.868   4.472   -0.643  1.00 0.00 ? 28 CYS A CB   5 
ATOM 2473 S SG   . CYS A 1 28 ? 1.605   3.176   0.381   1.00 0.00 ? 28 CYS A SG   5 
ATOM 2474 H H    . CYS A 1 28 ? -1.156  3.580   -2.336  1.00 0.00 ? 28 CYS A H    5 
ATOM 2475 H HA   . CYS A 1 28 ? -0.875  4.215   0.576   1.00 0.00 ? 28 CYS A HA   5 
ATOM 2476 H HB2  . CYS A 1 28 ? 1.095   4.282   -1.681  1.00 0.00 ? 28 CYS A HB2  5 
ATOM 2477 H HB3  . CYS A 1 28 ? 1.272   5.431   -0.355  1.00 0.00 ? 28 CYS A HB3  5 
ATOM 2478 N N    . TYR A 1 29 ? -2.220  6.326   -0.086  1.00 0.00 ? 29 TYR A N    5 
ATOM 2479 C CA   . TYR A 1 29 ? -2.760  7.688   -0.369  1.00 0.00 ? 29 TYR A CA   5 
ATOM 2480 C C    . TYR A 1 29 ? -2.162  8.692   0.618   1.00 0.00 ? 29 TYR A C    5 
ATOM 2481 O O    . TYR A 1 29 ? -2.444  8.660   1.800   1.00 0.00 ? 29 TYR A O    5 
ATOM 2482 C CB   . TYR A 1 29 ? -4.283  7.675   -0.223  1.00 0.00 ? 29 TYR A CB   5 
ATOM 2483 C CG   . TYR A 1 29 ? -4.917  7.349   -1.555  1.00 0.00 ? 29 TYR A CG   5 
ATOM 2484 C CD1  . TYR A 1 29 ? -5.223  8.378   -2.455  1.00 0.00 ? 29 TYR A CD1  5 
ATOM 2485 C CD2  . TYR A 1 29 ? -5.200  6.019   -1.891  1.00 0.00 ? 29 TYR A CD2  5 
ATOM 2486 C CE1  . TYR A 1 29 ? -5.813  8.077   -3.689  1.00 0.00 ? 29 TYR A CE1  5 
ATOM 2487 C CE2  . TYR A 1 29 ? -5.790  5.719   -3.125  1.00 0.00 ? 29 TYR A CE2  5 
ATOM 2488 C CZ   . TYR A 1 29 ? -6.095  6.747   -4.023  1.00 0.00 ? 29 TYR A CZ   5 
ATOM 2489 O OH   . TYR A 1 29 ? -6.676  6.451   -5.240  1.00 0.00 ? 29 TYR A OH   5 
ATOM 2490 H H    . TYR A 1 29 ? -2.639  5.770   0.604   1.00 0.00 ? 29 TYR A H    5 
ATOM 2491 H HA   . TYR A 1 29 ? -2.497  7.976   -1.376  1.00 0.00 ? 29 TYR A HA   5 
ATOM 2492 H HB2  . TYR A 1 29 ? -4.568  6.927   0.502   1.00 0.00 ? 29 TYR A HB2  5 
ATOM 2493 H HB3  . TYR A 1 29 ? -4.622  8.645   0.108   1.00 0.00 ? 29 TYR A HB3  5 
ATOM 2494 H HD1  . TYR A 1 29 ? -5.006  9.403   -2.197  1.00 0.00 ? 29 TYR A HD1  5 
ATOM 2495 H HD2  . TYR A 1 29 ? -4.964  5.226   -1.197  1.00 0.00 ? 29 TYR A HD2  5 
ATOM 2496 H HE1  . TYR A 1 29 ? -6.048  8.871   -4.383  1.00 0.00 ? 29 TYR A HE1  5 
ATOM 2497 H HE2  . TYR A 1 29 ? -6.008  4.694   -3.384  1.00 0.00 ? 29 TYR A HE2  5 
ATOM 2498 H HH   . TYR A 1 29 ? -5.975  6.384   -5.894  1.00 0.00 ? 29 TYR A HH   5 
ATOM 2499 N N    . GLY A 1 30 ? -1.340  9.588   0.143   1.00 0.00 ? 30 GLY A N    5 
ATOM 2500 C CA   . GLY A 1 30 ? -0.728  10.592  1.051   1.00 0.00 ? 30 GLY A CA   5 
ATOM 2501 C C    . GLY A 1 30 ? 0.381   9.935   1.872   1.00 0.00 ? 30 GLY A C    5 
ATOM 2502 O O    . GLY A 1 30 ? 1.229   9.248   1.338   1.00 0.00 ? 30 GLY A O    5 
ATOM 2503 H H    . GLY A 1 30 ? -1.128  9.601   -0.809  1.00 0.00 ? 30 GLY A H    5 
ATOM 2504 H HA2  . GLY A 1 30 ? -0.316  11.401  0.468   1.00 0.00 ? 30 GLY A HA2  5 
ATOM 2505 H HA3  . GLY A 1 30 ? -1.483  10.976  1.714   1.00 0.00 ? 30 GLY A HA3  5 
ATOM 2506 N N    . PRO A 1 31 ? 0.332   10.171  3.153   1.00 0.00 ? 31 PRO A N    5 
ATOM 2507 C CA   . PRO A 1 31 ? 1.359   9.582   4.039   1.00 0.00 ? 31 PRO A CA   5 
ATOM 2508 C C    . PRO A 1 31 ? 0.766   8.424   4.849   1.00 0.00 ? 31 PRO A C    5 
ATOM 2509 O O    . PRO A 1 31 ? 1.174   8.160   5.962   1.00 0.00 ? 31 PRO A O    5 
ATOM 2510 C CB   . PRO A 1 31 ? 1.772   10.730  4.960   1.00 0.00 ? 31 PRO A CB   5 
ATOM 2511 C CG   . PRO A 1 31 ? 0.602   11.732  4.951   1.00 0.00 ? 31 PRO A CG   5 
ATOM 2512 C CD   . PRO A 1 31 ? -0.194  11.458  3.665   1.00 0.00 ? 31 PRO A CD   5 
ATOM 2513 H HA   . PRO A 1 31 ? 2.207   9.247   3.466   1.00 0.00 ? 31 PRO A HA   5 
ATOM 2514 H HB2  . PRO A 1 31 ? 1.941   10.359  5.962   1.00 0.00 ? 31 PRO A HB2  5 
ATOM 2515 H HB3  . PRO A 1 31 ? 2.664   11.208  4.584   1.00 0.00 ? 31 PRO A HB3  5 
ATOM 2516 H HG2  . PRO A 1 31 ? -0.024  11.577  5.819   1.00 0.00 ? 31 PRO A HG2  5 
ATOM 2517 H HG3  . PRO A 1 31 ? 0.978   12.743  4.937   1.00 0.00 ? 31 PRO A HG3  5 
ATOM 2518 H HD2  . PRO A 1 31 ? -1.248  11.374  3.885   1.00 0.00 ? 31 PRO A HD2  5 
ATOM 2519 H HD3  . PRO A 1 31 ? -0.022  12.241  2.943   1.00 0.00 ? 31 PRO A HD3  5 
ATOM 2520 N N    . GLN A 1 32 ? -0.194  7.731   4.296   1.00 0.00 ? 32 GLN A N    5 
ATOM 2521 C CA   . GLN A 1 32 ? -0.810  6.591   5.034   1.00 0.00 ? 32 GLN A CA   5 
ATOM 2522 C C    . GLN A 1 32 ? -1.293  5.535   4.036   1.00 0.00 ? 32 GLN A C    5 
ATOM 2523 O O    . GLN A 1 32 ? -1.545  5.824   2.883   1.00 0.00 ? 32 GLN A O    5 
ATOM 2524 C CB   . GLN A 1 32 ? -1.999  7.097   5.856   1.00 0.00 ? 32 GLN A CB   5 
ATOM 2525 C CG   . GLN A 1 32 ? -1.516  7.535   7.241   1.00 0.00 ? 32 GLN A CG   5 
ATOM 2526 C CD   . GLN A 1 32 ? -2.138  6.632   8.306   1.00 0.00 ? 32 GLN A CD   5 
ATOM 2527 O OE1  . GLN A 1 32 ? -1.484  5.753   8.830   1.00 0.00 ? 32 GLN A OE1  5 
ATOM 2528 N NE2  . GLN A 1 32 ? -3.383  6.815   8.653   1.00 0.00 ? 32 GLN A NE2  5 
ATOM 2529 H H    . GLN A 1 32 ? -0.509  7.959   3.397   1.00 0.00 ? 32 GLN A H    5 
ATOM 2530 H HA   . GLN A 1 32 ? -0.077  6.154   5.696   1.00 0.00 ? 32 GLN A HA   5 
ATOM 2531 H HB2  . GLN A 1 32 ? -2.454  7.937   5.350   1.00 0.00 ? 32 GLN A HB2  5 
ATOM 2532 H HB3  . GLN A 1 32 ? -2.724  6.305   5.963   1.00 0.00 ? 32 GLN A HB3  5 
ATOM 2533 H HG2  . GLN A 1 32 ? -0.439  7.458   7.286   1.00 0.00 ? 32 GLN A HG2  5 
ATOM 2534 H HG3  . GLN A 1 32 ? -1.813  8.557   7.419   1.00 0.00 ? 32 GLN A HG3  5 
ATOM 2535 H HE21 . GLN A 1 32 ? -3.910  7.526   8.232   1.00 0.00 ? 32 GLN A HE21 5 
ATOM 2536 H HE22 . GLN A 1 32 ? -3.792  6.241   9.335   1.00 0.00 ? 32 GLN A HE22 5 
ATOM 2537 N N    . CYS A 1 33 ? -1.424  4.311   4.473   1.00 0.00 ? 33 CYS A N    5 
ATOM 2538 C CA   . CYS A 1 33 ? -1.891  3.235   3.552   1.00 0.00 ? 33 CYS A CA   5 
ATOM 2539 C C    . CYS A 1 33 ? -3.383  2.987   3.779   1.00 0.00 ? 33 CYS A C    5 
ATOM 2540 O O    . CYS A 1 33 ? -3.812  2.681   4.874   1.00 0.00 ? 33 CYS A O    5 
ATOM 2541 C CB   . CYS A 1 33 ? -1.111  1.949   3.832   1.00 0.00 ? 33 CYS A CB   5 
ATOM 2542 S SG   . CYS A 1 33 ? -1.279  0.820   2.427   1.00 0.00 ? 33 CYS A SG   5 
ATOM 2543 H H    . CYS A 1 33 ? -1.216  4.099   5.406   1.00 0.00 ? 33 CYS A H    5 
ATOM 2544 H HA   . CYS A 1 33 ? -1.728  3.540   2.528   1.00 0.00 ? 33 CYS A HA   5 
ATOM 2545 H HB2  . CYS A 1 33 ? -0.068  2.187   3.978   1.00 0.00 ? 33 CYS A HB2  5 
ATOM 2546 H HB3  . CYS A 1 33 ? -1.500  1.478   4.722   1.00 0.00 ? 33 CYS A HB3  5 
ATOM 2547 N N    . LEU A 1 34 ? -4.178  3.116   2.753   1.00 0.00 ? 34 LEU A N    5 
ATOM 2548 C CA   . LEU A 1 34 ? -5.642  2.888   2.916   1.00 0.00 ? 34 LEU A CA   5 
ATOM 2549 C C    . LEU A 1 34 ? -6.058  1.649   2.121   1.00 0.00 ? 34 LEU A C    5 
ATOM 2550 O O    . LEU A 1 34 ? -5.229  0.876   1.679   1.00 0.00 ? 34 LEU A O    5 
ATOM 2551 C CB   . LEU A 1 34 ? -6.410  4.109   2.400   1.00 0.00 ? 34 LEU A CB   5 
ATOM 2552 C CG   . LEU A 1 34 ? -5.832  5.381   3.023   1.00 0.00 ? 34 LEU A CG   5 
ATOM 2553 C CD1  . LEU A 1 34 ? -6.605  6.598   2.507   1.00 0.00 ? 34 LEU A CD1  5 
ATOM 2554 C CD2  . LEU A 1 34 ? -5.961  5.310   4.547   1.00 0.00 ? 34 LEU A CD2  5 
ATOM 2555 H H    . LEU A 1 34 ? -3.814  3.362   1.878   1.00 0.00 ? 34 LEU A H    5 
ATOM 2556 H HA   . LEU A 1 34 ? -5.867  2.737   3.962   1.00 0.00 ? 34 LEU A HA   5 
ATOM 2557 H HB2  . LEU A 1 34 ? -6.321  4.161   1.325   1.00 0.00 ? 34 LEU A HB2  5 
ATOM 2558 H HB3  . LEU A 1 34 ? -7.451  4.019   2.670   1.00 0.00 ? 34 LEU A HB3  5 
ATOM 2559 H HG   . LEU A 1 34 ? -4.792  5.475   2.752   1.00 0.00 ? 34 LEU A HG   5 
ATOM 2560 H HD11 . LEU A 1 34 ? -7.654  6.355   2.437   1.00 0.00 ? 34 LEU A HD11 5 
ATOM 2561 H HD12 . LEU A 1 34 ? -6.472  7.425   3.190   1.00 0.00 ? 34 LEU A HD12 5 
ATOM 2562 H HD13 . LEU A 1 34 ? -6.232  6.873   1.532   1.00 0.00 ? 34 LEU A HD13 5 
ATOM 2563 H HD21 . LEU A 1 34 ? -5.504  4.399   4.904   1.00 0.00 ? 34 LEU A HD21 5 
ATOM 2564 H HD22 . LEU A 1 34 ? -5.464  6.160   4.990   1.00 0.00 ? 34 LEU A HD22 5 
ATOM 2565 H HD23 . LEU A 1 34 ? -7.005  5.321   4.819   1.00 0.00 ? 34 LEU A HD23 5 
ATOM 2566 N N    . CYS A 1 35 ? -7.335  1.452   1.935   1.00 0.00 ? 35 CYS A N    5 
ATOM 2567 C CA   . CYS A 1 35 ? -7.804  0.264   1.168   1.00 0.00 ? 35 CYS A CA   5 
ATOM 2568 C C    . CYS A 1 35 ? -8.537  0.726   -0.091  1.00 0.00 ? 35 CYS A C    5 
ATOM 2569 O O    . CYS A 1 35 ? -8.468  1.878   -0.475  1.00 0.00 ? 35 CYS A O    5 
ATOM 2570 C CB   . CYS A 1 35 ? -8.750  -0.565  2.037   1.00 0.00 ? 35 CYS A CB   5 
ATOM 2571 S SG   . CYS A 1 35 ? -7.827  -1.270  3.425   1.00 0.00 ? 35 CYS A SG   5 
ATOM 2572 H H    . CYS A 1 35 ? -7.986  2.088   2.300   1.00 0.00 ? 35 CYS A H    5 
ATOM 2573 H HA   . CYS A 1 35 ? -6.956  -0.342  0.888   1.00 0.00 ? 35 CYS A HA   5 
ATOM 2574 H HB2  . CYS A 1 35 ? -9.542  0.067   2.413   1.00 0.00 ? 35 CYS A HB2  5 
ATOM 2575 H HB3  . CYS A 1 35 ? -9.177  -1.362  1.446   1.00 0.00 ? 35 CYS A HB3  5 
ATOM 2576 N N    . ARG A 1 36 ? -9.240  -0.162  -0.738  1.00 0.00 ? 36 ARG A N    5 
ATOM 2577 C CA   . ARG A 1 36 ? -9.977  0.226   -1.974  1.00 0.00 ? 36 ARG A CA   5 
ATOM 2578 C C    . ARG A 1 36 ? -9.057  1.047   -2.879  1.00 0.00 ? 36 ARG A C    5 
ATOM 2579 O O    . ARG A 1 36 ? -9.523  2.033   -3.426  1.00 0.00 ? 36 ARG A O    5 
ATOM 2580 C CB   . ARG A 1 36 ? -11.200 1.064   -1.594  1.00 0.00 ? 36 ARG A CB   5 
ATOM 2581 C CG   . ARG A 1 36 ? -12.470 0.231   -1.782  1.00 0.00 ? 36 ARG A CG   5 
ATOM 2582 C CD   . ARG A 1 36 ? -13.346 0.353   -0.534  1.00 0.00 ? 36 ARG A CD   5 
ATOM 2583 N NE   . ARG A 1 36 ? -14.026 -0.946  -0.274  1.00 0.00 ? 36 ARG A NE   5 
ATOM 2584 C CZ   . ARG A 1 36 ? -13.870 -1.545  0.875   1.00 0.00 ? 36 ARG A CZ   5 
ATOM 2585 N NH1  . ARG A 1 36 ? -13.693 -0.840  1.960   1.00 0.00 ? 36 ARG A NH1  5 
ATOM 2586 N NH2  . ARG A 1 36 ? -13.889 -2.848  0.938   1.00 0.00 ? 36 ARG A NH2  5 
ATOM 2587 O OXT  . ARG A 1 36 ? -7.902  0.676   -3.010  1.00 0.00 ? 36 ARG A OXT  5 
ATOM 2588 H H    . ARG A 1 36 ? -9.282  -1.085  -0.411  1.00 0.00 ? 36 ARG A H    5 
ATOM 2589 H HA   . ARG A 1 36 ? -10.297 -0.663  -2.496  1.00 0.00 ? 36 ARG A HA   5 
ATOM 2590 H HB2  . ARG A 1 36 ? -11.119 1.370   -0.561  1.00 0.00 ? 36 ARG A HB2  5 
ATOM 2591 H HB3  . ARG A 1 36 ? -11.249 1.937   -2.226  1.00 0.00 ? 36 ARG A HB3  5 
ATOM 2592 H HG2  . ARG A 1 36 ? -13.013 0.593   -2.643  1.00 0.00 ? 36 ARG A HG2  5 
ATOM 2593 H HG3  . ARG A 1 36 ? -12.204 -0.805  -1.933  1.00 0.00 ? 36 ARG A HG3  5 
ATOM 2594 H HD2  . ARG A 1 36 ? -12.730 0.612   0.314   1.00 0.00 ? 36 ARG A HD2  5 
ATOM 2595 H HD3  . ARG A 1 36 ? -14.088 1.123   -0.689  1.00 0.00 ? 36 ARG A HD3  5 
ATOM 2596 H HE   . ARG A 1 36 ? -14.590 -1.351  -0.966  1.00 0.00 ? 36 ARG A HE   5 
ATOM 2597 H HH11 . ARG A 1 36 ? -13.679 0.158   1.910   1.00 0.00 ? 36 ARG A HH11 5 
ATOM 2598 H HH12 . ARG A 1 36 ? -13.572 -1.300  2.839   1.00 0.00 ? 36 ARG A HH12 5 
ATOM 2599 H HH21 . ARG A 1 36 ? -14.022 -3.388  0.107   1.00 0.00 ? 36 ARG A HH21 5 
ATOM 2600 H HH22 . ARG A 1 36 ? -13.772 -3.307  1.819   1.00 0.00 ? 36 ARG A HH22 5 
ATOM 2601 N N    . MET A 1 1  ? -6.065  1.666   8.005   1.00 0.00 ? 1  MET A N    6 
ATOM 2602 C CA   . MET A 1 1  ? -4.791  1.633   7.233   1.00 0.00 ? 1  MET A CA   6 
ATOM 2603 C C    . MET A 1 1  ? -4.056  0.323   7.519   1.00 0.00 ? 1  MET A C    6 
ATOM 2604 O O    . MET A 1 1  ? -4.264  -0.307  8.537   1.00 0.00 ? 1  MET A O    6 
ATOM 2605 C CB   . MET A 1 1  ? -3.914  2.818   7.647   1.00 0.00 ? 1  MET A CB   6 
ATOM 2606 C CG   . MET A 1 1  ? -3.610  2.735   9.145   1.00 0.00 ? 1  MET A CG   6 
ATOM 2607 S SD   . MET A 1 1  ? -4.046  4.302   9.939   1.00 0.00 ? 1  MET A SD   6 
ATOM 2608 C CE   . MET A 1 1  ? -4.084  3.696   11.643  1.00 0.00 ? 1  MET A CE   6 
ATOM 2609 H H1   . MET A 1 1  ? -6.286  0.712   8.352   1.00 0.00 ? 1  MET A H1   6 
ATOM 2610 H H2   . MET A 1 1  ? -5.963  2.315   8.812   1.00 0.00 ? 1  MET A H2   6 
ATOM 2611 H H3   . MET A 1 1  ? -6.835  1.997   7.390   1.00 0.00 ? 1  MET A H3   6 
ATOM 2612 H HA   . MET A 1 1  ? -5.009  1.699   6.177   1.00 0.00 ? 1  MET A HA   6 
ATOM 2613 H HB2  . MET A 1 1  ? -2.989  2.790   7.089   1.00 0.00 ? 1  MET A HB2  6 
ATOM 2614 H HB3  . MET A 1 1  ? -4.434  3.740   7.437   1.00 0.00 ? 1  MET A HB3  6 
ATOM 2615 H HG2  . MET A 1 1  ? -4.188  1.936   9.587   1.00 0.00 ? 1  MET A HG2  6 
ATOM 2616 H HG3  . MET A 1 1  ? -2.558  2.540   9.289   1.00 0.00 ? 1  MET A HG3  6 
ATOM 2617 H HE1  . MET A 1 1  ? -3.395  2.873   11.751  1.00 0.00 ? 1  MET A HE1  6 
ATOM 2618 H HE2  . MET A 1 1  ? -3.797  4.493   12.314  1.00 0.00 ? 1  MET A HE2  6 
ATOM 2619 H HE3  . MET A 1 1  ? -5.084  3.359   11.882  1.00 0.00 ? 1  MET A HE3  6 
ATOM 2620 N N    . CYS A 1 2  ? -3.197  -0.093  6.628   1.00 0.00 ? 2  CYS A N    6 
ATOM 2621 C CA   . CYS A 1 2  ? -2.452  -1.364  6.851   1.00 0.00 ? 2  CYS A CA   6 
ATOM 2622 C C    . CYS A 1 2  ? -0.954  -1.110  6.668   1.00 0.00 ? 2  CYS A C    6 
ATOM 2623 O O    . CYS A 1 2  ? -0.401  -1.369  5.621   1.00 0.00 ? 2  CYS A O    6 
ATOM 2624 C CB   . CYS A 1 2  ? -2.917  -2.410  5.836   1.00 0.00 ? 2  CYS A CB   6 
ATOM 2625 S SG   . CYS A 1 2  ? -2.793  -4.062  6.569   1.00 0.00 ? 2  CYS A SG   6 
ATOM 2626 H H    . CYS A 1 2  ? -3.046  0.430   5.813   1.00 0.00 ? 2  CYS A H    6 
ATOM 2627 H HA   . CYS A 1 2  ? -2.639  -1.723  7.852   1.00 0.00 ? 2  CYS A HA   6 
ATOM 2628 H HB2  . CYS A 1 2  ? -3.944  -2.214  5.562   1.00 0.00 ? 2  CYS A HB2  6 
ATOM 2629 H HB3  . CYS A 1 2  ? -2.294  -2.359  4.957   1.00 0.00 ? 2  CYS A HB3  6 
ATOM 2630 N N    . MET A 1 3  ? -0.304  -0.599  7.681   1.00 0.00 ? 3  MET A N    6 
ATOM 2631 C CA   . MET A 1 3  ? 1.159   -0.312  7.588   1.00 0.00 ? 3  MET A CA   6 
ATOM 2632 C C    . MET A 1 3  ? 1.371   1.062   6.944   1.00 0.00 ? 3  MET A C    6 
ATOM 2633 O O    . MET A 1 3  ? 0.425   1.731   6.578   1.00 0.00 ? 3  MET A O    6 
ATOM 2634 C CB   . MET A 1 3  ? 1.869   -1.420  6.778   1.00 0.00 ? 3  MET A CB   6 
ATOM 2635 C CG   . MET A 1 3  ? 2.091   -0.990  5.320   1.00 0.00 ? 3  MET A CG   6 
ATOM 2636 S SD   . MET A 1 3  ? 1.985   -2.439  4.241   1.00 0.00 ? 3  MET A SD   6 
ATOM 2637 C CE   . MET A 1 3  ? 3.254   -3.432  5.063   1.00 0.00 ? 3  MET A CE   6 
ATOM 2638 H H    . MET A 1 3  ? -0.783  -0.397  8.511   1.00 0.00 ? 3  MET A H    6 
ATOM 2639 H HA   . MET A 1 3  ? 1.572   -0.292  8.588   1.00 0.00 ? 3  MET A HA   6 
ATOM 2640 H HB2  . MET A 1 3  ? 2.825   -1.634  7.233   1.00 0.00 ? 3  MET A HB2  6 
ATOM 2641 H HB3  . MET A 1 3  ? 1.264   -2.311  6.795   1.00 0.00 ? 3  MET A HB3  6 
ATOM 2642 H HG2  . MET A 1 3  ? 1.334   -0.275  5.036   1.00 0.00 ? 3  MET A HG2  6 
ATOM 2643 H HG3  . MET A 1 3  ? 3.068   -0.539  5.223   1.00 0.00 ? 3  MET A HG3  6 
ATOM 2644 H HE1  . MET A 1 3  ? 4.121   -2.817  5.261   1.00 0.00 ? 3  MET A HE1  6 
ATOM 2645 H HE2  . MET A 1 3  ? 2.861   -3.821  5.992   1.00 0.00 ? 3  MET A HE2  6 
ATOM 2646 H HE3  . MET A 1 3  ? 3.539   -4.253  4.425   1.00 0.00 ? 3  MET A HE3  6 
ATOM 2647 N N    . PRO A 1 4  ? 2.615   1.432   6.836   1.00 0.00 ? 4  PRO A N    6 
ATOM 2648 C CA   . PRO A 1 4  ? 2.938   2.746   6.234   1.00 0.00 ? 4  PRO A CA   6 
ATOM 2649 C C    . PRO A 1 4  ? 3.121   2.616   4.718   1.00 0.00 ? 4  PRO A C    6 
ATOM 2650 O O    . PRO A 1 4  ? 3.004   1.544   4.158   1.00 0.00 ? 4  PRO A O    6 
ATOM 2651 C CB   . PRO A 1 4  ? 4.252   3.152   6.904   1.00 0.00 ? 4  PRO A CB   6 
ATOM 2652 C CG   . PRO A 1 4  ? 4.903   1.847   7.403   1.00 0.00 ? 4  PRO A CG   6 
ATOM 2653 C CD   . PRO A 1 4  ? 3.773   0.811   7.516   1.00 0.00 ? 4  PRO A CD   6 
ATOM 2654 H HA   . PRO A 1 4  ? 2.170   3.467   6.463   1.00 0.00 ? 4  PRO A HA   6 
ATOM 2655 H HB2  . PRO A 1 4  ? 4.896   3.643   6.186   1.00 0.00 ? 4  PRO A HB2  6 
ATOM 2656 H HB3  . PRO A 1 4  ? 4.057   3.805   7.739   1.00 0.00 ? 4  PRO A HB3  6 
ATOM 2657 H HG2  . PRO A 1 4  ? 5.649   1.512   6.694   1.00 0.00 ? 4  PRO A HG2  6 
ATOM 2658 H HG3  . PRO A 1 4  ? 5.354   2.003   8.371   1.00 0.00 ? 4  PRO A HG3  6 
ATOM 2659 H HD2  . PRO A 1 4  ? 4.052   -0.110  7.022   1.00 0.00 ? 4  PRO A HD2  6 
ATOM 2660 H HD3  . PRO A 1 4  ? 3.537   0.626   8.553   1.00 0.00 ? 4  PRO A HD3  6 
ATOM 2661 N N    . CYS A 1 5  ? 3.411   3.702   4.052   1.00 0.00 ? 5  CYS A N    6 
ATOM 2662 C CA   . CYS A 1 5  ? 3.604   3.651   2.581   1.00 0.00 ? 5  CYS A CA   6 
ATOM 2663 C C    . CYS A 1 5  ? 4.778   4.554   2.191   1.00 0.00 ? 5  CYS A C    6 
ATOM 2664 O O    . CYS A 1 5  ? 4.664   5.400   1.326   1.00 0.00 ? 5  CYS A O    6 
ATOM 2665 C CB   . CYS A 1 5  ? 2.332   4.133   1.877   1.00 0.00 ? 5  CYS A CB   6 
ATOM 2666 S SG   . CYS A 1 5  ? 1.579   2.758   0.969   1.00 0.00 ? 5  CYS A SG   6 
ATOM 2667 H H    . CYS A 1 5  ? 3.504   4.550   4.521   1.00 0.00 ? 5  CYS A H    6 
ATOM 2668 H HA   . CYS A 1 5  ? 3.818   2.641   2.290   1.00 0.00 ? 5  CYS A HA   6 
ATOM 2669 H HB2  . CYS A 1 5  ? 1.632   4.502   2.613   1.00 0.00 ? 5  CYS A HB2  6 
ATOM 2670 H HB3  . CYS A 1 5  ? 2.579   4.926   1.188   1.00 0.00 ? 5  CYS A HB3  6 
ATOM 2671 N N    . PHE A 1 6  ? 5.907   4.381   2.824   1.00 0.00 ? 6  PHE A N    6 
ATOM 2672 C CA   . PHE A 1 6  ? 7.086   5.229   2.491   1.00 0.00 ? 6  PHE A CA   6 
ATOM 2673 C C    . PHE A 1 6  ? 8.370   4.452   2.779   1.00 0.00 ? 6  PHE A C    6 
ATOM 2674 O O    . PHE A 1 6  ? 8.964   4.582   3.831   1.00 0.00 ? 6  PHE A O    6 
ATOM 2675 C CB   . PHE A 1 6  ? 7.059   6.498   3.342   1.00 0.00 ? 6  PHE A CB   6 
ATOM 2676 C CG   . PHE A 1 6  ? 5.893   7.358   2.921   1.00 0.00 ? 6  PHE A CG   6 
ATOM 2677 C CD1  . PHE A 1 6  ? 6.036   8.261   1.860   1.00 0.00 ? 6  PHE A CD1  6 
ATOM 2678 C CD2  . PHE A 1 6  ? 4.668   7.252   3.588   1.00 0.00 ? 6  PHE A CD2  6 
ATOM 2679 C CE1  . PHE A 1 6  ? 4.955   9.057   1.467   1.00 0.00 ? 6  PHE A CE1  6 
ATOM 2680 C CE2  . PHE A 1 6  ? 3.585   8.047   3.195   1.00 0.00 ? 6  PHE A CE2  6 
ATOM 2681 C CZ   . PHE A 1 6  ? 3.728   8.950   2.134   1.00 0.00 ? 6  PHE A CZ   6 
ATOM 2682 H H    . PHE A 1 6  ? 5.978   3.694   3.519   1.00 0.00 ? 6  PHE A H    6 
ATOM 2683 H HA   . PHE A 1 6  ? 7.052   5.495   1.445   1.00 0.00 ? 6  PHE A HA   6 
ATOM 2684 H HB2  . PHE A 1 6  ? 6.953   6.232   4.384   1.00 0.00 ? 6  PHE A HB2  6 
ATOM 2685 H HB3  . PHE A 1 6  ? 7.978   7.047   3.201   1.00 0.00 ? 6  PHE A HB3  6 
ATOM 2686 H HD1  . PHE A 1 6  ? 6.981   8.342   1.345   1.00 0.00 ? 6  PHE A HD1  6 
ATOM 2687 H HD2  . PHE A 1 6  ? 4.558   6.555   4.405   1.00 0.00 ? 6  PHE A HD2  6 
ATOM 2688 H HE1  . PHE A 1 6  ? 5.066   9.752   0.648   1.00 0.00 ? 6  PHE A HE1  6 
ATOM 2689 H HE2  . PHE A 1 6  ? 2.638   7.965   3.710   1.00 0.00 ? 6  PHE A HE2  6 
ATOM 2690 H HZ   . PHE A 1 6  ? 2.894   9.564   1.831   1.00 0.00 ? 6  PHE A HZ   6 
ATOM 2691 N N    . THR A 1 7  ? 8.803   3.642   1.853   1.00 0.00 ? 7  THR A N    6 
ATOM 2692 C CA   . THR A 1 7  ? 10.047  2.855   2.072   1.00 0.00 ? 7  THR A CA   6 
ATOM 2693 C C    . THR A 1 7  ? 11.008  3.085   0.905   1.00 0.00 ? 7  THR A C    6 
ATOM 2694 O O    . THR A 1 7  ? 11.958  3.835   1.008   1.00 0.00 ? 7  THR A O    6 
ATOM 2695 C CB   . THR A 1 7  ? 9.701   1.366   2.158   1.00 0.00 ? 7  THR A CB   6 
ATOM 2696 O OG1  . THR A 1 7  ? 8.334   1.180   1.814   1.00 0.00 ? 7  THR A OG1  6 
ATOM 2697 C CG2  . THR A 1 7  ? 9.950   0.862   3.582   1.00 0.00 ? 7  THR A CG2  6 
ATOM 2698 H H    . THR A 1 7  ? 8.308   3.552   1.013   1.00 0.00 ? 7  THR A H    6 
ATOM 2699 H HA   . THR A 1 7  ? 10.515  3.169   2.994   1.00 0.00 ? 7  THR A HA   6 
ATOM 2700 H HB   . THR A 1 7  ? 10.322  0.813   1.471   1.00 0.00 ? 7  THR A HB   6 
ATOM 2701 H HG1  . THR A 1 7  ? 7.840   1.016   2.621   1.00 0.00 ? 7  THR A HG1  6 
ATOM 2702 H HG21 . THR A 1 7  ? 10.498  1.608   4.137   1.00 0.00 ? 7  THR A HG21 6 
ATOM 2703 H HG22 . THR A 1 7  ? 9.004   0.674   4.068   1.00 0.00 ? 7  THR A HG22 6 
ATOM 2704 H HG23 . THR A 1 7  ? 10.524  -0.052  3.543   1.00 0.00 ? 7  THR A HG23 6 
ATOM 2705 N N    . THR A 1 8  ? 10.768  2.443   -0.206  1.00 0.00 ? 8  THR A N    6 
ATOM 2706 C CA   . THR A 1 8  ? 11.667  2.620   -1.380  1.00 0.00 ? 8  THR A CA   6 
ATOM 2707 C C    . THR A 1 8  ? 10.885  2.339   -2.666  1.00 0.00 ? 8  THR A C    6 
ATOM 2708 O O    . THR A 1 8  ? 9.768   1.863   -2.632  1.00 0.00 ? 8  THR A O    6 
ATOM 2709 C CB   . THR A 1 8  ? 12.842  1.646   -1.268  1.00 0.00 ? 8  THR A CB   6 
ATOM 2710 O OG1  . THR A 1 8  ? 13.592  1.670   -2.474  1.00 0.00 ? 8  THR A OG1  6 
ATOM 2711 C CG2  . THR A 1 8  ? 12.316  0.230   -1.020  1.00 0.00 ? 8  THR A CG2  6 
ATOM 2712 H H    . THR A 1 8  ? 9.997   1.842   -0.267  1.00 0.00 ? 8  THR A H    6 
ATOM 2713 H HA   . THR A 1 8  ? 12.039  3.634   -1.399  1.00 0.00 ? 8  THR A HA   6 
ATOM 2714 H HB   . THR A 1 8  ? 13.475  1.939   -0.444  1.00 0.00 ? 8  THR A HB   6 
ATOM 2715 H HG1  . THR A 1 8  ? 14.493  1.410   -2.266  1.00 0.00 ? 8  THR A HG1  6 
ATOM 2716 H HG21 . THR A 1 8  ? 11.288  0.279   -0.691  1.00 0.00 ? 8  THR A HG21 6 
ATOM 2717 H HG22 . THR A 1 8  ? 12.375  -0.340  -1.935  1.00 0.00 ? 8  THR A HG22 6 
ATOM 2718 H HG23 . THR A 1 8  ? 12.915  -0.248  -0.258  1.00 0.00 ? 8  THR A HG23 6 
ATOM 2719 N N    . ASP A 1 9  ? 11.462  2.631   -3.802  1.00 0.00 ? 9  ASP A N    6 
ATOM 2720 C CA   . ASP A 1 9  ? 10.747  2.380   -5.087  1.00 0.00 ? 9  ASP A CA   6 
ATOM 2721 C C    . ASP A 1 9  ? 11.012  0.944   -5.547  1.00 0.00 ? 9  ASP A C    6 
ATOM 2722 O O    . ASP A 1 9  ? 11.826  0.700   -6.415  1.00 0.00 ? 9  ASP A O    6 
ATOM 2723 C CB   . ASP A 1 9  ? 11.249  3.359   -6.150  1.00 0.00 ? 9  ASP A CB   6 
ATOM 2724 C CG   . ASP A 1 9  ? 10.110  4.296   -6.559  1.00 0.00 ? 9  ASP A CG   6 
ATOM 2725 O OD1  . ASP A 1 9  ? 8.989   3.827   -6.650  1.00 0.00 ? 9  ASP A OD1  6 
ATOM 2726 O OD2  . ASP A 1 9  ? 10.381  5.466   -6.772  1.00 0.00 ? 9  ASP A OD2  6 
ATOM 2727 H H    . ASP A 1 9  ? 12.363  3.015   -3.810  1.00 0.00 ? 9  ASP A H    6 
ATOM 2728 H HA   . ASP A 1 9  ? 9.688   2.521   -4.942  1.00 0.00 ? 9  ASP A HA   6 
ATOM 2729 H HB2  . ASP A 1 9  ? 12.068  3.938   -5.750  1.00 0.00 ? 9  ASP A HB2  6 
ATOM 2730 H HB3  . ASP A 1 9  ? 11.585  2.807   -7.014  1.00 0.00 ? 9  ASP A HB3  6 
ATOM 2731 N N    . HIS A 1 10 ? 10.327  -0.007  -4.972  1.00 0.00 ? 10 HIS A N    6 
ATOM 2732 C CA   . HIS A 1 10 ? 10.536  -1.426  -5.374  1.00 0.00 ? 10 HIS A CA   6 
ATOM 2733 C C    . HIS A 1 10 ? 9.259   -2.220  -5.091  1.00 0.00 ? 10 HIS A C    6 
ATOM 2734 O O    . HIS A 1 10 ? 9.258   -3.168  -4.330  1.00 0.00 ? 10 HIS A O    6 
ATOM 2735 C CB   . HIS A 1 10 ? 11.698  -2.016  -4.572  1.00 0.00 ? 10 HIS A CB   6 
ATOM 2736 C CG   . HIS A 1 10 ? 12.986  -1.791  -5.318  1.00 0.00 ? 10 HIS A CG   6 
ATOM 2737 N ND1  . HIS A 1 10 ? 14.224  -1.864  -4.698  1.00 0.00 ? 10 HIS A ND1  6 
ATOM 2738 C CD2  . HIS A 1 10 ? 13.244  -1.491  -6.634  1.00 0.00 ? 10 HIS A CD2  6 
ATOM 2739 C CE1  . HIS A 1 10 ? 15.160  -1.614  -5.631  1.00 0.00 ? 10 HIS A CE1  6 
ATOM 2740 N NE2  . HIS A 1 10 ? 14.618  -1.380  -6.829  1.00 0.00 ? 10 HIS A NE2  6 
ATOM 2741 H H    . HIS A 1 10 ? 9.675   0.212   -4.274  1.00 0.00 ? 10 HIS A H    6 
ATOM 2742 H HA   . HIS A 1 10 ? 10.765  -1.474  -6.429  1.00 0.00 ? 10 HIS A HA   6 
ATOM 2743 H HB2  . HIS A 1 10 ? 11.751  -1.532  -3.607  1.00 0.00 ? 10 HIS A HB2  6 
ATOM 2744 H HB3  . HIS A 1 10 ? 11.542  -3.076  -4.436  1.00 0.00 ? 10 HIS A HB3  6 
ATOM 2745 H HD1  . HIS A 1 10 ? 14.387  -2.062  -3.752  1.00 0.00 ? 10 HIS A HD1  6 
ATOM 2746 H HD2  . HIS A 1 10 ? 12.494  -1.360  -7.400  1.00 0.00 ? 10 HIS A HD2  6 
ATOM 2747 H HE1  . HIS A 1 10 ? 16.223  -1.600  -5.435  1.00 0.00 ? 10 HIS A HE1  6 
ATOM 2748 N N    . GLN A 1 11 ? 8.168   -1.831  -5.692  1.00 0.00 ? 11 GLN A N    6 
ATOM 2749 C CA   . GLN A 1 11 ? 6.884   -2.550  -5.458  1.00 0.00 ? 11 GLN A CA   6 
ATOM 2750 C C    . GLN A 1 11 ? 6.427   -2.308  -4.018  1.00 0.00 ? 11 GLN A C    6 
ATOM 2751 O O    . GLN A 1 11 ? 5.941   -3.200  -3.351  1.00 0.00 ? 11 GLN A O    6 
ATOM 2752 C CB   . GLN A 1 11 ? 7.082   -4.050  -5.688  1.00 0.00 ? 11 GLN A CB   6 
ATOM 2753 C CG   . GLN A 1 11 ? 6.181   -4.510  -6.835  1.00 0.00 ? 11 GLN A CG   6 
ATOM 2754 C CD   . GLN A 1 11 ? 6.435   -3.634  -8.062  1.00 0.00 ? 11 GLN A CD   6 
ATOM 2755 O OE1  . GLN A 1 11 ? 5.511   -3.245  -8.748  1.00 0.00 ? 11 GLN A OE1  6 
ATOM 2756 N NE2  . GLN A 1 11 ? 7.660   -3.304  -8.370  1.00 0.00 ? 11 GLN A NE2  6 
ATOM 2757 H H    . GLN A 1 11 ? 8.192   -1.060  -6.296  1.00 0.00 ? 11 GLN A H    6 
ATOM 2758 H HA   . GLN A 1 11 ? 6.134   -2.177  -6.140  1.00 0.00 ? 11 GLN A HA   6 
ATOM 2759 H HB2  . GLN A 1 11 ? 8.115   -4.242  -5.939  1.00 0.00 ? 11 GLN A HB2  6 
ATOM 2760 H HB3  . GLN A 1 11 ? 6.823   -4.589  -4.789  1.00 0.00 ? 11 GLN A HB3  6 
ATOM 2761 H HG2  . GLN A 1 11 ? 6.401   -5.542  -7.074  1.00 0.00 ? 11 GLN A HG2  6 
ATOM 2762 H HG3  . GLN A 1 11 ? 5.147   -4.422  -6.540  1.00 0.00 ? 11 GLN A HG3  6 
ATOM 2763 H HE21 . GLN A 1 11 ? 8.406   -3.618  -7.817  1.00 0.00 ? 11 GLN A HE21 6 
ATOM 2764 H HE22 . GLN A 1 11 ? 7.833   -2.745  -9.156  1.00 0.00 ? 11 GLN A HE22 6 
ATOM 2765 N N    . MET A 1 12 ? 6.579   -1.105  -3.535  1.00 0.00 ? 12 MET A N    6 
ATOM 2766 C CA   . MET A 1 12 ? 6.154   -0.800  -2.140  1.00 0.00 ? 12 MET A CA   6 
ATOM 2767 C C    . MET A 1 12 ? 4.658   -1.053  -2.004  1.00 0.00 ? 12 MET A C    6 
ATOM 2768 O O    . MET A 1 12 ? 4.208   -1.731  -1.103  1.00 0.00 ? 12 MET A O    6 
ATOM 2769 C CB   . MET A 1 12 ? 6.437   0.668   -1.832  1.00 0.00 ? 12 MET A CB   6 
ATOM 2770 C CG   . MET A 1 12 ? 6.741   0.827   -0.341  1.00 0.00 ? 12 MET A CG   6 
ATOM 2771 S SD   . MET A 1 12 ? 5.328   1.603   0.481   1.00 0.00 ? 12 MET A SD   6 
ATOM 2772 C CE   . MET A 1 12 ? 4.625   0.096   1.195   1.00 0.00 ? 12 MET A CE   6 
ATOM 2773 H H    . MET A 1 12 ? 6.973   -0.401  -4.092  1.00 0.00 ? 12 MET A H    6 
ATOM 2774 H HA   . MET A 1 12 ? 6.695   -1.428  -1.448  1.00 0.00 ? 12 MET A HA   6 
ATOM 2775 H HB2  . MET A 1 12 ? 7.282   1.000   -2.415  1.00 0.00 ? 12 MET A HB2  6 
ATOM 2776 H HB3  . MET A 1 12 ? 5.572   1.261   -2.084  1.00 0.00 ? 12 MET A HB3  6 
ATOM 2777 H HG2  . MET A 1 12 ? 6.925   -0.143  0.094   1.00 0.00 ? 12 MET A HG2  6 
ATOM 2778 H HG3  . MET A 1 12 ? 7.617   1.449   -0.217  1.00 0.00 ? 12 MET A HG3  6 
ATOM 2779 H HE1  . MET A 1 12 ? 5.158   -0.764  0.814   1.00 0.00 ? 12 MET A HE1  6 
ATOM 2780 H HE2  . MET A 1 12 ? 4.717   0.127   2.268   1.00 0.00 ? 12 MET A HE2  6 
ATOM 2781 H HE3  . MET A 1 12 ? 3.580   0.026   0.927   1.00 0.00 ? 12 MET A HE3  6 
ATOM 2782 N N    . ALA A 1 13 ? 3.883   -0.502  -2.893  1.00 0.00 ? 13 ALA A N    6 
ATOM 2783 C CA   . ALA A 1 13 ? 2.409   -0.698  -2.826  1.00 0.00 ? 13 ALA A CA   6 
ATOM 2784 C C    . ALA A 1 13 ? 2.077   -2.185  -2.979  1.00 0.00 ? 13 ALA A C    6 
ATOM 2785 O O    . ALA A 1 13 ? 0.962   -2.605  -2.747  1.00 0.00 ? 13 ALA A O    6 
ATOM 2786 C CB   . ALA A 1 13 ? 1.735   0.092   -3.949  1.00 0.00 ? 13 ALA A CB   6 
ATOM 2787 H H    . ALA A 1 13 ? 4.274   0.047   -3.606  1.00 0.00 ? 13 ALA A H    6 
ATOM 2788 H HA   . ALA A 1 13 ? 2.045   -0.346  -1.873  1.00 0.00 ? 13 ALA A HA   6 
ATOM 2789 H HB1  . ALA A 1 13 ? 2.408   0.168   -4.789  1.00 0.00 ? 13 ALA A HB1  6 
ATOM 2790 H HB2  . ALA A 1 13 ? 0.832   -0.415  -4.254  1.00 0.00 ? 13 ALA A HB2  6 
ATOM 2791 H HB3  . ALA A 1 13 ? 1.489   1.081   -3.593  1.00 0.00 ? 13 ALA A HB3  6 
ATOM 2792 N N    . ARG A 1 14 ? 3.031   -2.985  -3.367  1.00 0.00 ? 14 ARG A N    6 
ATOM 2793 C CA   . ARG A 1 14 ? 2.758   -4.441  -3.528  1.00 0.00 ? 14 ARG A CA   6 
ATOM 2794 C C    . ARG A 1 14 ? 2.362   -5.035  -2.176  1.00 0.00 ? 14 ARG A C    6 
ATOM 2795 O O    . ARG A 1 14 ? 1.694   -6.047  -2.103  1.00 0.00 ? 14 ARG A O    6 
ATOM 2796 C CB   . ARG A 1 14 ? 4.015   -5.143  -4.043  1.00 0.00 ? 14 ARG A CB   6 
ATOM 2797 C CG   . ARG A 1 14 ? 3.621   -6.226  -5.048  1.00 0.00 ? 14 ARG A CG   6 
ATOM 2798 C CD   . ARG A 1 14 ? 4.620   -7.383  -4.972  1.00 0.00 ? 14 ARG A CD   6 
ATOM 2799 N NE   . ARG A 1 14 ? 4.693   -8.059  -6.297  1.00 0.00 ? 14 ARG A NE   6 
ATOM 2800 C CZ   . ARG A 1 14 ? 5.827   -8.550  -6.718  1.00 0.00 ? 14 ARG A CZ   6 
ATOM 2801 N NH1  . ARG A 1 14 ? 6.351   -9.582  -6.115  1.00 0.00 ? 14 ARG A NH1  6 
ATOM 2802 N NH2  . ARG A 1 14 ? 6.436   -8.008  -7.739  1.00 0.00 ? 14 ARG A NH2  6 
ATOM 2803 H H    . ARG A 1 14 ? 3.927   -2.631  -3.552  1.00 0.00 ? 14 ARG A H    6 
ATOM 2804 H HA   . ARG A 1 14 ? 1.952   -4.581  -4.233  1.00 0.00 ? 14 ARG A HA   6 
ATOM 2805 H HB2  . ARG A 1 14 ? 4.660   -4.422  -4.524  1.00 0.00 ? 14 ARG A HB2  6 
ATOM 2806 H HB3  . ARG A 1 14 ? 4.539   -5.597  -3.215  1.00 0.00 ? 14 ARG A HB3  6 
ATOM 2807 H HG2  . ARG A 1 14 ? 2.631   -6.591  -4.815  1.00 0.00 ? 14 ARG A HG2  6 
ATOM 2808 H HG3  . ARG A 1 14 ? 3.628   -5.813  -6.044  1.00 0.00 ? 14 ARG A HG3  6 
ATOM 2809 H HD2  . ARG A 1 14 ? 5.596   -7.000  -4.709  1.00 0.00 ? 14 ARG A HD2  6 
ATOM 2810 H HD3  . ARG A 1 14 ? 4.297   -8.091  -4.224  1.00 0.00 ? 14 ARG A HD3  6 
ATOM 2811 H HE   . ARG A 1 14 ? 3.890   -8.133  -6.853  1.00 0.00 ? 14 ARG A HE   6 
ATOM 2812 H HH11 . ARG A 1 14 ? 5.885   -9.994  -5.331  1.00 0.00 ? 14 ARG A HH11 6 
ATOM 2813 H HH12 . ARG A 1 14 ? 7.218   -9.964  -6.438  1.00 0.00 ? 14 ARG A HH12 6 
ATOM 2814 H HH21 . ARG A 1 14 ? 6.034   -7.215  -8.197  1.00 0.00 ? 14 ARG A HH21 6 
ATOM 2815 H HH22 . ARG A 1 14 ? 7.304   -8.385  -8.061  1.00 0.00 ? 14 ARG A HH22 6 
ATOM 2816 N N    . LYS A 1 15 ? 2.769   -4.413  -1.105  1.00 0.00 ? 15 LYS A N    6 
ATOM 2817 C CA   . LYS A 1 15 ? 2.419   -4.938  0.242   1.00 0.00 ? 15 LYS A CA   6 
ATOM 2818 C C    . LYS A 1 15 ? 1.374   -4.025  0.887   1.00 0.00 ? 15 LYS A C    6 
ATOM 2819 O O    . LYS A 1 15 ? 0.753   -4.376  1.869   1.00 0.00 ? 15 LYS A O    6 
ATOM 2820 C CB   . LYS A 1 15 ? 3.673   -4.989  1.125   1.00 0.00 ? 15 LYS A CB   6 
ATOM 2821 C CG   . LYS A 1 15 ? 4.710   -3.976  0.628   1.00 0.00 ? 15 LYS A CG   6 
ATOM 2822 C CD   . LYS A 1 15 ? 5.998   -4.119  1.440   1.00 0.00 ? 15 LYS A CD   6 
ATOM 2823 C CE   . LYS A 1 15 ? 5.916   -3.229  2.682   1.00 0.00 ? 15 LYS A CE   6 
ATOM 2824 N NZ   . LYS A 1 15 ? 7.009   -3.593  3.626   1.00 0.00 ? 15 LYS A NZ   6 
ATOM 2825 H H    . LYS A 1 15 ? 3.306   -3.600  -1.187  1.00 0.00 ? 15 LYS A H    6 
ATOM 2826 H HA   . LYS A 1 15 ? 2.010   -5.933  0.141   1.00 0.00 ? 15 LYS A HA   6 
ATOM 2827 H HB2  . LYS A 1 15 ? 3.403   -4.751  2.142   1.00 0.00 ? 15 LYS A HB2  6 
ATOM 2828 H HB3  . LYS A 1 15 ? 4.099   -5.980  1.089   1.00 0.00 ? 15 LYS A HB3  6 
ATOM 2829 H HG2  . LYS A 1 15 ? 4.919   -4.158  -0.416  1.00 0.00 ? 15 LYS A HG2  6 
ATOM 2830 H HG3  . LYS A 1 15 ? 4.321   -2.975  0.748   1.00 0.00 ? 15 LYS A HG3  6 
ATOM 2831 H HD2  . LYS A 1 15 ? 6.121   -5.150  1.741   1.00 0.00 ? 15 LYS A HD2  6 
ATOM 2832 H HD3  . LYS A 1 15 ? 6.840   -3.816  0.836   1.00 0.00 ? 15 LYS A HD3  6 
ATOM 2833 H HE2  . LYS A 1 15 ? 6.021   -2.194  2.392   1.00 0.00 ? 15 LYS A HE2  6 
ATOM 2834 H HE3  . LYS A 1 15 ? 4.961   -3.372  3.165   1.00 0.00 ? 15 LYS A HE3  6 
ATOM 2835 H HZ1  . LYS A 1 15 ? 7.708   -4.186  3.138   1.00 0.00 ? 15 LYS A HZ1  6 
ATOM 2836 H HZ2  . LYS A 1 15 ? 7.470   -2.727  3.973   1.00 0.00 ? 15 LYS A HZ2  6 
ATOM 2837 H HZ3  . LYS A 1 15 ? 6.611   -4.121  4.430   1.00 0.00 ? 15 LYS A HZ3  6 
ATOM 2838 N N    . CYS A 1 16 ? 1.168   -2.860  0.337   1.00 0.00 ? 16 CYS A N    6 
ATOM 2839 C CA   . CYS A 1 16 ? 0.154   -1.929  0.912   1.00 0.00 ? 16 CYS A CA   6 
ATOM 2840 C C    . CYS A 1 16 ? -1.213  -2.260  0.311   1.00 0.00 ? 16 CYS A C    6 
ATOM 2841 O O    . CYS A 1 16 ? -2.245  -1.943  0.867   1.00 0.00 ? 16 CYS A O    6 
ATOM 2842 C CB   . CYS A 1 16 ? 0.544   -0.486  0.569   1.00 0.00 ? 16 CYS A CB   6 
ATOM 2843 S SG   . CYS A 1 16 ? -0.864  0.625   0.835   1.00 0.00 ? 16 CYS A SG   6 
ATOM 2844 H H    . CYS A 1 16 ? 1.675   -2.598  -0.460  1.00 0.00 ? 16 CYS A H    6 
ATOM 2845 H HA   . CYS A 1 16 ? 0.119   -2.050  1.985   1.00 0.00 ? 16 CYS A HA   6 
ATOM 2846 H HB2  . CYS A 1 16 ? 1.365   -0.178  1.197   1.00 0.00 ? 16 CYS A HB2  6 
ATOM 2847 H HB3  . CYS A 1 16 ? 0.849   -0.437  -0.465  1.00 0.00 ? 16 CYS A HB3  6 
ATOM 2848 N N    . ASP A 1 17 ? -1.219  -2.905  -0.820  1.00 0.00 ? 17 ASP A N    6 
ATOM 2849 C CA   . ASP A 1 17 ? -2.504  -3.276  -1.474  1.00 0.00 ? 17 ASP A CA   6 
ATOM 2850 C C    . ASP A 1 17 ? -2.954  -4.634  -0.936  1.00 0.00 ? 17 ASP A C    6 
ATOM 2851 O O    . ASP A 1 17 ? -4.079  -4.811  -0.515  1.00 0.00 ? 17 ASP A O    6 
ATOM 2852 C CB   . ASP A 1 17 ? -2.280  -3.384  -2.984  1.00 0.00 ? 17 ASP A CB   6 
ATOM 2853 C CG   . ASP A 1 17 ? -3.624  -3.365  -3.714  1.00 0.00 ? 17 ASP A CG   6 
ATOM 2854 O OD1  . ASP A 1 17 ? -4.634  -3.570  -3.061  1.00 0.00 ? 17 ASP A OD1  6 
ATOM 2855 O OD2  . ASP A 1 17 ? -3.621  -3.144  -4.914  1.00 0.00 ? 17 ASP A OD2  6 
ATOM 2856 H H    . ASP A 1 17 ? -0.372  -3.153  -1.241  1.00 0.00 ? 17 ASP A H    6 
ATOM 2857 H HA   . ASP A 1 17 ? -3.256  -2.522  -1.265  1.00 0.00 ? 17 ASP A HA   6 
ATOM 2858 H HB2  . ASP A 1 17 ? -1.675  -2.556  -3.317  1.00 0.00 ? 17 ASP A HB2  6 
ATOM 2859 H HB3  . ASP A 1 17 ? -1.769  -4.310  -3.204  1.00 0.00 ? 17 ASP A HB3  6 
ATOM 2860 N N    . ASP A 1 18 ? -2.070  -5.597  -0.951  1.00 0.00 ? 18 ASP A N    6 
ATOM 2861 C CA   . ASP A 1 18 ? -2.427  -6.953  -0.445  1.00 0.00 ? 18 ASP A CA   6 
ATOM 2862 C C    . ASP A 1 18 ? -2.802  -6.864  1.035   1.00 0.00 ? 18 ASP A C    6 
ATOM 2863 O O    . ASP A 1 18 ? -3.647  -7.593  1.514   1.00 0.00 ? 18 ASP A O    6 
ATOM 2864 C CB   . ASP A 1 18 ? -1.228  -7.889  -0.612  1.00 0.00 ? 18 ASP A CB   6 
ATOM 2865 C CG   . ASP A 1 18 ? -1.333  -8.613  -1.956  1.00 0.00 ? 18 ASP A CG   6 
ATOM 2866 O OD1  . ASP A 1 18 ? -1.690  -7.967  -2.927  1.00 0.00 ? 18 ASP A OD1  6 
ATOM 2867 O OD2  . ASP A 1 18 ? -1.056  -9.801  -1.991  1.00 0.00 ? 18 ASP A OD2  6 
ATOM 2868 H H    . ASP A 1 18 ? -1.169  -5.426  -1.297  1.00 0.00 ? 18 ASP A H    6 
ATOM 2869 H HA   . ASP A 1 18 ? -3.266  -7.339  -1.006  1.00 0.00 ? 18 ASP A HA   6 
ATOM 2870 H HB2  . ASP A 1 18 ? -0.315  -7.314  -0.582  1.00 0.00 ? 18 ASP A HB2  6 
ATOM 2871 H HB3  . ASP A 1 18 ? -1.223  -8.616  0.187   1.00 0.00 ? 18 ASP A HB3  6 
ATOM 2872 N N    . CYS A 1 19 ? -2.180  -5.978  1.762   1.00 0.00 ? 19 CYS A N    6 
ATOM 2873 C CA   . CYS A 1 19 ? -2.506  -5.845  3.208   1.00 0.00 ? 19 CYS A CA   6 
ATOM 2874 C C    . CYS A 1 19 ? -4.007  -5.592  3.345   1.00 0.00 ? 19 CYS A C    6 
ATOM 2875 O O    . CYS A 1 19 ? -4.642  -6.017  4.290   1.00 0.00 ? 19 CYS A O    6 
ATOM 2876 C CB   . CYS A 1 19 ? -1.736  -4.657  3.786   1.00 0.00 ? 19 CYS A CB   6 
ATOM 2877 S SG   . CYS A 1 19 ? -1.329  -4.978  5.521   1.00 0.00 ? 19 CYS A SG   6 
ATOM 2878 H H    . CYS A 1 19 ? -1.501  -5.400  1.356   1.00 0.00 ? 19 CYS A H    6 
ATOM 2879 H HA   . CYS A 1 19 ? -2.235  -6.749  3.732   1.00 0.00 ? 19 CYS A HA   6 
ATOM 2880 H HB2  . CYS A 1 19 ? -0.829  -4.515  3.224   1.00 0.00 ? 19 CYS A HB2  6 
ATOM 2881 H HB3  . CYS A 1 19 ? -2.343  -3.768  3.717   1.00 0.00 ? 19 CYS A HB3  6 
ATOM 2882 N N    . CYS A 1 20 ? -4.571  -4.901  2.396   1.00 0.00 ? 20 CYS A N    6 
ATOM 2883 C CA   . CYS A 1 20 ? -6.030  -4.604  2.437   1.00 0.00 ? 20 CYS A CA   6 
ATOM 2884 C C    . CYS A 1 20 ? -6.821  -5.873  2.111   1.00 0.00 ? 20 CYS A C    6 
ATOM 2885 O O    . CYS A 1 20 ? -7.921  -6.068  2.587   1.00 0.00 ? 20 CYS A O    6 
ATOM 2886 C CB   . CYS A 1 20 ? -6.347  -3.526  1.399   1.00 0.00 ? 20 CYS A CB   6 
ATOM 2887 S SG   . CYS A 1 20 ? -5.458  -2.011  1.828   1.00 0.00 ? 20 CYS A SG   6 
ATOM 2888 H H    . CYS A 1 20 ? -4.027  -4.573  1.647   1.00 0.00 ? 20 CYS A H    6 
ATOM 2889 H HA   . CYS A 1 20 ? -6.301  -4.250  3.420   1.00 0.00 ? 20 CYS A HA   6 
ATOM 2890 H HB2  . CYS A 1 20 ? -6.036  -3.863  0.422   1.00 0.00 ? 20 CYS A HB2  6 
ATOM 2891 H HB3  . CYS A 1 20 ? -7.409  -3.330  1.391   1.00 0.00 ? 20 CYS A HB3  6 
ATOM 2892 N N    . GLY A 1 21 ? -6.268  -6.735  1.304   1.00 0.00 ? 21 GLY A N    6 
ATOM 2893 C CA   . GLY A 1 21 ? -6.987  -7.990  0.945   1.00 0.00 ? 21 GLY A CA   6 
ATOM 2894 C C    . GLY A 1 21 ? -6.408  -8.552  -0.354  1.00 0.00 ? 21 GLY A C    6 
ATOM 2895 O O    . GLY A 1 21 ? -6.190  -9.740  -0.484  1.00 0.00 ? 21 GLY A O    6 
ATOM 2896 H H    . GLY A 1 21 ? -5.380  -6.557  0.931   1.00 0.00 ? 21 GLY A H    6 
ATOM 2897 H HA2  . GLY A 1 21 ? -6.866  -8.713  1.740   1.00 0.00 ? 21 GLY A HA2  6 
ATOM 2898 H HA3  . GLY A 1 21 ? -8.036  -7.779  0.806   1.00 0.00 ? 21 GLY A HA3  6 
ATOM 2899 N N    . GLY A 1 22 ? -6.153  -7.706  -1.316  1.00 0.00 ? 22 GLY A N    6 
ATOM 2900 C CA   . GLY A 1 22 ? -5.586  -8.188  -2.604  1.00 0.00 ? 22 GLY A CA   6 
ATOM 2901 C C    . GLY A 1 22 ? -5.467  -7.018  -3.584  1.00 0.00 ? 22 GLY A C    6 
ATOM 2902 O O    . GLY A 1 22 ? -6.076  -5.982  -3.407  1.00 0.00 ? 22 GLY A O    6 
ATOM 2903 H H    . GLY A 1 22 ? -6.335  -6.755  -1.190  1.00 0.00 ? 22 GLY A H    6 
ATOM 2904 H HA2  . GLY A 1 22 ? -4.609  -8.613  -2.426  1.00 0.00 ? 22 GLY A HA2  6 
ATOM 2905 H HA3  . GLY A 1 22 ? -6.234  -8.939  -3.023  1.00 0.00 ? 22 GLY A HA3  6 
ATOM 2906 N N    . LYS A 1 23 ? -4.687  -7.176  -4.621  1.00 0.00 ? 23 LYS A N    6 
ATOM 2907 C CA   . LYS A 1 23 ? -4.530  -6.071  -5.611  1.00 0.00 ? 23 LYS A CA   6 
ATOM 2908 C C    . LYS A 1 23 ? -5.912  -5.615  -6.086  1.00 0.00 ? 23 LYS A C    6 
ATOM 2909 O O    . LYS A 1 23 ? -6.605  -6.327  -6.787  1.00 0.00 ? 23 LYS A O    6 
ATOM 2910 C CB   . LYS A 1 23 ? -3.711  -6.565  -6.808  1.00 0.00 ? 23 LYS A CB   6 
ATOM 2911 C CG   . LYS A 1 23 ? -4.330  -7.849  -7.366  1.00 0.00 ? 23 LYS A CG   6 
ATOM 2912 C CD   . LYS A 1 23 ? -3.341  -8.516  -8.324  1.00 0.00 ? 23 LYS A CD   6 
ATOM 2913 C CE   . LYS A 1 23 ? -3.722  -8.182  -9.769  1.00 0.00 ? 23 LYS A CE   6 
ATOM 2914 N NZ   . LYS A 1 23 ? -3.654  -9.418  -10.600 1.00 0.00 ? 23 LYS A NZ   6 
ATOM 2915 H H    . LYS A 1 23 ? -4.204  -8.018  -4.747  1.00 0.00 ? 23 LYS A H    6 
ATOM 2916 H HA   . LYS A 1 23 ? -4.020  -5.242  -5.145  1.00 0.00 ? 23 LYS A HA   6 
ATOM 2917 H HB2  . LYS A 1 23 ? -3.703  -5.805  -7.576  1.00 0.00 ? 23 LYS A HB2  6 
ATOM 2918 H HB3  . LYS A 1 23 ? -2.699  -6.765  -6.491  1.00 0.00 ? 23 LYS A HB3  6 
ATOM 2919 H HG2  . LYS A 1 23 ? -4.555  -8.523  -6.552  1.00 0.00 ? 23 LYS A HG2  6 
ATOM 2920 H HG3  . LYS A 1 23 ? -5.238  -7.610  -7.898  1.00 0.00 ? 23 LYS A HG3  6 
ATOM 2921 H HD2  . LYS A 1 23 ? -2.344  -8.152  -8.122  1.00 0.00 ? 23 LYS A HD2  6 
ATOM 2922 H HD3  . LYS A 1 23 ? -3.369  -9.586  -8.184  1.00 0.00 ? 23 LYS A HD3  6 
ATOM 2923 H HE2  . LYS A 1 23 ? -4.726  -7.787  -9.793  1.00 0.00 ? 23 LYS A HE2  6 
ATOM 2924 H HE3  . LYS A 1 23 ? -3.035  -7.446  -10.161 1.00 0.00 ? 23 LYS A HE3  6 
ATOM 2925 H HZ1  . LYS A 1 23 ? -4.183  -10.181 -10.133 1.00 0.00 ? 23 LYS A HZ1  6 
ATOM 2926 H HZ2  . LYS A 1 23 ? -4.070  -9.229  -11.536 1.00 0.00 ? 23 LYS A HZ2  6 
ATOM 2927 H HZ3  . LYS A 1 23 ? -2.662  -9.707  -10.714 1.00 0.00 ? 23 LYS A HZ3  6 
ATOM 2928 N N    . GLY A 1 24 ? -6.320  -4.434  -5.709  1.00 0.00 ? 24 GLY A N    6 
ATOM 2929 C CA   . GLY A 1 24 ? -7.657  -3.936  -6.138  1.00 0.00 ? 24 GLY A CA   6 
ATOM 2930 C C    . GLY A 1 24 ? -8.339  -3.220  -4.971  1.00 0.00 ? 24 GLY A C    6 
ATOM 2931 O O    . GLY A 1 24 ? -9.376  -2.610  -5.131  1.00 0.00 ? 24 GLY A O    6 
ATOM 2932 H H    . GLY A 1 24 ? -5.748  -3.874  -5.142  1.00 0.00 ? 24 GLY A H    6 
ATOM 2933 H HA2  . GLY A 1 24 ? -7.538  -3.249  -6.963  1.00 0.00 ? 24 GLY A HA2  6 
ATOM 2934 H HA3  . GLY A 1 24 ? -8.269  -4.770  -6.448  1.00 0.00 ? 24 GLY A HA3  6 
ATOM 2935 N N    . ARG A 1 25 ? -7.769  -3.289  -3.799  1.00 0.00 ? 25 ARG A N    6 
ATOM 2936 C CA   . ARG A 1 25 ? -8.402  -2.610  -2.631  1.00 0.00 ? 25 ARG A CA   6 
ATOM 2937 C C    . ARG A 1 25 ? -7.323  -2.103  -1.671  1.00 0.00 ? 25 ARG A C    6 
ATOM 2938 O O    . ARG A 1 25 ? -7.470  -2.178  -0.468  1.00 0.00 ? 25 ARG A O    6 
ATOM 2939 C CB   . ARG A 1 25 ? -9.325  -3.586  -1.885  1.00 0.00 ? 25 ARG A CB   6 
ATOM 2940 C CG   . ARG A 1 25 ? -9.047  -5.030  -2.321  1.00 0.00 ? 25 ARG A CG   6 
ATOM 2941 C CD   . ARG A 1 25 ? -9.313  -5.979  -1.150  1.00 0.00 ? 25 ARG A CD   6 
ATOM 2942 N NE   . ARG A 1 25 ? -10.631 -6.645  -1.341  1.00 0.00 ? 25 ARG A NE   6 
ATOM 2943 C CZ   . ARG A 1 25 ? -10.826 -7.852  -0.882  1.00 0.00 ? 25 ARG A CZ   6 
ATOM 2944 N NH1  . ARG A 1 25 ? -10.301 -8.877  -1.498  1.00 0.00 ? 25 ARG A NH1  6 
ATOM 2945 N NH2  . ARG A 1 25 ? -11.547 -8.035  0.189   1.00 0.00 ? 25 ARG A NH2  6 
ATOM 2946 H H    . ARG A 1 25 ? -6.934  -3.788  -3.685  1.00 0.00 ? 25 ARG A H    6 
ATOM 2947 H HA   . ARG A 1 25 ? -8.980  -1.772  -2.984  1.00 0.00 ? 25 ARG A HA   6 
ATOM 2948 H HB2  . ARG A 1 25 ? -9.154  -3.495  -0.821  1.00 0.00 ? 25 ARG A HB2  6 
ATOM 2949 H HB3  . ARG A 1 25 ? -10.354 -3.341  -2.101  1.00 0.00 ? 25 ARG A HB3  6 
ATOM 2950 H HG2  . ARG A 1 25 ? -9.695  -5.288  -3.147  1.00 0.00 ? 25 ARG A HG2  6 
ATOM 2951 H HG3  . ARG A 1 25 ? -8.018  -5.123  -2.629  1.00 0.00 ? 25 ARG A HG3  6 
ATOM 2952 H HD2  . ARG A 1 25 ? -8.535  -6.727  -1.109  1.00 0.00 ? 25 ARG A HD2  6 
ATOM 2953 H HD3  . ARG A 1 25 ? -9.322  -5.418  -0.226  1.00 0.00 ? 25 ARG A HD3  6 
ATOM 2954 H HE   . ARG A 1 25 ? -11.353 -6.178  -1.810  1.00 0.00 ? 25 ARG A HE   6 
ATOM 2955 H HH11 . ARG A 1 25 ? -9.751  -8.738  -2.320  1.00 0.00 ? 25 ARG A HH11 6 
ATOM 2956 H HH12 . ARG A 1 25 ? -10.451 -9.800  -1.146  1.00 0.00 ? 25 ARG A HH12 6 
ATOM 2957 H HH21 . ARG A 1 25 ? -11.950 -7.251  0.660   1.00 0.00 ? 25 ARG A HH21 6 
ATOM 2958 H HH22 . ARG A 1 25 ? -11.694 -8.959  0.540   1.00 0.00 ? 25 ARG A HH22 6 
ATOM 2959 N N    . GLY A 1 26 ? -6.247  -1.578  -2.187  1.00 0.00 ? 26 GLY A N    6 
ATOM 2960 C CA   . GLY A 1 26 ? -5.173  -1.064  -1.292  1.00 0.00 ? 26 GLY A CA   6 
ATOM 2961 C C    . GLY A 1 26 ? -4.069  -0.387  -2.107  1.00 0.00 ? 26 GLY A C    6 
ATOM 2962 O O    . GLY A 1 26 ? -3.644  -0.875  -3.134  1.00 0.00 ? 26 GLY A O    6 
ATOM 2963 H H    . GLY A 1 26 ? -6.149  -1.519  -3.155  1.00 0.00 ? 26 GLY A H    6 
ATOM 2964 H HA2  . GLY A 1 26 ? -5.589  -0.349  -0.623  1.00 0.00 ? 26 GLY A HA2  6 
ATOM 2965 H HA3  . GLY A 1 26 ? -4.763  -1.874  -0.723  1.00 0.00 ? 26 GLY A HA3  6 
ATOM 2966 N N    . LYS A 1 27 ? -3.609  0.746   -1.647  1.00 0.00 ? 27 LYS A N    6 
ATOM 2967 C CA   . LYS A 1 27 ? -2.535  1.481   -2.377  1.00 0.00 ? 27 LYS A CA   6 
ATOM 2968 C C    . LYS A 1 27 ? -1.921  2.527   -1.442  1.00 0.00 ? 27 LYS A C    6 
ATOM 2969 O O    . LYS A 1 27 ? -2.313  2.654   -0.300  1.00 0.00 ? 27 LYS A O    6 
ATOM 2970 C CB   . LYS A 1 27 ? -3.138  2.178   -3.599  1.00 0.00 ? 27 LYS A CB   6 
ATOM 2971 C CG   . LYS A 1 27 ? -2.318  1.834   -4.844  1.00 0.00 ? 27 LYS A CG   6 
ATOM 2972 C CD   . LYS A 1 27 ? -3.218  1.144   -5.872  1.00 0.00 ? 27 LYS A CD   6 
ATOM 2973 C CE   . LYS A 1 27 ? -2.472  -0.039  -6.494  1.00 0.00 ? 27 LYS A CE   6 
ATOM 2974 N NZ   . LYS A 1 27 ? -2.986  -0.280  -7.872  1.00 0.00 ? 27 LYS A NZ   6 
ATOM 2975 H H    . LYS A 1 27 ? -3.974  1.119   -0.817  1.00 0.00 ? 27 LYS A H    6 
ATOM 2976 H HA   . LYS A 1 27 ? -1.774  0.786   -2.695  1.00 0.00 ? 27 LYS A HA   6 
ATOM 2977 H HB2  . LYS A 1 27 ? -4.157  1.846   -3.735  1.00 0.00 ? 27 LYS A HB2  6 
ATOM 2978 H HB3  . LYS A 1 27 ? -3.124  3.247   -3.446  1.00 0.00 ? 27 LYS A HB3  6 
ATOM 2979 H HG2  . LYS A 1 27 ? -1.912  2.740   -5.270  1.00 0.00 ? 27 LYS A HG2  6 
ATOM 2980 H HG3  . LYS A 1 27 ? -1.512  1.171   -4.572  1.00 0.00 ? 27 LYS A HG3  6 
ATOM 2981 H HD2  . LYS A 1 27 ? -4.115  0.790   -5.386  1.00 0.00 ? 27 LYS A HD2  6 
ATOM 2982 H HD3  . LYS A 1 27 ? -3.482  1.846   -6.648  1.00 0.00 ? 27 LYS A HD3  6 
ATOM 2983 H HE2  . LYS A 1 27 ? -1.416  0.182   -6.536  1.00 0.00 ? 27 LYS A HE2  6 
ATOM 2984 H HE3  . LYS A 1 27 ? -2.632  -0.920  -5.892  1.00 0.00 ? 27 LYS A HE3  6 
ATOM 2985 H HZ1  . LYS A 1 27 ? -3.892  0.218   -7.996  1.00 0.00 ? 27 LYS A HZ1  6 
ATOM 2986 H HZ2  . LYS A 1 27 ? -2.297  0.074   -8.566  1.00 0.00 ? 27 LYS A HZ2  6 
ATOM 2987 H HZ3  . LYS A 1 27 ? -3.127  -1.299  -8.017  1.00 0.00 ? 27 LYS A HZ3  6 
ATOM 2988 N N    . CYS A 1 28 ? -0.965  3.281   -1.913  1.00 0.00 ? 28 CYS A N    6 
ATOM 2989 C CA   . CYS A 1 28 ? -0.339  4.317   -1.039  1.00 0.00 ? 28 CYS A CA   6 
ATOM 2990 C C    . CYS A 1 28 ? -1.096  5.645   -1.204  1.00 0.00 ? 28 CYS A C    6 
ATOM 2991 O O    . CYS A 1 28 ? -1.217  6.155   -2.300  1.00 0.00 ? 28 CYS A O    6 
ATOM 2992 C CB   . CYS A 1 28 ? 1.120   4.521   -1.451  1.00 0.00 ? 28 CYS A CB   6 
ATOM 2993 S SG   . CYS A 1 28 ? 2.099   3.082   -0.957  1.00 0.00 ? 28 CYS A SG   6 
ATOM 2994 H H    . CYS A 1 28 ? -0.660  3.171   -2.838  1.00 0.00 ? 28 CYS A H    6 
ATOM 2995 H HA   . CYS A 1 28 ? -0.377  3.984   -0.013  1.00 0.00 ? 28 CYS A HA   6 
ATOM 2996 H HB2  . CYS A 1 28 ? 1.177   4.645   -2.523  1.00 0.00 ? 28 CYS A HB2  6 
ATOM 2997 H HB3  . CYS A 1 28 ? 1.510   5.405   -0.967  1.00 0.00 ? 28 CYS A HB3  6 
ATOM 2998 N N    . TYR A 1 29 ? -1.607  6.221   -0.141  1.00 0.00 ? 29 TYR A N    6 
ATOM 2999 C CA   . TYR A 1 29 ? -2.340  7.510   -0.285  1.00 0.00 ? 29 TYR A CA   6 
ATOM 3000 C C    . TYR A 1 29 ? -2.120  8.359   0.966   1.00 0.00 ? 29 TYR A C    6 
ATOM 3001 O O    . TYR A 1 29 ? -1.836  7.848   2.032   1.00 0.00 ? 29 TYR A O    6 
ATOM 3002 C CB   . TYR A 1 29 ? -3.833  7.230   -0.451  1.00 0.00 ? 29 TYR A CB   6 
ATOM 3003 C CG   . TYR A 1 29 ? -4.144  6.975   -1.907  1.00 0.00 ? 29 TYR A CG   6 
ATOM 3004 C CD1  . TYR A 1 29 ? -4.056  8.020   -2.835  1.00 0.00 ? 29 TYR A CD1  6 
ATOM 3005 C CD2  . TYR A 1 29 ? -4.525  5.694   -2.326  1.00 0.00 ? 29 TYR A CD2  6 
ATOM 3006 C CE1  . TYR A 1 29 ? -4.349  7.783   -4.183  1.00 0.00 ? 29 TYR A CE1  6 
ATOM 3007 C CE2  . TYR A 1 29 ? -4.817  5.459   -3.675  1.00 0.00 ? 29 TYR A CE2  6 
ATOM 3008 C CZ   . TYR A 1 29 ? -4.730  6.502   -4.603  1.00 0.00 ? 29 TYR A CZ   6 
ATOM 3009 O OH   . TYR A 1 29 ? -5.023  6.269   -5.932  1.00 0.00 ? 29 TYR A OH   6 
ATOM 3010 H H    . TYR A 1 29 ? -1.510  5.816   0.745   1.00 0.00 ? 29 TYR A H    6 
ATOM 3011 H HA   . TYR A 1 29 ? -1.973  8.041   -1.151  1.00 0.00 ? 29 TYR A HA   6 
ATOM 3012 H HB2  . TYR A 1 29 ? -4.103  6.361   0.131   1.00 0.00 ? 29 TYR A HB2  6 
ATOM 3013 H HB3  . TYR A 1 29 ? -4.400  8.084   -0.108  1.00 0.00 ? 29 TYR A HB3  6 
ATOM 3014 H HD1  . TYR A 1 29 ? -3.762  9.007   -2.511  1.00 0.00 ? 29 TYR A HD1  6 
ATOM 3015 H HD2  . TYR A 1 29 ? -4.591  4.888   -1.610  1.00 0.00 ? 29 TYR A HD2  6 
ATOM 3016 H HE1  . TYR A 1 29 ? -4.282  8.588   -4.900  1.00 0.00 ? 29 TYR A HE1  6 
ATOM 3017 H HE2  . TYR A 1 29 ? -5.111  4.472   -3.999  1.00 0.00 ? 29 TYR A HE2  6 
ATOM 3018 H HH   . TYR A 1 29 ? -4.220  5.974   -6.366  1.00 0.00 ? 29 TYR A HH   6 
ATOM 3019 N N    . GLY A 1 30 ? -2.248  9.651   0.852   1.00 0.00 ? 30 GLY A N    6 
ATOM 3020 C CA   . GLY A 1 30 ? -2.044  10.519  2.041   1.00 0.00 ? 30 GLY A CA   6 
ATOM 3021 C C    . GLY A 1 30 ? -0.685  10.204  2.668   1.00 0.00 ? 30 GLY A C    6 
ATOM 3022 O O    . GLY A 1 30 ? 0.309   10.102  1.976   1.00 0.00 ? 30 GLY A O    6 
ATOM 3023 H H    . GLY A 1 30 ? -2.478  10.048  -0.013  1.00 0.00 ? 30 GLY A H    6 
ATOM 3024 H HA2  . GLY A 1 30 ? -2.072  11.557  1.740   1.00 0.00 ? 30 GLY A HA2  6 
ATOM 3025 H HA3  . GLY A 1 30 ? -2.822  10.332  2.764   1.00 0.00 ? 30 GLY A HA3  6 
ATOM 3026 N N    . PRO A 1 31 ? -0.688  10.057  3.965   1.00 0.00 ? 31 PRO A N    6 
ATOM 3027 C CA   . PRO A 1 31 ? 0.585   9.749   4.652   1.00 0.00 ? 31 PRO A CA   6 
ATOM 3028 C C    . PRO A 1 31 ? 0.546   8.340   5.253   1.00 0.00 ? 31 PRO A C    6 
ATOM 3029 O O    . PRO A 1 31 ? 1.051   8.105   6.334   1.00 0.00 ? 31 PRO A O    6 
ATOM 3030 C CB   . PRO A 1 31 ? 0.690   10.802  5.755   1.00 0.00 ? 31 PRO A CB   6 
ATOM 3031 C CG   . PRO A 1 31 ? -0.746  11.289  6.022   1.00 0.00 ? 31 PRO A CG   6 
ATOM 3032 C CD   . PRO A 1 31 ? -1.565  10.942  4.769   1.00 0.00 ? 31 PRO A CD   6 
ATOM 3033 H HA   . PRO A 1 31 ? 1.415   9.847   3.971   1.00 0.00 ? 31 PRO A HA   6 
ATOM 3034 H HB2  . PRO A 1 31 ? 1.110   10.361  6.649   1.00 0.00 ? 31 PRO A HB2  6 
ATOM 3035 H HB3  . PRO A 1 31 ? 1.300   11.628  5.424   1.00 0.00 ? 31 PRO A HB3  6 
ATOM 3036 H HG2  . PRO A 1 31 ? -1.153  10.783  6.888   1.00 0.00 ? 31 PRO A HG2  6 
ATOM 3037 H HG3  . PRO A 1 31 ? -0.754  12.357  6.177   1.00 0.00 ? 31 PRO A HG3  6 
ATOM 3038 H HD2  . PRO A 1 31 ? -2.473  10.424  5.046   1.00 0.00 ? 31 PRO A HD2  6 
ATOM 3039 H HD3  . PRO A 1 31 ? -1.798  11.836  4.212   1.00 0.00 ? 31 PRO A HD3  6 
ATOM 3040 N N    . GLN A 1 32 ? -0.046  7.401   4.565   1.00 0.00 ? 32 GLN A N    6 
ATOM 3041 C CA   . GLN A 1 32 ? -0.107  6.013   5.107   1.00 0.00 ? 32 GLN A CA   6 
ATOM 3042 C C    . GLN A 1 32 ? -0.698  5.063   4.061   1.00 0.00 ? 32 GLN A C    6 
ATOM 3043 O O    . GLN A 1 32 ? -1.100  5.472   2.989   1.00 0.00 ? 32 GLN A O    6 
ATOM 3044 C CB   . GLN A 1 32 ? -0.982  5.993   6.362   1.00 0.00 ? 32 GLN A CB   6 
ATOM 3045 C CG   . GLN A 1 32 ? -0.253  5.243   7.477   1.00 0.00 ? 32 GLN A CG   6 
ATOM 3046 C CD   . GLN A 1 32 ? 0.297   6.244   8.494   1.00 0.00 ? 32 GLN A CD   6 
ATOM 3047 O OE1  . GLN A 1 32 ? -0.446  6.799   9.280   1.00 0.00 ? 32 GLN A OE1  6 
ATOM 3048 N NE2  . GLN A 1 32 ? 1.575   6.501   8.513   1.00 0.00 ? 32 GLN A NE2  6 
ATOM 3049 H H    . GLN A 1 32 ? -0.447  7.607   3.695   1.00 0.00 ? 32 GLN A H    6 
ATOM 3050 H HA   . GLN A 1 32 ? 0.890   5.686   5.364   1.00 0.00 ? 32 GLN A HA   6 
ATOM 3051 H HB2  . GLN A 1 32 ? -1.181  7.008   6.678   1.00 0.00 ? 32 GLN A HB2  6 
ATOM 3052 H HB3  . GLN A 1 32 ? -1.913  5.495   6.143   1.00 0.00 ? 32 GLN A HB3  6 
ATOM 3053 H HG2  . GLN A 1 32 ? -0.941  4.571   7.968   1.00 0.00 ? 32 GLN A HG2  6 
ATOM 3054 H HG3  . GLN A 1 32 ? 0.564   4.677   7.055   1.00 0.00 ? 32 GLN A HG3  6 
ATOM 3055 H HE21 . GLN A 1 32 ? 2.175   6.053   7.879   1.00 0.00 ? 32 GLN A HE21 6 
ATOM 3056 H HE22 . GLN A 1 32 ? 1.937   7.143   9.159   1.00 0.00 ? 32 GLN A HE22 6 
ATOM 3057 N N    . CYS A 1 33 ? -0.749  3.795   4.370   1.00 0.00 ? 33 CYS A N    6 
ATOM 3058 C CA   . CYS A 1 33 ? -1.307  2.803   3.406   1.00 0.00 ? 33 CYS A CA   6 
ATOM 3059 C C    . CYS A 1 33 ? -2.835  2.792   3.513   1.00 0.00 ? 33 CYS A C    6 
ATOM 3060 O O    . CYS A 1 33 ? -3.388  2.587   4.574   1.00 0.00 ? 33 CYS A O    6 
ATOM 3061 C CB   . CYS A 1 33 ? -0.761  1.415   3.750   1.00 0.00 ? 33 CYS A CB   6 
ATOM 3062 S SG   . CYS A 1 33 ? -1.529  0.169   2.685   1.00 0.00 ? 33 CYS A SG   6 
ATOM 3063 H H    . CYS A 1 33 ? -0.417  3.494   5.240   1.00 0.00 ? 33 CYS A H    6 
ATOM 3064 H HA   . CYS A 1 33 ? -1.016  3.068   2.401   1.00 0.00 ? 33 CYS A HA   6 
ATOM 3065 H HB2  . CYS A 1 33 ? 0.309   1.405   3.601   1.00 0.00 ? 33 CYS A HB2  6 
ATOM 3066 H HB3  . CYS A 1 33 ? -0.980  1.189   4.783   1.00 0.00 ? 33 CYS A HB3  6 
ATOM 3067 N N    . LEU A 1 34 ? -3.523  3.015   2.424   1.00 0.00 ? 34 LEU A N    6 
ATOM 3068 C CA   . LEU A 1 34 ? -5.014  3.021   2.477   1.00 0.00 ? 34 LEU A CA   6 
ATOM 3069 C C    . LEU A 1 34 ? -5.563  1.719   1.882   1.00 0.00 ? 34 LEU A C    6 
ATOM 3070 O O    . LEU A 1 34 ? -4.824  0.824   1.523   1.00 0.00 ? 34 LEU A O    6 
ATOM 3071 C CB   . LEU A 1 34 ? -5.553  4.216   1.682   1.00 0.00 ? 34 LEU A CB   6 
ATOM 3072 C CG   . LEU A 1 34 ? -5.140  5.528   2.362   1.00 0.00 ? 34 LEU A CG   6 
ATOM 3073 C CD1  . LEU A 1 34 ? -6.027  6.668   1.855   1.00 0.00 ? 34 LEU A CD1  6 
ATOM 3074 C CD2  . LEU A 1 34 ? -5.304  5.404   3.880   1.00 0.00 ? 34 LEU A CD2  6 
ATOM 3075 H H    . LEU A 1 34 ? -3.061  3.182   1.577   1.00 0.00 ? 34 LEU A H    6 
ATOM 3076 H HA   . LEU A 1 34 ? -5.333  3.102   3.506   1.00 0.00 ? 34 LEU A HA   6 
ATOM 3077 H HB2  . LEU A 1 34 ? -5.151  4.189   0.680   1.00 0.00 ? 34 LEU A HB2  6 
ATOM 3078 H HB3  . LEU A 1 34 ? -6.631  4.161   1.637   1.00 0.00 ? 34 LEU A HB3  6 
ATOM 3079 H HG   . LEU A 1 34 ? -4.109  5.743   2.126   1.00 0.00 ? 34 LEU A HG   6 
ATOM 3080 H HD11 . LEU A 1 34 ? -7.061  6.359   1.877   1.00 0.00 ? 34 LEU A HD11 6 
ATOM 3081 H HD12 . LEU A 1 34 ? -5.897  7.533   2.489   1.00 0.00 ? 34 LEU A HD12 6 
ATOM 3082 H HD13 . LEU A 1 34 ? -5.748  6.920   0.844   1.00 0.00 ? 34 LEU A HD13 6 
ATOM 3083 H HD21 . LEU A 1 34 ? -6.268  4.971   4.104   1.00 0.00 ? 34 LEU A HD21 6 
ATOM 3084 H HD22 . LEU A 1 34 ? -4.524  4.771   4.275   1.00 0.00 ? 34 LEU A HD22 6 
ATOM 3085 H HD23 . LEU A 1 34 ? -5.237  6.383   4.330   1.00 0.00 ? 34 LEU A HD23 6 
ATOM 3086 N N    . CYS A 1 35 ? -6.862  1.611   1.783   1.00 0.00 ? 35 CYS A N    6 
ATOM 3087 C CA   . CYS A 1 35 ? -7.480  0.373   1.224   1.00 0.00 ? 35 CYS A CA   6 
ATOM 3088 C C    . CYS A 1 35 ? -8.643  0.758   0.304   1.00 0.00 ? 35 CYS A C    6 
ATOM 3089 O O    . CYS A 1 35 ? -8.758  1.890   -0.124  1.00 0.00 ? 35 CYS A O    6 
ATOM 3090 C CB   . CYS A 1 35 ? -7.998  -0.487  2.377   1.00 0.00 ? 35 CYS A CB   6 
ATOM 3091 S SG   . CYS A 1 35 ? -6.589  -1.177  3.277   1.00 0.00 ? 35 CYS A SG   6 
ATOM 3092 H H    . CYS A 1 35 ? -7.436  2.347   2.085   1.00 0.00 ? 35 CYS A H    6 
ATOM 3093 H HA   . CYS A 1 35 ? -6.741  -0.184  0.664   1.00 0.00 ? 35 CYS A HA   6 
ATOM 3094 H HB2  . CYS A 1 35 ? -8.589  0.122   3.045   1.00 0.00 ? 35 CYS A HB2  6 
ATOM 3095 H HB3  . CYS A 1 35 ? -8.604  -1.290  1.988   1.00 0.00 ? 35 CYS A HB3  6 
ATOM 3096 N N    . ARG A 1 36 ? -9.508  -0.170  -0.002  1.00 0.00 ? 36 ARG A N    6 
ATOM 3097 C CA   . ARG A 1 36 ? -10.662 0.146   -0.887  1.00 0.00 ? 36 ARG A CA   6 
ATOM 3098 C C    . ARG A 1 36 ? -11.604 -1.060  -0.943  1.00 0.00 ? 36 ARG A C    6 
ATOM 3099 O O    . ARG A 1 36 ? -11.341 -2.025  -0.244  1.00 0.00 ? 36 ARG A O    6 
ATOM 3100 C CB   . ARG A 1 36 ? -10.158 0.466   -2.296  1.00 0.00 ? 36 ARG A CB   6 
ATOM 3101 C CG   . ARG A 1 36 ? -11.002 1.591   -2.899  1.00 0.00 ? 36 ARG A CG   6 
ATOM 3102 C CD   . ARG A 1 36 ? -10.669 2.912   -2.204  1.00 0.00 ? 36 ARG A CD   6 
ATOM 3103 N NE   . ARG A 1 36 ? -11.353 4.032   -2.910  1.00 0.00 ? 36 ARG A NE   6 
ATOM 3104 C CZ   . ARG A 1 36 ? -10.951 5.261   -2.727  1.00 0.00 ? 36 ARG A CZ   6 
ATOM 3105 N NH1  . ARG A 1 36 ? -10.633 5.670   -1.528  1.00 0.00 ? 36 ARG A NH1  6 
ATOM 3106 N NH2  . ARG A 1 36 ? -10.866 6.078   -3.741  1.00 0.00 ? 36 ARG A NH2  6 
ATOM 3107 O OXT  . ARG A 1 36 ? -12.573 -0.997  -1.681  1.00 0.00 ? 36 ARG A OXT  6 
ATOM 3108 H H    . ARG A 1 36 ? -9.402  -1.074  0.352   1.00 0.00 ? 36 ARG A H    6 
ATOM 3109 H HA   . ARG A 1 36 ? -11.192 0.996   -0.491  1.00 0.00 ? 36 ARG A HA   6 
ATOM 3110 H HB2  . ARG A 1 36 ? -9.124  0.778   -2.246  1.00 0.00 ? 36 ARG A HB2  6 
ATOM 3111 H HB3  . ARG A 1 36 ? -10.241 -0.412  -2.916  1.00 0.00 ? 36 ARG A HB3  6 
ATOM 3112 H HG2  . ARG A 1 36 ? -10.787 1.676   -3.955  1.00 0.00 ? 36 ARG A HG2  6 
ATOM 3113 H HG3  . ARG A 1 36 ? -12.050 1.369   -2.763  1.00 0.00 ? 36 ARG A HG3  6 
ATOM 3114 H HD2  . ARG A 1 36 ? -11.006 2.874   -1.178  1.00 0.00 ? 36 ARG A HD2  6 
ATOM 3115 H HD3  . ARG A 1 36 ? -9.601  3.071   -2.227  1.00 0.00 ? 36 ARG A HD3  6 
ATOM 3116 H HE   . ARG A 1 36 ? -12.103 3.845   -3.514  1.00 0.00 ? 36 ARG A HE   6 
ATOM 3117 H HH11 . ARG A 1 36 ? -10.697 5.044   -0.753  1.00 0.00 ? 36 ARG A HH11 6 
ATOM 3118 H HH12 . ARG A 1 36 ? -10.324 6.610   -1.387  1.00 0.00 ? 36 ARG A HH12 6 
ATOM 3119 H HH21 . ARG A 1 36 ? -11.106 5.762   -4.659  1.00 0.00 ? 36 ARG A HH21 6 
ATOM 3120 H HH22 . ARG A 1 36 ? -10.559 7.019   -3.599  1.00 0.00 ? 36 ARG A HH22 6 
ATOM 3121 N N    . MET A 1 1  ? -4.879  0.811   8.601   1.00 0.00 ? 1  MET A N    7 
ATOM 3122 C CA   . MET A 1 1  ? -3.715  1.128   7.725   1.00 0.00 ? 1  MET A CA   7 
ATOM 3123 C C    . MET A 1 1  ? -2.679  0.005   7.829   1.00 0.00 ? 1  MET A C    7 
ATOM 3124 O O    . MET A 1 1  ? -2.619  -0.708  8.811   1.00 0.00 ? 1  MET A O    7 
ATOM 3125 C CB   . MET A 1 1  ? -3.086  2.449   8.171   1.00 0.00 ? 1  MET A CB   7 
ATOM 3126 C CG   . MET A 1 1  ? -2.596  2.324   9.614   1.00 0.00 ? 1  MET A CG   7 
ATOM 3127 S SD   . MET A 1 1  ? -1.123  3.350   9.841   1.00 0.00 ? 1  MET A SD   7 
ATOM 3128 C CE   . MET A 1 1  ? -1.513  3.943   11.506  1.00 0.00 ? 1  MET A CE   7 
ATOM 3129 H H1   . MET A 1 1  ? -5.079  -0.207  8.558   1.00 0.00 ? 1  MET A H1   7 
ATOM 3130 H H2   . MET A 1 1  ? -4.657  1.081   9.581   1.00 0.00 ? 1  MET A H2   7 
ATOM 3131 H H3   . MET A 1 1  ? -5.712  1.341   8.275   1.00 0.00 ? 1  MET A H3   7 
ATOM 3132 H HA   . MET A 1 1  ? -4.050  1.214   6.702   1.00 0.00 ? 1  MET A HA   7 
ATOM 3133 H HB2  . MET A 1 1  ? -2.253  2.687   7.526   1.00 0.00 ? 1  MET A HB2  7 
ATOM 3134 H HB3  . MET A 1 1  ? -3.823  3.237   8.111   1.00 0.00 ? 1  MET A HB3  7 
ATOM 3135 H HG2  . MET A 1 1  ? -3.373  2.654   10.288  1.00 0.00 ? 1  MET A HG2  7 
ATOM 3136 H HG3  . MET A 1 1  ? -2.352  1.292   9.823   1.00 0.00 ? 1  MET A HG3  7 
ATOM 3137 H HE1  . MET A 1 1  ? -2.200  3.261   11.981  1.00 0.00 ? 1  MET A HE1  7 
ATOM 3138 H HE2  . MET A 1 1  ? -0.604  4.000   12.089  1.00 0.00 ? 1  MET A HE2  7 
ATOM 3139 H HE3  . MET A 1 1  ? -1.968  4.921   11.441  1.00 0.00 ? 1  MET A HE3  7 
ATOM 3140 N N    . CYS A 1 2  ? -1.864  -0.156  6.823   1.00 0.00 ? 2  CYS A N    7 
ATOM 3141 C CA   . CYS A 1 2  ? -0.834  -1.233  6.863   1.00 0.00 ? 2  CYS A CA   7 
ATOM 3142 C C    . CYS A 1 2  ? 0.539   -0.614  7.136   1.00 0.00 ? 2  CYS A C    7 
ATOM 3143 O O    . CYS A 1 2  ? 1.141   -0.844  8.166   1.00 0.00 ? 2  CYS A O    7 
ATOM 3144 C CB   . CYS A 1 2  ? -0.811  -1.960  5.516   1.00 0.00 ? 2  CYS A CB   7 
ATOM 3145 S SG   . CYS A 1 2  ? 0.174   -3.471  5.656   1.00 0.00 ? 2  CYS A SG   7 
ATOM 3146 H H    . CYS A 1 2  ? -1.930  0.430   6.040   1.00 0.00 ? 2  CYS A H    7 
ATOM 3147 H HA   . CYS A 1 2  ? -1.076  -1.935  7.647   1.00 0.00 ? 2  CYS A HA   7 
ATOM 3148 H HB2  . CYS A 1 2  ? -1.821  -2.214  5.229   1.00 0.00 ? 2  CYS A HB2  7 
ATOM 3149 H HB3  . CYS A 1 2  ? -0.377  -1.315  4.768   1.00 0.00 ? 2  CYS A HB3  7 
ATOM 3150 N N    . MET A 1 3  ? 1.038   0.168   6.221   1.00 0.00 ? 3  MET A N    7 
ATOM 3151 C CA   . MET A 1 3  ? 2.369   0.804   6.422   1.00 0.00 ? 3  MET A CA   7 
ATOM 3152 C C    . MET A 1 3  ? 2.574   1.887   5.355   1.00 0.00 ? 3  MET A C    7 
ATOM 3153 O O    . MET A 1 3  ? 1.652   2.230   4.640   1.00 0.00 ? 3  MET A O    7 
ATOM 3154 C CB   . MET A 1 3  ? 3.460   -0.269  6.312   1.00 0.00 ? 3  MET A CB   7 
ATOM 3155 C CG   . MET A 1 3  ? 3.752   -0.571  4.840   1.00 0.00 ? 3  MET A CG   7 
ATOM 3156 S SD   . MET A 1 3  ? 3.890   -2.361  4.608   1.00 0.00 ? 3  MET A SD   7 
ATOM 3157 C CE   . MET A 1 3  ? 5.628   -2.388  4.105   1.00 0.00 ? 3  MET A CE   7 
ATOM 3158 H H    . MET A 1 3  ? 0.535   0.338   5.398   1.00 0.00 ? 3  MET A H    7 
ATOM 3159 H HA   . MET A 1 3  ? 2.406   1.255   7.403   1.00 0.00 ? 3  MET A HA   7 
ATOM 3160 H HB2  . MET A 1 3  ? 4.358   0.080   6.795   1.00 0.00 ? 3  MET A HB2  7 
ATOM 3161 H HB3  . MET A 1 3  ? 3.122   -1.172  6.799   1.00 0.00 ? 3  MET A HB3  7 
ATOM 3162 H HG2  . MET A 1 3  ? 2.948   -0.189  4.228   1.00 0.00 ? 3  MET A HG2  7 
ATOM 3163 H HG3  . MET A 1 3  ? 4.679   -0.097  4.553   1.00 0.00 ? 3  MET A HG3  7 
ATOM 3164 H HE1  . MET A 1 3  ? 6.012   -1.378  4.084   1.00 0.00 ? 3  MET A HE1  7 
ATOM 3165 H HE2  . MET A 1 3  ? 6.198   -2.973  4.809   1.00 0.00 ? 3  MET A HE2  7 
ATOM 3166 H HE3  . MET A 1 3  ? 5.710   -2.831  3.122   1.00 0.00 ? 3  MET A HE3  7 
ATOM 3167 N N    . PRO A 1 4  ? 3.777   2.394   5.281   1.00 0.00 ? 4  PRO A N    7 
ATOM 3168 C CA   . PRO A 1 4  ? 4.037   3.444   4.271   1.00 0.00 ? 4  PRO A CA   7 
ATOM 3169 C C    . PRO A 1 4  ? 4.662   2.832   3.014   1.00 0.00 ? 4  PRO A C    7 
ATOM 3170 O O    . PRO A 1 4  ? 4.705   1.629   2.852   1.00 0.00 ? 4  PRO A O    7 
ATOM 3171 C CB   . PRO A 1 4  ? 5.015   4.399   4.953   1.00 0.00 ? 4  PRO A CB   7 
ATOM 3172 C CG   . PRO A 1 4  ? 5.709   3.589   6.062   1.00 0.00 ? 4  PRO A CG   7 
ATOM 3173 C CD   . PRO A 1 4  ? 4.815   2.368   6.340   1.00 0.00 ? 4  PRO A CD   7 
ATOM 3174 H HA   . PRO A 1 4  ? 3.126   3.965   4.026   1.00 0.00 ? 4  PRO A HA   7 
ATOM 3175 H HB2  . PRO A 1 4  ? 5.744   4.756   4.237   1.00 0.00 ? 4  PRO A HB2  7 
ATOM 3176 H HB3  . PRO A 1 4  ? 4.482   5.230   5.389   1.00 0.00 ? 4  PRO A HB3  7 
ATOM 3177 H HG2  . PRO A 1 4  ? 6.687   3.268   5.728   1.00 0.00 ? 4  PRO A HG2  7 
ATOM 3178 H HG3  . PRO A 1 4  ? 5.798   4.184   6.957   1.00 0.00 ? 4  PRO A HG3  7 
ATOM 3179 H HD2  . PRO A 1 4  ? 5.399   1.460   6.274   1.00 0.00 ? 4  PRO A HD2  7 
ATOM 3180 H HD3  . PRO A 1 4  ? 4.355   2.451   7.312   1.00 0.00 ? 4  PRO A HD3  7 
ATOM 3181 N N    . CYS A 1 5  ? 5.145   3.654   2.122   1.00 0.00 ? 5  CYS A N    7 
ATOM 3182 C CA   . CYS A 1 5  ? 5.762   3.128   0.879   1.00 0.00 ? 5  CYS A CA   7 
ATOM 3183 C C    . CYS A 1 5  ? 7.147   3.752   0.690   1.00 0.00 ? 5  CYS A C    7 
ATOM 3184 O O    . CYS A 1 5  ? 7.369   4.519   -0.225  1.00 0.00 ? 5  CYS A O    7 
ATOM 3185 C CB   . CYS A 1 5  ? 4.879   3.479   -0.321  1.00 0.00 ? 5  CYS A CB   7 
ATOM 3186 S SG   . CYS A 1 5  ? 3.457   2.361   -0.383  1.00 0.00 ? 5  CYS A SG   7 
ATOM 3187 H H    . CYS A 1 5  ? 5.101   4.615   2.269   1.00 0.00 ? 5  CYS A H    7 
ATOM 3188 H HA   . CYS A 1 5  ? 5.855   2.062   0.958   1.00 0.00 ? 5  CYS A HA   7 
ATOM 3189 H HB2  . CYS A 1 5  ? 4.532   4.497   -0.225  1.00 0.00 ? 5  CYS A HB2  7 
ATOM 3190 H HB3  . CYS A 1 5  ? 5.453   3.380   -1.230  1.00 0.00 ? 5  CYS A HB3  7 
ATOM 3191 N N    . PHE A 1 6  ? 8.082   3.431   1.543   1.00 0.00 ? 6  PHE A N    7 
ATOM 3192 C CA   . PHE A 1 6  ? 9.447   4.012   1.401   1.00 0.00 ? 6  PHE A CA   7 
ATOM 3193 C C    . PHE A 1 6  ? 10.470  3.107   2.091   1.00 0.00 ? 6  PHE A C    7 
ATOM 3194 O O    . PHE A 1 6  ? 11.134  3.504   3.028   1.00 0.00 ? 6  PHE A O    7 
ATOM 3195 C CB   . PHE A 1 6  ? 9.478   5.401   2.042   1.00 0.00 ? 6  PHE A CB   7 
ATOM 3196 C CG   . PHE A 1 6  ? 8.531   6.315   1.302   1.00 0.00 ? 6  PHE A CG   7 
ATOM 3197 C CD1  . PHE A 1 6  ? 8.905   6.857   0.066   1.00 0.00 ? 6  PHE A CD1  7 
ATOM 3198 C CD2  . PHE A 1 6  ? 7.279   6.617   1.849   1.00 0.00 ? 6  PHE A CD2  7 
ATOM 3199 C CE1  . PHE A 1 6  ? 8.026   7.703   -0.621  1.00 0.00 ? 6  PHE A CE1  7 
ATOM 3200 C CE2  . PHE A 1 6  ? 6.401   7.463   1.162   1.00 0.00 ? 6  PHE A CE2  7 
ATOM 3201 C CZ   . PHE A 1 6  ? 6.774   8.005   -0.073  1.00 0.00 ? 6  PHE A CZ   7 
ATOM 3202 H H    . PHE A 1 6  ? 7.885   2.809   2.276   1.00 0.00 ? 6  PHE A H    7 
ATOM 3203 H HA   . PHE A 1 6  ? 9.693   4.095   0.353   1.00 0.00 ? 6  PHE A HA   7 
ATOM 3204 H HB2  . PHE A 1 6  ? 9.175   5.327   3.076   1.00 0.00 ? 6  PHE A HB2  7 
ATOM 3205 H HB3  . PHE A 1 6  ? 10.480  5.800   1.986   1.00 0.00 ? 6  PHE A HB3  7 
ATOM 3206 H HD1  . PHE A 1 6  ? 9.872   6.623   -0.356  1.00 0.00 ? 6  PHE A HD1  7 
ATOM 3207 H HD2  . PHE A 1 6  ? 6.992   6.199   2.803   1.00 0.00 ? 6  PHE A HD2  7 
ATOM 3208 H HE1  . PHE A 1 6  ? 8.315   8.121   -1.574  1.00 0.00 ? 6  PHE A HE1  7 
ATOM 3209 H HE2  . PHE A 1 6  ? 5.435   7.696   1.586   1.00 0.00 ? 6  PHE A HE2  7 
ATOM 3210 H HZ   . PHE A 1 6  ? 6.096   8.656   -0.604  1.00 0.00 ? 6  PHE A HZ   7 
ATOM 3211 N N    . THR A 1 7  ? 10.605  1.894   1.630   1.00 0.00 ? 7  THR A N    7 
ATOM 3212 C CA   . THR A 1 7  ? 11.589  0.963   2.252   1.00 0.00 ? 7  THR A CA   7 
ATOM 3213 C C    . THR A 1 7  ? 12.274  0.152   1.151   1.00 0.00 ? 7  THR A C    7 
ATOM 3214 O O    . THR A 1 7  ? 13.442  0.330   0.868   1.00 0.00 ? 7  THR A O    7 
ATOM 3215 C CB   . THR A 1 7  ? 10.863  0.014   3.209   1.00 0.00 ? 7  THR A CB   7 
ATOM 3216 O OG1  . THR A 1 7  ? 9.612   0.579   3.574   1.00 0.00 ? 7  THR A OG1  7 
ATOM 3217 C CG2  . THR A 1 7  ? 11.715  -0.200  4.461   1.00 0.00 ? 7  THR A CG2  7 
ATOM 3218 H H    . THR A 1 7  ? 10.062  1.597   0.870   1.00 0.00 ? 7  THR A H    7 
ATOM 3219 H HA   . THR A 1 7  ? 12.329  1.531   2.796   1.00 0.00 ? 7  THR A HA   7 
ATOM 3220 H HB   . THR A 1 7  ? 10.703  -0.935  2.721   1.00 0.00 ? 7  THR A HB   7 
ATOM 3221 H HG1  . THR A 1 7  ? 9.036   -0.135  3.856   1.00 0.00 ? 7  THR A HG1  7 
ATOM 3222 H HG21 . THR A 1 7  ? 12.674  -0.610  4.178   1.00 0.00 ? 7  THR A HG21 7 
ATOM 3223 H HG22 . THR A 1 7  ? 11.860  0.744   4.962   1.00 0.00 ? 7  THR A HG22 7 
ATOM 3224 H HG23 . THR A 1 7  ? 11.211  -0.887  5.124   1.00 0.00 ? 7  THR A HG23 7 
ATOM 3225 N N    . THR A 1 8  ? 11.551  -0.736  0.526   1.00 0.00 ? 8  THR A N    7 
ATOM 3226 C CA   . THR A 1 8  ? 12.153  -1.559  -0.561  1.00 0.00 ? 8  THR A CA   7 
ATOM 3227 C C    . THR A 1 8  ? 11.752  -0.975  -1.917  1.00 0.00 ? 8  THR A C    7 
ATOM 3228 O O    . THR A 1 8  ? 10.919  -0.095  -2.002  1.00 0.00 ? 8  THR A O    7 
ATOM 3229 C CB   . THR A 1 8  ? 11.642  -2.998  -0.454  1.00 0.00 ? 8  THR A CB   7 
ATOM 3230 O OG1  . THR A 1 8  ? 12.234  -3.785  -1.477  1.00 0.00 ? 8  THR A OG1  7 
ATOM 3231 C CG2  . THR A 1 8  ? 10.120  -3.012  -0.612  1.00 0.00 ? 8  THR A CG2  7 
ATOM 3232 H H    . THR A 1 8  ? 10.611  -0.860  0.770   1.00 0.00 ? 8  THR A H    7 
ATOM 3233 H HA   . THR A 1 8  ? 13.229  -1.550  -0.468  1.00 0.00 ? 8  THR A HA   7 
ATOM 3234 H HB   . THR A 1 8  ? 11.903  -3.403  0.511   1.00 0.00 ? 8  THR A HB   7 
ATOM 3235 H HG1  . THR A 1 8  ? 13.159  -3.915  -1.254  1.00 0.00 ? 8  THR A HG1  7 
ATOM 3236 H HG21 . THR A 1 8  ? 9.769   -2.009  -0.805  1.00 0.00 ? 8  THR A HG21 7 
ATOM 3237 H HG22 . THR A 1 8  ? 9.851   -3.653  -1.438  1.00 0.00 ? 8  THR A HG22 7 
ATOM 3238 H HG23 . THR A 1 8  ? 9.668   -3.384  0.295   1.00 0.00 ? 8  THR A HG23 7 
ATOM 3239 N N    . ASP A 1 9  ? 12.336  -1.460  -2.978  1.00 0.00 ? 9  ASP A N    7 
ATOM 3240 C CA   . ASP A 1 9  ? 11.984  -0.932  -4.327  1.00 0.00 ? 9  ASP A CA   7 
ATOM 3241 C C    . ASP A 1 9  ? 11.364  -2.051  -5.166  1.00 0.00 ? 9  ASP A C    7 
ATOM 3242 O O    . ASP A 1 9  ? 11.504  -3.219  -4.861  1.00 0.00 ? 9  ASP A O    7 
ATOM 3243 C CB   . ASP A 1 9  ? 13.245  -0.415  -5.020  1.00 0.00 ? 9  ASP A CB   7 
ATOM 3244 C CG   . ASP A 1 9  ? 14.073  0.407   -4.031  1.00 0.00 ? 9  ASP A CG   7 
ATOM 3245 O OD1  . ASP A 1 9  ? 14.510  -0.157  -3.041  1.00 0.00 ? 9  ASP A OD1  7 
ATOM 3246 O OD2  . ASP A 1 9  ? 14.257  1.587   -4.279  1.00 0.00 ? 9  ASP A OD2  7 
ATOM 3247 H H    . ASP A 1 9  ? 13.003  -2.171  -2.889  1.00 0.00 ? 9  ASP A H    7 
ATOM 3248 H HA   . ASP A 1 9  ? 11.273  -0.124  -4.222  1.00 0.00 ? 9  ASP A HA   7 
ATOM 3249 H HB2  . ASP A 1 9  ? 13.831  -1.252  -5.373  1.00 0.00 ? 9  ASP A HB2  7 
ATOM 3250 H HB3  . ASP A 1 9  ? 12.966  0.207   -5.856  1.00 0.00 ? 9  ASP A HB3  7 
ATOM 3251 N N    . HIS A 1 10 ? 10.681  -1.703  -6.221  1.00 0.00 ? 10 HIS A N    7 
ATOM 3252 C CA   . HIS A 1 10 ? 10.054  -2.754  -7.082  1.00 0.00 ? 10 HIS A CA   7 
ATOM 3253 C C    . HIS A 1 10 ? 9.276   -3.736  -6.202  1.00 0.00 ? 10 HIS A C    7 
ATOM 3254 O O    . HIS A 1 10 ? 9.037   -4.866  -6.579  1.00 0.00 ? 10 HIS A O    7 
ATOM 3255 C CB   . HIS A 1 10 ? 11.147  -3.507  -7.841  1.00 0.00 ? 10 HIS A CB   7 
ATOM 3256 C CG   . HIS A 1 10 ? 11.600  -2.683  -9.014  1.00 0.00 ? 10 HIS A CG   7 
ATOM 3257 N ND1  . HIS A 1 10 ? 12.325  -3.228  -10.062 1.00 0.00 ? 10 HIS A ND1  7 
ATOM 3258 C CD2  . HIS A 1 10 ? 11.437  -1.355  -9.320  1.00 0.00 ? 10 HIS A CD2  7 
ATOM 3259 C CE1  . HIS A 1 10 ? 12.569  -2.238  -10.941 1.00 0.00 ? 10 HIS A CE1  7 
ATOM 3260 N NE2  . HIS A 1 10 ? 12.051  -1.076  -10.537 1.00 0.00 ? 10 HIS A NE2  7 
ATOM 3261 H H    . HIS A 1 10 ? 10.584  -0.752  -6.448  1.00 0.00 ? 10 HIS A H    7 
ATOM 3262 H HA   . HIS A 1 10 ? 9.376   -2.295  -7.791  1.00 0.00 ? 10 HIS A HA   7 
ATOM 3263 H HB2  . HIS A 1 10 ? 11.984  -3.687  -7.183  1.00 0.00 ? 10 HIS A HB2  7 
ATOM 3264 H HB3  . HIS A 1 10 ? 10.757  -4.451  -8.194  1.00 0.00 ? 10 HIS A HB3  7 
ATOM 3265 H HD1  . HIS A 1 10 ? 12.609  -4.161  -10.147 1.00 0.00 ? 10 HIS A HD1  7 
ATOM 3266 H HD2  . HIS A 1 10 ? 10.914  -0.636  -8.707  1.00 0.00 ? 10 HIS A HD2  7 
ATOM 3267 H HE1  . HIS A 1 10 ? 13.118  -2.370  -11.863 1.00 0.00 ? 10 HIS A HE1  7 
ATOM 3268 N N    . GLN A 1 11 ? 8.877   -3.311  -5.035  1.00 0.00 ? 11 GLN A N    7 
ATOM 3269 C CA   . GLN A 1 11 ? 8.112   -4.217  -4.131  1.00 0.00 ? 11 GLN A CA   7 
ATOM 3270 C C    . GLN A 1 11 ? 7.554   -3.406  -2.958  1.00 0.00 ? 11 GLN A C    7 
ATOM 3271 O O    . GLN A 1 11 ? 7.594   -3.832  -1.821  1.00 0.00 ? 11 GLN A O    7 
ATOM 3272 C CB   . GLN A 1 11 ? 9.038   -5.313  -3.600  1.00 0.00 ? 11 GLN A CB   7 
ATOM 3273 C CG   . GLN A 1 11 ? 9.029   -6.501  -4.565  1.00 0.00 ? 11 GLN A CG   7 
ATOM 3274 C CD   . GLN A 1 11 ? 8.776   -7.792  -3.784  1.00 0.00 ? 11 GLN A CD   7 
ATOM 3275 O OE1  . GLN A 1 11 ? 9.482   -8.766  -3.953  1.00 0.00 ? 11 GLN A OE1  7 
ATOM 3276 N NE2  . GLN A 1 11 ? 7.792   -7.841  -2.928  1.00 0.00 ? 11 GLN A NE2  7 
ATOM 3277 H H    . GLN A 1 11 ? 9.079   -2.395  -4.752  1.00 0.00 ? 11 GLN A H    7 
ATOM 3278 H HA   . GLN A 1 11 ? 7.297   -4.667  -4.678  1.00 0.00 ? 11 GLN A HA   7 
ATOM 3279 H HB2  . GLN A 1 11 ? 10.043  -4.925  -3.514  1.00 0.00 ? 11 GLN A HB2  7 
ATOM 3280 H HB3  . GLN A 1 11 ? 8.694   -5.638  -2.629  1.00 0.00 ? 11 GLN A HB3  7 
ATOM 3281 H HG2  . GLN A 1 11 ? 8.247   -6.363  -5.297  1.00 0.00 ? 11 GLN A HG2  7 
ATOM 3282 H HG3  . GLN A 1 11 ? 9.984   -6.567  -5.066  1.00 0.00 ? 11 GLN A HG3  7 
ATOM 3283 H HE21 . GLN A 1 11 ? 7.223   -7.054  -2.791  1.00 0.00 ? 11 GLN A HE21 7 
ATOM 3284 H HE22 . GLN A 1 11 ? 7.621   -8.663  -2.424  1.00 0.00 ? 11 GLN A HE22 7 
ATOM 3285 N N    . MET A 1 12 ? 7.036   -2.238  -3.228  1.00 0.00 ? 12 MET A N    7 
ATOM 3286 C CA   . MET A 1 12 ? 6.477   -1.395  -2.132  1.00 0.00 ? 12 MET A CA   7 
ATOM 3287 C C    . MET A 1 12 ? 4.989   -1.148  -2.385  1.00 0.00 ? 12 MET A C    7 
ATOM 3288 O O    . MET A 1 12 ? 4.148   -1.450  -1.563  1.00 0.00 ? 12 MET A O    7 
ATOM 3289 C CB   . MET A 1 12 ? 7.210   -0.053  -2.100  1.00 0.00 ? 12 MET A CB   7 
ATOM 3290 C CG   . MET A 1 12 ? 7.204   0.504   -0.675  1.00 0.00 ? 12 MET A CG   7 
ATOM 3291 S SD   . MET A 1 12 ? 8.055   -0.649  0.431   1.00 0.00 ? 12 MET A SD   7 
ATOM 3292 C CE   . MET A 1 12 ? 6.597   -1.196  1.354   1.00 0.00 ? 12 MET A CE   7 
ATOM 3293 H H    . MET A 1 12 ? 7.016   -1.914  -4.153  1.00 0.00 ? 12 MET A H    7 
ATOM 3294 H HA   . MET A 1 12 ? 6.603   -1.900  -1.187  1.00 0.00 ? 12 MET A HA   7 
ATOM 3295 H HB2  . MET A 1 12 ? 8.227   -0.192  -2.433  1.00 0.00 ? 12 MET A HB2  7 
ATOM 3296 H HB3  . MET A 1 12 ? 6.711   0.644   -2.757  1.00 0.00 ? 12 MET A HB3  7 
ATOM 3297 H HG2  . MET A 1 12 ? 7.713   1.457   -0.660  1.00 0.00 ? 12 MET A HG2  7 
ATOM 3298 H HG3  . MET A 1 12 ? 6.185   0.636   -0.343  1.00 0.00 ? 12 MET A HG3  7 
ATOM 3299 H HE1  . MET A 1 12 ? 5.982   -0.344  1.596   1.00 0.00 ? 12 MET A HE1  7 
ATOM 3300 H HE2  . MET A 1 12 ? 6.028   -1.888  0.749   1.00 0.00 ? 12 MET A HE2  7 
ATOM 3301 H HE3  . MET A 1 12 ? 6.911   -1.681  2.267   1.00 0.00 ? 12 MET A HE3  7 
ATOM 3302 N N    . ALA A 1 13 ? 4.663   -0.590  -3.518  1.00 0.00 ? 13 ALA A N    7 
ATOM 3303 C CA   . ALA A 1 13 ? 3.232   -0.310  -3.829  1.00 0.00 ? 13 ALA A CA   7 
ATOM 3304 C C    . ALA A 1 13 ? 2.481   -1.624  -4.053  1.00 0.00 ? 13 ALA A C    7 
ATOM 3305 O O    . ALA A 1 13 ? 1.277   -1.637  -4.222  1.00 0.00 ? 13 ALA A O    7 
ATOM 3306 C CB   . ALA A 1 13 ? 3.147   0.548   -5.093  1.00 0.00 ? 13 ALA A CB   7 
ATOM 3307 H H    . ALA A 1 13 ? 5.362   -0.349  -4.161  1.00 0.00 ? 13 ALA A H    7 
ATOM 3308 H HA   . ALA A 1 13 ? 2.784   0.222   -3.005  1.00 0.00 ? 13 ALA A HA   7 
ATOM 3309 H HB1  . ALA A 1 13 ? 4.138   0.873   -5.375  1.00 0.00 ? 13 ALA A HB1  7 
ATOM 3310 H HB2  . ALA A 1 13 ? 2.717   -0.034  -5.894  1.00 0.00 ? 13 ALA A HB2  7 
ATOM 3311 H HB3  . ALA A 1 13 ? 2.525   1.410   -4.900  1.00 0.00 ? 13 ALA A HB3  7 
ATOM 3312 N N    . ARG A 1 14 ? 3.173   -2.730  -4.054  1.00 0.00 ? 14 ARG A N    7 
ATOM 3313 C CA   . ARG A 1 14 ? 2.485   -4.036  -4.267  1.00 0.00 ? 14 ARG A CA   7 
ATOM 3314 C C    . ARG A 1 14 ? 2.241   -4.711  -2.915  1.00 0.00 ? 14 ARG A C    7 
ATOM 3315 O O    . ARG A 1 14 ? 1.765   -5.828  -2.847  1.00 0.00 ? 14 ARG A O    7 
ATOM 3316 C CB   . ARG A 1 14 ? 3.358   -4.940  -5.140  1.00 0.00 ? 14 ARG A CB   7 
ATOM 3317 C CG   . ARG A 1 14 ? 2.474   -5.685  -6.143  1.00 0.00 ? 14 ARG A CG   7 
ATOM 3318 C CD   . ARG A 1 14 ? 2.544   -7.188  -5.867  1.00 0.00 ? 14 ARG A CD   7 
ATOM 3319 N NE   . ARG A 1 14 ? 3.515   -7.821  -6.803  1.00 0.00 ? 14 ARG A NE   7 
ATOM 3320 C CZ   . ARG A 1 14 ? 4.758   -7.425  -6.818  1.00 0.00 ? 14 ARG A CZ   7 
ATOM 3321 N NH1  . ARG A 1 14 ? 5.569   -7.786  -5.863  1.00 0.00 ? 14 ARG A NH1  7 
ATOM 3322 N NH2  . ARG A 1 14 ? 5.189   -6.667  -7.789  1.00 0.00 ? 14 ARG A NH2  7 
ATOM 3323 H H    . ARG A 1 14 ? 4.143   -2.702  -3.915  1.00 0.00 ? 14 ARG A H    7 
ATOM 3324 H HA   . ARG A 1 14 ? 1.539   -3.865  -4.759  1.00 0.00 ? 14 ARG A HA   7 
ATOM 3325 H HB2  . ARG A 1 14 ? 4.080   -4.338  -5.673  1.00 0.00 ? 14 ARG A HB2  7 
ATOM 3326 H HB3  . ARG A 1 14 ? 3.874   -5.654  -4.517  1.00 0.00 ? 14 ARG A HB3  7 
ATOM 3327 H HG2  . ARG A 1 14 ? 1.453   -5.347  -6.043  1.00 0.00 ? 14 ARG A HG2  7 
ATOM 3328 H HG3  . ARG A 1 14 ? 2.822   -5.489  -7.146  1.00 0.00 ? 14 ARG A HG3  7 
ATOM 3329 H HD2  . ARG A 1 14 ? 2.865   -7.353  -4.850  1.00 0.00 ? 14 ARG A HD2  7 
ATOM 3330 H HD3  . ARG A 1 14 ? 1.567   -7.626  -6.012  1.00 0.00 ? 14 ARG A HD3  7 
ATOM 3331 H HE   . ARG A 1 14 ? 3.220   -8.533  -7.408  1.00 0.00 ? 14 ARG A HE   7 
ATOM 3332 H HH11 . ARG A 1 14 ? 5.237   -8.367  -5.119  1.00 0.00 ? 14 ARG A HH11 7 
ATOM 3333 H HH12 . ARG A 1 14 ? 6.521   -7.482  -5.873  1.00 0.00 ? 14 ARG A HH12 7 
ATOM 3334 H HH21 . ARG A 1 14 ? 4.567   -6.388  -8.521  1.00 0.00 ? 14 ARG A HH21 7 
ATOM 3335 H HH22 . ARG A 1 14 ? 6.142   -6.364  -7.802  1.00 0.00 ? 14 ARG A HH22 7 
ATOM 3336 N N    . LYS A 1 15 ? 2.559   -4.045  -1.838  1.00 0.00 ? 15 LYS A N    7 
ATOM 3337 C CA   . LYS A 1 15 ? 2.340   -4.653  -0.495  1.00 0.00 ? 15 LYS A CA   7 
ATOM 3338 C C    . LYS A 1 15 ? 1.247   -3.880  0.242   1.00 0.00 ? 15 LYS A C    7 
ATOM 3339 O O    . LYS A 1 15 ? 0.529   -4.428  1.053   1.00 0.00 ? 15 LYS A O    7 
ATOM 3340 C CB   . LYS A 1 15 ? 3.639   -4.593  0.312   1.00 0.00 ? 15 LYS A CB   7 
ATOM 3341 C CG   . LYS A 1 15 ? 4.658   -5.564  -0.283  1.00 0.00 ? 15 LYS A CG   7 
ATOM 3342 C CD   . LYS A 1 15 ? 6.061   -5.188  0.198   1.00 0.00 ? 15 LYS A CD   7 
ATOM 3343 C CE   . LYS A 1 15 ? 6.446   -6.067  1.390   1.00 0.00 ? 15 LYS A CE   7 
ATOM 3344 N NZ   . LYS A 1 15 ? 7.390   -5.325  2.271   1.00 0.00 ? 15 LYS A NZ   7 
ATOM 3345 H H    . LYS A 1 15 ? 2.940   -3.145  -1.912  1.00 0.00 ? 15 LYS A H    7 
ATOM 3346 H HA   . LYS A 1 15 ? 2.033   -5.682  -0.612  1.00 0.00 ? 15 LYS A HA   7 
ATOM 3347 H HB2  . LYS A 1 15 ? 4.035   -3.590  0.280   1.00 0.00 ? 15 LYS A HB2  7 
ATOM 3348 H HB3  . LYS A 1 15 ? 3.438   -4.869  1.337   1.00 0.00 ? 15 LYS A HB3  7 
ATOM 3349 H HG2  . LYS A 1 15 ? 4.425   -6.572  0.035   1.00 0.00 ? 15 LYS A HG2  7 
ATOM 3350 H HG3  . LYS A 1 15 ? 4.622   -5.510  -1.361  1.00 0.00 ? 15 LYS A HG3  7 
ATOM 3351 H HD2  . LYS A 1 15 ? 6.769   -5.337  -0.604  1.00 0.00 ? 15 LYS A HD2  7 
ATOM 3352 H HD3  . LYS A 1 15 ? 6.072   -4.151  0.500   1.00 0.00 ? 15 LYS A HD3  7 
ATOM 3353 H HE2  . LYS A 1 15 ? 5.558   -6.322  1.949   1.00 0.00 ? 15 LYS A HE2  7 
ATOM 3354 H HE3  . LYS A 1 15 ? 6.918   -6.970  1.034   1.00 0.00 ? 15 LYS A HE3  7 
ATOM 3355 H HZ1  . LYS A 1 15 ? 6.961   -4.424  2.560   1.00 0.00 ? 15 LYS A HZ1  7 
ATOM 3356 H HZ2  . LYS A 1 15 ? 7.598   -5.898  3.115   1.00 0.00 ? 15 LYS A HZ2  7 
ATOM 3357 H HZ3  . LYS A 1 15 ? 8.272   -5.137  1.754   1.00 0.00 ? 15 LYS A HZ3  7 
ATOM 3358 N N    . CYS A 1 16 ? 1.110   -2.613  -0.035  1.00 0.00 ? 16 CYS A N    7 
ATOM 3359 C CA   . CYS A 1 16 ? 0.055   -1.813  0.647   1.00 0.00 ? 16 CYS A CA   7 
ATOM 3360 C C    . CYS A 1 16 ? -1.315  -2.308  0.175   1.00 0.00 ? 16 CYS A C    7 
ATOM 3361 O O    . CYS A 1 16 ? -2.173  -2.647  0.966   1.00 0.00 ? 16 CYS A O    7 
ATOM 3362 C CB   . CYS A 1 16 ? 0.233   -0.330  0.289   1.00 0.00 ? 16 CYS A CB   7 
ATOM 3363 S SG   . CYS A 1 16 ? -1.279  0.596   0.671   1.00 0.00 ? 16 CYS A SG   7 
ATOM 3364 H H    . CYS A 1 16 ? 1.697   -2.189  -0.695  1.00 0.00 ? 16 CYS A H    7 
ATOM 3365 H HA   . CYS A 1 16 ? 0.137   -1.940  1.716   1.00 0.00 ? 16 CYS A HA   7 
ATOM 3366 H HB2  . CYS A 1 16 ? 1.054   0.078   0.858   1.00 0.00 ? 16 CYS A HB2  7 
ATOM 3367 H HB3  . CYS A 1 16 ? 0.451   -0.242  -0.765  1.00 0.00 ? 16 CYS A HB3  7 
ATOM 3368 N N    . ASP A 1 17 ? -1.519  -2.360  -1.112  1.00 0.00 ? 17 ASP A N    7 
ATOM 3369 C CA   . ASP A 1 17 ? -2.823  -2.841  -1.647  1.00 0.00 ? 17 ASP A CA   7 
ATOM 3370 C C    . ASP A 1 17 ? -3.041  -4.288  -1.203  1.00 0.00 ? 17 ASP A C    7 
ATOM 3371 O O    . ASP A 1 17 ? -4.099  -4.655  -0.729  1.00 0.00 ? 17 ASP A O    7 
ATOM 3372 C CB   . ASP A 1 17 ? -2.786  -2.789  -3.174  1.00 0.00 ? 17 ASP A CB   7 
ATOM 3373 C CG   . ASP A 1 17 ? -4.211  -2.838  -3.724  1.00 0.00 ? 17 ASP A CG   7 
ATOM 3374 O OD1  . ASP A 1 17 ? -5.091  -3.265  -2.997  1.00 0.00 ? 17 ASP A OD1  7 
ATOM 3375 O OD2  . ASP A 1 17 ? -4.398  -2.447  -4.865  1.00 0.00 ? 17 ASP A OD2  7 
ATOM 3376 H H    . ASP A 1 17 ? -0.809  -2.087  -1.730  1.00 0.00 ? 17 ASP A H    7 
ATOM 3377 H HA   . ASP A 1 17 ? -3.626  -2.215  -1.278  1.00 0.00 ? 17 ASP A HA   7 
ATOM 3378 H HB2  . ASP A 1 17 ? -2.305  -1.877  -3.488  1.00 0.00 ? 17 ASP A HB2  7 
ATOM 3379 H HB3  . ASP A 1 17 ? -2.229  -3.635  -3.548  1.00 0.00 ? 17 ASP A HB3  7 
ATOM 3380 N N    . ASP A 1 18 ? -2.044  -5.115  -1.363  1.00 0.00 ? 18 ASP A N    7 
ATOM 3381 C CA   . ASP A 1 18 ? -2.180  -6.545  -0.963  1.00 0.00 ? 18 ASP A CA   7 
ATOM 3382 C C    . ASP A 1 18 ? -2.491  -6.636  0.533   1.00 0.00 ? 18 ASP A C    7 
ATOM 3383 O O    . ASP A 1 18 ? -3.163  -7.542  0.984   1.00 0.00 ? 18 ASP A O    7 
ATOM 3384 C CB   . ASP A 1 18 ? -0.867  -7.280  -1.249  1.00 0.00 ? 18 ASP A CB   7 
ATOM 3385 C CG   . ASP A 1 18 ? -0.802  -7.662  -2.729  1.00 0.00 ? 18 ASP A CG   7 
ATOM 3386 O OD1  . ASP A 1 18 ? -1.224  -6.862  -3.547  1.00 0.00 ? 18 ASP A OD1  7 
ATOM 3387 O OD2  . ASP A 1 18 ? -0.331  -8.750  -3.019  1.00 0.00 ? 18 ASP A OD2  7 
ATOM 3388 H H    . ASP A 1 18 ? -1.203  -4.793  -1.753  1.00 0.00 ? 18 ASP A H    7 
ATOM 3389 H HA   . ASP A 1 18 ? -2.979  -7.003  -1.526  1.00 0.00 ? 18 ASP A HA   7 
ATOM 3390 H HB2  . ASP A 1 18 ? -0.035  -6.634  -1.007  1.00 0.00 ? 18 ASP A HB2  7 
ATOM 3391 H HB3  . ASP A 1 18 ? -0.817  -8.173  -0.646  1.00 0.00 ? 18 ASP A HB3  7 
ATOM 3392 N N    . CYS A 1 19 ? -2.001  -5.706  1.304   1.00 0.00 ? 19 CYS A N    7 
ATOM 3393 C CA   . CYS A 1 19 ? -2.260  -5.734  2.772   1.00 0.00 ? 19 CYS A CA   7 
ATOM 3394 C C    . CYS A 1 19 ? -3.765  -5.668  3.020   1.00 0.00 ? 19 CYS A C    7 
ATOM 3395 O O    . CYS A 1 19 ? -4.295  -6.332  3.889   1.00 0.00 ? 19 CYS A O    7 
ATOM 3396 C CB   . CYS A 1 19 ? -1.584  -4.527  3.427   1.00 0.00 ? 19 CYS A CB   7 
ATOM 3397 S SG   . CYS A 1 19 ? -1.097  -4.948  5.119   1.00 0.00 ? 19 CYS A SG   7 
ATOM 3398 H H    . CYS A 1 19 ? -1.462  -4.987  0.918   1.00 0.00 ? 19 CYS A H    7 
ATOM 3399 H HA   . CYS A 1 19 ? -1.861  -6.645  3.192   1.00 0.00 ? 19 CYS A HA   7 
ATOM 3400 H HB2  . CYS A 1 19 ? -0.709  -4.253  2.857   1.00 0.00 ? 19 CYS A HB2  7 
ATOM 3401 H HB3  . CYS A 1 19 ? -2.274  -3.696  3.447   1.00 0.00 ? 19 CYS A HB3  7 
ATOM 3402 N N    . CYS A 1 20 ? -4.455  -4.863  2.263   1.00 0.00 ? 20 CYS A N    7 
ATOM 3403 C CA   . CYS A 1 20 ? -5.926  -4.735  2.447   1.00 0.00 ? 20 CYS A CA   7 
ATOM 3404 C C    . CYS A 1 20 ? -6.593  -6.108  2.308   1.00 0.00 ? 20 CYS A C    7 
ATOM 3405 O O    . CYS A 1 20 ? -7.592  -6.386  2.943   1.00 0.00 ? 20 CYS A O    7 
ATOM 3406 C CB   . CYS A 1 20 ? -6.476  -3.770  1.395   1.00 0.00 ? 20 CYS A CB   7 
ATOM 3407 S SG   . CYS A 1 20 ? -6.140  -2.076  1.934   1.00 0.00 ? 20 CYS A SG   7 
ATOM 3408 H H    . CYS A 1 20 ? -4.000  -4.335  1.574   1.00 0.00 ? 20 CYS A H    7 
ATOM 3409 H HA   . CYS A 1 20 ? -6.128  -4.340  3.431   1.00 0.00 ? 20 CYS A HA   7 
ATOM 3410 H HB2  . CYS A 1 20 ? -5.991  -3.953  0.447   1.00 0.00 ? 20 CYS A HB2  7 
ATOM 3411 H HB3  . CYS A 1 20 ? -7.540  -3.912  1.289   1.00 0.00 ? 20 CYS A HB3  7 
ATOM 3412 N N    . GLY A 1 21 ? -6.048  -6.973  1.497   1.00 0.00 ? 21 GLY A N    7 
ATOM 3413 C CA   . GLY A 1 21 ? -6.654  -8.328  1.341   1.00 0.00 ? 21 GLY A CA   7 
ATOM 3414 C C    . GLY A 1 21 ? -7.087  -8.555  -0.110  1.00 0.00 ? 21 GLY A C    7 
ATOM 3415 O O    . GLY A 1 21 ? -7.668  -9.571  -0.437  1.00 0.00 ? 21 GLY A O    7 
ATOM 3416 H H    . GLY A 1 21 ? -5.237  -6.738  0.999   1.00 0.00 ? 21 GLY A H    7 
ATOM 3417 H HA2  . GLY A 1 21 ? -5.928  -9.078  1.620   1.00 0.00 ? 21 GLY A HA2  7 
ATOM 3418 H HA3  . GLY A 1 21 ? -7.516  -8.409  1.986   1.00 0.00 ? 21 GLY A HA3  7 
ATOM 3419 N N    . GLY A 1 22 ? -6.810  -7.627  -0.985  1.00 0.00 ? 22 GLY A N    7 
ATOM 3420 C CA   . GLY A 1 22 ? -7.209  -7.811  -2.404  1.00 0.00 ? 22 GLY A CA   7 
ATOM 3421 C C    . GLY A 1 22 ? -6.109  -7.294  -3.327  1.00 0.00 ? 22 GLY A C    7 
ATOM 3422 O O    . GLY A 1 22 ? -5.184  -6.632  -2.900  1.00 0.00 ? 22 GLY A O    7 
ATOM 3423 H H    . GLY A 1 22 ? -6.340  -6.820  -0.713  1.00 0.00 ? 22 GLY A H    7 
ATOM 3424 H HA2  . GLY A 1 22 ? -7.368  -8.858  -2.587  1.00 0.00 ? 22 GLY A HA2  7 
ATOM 3425 H HA3  . GLY A 1 22 ? -8.121  -7.270  -2.598  1.00 0.00 ? 22 GLY A HA3  7 
ATOM 3426 N N    . LYS A 1 23 ? -6.202  -7.592  -4.593  1.00 0.00 ? 23 LYS A N    7 
ATOM 3427 C CA   . LYS A 1 23 ? -5.170  -7.122  -5.545  1.00 0.00 ? 23 LYS A CA   7 
ATOM 3428 C C    . LYS A 1 23 ? -5.542  -5.729  -6.058  1.00 0.00 ? 23 LYS A C    7 
ATOM 3429 O O    . LYS A 1 23 ? -5.000  -5.253  -7.035  1.00 0.00 ? 23 LYS A O    7 
ATOM 3430 C CB   . LYS A 1 23 ? -5.081  -8.096  -6.725  1.00 0.00 ? 23 LYS A CB   7 
ATOM 3431 C CG   . LYS A 1 23 ? -3.928  -7.685  -7.642  1.00 0.00 ? 23 LYS A CG   7 
ATOM 3432 C CD   . LYS A 1 23 ? -3.547  -8.861  -8.544  1.00 0.00 ? 23 LYS A CD   7 
ATOM 3433 C CE   . LYS A 1 23 ? -4.525  -8.945  -9.718  1.00 0.00 ? 23 LYS A CE   7 
ATOM 3434 N NZ   . LYS A 1 23 ? -5.710  -9.759  -9.322  1.00 0.00 ? 23 LYS A NZ   7 
ATOM 3435 H H    . LYS A 1 23 ? -6.952  -8.125  -4.916  1.00 0.00 ? 23 LYS A H    7 
ATOM 3436 H HA   . LYS A 1 23 ? -4.220  -7.080  -5.043  1.00 0.00 ? 23 LYS A HA   7 
ATOM 3437 H HB2  . LYS A 1 23 ? -4.907  -9.095  -6.352  1.00 0.00 ? 23 LYS A HB2  7 
ATOM 3438 H HB3  . LYS A 1 23 ? -6.006  -8.074  -7.280  1.00 0.00 ? 23 LYS A HB3  7 
ATOM 3439 H HG2  . LYS A 1 23 ? -4.235  -6.847  -8.252  1.00 0.00 ? 23 LYS A HG2  7 
ATOM 3440 H HG3  . LYS A 1 23 ? -3.075  -7.402  -7.045  1.00 0.00 ? 23 LYS A HG3  7 
ATOM 3441 H HD2  . LYS A 1 23 ? -2.544  -8.715  -8.920  1.00 0.00 ? 23 LYS A HD2  7 
ATOM 3442 H HD3  . LYS A 1 23 ? -3.589  -9.779  -7.977  1.00 0.00 ? 23 LYS A HD3  7 
ATOM 3443 H HE2  . LYS A 1 23 ? -4.847  -7.951  -9.991  1.00 0.00 ? 23 LYS A HE2  7 
ATOM 3444 H HE3  . LYS A 1 23 ? -4.036  -9.410  -10.562 1.00 0.00 ? 23 LYS A HE3  7 
ATOM 3445 H HZ1  . LYS A 1 23 ? -5.415  -10.496 -8.650  1.00 0.00 ? 23 LYS A HZ1  7 
ATOM 3446 H HZ2  . LYS A 1 23 ? -6.419  -9.143  -8.874  1.00 0.00 ? 23 LYS A HZ2  7 
ATOM 3447 H HZ3  . LYS A 1 23 ? -6.120  -10.207 -10.165 1.00 0.00 ? 23 LYS A HZ3  7 
ATOM 3448 N N    . GLY A 1 24 ? -6.467  -5.068  -5.410  1.00 0.00 ? 24 GLY A N    7 
ATOM 3449 C CA   . GLY A 1 24 ? -6.864  -3.710  -5.878  1.00 0.00 ? 24 GLY A CA   7 
ATOM 3450 C C    . GLY A 1 24 ? -7.687  -2.988  -4.805  1.00 0.00 ? 24 GLY A C    7 
ATOM 3451 O O    . GLY A 1 24 ? -8.422  -2.066  -5.100  1.00 0.00 ? 24 GLY A O    7 
ATOM 3452 H H    . GLY A 1 24 ? -6.899  -5.466  -4.625  1.00 0.00 ? 24 GLY A H    7 
ATOM 3453 H HA2  . GLY A 1 24 ? -5.975  -3.134  -6.093  1.00 0.00 ? 24 GLY A HA2  7 
ATOM 3454 H HA3  . GLY A 1 24 ? -7.457  -3.801  -6.775  1.00 0.00 ? 24 GLY A HA3  7 
ATOM 3455 N N    . ARG A 1 25 ? -7.577  -3.381  -3.562  1.00 0.00 ? 25 ARG A N    7 
ATOM 3456 C CA   . ARG A 1 25 ? -8.366  -2.684  -2.503  1.00 0.00 ? 25 ARG A CA   7 
ATOM 3457 C C    . ARG A 1 25 ? -7.424  -2.015  -1.501  1.00 0.00 ? 25 ARG A C    7 
ATOM 3458 O O    . ARG A 1 25 ? -7.678  -2.006  -0.314  1.00 0.00 ? 25 ARG A O    7 
ATOM 3459 C CB   . ARG A 1 25 ? -9.271  -3.673  -1.759  1.00 0.00 ? 25 ARG A CB   7 
ATOM 3460 C CG   . ARG A 1 25 ? -8.752  -5.102  -1.921  1.00 0.00 ? 25 ARG A CG   7 
ATOM 3461 C CD   . ARG A 1 25 ? -9.582  -6.037  -1.037  1.00 0.00 ? 25 ARG A CD   7 
ATOM 3462 N NE   . ARG A 1 25 ? -10.999 -6.026  -1.497  1.00 0.00 ? 25 ARG A NE   7 
ATOM 3463 C CZ   . ARG A 1 25 ? -11.950 -6.414  -0.693  1.00 0.00 ? 25 ARG A CZ   7 
ATOM 3464 N NH1  . ARG A 1 25 ? -11.906 -6.095  0.572   1.00 0.00 ? 25 ARG A NH1  7 
ATOM 3465 N NH2  . ARG A 1 25 ? -12.947 -7.122  -1.152  1.00 0.00 ? 25 ARG A NH2  7 
ATOM 3466 H H    . ARG A 1 25 ? -6.979  -4.121  -3.328  1.00 0.00 ? 25 ARG A H    7 
ATOM 3467 H HA   . ARG A 1 25 ? -8.977  -1.925  -2.967  1.00 0.00 ? 25 ARG A HA   7 
ATOM 3468 H HB2  . ARG A 1 25 ? -9.288  -3.418  -0.709  1.00 0.00 ? 25 ARG A HB2  7 
ATOM 3469 H HB3  . ARG A 1 25 ? -10.272 -3.610  -2.156  1.00 0.00 ? 25 ARG A HB3  7 
ATOM 3470 H HG2  . ARG A 1 25 ? -8.845  -5.404  -2.954  1.00 0.00 ? 25 ARG A HG2  7 
ATOM 3471 H HG3  . ARG A 1 25 ? -7.717  -5.149  -1.621  1.00 0.00 ? 25 ARG A HG3  7 
ATOM 3472 H HD2  . ARG A 1 25 ? -9.190  -7.041  -1.105  1.00 0.00 ? 25 ARG A HD2  7 
ATOM 3473 H HD3  . ARG A 1 25 ? -9.533  -5.701  -0.013  1.00 0.00 ? 25 ARG A HD3  7 
ATOM 3474 H HE   . ARG A 1 25 ? -11.218 -5.725  -2.405  1.00 0.00 ? 25 ARG A HE   7 
ATOM 3475 H HH11 . ARG A 1 25 ? -11.145 -5.552  0.924   1.00 0.00 ? 25 ARG A HH11 7 
ATOM 3476 H HH12 . ARG A 1 25 ? -12.635 -6.395  1.188   1.00 0.00 ? 25 ARG A HH12 7 
ATOM 3477 H HH21 . ARG A 1 25 ? -12.982 -7.365  -2.121  1.00 0.00 ? 25 ARG A HH21 7 
ATOM 3478 H HH22 . ARG A 1 25 ? -13.674 -7.419  -0.535  1.00 0.00 ? 25 ARG A HH22 7 
ATOM 3479 N N    . GLY A 1 26 ? -6.348  -1.446  -1.966  1.00 0.00 ? 26 GLY A N    7 
ATOM 3480 C CA   . GLY A 1 26 ? -5.403  -0.769  -1.033  1.00 0.00 ? 26 GLY A CA   7 
ATOM 3481 C C    . GLY A 1 26 ? -4.298  -0.050  -1.813  1.00 0.00 ? 26 GLY A C    7 
ATOM 3482 O O    . GLY A 1 26 ? -3.957  -0.420  -2.917  1.00 0.00 ? 26 GLY A O    7 
ATOM 3483 H H    . GLY A 1 26 ? -6.167  -1.457  -2.923  1.00 0.00 ? 26 GLY A H    7 
ATOM 3484 H HA2  . GLY A 1 26 ? -5.939  -0.053  -0.456  1.00 0.00 ? 26 GLY A HA2  7 
ATOM 3485 H HA3  . GLY A 1 26 ? -4.967  -1.494  -0.372  1.00 0.00 ? 26 GLY A HA3  7 
ATOM 3486 N N    . LYS A 1 27 ? -3.742  0.985   -1.239  1.00 0.00 ? 27 LYS A N    7 
ATOM 3487 C CA   . LYS A 1 27 ? -2.661  1.743   -1.933  1.00 0.00 ? 27 LYS A CA   7 
ATOM 3488 C C    . LYS A 1 27 ? -2.164  2.870   -1.021  1.00 0.00 ? 27 LYS A C    7 
ATOM 3489 O O    . LYS A 1 27 ? -2.928  3.482   -0.302  1.00 0.00 ? 27 LYS A O    7 
ATOM 3490 C CB   . LYS A 1 27 ? -3.206  2.343   -3.229  1.00 0.00 ? 27 LYS A CB   7 
ATOM 3491 C CG   . LYS A 1 27 ? -2.123  2.296   -4.308  1.00 0.00 ? 27 LYS A CG   7 
ATOM 3492 C CD   . LYS A 1 27 ? -2.627  1.480   -5.499  1.00 0.00 ? 27 LYS A CD   7 
ATOM 3493 C CE   . LYS A 1 27 ? -3.597  2.330   -6.323  1.00 0.00 ? 27 LYS A CE   7 
ATOM 3494 N NZ   . LYS A 1 27 ? -3.706  1.768   -7.699  1.00 0.00 ? 27 LYS A NZ   7 
ATOM 3495 H H    . LYS A 1 27 ? -4.038  1.266   -0.348  1.00 0.00 ? 27 LYS A H    7 
ATOM 3496 H HA   . LYS A 1 27 ? -1.843  1.076   -2.160  1.00 0.00 ? 27 LYS A HA   7 
ATOM 3497 H HB2  . LYS A 1 27 ? -4.066  1.775   -3.555  1.00 0.00 ? 27 LYS A HB2  7 
ATOM 3498 H HB3  . LYS A 1 27 ? -3.496  3.369   -3.057  1.00 0.00 ? 27 LYS A HB3  7 
ATOM 3499 H HG2  . LYS A 1 27 ? -1.891  3.301   -4.629  1.00 0.00 ? 27 LYS A HG2  7 
ATOM 3500 H HG3  . LYS A 1 27 ? -1.235  1.831   -3.907  1.00 0.00 ? 27 LYS A HG3  7 
ATOM 3501 H HD2  . LYS A 1 27 ? -1.791  1.187   -6.116  1.00 0.00 ? 27 LYS A HD2  7 
ATOM 3502 H HD3  . LYS A 1 27 ? -3.139  0.599   -5.142  1.00 0.00 ? 27 LYS A HD3  7 
ATOM 3503 H HE2  . LYS A 1 27 ? -4.569  2.324   -5.853  1.00 0.00 ? 27 LYS A HE2  7 
ATOM 3504 H HE3  . LYS A 1 27 ? -3.230  3.344   -6.377  1.00 0.00 ? 27 LYS A HE3  7 
ATOM 3505 H HZ1  . LYS A 1 27 ? -2.754  1.579   -8.073  1.00 0.00 ? 27 LYS A HZ1  7 
ATOM 3506 H HZ2  . LYS A 1 27 ? -4.246  0.879   -7.669  1.00 0.00 ? 27 LYS A HZ2  7 
ATOM 3507 H HZ3  . LYS A 1 27 ? -4.193  2.450   -8.315  1.00 0.00 ? 27 LYS A HZ3  7 
ATOM 3508 N N    . CYS A 1 28 ? -0.887  3.144   -1.044  1.00 0.00 ? 28 CYS A N    7 
ATOM 3509 C CA   . CYS A 1 28 ? -0.338  4.228   -0.178  1.00 0.00 ? 28 CYS A CA   7 
ATOM 3510 C C    . CYS A 1 28 ? -1.020  5.562   -0.519  1.00 0.00 ? 28 CYS A C    7 
ATOM 3511 O O    . CYS A 1 28 ? -0.532  6.320   -1.334  1.00 0.00 ? 28 CYS A O    7 
ATOM 3512 C CB   . CYS A 1 28 ? 1.169   4.352   -0.416  1.00 0.00 ? 28 CYS A CB   7 
ATOM 3513 S SG   . CYS A 1 28 ? 2.053   3.278   0.745   1.00 0.00 ? 28 CYS A SG   7 
ATOM 3514 H H    . CYS A 1 28 ? -0.287  2.637   -1.630  1.00 0.00 ? 28 CYS A H    7 
ATOM 3515 H HA   . CYS A 1 28 ? -0.512  3.981   0.859   1.00 0.00 ? 28 CYS A HA   7 
ATOM 3516 H HB2  . CYS A 1 28 ? 1.400   4.054   -1.429  1.00 0.00 ? 28 CYS A HB2  7 
ATOM 3517 H HB3  . CYS A 1 28 ? 1.475   5.377   -0.263  1.00 0.00 ? 28 CYS A HB3  7 
ATOM 3518 N N    . TYR A 1 29 ? -2.138  5.864   0.095   1.00 0.00 ? 29 TYR A N    7 
ATOM 3519 C CA   . TYR A 1 29 ? -2.824  7.152   -0.206  1.00 0.00 ? 29 TYR A CA   7 
ATOM 3520 C C    . TYR A 1 29 ? -2.446  8.180   0.860   1.00 0.00 ? 29 TYR A C    7 
ATOM 3521 O O    . TYR A 1 29 ? -1.926  7.839   1.902   1.00 0.00 ? 29 TYR A O    7 
ATOM 3522 C CB   . TYR A 1 29 ? -4.339  6.940   -0.197  1.00 0.00 ? 29 TYR A CB   7 
ATOM 3523 C CG   . TYR A 1 29 ? -4.773  6.351   -1.519  1.00 0.00 ? 29 TYR A CG   7 
ATOM 3524 C CD1  . TYR A 1 29 ? -4.382  6.960   -2.717  1.00 0.00 ? 29 TYR A CD1  7 
ATOM 3525 C CD2  . TYR A 1 29 ? -5.567  5.197   -1.544  1.00 0.00 ? 29 TYR A CD2  7 
ATOM 3526 C CE1  . TYR A 1 29 ? -4.783  6.414   -3.942  1.00 0.00 ? 29 TYR A CE1  7 
ATOM 3527 C CE2  . TYR A 1 29 ? -5.968  4.652   -2.771  1.00 0.00 ? 29 TYR A CE2  7 
ATOM 3528 C CZ   . TYR A 1 29 ? -5.577  5.260   -3.969  1.00 0.00 ? 29 TYR A CZ   7 
ATOM 3529 O OH   . TYR A 1 29 ? -5.973  4.723   -5.177  1.00 0.00 ? 29 TYR A OH   7 
ATOM 3530 H H    . TYR A 1 29 ? -2.523  5.250   0.756   1.00 0.00 ? 29 TYR A H    7 
ATOM 3531 H HA   . TYR A 1 29 ? -2.515  7.509   -1.178  1.00 0.00 ? 29 TYR A HA   7 
ATOM 3532 H HB2  . TYR A 1 29 ? -4.603  6.263   0.603   1.00 0.00 ? 29 TYR A HB2  7 
ATOM 3533 H HB3  . TYR A 1 29 ? -4.835  7.887   -0.046  1.00 0.00 ? 29 TYR A HB3  7 
ATOM 3534 H HD1  . TYR A 1 29 ? -3.769  7.849   -2.696  1.00 0.00 ? 29 TYR A HD1  7 
ATOM 3535 H HD2  . TYR A 1 29 ? -5.868  4.728   -0.620  1.00 0.00 ? 29 TYR A HD2  7 
ATOM 3536 H HE1  . TYR A 1 29 ? -4.481  6.884   -4.867  1.00 0.00 ? 29 TYR A HE1  7 
ATOM 3537 H HE2  . TYR A 1 29 ? -6.580  3.761   -2.791  1.00 0.00 ? 29 TYR A HE2  7 
ATOM 3538 H HH   . TYR A 1 29 ? -6.933  4.735   -5.205  1.00 0.00 ? 29 TYR A HH   7 
ATOM 3539 N N    . GLY A 1 30 ? -2.699  9.437   0.614   1.00 0.00 ? 30 GLY A N    7 
ATOM 3540 C CA   . GLY A 1 30 ? -2.344  10.473  1.625   1.00 0.00 ? 30 GLY A CA   7 
ATOM 3541 C C    . GLY A 1 30 ? -0.935  10.203  2.153   1.00 0.00 ? 30 GLY A C    7 
ATOM 3542 O O    . GLY A 1 30 ? -0.008  10.025  1.390   1.00 0.00 ? 30 GLY A O    7 
ATOM 3543 H H    . GLY A 1 30 ? -3.118  9.699   -0.232  1.00 0.00 ? 30 GLY A H    7 
ATOM 3544 H HA2  . GLY A 1 30 ? -2.379  11.451  1.169   1.00 0.00 ? 30 GLY A HA2  7 
ATOM 3545 H HA3  . GLY A 1 30 ? -3.046  10.433  2.444   1.00 0.00 ? 30 GLY A HA3  7 
ATOM 3546 N N    . PRO A 1 31 ? -0.824  10.179  3.452   1.00 0.00 ? 31 PRO A N    7 
ATOM 3547 C CA   . PRO A 1 31 ? 0.498   9.921   4.062   1.00 0.00 ? 31 PRO A CA   7 
ATOM 3548 C C    . PRO A 1 31 ? 0.533   8.526   4.691   1.00 0.00 ? 31 PRO A C    7 
ATOM 3549 O O    . PRO A 1 31 ? 1.448   8.186   5.415   1.00 0.00 ? 31 PRO A O    7 
ATOM 3550 C CB   . PRO A 1 31 ? 0.644   11.002  5.133   1.00 0.00 ? 31 PRO A CB   7 
ATOM 3551 C CG   . PRO A 1 31 ? -0.785  11.459  5.478   1.00 0.00 ? 31 PRO A CG   7 
ATOM 3552 C CD   . PRO A 1 31 ? -1.665  11.079  4.276   1.00 0.00 ? 31 PRO A CD   7 
ATOM 3553 H HA   . PRO A 1 31 ? 1.281   10.024  3.327   1.00 0.00 ? 31 PRO A HA   7 
ATOM 3554 H HB2  . PRO A 1 31 ? 1.129   10.592  6.010   1.00 0.00 ? 31 PRO A HB2  7 
ATOM 3555 H HB3  . PRO A 1 31 ? 1.209   11.835  4.748   1.00 0.00 ? 31 PRO A HB3  7 
ATOM 3556 H HG2  . PRO A 1 31 ? -1.130  10.952  6.370   1.00 0.00 ? 31 PRO A HG2  7 
ATOM 3557 H HG3  . PRO A 1 31 ? -0.810  12.527  5.625   1.00 0.00 ? 31 PRO A HG3  7 
ATOM 3558 H HD2  . PRO A 1 31 ? -2.556  10.565  4.607   1.00 0.00 ? 31 PRO A HD2  7 
ATOM 3559 H HD3  . PRO A 1 31 ? -1.927  11.959  3.710   1.00 0.00 ? 31 PRO A HD3  7 
ATOM 3560 N N    . GLN A 1 32 ? -0.456  7.714   4.425   1.00 0.00 ? 32 GLN A N    7 
ATOM 3561 C CA   . GLN A 1 32 ? -0.467  6.346   5.016   1.00 0.00 ? 32 GLN A CA   7 
ATOM 3562 C C    . GLN A 1 32 ? -1.146  5.363   4.056   1.00 0.00 ? 32 GLN A C    7 
ATOM 3563 O O    . GLN A 1 32 ? -1.900  5.744   3.181   1.00 0.00 ? 32 GLN A O    7 
ATOM 3564 C CB   . GLN A 1 32 ? -1.228  6.373   6.343   1.00 0.00 ? 32 GLN A CB   7 
ATOM 3565 C CG   . GLN A 1 32 ? -0.534  7.338   7.306   1.00 0.00 ? 32 GLN A CG   7 
ATOM 3566 C CD   . GLN A 1 32 ? -0.885  6.964   8.747   1.00 0.00 ? 32 GLN A CD   7 
ATOM 3567 O OE1  . GLN A 1 32 ? -1.994  7.183   9.192   1.00 0.00 ? 32 GLN A OE1  7 
ATOM 3568 N NE2  . GLN A 1 32 ? 0.022   6.403   9.501   1.00 0.00 ? 32 GLN A NE2  7 
ATOM 3569 H H    . GLN A 1 32 ? -1.187  8.005   3.843   1.00 0.00 ? 32 GLN A H    7 
ATOM 3570 H HA   . GLN A 1 32 ? 0.548   6.027   5.194   1.00 0.00 ? 32 GLN A HA   7 
ATOM 3571 H HB2  . GLN A 1 32 ? -2.243  6.704   6.169   1.00 0.00 ? 32 GLN A HB2  7 
ATOM 3572 H HB3  . GLN A 1 32 ? -1.239  5.384   6.773   1.00 0.00 ? 32 GLN A HB3  7 
ATOM 3573 H HG2  . GLN A 1 32 ? 0.536   7.278   7.167   1.00 0.00 ? 32 GLN A HG2  7 
ATOM 3574 H HG3  . GLN A 1 32 ? -0.867  8.346   7.107   1.00 0.00 ? 32 GLN A HG3  7 
ATOM 3575 H HE21 . GLN A 1 32 ? 0.916   6.226   9.142   1.00 0.00 ? 32 GLN A HE21 7 
ATOM 3576 H HE22 . GLN A 1 32 ? -0.193  6.161   10.426  1.00 0.00 ? 32 GLN A HE22 7 
ATOM 3577 N N    . CYS A 1 33 ? -0.876  4.096   4.218   1.00 0.00 ? 33 CYS A N    7 
ATOM 3578 C CA   . CYS A 1 33 ? -1.487  3.071   3.329   1.00 0.00 ? 33 CYS A CA   7 
ATOM 3579 C C    . CYS A 1 33 ? -2.899  2.738   3.823   1.00 0.00 ? 33 CYS A C    7 
ATOM 3580 O O    . CYS A 1 33 ? -3.095  2.330   4.950   1.00 0.00 ? 33 CYS A O    7 
ATOM 3581 C CB   . CYS A 1 33 ? -0.612  1.814   3.367   1.00 0.00 ? 33 CYS A CB   7 
ATOM 3582 S SG   . CYS A 1 33 ? -1.506  0.400   2.666   1.00 0.00 ? 33 CYS A SG   7 
ATOM 3583 H H    . CYS A 1 33 ? -0.260  3.817   4.927   1.00 0.00 ? 33 CYS A H    7 
ATOM 3584 H HA   . CYS A 1 33 ? -1.536  3.447   2.320   1.00 0.00 ? 33 CYS A HA   7 
ATOM 3585 H HB2  . CYS A 1 33 ? 0.285   1.990   2.797   1.00 0.00 ? 33 CYS A HB2  7 
ATOM 3586 H HB3  . CYS A 1 33 ? -0.347  1.598   4.389   1.00 0.00 ? 33 CYS A HB3  7 
ATOM 3587 N N    . LEU A 1 34 ? -3.883  2.906   2.982   1.00 0.00 ? 34 LEU A N    7 
ATOM 3588 C CA   . LEU A 1 34 ? -5.282  2.594   3.394   1.00 0.00 ? 34 LEU A CA   7 
ATOM 3589 C C    . LEU A 1 34 ? -5.911  1.651   2.364   1.00 0.00 ? 34 LEU A C    7 
ATOM 3590 O O    . LEU A 1 34 ? -5.243  1.149   1.483   1.00 0.00 ? 34 LEU A O    7 
ATOM 3591 C CB   . LEU A 1 34 ? -6.096  3.887   3.469   1.00 0.00 ? 34 LEU A CB   7 
ATOM 3592 C CG   . LEU A 1 34 ? -5.398  4.883   4.397   1.00 0.00 ? 34 LEU A CG   7 
ATOM 3593 C CD1  . LEU A 1 34 ? -6.126  6.228   4.342   1.00 0.00 ? 34 LEU A CD1  7 
ATOM 3594 C CD2  . LEU A 1 34 ? -5.423  4.351   5.831   1.00 0.00 ? 34 LEU A CD2  7 
ATOM 3595 H H    . LEU A 1 34 ? -3.702  3.230   2.075   1.00 0.00 ? 34 LEU A H    7 
ATOM 3596 H HA   . LEU A 1 34 ? -5.273  2.115   4.362   1.00 0.00 ? 34 LEU A HA   7 
ATOM 3597 H HB2  . LEU A 1 34 ? -6.182  4.315   2.481   1.00 0.00 ? 34 LEU A HB2  7 
ATOM 3598 H HB3  . LEU A 1 34 ? -7.081  3.671   3.854   1.00 0.00 ? 34 LEU A HB3  7 
ATOM 3599 H HG   . LEU A 1 34 ? -4.373  5.016   4.078   1.00 0.00 ? 34 LEU A HG   7 
ATOM 3600 H HD11 . LEU A 1 34 ? -7.149  6.070   4.035   1.00 0.00 ? 34 LEU A HD11 7 
ATOM 3601 H HD12 . LEU A 1 34 ? -6.110  6.686   5.320   1.00 0.00 ? 34 LEU A HD12 7 
ATOM 3602 H HD13 . LEU A 1 34 ? -5.633  6.875   3.633   1.00 0.00 ? 34 LEU A HD13 7 
ATOM 3603 H HD21 . LEU A 1 34 ? -5.545  3.278   5.815   1.00 0.00 ? 34 LEU A HD21 7 
ATOM 3604 H HD22 . LEU A 1 34 ? -4.494  4.599   6.324   1.00 0.00 ? 34 LEU A HD22 7 
ATOM 3605 H HD23 . LEU A 1 34 ? -6.245  4.799   6.368   1.00 0.00 ? 34 LEU A HD23 7 
ATOM 3606 N N    . CYS A 1 35 ? -7.189  1.407   2.466   1.00 0.00 ? 35 CYS A N    7 
ATOM 3607 C CA   . CYS A 1 35 ? -7.849  0.496   1.488   1.00 0.00 ? 35 CYS A CA   7 
ATOM 3608 C C    . CYS A 1 35 ? -8.721  1.313   0.533   1.00 0.00 ? 35 CYS A C    7 
ATOM 3609 O O    . CYS A 1 35 ? -8.883  2.508   0.691   1.00 0.00 ? 35 CYS A O    7 
ATOM 3610 C CB   . CYS A 1 35 ? -8.720  -0.516  2.237   1.00 0.00 ? 35 CYS A CB   7 
ATOM 3611 S SG   . CYS A 1 35 ? -7.666  -1.640  3.186   1.00 0.00 ? 35 CYS A SG   7 
ATOM 3612 H H    . CYS A 1 35 ? -7.712  1.820   3.184   1.00 0.00 ? 35 CYS A H    7 
ATOM 3613 H HA   . CYS A 1 35 ? -7.096  -0.029  0.922   1.00 0.00 ? 35 CYS A HA   7 
ATOM 3614 H HB2  . CYS A 1 35 ? -9.384  0.008   2.909   1.00 0.00 ? 35 CYS A HB2  7 
ATOM 3615 H HB3  . CYS A 1 35 ? -9.303  -1.083  1.526   1.00 0.00 ? 35 CYS A HB3  7 
ATOM 3616 N N    . ARG A 1 36 ? -9.281  0.678   -0.459  1.00 0.00 ? 36 ARG A N    7 
ATOM 3617 C CA   . ARG A 1 36 ? -10.140 1.415   -1.426  1.00 0.00 ? 36 ARG A CA   7 
ATOM 3618 C C    . ARG A 1 36 ? -10.561 0.473   -2.555  1.00 0.00 ? 36 ARG A C    7 
ATOM 3619 O O    . ARG A 1 36 ? -10.466 0.877   -3.703  1.00 0.00 ? 36 ARG A O    7 
ATOM 3620 C CB   . ARG A 1 36 ? -9.357  2.592   -2.009  1.00 0.00 ? 36 ARG A CB   7 
ATOM 3621 C CG   . ARG A 1 36 ? -10.215 3.856   -1.950  1.00 0.00 ? 36 ARG A CG   7 
ATOM 3622 C CD   . ARG A 1 36 ? -11.213 3.850   -3.109  1.00 0.00 ? 36 ARG A CD   7 
ATOM 3623 N NE   . ARG A 1 36 ? -11.549 5.252   -3.486  1.00 0.00 ? 36 ARG A NE   7 
ATOM 3624 C CZ   . ARG A 1 36 ? -10.603 6.146   -3.588  1.00 0.00 ? 36 ARG A CZ   7 
ATOM 3625 N NH1  . ARG A 1 36 ? -9.602  5.948   -4.402  1.00 0.00 ? 36 ARG A NH1  7 
ATOM 3626 N NH2  . ARG A 1 36 ? -10.662 7.240   -2.878  1.00 0.00 ? 36 ARG A NH2  7 
ATOM 3627 O OXT  . ARG A 1 36 ? -10.971 -0.636  -2.254  1.00 0.00 ? 36 ARG A OXT  7 
ATOM 3628 H H    . ARG A 1 36 ? -9.137  -0.284  -0.568  1.00 0.00 ? 36 ARG A H    7 
ATOM 3629 H HA   . ARG A 1 36 ? -11.018 1.783   -0.919  1.00 0.00 ? 36 ARG A HA   7 
ATOM 3630 H HB2  . ARG A 1 36 ? -8.452  2.741   -1.437  1.00 0.00 ? 36 ARG A HB2  7 
ATOM 3631 H HB3  . ARG A 1 36 ? -9.103  2.381   -3.037  1.00 0.00 ? 36 ARG A HB3  7 
ATOM 3632 H HG2  . ARG A 1 36 ? -10.751 3.883   -1.012  1.00 0.00 ? 36 ARG A HG2  7 
ATOM 3633 H HG3  . ARG A 1 36 ? -9.581  4.726   -2.027  1.00 0.00 ? 36 ARG A HG3  7 
ATOM 3634 H HD2  . ARG A 1 36 ? -10.775 3.344   -3.957  1.00 0.00 ? 36 ARG A HD2  7 
ATOM 3635 H HD3  . ARG A 1 36 ? -12.111 3.333   -2.807  1.00 0.00 ? 36 ARG A HD3  7 
ATOM 3636 H HE   . ARG A 1 36 ? -12.480 5.502   -3.659  1.00 0.00 ? 36 ARG A HE   7 
ATOM 3637 H HH11 . ARG A 1 36 ? -9.559  5.110   -4.946  1.00 0.00 ? 36 ARG A HH11 7 
ATOM 3638 H HH12 . ARG A 1 36 ? -8.879  6.634   -4.481  1.00 0.00 ? 36 ARG A HH12 7 
ATOM 3639 H HH21 . ARG A 1 36 ? -11.430 7.392   -2.257  1.00 0.00 ? 36 ARG A HH21 7 
ATOM 3640 H HH22 . ARG A 1 36 ? -9.938  7.925   -2.956  1.00 0.00 ? 36 ARG A HH22 7 
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