data_9MF8
# 
_entry.id   9MF8 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9MF8         pdb_00009mf8 10.2210/pdb9mf8/pdb 
WWPDB D_1000290814 ?            ?                   
BMRB  31221        ?            10.13018/BMR31221   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-01-22 ? 
2 'Structure model' 1 1 2025-03-26 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume'          
2 2 'Structure model' '_citation_author.identifier_ORCID' 
3 2 'Structure model' '_citation_author.name'             
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_mr                  . 
_pdbx_database_status.entry_id                        9MF8 
_pdbx_database_status.recvd_initial_deposition_date   2024-12-09 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  . 
_pdbx_database_status.status_code_nmr_data            REL 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_database_related.db_name        BMRB 
_pdbx_database_related.details        
'Backbone alpha-Methylation in the Villin Headpiece Miniprotein: HP35 with Aib at Position 15' 
_pdbx_database_related.db_id          31221 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              horne@pitt.edu 
_pdbx_contact_author.name_first         William 
_pdbx_contact_author.name_last          Horne 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2927-1739 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Harmon, T.W.' 1 ? 
'Lin, Y.'      2 ? 
'Sutton, R.T.' 3 ? 
'Osborne, S.'  4 ? 
'Horne, W.S.'  5 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   GE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Chembiochem 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1439-7633 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            26 
_citation.language                  ? 
_citation.page_first                e202401022 
_citation.page_last                 e202401022 
_citation.title                     
'Interplay between C alpha Methylation and C alpha Stereochemistry in the Folding Energetics of a Helix-Rich Miniprotein.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/cbic.202401022 
_citation.pdbx_database_id_PubMed   39791987 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Harmon, T.W.'    1 ?                   
primary 'Lin, Y.'         2 ?                   
primary 'Sutton, R.T.'    3 ?                   
primary 'Osborne, S.W.J.' 4 ?                   
primary 'Seth Horne, W.'  5 0000-0003-2927-1739 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 syn 
_entity.pdbx_description           Villin-1 
_entity.formula_weight             4042.703 
_entity.pdbx_number_of_molecules   1 
_entity.pdbx_ec                    ? 
_entity.pdbx_mutation              ? 
_entity.pdbx_fragment              ? 
_entity.details                    ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       'LSDEDFKAVFG(NLE)TR(AIB)AFANLPLWKQQNLKKEKGLF(NH2)' 
_entity_poly.pdbx_seq_one_letter_code_can   LSDEDFKAVFGLTRAAFANLPLWKQQNLKKEKGLFX 
_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  LEU n 
1 2  SER n 
1 3  ASP n 
1 4  GLU n 
1 5  ASP n 
1 6  PHE n 
1 7  LYS n 
1 8  ALA n 
1 9  VAL n 
1 10 PHE n 
1 11 GLY n 
1 12 NLE n 
1 13 THR n 
1 14 ARG n 
1 15 AIB n 
1 16 ALA n 
1 17 PHE n 
1 18 ALA n 
1 19 ASN n 
1 20 LEU n 
1 21 PRO n 
1 22 LEU n 
1 23 TRP n 
1 24 LYS n 
1 25 GLN n 
1 26 GLN n 
1 27 ASN n 
1 28 LEU n 
1 29 LYS n 
1 30 LYS n 
1 31 GLU n 
1 32 LYS n 
1 33 GLY n 
1 34 LEU n 
1 35 PHE n 
1 36 NH2 n 
# 
_pdbx_entity_src_syn.entity_id              1 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       36 
_pdbx_entity_src_syn.organism_scientific    'Gallus gallus' 
_pdbx_entity_src_syn.organism_common_name   chicken 
_pdbx_entity_src_syn.ncbi_taxonomy_id       9031 
_pdbx_entity_src_syn.details                ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
AIB 'L-peptide linking' n 'ALPHA-AMINOISOBUTYRIC ACID' ? 'C4 H9 N O2'     103.120 
ALA 'L-peptide linking' y ALANINE                      ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                     ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE                   ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'              ? 'C4 H7 N O4'     133.103 
GLN 'L-peptide linking' y GLUTAMINE                    ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'              ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                      ? 'C2 H5 N O2'     75.067  
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 
NH2 non-polymer         . 'AMINO GROUP'                ? 'H2 N'           16.023  
NLE 'L-peptide linking' n NORLEUCINE                   ? 'C6 H13 N O2'    131.173 
PHE 'L-peptide linking' y PHENYLALANINE                ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                      ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE                       ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE                    ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN                   ? 'C11 H12 N2 O2'  204.225 
VAL 'L-peptide linking' y VALINE                       ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  LEU 1  1  1  LEU LEU A . n 
A 1 2  SER 2  2  2  SER SER A . n 
A 1 3  ASP 3  3  3  ASP ASP A . n 
A 1 4  GLU 4  4  4  GLU GLU A . n 
A 1 5  ASP 5  5  5  ASP ASP A . n 
A 1 6  PHE 6  6  6  PHE PHE A . n 
A 1 7  LYS 7  7  7  LYS LYS A . n 
A 1 8  ALA 8  8  8  ALA ALA A . n 
A 1 9  VAL 9  9  9  VAL VAL A . n 
A 1 10 PHE 10 10 10 PHE PHE A . n 
A 1 11 GLY 11 11 11 GLY GLY A . n 
A 1 12 NLE 12 12 12 NLE NLE A . n 
A 1 13 THR 13 13 13 THR THR A . n 
A 1 14 ARG 14 14 14 ARG ARG A . n 
A 1 15 AIB 15 15 15 AIB AIB A . n 
A 1 16 ALA 16 16 16 ALA ALA A . n 
A 1 17 PHE 17 17 17 PHE PHE A . n 
A 1 18 ALA 18 18 18 ALA ALA A . n 
A 1 19 ASN 19 19 19 ASN ASN A . n 
A 1 20 LEU 20 20 20 LEU LEU A . n 
A 1 21 PRO 21 21 21 PRO PRO A . n 
A 1 22 LEU 22 22 22 LEU LEU A . n 
A 1 23 TRP 23 23 23 TRP TRP A . n 
A 1 24 LYS 24 24 24 LYS LYS A . n 
A 1 25 GLN 25 25 25 GLN GLN A . n 
A 1 26 GLN 26 26 26 GLN GLN A . n 
A 1 27 ASN 27 27 27 ASN ASN A . n 
A 1 28 LEU 28 28 28 LEU LEU A . n 
A 1 29 LYS 29 29 29 LYS LYS A . n 
A 1 30 LYS 30 30 30 LYS LYS A . n 
A 1 31 GLU 31 31 31 GLU GLU A . n 
A 1 32 LYS 32 32 32 LYS LYS A . n 
A 1 33 GLY 33 33 33 GLY GLY A . n 
A 1 34 LEU 34 34 34 LEU LEU A . n 
A 1 35 PHE 35 35 35 PHE PHE A . n 
A 1 36 NH2 36 36 36 NH2 NH2 A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        AIB 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   AIB 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9MF8 
_exptl.crystals_number            ? 
_exptl.details                    ? 
_exptl.method                     'SOLUTION NMR' 
_exptl.method_details             ? 
# 
_struct.entry_id                     9MF8 
_struct.title                        'Backbone alpha-Methylation in the Villin Headpiece Miniprotein: HP35 with Aib at Position 15' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9MF8 
_struct_keywords.text            'miniprotein, heterogeneous backbone, proteomimetic, STRUCTURAL PROTEIN' 
_struct_keywords.pdbx_keywords   'STRUCTURAL PROTEIN' 
# 
_struct_asym.id                            A 
_struct_asym.pdbx_blank_PDB_chainid_flag   N 
_struct_asym.pdbx_modified                 N 
_struct_asym.entity_id                     1 
_struct_asym.details                       ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    VILI_CHICK 
_struct_ref.pdbx_db_accession          P02640 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   LSDEDFKAVFGMTRSAFANLPLWKQQNLKKEKGLF 
_struct_ref.pdbx_align_begin           792 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9MF8 
_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                 35 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P02640 
_struct_ref_seq.db_align_beg                  792 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  826 
_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       35 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9MF8 NLE A 12 ? UNP P02640 MET 803 conflict  12 1 
1 9MF8 AIB A 15 ? UNP P02640 SER 806 conflict  15 2 
1 9MF8 NH2 A 36 ? UNP P02640 ?   ?   amidation 36 3 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 SER A 2  ? GLY A 11 ? SER A 2  GLY A 11 1 ? 10 
HELX_P HELX_P2 AA2 THR A 13 ? LEU A 20 ? THR A 13 LEU A 20 1 ? 8  
HELX_P HELX_P3 AA3 PRO A 21 ? LEU A 34 ? PRO A 21 LEU A 34 1 ? 14 
# 
_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 
covale1 covale both ? A GLY 11 C ? ? ? 1_555 A NLE 12 N ? ? A GLY 11 A NLE 12 1_555 ? ? ? ? ? ? ? 1.323 ? ? 
covale2 covale both ? A NLE 12 C ? ? ? 1_555 A THR 13 N ? ? A NLE 12 A THR 13 1_555 ? ? ? ? ? ? ? 1.325 ? ? 
covale3 covale both ? A ARG 14 C ? ? ? 1_555 A AIB 15 N ? ? A ARG 14 A AIB 15 1_555 ? ? ? ? ? ? ? 1.333 ? ? 
covale4 covale both ? A AIB 15 C ? ? ? 1_555 A ALA 16 N ? ? A AIB 15 A ALA 16 1_555 ? ? ? ? ? ? ? 1.330 ? ? 
covale5 covale both ? A PHE 35 C ? ? ? 1_555 A NH2 36 N ? ? A PHE 35 A NH2 36 1_555 ? ? ? ? ? ? ? 1.321 ? ? 
# 
_struct_conn_type.id          covale 
_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 NLE A 12 ? .   . .  . NLE A 12 ? 1_555 .   . .  . .     . . LEU 1  NLE Norleucine  'Named protein modification' 
2 AIB A 15 ? .   . .  . AIB A 15 ? 1_555 .   . .  . .     . . ALA 1  AIB Methylation 'Named protein modification' 
3 NH2 A 36 ? PHE A 35 ? NH2 A 36 ? 1_555 PHE A 35 ? 1_555 . . PHE 15 NH2 None        'Terminal amidation'         
# 
_pdbx_entry_details.entry_id                   9MF8 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_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 5  LYS A 32 ? ? -90.15  -65.76 
2 5  LEU A 34 ? ? -95.66  -81.41 
3 8  LEU A 34 ? ? -143.30 -53.53 
4 9  LEU A 34 ? ? -149.62 -34.20 
5 10 LEU A 34 ? ? -108.41 -87.89 
# 
_pdbx_nmr_ensemble.entry_id                                      9MF8 
_pdbx_nmr_ensemble.conformers_calculated_total_number            100 
_pdbx_nmr_ensemble.conformers_submitted_total_number             10 
_pdbx_nmr_ensemble.conformer_selection_criteria                  'structures with the lowest energy' 
_pdbx_nmr_ensemble.representative_conformer                      ? 
_pdbx_nmr_ensemble.average_constraints_per_residue               ? 
_pdbx_nmr_ensemble.average_constraint_violations_per_residue     ? 
_pdbx_nmr_ensemble.maximum_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.average_distance_constraint_violation         ? 
_pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation   ? 
_pdbx_nmr_ensemble.distance_constraint_violation_method          ? 
_pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.average_torsion_angle_constraint_violation    ? 
_pdbx_nmr_ensemble.torsion_angle_constraint_violation_method     ? 
# 
_pdbx_nmr_representative.entry_id             9MF8 
_pdbx_nmr_representative.conformer_id         1 
_pdbx_nmr_representative.selection_criteria   'lowest energy' 
# 
_pdbx_nmr_sample_details.solution_id      1 
_pdbx_nmr_sample_details.contents         '0.47 mM Villin-1 headpiece: Met12Nle, Ser15Aib, 0.15 mM DSS, 90% H2O/10% D2O' 
_pdbx_nmr_sample_details.solvent_system   '90% H2O/10% D2O' 
_pdbx_nmr_sample_details.label            sample_1 
_pdbx_nmr_sample_details.type             solution 
_pdbx_nmr_sample_details.details          ? 
# 
loop_
_pdbx_nmr_exptl_sample.solution_id 
_pdbx_nmr_exptl_sample.component 
_pdbx_nmr_exptl_sample.concentration 
_pdbx_nmr_exptl_sample.concentration_range 
_pdbx_nmr_exptl_sample.concentration_units 
_pdbx_nmr_exptl_sample.isotopic_labeling 
1 'Villin-1 headpiece: Met12Nle, Ser15Aib' 0.47 ? mM 'natural abundance' 
1 DSS                                      0.15 ? mM 'natural abundance' 
# 
_pdbx_nmr_exptl_sample_conditions.conditions_id          1 
_pdbx_nmr_exptl_sample_conditions.temperature            288 
_pdbx_nmr_exptl_sample_conditions.pressure_units         atm 
_pdbx_nmr_exptl_sample_conditions.pressure               1 
_pdbx_nmr_exptl_sample_conditions.pH                     5 
_pdbx_nmr_exptl_sample_conditions.ionic_strength         10 
_pdbx_nmr_exptl_sample_conditions.details                ? 
_pdbx_nmr_exptl_sample_conditions.ionic_strength_err     ? 
_pdbx_nmr_exptl_sample_conditions.ionic_strength_units   mM 
_pdbx_nmr_exptl_sample_conditions.label                  conditions_1 
_pdbx_nmr_exptl_sample_conditions.pH_err                 ? 
_pdbx_nmr_exptl_sample_conditions.pH_units               pH* 
_pdbx_nmr_exptl_sample_conditions.pressure_err           ? 
_pdbx_nmr_exptl_sample_conditions.temperature_err        ? 
_pdbx_nmr_exptl_sample_conditions.temperature_units      K 
# 
loop_
_pdbx_nmr_exptl.experiment_id 
_pdbx_nmr_exptl.conditions_id 
_pdbx_nmr_exptl.solution_id 
_pdbx_nmr_exptl.type 
_pdbx_nmr_exptl.spectrometer_id 
_pdbx_nmr_exptl.sample_state 
1 1 1 '2D 1H-1H TOCSY' 1 isotropic 
2 1 1 '2D 1H-1H COSY'  1 isotropic 
3 1 1 '2D 1H-1H NOESY' 1 isotropic 
# 
_pdbx_nmr_refine.entry_id           9MF8 
_pdbx_nmr_refine.method             'simulated annealing' 
_pdbx_nmr_refine.details            ? 
_pdbx_nmr_refine.software_ordinal   4 
# 
loop_
_pdbx_nmr_software.ordinal 
_pdbx_nmr_software.classification 
_pdbx_nmr_software.name 
_pdbx_nmr_software.version 
_pdbx_nmr_software.authors 
1 processing              TopSpin ? 'Bruker Biospin'                                     
2 'data analysis'         Poky    ? 'Manthey, Tonelli, Clos II, Rahimi, Markley and Lee' 
3 'peak picking'          Poky    ? 'Manthey, Tonelli, Clos II, Rahimi, Markley and Lee' 
4 'structure calculation' ARIA    ? 
;Linge, O'Donoghue and Nilges
;
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
AIB N    N N N 1   
AIB CA   C N N 2   
AIB C    C N N 3   
AIB O    O N N 4   
AIB OXT  O N N 5   
AIB CB1  C N N 6   
AIB CB2  C N N 7   
AIB H    H N N 8   
AIB H2   H N N 9   
AIB HXT  H N N 10  
AIB HB11 H N N 11  
AIB HB12 H N N 12  
AIB HB13 H N N 13  
AIB HB21 H N N 14  
AIB HB22 H N N 15  
AIB HB23 H N N 16  
ALA N    N N N 17  
ALA CA   C N S 18  
ALA C    C N N 19  
ALA O    O N N 20  
ALA CB   C N N 21  
ALA OXT  O N N 22  
ALA H    H N N 23  
ALA H2   H N N 24  
ALA HA   H N N 25  
ALA HB1  H N N 26  
ALA HB2  H N N 27  
ALA HB3  H N N 28  
ALA HXT  H N N 29  
ARG N    N N N 30  
ARG CA   C N S 31  
ARG C    C N N 32  
ARG O    O N N 33  
ARG CB   C N N 34  
ARG CG   C N N 35  
ARG CD   C N N 36  
ARG NE   N N N 37  
ARG CZ   C N N 38  
ARG NH1  N N N 39  
ARG NH2  N N N 40  
ARG OXT  O N N 41  
ARG H    H N N 42  
ARG H2   H N N 43  
ARG HA   H N N 44  
ARG HB2  H N N 45  
ARG HB3  H N N 46  
ARG HG2  H N N 47  
ARG HG3  H N N 48  
ARG HD2  H N N 49  
ARG HD3  H N N 50  
ARG HE   H N N 51  
ARG HH11 H N N 52  
ARG HH12 H N N 53  
ARG HH21 H N N 54  
ARG HH22 H N N 55  
ARG HXT  H N N 56  
ASN N    N N N 57  
ASN CA   C N S 58  
ASN C    C N N 59  
ASN O    O N N 60  
ASN CB   C N N 61  
ASN CG   C N N 62  
ASN OD1  O N N 63  
ASN ND2  N N N 64  
ASN OXT  O N N 65  
ASN H    H N N 66  
ASN H2   H N N 67  
ASN HA   H N N 68  
ASN HB2  H N N 69  
ASN HB3  H N N 70  
ASN HD21 H N N 71  
ASN HD22 H N N 72  
ASN HXT  H N N 73  
ASP N    N N N 74  
ASP CA   C N S 75  
ASP C    C N N 76  
ASP O    O N N 77  
ASP CB   C N N 78  
ASP CG   C N N 79  
ASP OD1  O N N 80  
ASP OD2  O N N 81  
ASP OXT  O N N 82  
ASP H    H N N 83  
ASP H2   H N N 84  
ASP HA   H N N 85  
ASP HB2  H N N 86  
ASP HB3  H N N 87  
ASP HD2  H N N 88  
ASP HXT  H N N 89  
GLN N    N N N 90  
GLN CA   C N S 91  
GLN C    C N N 92  
GLN O    O N N 93  
GLN CB   C N N 94  
GLN CG   C N N 95  
GLN CD   C N N 96  
GLN OE1  O N N 97  
GLN NE2  N N N 98  
GLN OXT  O N N 99  
GLN H    H N N 100 
GLN H2   H N N 101 
GLN HA   H N N 102 
GLN HB2  H N N 103 
GLN HB3  H N N 104 
GLN HG2  H N N 105 
GLN HG3  H N N 106 
GLN HE21 H N N 107 
GLN HE22 H N N 108 
GLN HXT  H N N 109 
GLU N    N N N 110 
GLU CA   C N S 111 
GLU C    C N N 112 
GLU O    O N N 113 
GLU CB   C N N 114 
GLU CG   C N N 115 
GLU CD   C N N 116 
GLU OE1  O N N 117 
GLU OE2  O N N 118 
GLU OXT  O N N 119 
GLU H    H N N 120 
GLU H2   H N N 121 
GLU HA   H N N 122 
GLU HB2  H N N 123 
GLU HB3  H N N 124 
GLU HG2  H N N 125 
GLU HG3  H N N 126 
GLU HE2  H N N 127 
GLU HXT  H N N 128 
GLY N    N N N 129 
GLY CA   C N N 130 
GLY C    C N N 131 
GLY O    O N N 132 
GLY OXT  O N N 133 
GLY H    H N N 134 
GLY H2   H N N 135 
GLY HA2  H N N 136 
GLY HA3  H N N 137 
GLY HXT  H N N 138 
LEU N    N N N 139 
LEU CA   C N S 140 
LEU C    C N N 141 
LEU O    O N N 142 
LEU CB   C N N 143 
LEU CG   C N N 144 
LEU CD1  C N N 145 
LEU CD2  C N N 146 
LEU OXT  O N N 147 
LEU H    H N N 148 
LEU H2   H N N 149 
LEU HA   H N N 150 
LEU HB2  H N N 151 
LEU HB3  H N N 152 
LEU HG   H N N 153 
LEU HD11 H N N 154 
LEU HD12 H N N 155 
LEU HD13 H N N 156 
LEU HD21 H N N 157 
LEU HD22 H N N 158 
LEU HD23 H N N 159 
LEU HXT  H N N 160 
LYS N    N N N 161 
LYS CA   C N S 162 
LYS C    C N N 163 
LYS O    O N N 164 
LYS CB   C N N 165 
LYS CG   C N N 166 
LYS CD   C N N 167 
LYS CE   C N N 168 
LYS NZ   N N N 169 
LYS OXT  O N N 170 
LYS H    H N N 171 
LYS H2   H N N 172 
LYS HA   H N N 173 
LYS HB2  H N N 174 
LYS HB3  H N N 175 
LYS HG2  H N N 176 
LYS HG3  H N N 177 
LYS HD2  H N N 178 
LYS HD3  H N N 179 
LYS HE2  H N N 180 
LYS HE3  H N N 181 
LYS HZ1  H N N 182 
LYS HZ2  H N N 183 
LYS HZ3  H N N 184 
LYS HXT  H N N 185 
MET N    N N N 186 
MET CA   C N S 187 
MET C    C N N 188 
MET O    O N N 189 
MET CB   C N N 190 
MET CG   C N N 191 
MET SD   S N N 192 
MET CE   C N N 193 
MET OXT  O N N 194 
MET H    H N N 195 
MET H2   H N N 196 
MET HA   H N N 197 
MET HB2  H N N 198 
MET HB3  H N N 199 
MET HG2  H N N 200 
MET HG3  H N N 201 
MET HE1  H N N 202 
MET HE2  H N N 203 
MET HE3  H N N 204 
MET HXT  H N N 205 
NH2 N    N N N 206 
NH2 HN1  H N N 207 
NH2 HN2  H N N 208 
NLE N    N N N 209 
NLE CA   C N S 210 
NLE C    C N N 211 
NLE O    O N N 212 
NLE OXT  O N N 213 
NLE CB   C N N 214 
NLE CG   C N N 215 
NLE CD   C N N 216 
NLE CE   C N N 217 
NLE H    H N N 218 
NLE H2   H N N 219 
NLE HA   H N N 220 
NLE HXT  H N N 221 
NLE HB2  H N N 222 
NLE HB3  H N N 223 
NLE HG2  H N N 224 
NLE HG3  H N N 225 
NLE HD2  H N N 226 
NLE HD3  H N N 227 
NLE HE1  H N N 228 
NLE HE2  H N N 229 
NLE HE3  H N N 230 
PHE N    N N N 231 
PHE CA   C N S 232 
PHE C    C N N 233 
PHE O    O N N 234 
PHE CB   C N N 235 
PHE CG   C Y N 236 
PHE CD1  C Y N 237 
PHE CD2  C Y N 238 
PHE CE1  C Y N 239 
PHE CE2  C Y N 240 
PHE CZ   C Y N 241 
PHE OXT  O N N 242 
PHE H    H N N 243 
PHE H2   H N N 244 
PHE HA   H N N 245 
PHE HB2  H N N 246 
PHE HB3  H N N 247 
PHE HD1  H N N 248 
PHE HD2  H N N 249 
PHE HE1  H N N 250 
PHE HE2  H N N 251 
PHE HZ   H N N 252 
PHE HXT  H N N 253 
PRO N    N N N 254 
PRO CA   C N S 255 
PRO C    C N N 256 
PRO O    O N N 257 
PRO CB   C N N 258 
PRO CG   C N N 259 
PRO CD   C N N 260 
PRO OXT  O N N 261 
PRO H    H N N 262 
PRO HA   H N N 263 
PRO HB2  H N N 264 
PRO HB3  H N N 265 
PRO HG2  H N N 266 
PRO HG3  H N N 267 
PRO HD2  H N N 268 
PRO HD3  H N N 269 
PRO HXT  H N N 270 
SER N    N N N 271 
SER CA   C N S 272 
SER C    C N N 273 
SER O    O N N 274 
SER CB   C N N 275 
SER OG   O N N 276 
SER OXT  O N N 277 
SER H    H N N 278 
SER H2   H N N 279 
SER HA   H N N 280 
SER HB2  H N N 281 
SER HB3  H N N 282 
SER HG   H N N 283 
SER HXT  H N N 284 
THR N    N N N 285 
THR CA   C N S 286 
THR C    C N N 287 
THR O    O N N 288 
THR CB   C N R 289 
THR OG1  O N N 290 
THR CG2  C N N 291 
THR OXT  O N N 292 
THR H    H N N 293 
THR H2   H N N 294 
THR HA   H N N 295 
THR HB   H N N 296 
THR HG1  H N N 297 
THR HG21 H N N 298 
THR HG22 H N N 299 
THR HG23 H N N 300 
THR HXT  H N N 301 
TRP N    N N N 302 
TRP CA   C N S 303 
TRP C    C N N 304 
TRP O    O N N 305 
TRP CB   C N N 306 
TRP CG   C Y N 307 
TRP CD1  C Y N 308 
TRP CD2  C Y N 309 
TRP NE1  N Y N 310 
TRP CE2  C Y N 311 
TRP CE3  C Y N 312 
TRP CZ2  C Y N 313 
TRP CZ3  C Y N 314 
TRP CH2  C Y N 315 
TRP OXT  O N N 316 
TRP H    H N N 317 
TRP H2   H N N 318 
TRP HA   H N N 319 
TRP HB2  H N N 320 
TRP HB3  H N N 321 
TRP HD1  H N N 322 
TRP HE1  H N N 323 
TRP HE3  H N N 324 
TRP HZ2  H N N 325 
TRP HZ3  H N N 326 
TRP HH2  H N N 327 
TRP HXT  H N N 328 
VAL N    N N N 329 
VAL CA   C N S 330 
VAL C    C N N 331 
VAL O    O N N 332 
VAL CB   C N N 333 
VAL CG1  C N N 334 
VAL CG2  C N N 335 
VAL OXT  O N N 336 
VAL H    H N N 337 
VAL H2   H N N 338 
VAL HA   H N N 339 
VAL HB   H N N 340 
VAL HG11 H N N 341 
VAL HG12 H N N 342 
VAL HG13 H N N 343 
VAL HG21 H N N 344 
VAL HG22 H N N 345 
VAL HG23 H N N 346 
VAL HXT  H N N 347 
# 
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 
AIB N   CA   sing N N 1   
AIB N   H    sing N N 2   
AIB N   H2   sing N N 3   
AIB CA  C    sing N N 4   
AIB CA  CB1  sing N N 5   
AIB CA  CB2  sing N N 6   
AIB C   O    doub N N 7   
AIB C   OXT  sing N N 8   
AIB OXT HXT  sing N N 9   
AIB CB1 HB11 sing N N 10  
AIB CB1 HB12 sing N N 11  
AIB CB1 HB13 sing N N 12  
AIB CB2 HB21 sing N N 13  
AIB CB2 HB22 sing N N 14  
AIB CB2 HB23 sing N N 15  
ALA N   CA   sing N N 16  
ALA N   H    sing N N 17  
ALA N   H2   sing N N 18  
ALA CA  C    sing N N 19  
ALA CA  CB   sing N N 20  
ALA CA  HA   sing N N 21  
ALA C   O    doub N N 22  
ALA C   OXT  sing N N 23  
ALA CB  HB1  sing N N 24  
ALA CB  HB2  sing N N 25  
ALA CB  HB3  sing N N 26  
ALA OXT HXT  sing N N 27  
ARG N   CA   sing N N 28  
ARG N   H    sing N N 29  
ARG N   H2   sing N N 30  
ARG CA  C    sing N N 31  
ARG CA  CB   sing N N 32  
ARG CA  HA   sing N N 33  
ARG C   O    doub N N 34  
ARG C   OXT  sing N N 35  
ARG CB  CG   sing N N 36  
ARG CB  HB2  sing N N 37  
ARG CB  HB3  sing N N 38  
ARG CG  CD   sing N N 39  
ARG CG  HG2  sing N N 40  
ARG CG  HG3  sing N N 41  
ARG CD  NE   sing N N 42  
ARG CD  HD2  sing N N 43  
ARG CD  HD3  sing N N 44  
ARG NE  CZ   sing N N 45  
ARG NE  HE   sing N N 46  
ARG CZ  NH1  sing N N 47  
ARG CZ  NH2  doub N N 48  
ARG NH1 HH11 sing N N 49  
ARG NH1 HH12 sing N N 50  
ARG NH2 HH21 sing N N 51  
ARG NH2 HH22 sing N N 52  
ARG OXT HXT  sing N N 53  
ASN N   CA   sing N N 54  
ASN N   H    sing N N 55  
ASN N   H2   sing N N 56  
ASN CA  C    sing N N 57  
ASN CA  CB   sing N N 58  
ASN CA  HA   sing N N 59  
ASN C   O    doub N N 60  
ASN C   OXT  sing N N 61  
ASN CB  CG   sing N N 62  
ASN CB  HB2  sing N N 63  
ASN CB  HB3  sing N N 64  
ASN CG  OD1  doub N N 65  
ASN CG  ND2  sing N N 66  
ASN ND2 HD21 sing N N 67  
ASN ND2 HD22 sing N N 68  
ASN OXT HXT  sing N N 69  
ASP N   CA   sing N N 70  
ASP N   H    sing N N 71  
ASP N   H2   sing N N 72  
ASP CA  C    sing N N 73  
ASP CA  CB   sing N N 74  
ASP CA  HA   sing N N 75  
ASP C   O    doub N N 76  
ASP C   OXT  sing N N 77  
ASP CB  CG   sing N N 78  
ASP CB  HB2  sing N N 79  
ASP CB  HB3  sing N N 80  
ASP CG  OD1  doub N N 81  
ASP CG  OD2  sing N N 82  
ASP OD2 HD2  sing N N 83  
ASP OXT HXT  sing N N 84  
GLN N   CA   sing N N 85  
GLN N   H    sing N N 86  
GLN N   H2   sing N N 87  
GLN CA  C    sing N N 88  
GLN CA  CB   sing N N 89  
GLN CA  HA   sing N N 90  
GLN C   O    doub N N 91  
GLN C   OXT  sing N N 92  
GLN CB  CG   sing N N 93  
GLN CB  HB2  sing N N 94  
GLN CB  HB3  sing N N 95  
GLN CG  CD   sing N N 96  
GLN CG  HG2  sing N N 97  
GLN CG  HG3  sing N N 98  
GLN CD  OE1  doub N N 99  
GLN CD  NE2  sing N N 100 
GLN NE2 HE21 sing N N 101 
GLN NE2 HE22 sing N N 102 
GLN OXT HXT  sing N N 103 
GLU N   CA   sing N N 104 
GLU N   H    sing N N 105 
GLU N   H2   sing N N 106 
GLU CA  C    sing N N 107 
GLU CA  CB   sing N N 108 
GLU CA  HA   sing N N 109 
GLU C   O    doub N N 110 
GLU C   OXT  sing N N 111 
GLU CB  CG   sing N N 112 
GLU CB  HB2  sing N N 113 
GLU CB  HB3  sing N N 114 
GLU CG  CD   sing N N 115 
GLU CG  HG2  sing N N 116 
GLU CG  HG3  sing N N 117 
GLU CD  OE1  doub N N 118 
GLU CD  OE2  sing N N 119 
GLU OE2 HE2  sing N N 120 
GLU OXT HXT  sing N N 121 
GLY N   CA   sing N N 122 
GLY N   H    sing N N 123 
GLY N   H2   sing N N 124 
GLY CA  C    sing N N 125 
GLY CA  HA2  sing N N 126 
GLY CA  HA3  sing N N 127 
GLY C   O    doub N N 128 
GLY C   OXT  sing N N 129 
GLY OXT HXT  sing N N 130 
LEU N   CA   sing N N 131 
LEU N   H    sing N N 132 
LEU N   H2   sing N N 133 
LEU CA  C    sing N N 134 
LEU CA  CB   sing N N 135 
LEU CA  HA   sing N N 136 
LEU C   O    doub N N 137 
LEU C   OXT  sing N N 138 
LEU CB  CG   sing N N 139 
LEU CB  HB2  sing N N 140 
LEU CB  HB3  sing N N 141 
LEU CG  CD1  sing N N 142 
LEU CG  CD2  sing N N 143 
LEU CG  HG   sing N N 144 
LEU CD1 HD11 sing N N 145 
LEU CD1 HD12 sing N N 146 
LEU CD1 HD13 sing N N 147 
LEU CD2 HD21 sing N N 148 
LEU CD2 HD22 sing N N 149 
LEU CD2 HD23 sing N N 150 
LEU OXT HXT  sing N N 151 
LYS N   CA   sing N N 152 
LYS N   H    sing N N 153 
LYS N   H2   sing N N 154 
LYS CA  C    sing N N 155 
LYS CA  CB   sing N N 156 
LYS CA  HA   sing N N 157 
LYS C   O    doub N N 158 
LYS C   OXT  sing N N 159 
LYS CB  CG   sing N N 160 
LYS CB  HB2  sing N N 161 
LYS CB  HB3  sing N N 162 
LYS CG  CD   sing N N 163 
LYS CG  HG2  sing N N 164 
LYS CG  HG3  sing N N 165 
LYS CD  CE   sing N N 166 
LYS CD  HD2  sing N N 167 
LYS CD  HD3  sing N N 168 
LYS CE  NZ   sing N N 169 
LYS CE  HE2  sing N N 170 
LYS CE  HE3  sing N N 171 
LYS NZ  HZ1  sing N N 172 
LYS NZ  HZ2  sing N N 173 
LYS NZ  HZ3  sing N N 174 
LYS OXT HXT  sing N N 175 
MET N   CA   sing N N 176 
MET N   H    sing N N 177 
MET N   H2   sing N N 178 
MET CA  C    sing N N 179 
MET CA  CB   sing N N 180 
MET CA  HA   sing N N 181 
MET C   O    doub N N 182 
MET C   OXT  sing N N 183 
MET CB  CG   sing N N 184 
MET CB  HB2  sing N N 185 
MET CB  HB3  sing N N 186 
MET CG  SD   sing N N 187 
MET CG  HG2  sing N N 188 
MET CG  HG3  sing N N 189 
MET SD  CE   sing N N 190 
MET CE  HE1  sing N N 191 
MET CE  HE2  sing N N 192 
MET CE  HE3  sing N N 193 
MET OXT HXT  sing N N 194 
NH2 N   HN1  sing N N 195 
NH2 N   HN2  sing N N 196 
NLE N   CA   sing N N 197 
NLE N   H    sing N N 198 
NLE N   H2   sing N N 199 
NLE CA  C    sing N N 200 
NLE CA  CB   sing N N 201 
NLE CA  HA   sing N N 202 
NLE C   O    doub N N 203 
NLE C   OXT  sing N N 204 
NLE OXT HXT  sing N N 205 
NLE CB  CG   sing N N 206 
NLE CB  HB2  sing N N 207 
NLE CB  HB3  sing N N 208 
NLE CG  CD   sing N N 209 
NLE CG  HG2  sing N N 210 
NLE CG  HG3  sing N N 211 
NLE CD  CE   sing N N 212 
NLE CD  HD2  sing N N 213 
NLE CD  HD3  sing N N 214 
NLE CE  HE1  sing N N 215 
NLE CE  HE2  sing N N 216 
NLE CE  HE3  sing N N 217 
PHE N   CA   sing N N 218 
PHE N   H    sing N N 219 
PHE N   H2   sing N N 220 
PHE CA  C    sing N N 221 
PHE CA  CB   sing N N 222 
PHE CA  HA   sing N N 223 
PHE C   O    doub N N 224 
PHE C   OXT  sing N N 225 
PHE CB  CG   sing N N 226 
PHE CB  HB2  sing N N 227 
PHE CB  HB3  sing N N 228 
PHE CG  CD1  doub Y N 229 
PHE CG  CD2  sing Y N 230 
PHE CD1 CE1  sing Y N 231 
PHE CD1 HD1  sing N N 232 
PHE CD2 CE2  doub Y N 233 
PHE CD2 HD2  sing N N 234 
PHE CE1 CZ   doub Y N 235 
PHE CE1 HE1  sing N N 236 
PHE CE2 CZ   sing Y N 237 
PHE CE2 HE2  sing N N 238 
PHE CZ  HZ   sing N N 239 
PHE OXT HXT  sing N N 240 
PRO N   CA   sing N N 241 
PRO N   CD   sing N N 242 
PRO N   H    sing N N 243 
PRO CA  C    sing N N 244 
PRO CA  CB   sing N N 245 
PRO CA  HA   sing N N 246 
PRO C   O    doub N N 247 
PRO C   OXT  sing N N 248 
PRO CB  CG   sing N N 249 
PRO CB  HB2  sing N N 250 
PRO CB  HB3  sing N N 251 
PRO CG  CD   sing N N 252 
PRO CG  HG2  sing N N 253 
PRO CG  HG3  sing N N 254 
PRO CD  HD2  sing N N 255 
PRO CD  HD3  sing N N 256 
PRO OXT HXT  sing N N 257 
SER N   CA   sing N N 258 
SER N   H    sing N N 259 
SER N   H2   sing N N 260 
SER CA  C    sing N N 261 
SER CA  CB   sing N N 262 
SER CA  HA   sing N N 263 
SER C   O    doub N N 264 
SER C   OXT  sing N N 265 
SER CB  OG   sing N N 266 
SER CB  HB2  sing N N 267 
SER CB  HB3  sing N N 268 
SER OG  HG   sing N N 269 
SER OXT HXT  sing N N 270 
THR N   CA   sing N N 271 
THR N   H    sing N N 272 
THR N   H2   sing N N 273 
THR CA  C    sing N N 274 
THR CA  CB   sing N N 275 
THR CA  HA   sing N N 276 
THR C   O    doub N N 277 
THR C   OXT  sing N N 278 
THR CB  OG1  sing N N 279 
THR CB  CG2  sing N N 280 
THR CB  HB   sing N N 281 
THR OG1 HG1  sing N N 282 
THR CG2 HG21 sing N N 283 
THR CG2 HG22 sing N N 284 
THR CG2 HG23 sing N N 285 
THR OXT HXT  sing N N 286 
TRP N   CA   sing N N 287 
TRP N   H    sing N N 288 
TRP N   H2   sing N N 289 
TRP CA  C    sing N N 290 
TRP CA  CB   sing N N 291 
TRP CA  HA   sing N N 292 
TRP C   O    doub N N 293 
TRP C   OXT  sing N N 294 
TRP CB  CG   sing N N 295 
TRP CB  HB2  sing N N 296 
TRP CB  HB3  sing N N 297 
TRP CG  CD1  doub Y N 298 
TRP CG  CD2  sing Y N 299 
TRP CD1 NE1  sing Y N 300 
TRP CD1 HD1  sing N N 301 
TRP CD2 CE2  doub Y N 302 
TRP CD2 CE3  sing Y N 303 
TRP NE1 CE2  sing Y N 304 
TRP NE1 HE1  sing N N 305 
TRP CE2 CZ2  sing Y N 306 
TRP CE3 CZ3  doub Y N 307 
TRP CE3 HE3  sing N N 308 
TRP CZ2 CH2  doub Y N 309 
TRP CZ2 HZ2  sing N N 310 
TRP CZ3 CH2  sing Y N 311 
TRP CZ3 HZ3  sing N N 312 
TRP CH2 HH2  sing N N 313 
TRP OXT HXT  sing N N 314 
VAL N   CA   sing N N 315 
VAL N   H    sing N N 316 
VAL N   H2   sing N N 317 
VAL CA  C    sing N N 318 
VAL CA  CB   sing N N 319 
VAL CA  HA   sing N N 320 
VAL C   O    doub N N 321 
VAL C   OXT  sing N N 322 
VAL CB  CG1  sing N N 323 
VAL CB  CG2  sing N N 324 
VAL CB  HB   sing N N 325 
VAL CG1 HG11 sing N N 326 
VAL CG1 HG12 sing N N 327 
VAL CG1 HG13 sing N N 328 
VAL CG2 HG21 sing N N 329 
VAL CG2 HG22 sing N N 330 
VAL CG2 HG23 sing N N 331 
VAL OXT HXT  sing N N 332 
# 
_pdbx_audit_support.funding_organization   
'National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           R35GM149220 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_nmr_spectrometer.spectrometer_id   1 
_pdbx_nmr_spectrometer.model             'AVANCE III' 
_pdbx_nmr_spectrometer.type              ? 
_pdbx_nmr_spectrometer.manufacturer      Bruker 
_pdbx_nmr_spectrometer.field_strength    700 
_pdbx_nmr_spectrometer.details           ? 
# 
_atom_sites.entry_id                    9MF8 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   1.000000 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   1.000000 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   1.000000 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
H 
N 
O 
# 
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    . LEU A 1 1  ? -6.239  4.392   7.368  1.00 1.11 ?  1  LEU A N    1  
ATOM   2    C CA   . LEU A 1 1  ? -6.837  4.477   6.017  1.00 0.77 ?  1  LEU A CA   1  
ATOM   3    C C    . LEU A 1 1  ? -7.979  3.483   5.878  1.00 0.62 ?  1  LEU A C    1  
ATOM   4    O O    . LEU A 1 1  ? -7.816  2.299   6.176  1.00 0.66 ?  1  LEU A O    1  
ATOM   5    C CB   . LEU A 1 1  ? -5.785  4.193   4.938  1.00 0.91 ?  1  LEU A CB   1  
ATOM   6    C CG   . LEU A 1 1  ? -4.652  5.216   4.822  1.00 1.01 ?  1  LEU A CG   1  
ATOM   7    C CD1  . LEU A 1 1  ? -3.608  4.739   3.827  1.00 1.23 ?  1  LEU A CD1  1  
ATOM   8    C CD2  . LEU A 1 1  ? -5.194  6.572   4.401  1.00 1.78 ?  1  LEU A CD2  1  
ATOM   9    H H1   . LEU A 1 1  ? -6.943  4.665   8.085  1.00 1.40 ?  1  LEU A H1   1  
ATOM   10   H H2   . LEU A 1 1  ? -5.420  5.026   7.442  1.00 1.62 ?  1  LEU A H2   1  
ATOM   11   H H3   . LEU A 1 1  ? -5.929  3.418   7.560  1.00 1.61 ?  1  LEU A H3   1  
ATOM   12   H HA   . LEU A 1 1  ? -7.224  5.474   5.879  1.00 0.75 ?  1  LEU A HA   1  
ATOM   13   H HB2  . LEU A 1 1  ? -5.348  3.228   5.141  1.00 1.23 ?  1  LEU A HB2  1  
ATOM   14   H HB3  . LEU A 1 1  ? -6.289  4.143   3.984  1.00 1.43 ?  1  LEU A HB3  1  
ATOM   15   H HG   . LEU A 1 1  ? -4.173  5.327   5.783  1.00 1.75 ?  1  LEU A HG   1  
ATOM   16   H HD11 . LEU A 1 1  ? -2.834  5.486   3.731  1.00 1.48 ?  1  LEU A HD11 1  
ATOM   17   H HD12 . LEU A 1 1  ? -4.075  4.579   2.865  1.00 1.80 ?  1  LEU A HD12 1  
ATOM   18   H HD13 . LEU A 1 1  ? -3.175  3.815   4.175  1.00 1.91 ?  1  LEU A HD13 1  
ATOM   19   H HD21 . LEU A 1 1  ? -5.873  6.937   5.155  1.00 2.17 ?  1  LEU A HD21 1  
ATOM   20   H HD22 . LEU A 1 1  ? -5.718  6.473   3.461  1.00 2.45 ?  1  LEU A HD22 1  
ATOM   21   H HD23 . LEU A 1 1  ? -4.376  7.267   4.286  1.00 2.19 ?  1  LEU A HD23 1  
ATOM   22   N N    . SER A 1 2  ? -9.134  3.967   5.440  1.00 0.58 ?  2  SER A N    1  
ATOM   23   C CA   . SER A 1 2  ? -10.245 3.088   5.115  1.00 0.59 ?  2  SER A CA   1  
ATOM   24   C C    . SER A 1 2  ? -9.861  2.247   3.904  1.00 0.53 ?  2  SER A C    1  
ATOM   25   O O    . SER A 1 2  ? -9.224  2.761   2.999  1.00 0.45 ?  2  SER A O    1  
ATOM   26   C CB   . SER A 1 2  ? -11.497 3.912   4.817  1.00 0.72 ?  2  SER A CB   1  
ATOM   27   O OG   . SER A 1 2  ? -11.735 4.863   5.840  1.00 1.28 ?  2  SER A OG   1  
ATOM   28   H H    . SER A 1 2  ? -9.242  4.939   5.331  1.00 0.63 ?  2  SER A H    1  
ATOM   29   H HA   . SER A 1 2  ? -10.428 2.441   5.958  1.00 0.67 ?  2  SER A HA   1  
ATOM   30   H HB2  . SER A 1 2  ? -11.371 4.433   3.879  1.00 1.39 ?  2  SER A HB2  1  
ATOM   31   H HB3  . SER A 1 2  ? -12.350 3.252   4.751  1.00 1.05 ?  2  SER A HB3  1  
ATOM   32   H HG   . SER A 1 2  ? -11.212 4.631   6.620  1.00 1.66 ?  2  SER A HG   1  
ATOM   33   N N    . ASP A 1 3  ? -10.234 0.972   3.897  1.00 0.61 ?  3  ASP A N    1  
ATOM   34   C CA   . ASP A 1 3  ? -9.760  0.018   2.880  1.00 0.60 ?  3  ASP A CA   1  
ATOM   35   C C    . ASP A 1 3  ? -9.865  0.566   1.454  1.00 0.49 ?  3  ASP A C    1  
ATOM   36   O O    . ASP A 1 3  ? -8.928  0.440   0.664  1.00 0.40 ?  3  ASP A O    1  
ATOM   37   C CB   . ASP A 1 3  ? -10.536 -1.293  2.981  1.00 0.76 ?  3  ASP A CB   1  
ATOM   38   C CG   . ASP A 1 3  ? -10.135 -2.289  1.913  1.00 1.42 ?  3  ASP A CG   1  
ATOM   39   O OD1  . ASP A 1 3  ? -8.975  -2.754  1.927  1.00 1.93 ?  3  ASP A OD1  1  
ATOM   40   O OD2  . ASP A 1 3  ? -10.990 -2.631  1.071  1.00 2.11 -1 3  ASP A OD2  1  
ATOM   41   H H    . ASP A 1 3  ? -10.848 0.653   4.592  1.00 0.71 ?  3  ASP A H    1  
ATOM   42   H HA   . ASP A 1 3  ? -8.722  -0.182  3.089  1.00 0.62 ?  3  ASP A HA   1  
ATOM   43   H HB2  . ASP A 1 3  ? -10.357 -1.740  3.948  1.00 1.30 ?  3  ASP A HB2  1  
ATOM   44   H HB3  . ASP A 1 3  ? -11.590 -1.087  2.875  1.00 1.20 ?  3  ASP A HB3  1  
ATOM   45   N N    . GLU A 1 4  ? -10.987 1.193   1.136  1.00 0.58 ?  4  GLU A N    1  
ATOM   46   C CA   . GLU A 1 4  ? -11.216 1.705   -0.210 1.00 0.58 ?  4  GLU A CA   1  
ATOM   47   C C    . GLU A 1 4  ? -10.385 2.965   -0.476 1.00 0.43 ?  4  GLU A C    1  
ATOM   48   O O    . GLU A 1 4  ? -9.999  3.237   -1.615 1.00 0.38 ?  4  GLU A O    1  
ATOM   49   C CB   . GLU A 1 4  ? -12.705 1.975   -0.423 1.00 0.80 ?  4  GLU A CB   1  
ATOM   50   C CG   . GLU A 1 4  ? -13.556 0.719   -0.313 1.00 1.35 ?  4  GLU A CG   1  
ATOM   51   C CD   . GLU A 1 4  ? -15.037 1.004   -0.412 1.00 1.81 ?  4  GLU A CD   1  
ATOM   52   O OE1  . GLU A 1 4  ? -15.611 1.523   0.568  1.00 2.46 ?  4  GLU A OE1  1  
ATOM   53   O OE2  . GLU A 1 4  ? -15.637 0.702   -1.466 1.00 2.08 -1 4  GLU A OE2  1  
ATOM   54   H H    . GLU A 1 4  ? -11.676 1.315   1.822  1.00 0.68 ?  4  GLU A H    1  
ATOM   55   H HA   . GLU A 1 4  ? -10.904 0.939   -0.902 1.00 0.59 ?  4  GLU A HA   1  
ATOM   56   H HB2  . GLU A 1 4  ? -13.043 2.683   0.319  1.00 1.07 ?  4  GLU A HB2  1  
ATOM   57   H HB3  . GLU A 1 4  ? -12.847 2.397   -1.406 1.00 1.03 ?  4  GLU A HB3  1  
ATOM   58   H HG2  . GLU A 1 4  ? -13.282 0.046   -1.112 1.00 1.90 ?  4  GLU A HG2  1  
ATOM   59   H HG3  . GLU A 1 4  ? -13.357 0.244   0.636  1.00 1.77 ?  4  GLU A HG3  1  
ATOM   60   N N    . ASP A 1 5  ? -10.090 3.718   0.575  1.00 0.44 ?  5  ASP A N    1  
ATOM   61   C CA   . ASP A 1 5  ? -9.242  4.902   0.456  1.00 0.40 ?  5  ASP A CA   1  
ATOM   62   C C    . ASP A 1 5  ? -7.796  4.456   0.310  1.00 0.28 ?  5  ASP A C    1  
ATOM   63   O O    . ASP A 1 5  ? -7.018  5.029   -0.449 1.00 0.29 ?  5  ASP A O    1  
ATOM   64   C CB   . ASP A 1 5  ? -9.400  5.808   1.681  1.00 0.52 ?  5  ASP A CB   1  
ATOM   65   C CG   . ASP A 1 5  ? -8.593  7.087   1.572  1.00 1.11 ?  5  ASP A CG   1  
ATOM   66   O OD1  . ASP A 1 5  ? -9.046  8.026   0.884  1.00 1.17 ?  5  ASP A OD1  1  
ATOM   67   O OD2  . ASP A 1 5  ? -7.509  7.166   2.182  1.00 1.82 -1 5  ASP A OD2  1  
ATOM   68   H H    . ASP A 1 5  ? -10.429 3.461   1.460  1.00 0.51 ?  5  ASP A H    1  
ATOM   69   H HA   . ASP A 1 5  ? -9.536  5.439   -0.433 1.00 0.43 ?  5  ASP A HA   1  
ATOM   70   H HB2  . ASP A 1 5  ? -10.441 6.071   1.794  1.00 1.00 ?  5  ASP A HB2  1  
ATOM   71   H HB3  . ASP A 1 5  ? -9.071  5.272   2.559  1.00 0.82 ?  5  ASP A HB3  1  
ATOM   72   N N    . PHE A 1 6  ? -7.468  3.399   1.034  1.00 0.24 ?  6  PHE A N    1  
ATOM   73   C CA   . PHE A 1 6  ? -6.186  2.732   0.929  1.00 0.18 ?  6  PHE A CA   1  
ATOM   74   C C    . PHE A 1 6  ? -5.996  2.232   -0.496 1.00 0.13 ?  6  PHE A C    1  
ATOM   75   O O    . PHE A 1 6  ? -4.922  2.363   -1.078 1.00 0.15 ?  6  PHE A O    1  
ATOM   76   C CB   . PHE A 1 6  ? -6.158  1.567   1.924  1.00 0.23 ?  6  PHE A CB   1  
ATOM   77   C CG   . PHE A 1 6  ? -4.857  0.826   1.998  1.00 0.25 ?  6  PHE A CG   1  
ATOM   78   C CD1  . PHE A 1 6  ? -3.981  1.047   3.045  1.00 0.43 ?  6  PHE A CD1  1  
ATOM   79   C CD2  . PHE A 1 6  ? -4.520  -0.105  1.033  1.00 0.25 ?  6  PHE A CD2  1  
ATOM   80   C CE1  . PHE A 1 6  ? -2.792  0.352   3.128  1.00 0.50 ?  6  PHE A CE1  1  
ATOM   81   C CE2  . PHE A 1 6  ? -3.335  -0.797  1.107  1.00 0.35 ?  6  PHE A CE2  1  
ATOM   82   C CZ   . PHE A 1 6  ? -2.468  -0.571  2.157  1.00 0.43 ?  6  PHE A CZ   1  
ATOM   83   H H    . PHE A 1 6  ? -8.125  3.048   1.668  1.00 0.29 ?  6  PHE A H    1  
ATOM   84   H HA   . PHE A 1 6  ? -5.406  3.437   1.172  1.00 0.23 ?  6  PHE A HA   1  
ATOM   85   H HB2  . PHE A 1 6  ? -6.373  1.946   2.910  1.00 0.31 ?  6  PHE A HB2  1  
ATOM   86   H HB3  . PHE A 1 6  ? -6.926  0.859   1.647  1.00 0.27 ?  6  PHE A HB3  1  
ATOM   87   H HD1  . PHE A 1 6  ? -4.237  1.771   3.804  1.00 0.55 ?  6  PHE A HD1  1  
ATOM   88   H HD2  . PHE A 1 6  ? -5.198  -0.283  0.210  1.00 0.29 ?  6  PHE A HD2  1  
ATOM   89   H HE1  . PHE A 1 6  ? -2.118  0.532   3.950  1.00 0.65 ?  6  PHE A HE1  1  
ATOM   90   H HE2  . PHE A 1 6  ? -3.086  -1.513  0.346  1.00 0.43 ?  6  PHE A HE2  1  
ATOM   91   H HZ   . PHE A 1 6  ? -1.538  -1.117  2.218  1.00 0.51 ?  6  PHE A HZ   1  
ATOM   92   N N    . LYS A 1 7  ? -7.061  1.668   -1.053 1.00 0.13 ?  7  LYS A N    1  
ATOM   93   C CA   . LYS A 1 7  ? -7.071  1.247   -2.444 1.00 0.15 ?  7  LYS A CA   1  
ATOM   94   C C    . LYS A 1 7  ? -6.869  2.447   -3.361 1.00 0.19 ?  7  LYS A C    1  
ATOM   95   O O    . LYS A 1 7  ? -6.191  2.357   -4.375 1.00 0.23 ?  7  LYS A O    1  
ATOM   96   C CB   . LYS A 1 7  ? -8.391  0.559   -2.785 1.00 0.23 ?  7  LYS A CB   1  
ATOM   97   C CG   . LYS A 1 7  ? -8.434  -0.007  -4.195 1.00 0.30 ?  7  LYS A CG   1  
ATOM   98   C CD   . LYS A 1 7  ? -9.842  -0.417  -4.597 1.00 0.44 ?  7  LYS A CD   1  
ATOM   99   C CE   . LYS A 1 7  ? -10.779 0.781   -4.638 1.00 1.26 ?  7  LYS A CE   1  
ATOM   100  N NZ   . LYS A 1 7  ? -12.114 0.427   -5.179 1.00 2.06 1  7  LYS A NZ   1  
ATOM   101  H H    . LYS A 1 7  ? -7.859  1.511   -0.501 1.00 0.18 ?  7  LYS A H    1  
ATOM   102  H HA   . LYS A 1 7  ? -6.258  0.550   -2.592 1.00 0.15 ?  7  LYS A HA   1  
ATOM   103  H HB2  . LYS A 1 7  ? -8.555  -0.247  -2.088 1.00 0.28 ?  7  LYS A HB2  1  
ATOM   104  H HB3  . LYS A 1 7  ? -9.188  1.279   -2.685 1.00 0.25 ?  7  LYS A HB3  1  
ATOM   105  H HG2  . LYS A 1 7  ? -8.077  0.744   -4.883 1.00 0.31 ?  7  LYS A HG2  1  
ATOM   106  H HG3  . LYS A 1 7  ? -7.790  -0.873  -4.243 1.00 0.36 ?  7  LYS A HG3  1  
ATOM   107  H HD2  . LYS A 1 7  ? -9.809  -0.871  -5.577 1.00 1.10 ?  7  LYS A HD2  1  
ATOM   108  H HD3  . LYS A 1 7  ? -10.217 -1.132  -3.880 1.00 0.92 ?  7  LYS A HD3  1  
ATOM   109  H HE2  . LYS A 1 7  ? -10.903 1.163   -3.635 1.00 1.83 ?  7  LYS A HE2  1  
ATOM   110  H HE3  . LYS A 1 7  ? -10.339 1.547   -5.260 1.00 1.84 ?  7  LYS A HE3  1  
ATOM   111  H HZ1  . LYS A 1 7  ? -12.727 1.268   -5.202 1.00 2.69 ?  7  LYS A HZ1  1  
ATOM   112  H HZ2  . LYS A 1 7  ? -12.563 -0.297  -4.587 1.00 2.55 ?  7  LYS A HZ2  1  
ATOM   113  H HZ3  . LYS A 1 7  ? -12.022 0.056   -6.146 1.00 2.30 ?  7  LYS A HZ3  1  
ATOM   114  N N    . ALA A 1 8  ? -7.471  3.570   -2.999 1.00 0.22 ?  8  ALA A N    1  
ATOM   115  C CA   . ALA A 1 8  ? -7.310  4.802   -3.764 1.00 0.30 ?  8  ALA A CA   1  
ATOM   116  C C    . ALA A 1 8  ? -5.871  5.316   -3.692 1.00 0.35 ?  8  ALA A C    1  
ATOM   117  O O    . ALA A 1 8  ? -5.404  6.014   -4.593 1.00 0.45 ?  8  ALA A O    1  
ATOM   118  C CB   . ALA A 1 8  ? -8.279  5.862   -3.266 1.00 0.35 ?  8  ALA A CB   1  
ATOM   119  H H    . ALA A 1 8  ? -8.055  3.568   -2.206 1.00 0.22 ?  8  ALA A H    1  
ATOM   120  H HA   . ALA A 1 8  ? -7.551  4.584   -4.793 1.00 0.34 ?  8  ALA A HA   1  
ATOM   121  H HB1  . ALA A 1 8  ? -9.286  5.473   -3.298 1.00 1.02 ?  8  ALA A HB1  1  
ATOM   122  H HB2  . ALA A 1 8  ? -8.210  6.738   -3.895 1.00 1.02 ?  8  ALA A HB2  1  
ATOM   123  H HB3  . ALA A 1 8  ? -8.028  6.128   -2.250 1.00 1.04 ?  8  ALA A HB3  1  
ATOM   124  N N    . VAL A 1 9  ? -5.176  4.983   -2.611 1.00 0.31 ?  9  VAL A N    1  
ATOM   125  C CA   . VAL A 1 9  ? -3.778  5.366   -2.457 1.00 0.39 ?  9  VAL A CA   1  
ATOM   126  C C    . VAL A 1 9  ? -2.851  4.416   -3.214 1.00 0.38 ?  9  VAL A C    1  
ATOM   127  O O    . VAL A 1 9  ? -2.099  4.832   -4.094 1.00 0.49 ?  9  VAL A O    1  
ATOM   128  C CB   . VAL A 1 9  ? -3.347  5.390   -0.970 1.00 0.42 ?  9  VAL A CB   1  
ATOM   129  C CG1  . VAL A 1 9  ? -1.893  5.824   -0.835 1.00 0.52 ?  9  VAL A CG1  1  
ATOM   130  C CG2  . VAL A 1 9  ? -4.249  6.304   -0.159 1.00 0.50 ?  9  VAL A CG2  1  
ATOM   131  H H    . VAL A 1 9  ? -5.623  4.488   -1.887 1.00 0.26 ?  9  VAL A H    1  
ATOM   132  H HA   . VAL A 1 9  ? -3.660  6.360   -2.857 1.00 0.47 ?  9  VAL A HA   1  
ATOM   133  H HB   . VAL A 1 9  ? -3.438  4.388   -0.574 1.00 0.37 ?  9  VAL A HB   1  
ATOM   134  H HG11 . VAL A 1 9  ? -1.612  5.822   0.209  1.00 0.97 ?  9  VAL A HG11 1  
ATOM   135  H HG12 . VAL A 1 9  ? -1.774  6.818   -1.238 1.00 0.84 ?  9  VAL A HG12 1  
ATOM   136  H HG13 . VAL A 1 9  ? -1.260  5.137   -1.378 1.00 1.18 ?  9  VAL A HG13 1  
ATOM   137  H HG21 . VAL A 1 9  ? -5.266  5.941   -0.210 1.00 0.95 ?  9  VAL A HG21 1  
ATOM   138  H HG22 . VAL A 1 9  ? -4.203  7.303   -0.561 1.00 0.76 ?  9  VAL A HG22 1  
ATOM   139  H HG23 . VAL A 1 9  ? -3.921  6.311   0.870  1.00 0.91 ?  9  VAL A HG23 1  
ATOM   140  N N    . PHE A 1 10 ? -2.925  3.139   -2.874 1.00 0.29 ?  10 PHE A N    1  
ATOM   141  C CA   . PHE A 1 10 ? -1.957  2.158   -3.351 1.00 0.33 ?  10 PHE A CA   1  
ATOM   142  C C    . PHE A 1 10 ? -2.398  1.466   -4.637 1.00 0.35 ?  10 PHE A C    1  
ATOM   143  O O    . PHE A 1 10 ? -1.580  0.870   -5.335 1.00 0.45 ?  10 PHE A O    1  
ATOM   144  C CB   . PHE A 1 10 ? -1.705  1.125   -2.258 1.00 0.32 ?  10 PHE A CB   1  
ATOM   145  C CG   . PHE A 1 10 ? -1.022  1.698   -1.050 1.00 0.33 ?  10 PHE A CG   1  
ATOM   146  C CD1  . PHE A 1 10 ? -1.752  2.138   0.041  1.00 0.39 ?  10 PHE A CD1  1  
ATOM   147  C CD2  . PHE A 1 10 ? 0.354   1.799   -1.011 1.00 0.39 ?  10 PHE A CD2  1  
ATOM   148  C CE1  . PHE A 1 10 ? -1.118  2.665   1.150  1.00 0.41 ?  10 PHE A CE1  1  
ATOM   149  C CE2  . PHE A 1 10 ? 0.997   2.323   0.093  1.00 0.42 ?  10 PHE A CE2  1  
ATOM   150  C CZ   . PHE A 1 10 ? 0.259   2.755   1.175  1.00 0.37 ?  10 PHE A CZ   1  
ATOM   151  H H    . PHE A 1 10 ? -3.647  2.844   -2.279 1.00 0.22 ?  10 PHE A H    1  
ATOM   152  H HA   . PHE A 1 10 ? -1.035  2.682   -3.545 1.00 0.39 ?  10 PHE A HA   1  
ATOM   153  H HB2  . PHE A 1 10 ? -2.649  0.707   -1.940 1.00 0.30 ?  10 PHE A HB2  1  
ATOM   154  H HB3  . PHE A 1 10 ? -1.080  0.336   -2.652 1.00 0.37 ?  10 PHE A HB3  1  
ATOM   155  H HD1  . PHE A 1 10 ? -2.830  2.064   0.024  1.00 0.48 ?  10 PHE A HD1  1  
ATOM   156  H HD2  . PHE A 1 10 ? 0.928   1.464   -1.858 1.00 0.47 ?  10 PHE A HD2  1  
ATOM   157  H HE1  . PHE A 1 10 ? -1.699  3.007   1.993  1.00 0.50 ?  10 PHE A HE1  1  
ATOM   158  H HE2  . PHE A 1 10 ? 2.075   2.393   0.111  1.00 0.52 ?  10 PHE A HE2  1  
ATOM   159  H HZ   . PHE A 1 10 ? 0.759   3.163   2.038  1.00 0.39 ?  10 PHE A HZ   1  
ATOM   160  N N    . GLY A 1 11 ? -3.681  1.533   -4.947 1.00 0.28 ?  11 GLY A N    1  
ATOM   161  C CA   . GLY A 1 11 ? -4.185  0.905   -6.153 1.00 0.31 ?  11 GLY A CA   1  
ATOM   162  C C    . GLY A 1 11 ? -4.871  -0.415  -5.872 1.00 0.29 ?  11 GLY A C    1  
ATOM   163  O O    . GLY A 1 11 ? -5.598  -0.943  -6.714 1.00 0.36 ?  11 GLY A O    1  
ATOM   164  H H    . GLY A 1 11 ? -4.299  2.016   -4.357 1.00 0.24 ?  11 GLY A H    1  
ATOM   165  H HA2  . GLY A 1 11 ? -4.892  1.571   -6.622 1.00 0.32 ?  11 GLY A HA2  1  
ATOM   166  H HA3  . GLY A 1 11 ? -3.362  0.734   -6.829 1.00 0.35 ?  11 GLY A HA3  1  
HETATM 167  N N    . NLE A 1 12 ? -4.649  -0.947  -4.681 1.00 0.24 ?  12 NLE A N    1  
HETATM 168  C CA   . NLE A 1 12 ? -5.229  -2.221  -4.289 1.00 0.24 ?  12 NLE A CA   1  
HETATM 169  C C    . NLE A 1 12 ? -5.710  -2.150  -2.849 1.00 0.21 ?  12 NLE A C    1  
HETATM 170  O O    . NLE A 1 12 ? -5.269  -1.291  -2.084 1.00 0.22 ?  12 NLE A O    1  
HETATM 171  C CB   . NLE A 1 12 ? -4.222  -3.372  -4.453 1.00 0.27 ?  12 NLE A CB   1  
HETATM 172  C CG   . NLE A 1 12 ? -3.026  -3.326  -3.503 1.00 0.64 ?  12 NLE A CG   1  
HETATM 173  C CD   . NLE A 1 12 ? -2.008  -2.258  -3.886 1.00 0.33 ?  12 NLE A CD   1  
HETATM 174  C CE   . NLE A 1 12 ? -1.401  -2.562  -5.240 1.00 0.64 ?  12 NLE A CE   1  
HETATM 175  H H    . NLE A 1 12 ? -4.090  -0.463  -4.039 1.00 0.26 ?  12 NLE A H    1  
HETATM 176  H HA   . NLE A 1 12 ? -6.079  -2.405  -4.928 1.00 0.26 ?  12 NLE A HA   1  
HETATM 177  H HB2  . NLE A 1 12 ? -3.852  -3.362  -5.465 1.00 0.51 ?  12 NLE A HB2  1  
HETATM 178  H HB3  . NLE A 1 12 ? -4.740  -4.302  -4.286 1.00 0.31 ?  12 NLE A HB3  1  
HETATM 179  H HG2  . NLE A 1 12 ? -2.540  -4.291  -3.516 1.00 1.24 ?  12 NLE A HG2  1  
HETATM 180  H HG3  . NLE A 1 12 ? -3.384  -3.119  -2.508 1.00 1.24 ?  12 NLE A HG3  1  
HETATM 181  H HD2  . NLE A 1 12 ? -1.218  -2.236  -3.150 1.00 0.70 ?  12 NLE A HD2  1  
HETATM 182  H HD3  . NLE A 1 12 ? -2.494  -1.297  -3.933 1.00 0.43 ?  12 NLE A HD3  1  
HETATM 183  H HE1  . NLE A 1 12 ? -0.953  -3.546  -5.221 1.00 1.10 ?  12 NLE A HE1  1  
HETATM 184  H HE2  . NLE A 1 12 ? -0.644  -1.828  -5.467 1.00 1.19 ?  12 NLE A HE2  1  
HETATM 185  H HE3  . NLE A 1 12 ? -2.170  -2.531  -5.996 1.00 1.26 ?  12 NLE A HE3  1  
ATOM   186  N N    . THR A 1 13 ? -6.618  -3.047  -2.493 1.00 0.24 ?  13 THR A N    1  
ATOM   187  C CA   . THR A 1 13 ? -7.180  -3.079  -1.155 1.00 0.27 ?  13 THR A CA   1  
ATOM   188  C C    . THR A 1 13 ? -6.165  -3.571  -0.135 1.00 0.24 ?  13 THR A C    1  
ATOM   189  O O    . THR A 1 13 ? -5.169  -4.198  -0.505 1.00 0.23 ?  13 THR A O    1  
ATOM   190  C CB   . THR A 1 13 ? -8.433  -3.970  -1.100 1.00 0.34 ?  13 THR A CB   1  
ATOM   191  O OG1  . THR A 1 13 ? -8.168  -5.232  -1.736 1.00 0.36 ?  13 THR A OG1  1  
ATOM   192  C CG2  . THR A 1 13 ? -9.605  -3.280  -1.777 1.00 0.43 ?  13 THR A CG2  1  
ATOM   193  H H    . THR A 1 13 ? -6.920  -3.707  -3.152 1.00 0.27 ?  13 THR A H    1  
ATOM   194  H HA   . THR A 1 13 ? -7.472  -2.072  -0.894 1.00 0.30 ?  13 THR A HA   1  
ATOM   195  H HB   . THR A 1 13 ? -8.687  -4.145  -0.063 1.00 0.34 ?  13 THR A HB   1  
ATOM   196  H HG1  . THR A 1 13 ? -8.700  -5.302  -2.539 1.00 0.58 ?  13 THR A HG1  1  
ATOM   197  H HG21 . THR A 1 13 ? -9.839  -2.367  -1.248 1.00 0.92 ?  13 THR A HG21 1  
ATOM   198  H HG22 . THR A 1 13 ? -10.465 -3.933  -1.763 1.00 1.34 ?  13 THR A HG22 1  
ATOM   199  H HG23 . THR A 1 13 ? -9.346  -3.046  -2.799 1.00 1.02 ?  13 THR A HG23 1  
ATOM   200  N N    . ARG A 1 14 ? -6.419  -3.312  1.139  1.00 0.29 ?  14 ARG A N    1  
ATOM   201  C CA   . ARG A 1 14 ? -5.468  -3.646  2.192  1.00 0.32 ?  14 ARG A CA   1  
ATOM   202  C C    . ARG A 1 14 ? -5.107  -5.129  2.150  1.00 0.30 ?  14 ARG A C    1  
ATOM   203  O O    . ARG A 1 14 ? -3.937  -5.498  2.313  1.00 0.31 ?  14 ARG A O    1  
ATOM   204  C CB   . ARG A 1 14 ? -6.038  -3.268  3.562  1.00 0.42 ?  14 ARG A CB   1  
ATOM   205  C CG   . ARG A 1 14 ? -6.376  -1.790  3.678  1.00 0.53 ?  14 ARG A CG   1  
ATOM   206  C CD   . ARG A 1 14 ? -6.854  -1.419  5.072  1.00 0.77 ?  14 ARG A CD   1  
ATOM   207  N NE   . ARG A 1 14 ? -5.769  -1.437  6.053  1.00 1.30 ?  14 ARG A NE   1  
ATOM   208  C CZ   . ARG A 1 14 ? -5.957  -1.416  7.370  1.00 1.88 ?  14 ARG A CZ   1  
ATOM   209  N NH1  . ARG A 1 14 ? -7.187  -1.358  7.866  1.00 2.02 1  14 ARG A NH1  1  
ATOM   210  N NH2  . ARG A 1 14 ? -4.915  -1.432  8.192  1.00 2.82 ?  14 ARG A NH2  1  
ATOM   211  H H    . ARG A 1 14 ? -7.284  -2.895  1.381  1.00 0.32 ?  14 ARG A H    1  
ATOM   212  H HA   . ARG A 1 14 ? -4.571  -3.069  2.016  1.00 0.34 ?  14 ARG A HA   1  
ATOM   213  H HB2  . ARG A 1 14 ? -6.937  -3.837  3.736  1.00 0.43 ?  14 ARG A HB2  1  
ATOM   214  H HB3  . ARG A 1 14 ? -5.314  -3.511  4.321  1.00 0.46 ?  14 ARG A HB3  1  
ATOM   215  H HG2  . ARG A 1 14 ? -5.493  -1.211  3.447  1.00 0.58 ?  14 ARG A HG2  1  
ATOM   216  H HG3  . ARG A 1 14 ? -7.154  -1.556  2.966  1.00 0.53 ?  14 ARG A HG3  1  
ATOM   217  H HD2  . ARG A 1 14 ? -7.277  -0.426  5.040  1.00 1.48 ?  14 ARG A HD2  1  
ATOM   218  H HD3  . ARG A 1 14 ? -7.614  -2.123  5.376  1.00 1.15 ?  14 ARG A HD3  1  
ATOM   219  H HE   . ARG A 1 14 ? -4.849  -1.462  5.706  1.00 1.80 ?  14 ARG A HE   1  
ATOM   220  H HH11 . ARG A 1 14 ? -7.333  -1.342  8.860  1.00 2.60 ?  14 ARG A HH11 1  
ATOM   221  H HH12 . ARG A 1 14 ? -7.977  -1.325  7.250  1.00 1.94 ?  14 ARG A HH12 1  
ATOM   222  H HH21 . ARG A 1 14 ? -3.982  -1.466  7.823  1.00 3.23 ?  14 ARG A HH21 1  
ATOM   223  H HH22 . ARG A 1 14 ? -5.056  -1.421  9.185  1.00 3.30 ?  14 ARG A HH22 1  
HETATM 224  N N    . AIB A 1 15 ? -6.114  -5.965  1.897  1.00 0.31 ?  15 AIB A N    1  
HETATM 225  C CA   . AIB A 1 15 ? -5.927  -7.415  1.751  1.00 0.33 ?  15 AIB A CA   1  
HETATM 226  C C    . AIB A 1 15 ? -4.905  -7.689  0.638  1.00 0.30 ?  15 AIB A C    1  
HETATM 227  O O    . AIB A 1 15 ? -3.972  -8.483  0.805  1.00 0.30 ?  15 AIB A O    1  
HETATM 228  C CB1  . AIB A 1 15 ? -7.253  -8.055  1.394  1.00 0.37 ?  15 AIB A CB1  1  
HETATM 229  C CB2  . AIB A 1 15 ? -5.466  -8.023  3.063  1.00 0.37 ?  15 AIB A CB2  1  
HETATM 230  H H    . AIB A 1 15 ? -7.021  -5.595  1.811  1.00 0.31 ?  15 AIB A H    1  
HETATM 231  H HB11 . AIB A 1 15 ? -7.633  -7.610  0.485  1.00 1.00 ?  15 AIB A HB11 1  
HETATM 232  H HB12 . AIB A 1 15 ? -7.959  -7.894  2.195  1.00 1.13 ?  15 AIB A HB12 1  
HETATM 233  H HB13 . AIB A 1 15 ? -7.113  -9.115  1.244  1.00 1.02 ?  15 AIB A HB13 1  
HETATM 234  H HB21 . AIB A 1 15 ? -5.342  -9.089  2.942  1.00 1.07 ?  15 AIB A HB21 1  
HETATM 235  H HB22 . AIB A 1 15 ? -6.202  -7.831  3.828  1.00 1.16 ?  15 AIB A HB22 1  
HETATM 236  H HB23 . AIB A 1 15 ? -4.523  -7.582  3.353  1.00 1.01 ?  15 AIB A HB23 1  
ATOM   237  N N    . ALA A 1 16 ? -5.069  -6.998  -0.487 1.00 0.27 ?  16 ALA A N    1  
ATOM   238  C CA   . ALA A 1 16 ? -4.223  -7.220  -1.652 1.00 0.26 ?  16 ALA A CA   1  
ATOM   239  C C    . ALA A 1 16 ? -2.815  -6.722  -1.384 1.00 0.23 ?  16 ALA A C    1  
ATOM   240  O O    . ALA A 1 16 ? -1.836  -7.290  -1.867 1.00 0.25 ?  16 ALA A O    1  
ATOM   241  C CB   . ALA A 1 16 ? -4.808  -6.525  -2.870 1.00 0.28 ?  16 ALA A CB   1  
ATOM   242  H H    . ALA A 1 16 ? -5.754  -6.293  -0.523 1.00 0.27 ?  16 ALA A H    1  
ATOM   243  H HA   . ALA A 1 16 ? -4.194  -8.282  -1.848 1.00 0.29 ?  16 ALA A HA   1  
ATOM   244  H HB1  . ALA A 1 16 ? -5.771  -6.949  -3.101 1.00 0.90 ?  16 ALA A HB1  1  
ATOM   245  H HB2  . ALA A 1 16 ? -4.145  -6.654  -3.711 1.00 0.96 ?  16 ALA A HB2  1  
ATOM   246  H HB3  . ALA A 1 16 ? -4.922  -5.472  -2.659 1.00 0.89 ?  16 ALA A HB3  1  
ATOM   247  N N    . PHE A 1 17 ? -2.730  -5.657  -0.604 1.00 0.20 ?  17 PHE A N    1  
ATOM   248  C CA   . PHE A 1 17 ? -1.456  -5.097  -0.201 1.00 0.19 ?  17 PHE A CA   1  
ATOM   249  C C    . PHE A 1 17 ? -0.700  -6.090  0.669  1.00 0.20 ?  17 PHE A C    1  
ATOM   250  O O    . PHE A 1 17 ? 0.480   -6.351  0.453  1.00 0.20 ?  17 PHE A O    1  
ATOM   251  C CB   . PHE A 1 17 ? -1.693  -3.796  0.557  1.00 0.22 ?  17 PHE A CB   1  
ATOM   252  C CG   . PHE A 1 17 ? -0.444  -3.037  0.876  1.00 0.24 ?  17 PHE A CG   1  
ATOM   253  C CD1  . PHE A 1 17 ? 0.075   -2.135  -0.032 1.00 0.28 ?  17 PHE A CD1  1  
ATOM   254  C CD2  . PHE A 1 17 ? 0.207   -3.220  2.083  1.00 0.28 ?  17 PHE A CD2  1  
ATOM   255  C CE1  . PHE A 1 17 ? 1.221   -1.429  0.255  1.00 0.33 ?  17 PHE A CE1  1  
ATOM   256  C CE2  . PHE A 1 17 ? 1.356   -2.516  2.376  1.00 0.32 ?  17 PHE A CE2  1  
ATOM   257  C CZ   . PHE A 1 17 ? 1.865   -1.618  1.457  1.00 0.33 ?  17 PHE A CZ   1  
ATOM   258  H H    . PHE A 1 17 ? -3.559  -5.223  -0.298 1.00 0.21 ?  17 PHE A H    1  
ATOM   259  H HA   . PHE A 1 17 ? -0.880  -4.889  -1.089 1.00 0.19 ?  17 PHE A HA   1  
ATOM   260  H HB2  . PHE A 1 17 ? -2.319  -3.159  -0.042 1.00 0.22 ?  17 PHE A HB2  1  
ATOM   261  H HB3  . PHE A 1 17 ? -2.197  -4.016  1.486  1.00 0.24 ?  17 PHE A HB3  1  
ATOM   262  H HD1  . PHE A 1 17 ? -0.426  -1.985  -0.977 1.00 0.30 ?  17 PHE A HD1  1  
ATOM   263  H HD2  . PHE A 1 17 ? -0.193  -3.924  2.801  1.00 0.30 ?  17 PHE A HD2  1  
ATOM   264  H HE1  . PHE A 1 17 ? 1.614   -0.730  -0.462 1.00 0.38 ?  17 PHE A HE1  1  
ATOM   265  H HE2  . PHE A 1 17 ? 1.860   -2.666  3.318  1.00 0.36 ?  17 PHE A HE2  1  
ATOM   266  H HZ   . PHE A 1 17 ? 2.766   -1.068  1.678  1.00 0.37 ?  17 PHE A HZ   1  
ATOM   267  N N    . ALA A 1 18 ? -1.399  -6.657  1.644  1.00 0.23 ?  18 ALA A N    1  
ATOM   268  C CA   . ALA A 1 18 ? -0.810  -7.652  2.529  1.00 0.25 ?  18 ALA A CA   1  
ATOM   269  C C    . ALA A 1 18 ? -0.432  -8.907  1.753  1.00 0.23 ?  18 ALA A C    1  
ATOM   270  O O    . ALA A 1 18 ? 0.482   -9.638  2.136  1.00 0.23 ?  18 ALA A O    1  
ATOM   271  C CB   . ALA A 1 18 ? -1.770  -7.993  3.654  1.00 0.30 ?  18 ALA A CB   1  
ATOM   272  H H    . ALA A 1 18 ? -2.336  -6.393  1.775  1.00 0.25 ?  18 ALA A H    1  
ATOM   273  H HA   . ALA A 1 18 ? 0.082   -7.225  2.962  1.00 0.27 ?  18 ALA A HA   1  
ATOM   274  H HB1  . ALA A 1 18 ? -2.030  -7.092  4.190  1.00 1.06 ?  18 ALA A HB1  1  
ATOM   275  H HB2  . ALA A 1 18 ? -1.298  -8.692  4.329  1.00 0.87 ?  18 ALA A HB2  1  
ATOM   276  H HB3  . ALA A 1 18 ? -2.662  -8.439  3.242  1.00 0.99 ?  18 ALA A HB3  1  
ATOM   277  N N    . ASN A 1 19 ? -1.150  -9.156  0.662  1.00 0.24 ?  19 ASN A N    1  
ATOM   278  C CA   . ASN A 1 19 ? -0.837  -10.269 -0.228 1.00 0.24 ?  19 ASN A CA   1  
ATOM   279  C C    . ASN A 1 19 ? 0.508   -10.050 -0.922 1.00 0.19 ?  19 ASN A C    1  
ATOM   280  O O    . ASN A 1 19 ? 1.155   -11.000 -1.366 1.00 0.22 ?  19 ASN A O    1  
ATOM   281  C CB   . ASN A 1 19 ? -1.946  -10.444 -1.270 1.00 0.31 ?  19 ASN A CB   1  
ATOM   282  C CG   . ASN A 1 19 ? -1.713  -11.631 -2.189 1.00 0.36 ?  19 ASN A CG   1  
ATOM   283  O OD1  . ASN A 1 19 ? -1.114  -11.496 -3.258 1.00 1.14 ?  19 ASN A OD1  1  
ATOM   284  N ND2  . ASN A 1 19 ? -2.180  -12.801 -1.782 1.00 1.08 ?  19 ASN A ND2  1  
ATOM   285  H H    . ASN A 1 19 ? -1.925  -8.585  0.461  1.00 0.25 ?  19 ASN A H    1  
ATOM   286  H HA   . ASN A 1 19 ? -0.775  -11.162 0.373  1.00 0.27 ?  19 ASN A HA   1  
ATOM   287  H HB2  . ASN A 1 19 ? -2.889  -10.584 -0.763 1.00 0.38 ?  19 ASN A HB2  1  
ATOM   288  H HB3  . ASN A 1 19 ? -2.001  -9.551  -1.876 1.00 0.32 ?  19 ASN A HB3  1  
ATOM   289  H HD21 . ASN A 1 19 ? -2.646  -12.843 -0.919 1.00 1.83 ?  19 ASN A HD21 1  
ATOM   290  H HD22 . ASN A 1 19 ? -2.041  -13.581 -2.360 1.00 1.08 ?  19 ASN A HD22 1  
ATOM   291  N N    . LEU A 1 20 ? 0.930   -8.794  -1.001 1.00 0.17 ?  20 LEU A N    1  
ATOM   292  C CA   . LEU A 1 20 ? 2.206   -8.451  -1.611 1.00 0.17 ?  20 LEU A CA   1  
ATOM   293  C C    . LEU A 1 20 ? 3.350   -8.807  -0.670 1.00 0.17 ?  20 LEU A C    1  
ATOM   294  O O    . LEU A 1 20 ? 3.180   -8.795  0.550  1.00 0.18 ?  20 LEU A O    1  
ATOM   295  C CB   . LEU A 1 20 ? 2.255   -6.960  -1.939 1.00 0.20 ?  20 LEU A CB   1  
ATOM   296  C CG   . LEU A 1 20 ? 1.225   -6.482  -2.959 1.00 0.29 ?  20 LEU A CG   1  
ATOM   297  C CD1  . LEU A 1 20 ? 1.169   -4.966  -2.978 1.00 0.32 ?  20 LEU A CD1  1  
ATOM   298  C CD2  . LEU A 1 20 ? 1.565   -7.017  -4.340 1.00 0.41 ?  20 LEU A CD2  1  
ATOM   299  H H    . LEU A 1 20 ? 0.374   -8.076  -0.625 1.00 0.19 ?  20 LEU A H    1  
ATOM   300  H HA   . LEU A 1 20 ? 2.304   -9.020  -2.522 1.00 0.22 ?  20 LEU A HA   1  
ATOM   301  H HB2  . LEU A 1 20 ? 2.109   -6.406  -1.022 1.00 0.19 ?  20 LEU A HB2  1  
ATOM   302  H HB3  . LEU A 1 20 ? 3.238   -6.734  -2.323 1.00 0.24 ?  20 LEU A HB3  1  
ATOM   303  H HG   . LEU A 1 20 ? 0.249   -6.852  -2.683 1.00 0.33 ?  20 LEU A HG   1  
ATOM   304  H HD11 . LEU A 1 20 ? 2.120   -4.576  -3.310 1.00 1.04 ?  20 LEU A HD11 1  
ATOM   305  H HD12 . LEU A 1 20 ? 0.960   -4.600  -1.983 1.00 1.05 ?  20 LEU A HD12 1  
ATOM   306  H HD13 . LEU A 1 20 ? 0.393   -4.641  -3.653 1.00 1.10 ?  20 LEU A HD13 1  
ATOM   307  H HD21 . LEU A 1 20 ? 0.843   -6.650  -5.056 1.00 1.10 ?  20 LEU A HD21 1  
ATOM   308  H HD22 . LEU A 1 20 ? 1.539   -8.097  -4.324 1.00 0.88 ?  20 LEU A HD22 1  
ATOM   309  H HD23 . LEU A 1 20 ? 2.554   -6.684  -4.622 1.00 1.17 ?  20 LEU A HD23 1  
ATOM   310  N N    . PRO A 1 21 ? 4.527   -9.142  -1.223 1.00 0.23 ?  21 PRO A N    1  
ATOM   311  C CA   . PRO A 1 21 ? 5.711   -9.460  -0.423 1.00 0.29 ?  21 PRO A CA   1  
ATOM   312  C C    . PRO A 1 21 ? 6.187   -8.267  0.397  1.00 0.26 ?  21 PRO A C    1  
ATOM   313  O O    . PRO A 1 21 ? 5.968   -7.118  -0.002 1.00 0.22 ?  21 PRO A O    1  
ATOM   314  C CB   . PRO A 1 21 ? 6.773   -9.842  -1.459 1.00 0.38 ?  21 PRO A CB   1  
ATOM   315  C CG   . PRO A 1 21 ? 6.021   -10.115 -2.718 1.00 0.43 ?  21 PRO A CG   1  
ATOM   316  C CD   . PRO A 1 21 ? 4.795   -9.248  -2.666 1.00 0.30 ?  21 PRO A CD   1  
ATOM   317  H HA   . PRO A 1 21 ? 5.529   -10.297 0.237  1.00 0.32 ?  21 PRO A HA   1  
ATOM   318  H HB2  . PRO A 1 21 ? 7.465   -9.022  -1.583 1.00 0.43 ?  21 PRO A HB2  1  
ATOM   319  H HB3  . PRO A 1 21 ? 7.307   -10.719 -1.122 1.00 0.48 ?  21 PRO A HB3  1  
ATOM   320  H HG2  . PRO A 1 21 ? 6.628   -9.852  -3.572 1.00 0.63 ?  21 PRO A HG2  1  
ATOM   321  H HG3  . PRO A 1 21 ? 5.741   -11.159 -2.759 1.00 0.61 ?  21 PRO A HG3  1  
ATOM   322  H HD2  . PRO A 1 21 ? 5.000   -8.278  -3.094 1.00 0.40 ?  21 PRO A HD2  1  
ATOM   323  H HD3  . PRO A 1 21 ? 3.972   -9.721  -3.178 1.00 0.39 ?  21 PRO A HD3  1  
ATOM   324  N N    . LEU A 1 22 ? 6.830   -8.537  1.528  1.00 0.30 ?  22 LEU A N    1  
ATOM   325  C CA   . LEU A 1 22 ? 7.228   -7.489  2.467  1.00 0.31 ?  22 LEU A CA   1  
ATOM   326  C C    . LEU A 1 22 ? 7.928   -6.327  1.763  1.00 0.28 ?  22 LEU A C    1  
ATOM   327  O O    . LEU A 1 22 ? 7.562   -5.169  1.962  1.00 0.28 ?  22 LEU A O    1  
ATOM   328  C CB   . LEU A 1 22 ? 8.139   -8.073  3.551  1.00 0.41 ?  22 LEU A CB   1  
ATOM   329  C CG   . LEU A 1 22 ? 8.634   -7.077  4.601  1.00 1.07 ?  22 LEU A CG   1  
ATOM   330  C CD1  . LEU A 1 22 ? 7.473   -6.547  5.428  1.00 1.64 ?  22 LEU A CD1  1  
ATOM   331  C CD2  . LEU A 1 22 ? 9.678   -7.726  5.494  1.00 1.54 ?  22 LEU A CD2  1  
ATOM   332  H H    . LEU A 1 22 ? 7.041   -9.471  1.747  1.00 0.34 ?  22 LEU A H    1  
ATOM   333  H HA   . LEU A 1 22 ? 6.330   -7.116  2.934  1.00 0.30 ?  22 LEU A HA   1  
ATOM   334  H HB2  . LEU A 1 22 ? 7.597   -8.857  4.060  1.00 1.00 ?  22 LEU A HB2  1  
ATOM   335  H HB3  . LEU A 1 22 ? 8.998   -8.509  3.069  1.00 0.94 ?  22 LEU A HB3  1  
ATOM   336  H HG   . LEU A 1 22 ? 9.095   -6.239  4.100  1.00 1.97 ?  22 LEU A HG   1  
ATOM   337  H HD11 . LEU A 1 22 ? 7.850   -5.885  6.193  1.00 2.16 ?  22 LEU A HD11 1  
ATOM   338  H HD12 . LEU A 1 22 ? 6.955   -7.374  5.892  1.00 1.77 ?  22 LEU A HD12 1  
ATOM   339  H HD13 . LEU A 1 22 ? 6.791   -6.008  4.790  1.00 2.26 ?  22 LEU A HD13 1  
ATOM   340  H HD21 . LEU A 1 22 ? 10.504  -8.068  4.890  1.00 2.09 ?  22 LEU A HD21 1  
ATOM   341  H HD22 . LEU A 1 22 ? 9.238   -8.565  6.012  1.00 1.81 ?  22 LEU A HD22 1  
ATOM   342  H HD23 . LEU A 1 22 ? 10.034  -7.005  6.214  1.00 2.05 ?  22 LEU A HD23 1  
ATOM   343  N N    . TRP A 1 23 ? 8.909   -6.640  0.920  1.00 0.33 ?  23 TRP A N    1  
ATOM   344  C CA   . TRP A 1 23 ? 9.666   -5.609  0.215  1.00 0.34 ?  23 TRP A CA   1  
ATOM   345  C C    . TRP A 1 23 ? 8.759   -4.743  -0.658 1.00 0.27 ?  23 TRP A C    1  
ATOM   346  O O    . TRP A 1 23 ? 8.981   -3.542  -0.790 1.00 0.25 ?  23 TRP A O    1  
ATOM   347  C CB   . TRP A 1 23 ? 10.788  -6.229  -0.630 1.00 0.42 ?  23 TRP A CB   1  
ATOM   348  C CG   . TRP A 1 23 ? 10.318  -7.194  -1.678 1.00 0.48 ?  23 TRP A CG   1  
ATOM   349  C CD1  . TRP A 1 23 ? 10.167  -8.544  -1.543 1.00 0.56 ?  23 TRP A CD1  1  
ATOM   350  C CD2  . TRP A 1 23 ? 9.952   -6.883  -3.026 1.00 0.51 ?  23 TRP A CD2  1  
ATOM   351  N NE1  . TRP A 1 23 ? 9.726   -9.090  -2.723 1.00 0.62 ?  23 TRP A NE1  1  
ATOM   352  C CE2  . TRP A 1 23 ? 9.586   -8.090  -3.649 1.00 0.60 ?  23 TRP A CE2  1  
ATOM   353  C CE3  . TRP A 1 23 ? 9.897   -5.698  -3.768 1.00 0.49 ?  23 TRP A CE3  1  
ATOM   354  C CZ2  . TRP A 1 23 ? 9.171   -8.146  -4.976 1.00 0.68 ?  23 TRP A CZ2  1  
ATOM   355  C CZ3  . TRP A 1 23 ? 9.483   -5.755  -5.084 1.00 0.59 ?  23 TRP A CZ3  1  
ATOM   356  C CH2  . TRP A 1 23 ? 9.125   -6.971  -5.677 1.00 0.68 ?  23 TRP A CH2  1  
ATOM   357  H H    . TRP A 1 23 ? 9.138   -7.583  0.776  1.00 0.37 ?  23 TRP A H    1  
ATOM   358  H HA   . TRP A 1 23 ? 10.112  -4.976  0.966  1.00 0.35 ?  23 TRP A HA   1  
ATOM   359  H HB2  . TRP A 1 23 ? 11.323  -5.439  -1.131 1.00 0.42 ?  23 TRP A HB2  1  
ATOM   360  H HB3  . TRP A 1 23 ? 11.468  -6.754  0.024  1.00 0.48 ?  23 TRP A HB3  1  
ATOM   361  H HD1  . TRP A 1 23 ? 10.366  -9.090  -0.634 1.00 0.59 ?  23 TRP A HD1  1  
ATOM   362  H HE1  . TRP A 1 23 ? 9.543   -10.043 -2.875 1.00 0.69 ?  23 TRP A HE1  1  
ATOM   363  H HE3  . TRP A 1 23 ? 10.168  -4.749  -3.325 1.00 0.44 ?  23 TRP A HE3  1  
ATOM   364  H HZ2  . TRP A 1 23 ? 8.891   -9.075  -5.449 1.00 0.76 ?  23 TRP A HZ2  1  
ATOM   365  H HZ3  . TRP A 1 23 ? 9.434   -4.849  -5.670 1.00 0.61 ?  23 TRP A HZ3  1  
ATOM   366  H HH2  . TRP A 1 23 ? 8.810   -6.967  -6.709 1.00 0.76 ?  23 TRP A HH2  1  
ATOM   367  N N    . LYS A 1 24 ? 7.719   -5.343  -1.224 1.00 0.24 ?  24 LYS A N    1  
ATOM   368  C CA   . LYS A 1 24 ? 6.808   -4.612  -2.093 1.00 0.22 ?  24 LYS A CA   1  
ATOM   369  C C    . LYS A 1 24 ? 5.945   -3.689  -1.252 1.00 0.14 ?  24 LYS A C    1  
ATOM   370  O O    . LYS A 1 24 ? 5.690   -2.543  -1.626 1.00 0.15 ?  24 LYS A O    1  
ATOM   371  C CB   . LYS A 1 24 ? 5.934   -5.577  -2.900 1.00 0.26 ?  24 LYS A CB   1  
ATOM   372  C CG   . LYS A 1 24 ? 5.040   -4.888  -3.925 1.00 0.35 ?  24 LYS A CG   1  
ATOM   373  C CD   . LYS A 1 24 ? 5.859   -4.198  -5.006 1.00 0.97 ?  24 LYS A CD   1  
ATOM   374  C CE   . LYS A 1 24 ? 4.971   -3.564  -6.068 1.00 0.98 ?  24 LYS A CE   1  
ATOM   375  N NZ   . LYS A 1 24 ? 4.166   -4.578  -6.799 1.00 1.37 1  24 LYS A NZ   1  
ATOM   376  H H    . LYS A 1 24 ? 7.546   -6.293  -1.032 1.00 0.26 ?  24 LYS A H    1  
ATOM   377  H HA   . LYS A 1 24 ? 7.403   -4.017  -2.770 1.00 0.25 ?  24 LYS A HA   1  
ATOM   378  H HB2  . LYS A 1 24 ? 6.576   -6.271  -3.423 1.00 0.33 ?  24 LYS A HB2  1  
ATOM   379  H HB3  . LYS A 1 24 ? 5.303   -6.128  -2.219 1.00 0.24 ?  24 LYS A HB3  1  
ATOM   380  H HG2  . LYS A 1 24 ? 4.404   -5.628  -4.389 1.00 0.83 ?  24 LYS A HG2  1  
ATOM   381  H HG3  . LYS A 1 24 ? 4.431   -4.150  -3.419 1.00 0.96 ?  24 LYS A HG3  1  
ATOM   382  H HD2  . LYS A 1 24 ? 6.461   -3.426  -4.550 1.00 1.51 ?  24 LYS A HD2  1  
ATOM   383  H HD3  . LYS A 1 24 ? 6.502   -4.928  -5.476 1.00 1.43 ?  24 LYS A HD3  1  
ATOM   384  H HE2  . LYS A 1 24 ? 4.301   -2.865  -5.589 1.00 1.17 ?  24 LYS A HE2  1  
ATOM   385  H HE3  . LYS A 1 24 ? 5.596   -3.036  -6.773 1.00 1.36 ?  24 LYS A HE3  1  
ATOM   386  H HZ1  . LYS A 1 24 ? 4.787   -5.306  -7.204 1.00 1.91 ?  24 LYS A HZ1  1  
ATOM   387  H HZ2  . LYS A 1 24 ? 3.636   -4.128  -7.570 1.00 1.69 ?  24 LYS A HZ2  1  
ATOM   388  H HZ3  . LYS A 1 24 ? 3.489   -5.034  -6.156 1.00 1.76 ?  24 LYS A HZ3  1  
ATOM   389  N N    . GLN A 1 25 ? 5.514   -4.197  -0.103 1.00 0.11 ?  25 GLN A N    1  
ATOM   390  C CA   . GLN A 1 25 ? 4.775   -3.394  0.860  1.00 0.09 ?  25 GLN A CA   1  
ATOM   391  C C    . GLN A 1 25 ? 5.603   -2.188  1.291  1.00 0.09 ?  25 GLN A C    1  
ATOM   392  O O    . GLN A 1 25 ? 5.118   -1.060  1.311  1.00 0.12 ?  25 GLN A O    1  
ATOM   393  C CB   . GLN A 1 25 ? 4.409   -4.227  2.089  1.00 0.14 ?  25 GLN A CB   1  
ATOM   394  C CG   . GLN A 1 25 ? 3.452   -5.369  1.803  1.00 0.16 ?  25 GLN A CG   1  
ATOM   395  C CD   . GLN A 1 25 ? 3.061   -6.124  3.059  1.00 0.22 ?  25 GLN A CD   1  
ATOM   396  O OE1  . GLN A 1 25 ? 3.028   -5.560  4.153  1.00 0.41 ?  25 GLN A OE1  1  
ATOM   397  N NE2  . GLN A 1 25 ? 2.757   -7.402  2.911  1.00 0.24 ?  25 GLN A NE2  1  
ATOM   398  H H    . GLN A 1 25 ? 5.696   -5.143  0.101  1.00 0.15 ?  25 GLN A H    1  
ATOM   399  H HA   . GLN A 1 25 ? 3.868   -3.046  0.384  1.00 0.10 ?  25 GLN A HA   1  
ATOM   400  H HB2  . GLN A 1 25 ? 5.314   -4.643  2.507  1.00 0.22 ?  25 GLN A HB2  1  
ATOM   401  H HB3  . GLN A 1 25 ? 3.953   -3.580  2.822  1.00 0.18 ?  25 GLN A HB3  1  
ATOM   402  H HG2  . GLN A 1 25 ? 2.558   -4.965  1.351  1.00 0.18 ?  25 GLN A HG2  1  
ATOM   403  H HG3  . GLN A 1 25 ? 3.922   -6.057  1.118  1.00 0.21 ?  25 GLN A HG3  1  
ATOM   404  H HE21 . GLN A 1 25 ? 2.800   -7.790  2.007  1.00 0.33 ?  25 GLN A HE21 1  
ATOM   405  H HE22 . GLN A 1 25 ? 2.498   -7.911  3.708  1.00 0.27 ?  25 GLN A HE22 1  
ATOM   406  N N    . GLN A 1 26 ? 6.864   -2.443  1.619  1.00 0.14 ?  26 GLN A N    1  
ATOM   407  C CA   . GLN A 1 26 ? 7.779   -1.396  2.057  1.00 0.18 ?  26 GLN A CA   1  
ATOM   408  C C    . GLN A 1 26 ? 8.009   -0.375  0.948  1.00 0.18 ?  26 GLN A C    1  
ATOM   409  O O    . GLN A 1 26 ? 8.065   0.827   1.199  1.00 0.25 ?  26 GLN A O    1  
ATOM   410  C CB   . GLN A 1 26 ? 9.111   -2.008  2.484  1.00 0.28 ?  26 GLN A CB   1  
ATOM   411  C CG   . GLN A 1 26 ? 8.992   -2.968  3.657  1.00 0.38 ?  26 GLN A CG   1  
ATOM   412  C CD   . GLN A 1 26 ? 10.299  -3.659  3.996  1.00 0.90 ?  26 GLN A CD   1  
ATOM   413  O OE1  . GLN A 1 26 ? 10.544  -4.011  5.150  1.00 1.46 ?  26 GLN A OE1  1  
ATOM   414  N NE2  . GLN A 1 26 ? 11.148  -3.857  3.001  1.00 1.59 ?  26 GLN A NE2  1  
ATOM   415  H H    . GLN A 1 26 ? 7.188   -3.371  1.570  1.00 0.18 ?  26 GLN A H    1  
ATOM   416  H HA   . GLN A 1 26 ? 7.334   -0.897  2.903  1.00 0.21 ?  26 GLN A HA   1  
ATOM   417  H HB2  . GLN A 1 26 ? 9.529   -2.545  1.648  1.00 0.31 ?  26 GLN A HB2  1  
ATOM   418  H HB3  . GLN A 1 26 ? 9.785   -1.214  2.763  1.00 0.31 ?  26 GLN A HB3  1  
ATOM   419  H HG2  . GLN A 1 26 ? 8.665   -2.414  4.523  1.00 0.76 ?  26 GLN A HG2  1  
ATOM   420  H HG3  . GLN A 1 26 ? 8.257   -3.721  3.416  1.00 0.60 ?  26 GLN A HG3  1  
ATOM   421  H HE21 . GLN A 1 26 ? 10.897  -3.549  2.103  1.00 1.96 ?  26 GLN A HE21 1  
ATOM   422  H HE22 . GLN A 1 26 ? 11.995  -4.310  3.198  1.00 1.99 ?  26 GLN A HE22 1  
ATOM   423  N N    . ASN A 1 27 ? 8.157   -0.865  -0.276 1.00 0.19 ?  27 ASN A N    1  
ATOM   424  C CA   . ASN A 1 27 ? 8.326   0.002   -1.438 1.00 0.26 ?  27 ASN A CA   1  
ATOM   425  C C    . ASN A 1 27 ? 7.129   0.919   -1.606 1.00 0.22 ?  27 ASN A C    1  
ATOM   426  O O    . ASN A 1 27 ? 7.278   2.136   -1.716 1.00 0.25 ?  27 ASN A O    1  
ATOM   427  C CB   . ASN A 1 27 ? 8.529   -0.831  -2.706 1.00 0.38 ?  27 ASN A CB   1  
ATOM   428  C CG   . ASN A 1 27 ? 9.962   -1.290  -2.869 1.00 0.98 ?  27 ASN A CG   1  
ATOM   429  O OD1  . ASN A 1 27 ? 10.710  -1.382  -1.897 1.00 1.81 ?  27 ASN A OD1  1  
ATOM   430  N ND2  . ASN A 1 27 ? 10.350  -1.597  -4.095 1.00 1.18 ?  27 ASN A ND2  1  
ATOM   431  H H    . ASN A 1 27 ? 8.157   -1.842  -0.402 1.00 0.20 ?  27 ASN A H    1  
ATOM   432  H HA   . ASN A 1 27 ? 9.204   0.606   -1.273 1.00 0.34 ?  27 ASN A HA   1  
ATOM   433  H HB2  . ASN A 1 27 ? 7.895   -1.703  -2.661 1.00 0.77 ?  27 ASN A HB2  1  
ATOM   434  H HB3  . ASN A 1 27 ? 8.259   -0.237  -3.566 1.00 0.92 ?  27 ASN A HB3  1  
ATOM   435  H HD21 . ASN A 1 27 ? 9.697   -1.514  -4.823 1.00 1.16 ?  27 ASN A HD21 1  
ATOM   436  H HD22 . ASN A 1 27 ? 11.274  -1.895  -4.227 1.00 1.75 ?  27 ASN A HD22 1  
ATOM   437  N N    . LEU A 1 28 ? 5.946   0.332   -1.593 1.00 0.19 ?  28 LEU A N    1  
ATOM   438  C CA   . LEU A 1 28 ? 4.712   1.086   -1.736 1.00 0.24 ?  28 LEU A CA   1  
ATOM   439  C C    . LEU A 1 28 ? 4.530   2.082   -0.594 1.00 0.24 ?  28 LEU A C    1  
ATOM   440  O O    . LEU A 1 28 ? 4.089   3.210   -0.811 1.00 0.29 ?  28 LEU A O    1  
ATOM   441  C CB   . LEU A 1 28 ? 3.531   0.126   -1.805 1.00 0.28 ?  28 LEU A CB   1  
ATOM   442  C CG   . LEU A 1 28 ? 3.352   -0.590  -3.145 1.00 0.38 ?  28 LEU A CG   1  
ATOM   443  C CD1  . LEU A 1 28 ? 2.324   -1.699  -3.031 1.00 0.88 ?  28 LEU A CD1  1  
ATOM   444  C CD2  . LEU A 1 28 ? 2.934   0.398   -4.220 1.00 0.72 ?  28 LEU A CD2  1  
ATOM   445  H H    . LEU A 1 28 ? 5.897   -0.646  -1.491 1.00 0.18 ?  28 LEU A H    1  
ATOM   446  H HA   . LEU A 1 28 ? 4.770   1.634   -2.662 1.00 0.30 ?  28 LEU A HA   1  
ATOM   447  H HB2  . LEU A 1 28 ? 3.658   -0.621  -1.035 1.00 0.28 ?  28 LEU A HB2  1  
ATOM   448  H HB3  . LEU A 1 28 ? 2.636   0.680   -1.596 1.00 0.33 ?  28 LEU A HB3  1  
ATOM   449  H HG   . LEU A 1 28 ? 4.292   -1.031  -3.440 1.00 0.78 ?  28 LEU A HG   1  
ATOM   450  H HD11 . LEU A 1 28 ? 1.373   -1.280  -2.739 1.00 1.30 ?  28 LEU A HD11 1  
ATOM   451  H HD12 . LEU A 1 28 ? 2.646   -2.416  -2.289 1.00 1.54 ?  28 LEU A HD12 1  
ATOM   452  H HD13 . LEU A 1 28 ? 2.221   -2.192  -3.987 1.00 1.23 ?  28 LEU A HD13 1  
ATOM   453  H HD21 . LEU A 1 28 ? 2.027   0.898   -3.915 1.00 1.32 ?  28 LEU A HD21 1  
ATOM   454  H HD22 . LEU A 1 28 ? 2.759   -0.130  -5.144 1.00 1.40 ?  28 LEU A HD22 1  
ATOM   455  H HD23 . LEU A 1 28 ? 3.717   1.128   -4.365 1.00 1.20 ?  28 LEU A HD23 1  
ATOM   456  N N    . LYS A 1 29 ? 4.876   1.669   0.619  1.00 0.24 ?  29 LYS A N    1  
ATOM   457  C CA   . LYS A 1 29 ? 4.801   2.560   1.772  1.00 0.32 ?  29 LYS A CA   1  
ATOM   458  C C    . LYS A 1 29 ? 5.778   3.724   1.631  1.00 0.34 ?  29 LYS A C    1  
ATOM   459  O O    . LYS A 1 29 ? 5.474   4.847   2.036  1.00 0.40 ?  29 LYS A O    1  
ATOM   460  C CB   . LYS A 1 29 ? 5.079   1.808   3.075  1.00 0.42 ?  29 LYS A CB   1  
ATOM   461  C CG   . LYS A 1 29 ? 3.972   0.860   3.498  1.00 0.71 ?  29 LYS A CG   1  
ATOM   462  C CD   . LYS A 1 29 ? 2.666   1.600   3.747  1.00 1.19 ?  29 LYS A CD   1  
ATOM   463  C CE   . LYS A 1 29 ? 1.652   0.723   4.464  1.00 1.23 ?  29 LYS A CE   1  
ATOM   464  N NZ   . LYS A 1 29 ? 2.114   0.337   5.823  1.00 1.39 1  29 LYS A NZ   1  
ATOM   465  H H    . LYS A 1 29 ? 5.175   0.741   0.743  1.00 0.22 ?  29 LYS A H    1  
ATOM   466  H HA   . LYS A 1 29 ? 3.800   2.957   1.807  1.00 0.36 ?  29 LYS A HA   1  
ATOM   467  H HB2  . LYS A 1 29 ? 5.988   1.236   2.961  1.00 0.78 ?  29 LYS A HB2  1  
ATOM   468  H HB3  . LYS A 1 29 ? 5.214   2.530   3.861  1.00 0.60 ?  29 LYS A HB3  1  
ATOM   469  H HG2  . LYS A 1 29 ? 3.820   0.135   2.716  1.00 1.23 ?  29 LYS A HG2  1  
ATOM   470  H HG3  . LYS A 1 29 ? 4.270   0.358   4.405  1.00 1.29 ?  29 LYS A HG3  1  
ATOM   471  H HD2  . LYS A 1 29 ? 2.865   2.471   4.352  1.00 1.64 ?  29 LYS A HD2  1  
ATOM   472  H HD3  . LYS A 1 29 ? 2.252   1.908   2.797  1.00 1.75 ?  29 LYS A HD3  1  
ATOM   473  H HE2  . LYS A 1 29 ? 0.724   1.265   4.550  1.00 1.53 ?  29 LYS A HE2  1  
ATOM   474  H HE3  . LYS A 1 29 ? 1.492   -0.171  3.881  1.00 1.48 ?  29 LYS A HE3  1  
ATOM   475  H HZ1  . LYS A 1 29 ? 2.957   -0.268  5.760  1.00 2.04 ?  29 LYS A HZ1  1  
ATOM   476  H HZ2  . LYS A 1 29 ? 1.367   -0.184  6.325  1.00 1.56 ?  29 LYS A HZ2  1  
ATOM   477  H HZ3  . LYS A 1 29 ? 2.353   1.187   6.374  1.00 1.51 ?  29 LYS A HZ3  1  
ATOM   478  N N    . LYS A 1 30 ? 6.952   3.453   1.065  1.00 0.34 ?  30 LYS A N    1  
ATOM   479  C CA   . LYS A 1 30 ? 7.928   4.506   0.807  1.00 0.43 ?  30 LYS A CA   1  
ATOM   480  C C    . LYS A 1 30 ? 7.409   5.473   -0.251 1.00 0.42 ?  30 LYS A C    1  
ATOM   481  O O    . LYS A 1 30 ? 7.592   6.691   -0.139 1.00 0.47 ?  30 LYS A O    1  
ATOM   482  C CB   . LYS A 1 30 ? 9.278   3.923   0.363  1.00 0.54 ?  30 LYS A CB   1  
ATOM   483  C CG   . LYS A 1 30 ? 10.052  3.238   1.482  1.00 1.28 ?  30 LYS A CG   1  
ATOM   484  C CD   . LYS A 1 30 ? 11.499  2.964   1.088  1.00 1.67 ?  30 LYS A CD   1  
ATOM   485  C CE   . LYS A 1 30 ? 11.611  1.901   0.001  1.00 2.49 ?  30 LYS A CE   1  
ATOM   486  N NZ   . LYS A 1 30 ? 11.233  0.550   0.496  1.00 3.14 1  30 LYS A NZ   1  
ATOM   487  H H    . LYS A 1 30 ? 7.168   2.523   0.826  1.00 0.33 ?  30 LYS A H    1  
ATOM   488  H HA   . LYS A 1 30 ? 8.069   5.048   1.727  1.00 0.48 ?  30 LYS A HA   1  
ATOM   489  H HB2  . LYS A 1 30 ? 9.102   3.196   -0.415 1.00 0.89 ?  30 LYS A HB2  1  
ATOM   490  H HB3  . LYS A 1 30 ? 9.889   4.720   -0.032 1.00 1.06 ?  30 LYS A HB3  1  
ATOM   491  H HG2  . LYS A 1 30 ? 10.043  3.873   2.353  1.00 1.89 ?  30 LYS A HG2  1  
ATOM   492  H HG3  . LYS A 1 30 ? 9.569   2.300   1.715  1.00 1.85 ?  30 LYS A HG3  1  
ATOM   493  H HD2  . LYS A 1 30 ? 11.941  3.880   0.725  1.00 2.02 ?  30 LYS A HD2  1  
ATOM   494  H HD3  . LYS A 1 30 ? 12.038  2.627   1.962  1.00 1.96 ?  30 LYS A HD3  1  
ATOM   495  H HE2  . LYS A 1 30 ? 10.958  2.170   -0.813 1.00 2.89 ?  30 LYS A HE2  1  
ATOM   496  H HE3  . LYS A 1 30 ? 12.632  1.872   -0.354 1.00 2.91 ?  30 LYS A HE3  1  
ATOM   497  H HZ1  . LYS A 1 30 ? 11.346  -0.155  -0.264 1.00 3.57 ?  30 LYS A HZ1  1  
ATOM   498  H HZ2  . LYS A 1 30 ? 10.246  0.548   0.813  1.00 3.62 ?  30 LYS A HZ2  1  
ATOM   499  H HZ3  . LYS A 1 30 ? 11.843  0.280   1.297  1.00 3.29 ?  30 LYS A HZ3  1  
ATOM   500  N N    . GLU A 1 31 ? 6.754   4.918   -1.266 1.00 0.42 ?  31 GLU A N    1  
ATOM   501  C CA   . GLU A 1 31 ? 6.190   5.708   -2.354 1.00 0.49 ?  31 GLU A CA   1  
ATOM   502  C C    . GLU A 1 31 ? 5.010   6.555   -1.888 1.00 0.52 ?  31 GLU A C    1  
ATOM   503  O O    . GLU A 1 31 ? 4.807   7.660   -2.389 1.00 0.70 ?  31 GLU A O    1  
ATOM   504  C CB   . GLU A 1 31 ? 5.741   4.802   -3.500 1.00 0.52 ?  31 GLU A CB   1  
ATOM   505  C CG   . GLU A 1 31 ? 6.882   4.111   -4.223 1.00 0.87 ?  31 GLU A CG   1  
ATOM   506  C CD   . GLU A 1 31 ? 6.408   3.324   -5.423 1.00 1.47 ?  31 GLU A CD   1  
ATOM   507  O OE1  . GLU A 1 31 ? 6.486   2.082   -5.396 1.00 1.67 ?  31 GLU A OE1  1  
ATOM   508  O OE2  . GLU A 1 31 ? 5.947   3.948   -6.405 1.00 2.30 -1 31 GLU A OE2  1  
ATOM   509  H H    . GLU A 1 31 ? 6.657   3.936   -1.293 1.00 0.41 ?  31 GLU A H    1  
ATOM   510  H HA   . GLU A 1 31 ? 6.965   6.367   -2.714 1.00 0.57 ?  31 GLU A HA   1  
ATOM   511  H HB2  . GLU A 1 31 ? 5.086   4.041   -3.103 1.00 0.87 ?  31 GLU A HB2  1  
ATOM   512  H HB3  . GLU A 1 31 ? 5.195   5.394   -4.216 1.00 0.80 ?  31 GLU A HB3  1  
ATOM   513  H HG2  . GLU A 1 31 ? 7.585   4.857   -4.557 1.00 1.45 ?  31 GLU A HG2  1  
ATOM   514  H HG3  . GLU A 1 31 ? 7.373   3.437   -3.539 1.00 1.49 ?  31 GLU A HG3  1  
ATOM   515  N N    . LYS A 1 32 ? 4.233   6.018   -0.948 1.00 0.43 ?  32 LYS A N    1  
ATOM   516  C CA   . LYS A 1 32 ? 3.057   6.707   -0.409 1.00 0.55 ?  32 LYS A CA   1  
ATOM   517  C C    . LYS A 1 32 ? 3.364   8.162   -0.063 1.00 0.66 ?  32 LYS A C    1  
ATOM   518  O O    . LYS A 1 32 ? 2.792   9.082   -0.651 1.00 1.23 ?  32 LYS A O    1  
ATOM   519  C CB   . LYS A 1 32 ? 2.539   5.978   0.834  1.00 0.74 ?  32 LYS A CB   1  
ATOM   520  C CG   . LYS A 1 32 ? 1.400   6.699   1.538  1.00 1.46 ?  32 LYS A CG   1  
ATOM   521  C CD   . LYS A 1 32 ? 0.977   5.965   2.798  1.00 2.20 ?  32 LYS A CD   1  
ATOM   522  C CE   . LYS A 1 32 ? -0.121  6.703   3.548  1.00 3.14 ?  32 LYS A CE   1  
ATOM   523  N NZ   . LYS A 1 32 ? 0.331   8.029   4.052  1.00 3.91 1  32 LYS A NZ   1  
ATOM   524  H H    . LYS A 1 32 ? 4.446   5.115   -0.619 1.00 0.38 ?  32 LYS A H    1  
ATOM   525  H HA   . LYS A 1 32 ? 2.290   6.687   -1.167 1.00 0.79 ?  32 LYS A HA   1  
ATOM   526  H HB2  . LYS A 1 32 ? 2.189   4.999   0.541  1.00 1.02 ?  32 LYS A HB2  1  
ATOM   527  H HB3  . LYS A 1 32 ? 3.353   5.863   1.535  1.00 1.25 ?  32 LYS A HB3  1  
ATOM   528  H HG2  . LYS A 1 32 ? 1.725   7.694   1.804  1.00 2.11 ?  32 LYS A HG2  1  
ATOM   529  H HG3  . LYS A 1 32 ? 0.557   6.760   0.866  1.00 1.77 ?  32 LYS A HG3  1  
ATOM   530  H HD2  . LYS A 1 32 ? 0.613   4.988   2.528  1.00 2.36 ?  32 LYS A HD2  1  
ATOM   531  H HD3  . LYS A 1 32 ? 1.835   5.863   3.445  1.00 2.67 ?  32 LYS A HD3  1  
ATOM   532  H HE2  . LYS A 1 32 ? -0.957  6.848   2.883  1.00 3.54 ?  32 LYS A HE2  1  
ATOM   533  H HE3  . LYS A 1 32 ? -0.431  6.097   4.386  1.00 3.37 ?  32 LYS A HE3  1  
ATOM   534  H HZ1  . LYS A 1 32 ? 0.532   8.668   3.256  1.00 3.96 ?  32 LYS A HZ1  1  
ATOM   535  H HZ2  . LYS A 1 32 ? 1.197   7.921   4.621  1.00 4.35 ?  32 LYS A HZ2  1  
ATOM   536  H HZ3  . LYS A 1 32 ? -0.407  8.454   4.648  1.00 4.36 ?  32 LYS A HZ3  1  
ATOM   537  N N    . GLY A 1 33 ? 4.262   8.363   0.886  1.00 0.94 ?  33 GLY A N    1  
ATOM   538  C CA   . GLY A 1 33 ? 4.638   9.705   1.272  1.00 1.34 ?  33 GLY A CA   1  
ATOM   539  C C    . GLY A 1 33 ? 5.784   9.713   2.255  1.00 1.43 ?  33 GLY A C    1  
ATOM   540  O O    . GLY A 1 33 ? 5.764   10.451  3.236  1.00 1.99 ?  33 GLY A O    1  
ATOM   541  H H    . GLY A 1 33 ? 4.666   7.593   1.338  1.00 1.26 ?  33 GLY A H    1  
ATOM   542  H HA2  . GLY A 1 33 ? 4.928   10.254  0.390  1.00 1.68 ?  33 GLY A HA2  1  
ATOM   543  H HA3  . GLY A 1 33 ? 3.788   10.190  1.723  1.00 1.72 ?  33 GLY A HA3  1  
ATOM   544  N N    . LEU A 1 34 ? 6.780   8.881   1.998  1.00 1.27 ?  34 LEU A N    1  
ATOM   545  C CA   . LEU A 1 34 ? 7.934   8.786   2.875  1.00 1.73 ?  34 LEU A CA   1  
ATOM   546  C C    . LEU A 1 34 ? 9.188   9.274   2.161  1.00 1.86 ?  34 LEU A C    1  
ATOM   547  O O    . LEU A 1 34 ? 9.947   10.081  2.698  1.00 2.56 ?  34 LEU A O    1  
ATOM   548  C CB   . LEU A 1 34 ? 8.112   7.342   3.349  1.00 1.91 ?  34 LEU A CB   1  
ATOM   549  C CG   . LEU A 1 34 ? 9.256   7.103   4.337  1.00 2.29 ?  34 LEU A CG   1  
ATOM   550  C CD1  . LEU A 1 34 ? 9.096   7.969   5.577  1.00 2.76 ?  34 LEU A CD1  1  
ATOM   551  C CD2  . LEU A 1 34 ? 9.314   5.636   4.723  1.00 3.08 ?  34 LEU A CD2  1  
ATOM   552  H H    . LEU A 1 34 ? 6.745   8.322   1.194  1.00 1.11 ?  34 LEU A H    1  
ATOM   553  H HA   . LEU A 1 34 ? 7.751   9.418   3.730  1.00 2.15 ?  34 LEU A HA   1  
ATOM   554  H HB2  . LEU A 1 34 ? 7.191   7.024   3.812  1.00 2.24 ?  34 LEU A HB2  1  
ATOM   555  H HB3  . LEU A 1 34 ? 8.286   6.729   2.481  1.00 2.03 ?  34 LEU A HB3  1  
ATOM   556  H HG   . LEU A 1 34 ? 10.193  7.363   3.865  1.00 2.45 ?  34 LEU A HG   1  
ATOM   557  H HD11 . LEU A 1 34 ? 8.137   7.772   6.032  1.00 3.05 ?  34 LEU A HD11 1  
ATOM   558  H HD12 . LEU A 1 34 ? 9.156   9.011   5.300  1.00 3.27 ?  34 LEU A HD12 1  
ATOM   559  H HD13 . LEU A 1 34 ? 9.882   7.739   6.280  1.00 2.92 ?  34 LEU A HD13 1  
ATOM   560  H HD21 . LEU A 1 34 ? 8.396   5.360   5.222  1.00 3.53 ?  34 LEU A HD21 1  
ATOM   561  H HD22 . LEU A 1 34 ? 10.148  5.471   5.389  1.00 3.41 ?  34 LEU A HD22 1  
ATOM   562  H HD23 . LEU A 1 34 ? 9.436   5.035   3.836  1.00 3.42 ?  34 LEU A HD23 1  
ATOM   563  N N    . PHE A 1 35 ? 9.399   8.788   0.945  1.00 1.42 ?  35 PHE A N    1  
ATOM   564  C CA   . PHE A 1 35 ? 10.542  9.209   0.151  1.00 1.78 ?  35 PHE A CA   1  
ATOM   565  C C    . PHE A 1 35 ? 10.086  9.694   -1.217 1.00 2.17 ?  35 PHE A C    1  
ATOM   566  O O    . PHE A 1 35 ? 10.361  9.070   -2.243 1.00 2.84 ?  35 PHE A O    1  
ATOM   567  C CB   . PHE A 1 35 ? 11.552  8.067   0.002  1.00 1.55 ?  35 PHE A CB   1  
ATOM   568  C CG   . PHE A 1 35 ? 12.226  7.679   1.290  1.00 1.48 ?  35 PHE A CG   1  
ATOM   569  C CD1  . PHE A 1 35 ? 11.954  6.463   1.893  1.00 1.95 ?  35 PHE A CD1  1  
ATOM   570  C CD2  . PHE A 1 35 ? 13.133  8.534   1.894  1.00 1.61 ?  35 PHE A CD2  1  
ATOM   571  C CE1  . PHE A 1 35 ? 12.577  6.106   3.075  1.00 2.46 ?  35 PHE A CE1  1  
ATOM   572  C CE2  . PHE A 1 35 ? 13.757  8.184   3.075  1.00 1.99 ?  35 PHE A CE2  1  
ATOM   573  C CZ   . PHE A 1 35 ? 13.479  6.968   3.667  1.00 2.41 ?  35 PHE A CZ   1  
ATOM   574  H H    . PHE A 1 35 ? 8.766   8.135   0.568  1.00 1.04 ?  35 PHE A H    1  
ATOM   575  H HA   . PHE A 1 35 ? 11.015  10.031  0.668  1.00 2.31 ?  35 PHE A HA   1  
ATOM   576  H HB2  . PHE A 1 35 ? 11.042  7.196   -0.382 1.00 1.53 ?  35 PHE A HB2  1  
ATOM   577  H HB3  . PHE A 1 35 ? 12.317  8.364   -0.699 1.00 1.88 ?  35 PHE A HB3  1  
ATOM   578  H HD1  . PHE A 1 35 ? 11.250  5.787   1.433  1.00 2.21 ?  35 PHE A HD1  1  
ATOM   579  H HD2  . PHE A 1 35 ? 13.351  9.484   1.432  1.00 1.82 ?  35 PHE A HD2  1  
ATOM   580  H HE1  . PHE A 1 35 ? 12.356  5.155   3.536  1.00 3.08 ?  35 PHE A HE1  1  
ATOM   581  H HE2  . PHE A 1 35 ? 14.462  8.861   3.535  1.00 2.26 ?  35 PHE A HE2  1  
ATOM   582  H HZ   . PHE A 1 35 ? 13.966  6.692   4.591  1.00 2.93 ?  35 PHE A HZ   1  
HETATM 583  N N    . NH2 A 1 36 ? 9.396   10.820  -1.228 1.00 2.32 ?  36 NH2 A N    1  
HETATM 584  H HN1  . NH2 A 1 36 ? 9.216   11.261  -0.369 1.00 2.41 ?  36 NH2 A HN1  1  
HETATM 585  H HN2  . NH2 A 1 36 ? 9.087   11.167  -2.091 1.00 2.69 ?  36 NH2 A HN2  1  
ATOM   586  N N    . LEU A 1 1  ? -7.258  5.987   6.690  1.00 1.11 ?  1  LEU A N    2  
ATOM   587  C CA   . LEU A 1 1  ? -7.618  5.549   5.324  1.00 0.77 ?  1  LEU A CA   2  
ATOM   588  C C    . LEU A 1 1  ? -8.476  4.293   5.374  1.00 0.62 ?  1  LEU A C    2  
ATOM   589  O O    . LEU A 1 1  ? -8.031  3.248   5.853  1.00 0.66 ?  1  LEU A O    2  
ATOM   590  C CB   . LEU A 1 1  ? -6.353  5.266   4.503  1.00 0.91 ?  1  LEU A CB   2  
ATOM   591  C CG   . LEU A 1 1  ? -5.419  6.459   4.288  1.00 1.01 ?  1  LEU A CG   2  
ATOM   592  C CD1  . LEU A 1 1  ? -4.129  6.004   3.621  1.00 1.23 ?  1  LEU A CD1  2  
ATOM   593  C CD2  . LEU A 1 1  ? -6.097  7.531   3.446  1.00 1.78 ?  1  LEU A CD2  2  
ATOM   594  H H1   . LEU A 1 1  ? -8.118  6.199   7.235  1.00 1.40 ?  1  LEU A H1   2  
ATOM   595  H H2   . LEU A 1 1  ? -6.670  6.841   6.651  1.00 1.62 ?  1  LEU A H2   2  
ATOM   596  H H3   . LEU A 1 1  ? -6.730  5.238   7.181  1.00 1.61 ?  1  LEU A H3   2  
ATOM   597  H HA   . LEU A 1 1  ? -8.180  6.338   4.849  1.00 0.75 ?  1  LEU A HA   2  
ATOM   598  H HB2  . LEU A 1 1  ? -5.795  4.486   5.001  1.00 1.23 ?  1  LEU A HB2  2  
ATOM   599  H HB3  . LEU A 1 1  ? -6.658  4.899   3.535  1.00 1.43 ?  1  LEU A HB3  2  
ATOM   600  H HG   . LEU A 1 1  ? -5.167  6.891   5.245  1.00 1.75 ?  1  LEU A HG   2  
ATOM   601  H HD11 . LEU A 1 1  ? -3.629  5.288   4.255  1.00 1.48 ?  1  LEU A HD11 2  
ATOM   602  H HD12 . LEU A 1 1  ? -3.485  6.857   3.464  1.00 1.80 ?  1  LEU A HD12 2  
ATOM   603  H HD13 . LEU A 1 1  ? -4.358  5.546   2.670  1.00 1.91 ?  1  LEU A HD13 2  
ATOM   604  H HD21 . LEU A 1 1  ? -6.389  7.109   2.495  1.00 2.17 ?  1  LEU A HD21 2  
ATOM   605  H HD22 . LEU A 1 1  ? -5.410  8.348   3.281  1.00 2.45 ?  1  LEU A HD22 2  
ATOM   606  H HD23 . LEU A 1 1  ? -6.973  7.895   3.961  1.00 2.19 ?  1  LEU A HD23 2  
ATOM   607  N N    . SER A 1 2  ? -9.708  4.401   4.899  1.00 0.58 ?  2  SER A N    2  
ATOM   608  C CA   . SER A 1 2  ? -10.567 3.237   4.753  1.00 0.59 ?  2  SER A CA   2  
ATOM   609  C C    . SER A 1 2  ? -10.024 2.346   3.641  1.00 0.53 ?  2  SER A C    2  
ATOM   610  O O    . SER A 1 2  ? -9.242  2.819   2.819  1.00 0.45 ?  2  SER A O    2  
ATOM   611  C CB   . SER A 1 2  ? -11.995 3.673   4.430  1.00 0.72 ?  2  SER A CB   2  
ATOM   612  O OG   . SER A 1 2  ? -12.458 4.641   5.359  1.00 1.28 ?  2  SER A OG   2  
ATOM   613  H H    . SER A 1 2  ? -10.054 5.284   4.648  1.00 0.63 ?  2  SER A H    2  
ATOM   614  H HA   . SER A 1 2  ? -10.558 2.690   5.682  1.00 0.67 ?  2  SER A HA   2  
ATOM   615  H HB2  . SER A 1 2  ? -12.021 4.102   3.439  1.00 1.39 ?  2  SER A HB2  2  
ATOM   616  H HB3  . SER A 1 2  ? -12.648 2.814   4.467  1.00 1.05 ?  2  SER A HB3  2  
ATOM   617  H HG   . SER A 1 2  ? -13.146 5.177   4.943  1.00 1.66 ?  2  SER A HG   2  
ATOM   618  N N    . ASP A 1 3  ? -10.424 1.082   3.606  1.00 0.61 ?  3  ASP A N    2  
ATOM   619  C CA   . ASP A 1 3  ? -9.880  0.131   2.628  1.00 0.60 ?  3  ASP A CA   2  
ATOM   620  C C    . ASP A 1 3  ? -9.980  0.674   1.209  1.00 0.49 ?  3  ASP A C    2  
ATOM   621  O O    . ASP A 1 3  ? -9.049  0.545   0.414  1.00 0.40 ?  3  ASP A O    2  
ATOM   622  C CB   . ASP A 1 3  ? -10.603 -1.213  2.710  1.00 0.76 ?  3  ASP A CB   2  
ATOM   623  C CG   . ASP A 1 3  ? -10.334 -1.937  4.009  1.00 1.42 ?  3  ASP A CG   2  
ATOM   624  O OD1  . ASP A 1 3  ? -9.246  -2.530  4.148  1.00 1.93 ?  3  ASP A OD1  2  
ATOM   625  O OD2  . ASP A 1 3  ? -11.206 -1.911  4.904  1.00 2.11 -1 3  ASP A OD2  2  
ATOM   626  H H    . ASP A 1 3  ? -11.100 0.776   4.248  1.00 0.71 ?  3  ASP A H    2  
ATOM   627  H HA   . ASP A 1 3  ? -8.839  -0.019  2.866  1.00 0.62 ?  3  ASP A HA   2  
ATOM   628  H HB2  . ASP A 1 3  ? -11.665 -1.049  2.624  1.00 1.30 ?  3  ASP A HB2  2  
ATOM   629  H HB3  . ASP A 1 3  ? -10.274 -1.841  1.895  1.00 1.20 ?  3  ASP A HB3  2  
ATOM   630  N N    . GLU A 1 4  ? -11.107 1.302   0.918  1.00 0.58 ?  4  GLU A N    2  
ATOM   631  C CA   . GLU A 1 4  ? -11.364 1.881   -0.391 1.00 0.58 ?  4  GLU A CA   2  
ATOM   632  C C    . GLU A 1 4  ? -10.408 3.042   -0.676 1.00 0.43 ?  4  GLU A C    2  
ATOM   633  O O    . GLU A 1 4  ? -9.952  3.226   -1.806 1.00 0.38 ?  4  GLU A O    2  
ATOM   634  C CB   . GLU A 1 4  ? -12.809 2.357   -0.443 1.00 0.80 ?  4  GLU A CB   2  
ATOM   635  C CG   . GLU A 1 4  ? -13.282 2.761   -1.821 1.00 1.35 ?  4  GLU A CG   2  
ATOM   636  C CD   . GLU A 1 4  ? -14.715 3.236   -1.805 1.00 1.81 ?  4  GLU A CD   2  
ATOM   637  O OE1  . GLU A 1 4  ? -14.957 4.415   -2.150 1.00 2.46 ?  4  GLU A OE1  2  
ATOM   638  O OE2  . GLU A 1 4  ? -15.607 2.437   -1.460 1.00 2.08 -1 4  GLU A OE2  2  
ATOM   639  H H    . GLU A 1 4  ? -11.799 1.373   1.609  1.00 0.68 ?  4  GLU A H    2  
ATOM   640  H HA   . GLU A 1 4  ? -11.216 1.112   -1.134 1.00 0.59 ?  4  GLU A HA   2  
ATOM   641  H HB2  . GLU A 1 4  ? -13.448 1.562   -0.089 1.00 1.07 ?  4  GLU A HB2  2  
ATOM   642  H HB3  . GLU A 1 4  ? -12.916 3.208   0.213  1.00 1.03 ?  4  GLU A HB3  2  
ATOM   643  H HG2  . GLU A 1 4  ? -12.653 3.559   -2.187 1.00 1.90 ?  4  GLU A HG2  2  
ATOM   644  H HG3  . GLU A 1 4  ? -13.205 1.908   -2.479 1.00 1.77 ?  4  GLU A HG3  2  
ATOM   645  N N    . ASP A 1 5  ? -10.090 3.809   0.360  1.00 0.44 ?  5  ASP A N    2  
ATOM   646  C CA   . ASP A 1 5  ? -9.190  4.950   0.224  1.00 0.40 ?  5  ASP A CA   2  
ATOM   647  C C    . ASP A 1 5  ? -7.765  4.457   0.053  1.00 0.28 ?  5  ASP A C    2  
ATOM   648  O O    . ASP A 1 5  ? -6.981  5.010   -0.716 1.00 0.29 ?  5  ASP A O    2  
ATOM   649  C CB   . ASP A 1 5  ? -9.278  5.860   1.452  1.00 0.52 ?  5  ASP A CB   2  
ATOM   650  C CG   . ASP A 1 5  ? -10.616 6.555   1.571  1.00 1.11 ?  5  ASP A CG   2  
ATOM   651  O OD1  . ASP A 1 5  ? -10.749 7.694   1.075  1.00 1.17 ?  5  ASP A OD1  2  
ATOM   652  O OD2  . ASP A 1 5  ? -11.546 5.961   2.152  1.00 1.82 -1 5  ASP A OD2  2  
ATOM   653  H H    . ASP A 1 5  ? -10.448 3.588   1.249  1.00 0.51 ?  5  ASP A H    2  
ATOM   654  H HA   . ASP A 1 5  ? -9.479  5.505   -0.656 1.00 0.43 ?  5  ASP A HA   2  
ATOM   655  H HB2  . ASP A 1 5  ? -9.122  5.268   2.340  1.00 1.00 ?  5  ASP A HB2  2  
ATOM   656  H HB3  . ASP A 1 5  ? -8.507  6.613   1.388  1.00 0.82 ?  5  ASP A HB3  2  
ATOM   657  N N    . PHE A 1 6  ? -7.455  3.399   0.783  1.00 0.24 ?  6  PHE A N    2  
ATOM   658  C CA   . PHE A 1 6  ? -6.175  2.727   0.687  1.00 0.18 ?  6  PHE A CA   2  
ATOM   659  C C    . PHE A 1 6  ? -5.990  2.197   -0.729 1.00 0.13 ?  6  PHE A C    2  
ATOM   660  O O    . PHE A 1 6  ? -4.913  2.305   -1.316 1.00 0.15 ?  6  PHE A O    2  
ATOM   661  C CB   . PHE A 1 6  ? -6.145  1.584   1.703  1.00 0.23 ?  6  PHE A CB   2  
ATOM   662  C CG   . PHE A 1 6  ? -4.807  0.940   1.887  1.00 0.25 ?  6  PHE A CG   2  
ATOM   663  C CD1  . PHE A 1 6  ? -4.009  1.266   2.966  1.00 0.43 ?  6  PHE A CD1  2  
ATOM   664  C CD2  . PHE A 1 6  ? -4.338  0.022   0.963  1.00 0.25 ?  6  PHE A CD2  2  
ATOM   665  C CE1  . PHE A 1 6  ? -2.770  0.689   3.124  1.00 0.50 ?  6  PHE A CE1  2  
ATOM   666  C CE2  . PHE A 1 6  ? -3.096  -0.562  1.117  1.00 0.35 ?  6  PHE A CE2  2  
ATOM   667  C CZ   . PHE A 1 6  ? -2.344  -0.282  2.253  1.00 0.43 ?  6  PHE A CZ   2  
ATOM   668  H H    . PHE A 1 6  ? -8.120  3.053   1.415  1.00 0.29 ?  6  PHE A H    2  
ATOM   669  H HA   . PHE A 1 6  ? -5.393  3.435   0.911  1.00 0.23 ?  6  PHE A HA   2  
ATOM   670  H HB2  . PHE A 1 6  ? -6.458  1.963   2.663  1.00 0.31 ?  6  PHE A HB2  2  
ATOM   671  H HB3  . PHE A 1 6  ? -6.840  0.820   1.385  1.00 0.27 ?  6  PHE A HB3  2  
ATOM   672  H HD1  . PHE A 1 6  ? -4.367  1.981   3.692  1.00 0.55 ?  6  PHE A HD1  2  
ATOM   673  H HD2  . PHE A 1 6  ? -4.956  -0.239  0.118  1.00 0.29 ?  6  PHE A HD2  2  
ATOM   674  H HE1  . PHE A 1 6  ? -2.161  0.951   3.971  1.00 0.65 ?  6  PHE A HE1  2  
ATOM   675  H HE2  . PHE A 1 6  ? -2.741  -1.275  0.390  1.00 0.43 ?  6  PHE A HE2  2  
ATOM   676  H HZ   . PHE A 1 6  ? -1.386  -0.760  2.395  1.00 0.51 ?  6  PHE A HZ   2  
ATOM   677  N N    . LYS A 1 7  ? -7.065  1.643   -1.272 1.00 0.13 ?  7  LYS A N    2  
ATOM   678  C CA   . LYS A 1 7  ? -7.080  1.162   -2.641 1.00 0.15 ?  7  LYS A CA   2  
ATOM   679  C C    . LYS A 1 7  ? -6.899  2.319   -3.613 1.00 0.19 ?  7  LYS A C    2  
ATOM   680  O O    . LYS A 1 7  ? -6.222  2.191   -4.625 1.00 0.23 ?  7  LYS A O    2  
ATOM   681  C CB   . LYS A 1 7  ? -8.392  0.435   -2.928 1.00 0.23 ?  7  LYS A CB   2  
ATOM   682  C CG   . LYS A 1 7  ? -8.494  -0.103  -4.343 1.00 0.30 ?  7  LYS A CG   2  
ATOM   683  C CD   . LYS A 1 7  ? -9.794  -0.853  -4.559 1.00 0.44 ?  7  LYS A CD   2  
ATOM   684  C CE   . LYS A 1 7  ? -9.911  -1.362  -5.986 1.00 1.26 ?  7  LYS A CE   2  
ATOM   685  N NZ   . LYS A 1 7  ? -10.028 -0.252  -6.966 1.00 2.06 1  7  LYS A NZ   2  
ATOM   686  H H    . LYS A 1 7  ? -7.875  1.540   -0.724 1.00 0.18 ?  7  LYS A H    2  
ATOM   687  H HA   . LYS A 1 7  ? -6.259  0.473   -2.760 1.00 0.15 ?  7  LYS A HA   2  
ATOM   688  H HB2  . LYS A 1 7  ? -8.492  -0.390  -2.241 1.00 0.28 ?  7  LYS A HB2  2  
ATOM   689  H HB3  . LYS A 1 7  ? -9.209  1.123   -2.770 1.00 0.25 ?  7  LYS A HB3  2  
ATOM   690  H HG2  . LYS A 1 7  ? -8.446  0.723   -5.035 1.00 0.31 ?  7  LYS A HG2  2  
ATOM   691  H HG3  . LYS A 1 7  ? -7.667  -0.772  -4.523 1.00 0.36 ?  7  LYS A HG3  2  
ATOM   692  H HD2  . LYS A 1 7  ? -9.828  -1.695  -3.884 1.00 1.10 ?  7  LYS A HD2  2  
ATOM   693  H HD3  . LYS A 1 7  ? -10.621 -0.190  -4.354 1.00 0.92 ?  7  LYS A HD3  2  
ATOM   694  H HE2  . LYS A 1 7  ? -9.031  -1.941  -6.218 1.00 1.83 ?  7  LYS A HE2  2  
ATOM   695  H HE3  . LYS A 1 7  ? -10.784 -1.992  -6.061 1.00 1.84 ?  7  LYS A HE3  2  
ATOM   696  H HZ1  . LYS A 1 7  ? -10.087 -0.634  -7.931 1.00 2.69 ?  7  LYS A HZ1  2  
ATOM   697  H HZ2  . LYS A 1 7  ? -9.202  0.373   -6.905 1.00 2.55 ?  7  LYS A HZ2  2  
ATOM   698  H HZ3  . LYS A 1 7  ? -10.885 0.307   -6.777 1.00 2.30 ?  7  LYS A HZ3  2  
ATOM   699  N N    . ALA A 1 8  ? -7.511  3.450   -3.299 1.00 0.22 ?  8  ALA A N    2  
ATOM   700  C CA   . ALA A 1 8  ? -7.357  4.648   -4.113 1.00 0.30 ?  8  ALA A CA   2  
ATOM   701  C C    . ALA A 1 8  ? -5.900  5.103   -4.142 1.00 0.35 ?  8  ALA A C    2  
ATOM   702  O O    . ALA A 1 8  ? -5.401  5.559   -5.171 1.00 0.45 ?  8  ALA A O    2  
ATOM   703  C CB   . ALA A 1 8  ? -8.252  5.759   -3.590 1.00 0.35 ?  8  ALA A CB   2  
ATOM   704  H H    . ALA A 1 8  ? -8.093  3.479   -2.507 1.00 0.22 ?  8  ALA A H    2  
ATOM   705  H HA   . ALA A 1 8  ? -7.670  4.408   -5.118 1.00 0.34 ?  8  ALA A HA   2  
ATOM   706  H HB1  . ALA A 1 8  ? -7.930  6.044   -2.600 1.00 1.02 ?  8  ALA A HB1  2  
ATOM   707  H HB2  . ALA A 1 8  ? -9.273  5.409   -3.550 1.00 1.02 ?  8  ALA A HB2  2  
ATOM   708  H HB3  . ALA A 1 8  ? -8.189  6.613   -4.249 1.00 1.04 ?  8  ALA A HB3  2  
ATOM   709  N N    . VAL A 1 9  ? -5.221  4.966   -3.008 1.00 0.31 ?  9  VAL A N    2  
ATOM   710  C CA   . VAL A 1 9  ? -3.822  5.361   -2.897 1.00 0.39 ?  9  VAL A CA   2  
ATOM   711  C C    . VAL A 1 9  ? -2.900  4.379   -3.621 1.00 0.38 ?  9  VAL A C    2  
ATOM   712  O O    . VAL A 1 9  ? -2.200  4.745   -4.566 1.00 0.49 ?  9  VAL A O    2  
ATOM   713  C CB   . VAL A 1 9  ? -3.379  5.460   -1.418 1.00 0.42 ?  9  VAL A CB   2  
ATOM   714  C CG1  . VAL A 1 9  ? -1.913  5.850   -1.320 1.00 0.52 ?  9  VAL A CG1  2  
ATOM   715  C CG2  . VAL A 1 9  ? -4.241  6.451   -0.658 1.00 0.50 ?  9  VAL A CG2  2  
ATOM   716  H H    . VAL A 1 9  ? -5.681  4.598   -2.218 1.00 0.26 ?  9  VAL A H    2  
ATOM   717  H HA   . VAL A 1 9  ? -3.716  6.336   -3.347 1.00 0.47 ?  9  VAL A HA   2  
ATOM   718  H HB   . VAL A 1 9  ? -3.500  4.488   -0.961 1.00 0.37 ?  9  VAL A HB   2  
ATOM   719  H HG11 . VAL A 1 9  ? -1.310  5.114   -1.830 1.00 0.97 ?  9  VAL A HG11 2  
ATOM   720  H HG12 . VAL A 1 9  ? -1.623  5.898   -0.282 1.00 0.84 ?  9  VAL A HG12 2  
ATOM   721  H HG13 . VAL A 1 9  ? -1.767  6.817   -1.779 1.00 1.18 ?  9  VAL A HG13 2  
ATOM   722  H HG21 . VAL A 1 9  ? -5.271  6.129   -0.688 1.00 0.95 ?  9  VAL A HG21 2  
ATOM   723  H HG22 . VAL A 1 9  ? -4.154  7.425   -1.113 1.00 0.76 ?  9  VAL A HG22 2  
ATOM   724  H HG23 . VAL A 1 9  ? -3.911  6.501   0.370  1.00 0.91 ?  9  VAL A HG23 2  
ATOM   725  N N    . PHE A 1 10 ? -2.923  3.130   -3.181 1.00 0.29 ?  10 PHE A N    2  
ATOM   726  C CA   . PHE A 1 10 ? -1.950  2.139   -3.623 1.00 0.33 ?  10 PHE A CA   2  
ATOM   727  C C    . PHE A 1 10 ? -2.394  1.404   -4.884 1.00 0.35 ?  10 PHE A C    2  
ATOM   728  O O    . PHE A 1 10 ? -1.563  0.906   -5.643 1.00 0.45 ?  10 PHE A O    2  
ATOM   729  C CB   . PHE A 1 10 ? -1.692  1.136   -2.500 1.00 0.32 ?  10 PHE A CB   2  
ATOM   730  C CG   . PHE A 1 10 ? -1.034  1.747   -1.298 1.00 0.33 ?  10 PHE A CG   2  
ATOM   731  C CD1  . PHE A 1 10 ? -1.790  2.267   -0.262 1.00 0.39 ?  10 PHE A CD1  2  
ATOM   732  C CD2  . PHE A 1 10 ? 0.343   1.799   -1.208 1.00 0.39 ?  10 PHE A CD2  2  
ATOM   733  C CE1  . PHE A 1 10 ? -1.181  2.827   0.842  1.00 0.41 ?  10 PHE A CE1  2  
ATOM   734  C CE2  . PHE A 1 10 ? 0.960   2.357   -0.107 1.00 0.42 ?  10 PHE A CE2  2  
ATOM   735  C CZ   . PHE A 1 10 ? 0.197   2.870   0.921  1.00 0.37 ?  10 PHE A CZ   2  
ATOM   736  H H    . PHE A 1 10 ? -3.613  2.864   -2.533 1.00 0.22 ?  10 PHE A H    2  
ATOM   737  H HA   . PHE A 1 10 ? -1.030  2.658   -3.837 1.00 0.39 ?  10 PHE A HA   2  
ATOM   738  H HB2  . PHE A 1 10 ? -2.633  0.711   -2.183 1.00 0.30 ?  10 PHE A HB2  2  
ATOM   739  H HB3  . PHE A 1 10 ? -1.051  0.348   -2.868 1.00 0.37 ?  10 PHE A HB3  2  
ATOM   740  H HD1  . PHE A 1 10 ? -2.867  2.229   -0.320 1.00 0.48 ?  10 PHE A HD1  2  
ATOM   741  H HD2  . PHE A 1 10 ? 0.937   1.401   -2.013 1.00 0.47 ?  10 PHE A HD2  2  
ATOM   742  H HE1  . PHE A 1 10 ? -1.783  3.231   1.640  1.00 0.50 ?  10 PHE A HE1  2  
ATOM   743  H HE2  . PHE A 1 10 ? 2.038   2.389   -0.047 1.00 0.52 ?  10 PHE A HE2  2  
ATOM   744  H HZ   . PHE A 1 10 ? 0.677   3.303   1.785  1.00 0.39 ?  10 PHE A HZ   2  
ATOM   745  N N    . GLY A 1 11 ? -3.692  1.342   -5.112 1.00 0.28 ?  11 GLY A N    2  
ATOM   746  C CA   . GLY A 1 11 ? -4.207  0.610   -6.250 1.00 0.31 ?  11 GLY A CA   2  
ATOM   747  C C    . GLY A 1 11 ? -4.853  -0.697  -5.841 1.00 0.29 ?  11 GLY A C    2  
ATOM   748  O O    . GLY A 1 11 ? -5.477  -1.376  -6.658 1.00 0.36 ?  11 GLY A O    2  
ATOM   749  H H    . GLY A 1 11 ? -4.315  1.812   -4.513 1.00 0.24 ?  11 GLY A H    2  
ATOM   750  H HA2  . GLY A 1 11 ? -4.938  1.219   -6.757 1.00 0.32 ?  11 GLY A HA2  2  
ATOM   751  H HA3  . GLY A 1 11 ? -3.393  0.401   -6.928 1.00 0.35 ?  11 GLY A HA3  2  
HETATM 752  N N    . NLE A 1 12 ? -4.706  -1.048  -4.570 1.00 0.24 ?  12 NLE A N    2  
HETATM 753  C CA   . NLE A 1 12 ? -5.266  -2.283  -4.042 1.00 0.24 ?  12 NLE A CA   2  
HETATM 754  C C    . NLE A 1 12 ? -5.653  -2.098  -2.579 1.00 0.21 ?  12 NLE A C    2  
HETATM 755  O O    . NLE A 1 12 ? -5.142  -1.201  -1.907 1.00 0.22 ?  12 NLE A O    2  
HETATM 756  C CB   . NLE A 1 12 ? -4.276  -3.450  -4.186 1.00 0.27 ?  12 NLE A CB   2  
HETATM 757  C CG   . NLE A 1 12 ? -3.005  -3.332  -3.347 1.00 0.64 ?  12 NLE A CG   2  
HETATM 758  C CD   . NLE A 1 12 ? -2.018  -2.313  -3.905 1.00 0.33 ?  12 NLE A CD   2  
HETATM 759  C CE   . NLE A 1 12 ? -1.526  -2.739  -5.275 1.00 0.64 ?  12 NLE A CE   2  
HETATM 760  H H    . NLE A 1 12 ? -4.213  -0.457  -3.966 1.00 0.26 ?  12 NLE A H    2  
HETATM 761  H HA   . NLE A 1 12 ? -6.157  -2.506  -4.609 1.00 0.26 ?  12 NLE A HA   2  
HETATM 762  H HB2  . NLE A 1 12 ? -3.990  -3.533  -5.222 1.00 0.51 ?  12 NLE A HB2  2  
HETATM 763  H HB3  . NLE A 1 12 ? -4.779  -4.358  -3.896 1.00 0.31 ?  12 NLE A HB3  2  
HETATM 764  H HG2  . NLE A 1 12 ? -2.525  -4.300  -3.310 1.00 1.24 ?  12 NLE A HG2  2  
HETATM 765  H HG3  . NLE A 1 12 ? -3.279  -3.033  -2.346 1.00 1.24 ?  12 NLE A HG3  2  
HETATM 766  H HD2  . NLE A 1 12 ? -1.169  -2.237  -3.242 1.00 0.70 ?  12 NLE A HD2  2  
HETATM 767  H HD3  . NLE A 1 12 ? -2.504  -1.354  -3.994 1.00 0.43 ?  12 NLE A HD3  2  
HETATM 768  H HE1  . NLE A 1 12 ? -1.078  -3.719  -5.210 1.00 1.10 ?  12 NLE A HE1  2  
HETATM 769  H HE2  . NLE A 1 12 ? -0.792  -2.031  -5.630 1.00 1.19 ?  12 NLE A HE2  2  
HETATM 770  H HE3  . NLE A 1 12 ? -2.357  -2.768  -5.964 1.00 1.26 ?  12 NLE A HE3  2  
ATOM   771  N N    . THR A 1 13 ? -6.565  -2.938  -2.102 1.00 0.24 ?  13 THR A N    2  
ATOM   772  C CA   . THR A 1 13 ? -7.035  -2.865  -0.726 1.00 0.27 ?  13 THR A CA   2  
ATOM   773  C C    . THR A 1 13 ? -5.997  -3.417  0.241  1.00 0.24 ?  13 THR A C    2  
ATOM   774  O O    . THR A 1 13 ? -5.079  -4.116  -0.181 1.00 0.23 ?  13 THR A O    2  
ATOM   775  C CB   . THR A 1 13 ? -8.349  -3.644  -0.550 1.00 0.34 ?  13 THR A CB   2  
ATOM   776  O OG1  . THR A 1 13 ? -8.256  -4.903  -1.232 1.00 0.36 ?  13 THR A OG1  2  
ATOM   777  C CG2  . THR A 1 13 ? -9.530  -2.844  -1.083 1.00 0.43 ?  13 THR A CG2  2  
ATOM   778  H H    . THR A 1 13 ? -6.926  -3.635  -2.691 1.00 0.27 ?  13 THR A H    2  
ATOM   779  H HA   . THR A 1 13 ? -7.220  -1.827  -0.488 1.00 0.30 ?  13 THR A HA   2  
ATOM   780  H HB   . THR A 1 13 ? -8.502  -3.826  0.505  1.00 0.34 ?  13 THR A HB   2  
ATOM   781  H HG1  . THR A 1 13 ? -9.143  -5.237  -1.419 1.00 0.58 ?  13 THR A HG1  2  
ATOM   782  H HG21 . THR A 1 13 ? -9.390  -2.663  -2.138 1.00 0.92 ?  13 THR A HG21 2  
ATOM   783  H HG22 . THR A 1 13 ? -9.591  -1.901  -0.561 1.00 1.34 ?  13 THR A HG22 2  
ATOM   784  H HG23 . THR A 1 13 ? -10.443 -3.399  -0.930 1.00 1.02 ?  13 THR A HG23 2  
ATOM   785  N N    . ARG A 1 14 ? -6.150  -3.126  1.531  1.00 0.29 ?  14 ARG A N    2  
ATOM   786  C CA   . ARG A 1 14 ? -5.163  -3.532  2.533  1.00 0.32 ?  14 ARG A CA   2  
ATOM   787  C C    . ARG A 1 14 ? -4.871  -5.027  2.458  1.00 0.30 ?  14 ARG A C    2  
ATOM   788  O O    . ARG A 1 14 ? -3.715  -5.439  2.535  1.00 0.31 ?  14 ARG A O    2  
ATOM   789  C CB   . ARG A 1 14 ? -5.635  -3.159  3.940  1.00 0.42 ?  14 ARG A CB   2  
ATOM   790  C CG   . ARG A 1 14 ? -5.555  -1.670  4.232  1.00 0.53 ?  14 ARG A CG   2  
ATOM   791  C CD   . ARG A 1 14 ? -6.005  -1.348  5.647  1.00 0.77 ?  14 ARG A CD   2  
ATOM   792  N NE   . ARG A 1 14 ? -7.420  -1.640  5.860  1.00 1.30 ?  14 ARG A NE   2  
ATOM   793  C CZ   . ARG A 1 14 ? -8.052  -1.465  7.019  1.00 1.88 ?  14 ARG A CZ   2  
ATOM   794  N NH1  . ARG A 1 14 ? -7.385  -1.040  8.086  1.00 2.02 1  14 ARG A NH1  2  
ATOM   795  N NH2  . ARG A 1 14 ? -9.351  -1.723  7.108  1.00 2.82 ?  14 ARG A NH2  2  
ATOM   796  H H    . ARG A 1 14 ? -6.950  -2.641  1.818  1.00 0.32 ?  14 ARG A H    2  
ATOM   797  H HA   . ARG A 1 14 ? -4.249  -2.995  2.321  1.00 0.34 ?  14 ARG A HA   2  
ATOM   798  H HB2  . ARG A 1 14 ? -6.661  -3.471  4.058  1.00 0.43 ?  14 ARG A HB2  2  
ATOM   799  H HB3  . ARG A 1 14 ? -5.024  -3.680  4.659  1.00 0.46 ?  14 ARG A HB3  2  
ATOM   800  H HG2  . ARG A 1 14 ? -4.531  -1.346  4.110  1.00 0.58 ?  14 ARG A HG2  2  
ATOM   801  H HG3  . ARG A 1 14 ? -6.186  -1.142  3.532  1.00 0.53 ?  14 ARG A HG3  2  
ATOM   802  H HD2  . ARG A 1 14 ? -5.421  -1.934  6.340  1.00 1.48 ?  14 ARG A HD2  2  
ATOM   803  H HD3  . ARG A 1 14 ? -5.835  -0.299  5.834  1.00 1.15 ?  14 ARG A HD3  2  
ATOM   804  H HE   . ARG A 1 14 ? -7.937  -1.980  5.084  1.00 1.80 ?  14 ARG A HE   2  
ATOM   805  H HH11 . ARG A 1 14 ? -7.861  -0.906  8.959  1.00 2.60 ?  14 ARG A HH11 2  
ATOM   806  H HH12 . ARG A 1 14 ? -6.401  -0.855  8.027  1.00 1.94 ?  14 ARG A HH12 2  
ATOM   807  H HH21 . ARG A 1 14 ? -9.857  -2.050  6.298  1.00 3.23 ?  14 ARG A HH21 2  
ATOM   808  H HH22 . ARG A 1 14 ? -9.836  -1.599  7.978  1.00 3.30 ?  14 ARG A HH22 2  
HETATM 809  N N    . AIB A 1 15 ? -5.923  -5.821  2.278  1.00 0.31 ?  15 AIB A N    2  
HETATM 810  C CA   . AIB A 1 15 ? -5.801  -7.279  2.151  1.00 0.33 ?  15 AIB A CA   2  
HETATM 811  C C    . AIB A 1 15 ? -4.867  -7.614  0.980  1.00 0.30 ?  15 AIB A C    2  
HETATM 812  O O    . AIB A 1 15 ? -3.956  -8.444  1.101  1.00 0.30 ?  15 AIB A O    2  
HETATM 813  C CB1  . AIB A 1 15 ? -7.167  -7.873  1.890  1.00 0.37 ?  15 AIB A CB1  2  
HETATM 814  C CB2  . AIB A 1 15 ? -5.281  -7.882  3.444  1.00 0.37 ?  15 AIB A CB2  2  
HETATM 815  H H    . AIB A 1 15 ? -6.817  -5.415  2.227  1.00 0.31 ?  15 AIB A H    2  
HETATM 816  H HB11 . AIB A 1 15 ? -7.822  -7.648  2.717  1.00 1.00 ?  15 AIB A HB11 2  
HETATM 817  H HB12 . AIB A 1 15 ? -7.079  -8.944  1.780  1.00 1.13 ?  15 AIB A HB12 2  
HETATM 818  H HB13 . AIB A 1 15 ? -7.574  -7.450  0.984  1.00 1.02 ?  15 AIB A HB13 2  
HETATM 819  H HB21 . AIB A 1 15 ? -5.210  -8.954  3.340  1.00 1.07 ?  15 AIB A HB21 2  
HETATM 820  H HB22 . AIB A 1 15 ? -5.959  -7.643  4.251  1.00 1.16 ?  15 AIB A HB22 2  
HETATM 821  H HB23 . AIB A 1 15 ? -4.305  -7.476  3.663  1.00 1.01 ?  15 AIB A HB23 2  
ATOM   822  N N    . ALA A 1 16 ? -5.079  -6.933  -0.140 1.00 0.27 ?  16 ALA A N    2  
ATOM   823  C CA   . ALA A 1 16 ? -4.317  -7.193  -1.350 1.00 0.26 ?  16 ALA A CA   2  
ATOM   824  C C    . ALA A 1 16 ? -2.906  -6.651  -1.210 1.00 0.23 ?  16 ALA A C    2  
ATOM   825  O O    . ALA A 1 16 ? -1.965  -7.156  -1.820 1.00 0.25 ?  16 ALA A O    2  
ATOM   826  C CB   . ALA A 1 16 ? -5.013  -6.573  -2.550 1.00 0.28 ?  16 ALA A CB   2  
ATOM   827  H H    . ALA A 1 16 ? -5.747  -6.209  -0.143 1.00 0.27 ?  16 ALA A H    2  
ATOM   828  H HA   . ALA A 1 16 ? -4.272  -8.261  -1.496 1.00 0.29 ?  16 ALA A HA   2  
ATOM   829  H HB1  . ALA A 1 16 ? -5.137  -5.514  -2.383 1.00 0.90 ?  16 ALA A HB1  2  
ATOM   830  H HB2  . ALA A 1 16 ? -5.980  -7.033  -2.684 1.00 0.96 ?  16 ALA A HB2  2  
ATOM   831  H HB3  . ALA A 1 16 ? -4.414  -6.729  -3.436 1.00 0.89 ?  16 ALA A HB3  2  
ATOM   832  N N    . PHE A 1 17 ? -2.774  -5.619  -0.396 1.00 0.20 ?  17 PHE A N    2  
ATOM   833  C CA   . PHE A 1 17 ? -1.487  -5.026  -0.097 1.00 0.19 ?  17 PHE A CA   2  
ATOM   834  C C    . PHE A 1 17 ? -0.649  -5.990  0.726  1.00 0.20 ?  17 PHE A C    2  
ATOM   835  O O    . PHE A 1 17 ? 0.495   -6.269  0.394  1.00 0.20 ?  17 PHE A O    2  
ATOM   836  C CB   . PHE A 1 17 ? -1.696  -3.720  0.659  1.00 0.22 ?  17 PHE A CB   2  
ATOM   837  C CG   . PHE A 1 17 ? -0.441  -2.935  0.893  1.00 0.24 ?  17 PHE A CG   2  
ATOM   838  C CD1  . PHE A 1 17 ? 0.071   -2.107  -0.093 1.00 0.28 ?  17 PHE A CD1  2  
ATOM   839  C CD2  . PHE A 1 17 ? 0.231   -3.034  2.097  1.00 0.28 ?  17 PHE A CD2  2  
ATOM   840  C CE1  . PHE A 1 17 ? 1.232   -1.392  0.122  1.00 0.33 ?  17 PHE A CE1  2  
ATOM   841  C CE2  . PHE A 1 17 ? 1.388   -2.321  2.315  1.00 0.32 ?  17 PHE A CE2  2  
ATOM   842  C CZ   . PHE A 1 17 ? 1.869   -1.464  1.325  1.00 0.33 ?  17 PHE A CZ   2  
ATOM   843  H H    . PHE A 1 17 ? -3.580  -5.233  0.014  1.00 0.21 ?  17 PHE A H    2  
ATOM   844  H HA   . PHE A 1 17 ? -0.984  -4.821  -1.029 1.00 0.19 ?  17 PHE A HA   2  
ATOM   845  H HB2  . PHE A 1 17 ? -2.371  -3.101  0.096  1.00 0.22 ?  17 PHE A HB2  2  
ATOM   846  H HB3  . PHE A 1 17 ? -2.136  -3.938  1.620  1.00 0.24 ?  17 PHE A HB3  2  
ATOM   847  H HD1  . PHE A 1 17 ? -0.449  -2.023  -1.035 1.00 0.30 ?  17 PHE A HD1  2  
ATOM   848  H HD2  . PHE A 1 17 ? -0.159  -3.675  2.873  1.00 0.30 ?  17 PHE A HD2  2  
ATOM   849  H HE1  . PHE A 1 17 ? 1.623   -0.749  -0.652 1.00 0.38 ?  17 PHE A HE1  2  
ATOM   850  H HE2  . PHE A 1 17 ? 1.901   -2.407  3.258  1.00 0.36 ?  17 PHE A HE2  2  
ATOM   851  H HZ   . PHE A 1 17 ? 2.770   -0.893  1.489  1.00 0.37 ?  17 PHE A HZ   2  
ATOM   852  N N    . ALA A 1 18 ? -1.241  -6.516  1.788  1.00 0.23 ?  18 ALA A N    2  
ATOM   853  C CA   . ALA A 1 18 ? -0.561  -7.468  2.652  1.00 0.25 ?  18 ALA A CA   2  
ATOM   854  C C    . ALA A 1 18 ? -0.305  -8.778  1.917  1.00 0.23 ?  18 ALA A C    2  
ATOM   855  O O    . ALA A 1 18 ? 0.561   -9.559  2.304  1.00 0.23 ?  18 ALA A O    2  
ATOM   856  C CB   . ALA A 1 18 ? -1.370  -7.708  3.913  1.00 0.30 ?  18 ALA A CB   2  
ATOM   857  H H    . ALA A 1 18 ? -2.163  -6.251  2.001  1.00 0.25 ?  18 ALA A H    2  
ATOM   858  H HA   . ALA A 1 18 ? 0.388   -7.037  2.937  1.00 0.27 ?  18 ALA A HA   2  
ATOM   859  H HB1  . ALA A 1 18 ? -1.566  -6.764  4.399  1.00 1.06 ?  18 ALA A HB1  2  
ATOM   860  H HB2  . ALA A 1 18 ? -0.813  -8.348  4.580  1.00 0.87 ?  18 ALA A HB2  2  
ATOM   861  H HB3  . ALA A 1 18 ? -2.305  -8.182  3.656  1.00 0.99 ?  18 ALA A HB3  2  
ATOM   862  N N    . ASN A 1 19 ? -1.083  -9.019  0.865  1.00 0.24 ?  19 ASN A N    2  
ATOM   863  C CA   . ASN A 1 19 ? -0.846  -10.153 -0.023 1.00 0.24 ?  19 ASN A CA   2  
ATOM   864  C C    . ASN A 1 19 ? 0.468   -9.974  -0.786 1.00 0.19 ?  19 ASN A C    2  
ATOM   865  O O    . ASN A 1 19 ? 1.127   -10.950 -1.151 1.00 0.22 ?  19 ASN A O    2  
ATOM   866  C CB   . ASN A 1 19 ? -2.010  -10.304 -1.011 1.00 0.31 ?  19 ASN A CB   2  
ATOM   867  C CG   . ASN A 1 19 ? -1.839  -11.485 -1.950 1.00 0.36 ?  19 ASN A CG   2  
ATOM   868  O OD1  . ASN A 1 19 ? -2.225  -12.606 -1.627 1.00 1.14 ?  19 ASN A OD1  2  
ATOM   869  N ND2  . ASN A 1 19 ? -1.279  -11.242 -3.125 1.00 1.08 ?  19 ASN A ND2  2  
ATOM   870  H H    . ASN A 1 19 ? -1.854  -8.431  0.696  1.00 0.25 ?  19 ASN A H    2  
ATOM   871  H HA   . ASN A 1 19 ? -0.779  -11.042 0.584  1.00 0.27 ?  19 ASN A HA   2  
ATOM   872  H HB2  . ASN A 1 19 ? -2.927  -10.441 -0.458 1.00 0.38 ?  19 ASN A HB2  2  
ATOM   873  H HB3  . ASN A 1 19 ? -2.086  -9.404  -1.605 1.00 0.32 ?  19 ASN A HB3  2  
ATOM   874  H HD21 . ASN A 1 19 ? -1.009  -10.322 -3.330 1.00 1.83 ?  19 ASN A HD21 2  
ATOM   875  H HD22 . ASN A 1 19 ? -1.153  -11.994 -3.740 1.00 1.08 ?  19 ASN A HD22 2  
ATOM   876  N N    . LEU A 1 20 ? 0.852   -8.719  -0.999 1.00 0.17 ?  20 LEU A N    2  
ATOM   877  C CA   . LEU A 1 20 ? 2.055   -8.397  -1.754 1.00 0.17 ?  20 LEU A CA   2  
ATOM   878  C C    . LEU A 1 20 ? 3.300   -8.764  -0.955 1.00 0.17 ?  20 LEU A C    2  
ATOM   879  O O    . LEU A 1 20 ? 3.262   -8.811  0.276  1.00 0.18 ?  20 LEU A O    2  
ATOM   880  C CB   . LEU A 1 20 ? 2.088   -6.904  -2.091 1.00 0.20 ?  20 LEU A CB   2  
ATOM   881  C CG   . LEU A 1 20 ? 0.895   -6.387  -2.896 1.00 0.29 ?  20 LEU A CG   2  
ATOM   882  C CD1  . LEU A 1 20 ? 0.953   -4.874  -3.016 1.00 0.32 ?  20 LEU A CD1  2  
ATOM   883  C CD2  . LEU A 1 20 ? 0.860   -7.030  -4.274 1.00 0.41 ?  20 LEU A CD2  2  
ATOM   884  H H    . LEU A 1 20 ? 0.322   -7.985  -0.615 1.00 0.19 ?  20 LEU A H    2  
ATOM   885  H HA   . LEU A 1 20 ? 2.040   -8.968  -2.669 1.00 0.22 ?  20 LEU A HA   2  
ATOM   886  H HB2  . LEU A 1 20 ? 2.137   -6.351  -1.164 1.00 0.19 ?  20 LEU A HB2  2  
ATOM   887  H HB3  . LEU A 1 20 ? 2.986   -6.705  -2.655 1.00 0.24 ?  20 LEU A HB3  2  
ATOM   888  H HG   . LEU A 1 20 ? -0.019  -6.646  -2.381 1.00 0.33 ?  20 LEU A HG   2  
ATOM   889  H HD11 . LEU A 1 20 ? 0.950   -4.433  -2.030 1.00 1.04 ?  20 LEU A HD11 2  
ATOM   890  H HD12 . LEU A 1 20 ? 0.094   -4.524  -3.569 1.00 1.05 ?  20 LEU A HD12 2  
ATOM   891  H HD13 . LEU A 1 20 ? 1.855   -4.586  -3.535 1.00 1.10 ?  20 LEU A HD13 2  
ATOM   892  H HD21 . LEU A 1 20 ? 0.732   -8.097  -4.170 1.00 1.10 ?  20 LEU A HD21 2  
ATOM   893  H HD22 . LEU A 1 20 ? 1.786   -6.829  -4.790 1.00 0.88 ?  20 LEU A HD22 2  
ATOM   894  H HD23 . LEU A 1 20 ? 0.037   -6.622  -4.841 1.00 1.17 ?  20 LEU A HD23 2  
ATOM   895  N N    . PRO A 1 21 ? 4.421   -9.033  -1.639 1.00 0.23 ?  21 PRO A N    2  
ATOM   896  C CA   . PRO A 1 21 ? 5.677   -9.376  -0.977 1.00 0.29 ?  21 PRO A CA   2  
ATOM   897  C C    . PRO A 1 21 ? 6.190   -8.236  -0.106 1.00 0.26 ?  21 PRO A C    2  
ATOM   898  O O    . PRO A 1 21 ? 5.972   -7.065  -0.437 1.00 0.22 ?  21 PRO A O    2  
ATOM   899  C CB   . PRO A 1 21 ? 6.650   -9.647  -2.128 1.00 0.38 ?  21 PRO A CB   2  
ATOM   900  C CG   . PRO A 1 21 ? 5.792   -9.852  -3.331 1.00 0.43 ?  21 PRO A CG   2  
ATOM   901  C CD   . PRO A 1 21 ? 4.555   -9.031  -3.104 1.00 0.30 ?  21 PRO A CD   2  
ATOM   902  H HA   . PRO A 1 21 ? 5.572   -10.266 -0.374 1.00 0.32 ?  21 PRO A HA   2  
ATOM   903  H HB2  . PRO A 1 21 ? 7.307   -8.795  -2.251 1.00 0.43 ?  21 PRO A HB2  2  
ATOM   904  H HB3  . PRO A 1 21 ? 7.235   -10.526 -1.907 1.00 0.48 ?  21 PRO A HB3  2  
ATOM   905  H HG2  . PRO A 1 21 ? 6.311   -9.510  -4.216 1.00 0.63 ?  21 PRO A HG2  2  
ATOM   906  H HG3  . PRO A 1 21 ? 5.536   -10.898 -3.424 1.00 0.61 ?  21 PRO A HG3  2  
ATOM   907  H HD2  . PRO A 1 21 ? 4.694   -8.027  -3.478 1.00 0.40 ?  21 PRO A HD2  2  
ATOM   908  H HD3  . PRO A 1 21 ? 3.700   -9.494  -3.573 1.00 0.39 ?  21 PRO A HD3  2  
ATOM   909  N N    . LEU A 1 22 ? 6.848   -8.569  0.995  1.00 0.30 ?  22 LEU A N    2  
ATOM   910  C CA   . LEU A 1 22 ? 7.275   -7.570  1.972  1.00 0.31 ?  22 LEU A CA   2  
ATOM   911  C C    . LEU A 1 22 ? 7.993   -6.400  1.315  1.00 0.28 ?  22 LEU A C    2  
ATOM   912  O O    . LEU A 1 22 ? 7.683   -5.241  1.601  1.00 0.28 ?  22 LEU A O    2  
ATOM   913  C CB   . LEU A 1 22 ? 8.172   -8.205  3.033  1.00 0.41 ?  22 LEU A CB   2  
ATOM   914  C CG   . LEU A 1 22 ? 7.461   -9.153  4.002  1.00 1.07 ?  22 LEU A CG   2  
ATOM   915  C CD1  . LEU A 1 22 ? 8.470   -9.848  4.897  1.00 1.64 ?  22 LEU A CD1  2  
ATOM   916  C CD2  . LEU A 1 22 ? 6.443   -8.392  4.842  1.00 1.54 ?  22 LEU A CD2  2  
ATOM   917  H H    . LEU A 1 22 ? 7.065   -9.513  1.153  1.00 0.34 ?  22 LEU A H    2  
ATOM   918  H HA   . LEU A 1 22 ? 6.389   -7.192  2.454  1.00 0.30 ?  22 LEU A HA   2  
ATOM   919  H HB2  . LEU A 1 22 ? 8.952   -8.758  2.528  1.00 1.00 ?  22 LEU A HB2  2  
ATOM   920  H HB3  . LEU A 1 22 ? 8.630   -7.415  3.607  1.00 0.94 ?  22 LEU A HB3  2  
ATOM   921  H HG   . LEU A 1 22 ? 6.936   -9.909  3.441  1.00 1.97 ?  22 LEU A HG   2  
ATOM   922  H HD11 . LEU A 1 22 ? 7.953   -10.512 5.574  1.00 2.16 ?  22 LEU A HD11 2  
ATOM   923  H HD12 . LEU A 1 22 ? 9.016   -9.110  5.463  1.00 1.77 ?  22 LEU A HD12 2  
ATOM   924  H HD13 . LEU A 1 22 ? 9.157   -10.417 4.289  1.00 2.26 ?  22 LEU A HD13 2  
ATOM   925  H HD21 . LEU A 1 22 ? 5.666   -8.003  4.204  1.00 2.09 ?  22 LEU A HD21 2  
ATOM   926  H HD22 . LEU A 1 22 ? 6.935   -7.574  5.349  1.00 1.81 ?  22 LEU A HD22 2  
ATOM   927  H HD23 . LEU A 1 22 ? 6.009   -9.059  5.572  1.00 2.05 ?  22 LEU A HD23 2  
ATOM   928  N N    . TRP A 1 23 ? 8.917   -6.700  0.405  1.00 0.33 ?  23 TRP A N    2  
ATOM   929  C CA   . TRP A 1 23 ? 9.691   -5.661  -0.259 1.00 0.34 ?  23 TRP A CA   2  
ATOM   930  C C    . TRP A 1 23 ? 8.779   -4.687  -1.002 1.00 0.27 ?  23 TRP A C    2  
ATOM   931  O O    . TRP A 1 23 ? 9.037   -3.483  -1.030 1.00 0.25 ?  23 TRP A O    2  
ATOM   932  C CB   . TRP A 1 23 ? 10.729  -6.265  -1.220 1.00 0.42 ?  23 TRP A CB   2  
ATOM   933  C CG   . TRP A 1 23 ? 10.152  -7.033  -2.374 1.00 0.48 ?  23 TRP A CG   2  
ATOM   934  C CD1  . TRP A 1 23 ? 9.939   -8.379  -2.438 1.00 0.56 ?  23 TRP A CD1  2  
ATOM   935  C CD2  . TRP A 1 23 ? 9.736   -6.502  -3.641 1.00 0.51 ?  23 TRP A CD2  2  
ATOM   936  N NE1  . TRP A 1 23 ? 9.412   -8.716  -3.660 1.00 0.62 ?  23 TRP A NE1  2  
ATOM   937  C CE2  . TRP A 1 23 ? 9.274   -7.582  -4.414 1.00 0.60 ?  23 TRP A CE2  2  
ATOM   938  C CE3  . TRP A 1 23 ? 9.700   -5.217  -4.191 1.00 0.49 ?  23 TRP A CE3  2  
ATOM   939  C CZ2  . TRP A 1 23 ? 8.787   -7.418  -5.707 1.00 0.68 ?  23 TRP A CZ2  2  
ATOM   940  C CZ3  . TRP A 1 23 ? 9.218   -5.057  -5.475 1.00 0.59 ?  23 TRP A CZ3  2  
ATOM   941  C CH2  . TRP A 1 23 ? 8.765   -6.150  -6.219 1.00 0.68 ?  23 TRP A CH2  2  
ATOM   942  H H    . TRP A 1 23 ? 9.082   -7.641  0.181  1.00 0.37 ?  23 TRP A H    2  
ATOM   943  H HA   . TRP A 1 23 ? 10.212  -5.111  0.510  1.00 0.35 ?  23 TRP A HA   2  
ATOM   944  H HB2  . TRP A 1 23 ? 11.327  -5.468  -1.627 1.00 0.42 ?  23 TRP A HB2  2  
ATOM   945  H HB3  . TRP A 1 23 ? 11.368  -6.933  -0.663 1.00 0.48 ?  23 TRP A HB3  2  
ATOM   946  H HD1  . TRP A 1 23 ? 10.158  -9.066  -1.637 1.00 0.59 ?  23 TRP A HD1  2  
ATOM   947  H HE1  . TRP A 1 23 ? 9.171   -9.627  -3.947 1.00 0.69 ?  23 TRP A HE1  2  
ATOM   948  H HE3  . TRP A 1 23 ? 10.043  -4.361  -3.629 1.00 0.44 ?  23 TRP A HE3  2  
ATOM   949  H HZ2  . TRP A 1 23 ? 8.434   -8.252  -6.295 1.00 0.76 ?  23 TRP A HZ2  2  
ATOM   950  H HZ3  . TRP A 1 23 ? 9.183   -4.072  -5.916 1.00 0.61 ?  23 TRP A HZ3  2  
ATOM   951  H HH2  . TRP A 1 23 ? 8.397   -5.977  -7.220 1.00 0.76 ?  23 TRP A HH2  2  
ATOM   952  N N    . LYS A 1 24 ? 7.694   -5.205  -1.571 1.00 0.24 ?  24 LYS A N    2  
ATOM   953  C CA   . LYS A 1 24 ? 6.784   -4.381  -2.348 1.00 0.22 ?  24 LYS A CA   2  
ATOM   954  C C    . LYS A 1 24 ? 5.911   -3.560  -1.415 1.00 0.14 ?  24 LYS A C    2  
ATOM   955  O O    . LYS A 1 24 ? 5.638   -2.392  -1.677 1.00 0.15 ?  24 LYS A O    2  
ATOM   956  C CB   . LYS A 1 24 ? 5.920   -5.240  -3.275 1.00 0.26 ?  24 LYS A CB   2  
ATOM   957  C CG   . LYS A 1 24 ? 5.077   -4.422  -4.241 1.00 0.35 ?  24 LYS A CG   2  
ATOM   958  C CD   . LYS A 1 24 ? 4.303   -5.309  -5.201 1.00 0.97 ?  24 LYS A CD   2  
ATOM   959  C CE   . LYS A 1 24 ? 3.403   -4.489  -6.115 1.00 0.98 ?  24 LYS A CE   2  
ATOM   960  N NZ   . LYS A 1 24 ? 4.183   -3.629  -7.044 1.00 1.37 1  24 LYS A NZ   2  
ATOM   961  H H    . LYS A 1 24 ? 7.491   -6.159  -1.444 1.00 0.26 ?  24 LYS A H    2  
ATOM   962  H HA   . LYS A 1 24 ? 7.381   -3.708  -2.947 1.00 0.25 ?  24 LYS A HA   2  
ATOM   963  H HB2  . LYS A 1 24 ? 6.563   -5.890  -3.850 1.00 0.33 ?  24 LYS A HB2  2  
ATOM   964  H HB3  . LYS A 1 24 ? 5.255   -5.844  -2.674 1.00 0.24 ?  24 LYS A HB3  2  
ATOM   965  H HG2  . LYS A 1 24 ? 4.376   -3.825  -3.676 1.00 0.83 ?  24 LYS A HG2  2  
ATOM   966  H HG3  . LYS A 1 24 ? 5.729   -3.774  -4.811 1.00 0.96 ?  24 LYS A HG3  2  
ATOM   967  H HD2  . LYS A 1 24 ? 5.005   -5.865  -5.808 1.00 1.51 ?  24 LYS A HD2  2  
ATOM   968  H HD3  . LYS A 1 24 ? 3.697   -5.996  -4.632 1.00 1.43 ?  24 LYS A HD3  2  
ATOM   969  H HE2  . LYS A 1 24 ? 2.789   -5.161  -6.692 1.00 1.17 ?  24 LYS A HE2  2  
ATOM   970  H HE3  . LYS A 1 24 ? 2.770   -3.862  -5.504 1.00 1.36 ?  24 LYS A HE3  2  
ATOM   971  H HZ1  . LYS A 1 24 ? 3.540   -3.018  -7.591 1.00 1.91 ?  24 LYS A HZ1  2  
ATOM   972  H HZ2  . LYS A 1 24 ? 4.723   -4.218  -7.707 1.00 1.69 ?  24 LYS A HZ2  2  
ATOM   973  H HZ3  . LYS A 1 24 ? 4.844   -3.028  -6.512 1.00 1.76 ?  24 LYS A HZ3  2  
ATOM   974  N N    . GLN A 1 25 ? 5.486   -4.177  -0.317 1.00 0.11 ?  25 GLN A N    2  
ATOM   975  C CA   . GLN A 1 25 ? 4.730   -3.471  0.709  1.00 0.09 ?  25 GLN A CA   2  
ATOM   976  C C    . GLN A 1 25 ? 5.527   -2.298  1.264  1.00 0.09 ?  25 GLN A C    2  
ATOM   977  O O    . GLN A 1 25 ? 5.020   -1.183  1.363  1.00 0.12 ?  25 GLN A O    2  
ATOM   978  C CB   . GLN A 1 25 ? 4.358   -4.412  1.850  1.00 0.14 ?  25 GLN A CB   2  
ATOM   979  C CG   . GLN A 1 25 ? 3.167   -5.296  1.546  1.00 0.16 ?  25 GLN A CG   2  
ATOM   980  C CD   . GLN A 1 25 ? 2.767   -6.145  2.733  1.00 0.22 ?  25 GLN A CD   2  
ATOM   981  O OE1  . GLN A 1 25 ? 2.023   -5.697  3.605  1.00 0.41 ?  25 GLN A OE1  2  
ATOM   982  N NE2  . GLN A 1 25 ? 3.216   -7.386  2.754  1.00 0.24 ?  25 GLN A NE2  2  
ATOM   983  H H    . GLN A 1 25 ? 5.681   -5.136  -0.199 1.00 0.15 ?  25 GLN A H    2  
ATOM   984  H HA   . GLN A 1 25 ? 3.826   -3.094  0.255  1.00 0.10 ?  25 GLN A HA   2  
ATOM   985  H HB2  . GLN A 1 25 ? 5.203   -5.044  2.070  1.00 0.22 ?  25 GLN A HB2  2  
ATOM   986  H HB3  . GLN A 1 25 ? 4.124   -3.820  2.720  1.00 0.18 ?  25 GLN A HB3  2  
ATOM   987  H HG2  . GLN A 1 25 ? 2.333   -4.671  1.269  1.00 0.18 ?  25 GLN A HG2  2  
ATOM   988  H HG3  . GLN A 1 25 ? 3.419   -5.948  0.722  1.00 0.21 ?  25 GLN A HG3  2  
ATOM   989  H HE21 . GLN A 1 25 ? 3.773   -7.690  2.007  1.00 0.33 ?  25 GLN A HE21 2  
ATOM   990  H HE22 . GLN A 1 25 ? 2.971   -7.953  3.516  1.00 0.27 ?  25 GLN A HE22 2  
ATOM   991  N N    . GLN A 1 26 ? 6.777   -2.555  1.617  1.00 0.14 ?  26 GLN A N    2  
ATOM   992  C CA   . GLN A 1 26 ? 7.639   -1.520  2.169  1.00 0.18 ?  26 GLN A CA   2  
ATOM   993  C C    . GLN A 1 26 ? 7.938   -0.451  1.127  1.00 0.18 ?  26 GLN A C    2  
ATOM   994  O O    . GLN A 1 26 ? 7.955   0.738   1.439  1.00 0.25 ?  26 GLN A O    2  
ATOM   995  C CB   . GLN A 1 26 ? 8.940   -2.126  2.696  1.00 0.28 ?  26 GLN A CB   2  
ATOM   996  C CG   . GLN A 1 26 ? 8.726   -3.173  3.779  1.00 0.38 ?  26 GLN A CG   2  
ATOM   997  C CD   . GLN A 1 26 ? 7.889   -2.667  4.939  1.00 0.90 ?  26 GLN A CD   2  
ATOM   998  O OE1  . GLN A 1 26 ? 7.897   -1.477  5.267  1.00 1.46 ?  26 GLN A OE1  2  
ATOM   999  N NE2  . GLN A 1 26 ? 7.162   -3.571  5.568  1.00 1.59 ?  26 GLN A NE2  2  
ATOM   1000 H H    . GLN A 1 26 ? 7.128   -3.469  1.509  1.00 0.18 ?  26 GLN A H    2  
ATOM   1001 H HA   . GLN A 1 26 ? 7.113   -1.062  2.991  1.00 0.21 ?  26 GLN A HA   2  
ATOM   1002 H HB2  . GLN A 1 26 ? 9.467   -2.589  1.875  1.00 0.31 ?  26 GLN A HB2  2  
ATOM   1003 H HB3  . GLN A 1 26 ? 9.551   -1.336  3.104  1.00 0.31 ?  26 GLN A HB3  2  
ATOM   1004 H HG2  . GLN A 1 26 ? 8.223   -4.025  3.345  1.00 0.76 ?  26 GLN A HG2  2  
ATOM   1005 H HG3  . GLN A 1 26 ? 9.687   -3.483  4.157  1.00 0.60 ?  26 GLN A HG3  2  
ATOM   1006 H HE21 . GLN A 1 26 ? 7.208   -4.501  5.255  1.00 1.96 ?  26 GLN A HE21 2  
ATOM   1007 H HE22 . GLN A 1 26 ? 6.608   -3.280  6.320  1.00 1.99 ?  26 GLN A HE22 2  
ATOM   1008 N N    . ASN A 1 27 ? 8.157   -0.881  -0.112 1.00 0.19 ?  27 ASN A N    2  
ATOM   1009 C CA   . ASN A 1 27 ? 8.409   0.042   -1.213 1.00 0.26 ?  27 ASN A CA   2  
ATOM   1010 C C    . ASN A 1 27 ? 7.210   0.963   -1.428 1.00 0.22 ?  27 ASN A C    2  
ATOM   1011 O O    . ASN A 1 27 ? 7.363   2.172   -1.598 1.00 0.25 ?  27 ASN A O    2  
ATOM   1012 C CB   . ASN A 1 27 ? 8.708   -0.737  -2.495 1.00 0.38 ?  27 ASN A CB   2  
ATOM   1013 C CG   . ASN A 1 27 ? 8.984   0.166   -3.682 1.00 0.98 ?  27 ASN A CG   2  
ATOM   1014 O OD1  . ASN A 1 27 ? 9.514   1.266   -3.533 1.00 1.81 ?  27 ASN A OD1  2  
ATOM   1015 N ND2  . ASN A 1 27 ? 8.625   -0.292  -4.870 1.00 1.18 ?  27 ASN A ND2  2  
ATOM   1016 H H    . ASN A 1 27 ? 8.158   -1.849  -0.291 1.00 0.20 ?  27 ASN A H    2  
ATOM   1017 H HA   . ASN A 1 27 ? 9.267   0.641   -0.955 1.00 0.34 ?  27 ASN A HA   2  
ATOM   1018 H HB2  . ASN A 1 27 ? 9.575   -1.360  -2.336 1.00 0.77 ?  27 ASN A HB2  2  
ATOM   1019 H HB3  . ASN A 1 27 ? 7.862   -1.365  -2.731 1.00 0.92 ?  27 ASN A HB3  2  
ATOM   1020 H HD21 . ASN A 1 27 ? 8.205   -1.178  -4.921 1.00 1.16 ?  27 ASN A HD21 2  
ATOM   1021 H HD22 . ASN A 1 27 ? 8.790   0.275   -5.652 1.00 1.75 ?  27 ASN A HD22 2  
ATOM   1022 N N    . LEU A 1 28 ? 6.020   0.382   -1.403 1.00 0.19 ?  28 LEU A N    2  
ATOM   1023 C CA   . LEU A 1 28 ? 4.788   1.134   -1.591 1.00 0.24 ?  28 LEU A CA   2  
ATOM   1024 C C    . LEU A 1 28 ? 4.514   2.063   -0.414 1.00 0.24 ?  28 LEU A C    2  
ATOM   1025 O O    . LEU A 1 28 ? 4.102   3.212   -0.597 1.00 0.29 ?  28 LEU A O    2  
ATOM   1026 C CB   . LEU A 1 28 ? 3.618   0.173   -1.777 1.00 0.28 ?  28 LEU A CB   2  
ATOM   1027 C CG   . LEU A 1 28 ? 3.569   -0.545  -3.125 1.00 0.38 ?  28 LEU A CG   2  
ATOM   1028 C CD1  . LEU A 1 28 ? 2.469   -1.593  -3.135 1.00 0.88 ?  28 LEU A CD1  2  
ATOM   1029 C CD2  . LEU A 1 28 ? 3.350   0.454   -4.245 1.00 0.72 ?  28 LEU A CD2  2  
ATOM   1030 H H    . LEU A 1 28 ? 5.966   -0.588  -1.257 1.00 0.18 ?  28 LEU A H    2  
ATOM   1031 H HA   . LEU A 1 28 ? 4.898   1.728   -2.482 1.00 0.30 ?  28 LEU A HA   2  
ATOM   1032 H HB2  . LEU A 1 28 ? 3.671   -0.574  -0.998 1.00 0.28 ?  28 LEU A HB2  2  
ATOM   1033 H HB3  . LEU A 1 28 ? 2.706   0.726   -1.656 1.00 0.33 ?  28 LEU A HB3  2  
ATOM   1034 H HG   . LEU A 1 28 ? 4.511   -1.044  -3.296 1.00 0.78 ?  28 LEU A HG   2  
ATOM   1035 H HD11 . LEU A 1 28 ? 1.520   -1.120  -2.934 1.00 1.30 ?  28 LEU A HD11 2  
ATOM   1036 H HD12 . LEU A 1 28 ? 2.672   -2.335  -2.374 1.00 1.54 ?  28 LEU A HD12 2  
ATOM   1037 H HD13 . LEU A 1 28 ? 2.436   -2.070  -4.103 1.00 1.23 ?  28 LEU A HD13 2  
ATOM   1038 H HD21 . LEU A 1 28 ? 3.250   -0.073  -5.180 1.00 1.32 ?  28 LEU A HD21 2  
ATOM   1039 H HD22 . LEU A 1 28 ? 4.193   1.125   -4.300 1.00 1.40 ?  28 LEU A HD22 2  
ATOM   1040 H HD23 . LEU A 1 28 ? 2.450   1.019   -4.051 1.00 1.20 ?  28 LEU A HD23 2  
ATOM   1041 N N    . LYS A 1 29 ? 4.741   1.562   0.791  1.00 0.24 ?  29 LYS A N    2  
ATOM   1042 C CA   . LYS A 1 29 ? 4.536   2.351   1.997  1.00 0.32 ?  29 LYS A CA   2  
ATOM   1043 C C    . LYS A 1 29 ? 5.513   3.523   2.028  1.00 0.34 ?  29 LYS A C    2  
ATOM   1044 O O    . LYS A 1 29 ? 5.182   4.614   2.494  1.00 0.40 ?  29 LYS A O    2  
ATOM   1045 C CB   . LYS A 1 29 ? 4.711   1.474   3.239  1.00 0.42 ?  29 LYS A CB   2  
ATOM   1046 C CG   . LYS A 1 29 ? 4.340   2.169   4.537  1.00 0.71 ?  29 LYS A CG   2  
ATOM   1047 C CD   . LYS A 1 29 ? 2.837   2.388   4.660  1.00 1.19 ?  29 LYS A CD   2  
ATOM   1048 C CE   . LYS A 1 29 ? 2.088   1.089   4.935  1.00 1.23 ?  29 LYS A CE   2  
ATOM   1049 N NZ   . LYS A 1 29 ? 2.544   0.435   6.190  1.00 1.39 1  29 LYS A NZ   2  
ATOM   1050 H H    . LYS A 1 29 ? 5.049   0.631   0.873  1.00 0.22 ?  29 LYS A H    2  
ATOM   1051 H HA   . LYS A 1 29 ? 3.530   2.737   1.972  1.00 0.36 ?  29 LYS A HA   2  
ATOM   1052 H HB2  . LYS A 1 29 ? 4.086   0.601   3.135  1.00 0.78 ?  29 LYS A HB2  2  
ATOM   1053 H HB3  . LYS A 1 29 ? 5.744   1.162   3.303  1.00 0.60 ?  29 LYS A HB3  2  
ATOM   1054 H HG2  . LYS A 1 29 ? 4.672   1.562   5.363  1.00 1.23 ?  29 LYS A HG2  2  
ATOM   1055 H HG3  . LYS A 1 29 ? 4.836   3.128   4.572  1.00 1.29 ?  29 LYS A HG3  2  
ATOM   1056 H HD2  . LYS A 1 29 ? 2.651   3.073   5.471  1.00 1.64 ?  29 LYS A HD2  2  
ATOM   1057 H HD3  . LYS A 1 29 ? 2.471   2.813   3.739  1.00 1.75 ?  29 LYS A HD3  2  
ATOM   1058 H HE2  . LYS A 1 29 ? 1.034   1.308   5.019  1.00 1.53 ?  29 LYS A HE2  2  
ATOM   1059 H HE3  . LYS A 1 29 ? 2.245   0.413   4.109  1.00 1.48 ?  29 LYS A HE3  2  
ATOM   1060 H HZ1  . LYS A 1 29 ? 2.009   -0.443  6.350  1.00 2.04 ?  29 LYS A HZ1  2  
ATOM   1061 H HZ2  . LYS A 1 29 ? 2.396   1.069   7.000  1.00 1.56 ?  29 LYS A HZ2  2  
ATOM   1062 H HZ3  . LYS A 1 29 ? 3.556   0.202   6.126  1.00 1.51 ?  29 LYS A HZ3  2  
ATOM   1063 N N    . LYS A 1 30 ? 6.715   3.282   1.522  1.00 0.34 ?  30 LYS A N    2  
ATOM   1064 C CA   . LYS A 1 30 ? 7.717   4.326   1.368  1.00 0.43 ?  30 LYS A CA   2  
ATOM   1065 C C    . LYS A 1 30 ? 7.302   5.303   0.272  1.00 0.42 ?  30 LYS A C    2  
ATOM   1066 O O    . LYS A 1 30 ? 7.516   6.509   0.386  1.00 0.47 ?  30 LYS A O    2  
ATOM   1067 C CB   . LYS A 1 30 ? 9.072   3.692   1.043  1.00 0.54 ?  30 LYS A CB   2  
ATOM   1068 C CG   . LYS A 1 30 ? 10.140  4.687   0.623  1.00 1.28 ?  30 LYS A CG   2  
ATOM   1069 C CD   . LYS A 1 30 ? 11.453  3.985   0.318  1.00 1.67 ?  30 LYS A CD   2  
ATOM   1070 C CE   . LYS A 1 30 ? 12.364  4.848   -0.541 1.00 2.49 ?  30 LYS A CE   2  
ATOM   1071 N NZ   . LYS A 1 30 ? 11.832  5.005   -1.921 1.00 3.14 1  30 LYS A NZ   2  
ATOM   1072 H H    . LYS A 1 30 ? 6.941   2.365   1.252  1.00 0.33 ?  30 LYS A H    2  
ATOM   1073 H HA   . LYS A 1 30 ? 7.789   4.860   2.300  1.00 0.48 ?  30 LYS A HA   2  
ATOM   1074 H HB2  . LYS A 1 30 ? 9.428   3.167   1.918  1.00 0.89 ?  30 LYS A HB2  2  
ATOM   1075 H HB3  . LYS A 1 30 ? 8.938   2.982   0.241  1.00 1.06 ?  30 LYS A HB3  2  
ATOM   1076 H HG2  . LYS A 1 30 ? 9.806   5.207   -0.262 1.00 1.89 ?  30 LYS A HG2  2  
ATOM   1077 H HG3  . LYS A 1 30 ? 10.295  5.393   1.424  1.00 1.85 ?  30 LYS A HG3  2  
ATOM   1078 H HD2  . LYS A 1 30 ? 11.955  3.762   1.249  1.00 2.02 ?  30 LYS A HD2  2  
ATOM   1079 H HD3  . LYS A 1 30 ? 11.242  3.065   -0.208 1.00 1.96 ?  30 LYS A HD3  2  
ATOM   1080 H HE2  . LYS A 1 30 ? 12.452  5.824   -0.086 1.00 2.89 ?  30 LYS A HE2  2  
ATOM   1081 H HE3  . LYS A 1 30 ? 13.339  4.385   -0.591 1.00 2.91 ?  30 LYS A HE3  2  
ATOM   1082 H HZ1  . LYS A 1 30 ? 10.856  5.358   -1.894 1.00 3.57 ?  30 LYS A HZ1  2  
ATOM   1083 H HZ2  . LYS A 1 30 ? 11.838  4.090   -2.414 1.00 3.62 ?  30 LYS A HZ2  2  
ATOM   1084 H HZ3  . LYS A 1 30 ? 12.415  5.675   -2.459 1.00 3.29 ?  30 LYS A HZ3  2  
ATOM   1085 N N    . GLU A 1 31 ? 6.706   4.772   -0.787 1.00 0.42 ?  31 GLU A N    2  
ATOM   1086 C CA   . GLU A 1 31 ? 6.210   5.590   -1.886 1.00 0.49 ?  31 GLU A CA   2  
ATOM   1087 C C    . GLU A 1 31 ? 5.119   6.542   -1.401 1.00 0.52 ?  31 GLU A C    2  
ATOM   1088 O O    . GLU A 1 31 ? 4.988   7.665   -1.897 1.00 0.70 ?  31 GLU A O    2  
ATOM   1089 C CB   . GLU A 1 31 ? 5.668   4.695   -3.003 1.00 0.52 ?  31 GLU A CB   2  
ATOM   1090 C CG   . GLU A 1 31 ? 5.151   5.460   -4.209 1.00 0.87 ?  31 GLU A CG   2  
ATOM   1091 C CD   . GLU A 1 31 ? 4.477   4.562   -5.223 1.00 1.47 ?  31 GLU A CD   2  
ATOM   1092 O OE1  . GLU A 1 31 ? 5.145   4.160   -6.199 1.00 1.67 ?  31 GLU A OE1  2  
ATOM   1093 O OE2  . GLU A 1 31 ? 3.284   4.237   -5.041 1.00 2.30 -1 31 GLU A OE2  2  
ATOM   1094 H H    . GLU A 1 31 ? 6.610   3.794   -0.840 1.00 0.41 ?  31 GLU A H    2  
ATOM   1095 H HA   . GLU A 1 31 ? 7.035   6.171   -2.266 1.00 0.57 ?  31 GLU A HA   2  
ATOM   1096 H HB2  . GLU A 1 31 ? 6.456   4.034   -3.334 1.00 0.87 ?  31 GLU A HB2  2  
ATOM   1097 H HB3  . GLU A 1 31 ? 4.857   4.101   -2.608 1.00 0.80 ?  31 GLU A HB3  2  
ATOM   1098 H HG2  . GLU A 1 31 ? 4.438   6.194   -3.872 1.00 1.45 ?  31 GLU A HG2  2  
ATOM   1099 H HG3  . GLU A 1 31 ? 5.980   5.959   -4.686 1.00 1.49 ?  31 GLU A HG3  2  
ATOM   1100 N N    . LYS A 1 32 ? 4.333   6.086   -0.433 1.00 0.43 ?  32 LYS A N    2  
ATOM   1101 C CA   . LYS A 1 32 ? 3.279   6.908   0.141  1.00 0.55 ?  32 LYS A CA   2  
ATOM   1102 C C    . LYS A 1 32 ? 3.855   8.003   1.038  1.00 0.66 ?  32 LYS A C    2  
ATOM   1103 O O    . LYS A 1 32 ? 4.215   7.751   2.190  1.00 1.23 ?  32 LYS A O    2  
ATOM   1104 C CB   . LYS A 1 32 ? 2.303   6.057   0.956  1.00 0.74 ?  32 LYS A CB   2  
ATOM   1105 C CG   . LYS A 1 32 ? 1.139   6.862   1.521  1.00 1.46 ?  32 LYS A CG   2  
ATOM   1106 C CD   . LYS A 1 32 ? 0.426   6.136   2.656  1.00 2.20 ?  32 LYS A CD   2  
ATOM   1107 C CE   . LYS A 1 32 ? 1.333   5.969   3.866  1.00 3.14 ?  32 LYS A CE   2  
ATOM   1108 N NZ   . LYS A 1 32 ? 0.611   5.416   5.041  1.00 3.91 1  32 LYS A NZ   2  
ATOM   1109 H H    . LYS A 1 32 ? 4.460   5.165   -0.108 1.00 0.38 ?  32 LYS A H    2  
ATOM   1110 H HA   . LYS A 1 32 ? 2.741   7.373   -0.671 1.00 0.79 ?  32 LYS A HA   2  
ATOM   1111 H HB2  . LYS A 1 32 ? 1.904   5.278   0.322  1.00 1.02 ?  32 LYS A HB2  2  
ATOM   1112 H HB3  . LYS A 1 32 ? 2.836   5.606   1.779  1.00 1.25 ?  32 LYS A HB3  2  
ATOM   1113 H HG2  . LYS A 1 32 ? 1.517   7.802   1.894  1.00 2.11 ?  32 LYS A HG2  2  
ATOM   1114 H HG3  . LYS A 1 32 ? 0.431   7.051   0.727  1.00 1.77 ?  32 LYS A HG3  2  
ATOM   1115 H HD2  . LYS A 1 32 ? -0.442  6.707   2.947  1.00 2.36 ?  32 LYS A HD2  2  
ATOM   1116 H HD3  . LYS A 1 32 ? 0.118   5.161   2.309  1.00 2.67 ?  32 LYS A HD3  2  
ATOM   1117 H HE2  . LYS A 1 32 ? 2.139   5.299   3.607  1.00 3.54 ?  32 LYS A HE2  2  
ATOM   1118 H HE3  . LYS A 1 32 ? 1.741   6.934   4.127  1.00 3.37 ?  32 LYS A HE3  2  
ATOM   1119 H HZ1  . LYS A 1 32 ? -0.153  6.061   5.329  1.00 3.96 ?  32 LYS A HZ1  2  
ATOM   1120 H HZ2  . LYS A 1 32 ? 1.264   5.300   5.842  1.00 4.35 ?  32 LYS A HZ2  2  
ATOM   1121 H HZ3  . LYS A 1 32 ? 0.198   4.492   4.809  1.00 4.36 ?  32 LYS A HZ3  2  
ATOM   1122 N N    . GLY A 1 33 ? 3.967   9.206   0.498  1.00 0.94 ?  33 GLY A N    2  
ATOM   1123 C CA   . GLY A 1 33 ? 4.304   10.360  1.312  1.00 1.34 ?  33 GLY A CA   2  
ATOM   1124 C C    . GLY A 1 33 ? 5.791   10.565  1.508  1.00 1.43 ?  33 GLY A C    2  
ATOM   1125 O O    . GLY A 1 33 ? 6.282   11.689  1.413  1.00 1.99 ?  33 GLY A O    2  
ATOM   1126 H H    . GLY A 1 33 ? 3.831   9.315   -0.465 1.00 1.26 ?  33 GLY A H    2  
ATOM   1127 H HA2  . GLY A 1 33 ? 3.895   11.242  0.847  1.00 1.68 ?  33 GLY A HA2  2  
ATOM   1128 H HA3  . GLY A 1 33 ? 3.845   10.238  2.280  1.00 1.72 ?  33 GLY A HA3  2  
ATOM   1129 N N    . LEU A 1 34 ? 6.511   9.490   1.788  1.00 1.27 ?  34 LEU A N    2  
ATOM   1130 C CA   . LEU A 1 34 ? 7.926   9.591   2.104  1.00 1.73 ?  34 LEU A CA   2  
ATOM   1131 C C    . LEU A 1 34 ? 8.746   9.915   0.859  1.00 1.86 ?  34 LEU A C    2  
ATOM   1132 O O    . LEU A 1 34 ? 9.364   10.976  0.768  1.00 2.56 ?  34 LEU A O    2  
ATOM   1133 C CB   . LEU A 1 34 ? 8.425   8.290   2.742  1.00 1.91 ?  34 LEU A CB   2  
ATOM   1134 C CG   . LEU A 1 34 ? 7.690   7.853   4.014  1.00 2.29 ?  34 LEU A CG   2  
ATOM   1135 C CD1  . LEU A 1 34 ? 8.336   6.608   4.599  1.00 2.76 ?  34 LEU A CD1  2  
ATOM   1136 C CD2  . LEU A 1 34 ? 7.670   8.972   5.044  1.00 3.08 ?  34 LEU A CD2  2  
ATOM   1137 H H    . LEU A 1 34 ? 6.079   8.610   1.784  1.00 1.11 ?  34 LEU A H    2  
ATOM   1138 H HA   . LEU A 1 34 ? 8.046   10.395  2.812  1.00 2.15 ?  34 LEU A HA   2  
ATOM   1139 H HB2  . LEU A 1 34 ? 8.330   7.501   2.011  1.00 2.24 ?  34 LEU A HB2  2  
ATOM   1140 H HB3  . LEU A 1 34 ? 9.469   8.411   2.982  1.00 2.03 ?  34 LEU A HB3  2  
ATOM   1141 H HG   . LEU A 1 34 ? 6.667   7.611   3.762  1.00 2.45 ?  34 LEU A HG   2  
ATOM   1142 H HD11 . LEU A 1 34 ? 8.296   5.807   3.879  1.00 3.05 ?  34 LEU A HD11 2  
ATOM   1143 H HD12 . LEU A 1 34 ? 7.807   6.314   5.494  1.00 3.27 ?  34 LEU A HD12 2  
ATOM   1144 H HD13 . LEU A 1 34 ? 9.366   6.820   4.844  1.00 2.92 ?  34 LEU A HD13 2  
ATOM   1145 H HD21 . LEU A 1 34 ? 7.106   9.808   4.658  1.00 3.53 ?  34 LEU A HD21 2  
ATOM   1146 H HD22 . LEU A 1 34 ? 8.681   9.287   5.252  1.00 3.41 ?  34 LEU A HD22 2  
ATOM   1147 H HD23 . LEU A 1 34 ? 7.209   8.616   5.954  1.00 3.42 ?  34 LEU A HD23 2  
ATOM   1148 N N    . PHE A 1 35 ? 8.749   8.997   -0.096 1.00 1.42 ?  35 PHE A N    2  
ATOM   1149 C CA   . PHE A 1 35 ? 9.510   9.169   -1.323 1.00 1.78 ?  35 PHE A CA   2  
ATOM   1150 C C    . PHE A 1 35 ? 8.682   8.728   -2.522 1.00 2.17 ?  35 PHE A C    2  
ATOM   1151 O O    . PHE A 1 35 ? 8.711   7.565   -2.921 1.00 2.84 ?  35 PHE A O    2  
ATOM   1152 C CB   . PHE A 1 35 ? 10.818  8.373   -1.267 1.00 1.55 ?  35 PHE A CB   2  
ATOM   1153 C CG   . PHE A 1 35 ? 11.762  8.827   -0.186 1.00 1.48 ?  35 PHE A CG   2  
ATOM   1154 C CD1  . PHE A 1 35 ? 11.737  8.237   1.068  1.00 1.95 ?  35 PHE A CD1  2  
ATOM   1155 C CD2  . PHE A 1 35 ? 12.674  9.843   -0.425 1.00 1.61 ?  35 PHE A CD2  2  
ATOM   1156 C CE1  . PHE A 1 35 ? 12.606  8.649   2.060  1.00 2.46 ?  35 PHE A CE1  2  
ATOM   1157 C CE2  . PHE A 1 35 ? 13.544  10.259  0.562  1.00 1.99 ?  35 PHE A CE2  2  
ATOM   1158 C CZ   . PHE A 1 35 ? 13.499  9.671   1.813  1.00 2.41 ?  35 PHE A CZ   2  
ATOM   1159 H H    . PHE A 1 35 ? 8.220   8.180   0.025  1.00 1.04 ?  35 PHE A H    2  
ATOM   1160 H HA   . PHE A 1 35 ? 9.740   10.219  -1.427 1.00 2.31 ?  35 PHE A HA   2  
ATOM   1161 H HB2  . PHE A 1 35 ? 10.589  7.334   -1.089 1.00 1.53 ?  35 PHE A HB2  2  
ATOM   1162 H HB3  . PHE A 1 35 ? 11.327  8.465   -2.215 1.00 1.88 ?  35 PHE A HB3  2  
ATOM   1163 H HD1  . PHE A 1 35 ? 11.032  7.443   1.266  1.00 2.21 ?  35 PHE A HD1  2  
ATOM   1164 H HD2  . PHE A 1 35 ? 12.702  10.311  -1.397 1.00 1.82 ?  35 PHE A HD2  2  
ATOM   1165 H HE1  . PHE A 1 35 ? 12.576  8.182   3.034  1.00 3.08 ?  35 PHE A HE1  2  
ATOM   1166 H HE2  . PHE A 1 35 ? 14.251  11.050  0.360  1.00 2.26 ?  35 PHE A HE2  2  
ATOM   1167 H HZ   . PHE A 1 35 ? 14.175  9.998   2.590  1.00 2.93 ?  35 PHE A HZ   2  
HETATM 1168 N N    . NH2 A 1 36 ? 7.929   9.654   -3.082 1.00 2.32 ?  36 NH2 A N    2  
HETATM 1169 H HN1  . NH2 A 1 36 ? 7.957   10.564  -2.710 1.00 2.41 ?  36 NH2 A HN1  2  
HETATM 1170 H HN2  . NH2 A 1 36 ? 7.372   9.398   -3.844 1.00 2.69 ?  36 NH2 A HN2  2  
ATOM   1171 N N    . LEU A 1 1  ? -7.017  5.691   6.719  1.00 1.11 ?  1  LEU A N    3  
ATOM   1172 C CA   . LEU A 1 1  ? -7.222  5.148   5.358  1.00 0.77 ?  1  LEU A CA   3  
ATOM   1173 C C    . LEU A 1 1  ? -8.173  3.965   5.390  1.00 0.62 ?  1  LEU A C    3  
ATOM   1174 O O    . LEU A 1 1  ? -7.794  2.863   5.796  1.00 0.66 ?  1  LEU A O    3  
ATOM   1175 C CB   . LEU A 1 1  ? -5.892  4.705   4.728  1.00 0.91 ?  1  LEU A CB   3  
ATOM   1176 C CG   . LEU A 1 1  ? -5.083  5.800   4.023  1.00 1.01 ?  1  LEU A CG   3  
ATOM   1177 C CD1  . LEU A 1 1  ? -4.590  6.845   5.008  1.00 1.23 ?  1  LEU A CD1  3  
ATOM   1178 C CD2  . LEU A 1 1  ? -3.913  5.185   3.270  1.00 1.78 ?  1  LEU A CD2  3  
ATOM   1179 H H1   . LEU A 1 1  ? -6.619  4.961   7.339  1.00 1.40 ?  1  LEU A H1   3  
ATOM   1180 H H2   . LEU A 1 1  ? -7.924  6.007   7.117  1.00 1.62 ?  1  LEU A H2   3  
ATOM   1181 H H3   . LEU A 1 1  ? -6.368  6.500   6.691  1.00 1.61 ?  1  LEU A H3   3  
ATOM   1182 H HA   . LEU A 1 1  ? -7.656  5.925   4.746  1.00 0.75 ?  1  LEU A HA   3  
ATOM   1183 H HB2  . LEU A 1 1  ? -5.276  4.282   5.507  1.00 1.23 ?  1  LEU A HB2  3  
ATOM   1184 H HB3  . LEU A 1 1  ? -6.108  3.932   4.006  1.00 1.43 ?  1  LEU A HB3  3  
ATOM   1185 H HG   . LEU A 1 1  ? -5.715  6.296   3.302  1.00 1.75 ?  1  LEU A HG   3  
ATOM   1186 H HD11 . LEU A 1 1  ? -3.996  6.368   5.773  1.00 1.48 ?  1  LEU A HD11 3  
ATOM   1187 H HD12 . LEU A 1 1  ? -5.437  7.336   5.463  1.00 1.80 ?  1  LEU A HD12 3  
ATOM   1188 H HD13 . LEU A 1 1  ? -3.989  7.575   4.488  1.00 1.91 ?  1  LEU A HD13 3  
ATOM   1189 H HD21 . LEU A 1 1  ? -3.272  4.664   3.965  1.00 2.17 ?  1  LEU A HD21 3  
ATOM   1190 H HD22 . LEU A 1 1  ? -3.353  5.965   2.778  1.00 2.45 ?  1  LEU A HD22 3  
ATOM   1191 H HD23 . LEU A 1 1  ? -4.286  4.490   2.533  1.00 2.19 ?  1  LEU A HD23 3  
ATOM   1192 N N    . SER A 1 2  ? -9.411  4.201   4.981  1.00 0.58 ?  2  SER A N    3  
ATOM   1193 C CA   . SER A 1 2  ? -10.387 3.135   4.835  1.00 0.59 ?  2  SER A CA   3  
ATOM   1194 C C    . SER A 1 2  ? -9.982  2.234   3.678  1.00 0.53 ?  2  SER A C    3  
ATOM   1195 O O    . SER A 1 2  ? -9.199  2.653   2.835  1.00 0.45 ?  2  SER A O    3  
ATOM   1196 C CB   . SER A 1 2  ? -11.774 3.729   4.601  1.00 0.72 ?  2  SER A CB   3  
ATOM   1197 O OG   . SER A 1 2  ? -11.727 4.761   3.627  1.00 1.28 ?  2  SER A OG   3  
ATOM   1198 H H    . SER A 1 2  ? -9.675  5.119   4.763  1.00 0.63 ?  2  SER A H    3  
ATOM   1199 H HA   . SER A 1 2  ? -10.393 2.557   5.746  1.00 0.67 ?  2  SER A HA   3  
ATOM   1200 H HB2  . SER A 1 2  ? -12.441 2.954   4.254  1.00 1.39 ?  2  SER A HB2  3  
ATOM   1201 H HB3  . SER A 1 2  ? -12.146 4.140   5.526  1.00 1.05 ?  2  SER A HB3  3  
ATOM   1202 H HG   . SER A 1 2  ? -11.566 5.609   4.064  1.00 1.66 ?  2  SER A HG   3  
ATOM   1203 N N    . ASP A 1 3  ? -10.501 1.018   3.629  1.00 0.61 ?  3  ASP A N    3  
ATOM   1204 C CA   . ASP A 1 3  ? -10.061 0.035   2.634  1.00 0.60 ?  3  ASP A CA   3  
ATOM   1205 C C    . ASP A 1 3  ? -10.136 0.596   1.219  1.00 0.49 ?  3  ASP A C    3  
ATOM   1206 O O    . ASP A 1 3  ? -9.213  0.420   0.418  1.00 0.40 ?  3  ASP A O    3  
ATOM   1207 C CB   . ASP A 1 3  ? -10.892 -1.242  2.736  1.00 0.76 ?  3  ASP A CB   3  
ATOM   1208 C CG   . ASP A 1 3  ? -10.648 -1.985  4.031  1.00 1.42 ?  3  ASP A CG   3  
ATOM   1209 O OD1  . ASP A 1 3  ? -9.917  -3.000  4.012  1.00 1.93 ?  3  ASP A OD1  3  
ATOM   1210 O OD2  . ASP A 1 3  ? -11.188 -1.564  5.072  1.00 2.11 -1 3  ASP A OD2  3  
ATOM   1211 H H    . ASP A 1 3  ? -11.204 0.770   4.269  1.00 0.71 ?  3  ASP A H    3  
ATOM   1212 H HA   . ASP A 1 3  ? -9.030  -0.206  2.850  1.00 0.62 ?  3  ASP A HA   3  
ATOM   1213 H HB2  . ASP A 1 3  ? -11.939 -0.991  2.678  1.00 1.30 ?  3  ASP A HB2  3  
ATOM   1214 H HB3  . ASP A 1 3  ? -10.637 -1.894  1.914  1.00 1.20 ?  3  ASP A HB3  3  
ATOM   1215 N N    . GLU A 1 4  ? -11.221 1.301   0.932  1.00 0.58 ?  4  GLU A N    3  
ATOM   1216 C CA   . GLU A 1 4  ? -11.426 1.887   -0.385 1.00 0.58 ?  4  GLU A CA   3  
ATOM   1217 C C    . GLU A 1 4  ? -10.461 3.045   -0.637 1.00 0.43 ?  4  GLU A C    3  
ATOM   1218 O O    . GLU A 1 4  ? -10.027 3.267   -1.768 1.00 0.38 ?  4  GLU A O    3  
ATOM   1219 C CB   . GLU A 1 4  ? -12.870 2.360   -0.532 1.00 0.80 ?  4  GLU A CB   3  
ATOM   1220 C CG   . GLU A 1 4  ? -13.885 1.234   -0.437 1.00 1.35 ?  4  GLU A CG   3  
ATOM   1221 C CD   . GLU A 1 4  ? -13.704 0.189   -1.517 1.00 1.81 ?  4  GLU A CD   3  
ATOM   1222 O OE1  . GLU A 1 4  ? -13.127 -0.877  -1.223 1.00 2.46 ?  4  GLU A OE1  3  
ATOM   1223 O OE2  . GLU A 1 4  ? -14.122 0.434   -2.671 1.00 2.08 -1 4  GLU A OE2  3  
ATOM   1224 H H    . GLU A 1 4  ? -11.905 1.427   1.625  1.00 0.68 ?  4  GLU A H    3  
ATOM   1225 H HA   . GLU A 1 4  ? -11.238 1.116   -1.116 1.00 0.59 ?  4  GLU A HA   3  
ATOM   1226 H HB2  . GLU A 1 4  ? -13.083 3.076   0.248  1.00 1.07 ?  4  GLU A HB2  3  
ATOM   1227 H HB3  . GLU A 1 4  ? -12.984 2.841   -1.492 1.00 1.03 ?  4  GLU A HB3  3  
ATOM   1228 H HG2  . GLU A 1 4  ? -13.779 0.752   0.521  1.00 1.90 ?  4  GLU A HG2  3  
ATOM   1229 H HG3  . GLU A 1 4  ? -14.877 1.650   -0.522 1.00 1.77 ?  4  GLU A HG3  3  
ATOM   1230 N N    . ASP A 1 5  ? -10.104 3.764   0.419  1.00 0.44 ?  5  ASP A N    3  
ATOM   1231 C CA   . ASP A 1 5  ? -9.195  4.898   0.289  1.00 0.40 ?  5  ASP A CA   3  
ATOM   1232 C C    . ASP A 1 5  ? -7.775  4.384   0.133  1.00 0.28 ?  5  ASP A C    3  
ATOM   1233 O O    . ASP A 1 5  ? -6.970  4.939   -0.610 1.00 0.29 ?  5  ASP A O    3  
ATOM   1234 C CB   . ASP A 1 5  ? -9.293  5.818   1.506  1.00 0.52 ?  5  ASP A CB   3  
ATOM   1235 C CG   . ASP A 1 5  ? -8.461  7.075   1.356  1.00 1.11 ?  5  ASP A CG   3  
ATOM   1236 O OD1  . ASP A 1 5  ? -8.921  8.017   0.674  1.00 1.17 ?  5  ASP A OD1  3  
ATOM   1237 O OD2  . ASP A 1 5  ? -7.355  7.139   1.929  1.00 1.82 -1 5  ASP A OD2  3  
ATOM   1238 H H    . ASP A 1 5  ? -10.433 3.511   1.311  1.00 0.51 ?  5  ASP A H    3  
ATOM   1239 H HA   . ASP A 1 5  ? -9.468  5.446   -0.599 1.00 0.43 ?  5  ASP A HA   3  
ATOM   1240 H HB2  . ASP A 1 5  ? -10.325 6.107   1.647  1.00 1.00 ?  5  ASP A HB2  3  
ATOM   1241 H HB3  . ASP A 1 5  ? -8.951  5.284   2.381  1.00 0.82 ?  5  ASP A HB3  3  
ATOM   1242 N N    . PHE A 1 6  ? -7.499  3.296   0.829  1.00 0.24 ?  6  PHE A N    3  
ATOM   1243 C CA   . PHE A 1 6  ? -6.238  2.592   0.723  1.00 0.18 ?  6  PHE A CA   3  
ATOM   1244 C C    . PHE A 1 6  ? -6.064  2.102   -0.707 1.00 0.13 ?  6  PHE A C    3  
ATOM   1245 O O    . PHE A 1 6  ? -4.990  2.225   -1.295 1.00 0.15 ?  6  PHE A O    3  
ATOM   1246 C CB   . PHE A 1 6  ? -6.245  1.416   1.702  1.00 0.23 ?  6  PHE A CB   3  
ATOM   1247 C CG   . PHE A 1 6  ? -4.901  0.813   1.971  1.00 0.25 ?  6  PHE A CG   3  
ATOM   1248 C CD1  . PHE A 1 6  ? -4.199  1.132   3.119  1.00 0.43 ?  6  PHE A CD1  3  
ATOM   1249 C CD2  . PHE A 1 6  ? -4.329  -0.060  1.062  1.00 0.25 ?  6  PHE A CD2  3  
ATOM   1250 C CE1  . PHE A 1 6  ? -2.954  0.591   3.356  1.00 0.50 ?  6  PHE A CE1  3  
ATOM   1251 C CE2  . PHE A 1 6  ? -3.083  -0.606  1.294  1.00 0.35 ?  6  PHE A CE2  3  
ATOM   1252 C CZ   . PHE A 1 6  ? -2.426  -0.326  2.497  1.00 0.43 ?  6  PHE A CZ   3  
ATOM   1253 H H    . PHE A 1 6  ? -8.178  2.949   1.444  1.00 0.29 ?  6  PHE A H    3  
ATOM   1254 H HA   . PHE A 1 6  ? -5.438  3.271   0.974  1.00 0.23 ?  6  PHE A HA   3  
ATOM   1255 H HB2  . PHE A 1 6  ? -6.647  1.751   2.645  1.00 0.31 ?  6  PHE A HB2  3  
ATOM   1256 H HB3  . PHE A 1 6  ? -6.882  0.639   1.306  1.00 0.27 ?  6  PHE A HB3  3  
ATOM   1257 H HD1  . PHE A 1 6  ? -4.638  1.811   3.835  1.00 0.55 ?  6  PHE A HD1  3  
ATOM   1258 H HD2  . PHE A 1 6  ? -4.870  -0.314  0.162  1.00 0.29 ?  6  PHE A HD2  3  
ATOM   1259 H HE1  . PHE A 1 6  ? -2.420  0.847   4.255  1.00 0.65 ?  6  PHE A HE1  3  
ATOM   1260 H HE2  . PHE A 1 6  ? -2.649  -1.285  0.577  1.00 0.43 ?  6  PHE A HE2  3  
ATOM   1261 H HZ   . PHE A 1 6  ? -1.463  -0.772  2.700  1.00 0.51 ?  6  PHE A HZ   3  
ATOM   1262 N N    . LYS A 1 7  ? -7.146  1.565   -1.263 1.00 0.13 ?  7  LYS A N    3  
ATOM   1263 C CA   . LYS A 1 7  ? -7.164  1.146   -2.654 1.00 0.15 ?  7  LYS A CA   3  
ATOM   1264 C C    . LYS A 1 7  ? -6.949  2.341   -3.576 1.00 0.19 ?  7  LYS A C    3  
ATOM   1265 O O    . LYS A 1 7  ? -6.266  2.239   -4.587 1.00 0.23 ?  7  LYS A O    3  
ATOM   1266 C CB   . LYS A 1 7  ? -8.489  0.465   -2.995 1.00 0.23 ?  7  LYS A CB   3  
ATOM   1267 C CG   . LYS A 1 7  ? -8.545  -0.073  -4.415 1.00 0.30 ?  7  LYS A CG   3  
ATOM   1268 C CD   . LYS A 1 7  ? -9.868  -0.761  -4.702 1.00 0.44 ?  7  LYS A CD   3  
ATOM   1269 C CE   . LYS A 1 7  ? -9.894  -1.350  -6.105 1.00 1.26 ?  7  LYS A CE   3  
ATOM   1270 N NZ   . LYS A 1 7  ? -11.140 -2.117  -6.364 1.00 2.06 1  7  LYS A NZ   3  
ATOM   1271 H H    . LYS A 1 7  ? -7.951  1.431   -0.711 1.00 0.18 ?  7  LYS A H    3  
ATOM   1272 H HA   . LYS A 1 7  ? -6.358  0.444   -2.800 1.00 0.15 ?  7  LYS A HA   3  
ATOM   1273 H HB2  . LYS A 1 7  ? -8.648  -0.356  -2.312 1.00 0.28 ?  7  LYS A HB2  3  
ATOM   1274 H HB3  . LYS A 1 7  ? -9.287  1.182   -2.874 1.00 0.25 ?  7  LYS A HB3  3  
ATOM   1275 H HG2  . LYS A 1 7  ? -8.420  0.747   -5.104 1.00 0.31 ?  7  LYS A HG2  3  
ATOM   1276 H HG3  . LYS A 1 7  ? -7.744  -0.784  -4.551 1.00 0.36 ?  7  LYS A HG3  3  
ATOM   1277 H HD2  . LYS A 1 7  ? -10.013 -1.555  -3.984 1.00 1.10 ?  7  LYS A HD2  3  
ATOM   1278 H HD3  . LYS A 1 7  ? -10.666 -0.038  -4.610 1.00 0.92 ?  7  LYS A HD3  3  
ATOM   1279 H HE2  . LYS A 1 7  ? -9.824  -0.546  -6.822 1.00 1.83 ?  7  LYS A HE2  3  
ATOM   1280 H HE3  . LYS A 1 7  ? -9.045  -2.008  -6.221 1.00 1.84 ?  7  LYS A HE3  3  
ATOM   1281 H HZ1  . LYS A 1 7  ? -11.247 -2.877  -5.662 1.00 2.69 ?  7  LYS A HZ1  3  
ATOM   1282 H HZ2  . LYS A 1 7  ? -11.107 -2.543  -7.312 1.00 2.55 ?  7  LYS A HZ2  3  
ATOM   1283 H HZ3  . LYS A 1 7  ? -11.967 -1.489  -6.309 1.00 2.30 ?  7  LYS A HZ3  3  
ATOM   1284 N N    . ALA A 1 8  ? -7.543  3.470   -3.224 1.00 0.22 ?  8  ALA A N    3  
ATOM   1285 C CA   . ALA A 1 8  ? -7.381  4.690   -4.005 1.00 0.30 ?  8  ALA A CA   3  
ATOM   1286 C C    . ALA A 1 8  ? -5.929  5.164   -4.003 1.00 0.35 ?  8  ALA A C    3  
ATOM   1287 O O    . ALA A 1 8  ? -5.430  5.663   -5.008 1.00 0.45 ?  8  ALA A O    3  
ATOM   1288 C CB   . ALA A 1 8  ? -8.297  5.780   -3.474 1.00 0.35 ?  8  ALA A CB   3  
ATOM   1289 H H    . ALA A 1 8  ? -8.120  3.483   -2.428 1.00 0.22 ?  8  ALA A H    3  
ATOM   1290 H HA   . ALA A 1 8  ? -7.673  4.473   -5.021 1.00 0.34 ?  8  ALA A HA   3  
ATOM   1291 H HB1  . ALA A 1 8  ? -8.014  6.024   -2.462 1.00 1.02 ?  8  ALA A HB1  3  
ATOM   1292 H HB2  . ALA A 1 8  ? -9.318  5.431   -3.490 1.00 1.02 ?  8  ALA A HB2  3  
ATOM   1293 H HB3  . ALA A 1 8  ? -8.207  6.660   -4.096 1.00 1.04 ?  8  ALA A HB3  3  
ATOM   1294 N N    . VAL A 1 9  ? -5.259  5.001   -2.870 1.00 0.31 ?  9  VAL A N    3  
ATOM   1295 C CA   . VAL A 1 9  ? -3.870  5.428   -2.731 1.00 0.39 ?  9  VAL A CA   3  
ATOM   1296 C C    . VAL A 1 9  ? -2.908  4.457   -3.417 1.00 0.38 ?  9  VAL A C    3  
ATOM   1297 O O    . VAL A 1 9  ? -2.103  4.854   -4.259 1.00 0.49 ?  9  VAL A O    3  
ATOM   1298 C CB   . VAL A 1 9  ? -3.466  5.560   -1.243 1.00 0.42 ?  9  VAL A CB   3  
ATOM   1299 C CG1  . VAL A 1 9  ? -2.007  5.968   -1.113 1.00 0.52 ?  9  VAL A CG1  3  
ATOM   1300 C CG2  . VAL A 1 9  ? -4.358  6.559   -0.525 1.00 0.50 ?  9  VAL A CG2  3  
ATOM   1301 H H    . VAL A 1 9  ? -5.714  4.594   -2.098 1.00 0.26 ?  9  VAL A H    3  
ATOM   1302 H HA   . VAL A 1 9  ? -3.773  6.398   -3.192 1.00 0.47 ?  9  VAL A HA   3  
ATOM   1303 H HB   . VAL A 1 9  ? -3.591  4.596   -0.769 1.00 0.37 ?  9  VAL A HB   3  
ATOM   1304 H HG11 . VAL A 1 9  ? -1.755  6.072   -0.068 1.00 0.97 ?  9  VAL A HG11 3  
ATOM   1305 H HG12 . VAL A 1 9  ? -1.852  6.909   -1.616 1.00 0.84 ?  9  VAL A HG12 3  
ATOM   1306 H HG13 . VAL A 1 9  ? -1.382  5.210   -1.560 1.00 1.18 ?  9  VAL A HG13 3  
ATOM   1307 H HG21 . VAL A 1 9  ? -4.278  7.523   -1.002 1.00 0.95 ?  9  VAL A HG21 3  
ATOM   1308 H HG22 . VAL A 1 9  ? -4.048  6.640   0.507  1.00 0.76 ?  9  VAL A HG22 3  
ATOM   1309 H HG23 . VAL A 1 9  ? -5.384  6.220   -0.566 1.00 0.91 ?  9  VAL A HG23 3  
ATOM   1310 N N    . PHE A 1 10 ? -3.001  3.186   -3.055 1.00 0.29 ?  10 PHE A N    3  
ATOM   1311 C CA   . PHE A 1 10 ? -2.025  2.192   -3.485 1.00 0.33 ?  10 PHE A CA   3  
ATOM   1312 C C    . PHE A 1 10 ? -2.437  1.480   -4.768 1.00 0.35 ?  10 PHE A C    3  
ATOM   1313 O O    . PHE A 1 10 ? -1.587  1.027   -5.534 1.00 0.45 ?  10 PHE A O    3  
ATOM   1314 C CB   . PHE A 1 10 ? -1.806  1.171   -2.371 1.00 0.32 ?  10 PHE A CB   3  
ATOM   1315 C CG   . PHE A 1 10 ? -1.133  1.751   -1.163 1.00 0.33 ?  10 PHE A CG   3  
ATOM   1316 C CD1  . PHE A 1 10 ? -1.876  2.299   -0.130 1.00 0.39 ?  10 PHE A CD1  3  
ATOM   1317 C CD2  . PHE A 1 10 ? 0.245   1.754   -1.067 1.00 0.39 ?  10 PHE A CD2  3  
ATOM   1318 C CE1  . PHE A 1 10 ? -1.252  2.840   0.976  1.00 0.41 ?  10 PHE A CE1  3  
ATOM   1319 C CE2  . PHE A 1 10 ? 0.875   2.292   0.035  1.00 0.42 ?  10 PHE A CE2  3  
ATOM   1320 C CZ   . PHE A 1 10 ? 0.127   2.835   1.060  1.00 0.37 ?  10 PHE A CZ   3  
ATOM   1321 H H    . PHE A 1 10 ? -3.744  2.907   -2.473 1.00 0.22 ?  10 PHE A H    3  
ATOM   1322 H HA   . PHE A 1 10 ? -1.095  2.708   -3.663 1.00 0.39 ?  10 PHE A HA   3  
ATOM   1323 H HB2  . PHE A 1 10 ? -2.764  0.776   -2.060 1.00 0.30 ?  10 PHE A HB2  3  
ATOM   1324 H HB3  . PHE A 1 10 ? -1.191  0.365   -2.744 1.00 0.37 ?  10 PHE A HB3  3  
ATOM   1325 H HD1  . PHE A 1 10 ? -2.954  2.299   -0.192 1.00 0.48 ?  10 PHE A HD1  3  
ATOM   1326 H HD2  . PHE A 1 10 ? 0.830   1.332   -1.868 1.00 0.47 ?  10 PHE A HD2  3  
ATOM   1327 H HE1  . PHE A 1 10 ? -1.842  3.267   1.774  1.00 0.50 ?  10 PHE A HE1  3  
ATOM   1328 H HE2  . PHE A 1 10 ? 1.951   2.283   0.097  1.00 0.52 ?  10 PHE A HE2  3  
ATOM   1329 H HZ   . PHE A 1 10 ? 0.618   3.256   1.921  1.00 0.39 ?  10 PHE A HZ   3  
ATOM   1330 N N    . GLY A 1 11 ? -3.731  1.382   -5.008 1.00 0.28 ?  11 GLY A N    3  
ATOM   1331 C CA   . GLY A 1 11 ? -4.212  0.657   -6.168 1.00 0.31 ?  11 GLY A CA   3  
ATOM   1332 C C    . GLY A 1 11 ? -4.864  -0.657  -5.789 1.00 0.29 ?  11 GLY A C    3  
ATOM   1333 O O    . GLY A 1 11 ? -5.452  -1.336  -6.634 1.00 0.36 ?  11 GLY A O    3  
ATOM   1334 H H    . GLY A 1 11 ? -4.373  1.818   -4.406 1.00 0.24 ?  11 GLY A H    3  
ATOM   1335 H HA2  . GLY A 1 11 ? -4.932  1.270   -6.687 1.00 0.32 ?  11 GLY A HA2  3  
ATOM   1336 H HA3  . GLY A 1 11 ? -3.379  0.457   -6.826 1.00 0.35 ?  11 GLY A HA3  3  
HETATM 1337 N N    . NLE A 1 12 ? -4.762  -1.014  -4.516 1.00 0.24 ?  12 NLE A N    3  
HETATM 1338 C CA   . NLE A 1 12 ? -5.342  -2.246  -4.009 1.00 0.24 ?  12 NLE A CA   3  
HETATM 1339 C C    . NLE A 1 12 ? -5.690  -2.084  -2.534 1.00 0.21 ?  12 NLE A C    3  
HETATM 1340 O O    . NLE A 1 12 ? -5.133  -1.222  -1.853 1.00 0.22 ?  12 NLE A O    3  
HETATM 1341 C CB   . NLE A 1 12 ? -4.385  -3.432  -4.203 1.00 0.27 ?  12 NLE A CB   3  
HETATM 1342 C CG   . NLE A 1 12 ? -3.100  -3.372  -3.378 1.00 0.64 ?  12 NLE A CG   3  
HETATM 1343 C CD   . NLE A 1 12 ? -2.097  -2.358  -3.916 1.00 0.33 ?  12 NLE A CD   3  
HETATM 1344 C CE   . NLE A 1 12 ? -1.629  -2.754  -5.303 1.00 0.64 ?  12 NLE A CE   3  
HETATM 1345 H H    . NLE A 1 12 ? -4.282  -0.428  -3.896 1.00 0.26 ?  12 NLE A H    3  
HETATM 1346 H HA   . NLE A 1 12 ? -6.251  -2.434  -4.561 1.00 0.26 ?  12 NLE A HA   3  
HETATM 1347 H HB2  . NLE A 1 12 ? -4.114  -3.487  -5.245 1.00 0.51 ?  12 NLE A HB2  3  
HETATM 1348 H HB3  . NLE A 1 12 ? -4.906  -4.336  -3.936 1.00 0.31 ?  12 NLE A HB3  3  
HETATM 1349 H HG2  . NLE A 1 12 ? -2.642  -4.350  -3.381 1.00 1.24 ?  12 NLE A HG2  3  
HETATM 1350 H HG3  . NLE A 1 12 ? -3.354  -3.100  -2.364 1.00 1.24 ?  12 NLE A HG3  3  
HETATM 1351 H HD2  . NLE A 1 12 ? -1.242  -2.319  -3.260 1.00 0.70 ?  12 NLE A HD2  3  
HETATM 1352 H HD3  . NLE A 1 12 ? -2.564  -1.387  -3.972 1.00 0.43 ?  12 NLE A HD3  3  
HETATM 1353 H HE1  . NLE A 1 12 ? -2.467  -2.749  -5.984 1.00 1.10 ?  12 NLE A HE1  3  
HETATM 1354 H HE2  . NLE A 1 12 ? -1.201  -3.746  -5.268 1.00 1.19 ?  12 NLE A HE2  3  
HETATM 1355 H HE3  . NLE A 1 12 ? -0.883  -2.052  -5.645 1.00 1.26 ?  12 NLE A HE3  3  
ATOM   1356 N N    . THR A 1 13 ? -6.619  -2.897  -2.056 1.00 0.24 ?  13 THR A N    3  
ATOM   1357 C CA   . THR A 1 13 ? -7.059  -2.832  -0.672 1.00 0.27 ?  13 THR A CA   3  
ATOM   1358 C C    . THR A 1 13 ? -6.038  -3.454  0.269  1.00 0.24 ?  13 THR A C    3  
ATOM   1359 O O    . THR A 1 13 ? -5.142  -4.173  -0.177 1.00 0.23 ?  13 THR A O    3  
ATOM   1360 C CB   . THR A 1 13 ? -8.411  -3.541  -0.493 1.00 0.34 ?  13 THR A CB   3  
ATOM   1361 O OG1  . THR A 1 13 ? -8.373  -4.828  -1.128 1.00 0.36 ?  13 THR A OG1  3  
ATOM   1362 C CG2  . THR A 1 13 ? -9.538  -2.705  -1.079 1.00 0.43 ?  13 THR A CG2  3  
ATOM   1363 H H    . THR A 1 13 ? -7.024  -3.565  -2.651 1.00 0.27 ?  13 THR A H    3  
ATOM   1364 H HA   . THR A 1 13 ? -7.185  -1.793  -0.408 1.00 0.30 ?  13 THR A HA   3  
ATOM   1365 H HB   . THR A 1 13 ? -8.592  -3.676  0.565  1.00 0.34 ?  13 THR A HB   3  
ATOM   1366 H HG1  . THR A 1 13 ? -9.270  -5.153  -1.256 1.00 0.58 ?  13 THR A HG1  3  
ATOM   1367 H HG21 . THR A 1 13 ? -9.354  -2.545  -2.131 1.00 0.92 ?  13 THR A HG21 3  
ATOM   1368 H HG22 . THR A 1 13 ? -9.583  -1.753  -0.572 1.00 1.34 ?  13 THR A HG22 3  
ATOM   1369 H HG23 . THR A 1 13 ? -10.475 -3.224  -0.953 1.00 1.02 ?  13 THR A HG23 3  
ATOM   1370 N N    . ARG A 1 14 ? -6.187  -3.190  1.565  1.00 0.29 ?  14 ARG A N    3  
ATOM   1371 C CA   . ARG A 1 14 ? -5.225  -3.640  2.571  1.00 0.32 ?  14 ARG A CA   3  
ATOM   1372 C C    . ARG A 1 14 ? -4.896  -5.120  2.413  1.00 0.30 ?  14 ARG A C    3  
ATOM   1373 O O    . ARG A 1 14 ? -3.726  -5.509  2.460  1.00 0.31 ?  14 ARG A O    3  
ATOM   1374 C CB   . ARG A 1 14 ? -5.767  -3.391  3.978  1.00 0.42 ?  14 ARG A CB   3  
ATOM   1375 C CG   . ARG A 1 14 ? -5.916  -1.926  4.335  1.00 0.53 ?  14 ARG A CG   3  
ATOM   1376 C CD   . ARG A 1 14 ? -6.450  -1.763  5.747  1.00 0.77 ?  14 ARG A CD   3  
ATOM   1377 N NE   . ARG A 1 14 ? -6.569  -0.360  6.132  1.00 1.30 ?  14 ARG A NE   3  
ATOM   1378 C CZ   . ARG A 1 14 ? -5.911  0.192   7.150  1.00 1.88 ?  14 ARG A CZ   3  
ATOM   1379 N NH1  . ARG A 1 14 ? -5.036  -0.519  7.853  1.00 2.02 1  14 ARG A NH1  3  
ATOM   1380 N NH2  . ARG A 1 14 ? -6.124  1.461   7.461  1.00 2.82 ?  14 ARG A NH2  3  
ATOM   1381 H H    . ARG A 1 14 ? -6.973  -2.685  1.855  1.00 0.32 ?  14 ARG A H    3  
ATOM   1382 H HA   . ARG A 1 14 ? -4.318  -3.065  2.440  1.00 0.34 ?  14 ARG A HA   3  
ATOM   1383 H HB2  . ARG A 1 14 ? -6.736  -3.857  4.064  1.00 0.43 ?  14 ARG A HB2  3  
ATOM   1384 H HB3  . ARG A 1 14 ? -5.097  -3.846  4.690  1.00 0.46 ?  14 ARG A HB3  3  
ATOM   1385 H HG2  . ARG A 1 14 ? -4.947  -1.448  4.267  1.00 0.58 ?  14 ARG A HG2  3  
ATOM   1386 H HG3  . ARG A 1 14 ? -6.602  -1.463  3.642  1.00 0.53 ?  14 ARG A HG3  3  
ATOM   1387 H HD2  . ARG A 1 14 ? -7.425  -2.222  5.802  1.00 1.48 ?  14 ARG A HD2  3  
ATOM   1388 H HD3  . ARG A 1 14 ? -5.783  -2.260  6.431  1.00 1.15 ?  14 ARG A HD3  3  
ATOM   1389 H HE   . ARG A 1 14 ? -7.196  0.193   5.618  1.00 1.80 ?  14 ARG A HE   3  
ATOM   1390 H HH11 . ARG A 1 14 ? -4.545  -0.095  8.617  1.00 2.60 ?  14 ARG A HH11 3  
ATOM   1391 H HH12 . ARG A 1 14 ? -4.864  -1.481  7.625  1.00 1.94 ?  14 ARG A HH12 3  
ATOM   1392 H HH21 . ARG A 1 14 ? -6.784  2.008   6.931  1.00 3.23 ?  14 ARG A HH21 3  
ATOM   1393 H HH22 . ARG A 1 14 ? -5.628  1.886   8.224  1.00 3.30 ?  14 ARG A HH22 3  
HETATM 1394 N N    . AIB A 1 15 ? -5.936  -5.926  2.211  1.00 0.31 ?  15 AIB A N    3  
HETATM 1395 C CA   . AIB A 1 15 ? -5.795  -7.376  2.028  1.00 0.33 ?  15 AIB A CA   3  
HETATM 1396 C C    . AIB A 1 15 ? -4.831  -7.661  0.869  1.00 0.30 ?  15 AIB A C    3  
HETATM 1397 O O    . AIB A 1 15 ? -3.886  -8.447  1.002  1.00 0.30 ?  15 AIB A O    3  
HETATM 1398 C CB1  . AIB A 1 15 ? -7.149  -7.978  1.716  1.00 0.37 ?  15 AIB A CB1  3  
HETATM 1399 C CB2  . AIB A 1 15 ? -5.292  -8.022  3.306  1.00 0.37 ?  15 AIB A CB2  3  
HETATM 1400 H H    . AIB A 1 15 ? -6.837  -5.533  2.184  1.00 0.31 ?  15 AIB A H    3  
HETATM 1401 H HB11 . AIB A 1 15 ? -7.541  -7.531  0.814  1.00 1.00 ?  15 AIB A HB11 3  
HETATM 1402 H HB12 . AIB A 1 15 ? -7.826  -7.787  2.536  1.00 1.13 ?  15 AIB A HB12 3  
HETATM 1403 H HB13 . AIB A 1 15 ? -7.047  -9.044  1.574  1.00 1.02 ?  15 AIB A HB13 3  
HETATM 1404 H HB21 . AIB A 1 15 ? -5.980  -7.810  4.111  1.00 1.07 ?  15 AIB A HB21 3  
HETATM 1405 H HB22 . AIB A 1 15 ? -4.319  -7.622  3.552  1.00 1.16 ?  15 AIB A HB22 3  
HETATM 1406 H HB23 . AIB A 1 15 ? -5.217  -9.089  3.166  1.00 1.01 ?  15 AIB A HB23 3  
ATOM   1407 N N    . ALA A 1 16 ? -5.056  -6.984  -0.250 1.00 0.27 ?  16 ALA A N    3  
ATOM   1408 C CA   . ALA A 1 16 ? -4.288  -7.229  -1.460 1.00 0.26 ?  16 ALA A CA   3  
ATOM   1409 C C    . ALA A 1 16 ? -2.876  -6.681  -1.316 1.00 0.23 ?  16 ALA A C    3  
ATOM   1410 O O    . ALA A 1 16 ? -1.931  -7.201  -1.907 1.00 0.25 ?  16 ALA A O    3  
ATOM   1411 C CB   . ALA A 1 16 ? -4.985  -6.610  -2.660 1.00 0.28 ?  16 ALA A CB   3  
ATOM   1412 H H    . ALA A 1 16 ? -5.737  -6.272  -0.253 1.00 0.27 ?  16 ALA A H    3  
ATOM   1413 H HA   . ALA A 1 16 ? -4.238  -8.297  -1.611 1.00 0.29 ?  16 ALA A HA   3  
ATOM   1414 H HB1  . ALA A 1 16 ? -5.943  -7.088  -2.806 1.00 0.90 ?  16 ALA A HB1  3  
ATOM   1415 H HB2  . ALA A 1 16 ? -4.376  -6.744  -3.541 1.00 0.96 ?  16 ALA A HB2  3  
ATOM   1416 H HB3  . ALA A 1 16 ? -5.135  -5.556  -2.481 1.00 0.89 ?  16 ALA A HB3  3  
ATOM   1417 N N    . PHE A 1 17 ? -2.747  -5.630  -0.520 1.00 0.20 ?  17 PHE A N    3  
ATOM   1418 C CA   . PHE A 1 17 ? -1.457  -5.024  -0.240 1.00 0.19 ?  17 PHE A CA   3  
ATOM   1419 C C    . PHE A 1 17 ? -0.605  -5.962  0.604  1.00 0.20 ?  17 PHE A C    3  
ATOM   1420 O O    . PHE A 1 17 ? 0.548   -6.235  0.280  1.00 0.20 ?  17 PHE A O    3  
ATOM   1421 C CB   . PHE A 1 17 ? -1.662  -3.696  0.482  1.00 0.22 ?  17 PHE A CB   3  
ATOM   1422 C CG   . PHE A 1 17 ? -0.398  -2.930  0.723  1.00 0.24 ?  17 PHE A CG   3  
ATOM   1423 C CD1  . PHE A 1 17 ? 0.189   -2.194  -0.294 1.00 0.28 ?  17 PHE A CD1  3  
ATOM   1424 C CD2  . PHE A 1 17 ? 0.207   -2.950  1.966  1.00 0.28 ?  17 PHE A CD2  3  
ATOM   1425 C CE1  . PHE A 1 17 ? 1.358   -1.493  -0.070 1.00 0.33 ?  17 PHE A CE1  3  
ATOM   1426 C CE2  . PHE A 1 17 ? 1.371   -2.253  2.194  1.00 0.32 ?  17 PHE A CE2  3  
ATOM   1427 C CZ   . PHE A 1 17 ? 1.936   -1.498  1.159  1.00 0.33 ?  17 PHE A CZ   3  
ATOM   1428 H H    . PHE A 1 17 ? -3.553  -5.240  -0.114 1.00 0.21 ?  17 PHE A H    3  
ATOM   1429 H HA   . PHE A 1 17 ? -0.960  -4.842  -1.180 1.00 0.19 ?  17 PHE A HA   3  
ATOM   1430 H HB2  . PHE A 1 17 ? -2.315  -3.077  -0.109 1.00 0.22 ?  17 PHE A HB2  3  
ATOM   1431 H HB3  . PHE A 1 17 ? -2.125  -3.884  1.439  1.00 0.24 ?  17 PHE A HB3  3  
ATOM   1432 H HD1  . PHE A 1 17 ? -0.277  -2.170  -1.268 1.00 0.30 ?  17 PHE A HD1  3  
ATOM   1433 H HD2  . PHE A 1 17 ? -0.243  -3.521  2.765  1.00 0.30 ?  17 PHE A HD2  3  
ATOM   1434 H HE1  . PHE A 1 17 ? 1.808   -0.923  -0.867 1.00 0.38 ?  17 PHE A HE1  3  
ATOM   1435 H HE2  . PHE A 1 17 ? 1.830   -2.278  3.169  1.00 0.36 ?  17 PHE A HE2  3  
ATOM   1436 H HZ   . PHE A 1 17 ? 2.846   -0.941  1.325  1.00 0.37 ?  17 PHE A HZ   3  
ATOM   1437 N N    . ALA A 1 18 ? -1.191  -6.474  1.677  1.00 0.23 ?  18 ALA A N    3  
ATOM   1438 C CA   . ALA A 1 18 ? -0.497  -7.395  2.563  1.00 0.25 ?  18 ALA A CA   3  
ATOM   1439 C C    . ALA A 1 18 ? -0.255  -8.729  1.869  1.00 0.23 ?  18 ALA A C    3  
ATOM   1440 O O    . ALA A 1 18 ? 0.606   -9.510  2.276  1.00 0.23 ?  18 ALA A O    3  
ATOM   1441 C CB   . ALA A 1 18 ? -1.292  -7.594  3.840  1.00 0.30 ?  18 ALA A CB   3  
ATOM   1442 H H    . ALA A 1 18 ? -2.118  -6.220  1.880  1.00 0.25 ?  18 ALA A H    3  
ATOM   1443 H HA   . ALA A 1 18 ? 0.455   -6.956  2.822  1.00 0.27 ?  18 ALA A HA   3  
ATOM   1444 H HB1  . ALA A 1 18 ? -1.484  -6.634  4.295  1.00 1.06 ?  18 ALA A HB1  3  
ATOM   1445 H HB2  . ALA A 1 18 ? -0.725  -8.208  4.523  1.00 0.87 ?  18 ALA A HB2  3  
ATOM   1446 H HB3  . ALA A 1 18 ? -2.228  -8.079  3.610  1.00 0.99 ?  18 ALA A HB3  3  
ATOM   1447 N N    . ASN A 1 19 ? -1.039  -8.986  0.830  1.00 0.24 ?  19 ASN A N    3  
ATOM   1448 C CA   . ASN A 1 19 ? -0.844  -10.160 -0.010 1.00 0.24 ?  19 ASN A CA   3  
ATOM   1449 C C    . ASN A 1 19 ? 0.433   -10.020 -0.842 1.00 0.19 ?  19 ASN A C    3  
ATOM   1450 O O    . ASN A 1 19 ? 1.011   -11.014 -1.288 1.00 0.22 ?  19 ASN A O    3  
ATOM   1451 C CB   . ASN A 1 19 ? -2.049  -10.351 -0.931 1.00 0.31 ?  19 ASN A CB   3  
ATOM   1452 C CG   . ASN A 1 19 ? -1.970  -11.629 -1.741 1.00 0.36 ?  19 ASN A CG   3  
ATOM   1453 O OD1  . ASN A 1 19 ? -1.465  -12.647 -1.266 1.00 1.14 ?  19 ASN A OD1  3  
ATOM   1454 N ND2  . ASN A 1 19 ? -2.456  -11.587 -2.970 1.00 1.08 ?  19 ASN A ND2  3  
ATOM   1455 H H    . ASN A 1 19 ? -1.789  -8.381  0.637  1.00 0.25 ?  19 ASN A H    3  
ATOM   1456 H HA   . ASN A 1 19 ? -0.751  -11.020 0.635  1.00 0.27 ?  19 ASN A HA   3  
ATOM   1457 H HB2  . ASN A 1 19 ? -2.948  -10.381 -0.335 1.00 0.38 ?  19 ASN A HB2  3  
ATOM   1458 H HB3  . ASN A 1 19 ? -2.103  -9.515  -1.613 1.00 0.32 ?  19 ASN A HB3  3  
ATOM   1459 H HD21 . ASN A 1 19 ? -2.837  -10.738 -3.290 1.00 1.83 ?  19 ASN A HD21 3  
ATOM   1460 H HD22 . ASN A 1 19 ? -2.415  -12.400 -3.514 1.00 1.08 ?  19 ASN A HD22 3  
ATOM   1461 N N    . LEU A 1 20 ? 0.875   -8.780  -1.036 1.00 0.17 ?  20 LEU A N    3  
ATOM   1462 C CA   . LEU A 1 20 ? 2.080   -8.503  -1.806 1.00 0.17 ?  20 LEU A CA   3  
ATOM   1463 C C    . LEU A 1 20 ? 3.315   -8.880  -0.995 1.00 0.17 ?  20 LEU A C    3  
ATOM   1464 O O    . LEU A 1 20 ? 3.235   -9.019  0.225  1.00 0.18 ?  20 LEU A O    3  
ATOM   1465 C CB   . LEU A 1 20 ? 2.142   -7.017  -2.174 1.00 0.20 ?  20 LEU A CB   3  
ATOM   1466 C CG   . LEU A 1 20 ? 0.974   -6.494  -3.011 1.00 0.29 ?  20 LEU A CG   3  
ATOM   1467 C CD1  . LEU A 1 20 ? 1.050   -4.979  -3.136 1.00 0.32 ?  20 LEU A CD1  3  
ATOM   1468 C CD2  . LEU A 1 20 ? 0.970   -7.143  -4.388 1.00 0.41 ?  20 LEU A CD2  3  
ATOM   1469 H H    . LEU A 1 20 ? 0.385   -8.029  -0.633 1.00 0.19 ?  20 LEU A H    3  
ATOM   1470 H HA   . LEU A 1 20 ? 2.049   -9.095  -2.707 1.00 0.22 ?  20 LEU A HA   3  
ATOM   1471 H HB2  . LEU A 1 20 ? 2.185   -6.445  -1.258 1.00 0.19 ?  20 LEU A HB2  3  
ATOM   1472 H HB3  . LEU A 1 20 ? 3.054   -6.844  -2.724 1.00 0.24 ?  20 LEU A HB3  3  
ATOM   1473 H HG   . LEU A 1 20 ? 0.045   -6.744  -2.518 1.00 0.33 ?  20 LEU A HG   3  
ATOM   1474 H HD11 . LEU A 1 20 ? 1.972   -4.704  -3.624 1.00 1.04 ?  20 LEU A HD11 3  
ATOM   1475 H HD12 . LEU A 1 20 ? 1.017   -4.534  -2.151 1.00 1.05 ?  20 LEU A HD12 3  
ATOM   1476 H HD13 . LEU A 1 20 ? 0.213   -4.624  -3.719 1.00 1.10 ?  20 LEU A HD13 3  
ATOM   1477 H HD21 . LEU A 1 20 ? 0.850   -8.210  -4.282 1.00 1.10 ?  20 LEU A HD21 3  
ATOM   1478 H HD22 . LEU A 1 20 ? 1.905   -6.935  -4.887 1.00 0.88 ?  20 LEU A HD22 3  
ATOM   1479 H HD23 . LEU A 1 20 ? 0.153   -6.744  -4.972 1.00 1.17 ?  20 LEU A HD23 3  
ATOM   1480 N N    . PRO A 1 21 ? 4.471   -9.061  -1.653 1.00 0.23 ?  21 PRO A N    3  
ATOM   1481 C CA   . PRO A 1 21 ? 5.732   -9.323  -0.956 1.00 0.29 ?  21 PRO A CA   3  
ATOM   1482 C C    . PRO A 1 21 ? 6.098   -8.164  -0.037 1.00 0.26 ?  21 PRO A C    3  
ATOM   1483 O O    . PRO A 1 21 ? 5.836   -7.001  -0.346 1.00 0.22 ?  21 PRO A O    3  
ATOM   1484 C CB   . PRO A 1 21 ? 6.755   -9.454  -2.088 1.00 0.38 ?  21 PRO A CB   3  
ATOM   1485 C CG   . PRO A 1 21 ? 5.953   -9.731  -3.313 1.00 0.43 ?  21 PRO A CG   3  
ATOM   1486 C CD   . PRO A 1 21 ? 4.643   -9.028  -3.114 1.00 0.30 ?  21 PRO A CD   3  
ATOM   1487 H HA   . PRO A 1 21 ? 5.690   -10.239 -0.387 1.00 0.32 ?  21 PRO A HA   3  
ATOM   1488 H HB2  . PRO A 1 21 ? 7.311   -8.530  -2.181 1.00 0.43 ?  21 PRO A HB2  3  
ATOM   1489 H HB3  . PRO A 1 21 ? 7.435   -10.266 -1.869 1.00 0.48 ?  21 PRO A HB3  3  
ATOM   1490 H HG2  . PRO A 1 21 ? 6.460   -9.337  -4.183 1.00 0.63 ?  21 PRO A HG2  3  
ATOM   1491 H HG3  . PRO A 1 21 ? 5.797   -10.796 -3.415 1.00 0.61 ?  21 PRO A HG3  3  
ATOM   1492 H HD2  . PRO A 1 21 ? 4.703   -8.011  -3.473 1.00 0.40 ?  21 PRO A HD2  3  
ATOM   1493 H HD3  . PRO A 1 21 ? 3.844   -9.558  -3.610 1.00 0.39 ?  21 PRO A HD3  3  
ATOM   1494 N N    . LEU A 1 22 ? 6.708   -8.501  1.096  1.00 0.30 ?  22 LEU A N    3  
ATOM   1495 C CA   . LEU A 1 22 ? 7.037   -7.534  2.136  1.00 0.31 ?  22 LEU A CA   3  
ATOM   1496 C C    . LEU A 1 22 ? 7.903   -6.394  1.604  1.00 0.28 ?  22 LEU A C    3  
ATOM   1497 O O    . LEU A 1 22 ? 7.755   -5.249  2.034  1.00 0.28 ?  22 LEU A O    3  
ATOM   1498 C CB   . LEU A 1 22 ? 7.745   -8.240  3.298  1.00 0.41 ?  22 LEU A CB   3  
ATOM   1499 C CG   . LEU A 1 22 ? 8.117   -7.349  4.485  1.00 1.07 ?  22 LEU A CG   3  
ATOM   1500 C CD1  . LEU A 1 22 ? 6.873   -6.766  5.140  1.00 1.64 ?  22 LEU A CD1  3  
ATOM   1501 C CD2  . LEU A 1 22 ? 8.932   -8.137  5.498  1.00 1.54 ?  22 LEU A CD2  3  
ATOM   1502 H H    . LEU A 1 22 ? 6.947   -9.443  1.241  1.00 0.34 ?  22 LEU A H    3  
ATOM   1503 H HA   . LEU A 1 22 ? 6.109   -7.120  2.499  1.00 0.30 ?  22 LEU A HA   3  
ATOM   1504 H HB2  . LEU A 1 22 ? 7.100   -9.028  3.657  1.00 1.00 ?  22 LEU A HB2  3  
ATOM   1505 H HB3  . LEU A 1 22 ? 8.650   -8.687  2.917  1.00 0.94 ?  22 LEU A HB3  3  
ATOM   1506 H HG   . LEU A 1 22 ? 8.724   -6.528  4.133  1.00 1.97 ?  22 LEU A HG   3  
ATOM   1507 H HD11 . LEU A 1 22 ? 6.357   -6.134  4.434  1.00 2.16 ?  22 LEU A HD11 3  
ATOM   1508 H HD12 . LEU A 1 22 ? 7.160   -6.184  6.003  1.00 1.77 ?  22 LEU A HD12 3  
ATOM   1509 H HD13 . LEU A 1 22 ? 6.220   -7.569  5.450  1.00 2.26 ?  22 LEU A HD13 3  
ATOM   1510 H HD21 . LEU A 1 22 ? 9.192   -7.495  6.327  1.00 2.09 ?  22 LEU A HD21 3  
ATOM   1511 H HD22 . LEU A 1 22 ? 9.834   -8.501  5.028  1.00 1.81 ?  22 LEU A HD22 3  
ATOM   1512 H HD23 . LEU A 1 22 ? 8.349   -8.971  5.857  1.00 2.05 ?  22 LEU A HD23 3  
ATOM   1513 N N    . TRP A 1 23 ? 8.806   -6.698  0.674  1.00 0.33 ?  23 TRP A N    3  
ATOM   1514 C CA   . TRP A 1 23 ? 9.636   -5.660  0.073  1.00 0.34 ?  23 TRP A CA   3  
ATOM   1515 C C    . TRP A 1 23 ? 8.776   -4.709  -0.749 1.00 0.27 ?  23 TRP A C    3  
ATOM   1516 O O    . TRP A 1 23 ? 9.047   -3.514  -0.820 1.00 0.25 ?  23 TRP A O    3  
ATOM   1517 C CB   . TRP A 1 23 ? 10.755  -6.260  -0.797 1.00 0.42 ?  23 TRP A CB   3  
ATOM   1518 C CG   . TRP A 1 23 ? 10.280  -6.990  -2.023 1.00 0.48 ?  23 TRP A CG   3  
ATOM   1519 C CD1  . TRP A 1 23 ? 10.085  -8.331  -2.149 1.00 0.56 ?  23 TRP A CD1  3  
ATOM   1520 C CD2  . TRP A 1 23 ? 9.956   -6.417  -3.299 1.00 0.51 ?  23 TRP A CD2  3  
ATOM   1521 N NE1  . TRP A 1 23 ? 9.654   -8.629  -3.418 1.00 0.62 ?  23 TRP A NE1  3  
ATOM   1522 C CE2  . TRP A 1 23 ? 9.563   -7.471  -4.142 1.00 0.60 ?  23 TRP A CE2  3  
ATOM   1523 C CE3  . TRP A 1 23 ? 9.954   -5.113  -3.808 1.00 0.49 ?  23 TRP A CE3  3  
ATOM   1524 C CZ2  . TRP A 1 23 ? 9.174   -7.264  -5.463 1.00 0.68 ?  23 TRP A CZ2  3  
ATOM   1525 C CZ3  . TRP A 1 23 ? 9.568   -4.910  -5.119 1.00 0.59 ?  23 TRP A CZ3  3  
ATOM   1526 C CH2  . TRP A 1 23 ? 9.181   -5.981  -5.933 1.00 0.68 ?  23 TRP A CH2  3  
ATOM   1527 H H    . TRP A 1 23 ? 8.926   -7.634  0.401  1.00 0.37 ?  23 TRP A H    3  
ATOM   1528 H HA   . TRP A 1 23 ? 10.085  -5.100  0.879  1.00 0.35 ?  23 TRP A HA   3  
ATOM   1529 H HB2  . TRP A 1 23 ? 11.405  -5.464  -1.125 1.00 0.42 ?  23 TRP A HB2  3  
ATOM   1530 H HB3  . TRP A 1 23 ? 11.327  -6.954  -0.200 1.00 0.48 ?  23 TRP A HB3  3  
ATOM   1531 H HD1  . TRP A 1 23 ? 10.249  -9.045  -1.359 1.00 0.59 ?  23 TRP A HD1  3  
ATOM   1532 H HE1  . TRP A 1 23 ? 9.441   -9.529  -3.752 1.00 0.69 ?  23 TRP A HE1  3  
ATOM   1533 H HE3  . TRP A 1 23 ? 10.247  -4.274  -3.195 1.00 0.44 ?  23 TRP A HE3  3  
ATOM   1534 H HZ2  . TRP A 1 23 ? 8.871   -8.079  -6.103 1.00 0.76 ?  23 TRP A HZ2  3  
ATOM   1535 H HZ3  . TRP A 1 23 ? 9.559   -3.912  -5.529 1.00 0.61 ?  23 TRP A HZ3  3  
ATOM   1536 H HH2  . TRP A 1 23 ? 8.888   -5.773  -6.950 1.00 0.76 ?  23 TRP A HH2  3  
ATOM   1537 N N    . LYS A 1 24 ? 7.717   -5.244  -1.347 1.00 0.24 ?  24 LYS A N    3  
ATOM   1538 C CA   . LYS A 1 24 ? 6.843   -4.451  -2.193 1.00 0.22 ?  24 LYS A CA   3  
ATOM   1539 C C    . LYS A 1 24 ? 5.934   -3.598  -1.326 1.00 0.14 ?  24 LYS A C    3  
ATOM   1540 O O    . LYS A 1 24 ? 5.647   -2.450  -1.652 1.00 0.15 ?  24 LYS A O    3  
ATOM   1541 C CB   . LYS A 1 24 ? 6.024   -5.357  -3.115 1.00 0.26 ?  24 LYS A CB   3  
ATOM   1542 C CG   . LYS A 1 24 ? 5.180   -4.599  -4.126 1.00 0.35 ?  24 LYS A CG   3  
ATOM   1543 C CD   . LYS A 1 24 ? 4.509   -5.547  -5.104 1.00 0.97 ?  24 LYS A CD   3  
ATOM   1544 C CE   . LYS A 1 24 ? 3.620   -4.804  -6.086 1.00 0.98 ?  24 LYS A CE   3  
ATOM   1545 N NZ   . LYS A 1 24 ? 4.401   -3.898  -6.967 1.00 1.37 1  24 LYS A NZ   3  
ATOM   1546 H H    . LYS A 1 24 ? 7.509   -6.192  -1.197 1.00 0.26 ?  24 LYS A H    3  
ATOM   1547 H HA   . LYS A 1 24 ? 7.464   -3.802  -2.793 1.00 0.25 ?  24 LYS A HA   3  
ATOM   1548 H HB2  . LYS A 1 24 ? 6.698   -6.006  -3.655 1.00 0.33 ?  24 LYS A HB2  3  
ATOM   1549 H HB3  . LYS A 1 24 ? 5.363   -5.962  -2.511 1.00 0.24 ?  24 LYS A HB3  3  
ATOM   1550 H HG2  . LYS A 1 24 ? 4.420   -4.040  -3.599 1.00 0.83 ?  24 LYS A HG2  3  
ATOM   1551 H HG3  . LYS A 1 24 ? 5.817   -3.919  -4.674 1.00 0.96 ?  24 LYS A HG3  3  
ATOM   1552 H HD2  . LYS A 1 24 ? 5.273   -6.075  -5.656 1.00 1.51 ?  24 LYS A HD2  3  
ATOM   1553 H HD3  . LYS A 1 24 ? 3.911   -6.256  -4.552 1.00 1.43 ?  24 LYS A HD3  3  
ATOM   1554 H HE2  . LYS A 1 24 ? 3.100   -5.526  -6.698 1.00 1.17 ?  24 LYS A HE2  3  
ATOM   1555 H HE3  . LYS A 1 24 ? 2.900   -4.221  -5.530 1.00 1.36 ?  24 LYS A HE3  3  
ATOM   1556 H HZ1  . LYS A 1 24 ? 3.757   -3.332  -7.557 1.00 1.91 ?  24 LYS A HZ1  3  
ATOM   1557 H HZ2  . LYS A 1 24 ? 5.021   -4.453  -7.589 1.00 1.69 ?  24 LYS A HZ2  3  
ATOM   1558 H HZ3  . LYS A 1 24 ? 4.987   -3.256  -6.396 1.00 1.76 ?  24 LYS A HZ3  3  
ATOM   1559 N N    . GLN A 1 25 ? 5.495   -4.173  -0.213 1.00 0.11 ?  25 GLN A N    3  
ATOM   1560 C CA   . GLN A 1 25 ? 4.729   -3.433  0.778  1.00 0.09 ?  25 GLN A CA   3  
ATOM   1561 C C    . GLN A 1 25 ? 5.531   -2.236  1.267  1.00 0.09 ?  25 GLN A C    3  
ATOM   1562 O O    . GLN A 1 25 ? 5.034   -1.110  1.296  1.00 0.12 ?  25 GLN A O    3  
ATOM   1563 C CB   . GLN A 1 25 ? 4.379   -4.329  1.964  1.00 0.14 ?  25 GLN A CB   3  
ATOM   1564 C CG   . GLN A 1 25 ? 3.458   -5.485  1.618  1.00 0.16 ?  25 GLN A CG   3  
ATOM   1565 C CD   . GLN A 1 25 ? 3.194   -6.380  2.812  1.00 0.22 ?  25 GLN A CD   3  
ATOM   1566 O OE1  . GLN A 1 25 ? 3.210   -5.928  3.957  1.00 0.41 ?  25 GLN A OE1  3  
ATOM   1567 N NE2  . GLN A 1 25 ? 2.952   -7.655  2.560  1.00 0.24 ?  25 GLN A NE2  3  
ATOM   1568 H H    . GLN A 1 25 ? 5.686   -5.123  -0.059 1.00 0.15 ?  25 GLN A H    3  
ATOM   1569 H HA   . GLN A 1 25 ? 3.818   -3.085  0.312  1.00 0.10 ?  25 GLN A HA   3  
ATOM   1570 H HB2  . GLN A 1 25 ? 5.290   -4.735  2.374  1.00 0.22 ?  25 GLN A HB2  3  
ATOM   1571 H HB3  . GLN A 1 25 ? 3.894   -3.728  2.718  1.00 0.18 ?  25 GLN A HB3  3  
ATOM   1572 H HG2  . GLN A 1 25 ? 2.519   -5.087  1.270  1.00 0.18 ?  25 GLN A HG2  3  
ATOM   1573 H HG3  . GLN A 1 25 ? 3.914   -6.074  0.837  1.00 0.21 ?  25 GLN A HG3  3  
ATOM   1574 H HE21 . GLN A 1 25 ? 2.957   -7.954  1.621  1.00 0.33 ?  25 GLN A HE21 3  
ATOM   1575 H HE22 . GLN A 1 25 ? 2.775   -8.251  3.319  1.00 0.27 ?  25 GLN A HE22 3  
ATOM   1576 N N    . GLN A 1 26 ? 6.777   -2.493  1.642  1.00 0.14 ?  26 GLN A N    3  
ATOM   1577 C CA   . GLN A 1 26 ? 7.671   -1.438  2.099  1.00 0.18 ?  26 GLN A CA   3  
ATOM   1578 C C    . GLN A 1 26 ? 7.899   -0.402  1.005  1.00 0.18 ?  26 GLN A C    3  
ATOM   1579 O O    . GLN A 1 26 ? 7.783   0.794   1.249  1.00 0.25 ?  26 GLN A O    3  
ATOM   1580 C CB   . GLN A 1 26 ? 9.005   -2.030  2.547  1.00 0.28 ?  26 GLN A CB   3  
ATOM   1581 C CG   . GLN A 1 26 ? 8.899   -2.893  3.791  1.00 0.38 ?  26 GLN A CG   3  
ATOM   1582 C CD   . GLN A 1 26 ? 10.193  -3.606  4.114  1.00 0.90 ?  26 GLN A CD   3  
ATOM   1583 O OE1  . GLN A 1 26 ? 11.045  -3.080  4.830  1.00 1.46 ?  26 GLN A OE1  3  
ATOM   1584 N NE2  . GLN A 1 26 ? 10.350  -4.805  3.585  1.00 1.59 ?  26 GLN A NE2  3  
ATOM   1585 H H    . GLN A 1 26 ? 7.103   -3.423  1.615  1.00 0.18 ?  26 GLN A H    3  
ATOM   1586 H HA   . GLN A 1 26 ? 7.203   -0.954  2.942  1.00 0.21 ?  26 GLN A HA   3  
ATOM   1587 H HB2  . GLN A 1 26 ? 9.405   -2.634  1.747  1.00 0.31 ?  26 GLN A HB2  3  
ATOM   1588 H HB3  . GLN A 1 26 ? 9.690   -1.223  2.752  1.00 0.31 ?  26 GLN A HB3  3  
ATOM   1589 H HG2  . GLN A 1 26 ? 8.633   -2.266  4.627  1.00 0.76 ?  26 GLN A HG2  3  
ATOM   1590 H HG3  . GLN A 1 26 ? 8.127   -3.634  3.638  1.00 0.60 ?  26 GLN A HG3  3  
ATOM   1591 H HE21 . GLN A 1 26 ? 9.630   -5.160  3.020  1.00 1.96 ?  26 GLN A HE21 3  
ATOM   1592 H HE22 . GLN A 1 26 ? 11.178  -5.295  3.782  1.00 1.99 ?  26 GLN A HE22 3  
ATOM   1593 N N    . ASN A 1 27 ? 8.208   -0.871  -0.198 1.00 0.19 ?  27 ASN A N    3  
ATOM   1594 C CA   . ASN A 1 27 ? 8.465   0.013   -1.333 1.00 0.26 ?  27 ASN A CA   3  
ATOM   1595 C C    . ASN A 1 27 ? 7.278   0.936   -1.590 1.00 0.22 ?  27 ASN A C    3  
ATOM   1596 O O    . ASN A 1 27 ? 7.436   2.154   -1.696 1.00 0.25 ?  27 ASN A O    3  
ATOM   1597 C CB   . ASN A 1 27 ? 8.769   -0.820  -2.585 1.00 0.38 ?  27 ASN A CB   3  
ATOM   1598 C CG   . ASN A 1 27 ? 9.060   0.026   -3.813 1.00 0.98 ?  27 ASN A CG   3  
ATOM   1599 O OD1  . ASN A 1 27 ? 9.558   1.148   -3.714 1.00 1.81 ?  27 ASN A OD1  3  
ATOM   1600 N ND2  . ASN A 1 27 ? 8.754   -0.512  -4.986 1.00 1.18 ?  27 ASN A ND2  3  
ATOM   1601 H H    . ASN A 1 27 ? 8.273   -1.843  -0.328 1.00 0.20 ?  27 ASN A H    3  
ATOM   1602 H HA   . ASN A 1 27 ? 9.326   0.615   -1.096 1.00 0.34 ?  27 ASN A HA   3  
ATOM   1603 H HB2  . ASN A 1 27 ? 9.630   -1.443  -2.392 1.00 0.77 ?  27 ASN A HB2  3  
ATOM   1604 H HB3  . ASN A 1 27 ? 7.920   -1.452  -2.796 1.00 0.92 ?  27 ASN A HB3  3  
ATOM   1605 H HD21 . ASN A 1 27 ? 8.363   -1.414  -4.996 1.00 1.16 ?  27 ASN A HD21 3  
ATOM   1606 H HD22 . ASN A 1 27 ? 8.935   0.011   -5.796 1.00 1.75 ?  27 ASN A HD22 3  
ATOM   1607 N N    . LEU A 1 28 ? 6.088   0.353   -1.658 1.00 0.19 ?  28 LEU A N    3  
ATOM   1608 C CA   . LEU A 1 28 ? 4.871   1.108   -1.925 1.00 0.24 ?  28 LEU A CA   3  
ATOM   1609 C C    . LEU A 1 28 ? 4.556   2.077   -0.790 1.00 0.24 ?  28 LEU A C    3  
ATOM   1610 O O    . LEU A 1 28 ? 4.261   3.246   -1.029 1.00 0.29 ?  28 LEU A O    3  
ATOM   1611 C CB   . LEU A 1 28 ? 3.689   0.160   -2.136 1.00 0.28 ?  28 LEU A CB   3  
ATOM   1612 C CG   . LEU A 1 28 ? 3.416   -0.267  -3.585 1.00 0.38 ?  28 LEU A CG   3  
ATOM   1613 C CD1  . LEU A 1 28 ? 4.632   -0.929  -4.209 1.00 0.88 ?  28 LEU A CD1  3  
ATOM   1614 C CD2  . LEU A 1 28 ? 2.221   -1.206  -3.640 1.00 0.72 ?  28 LEU A CD2  3  
ATOM   1615 H H    . LEU A 1 28 ? 6.025   -0.619  -1.521 1.00 0.18 ?  28 LEU A H    3  
ATOM   1616 H HA   . LEU A 1 28 ? 5.029   1.676   -2.828 1.00 0.30 ?  28 LEU A HA   3  
ATOM   1617 H HB2  . LEU A 1 28 ? 3.864   -0.729  -1.549 1.00 0.28 ?  28 LEU A HB2  3  
ATOM   1618 H HB3  . LEU A 1 28 ? 2.805   0.644   -1.759 1.00 0.33 ?  28 LEU A HB3  3  
ATOM   1619 H HG   . LEU A 1 28 ? 3.179   0.608   -4.168 1.00 0.78 ?  28 LEU A HG   3  
ATOM   1620 H HD11 . LEU A 1 28 ? 4.893   -1.810  -3.642 1.00 1.30 ?  28 LEU A HD11 3  
ATOM   1621 H HD12 . LEU A 1 28 ? 5.461   -0.239  -4.203 1.00 1.54 ?  28 LEU A HD12 3  
ATOM   1622 H HD13 . LEU A 1 28 ? 4.404   -1.211  -5.226 1.00 1.23 ?  28 LEU A HD13 3  
ATOM   1623 H HD21 . LEU A 1 28 ? 1.347   -0.700  -3.261 1.00 1.32 ?  28 LEU A HD21 3  
ATOM   1624 H HD22 . LEU A 1 28 ? 2.421   -2.080  -3.038 1.00 1.40 ?  28 LEU A HD22 3  
ATOM   1625 H HD23 . LEU A 1 28 ? 2.047   -1.507  -4.663 1.00 1.20 ?  28 LEU A HD23 3  
ATOM   1626 N N    . LYS A 1 29 ? 4.627   1.588   0.442  1.00 0.24 ?  29 LYS A N    3  
ATOM   1627 C CA   . LYS A 1 29 ? 4.299   2.403   1.607  1.00 0.32 ?  29 LYS A CA   3  
ATOM   1628 C C    . LYS A 1 29 ? 5.263   3.574   1.745  1.00 0.34 ?  29 LYS A C    3  
ATOM   1629 O O    . LYS A 1 29 ? 4.848   4.703   2.016  1.00 0.40 ?  29 LYS A O    3  
ATOM   1630 C CB   . LYS A 1 29 ? 4.317   1.556   2.884  1.00 0.42 ?  29 LYS A CB   3  
ATOM   1631 C CG   . LYS A 1 29 ? 3.979   2.343   4.141  1.00 0.71 ?  29 LYS A CG   3  
ATOM   1632 C CD   . LYS A 1 29 ? 2.525   2.797   4.162  1.00 1.19 ?  29 LYS A CD   3  
ATOM   1633 C CE   . LYS A 1 29 ? 1.572   1.649   4.469  1.00 1.23 ?  29 LYS A CE   3  
ATOM   1634 N NZ   . LYS A 1 29 ? 1.847   1.034   5.796  1.00 1.39 1  29 LYS A NZ   3  
ATOM   1635 H H    . LYS A 1 29 ? 4.907   0.654   0.574  1.00 0.22 ?  29 LYS A H    3  
ATOM   1636 H HA   . LYS A 1 29 ? 3.306   2.794   1.463  1.00 0.36 ?  29 LYS A HA   3  
ATOM   1637 H HB2  . LYS A 1 29 ? 3.598   0.759   2.781  1.00 0.78 ?  29 LYS A HB2  3  
ATOM   1638 H HB3  . LYS A 1 29 ? 5.303   1.131   3.005  1.00 0.60 ?  29 LYS A HB3  3  
ATOM   1639 H HG2  . LYS A 1 29 ? 4.157   1.717   4.998  1.00 1.23 ?  29 LYS A HG2  3  
ATOM   1640 H HG3  . LYS A 1 29 ? 4.618   3.211   4.189  1.00 1.29 ?  29 LYS A HG3  3  
ATOM   1641 H HD2  . LYS A 1 29 ? 2.410   3.558   4.919  1.00 1.64 ?  29 LYS A HD2  3  
ATOM   1642 H HD3  . LYS A 1 29 ? 2.277   3.210   3.196  1.00 1.75 ?  29 LYS A HD3  3  
ATOM   1643 H HE2  . LYS A 1 29 ? 0.561   2.028   4.463  1.00 1.53 ?  29 LYS A HE2  3  
ATOM   1644 H HE3  . LYS A 1 29 ? 1.674   0.895   3.705  1.00 1.48 ?  29 LYS A HE3  3  
ATOM   1645 H HZ1  . LYS A 1 29 ? 1.112   0.334   6.024  1.00 2.04 ?  29 LYS A HZ1  3  
ATOM   1646 H HZ2  . LYS A 1 29 ? 1.854   1.763   6.536  1.00 1.56 ?  29 LYS A HZ2  3  
ATOM   1647 H HZ3  . LYS A 1 29 ? 2.771   0.556   5.788  1.00 1.51 ?  29 LYS A HZ3  3  
ATOM   1648 N N    . LYS A 1 30 ? 6.544   3.307   1.548  1.00 0.34 ?  30 LYS A N    3  
ATOM   1649 C CA   . LYS A 1 30 ? 7.555   4.343   1.648  1.00 0.43 ?  30 LYS A CA   3  
ATOM   1650 C C    . LYS A 1 30 ? 7.421   5.337   0.504  1.00 0.42 ?  30 LYS A C    3  
ATOM   1651 O O    . LYS A 1 30 ? 7.593   6.537   0.696  1.00 0.47 ?  30 LYS A O    3  
ATOM   1652 C CB   . LYS A 1 30 ? 8.958   3.736   1.670  1.00 0.54 ?  30 LYS A CB   3  
ATOM   1653 C CG   . LYS A 1 30 ? 9.248   2.939   2.931  1.00 1.28 ?  30 LYS A CG   3  
ATOM   1654 C CD   . LYS A 1 30 ? 10.648  2.350   2.913  1.00 1.67 ?  30 LYS A CD   3  
ATOM   1655 C CE   . LYS A 1 30 ? 10.922  1.525   4.164  1.00 2.49 ?  30 LYS A CE   3  
ATOM   1656 N NZ   . LYS A 1 30 ? 12.279  0.918   4.143  1.00 3.14 1  30 LYS A NZ   3  
ATOM   1657 H H    . LYS A 1 30 ? 6.818   2.386   1.330  1.00 0.33 ?  30 LYS A H    3  
ATOM   1658 H HA   . LYS A 1 30 ? 7.389   4.865   2.577  1.00 0.48 ?  30 LYS A HA   3  
ATOM   1659 H HB2  . LYS A 1 30 ? 9.067   3.078   0.820  1.00 0.89 ?  30 LYS A HB2  3  
ATOM   1660 H HB3  . LYS A 1 30 ? 9.685   4.532   1.595  1.00 1.06 ?  30 LYS A HB3  3  
ATOM   1661 H HG2  . LYS A 1 30 ? 9.155   3.592   3.785  1.00 1.89 ?  30 LYS A HG2  3  
ATOM   1662 H HG3  . LYS A 1 30 ? 8.530   2.137   3.010  1.00 1.85 ?  30 LYS A HG3  3  
ATOM   1663 H HD2  . LYS A 1 30 ? 10.749  1.717   2.046  1.00 2.02 ?  30 LYS A HD2  3  
ATOM   1664 H HD3  . LYS A 1 30 ? 11.368  3.155   2.859  1.00 1.96 ?  30 LYS A HD3  3  
ATOM   1665 H HE2  . LYS A 1 30 ? 10.839  2.164   5.028  1.00 2.89 ?  30 LYS A HE2  3  
ATOM   1666 H HE3  . LYS A 1 30 ? 10.185  0.736   4.230  1.00 2.91 ?  30 LYS A HE3  3  
ATOM   1667 H HZ1  . LYS A 1 30 ? 12.382  0.301   3.313  1.00 3.57 ?  30 LYS A HZ1  3  
ATOM   1668 H HZ2  . LYS A 1 30 ? 12.432  0.352   5.002  1.00 3.62 ?  30 LYS A HZ2  3  
ATOM   1669 H HZ3  . LYS A 1 30 ? 13.004  1.662   4.098  1.00 3.29 ?  30 LYS A HZ3  3  
ATOM   1670 N N    . GLU A 1 31 ? 7.090   4.836   -0.678 1.00 0.42 ?  31 GLU A N    3  
ATOM   1671 C CA   . GLU A 1 31 ? 6.917   5.691   -1.843 1.00 0.49 ?  31 GLU A CA   3  
ATOM   1672 C C    . GLU A 1 31 ? 5.716   6.616   -1.656 1.00 0.52 ?  31 GLU A C    3  
ATOM   1673 O O    . GLU A 1 31 ? 5.777   7.805   -1.968 1.00 0.70 ?  31 GLU A O    3  
ATOM   1674 C CB   . GLU A 1 31 ? 6.724   4.840   -3.100 1.00 0.52 ?  31 GLU A CB   3  
ATOM   1675 C CG   . GLU A 1 31 ? 6.919   5.608   -4.394 1.00 0.87 ?  31 GLU A CG   3  
ATOM   1676 C CD   . GLU A 1 31 ? 8.353   6.058   -4.583 1.00 1.47 ?  31 GLU A CD   3  
ATOM   1677 O OE1  . GLU A 1 31 ? 9.147   5.291   -5.166 1.00 1.67 ?  31 GLU A OE1  3  
ATOM   1678 O OE2  . GLU A 1 31 ? 8.697   7.177   -4.152 1.00 2.30 -1 31 GLU A OE2  3  
ATOM   1679 H H    . GLU A 1 31 ? 6.972   3.863   -0.774 1.00 0.41 ?  31 GLU A H    3  
ATOM   1680 H HA   . GLU A 1 31 ? 7.808   6.289   -1.954 1.00 0.57 ?  31 GLU A HA   3  
ATOM   1681 H HB2  . GLU A 1 31 ? 7.432   4.026   -3.082 1.00 0.87 ?  31 GLU A HB2  3  
ATOM   1682 H HB3  . GLU A 1 31 ? 5.723   4.434   -3.096 1.00 0.80 ?  31 GLU A HB3  3  
ATOM   1683 H HG2  . GLU A 1 31 ? 6.645   4.975   -5.220 1.00 1.45 ?  31 GLU A HG2  3  
ATOM   1684 H HG3  . GLU A 1 31 ? 6.283   6.479   -4.382 1.00 1.49 ?  31 GLU A HG3  3  
ATOM   1685 N N    . LYS A 1 32 ? 4.634   6.062   -1.131 1.00 0.43 ?  32 LYS A N    3  
ATOM   1686 C CA   . LYS A 1 32 ? 3.384   6.797   -0.988 1.00 0.55 ?  32 LYS A CA   3  
ATOM   1687 C C    . LYS A 1 32 ? 3.355   7.664   0.270  1.00 0.66 ?  32 LYS A C    3  
ATOM   1688 O O    . LYS A 1 32 ? 3.239   8.885   0.185  1.00 1.23 ?  32 LYS A O    3  
ATOM   1689 C CB   . LYS A 1 32 ? 2.204   5.824   -0.962 1.00 0.74 ?  32 LYS A CB   3  
ATOM   1690 C CG   . LYS A 1 32 ? 1.958   5.122   -2.286 1.00 1.46 ?  32 LYS A CG   3  
ATOM   1691 C CD   . LYS A 1 32 ? 1.384   6.070   -3.325 1.00 2.20 ?  32 LYS A CD   3  
ATOM   1692 C CE   . LYS A 1 32 ? 1.016   5.337   -4.604 1.00 3.14 ?  32 LYS A CE   3  
ATOM   1693 N NZ   . LYS A 1 32 ? 0.281   6.210   -5.557 1.00 3.91 1  32 LYS A NZ   3  
ATOM   1694 H H    . LYS A 1 32 ? 4.673   5.122   -0.839 1.00 0.38 ?  32 LYS A H    3  
ATOM   1695 H HA   . LYS A 1 32 ? 3.281   7.438   -1.849 1.00 0.79 ?  32 LYS A HA   3  
ATOM   1696 H HB2  . LYS A 1 32 ? 2.391   5.072   -0.210 1.00 1.02 ?  32 LYS A HB2  3  
ATOM   1697 H HB3  . LYS A 1 32 ? 1.311   6.371   -0.698 1.00 1.25 ?  32 LYS A HB3  3  
ATOM   1698 H HG2  . LYS A 1 32 ? 2.895   4.732   -2.653 1.00 2.11 ?  32 LYS A HG2  3  
ATOM   1699 H HG3  . LYS A 1 32 ? 1.265   4.309   -2.129 1.00 1.77 ?  32 LYS A HG3  3  
ATOM   1700 H HD2  . LYS A 1 32 ? 0.498   6.538   -2.923 1.00 2.36 ?  32 LYS A HD2  3  
ATOM   1701 H HD3  . LYS A 1 32 ? 2.120   6.827   -3.554 1.00 2.67 ?  32 LYS A HD3  3  
ATOM   1702 H HE2  . LYS A 1 32 ? 1.922   4.989   -5.075 1.00 3.54 ?  32 LYS A HE2  3  
ATOM   1703 H HE3  . LYS A 1 32 ? 0.396   4.489   -4.351 1.00 3.37 ?  32 LYS A HE3  3  
ATOM   1704 H HZ1  . LYS A 1 32 ? 0.872   7.019   -5.833 1.00 3.96 ?  32 LYS A HZ1  3  
ATOM   1705 H HZ2  . LYS A 1 32 ? -0.590  6.567   -5.117 1.00 4.35 ?  32 LYS A HZ2  3  
ATOM   1706 H HZ3  . LYS A 1 32 ? 0.028   5.674   -6.411 1.00 4.36 ?  32 LYS A HZ3  3  
ATOM   1707 N N    . GLY A 1 33 ? 3.465   7.032   1.430  1.00 0.94 ?  33 GLY A N    3  
ATOM   1708 C CA   . GLY A 1 33 ? 3.224   7.735   2.677  1.00 1.34 ?  33 GLY A CA   3  
ATOM   1709 C C    . GLY A 1 33 ? 4.468   8.353   3.284  1.00 1.43 ?  33 GLY A C    3  
ATOM   1710 O O    . GLY A 1 33 ? 4.442   9.508   3.714  1.00 1.99 ?  33 GLY A O    3  
ATOM   1711 H H    . GLY A 1 33 ? 3.725   6.084   1.443  1.00 1.26 ?  33 GLY A H    3  
ATOM   1712 H HA2  . GLY A 1 33 ? 2.507   8.518   2.495  1.00 1.68 ?  33 GLY A HA2  3  
ATOM   1713 H HA3  . GLY A 1 33 ? 2.801   7.040   3.388  1.00 1.72 ?  33 GLY A HA3  3  
ATOM   1714 N N    . LEU A 1 34 ? 5.551   7.592   3.325  1.00 1.27 ?  34 LEU A N    3  
ATOM   1715 C CA   . LEU A 1 34 ? 6.766   8.032   4.001  1.00 1.73 ?  34 LEU A CA   3  
ATOM   1716 C C    . LEU A 1 34 ? 7.411   9.208   3.276  1.00 1.86 ?  34 LEU A C    3  
ATOM   1717 O O    . LEU A 1 34 ? 7.556   10.292  3.840  1.00 2.56 ?  34 LEU A O    3  
ATOM   1718 C CB   . LEU A 1 34 ? 7.764   6.878   4.112  1.00 1.91 ?  34 LEU A CB   3  
ATOM   1719 C CG   . LEU A 1 34 ? 9.033   7.188   4.908  1.00 2.29 ?  34 LEU A CG   3  
ATOM   1720 C CD1  . LEU A 1 34 ? 8.690   7.565   6.338  1.00 2.76 ?  34 LEU A CD1  3  
ATOM   1721 C CD2  . LEU A 1 34 ? 9.979   5.999   4.883  1.00 3.08 ?  34 LEU A CD2  3  
ATOM   1722 H H    . LEU A 1 34 ? 5.533   6.712   2.895  1.00 1.11 ?  34 LEU A H    3  
ATOM   1723 H HA   . LEU A 1 34 ? 6.490   8.349   4.992  1.00 2.15 ?  34 LEU A HA   3  
ATOM   1724 H HB2  . LEU A 1 34 ? 7.264   6.042   4.579  1.00 2.24 ?  34 LEU A HB2  3  
ATOM   1725 H HB3  . LEU A 1 34 ? 8.055   6.589   3.114  1.00 2.03 ?  34 LEU A HB3  3  
ATOM   1726 H HG   . LEU A 1 34 ? 9.539   8.027   4.453  1.00 2.45 ?  34 LEU A HG   3  
ATOM   1727 H HD11 . LEU A 1 34 ? 8.108   6.775   6.789  1.00 3.05 ?  34 LEU A HD11 3  
ATOM   1728 H HD12 . LEU A 1 34 ? 8.119   8.480   6.343  1.00 3.27 ?  34 LEU A HD12 3  
ATOM   1729 H HD13 . LEU A 1 34 ? 9.600   7.706   6.901  1.00 2.92 ?  34 LEU A HD13 3  
ATOM   1730 H HD21 . LEU A 1 34 ? 9.494   5.142   5.328  1.00 3.53 ?  34 LEU A HD21 3  
ATOM   1731 H HD22 . LEU A 1 34 ? 10.872  6.238   5.442  1.00 3.41 ?  34 LEU A HD22 3  
ATOM   1732 H HD23 . LEU A 1 34 ? 10.244  5.771   3.861  1.00 3.42 ?  34 LEU A HD23 3  
ATOM   1733 N N    . PHE A 1 35 ? 7.802   8.988   2.034  1.00 1.42 ?  35 PHE A N    3  
ATOM   1734 C CA   . PHE A 1 35 ? 8.452   10.020  1.246  1.00 1.78 ?  35 PHE A CA   3  
ATOM   1735 C C    . PHE A 1 35 ? 7.416   10.790  0.440  1.00 2.17 ?  35 PHE A C    3  
ATOM   1736 O O    . PHE A 1 35 ? 7.103   11.943  0.741  1.00 2.84 ?  35 PHE A O    3  
ATOM   1737 C CB   . PHE A 1 35 ? 9.504   9.409   0.315  1.00 1.55 ?  35 PHE A CB   3  
ATOM   1738 C CG   . PHE A 1 35 ? 10.575  8.634   1.034  1.00 1.48 ?  35 PHE A CG   3  
ATOM   1739 C CD1  . PHE A 1 35 ? 10.653  7.255   0.914  1.00 1.95 ?  35 PHE A CD1  3  
ATOM   1740 C CD2  . PHE A 1 35 ? 11.505  9.284   1.830  1.00 1.61 ?  35 PHE A CD2  3  
ATOM   1741 C CE1  . PHE A 1 35 ? 11.635  6.541   1.573  1.00 2.46 ?  35 PHE A CE1  3  
ATOM   1742 C CE2  . PHE A 1 35 ? 12.489  8.575   2.492  1.00 1.99 ?  35 PHE A CE2  3  
ATOM   1743 C CZ   . PHE A 1 35 ? 12.555  7.202   2.362  1.00 2.41 ?  35 PHE A CZ   3  
ATOM   1744 H H    . PHE A 1 35 ? 7.643   8.108   1.631  1.00 1.04 ?  35 PHE A H    3  
ATOM   1745 H HA   . PHE A 1 35 ? 8.935   10.702  1.927  1.00 2.31 ?  35 PHE A HA   3  
ATOM   1746 H HB2  . PHE A 1 35 ? 9.016   8.738   -0.376 1.00 1.53 ?  35 PHE A HB2  3  
ATOM   1747 H HB3  . PHE A 1 35 ? 9.984   10.201  -0.241 1.00 1.88 ?  35 PHE A HB3  3  
ATOM   1748 H HD1  . PHE A 1 35 ? 9.933   6.737   0.297  1.00 2.21 ?  35 PHE A HD1  3  
ATOM   1749 H HD2  . PHE A 1 35 ? 11.456  10.359  1.932  1.00 1.82 ?  35 PHE A HD2  3  
ATOM   1750 H HE1  . PHE A 1 35 ? 11.684  5.467   1.469  1.00 3.08 ?  35 PHE A HE1  3  
ATOM   1751 H HE2  . PHE A 1 35 ? 13.207  9.094   3.108  1.00 2.26 ?  35 PHE A HE2  3  
ATOM   1752 H HZ   . PHE A 1 35 ? 13.324  6.645   2.877  1.00 2.93 ?  35 PHE A HZ   3  
HETATM 1753 N N    . NH2 A 1 36 ? 6.874   10.150  -0.579 1.00 2.32 ?  36 NH2 A N    3  
HETATM 1754 H HN1  . NH2 A 1 36 ? 7.171   9.231   -0.761 1.00 2.41 ?  36 NH2 A HN1  3  
HETATM 1755 H HN2  . NH2 A 1 36 ? 6.195   10.615  -1.111 1.00 2.69 ?  36 NH2 A HN2  3  
ATOM   1756 N N    . LEU A 1 1  ? -6.842  6.693   7.547  1.00 1.11 ?  1  LEU A N    4  
ATOM   1757 C CA   . LEU A 1 1  ? -6.629  6.001   6.255  1.00 0.77 ?  1  LEU A CA   4  
ATOM   1758 C C    . LEU A 1 1  ? -7.679  4.913   6.058  1.00 0.62 ?  1  LEU A C    4  
ATOM   1759 O O    . LEU A 1 1  ? -7.448  3.745   6.367  1.00 0.66 ?  1  LEU A O    4  
ATOM   1760 C CB   . LEU A 1 1  ? -5.218  5.397   6.207  1.00 0.91 ?  1  LEU A CB   4  
ATOM   1761 C CG   . LEU A 1 1  ? -4.859  4.629   4.928  1.00 1.01 ?  1  LEU A CG   4  
ATOM   1762 C CD1  . LEU A 1 1  ? -4.895  5.543   3.715  1.00 1.23 ?  1  LEU A CD1  4  
ATOM   1763 C CD2  . LEU A 1 1  ? -3.488  3.986   5.067  1.00 1.78 ?  1  LEU A CD2  4  
ATOM   1764 H H1   . LEU A 1 1  ? -6.103  7.408   7.698  1.00 1.40 ?  1  LEU A H1   4  
ATOM   1765 H H2   . LEU A 1 1  ? -6.816  6.010   8.329  1.00 1.62 ?  1  LEU A H2   4  
ATOM   1766 H H3   . LEU A 1 1  ? -7.768  7.165   7.549  1.00 1.61 ?  1  LEU A H3   4  
ATOM   1767 H HA   . LEU A 1 1  ? -6.732  6.727   5.462  1.00 0.75 ?  1  LEU A HA   4  
ATOM   1768 H HB2  . LEU A 1 1  ? -4.506  6.200   6.327  1.00 1.23 ?  1  LEU A HB2  4  
ATOM   1769 H HB3  . LEU A 1 1  ? -5.114  4.722   7.043  1.00 1.43 ?  1  LEU A HB3  4  
ATOM   1770 H HG   . LEU A 1 1  ? -5.584  3.843   4.772  1.00 1.75 ?  1  LEU A HG   4  
ATOM   1771 H HD11 . LEU A 1 1  ? -5.881  5.973   3.616  1.00 1.48 ?  1  LEU A HD11 4  
ATOM   1772 H HD12 . LEU A 1 1  ? -4.661  4.973   2.827  1.00 1.80 ?  1  LEU A HD12 4  
ATOM   1773 H HD13 . LEU A 1 1  ? -4.167  6.331   3.836  1.00 1.91 ?  1  LEU A HD13 4  
ATOM   1774 H HD21 . LEU A 1 1  ? -3.235  3.473   4.152  1.00 2.17 ?  1  LEU A HD21 4  
ATOM   1775 H HD22 . LEU A 1 1  ? -3.503  3.279   5.884  1.00 2.45 ?  1  LEU A HD22 4  
ATOM   1776 H HD23 . LEU A 1 1  ? -2.751  4.751   5.266  1.00 2.19 ?  1  LEU A HD23 4  
ATOM   1777 N N    . SER A 1 2  ? -8.838  5.301   5.551  1.00 0.58 ?  2  SER A N    4  
ATOM   1778 C CA   . SER A 1 2  ? -9.912  4.353   5.317  1.00 0.59 ?  2  SER A CA   4  
ATOM   1779 C C    . SER A 1 2  ? -9.631  3.574   4.040  1.00 0.53 ?  2  SER A C    4  
ATOM   1780 O O    . SER A 1 2  ? -8.978  4.077   3.124  1.00 0.45 ?  2  SER A O    4  
ATOM   1781 C CB   . SER A 1 2  ? -11.254 5.083   5.222  1.00 0.72 ?  2  SER A CB   4  
ATOM   1782 O OG   . SER A 1 2  ? -12.337 4.171   5.271  1.00 1.28 ?  2  SER A OG   4  
ATOM   1783 H H    . SER A 1 2  ? -8.970  6.246   5.319  1.00 0.63 ?  2  SER A H    4  
ATOM   1784 H HA   . SER A 1 2  ? -9.938  3.667   6.149  1.00 0.67 ?  2  SER A HA   4  
ATOM   1785 H HB2  . SER A 1 2  ? -11.345 5.774   6.047  1.00 1.39 ?  2  SER A HB2  4  
ATOM   1786 H HB3  . SER A 1 2  ? -11.300 5.625   4.290  1.00 1.05 ?  2  SER A HB3  4  
ATOM   1787 H HG   . SER A 1 2  ? -12.826 4.203   4.430  1.00 1.66 ?  2  SER A HG   4  
ATOM   1788 N N    . ASP A 1 3  ? -10.135 2.340   4.000  1.00 0.61 ?  3  ASP A N    4  
ATOM   1789 C CA   . ASP A 1 3  ? -9.792  1.369   2.959  1.00 0.60 ?  3  ASP A CA   4  
ATOM   1790 C C    . ASP A 1 3  ? -10.089 1.885   1.560  1.00 0.49 ?  3  ASP A C    4  
ATOM   1791 O O    . ASP A 1 3  ? -9.492  1.419   0.587  1.00 0.40 ?  3  ASP A O    4  
ATOM   1792 C CB   . ASP A 1 3  ? -10.532 0.048   3.187  1.00 0.76 ?  3  ASP A CB   4  
ATOM   1793 C CG   . ASP A 1 3  ? -10.006 -0.730  4.378  1.00 1.42 ?  3  ASP A CG   4  
ATOM   1794 O OD1  . ASP A 1 3  ? -9.313  -0.128  5.223  1.00 1.93 ?  3  ASP A OD1  4  
ATOM   1795 O OD2  . ASP A 1 3  ? -10.289 -1.942  4.486  1.00 2.11 -1 3  ASP A OD2  4  
ATOM   1796 H H    . ASP A 1 3  ? -10.764 2.068   4.703  1.00 0.71 ?  3  ASP A H    4  
ATOM   1797 H HA   . ASP A 1 3  ? -8.733  1.181   3.032  1.00 0.62 ?  3  ASP A HA   4  
ATOM   1798 H HB2  . ASP A 1 3  ? -11.578 0.253   3.352  1.00 1.30 ?  3  ASP A HB2  4  
ATOM   1799 H HB3  . ASP A 1 3  ? -10.430 -0.566  2.305  1.00 1.20 ?  3  ASP A HB3  4  
ATOM   1800 N N    . GLU A 1 4  ? -11.015 2.830   1.456  1.00 0.58 ?  4  GLU A N    4  
ATOM   1801 C CA   . GLU A 1 4  ? -11.312 3.464   0.181  1.00 0.58 ?  4  GLU A CA   4  
ATOM   1802 C C    . GLU A 1 4  ? -10.097 4.248   -0.300 1.00 0.43 ?  4  GLU A C    4  
ATOM   1803 O O    . GLU A 1 4  ? -9.657  4.099   -1.439 1.00 0.38 ?  4  GLU A O    4  
ATOM   1804 C CB   . GLU A 1 4  ? -12.518 4.405   0.291  1.00 0.80 ?  4  GLU A CB   4  
ATOM   1805 C CG   . GLU A 1 4  ? -13.814 3.729   0.712  1.00 1.35 ?  4  GLU A CG   4  
ATOM   1806 C CD   . GLU A 1 4  ? -13.834 3.353   2.179  1.00 1.81 ?  4  GLU A CD   4  
ATOM   1807 O OE1  . GLU A 1 4  ? -13.675 4.249   3.030  1.00 2.46 ?  4  GLU A OE1  4  
ATOM   1808 O OE2  . GLU A 1 4  ? -14.020 2.160   2.489  1.00 2.08 -1 4  GLU A OE2  4  
ATOM   1809 H H    . GLU A 1 4  ? -11.512 3.101   2.256  1.00 0.68 ?  4  GLU A H    4  
ATOM   1810 H HA   . GLU A 1 4  ? -11.531 2.687   -0.536 1.00 0.59 ?  4  GLU A HA   4  
ATOM   1811 H HB2  . GLU A 1 4  ? -12.290 5.171   1.017  1.00 1.07 ?  4  GLU A HB2  4  
ATOM   1812 H HB3  . GLU A 1 4  ? -12.678 4.873   -0.669 1.00 1.03 ?  4  GLU A HB3  4  
ATOM   1813 H HG2  . GLU A 1 4  ? -14.636 4.401   0.520  1.00 1.90 ?  4  GLU A HG2  4  
ATOM   1814 H HG3  . GLU A 1 4  ? -13.941 2.831   0.125  1.00 1.77 ?  4  GLU A HG3  4  
ATOM   1815 N N    . ASP A 1 5  ? -9.533  5.051   0.595  1.00 0.44 ?  5  ASP A N    4  
ATOM   1816 C CA   . ASP A 1 5  ? -8.368  5.859   0.264  1.00 0.40 ?  5  ASP A CA   4  
ATOM   1817 C C    . ASP A 1 5  ? -7.142  4.969   0.178  1.00 0.28 ?  5  ASP A C    4  
ATOM   1818 O O    . ASP A 1 5  ? -6.224  5.238   -0.585 1.00 0.29 ?  5  ASP A O    4  
ATOM   1819 C CB   . ASP A 1 5  ? -8.152  6.966   1.299  1.00 0.52 ?  5  ASP A CB   4  
ATOM   1820 C CG   . ASP A 1 5  ? -6.982  7.873   0.955  1.00 1.11 ?  5  ASP A CG   4  
ATOM   1821 O OD1  . ASP A 1 5  ? -7.096  8.656   -0.008 1.00 1.17 ?  5  ASP A OD1  4  
ATOM   1822 O OD2  . ASP A 1 5  ? -5.933  7.792   1.634  1.00 1.82 -1 5  ASP A OD2  4  
ATOM   1823 H H    . ASP A 1 5  ? -9.890  5.080   1.511  1.00 0.51 ?  5  ASP A H    4  
ATOM   1824 H HA   . ASP A 1 5  ? -8.543  6.305   -0.703 1.00 0.43 ?  5  ASP A HA   4  
ATOM   1825 H HB2  . ASP A 1 5  ? -9.043  7.571   1.358  1.00 1.00 ?  5  ASP A HB2  4  
ATOM   1826 H HB3  . ASP A 1 5  ? -7.964  6.516   2.262  1.00 0.82 ?  5  ASP A HB3  4  
ATOM   1827 N N    . PHE A 1 6  ? -7.147  3.895   0.956  1.00 0.24 ?  6  PHE A N    4  
ATOM   1828 C CA   . PHE A 1 6  ? -6.094  2.896   0.885  1.00 0.18 ?  6  PHE A CA   4  
ATOM   1829 C C    . PHE A 1 6  ? -6.008  2.350   -0.536 1.00 0.13 ?  6  PHE A C    4  
ATOM   1830 O O    . PHE A 1 6  ? -4.934  2.318   -1.139 1.00 0.15 ?  6  PHE A O    4  
ATOM   1831 C CB   . PHE A 1 6  ? -6.373  1.760   1.877  1.00 0.23 ?  6  PHE A CB   4  
ATOM   1832 C CG   . PHE A 1 6  ? -5.218  0.818   2.078  1.00 0.25 ?  6  PHE A CG   4  
ATOM   1833 C CD1  . PHE A 1 6  ? -4.414  0.924   3.200  1.00 0.43 ?  6  PHE A CD1  4  
ATOM   1834 C CD2  . PHE A 1 6  ? -4.939  -0.173  1.152  1.00 0.25 ?  6  PHE A CD2  4  
ATOM   1835 C CE1  . PHE A 1 6  ? -3.351  0.063   3.394  1.00 0.50 ?  6  PHE A CE1  4  
ATOM   1836 C CE2  . PHE A 1 6  ? -3.879  -1.037  1.339  1.00 0.35 ?  6  PHE A CE2  4  
ATOM   1837 C CZ   . PHE A 1 6  ? -3.083  -0.919  2.462  1.00 0.43 ?  6  PHE A CZ   4  
ATOM   1838 H H    . PHE A 1 6  ? -7.878  3.778   1.602  1.00 0.29 ?  6  PHE A H    4  
ATOM   1839 H HA   . PHE A 1 6  ? -5.158  3.372   1.138  1.00 0.23 ?  6  PHE A HA   4  
ATOM   1840 H HB2  . PHE A 1 6  ? -6.622  2.186   2.837  1.00 0.31 ?  6  PHE A HB2  4  
ATOM   1841 H HB3  . PHE A 1 6  ? -7.212  1.184   1.519  1.00 0.27 ?  6  PHE A HB3  4  
ATOM   1842 H HD1  . PHE A 1 6  ? -4.623  1.691   3.928  1.00 0.55 ?  6  PHE A HD1  4  
ATOM   1843 H HD2  . PHE A 1 6  ? -5.560  -0.267  0.273  1.00 0.29 ?  6  PHE A HD2  4  
ATOM   1844 H HE1  . PHE A 1 6  ? -2.732  0.158   4.274  1.00 0.65 ?  6  PHE A HE1  4  
ATOM   1845 H HE2  . PHE A 1 6  ? -3.673  -1.803  0.609  1.00 0.43 ?  6  PHE A HE2  4  
ATOM   1846 H HZ   . PHE A 1 6  ? -2.253  -1.595  2.610  1.00 0.51 ?  6  PHE A HZ   4  
ATOM   1847 N N    . LYS A 1 7  ? -7.155  1.950   -1.076 1.00 0.13 ?  7  LYS A N    4  
ATOM   1848 C CA   . LYS A 1 7  ? -7.210  1.438   -2.436 1.00 0.15 ?  7  LYS A CA   4  
ATOM   1849 C C    . LYS A 1 7  ? -6.924  2.551   -3.441 1.00 0.19 ?  7  LYS A C    4  
ATOM   1850 O O    . LYS A 1 7  ? -6.337  2.310   -4.489 1.00 0.23 ?  7  LYS A O    4  
ATOM   1851 C CB   . LYS A 1 7  ? -8.572  0.799   -2.728 1.00 0.23 ?  7  LYS A CB   4  
ATOM   1852 C CG   . LYS A 1 7  ? -8.611  0.052   -4.056 1.00 0.30 ?  7  LYS A CG   4  
ATOM   1853 C CD   . LYS A 1 7  ? -9.937  -0.659  -4.301 1.00 0.44 ?  7  LYS A CD   4  
ATOM   1854 C CE   . LYS A 1 7  ? -11.036 0.289   -4.775 1.00 1.26 ?  7  LYS A CE   4  
ATOM   1855 N NZ   . LYS A 1 7  ? -11.590 1.125   -3.677 1.00 2.06 1  7  LYS A NZ   4  
ATOM   1856 H H    . LYS A 1 7  ? -7.980  1.990   -0.542 1.00 0.18 ?  7  LYS A H    4  
ATOM   1857 H HA   . LYS A 1 7  ? -6.442  0.685   -2.532 1.00 0.15 ?  7  LYS A HA   4  
ATOM   1858 H HB2  . LYS A 1 7  ? -8.809  0.102   -1.936 1.00 0.28 ?  7  LYS A HB2  4  
ATOM   1859 H HB3  . LYS A 1 7  ? -9.322  1.573   -2.751 1.00 0.25 ?  7  LYS A HB3  4  
ATOM   1860 H HG2  . LYS A 1 7  ? -8.444  0.758   -4.854 1.00 0.31 ?  7  LYS A HG2  4  
ATOM   1861 H HG3  . LYS A 1 7  ? -7.818  -0.681  -4.060 1.00 0.36 ?  7  LYS A HG3  4  
ATOM   1862 H HD2  . LYS A 1 7  ? -9.788  -1.418  -5.053 1.00 1.10 ?  7  LYS A HD2  4  
ATOM   1863 H HD3  . LYS A 1 7  ? -10.253 -1.126  -3.380 1.00 0.92 ?  7  LYS A HD3  4  
ATOM   1864 H HE2  . LYS A 1 7  ? -10.628 0.939   -5.533 1.00 1.83 ?  7  LYS A HE2  4  
ATOM   1865 H HE3  . LYS A 1 7  ? -11.835 -0.299  -5.203 1.00 1.84 ?  7  LYS A HE3  4  
ATOM   1866 H HZ1  . LYS A 1 7  ? -11.872 0.524   -2.876 1.00 2.69 ?  7  LYS A HZ1  4  
ATOM   1867 H HZ2  . LYS A 1 7  ? -12.428 1.641   -4.014 1.00 2.55 ?  7  LYS A HZ2  4  
ATOM   1868 H HZ3  . LYS A 1 7  ? -10.884 1.814   -3.356 1.00 2.30 ?  7  LYS A HZ3  4  
ATOM   1869 N N    . ALA A 1 8  ? -7.341  3.769   -3.119 1.00 0.22 ?  8  ALA A N    4  
ATOM   1870 C CA   . ALA A 1 8  ? -7.073  4.917   -3.978 1.00 0.30 ?  8  ALA A CA   4  
ATOM   1871 C C    . ALA A 1 8  ? -5.576  5.199   -4.079 1.00 0.35 ?  8  ALA A C    4  
ATOM   1872 O O    . ALA A 1 8  ? -5.074  5.583   -5.133 1.00 0.45 ?  8  ALA A O    4  
ATOM   1873 C CB   . ALA A 1 8  ? -7.804  6.147   -3.467 1.00 0.35 ?  8  ALA A CB   4  
ATOM   1874 H H    . ALA A 1 8  ? -7.858  3.898   -2.291 1.00 0.22 ?  8  ALA A H    4  
ATOM   1875 H HA   . ALA A 1 8  ? -7.451  4.687   -4.963 1.00 0.34 ?  8  ALA A HA   4  
ATOM   1876 H HB1  . ALA A 1 8  ? -7.384  6.444   -2.518 1.00 1.02 ?  8  ALA A HB1  4  
ATOM   1877 H HB2  . ALA A 1 8  ? -8.852  5.916   -3.341 1.00 1.02 ?  8  ALA A HB2  4  
ATOM   1878 H HB3  . ALA A 1 8  ? -7.695  6.953   -4.178 1.00 1.04 ?  8  ALA A HB3  4  
ATOM   1879 N N    . VAL A 1 9  ? -4.871  5.006   -2.973 1.00 0.31 ?  9  VAL A N    4  
ATOM   1880 C CA   . VAL A 1 9  ? -3.438  5.252   -2.923 1.00 0.39 ?  9  VAL A CA   4  
ATOM   1881 C C    . VAL A 1 9  ? -2.652  4.106   -3.549 1.00 0.38 ?  9  VAL A C    4  
ATOM   1882 O O    . VAL A 1 9  ? -1.874  4.306   -4.483 1.00 0.49 ?  9  VAL A O    4  
ATOM   1883 C CB   . VAL A 1 9  ? -2.953  5.452   -1.470 1.00 0.42 ?  9  VAL A CB   4  
ATOM   1884 C CG1  . VAL A 1 9  ? -1.436  5.551   -1.414 1.00 0.52 ?  9  VAL A CG1  4  
ATOM   1885 C CG2  . VAL A 1 9  ? -3.586  6.689   -0.856 1.00 0.50 ?  9  VAL A CG2  4  
ATOM   1886 H H    . VAL A 1 9  ? -5.332  4.701   -2.159 1.00 0.26 ?  9  VAL A H    4  
ATOM   1887 H HA   . VAL A 1 9  ? -3.236  6.158   -3.474 1.00 0.47 ?  9  VAL A HA   4  
ATOM   1888 H HB   . VAL A 1 9  ? -3.256  4.592   -0.888 1.00 0.37 ?  9  VAL A HB   4  
ATOM   1889 H HG11 . VAL A 1 9  ? -1.126  5.768   -0.403 1.00 0.97 ?  9  VAL A HG11 4  
ATOM   1890 H HG12 . VAL A 1 9  ? -1.102  6.338   -2.071 1.00 0.84 ?  9  VAL A HG12 4  
ATOM   1891 H HG13 . VAL A 1 9  ? -1.003  4.611   -1.728 1.00 1.18 ?  9  VAL A HG13 4  
ATOM   1892 H HG21 . VAL A 1 9  ? -3.284  7.562   -1.414 1.00 0.95 ?  9  VAL A HG21 4  
ATOM   1893 H HG22 . VAL A 1 9  ? -3.263  6.786   0.170  1.00 0.76 ?  9  VAL A HG22 4  
ATOM   1894 H HG23 . VAL A 1 9  ? -4.661  6.594   -0.888 1.00 0.91 ?  9  VAL A HG23 4  
ATOM   1895 N N    . PHE A 1 10 ? -2.870  2.907   -3.037 1.00 0.29 ?  10 PHE A N    4  
ATOM   1896 C CA   . PHE A 1 10 ? -2.050  1.762   -3.401 1.00 0.33 ?  10 PHE A CA   4  
ATOM   1897 C C    . PHE A 1 10 ? -2.571  1.053   -4.645 1.00 0.35 ?  10 PHE A C    4  
ATOM   1898 O O    . PHE A 1 10 ? -1.825  0.342   -5.321 1.00 0.45 ?  10 PHE A O    4  
ATOM   1899 C CB   . PHE A 1 10 ? -1.968  0.797   -2.220 1.00 0.32 ?  10 PHE A CB   4  
ATOM   1900 C CG   . PHE A 1 10 ? -1.300  1.403   -1.020 1.00 0.33 ?  10 PHE A CG   4  
ATOM   1901 C CD1  . PHE A 1 10 ? -2.045  1.866   0.054  1.00 0.39 ?  10 PHE A CD1  4  
ATOM   1902 C CD2  . PHE A 1 10 ? 0.078   1.520   -0.972 1.00 0.39 ?  10 PHE A CD2  4  
ATOM   1903 C CE1  . PHE A 1 10 ? -1.425  2.432   1.151  1.00 0.41 ?  10 PHE A CE1  4  
ATOM   1904 C CE2  . PHE A 1 10 ? 0.703   2.084   0.124  1.00 0.42 ?  10 PHE A CE2  4  
ATOM   1905 C CZ   . PHE A 1 10 ? -0.049  2.540   1.187  1.00 0.37 ?  10 PHE A CZ   4  
ATOM   1906 H H    . PHE A 1 10 ? -3.601  2.788   -2.390 1.00 0.22 ?  10 PHE A H    4  
ATOM   1907 H HA   . PHE A 1 10 ? -1.058  2.131   -3.610 1.00 0.39 ?  10 PHE A HA   4  
ATOM   1908 H HB2  . PHE A 1 10 ? -2.968  0.501   -1.934 1.00 0.30 ?  10 PHE A HB2  4  
ATOM   1909 H HB3  . PHE A 1 10 ? -1.407  -0.077  -2.514 1.00 0.37 ?  10 PHE A HB3  4  
ATOM   1910 H HD1  . PHE A 1 10 ? -3.121  1.781   0.028  1.00 0.48 ?  10 PHE A HD1  4  
ATOM   1911 H HD2  . PHE A 1 10 ? 0.665   1.165   -1.802 1.00 0.47 ?  10 PHE A HD2  4  
ATOM   1912 H HE1  . PHE A 1 10 ? -2.017  2.792   1.979  1.00 0.50 ?  10 PHE A HE1  4  
ATOM   1913 H HE2  . PHE A 1 10 ? 1.781   2.167   0.149  1.00 0.52 ?  10 PHE A HE2  4  
ATOM   1914 H HZ   . PHE A 1 10 ? 0.438   2.981   2.044  1.00 0.39 ?  10 PHE A HZ   4  
ATOM   1915 N N    . GLY A 1 11 ? -3.842  1.249   -4.951 1.00 0.28 ?  11 GLY A N    4  
ATOM   1916 C CA   . GLY A 1 11 ? -4.431  0.619   -6.114 1.00 0.31 ?  11 GLY A CA   4  
ATOM   1917 C C    . GLY A 1 11 ? -5.203  -0.630  -5.752 1.00 0.29 ?  11 GLY A C    4  
ATOM   1918 O O    . GLY A 1 11 ? -6.009  -1.129  -6.537 1.00 0.36 ?  11 GLY A O    4  
ATOM   1919 H H    . GLY A 1 11 ? -4.394  1.831   -4.383 1.00 0.24 ?  11 GLY A H    4  
ATOM   1920 H HA2  . GLY A 1 11 ? -5.101  1.318   -6.588 1.00 0.32 ?  11 GLY A HA2  4  
ATOM   1921 H HA3  . GLY A 1 11 ? -3.646  0.357   -6.807 1.00 0.35 ?  11 GLY A HA3  4  
HETATM 1922 N N    . NLE A 1 12 ? -4.963  -1.130  -4.553 1.00 0.24 ?  12 NLE A N    4  
HETATM 1923 C CA   . NLE A 1 12 ? -5.591  -2.354  -4.091 1.00 0.24 ?  12 NLE A CA   4  
HETATM 1924 C C    . NLE A 1 12 ? -5.902  -2.278  -2.605 1.00 0.21 ?  12 NLE A C    4  
HETATM 1925 O O    . NLE A 1 12 ? -5.444  -1.370  -1.910 1.00 0.22 ?  12 NLE A O    4  
HETATM 1926 C CB   . NLE A 1 12 ? -4.709  -3.572  -4.393 1.00 0.27 ?  12 NLE A CB   4  
HETATM 1927 C CG   . NLE A 1 12 ? -3.227  -3.264  -4.576 1.00 0.64 ?  12 NLE A CG   4  
HETATM 1928 C CD   . NLE A 1 12 ? -2.563  -2.805  -3.290 1.00 0.33 ?  12 NLE A CD   4  
HETATM 1929 C CE   . NLE A 1 12 ? -1.114  -2.475  -3.567 1.00 0.64 ?  12 NLE A CE   4  
HETATM 1930 H H    . NLE A 1 12 ? -4.353  -0.656  -3.953 1.00 0.26 ?  12 NLE A H    4  
HETATM 1931 H HA   . NLE A 1 12 ? -6.521  -2.463  -4.626 1.00 0.26 ?  12 NLE A HA   4  
HETATM 1932 H HB2  . NLE A 1 12 ? -5.069  -4.043  -5.295 1.00 0.51 ?  12 NLE A HB2  4  
HETATM 1933 H HB3  . NLE A 1 12 ? -4.801  -4.267  -3.578 1.00 0.31 ?  12 NLE A HB3  4  
HETATM 1934 H HG2  . NLE A 1 12 ? -3.124  -2.488  -5.320 1.00 1.24 ?  12 NLE A HG2  4  
HETATM 1935 H HG3  . NLE A 1 12 ? -2.729  -4.156  -4.917 1.00 1.24 ?  12 NLE A HG3  4  
HETATM 1936 H HD2  . NLE A 1 12 ? -2.607  -3.596  -2.555 1.00 0.70 ?  12 NLE A HD2  4  
HETATM 1937 H HD3  . NLE A 1 12 ? -3.060  -1.922  -2.919 1.00 0.43 ?  12 NLE A HD3  4  
HETATM 1938 H HE1  . NLE A 1 12 ? -1.059  -1.681  -4.296 1.00 1.10 ?  12 NLE A HE1  4  
HETATM 1939 H HE2  . NLE A 1 12 ? -0.614  -3.350  -3.953 1.00 1.19 ?  12 NLE A HE2  4  
HETATM 1940 H HE3  . NLE A 1 12 ? -0.634  -2.159  -2.656 1.00 1.26 ?  12 NLE A HE3  4  
ATOM   1941 N N    . THR A 1 13 ? -6.686  -3.232  -2.136 1.00 0.24 ?  13 THR A N    4  
ATOM   1942 C CA   . THR A 1 13 ? -7.126  -3.263  -0.755 1.00 0.27 ?  13 THR A CA   4  
ATOM   1943 C C    . THR A 1 13 ? -6.083  -3.901  0.152  1.00 0.24 ?  13 THR A C    4  
ATOM   1944 O O    . THR A 1 13 ? -5.151  -4.546  -0.337 1.00 0.23 ?  13 THR A O    4  
ATOM   1945 C CB   . THR A 1 13 ? -8.450  -4.030  -0.630 1.00 0.34 ?  13 THR A CB   4  
ATOM   1946 O OG1  . THR A 1 13 ? -8.349  -5.283  -1.325 1.00 0.36 ?  13 THR A OG1  4  
ATOM   1947 C CG2  . THR A 1 13 ? -9.602  -3.211  -1.196 1.00 0.43 ?  13 THR A CG2  4  
ATOM   1948 H H    . THR A 1 13 ? -6.981  -3.946  -2.741 1.00 0.27 ?  13 THR A H    4  
ATOM   1949 H HA   . THR A 1 13 ? -7.293  -2.247  -0.433 1.00 0.30 ?  13 THR A HA   4  
ATOM   1950 H HB   . THR A 1 13 ? -8.641  -4.223  0.414  1.00 0.34 ?  13 THR A HB   4  
ATOM   1951 H HG1  . THR A 1 13 ? -8.730  -5.194  -2.210 1.00 0.58 ?  13 THR A HG1  4  
ATOM   1952 H HG21 . THR A 1 13 ? -10.517 -3.780  -1.130 1.00 0.92 ?  13 THR A HG21 4  
ATOM   1953 H HG22 . THR A 1 13 ? -9.400  -2.971  -2.230 1.00 1.34 ?  13 THR A HG22 4  
ATOM   1954 H HG23 . THR A 1 13 ? -9.705  -2.297  -0.629 1.00 1.02 ?  13 THR A HG23 4  
ATOM   1955 N N    . ARG A 1 14 ? -6.250  -3.742  1.459  1.00 0.29 ?  14 ARG A N    4  
ATOM   1956 C CA   . ARG A 1 14 ? -5.261  -4.214  2.426  1.00 0.32 ?  14 ARG A CA   4  
ATOM   1957 C C    . ARG A 1 14 ? -4.941  -5.688  2.218  1.00 0.30 ?  14 ARG A C    4  
ATOM   1958 O O    . ARG A 1 14 ? -3.784  -6.094  2.316  1.00 0.31 ?  14 ARG A O    4  
ATOM   1959 C CB   . ARG A 1 14 ? -5.752  -3.989  3.853  1.00 0.42 ?  14 ARG A CB   4  
ATOM   1960 C CG   . ARG A 1 14 ? -6.003  -2.531  4.189  1.00 0.53 ?  14 ARG A CG   4  
ATOM   1961 C CD   . ARG A 1 14 ? -6.411  -2.362  5.641  1.00 0.77 ?  14 ARG A CD   4  
ATOM   1962 N NE   . ARG A 1 14 ? -6.890  -1.013  5.919  1.00 1.30 ?  14 ARG A NE   4  
ATOM   1963 C CZ   . ARG A 1 14 ? -6.257  -0.132  6.687  1.00 1.88 ?  14 ARG A CZ   4  
ATOM   1964 N NH1  . ARG A 1 14 ? -5.075  -0.422  7.216  1.00 2.02 1  14 ARG A NH1  4  
ATOM   1965 N NH2  . ARG A 1 14 ? -6.805  1.051   6.912  1.00 2.82 ?  14 ARG A NH2  4  
ATOM   1966 H H    . ARG A 1 14 ? -7.065  -3.302  1.788  1.00 0.32 ?  14 ARG A H    4  
ATOM   1967 H HA   . ARG A 1 14 ? -4.357  -3.640  2.274  1.00 0.34 ?  14 ARG A HA   4  
ATOM   1968 H HB2  . ARG A 1 14 ? -6.674  -4.533  3.994  1.00 0.43 ?  14 ARG A HB2  4  
ATOM   1969 H HB3  . ARG A 1 14 ? -5.012  -4.371  4.536  1.00 0.46 ?  14 ARG A HB3  4  
ATOM   1970 H HG2  . ARG A 1 14 ? -5.095  -1.969  4.013  1.00 0.58 ?  14 ARG A HG2  4  
ATOM   1971 H HG3  . ARG A 1 14 ? -6.792  -2.155  3.555  1.00 0.53 ?  14 ARG A HG3  4  
ATOM   1972 H HD2  . ARG A 1 14 ? -7.200  -3.064  5.863  1.00 1.48 ?  14 ARG A HD2  4  
ATOM   1973 H HD3  . ARG A 1 14 ? -5.559  -2.569  6.270  1.00 1.15 ?  14 ARG A HD3  4  
ATOM   1974 H HE   . ARG A 1 14 ? -7.762  -0.756  5.522  1.00 1.80 ?  14 ARG A HE   4  
ATOM   1975 H HH11 . ARG A 1 14 ? -4.603  0.250   7.793  1.00 2.60 ?  14 ARG A HH11 4  
ATOM   1976 H HH12 . ARG A 1 14 ? -4.645  -1.310  7.041  1.00 1.94 ?  14 ARG A HH12 4  
ATOM   1977 H HH21 . ARG A 1 14 ? -7.696  1.279   6.507  1.00 3.23 ?  14 ARG A HH21 4  
ATOM   1978 H HH22 . ARG A 1 14 ? -6.339  1.723   7.491  1.00 3.30 ?  14 ARG A HH22 4  
HETATM 1979 N N    . AIB A 1 15 ? -5.974  -6.473  1.905  1.00 0.31 ?  15 AIB A N    4  
HETATM 1980 C CA   . AIB A 1 15 ? -5.823  -7.908  1.638  1.00 0.33 ?  15 AIB A CA   4  
HETATM 1981 C C    . AIB A 1 15 ? -4.774  -8.115  0.540  1.00 0.30 ?  15 AIB A C    4  
HETATM 1982 O O    . AIB A 1 15 ? -3.833  -8.901  0.692  1.00 0.30 ?  15 AIB A O    4  
HETATM 1983 C CB1  . AIB A 1 15 ? -7.150  -8.477  1.181  1.00 0.37 ?  15 AIB A CB1  4  
HETATM 1984 C CB2  . AIB A 1 15 ? -5.423  -8.639  2.906  1.00 0.37 ?  15 AIB A CB2  4  
HETATM 1985 H H    . AIB A 1 15 ? -6.868  -6.073  1.852  1.00 0.31 ?  15 AIB A H    4  
HETATM 1986 H HB11 . AIB A 1 15 ? -7.892  -8.327  1.952  1.00 1.00 ?  15 AIB A HB11 4  
HETATM 1987 H HB12 . AIB A 1 15 ? -7.041  -9.534  0.987  1.00 1.13 ?  15 AIB A HB12 4  
HETATM 1988 H HB13 . AIB A 1 15 ? -7.465  -7.976  0.277  1.00 1.02 ?  15 AIB A HB13 4  
HETATM 1989 H HB21 . AIB A 1 15 ? -4.462  -8.278  3.241  1.00 1.07 ?  15 AIB A HB21 4  
HETATM 1990 H HB22 . AIB A 1 15 ? -5.361  -9.698  2.706  1.00 1.16 ?  15 AIB A HB22 4  
HETATM 1991 H HB23 . AIB A 1 15 ? -6.162  -8.460  3.672  1.00 1.01 ?  15 AIB A HB23 4  
ATOM   1992 N N    . ALA A 1 16 ? -4.919  -7.369  -0.549 1.00 0.27 ?  16 ALA A N    4  
ATOM   1993 C CA   . ALA A 1 16 ? -4.045  -7.524  -1.698 1.00 0.26 ?  16 ALA A CA   4  
ATOM   1994 C C    . ALA A 1 16 ? -2.677  -6.927  -1.406 1.00 0.23 ?  16 ALA A C    4  
ATOM   1995 O O    . ALA A 1 16 ? -1.661  -7.402  -1.904 1.00 0.25 ?  16 ALA A O    4  
ATOM   1996 C CB   . ALA A 1 16 ? -4.667  -6.880  -2.924 1.00 0.28 ?  16 ALA A CB   4  
ATOM   1997 H H    . ALA A 1 16 ? -5.614  -6.671  -0.565 1.00 0.27 ?  16 ALA A H    4  
ATOM   1998 H HA   . ALA A 1 16 ? -3.935  -8.581  -1.890 1.00 0.29 ?  16 ALA A HA   4  
ATOM   1999 H HB1  . ALA A 1 16 ? -5.558  -7.420  -3.204 1.00 0.90 ?  16 ALA A HB1  4  
ATOM   2000 H HB2  . ALA A 1 16 ? -3.959  -6.899  -3.740 1.00 0.96 ?  16 ALA A HB2  4  
ATOM   2001 H HB3  . ALA A 1 16 ? -4.925  -5.859  -2.695 1.00 0.89 ?  16 ALA A HB3  4  
ATOM   2002 N N    . PHE A 1 17 ? -2.666  -5.889  -0.580 1.00 0.20 ?  17 PHE A N    4  
ATOM   2003 C CA   . PHE A 1 17 ? -1.429  -5.260  -0.147 1.00 0.19 ?  17 PHE A CA   4  
ATOM   2004 C C    . PHE A 1 17 ? -0.586  -6.255  0.647  1.00 0.20 ?  17 PHE A C    4  
ATOM   2005 O O    . PHE A 1 17 ? 0.582   -6.480  0.345  1.00 0.20 ?  17 PHE A O    4  
ATOM   2006 C CB   . PHE A 1 17 ? -1.754  -4.032  0.707  1.00 0.22 ?  17 PHE A CB   4  
ATOM   2007 C CG   . PHE A 1 17 ? -0.556  -3.223  1.109  1.00 0.24 ?  17 PHE A CG   4  
ATOM   2008 C CD1  . PHE A 1 17 ? -0.053  -2.237  0.276  1.00 0.28 ?  17 PHE A CD1  4  
ATOM   2009 C CD2  . PHE A 1 17 ? 0.071   -3.456  2.317  1.00 0.28 ?  17 PHE A CD2  4  
ATOM   2010 C CE1  . PHE A 1 17 ? 1.055   -1.500  0.648  1.00 0.33 ?  17 PHE A CE1  4  
ATOM   2011 C CE2  . PHE A 1 17 ? 1.177   -2.724  2.693  1.00 0.32 ?  17 PHE A CE2  4  
ATOM   2012 C CZ   . PHE A 1 17 ? 1.651   -1.707  1.842  1.00 0.33 ?  17 PHE A CZ   4  
ATOM   2013 H H    . PHE A 1 17 ? -3.521  -5.530  -0.253 1.00 0.21 ?  17 PHE A H    4  
ATOM   2014 H HA   . PHE A 1 17 ? -0.882  -4.949  -1.022 1.00 0.19 ?  17 PHE A HA   4  
ATOM   2015 H HB2  . PHE A 1 17 ? -2.414  -3.387  0.149  1.00 0.22 ?  17 PHE A HB2  4  
ATOM   2016 H HB3  . PHE A 1 17 ? -2.255  -4.354  1.607  1.00 0.24 ?  17 PHE A HB3  4  
ATOM   2017 H HD1  . PHE A 1 17 ? -0.536  -2.045  -0.671 1.00 0.30 ?  17 PHE A HD1  4  
ATOM   2018 H HD2  . PHE A 1 17 ? -0.312  -4.224  2.970  1.00 0.30 ?  17 PHE A HD2  4  
ATOM   2019 H HE1  . PHE A 1 17 ? 1.439   -0.733  -0.007 1.00 0.38 ?  17 PHE A HE1  4  
ATOM   2020 H HE2  . PHE A 1 17 ? 1.654   -2.915  3.641  1.00 0.36 ?  17 PHE A HE2  4  
ATOM   2021 H HZ   . PHE A 1 17 ? 2.510   -1.119  2.124  1.00 0.37 ?  17 PHE A HZ   4  
ATOM   2022 N N    . ALA A 1 18 ? -1.207  -6.874  1.642  1.00 0.23 ?  18 ALA A N    4  
ATOM   2023 C CA   . ALA A 1 18 ? -0.527  -7.841  2.491  1.00 0.25 ?  18 ALA A CA   4  
ATOM   2024 C C    . ALA A 1 18 ? -0.253  -9.137  1.734  1.00 0.23 ?  18 ALA A C    4  
ATOM   2025 O O    . ALA A 1 18 ? 0.591   -9.937  2.137  1.00 0.23 ?  18 ALA A O    4  
ATOM   2026 C CB   . ALA A 1 18 ? -1.345  -8.115  3.743  1.00 0.30 ?  18 ALA A CB   4  
ATOM   2027 H H    . ALA A 1 18 ? -2.152  -6.673  1.813  1.00 0.25 ?  18 ALA A H    4  
ATOM   2028 H HA   . ALA A 1 18 ? 0.415   -7.410  2.794  1.00 0.27 ?  18 ALA A HA   4  
ATOM   2029 H HB1  . ALA A 1 18 ? -2.274  -8.591  3.471  1.00 1.06 ?  18 ALA A HB1  4  
ATOM   2030 H HB2  . ALA A 1 18 ? -1.552  -7.182  4.246  1.00 0.87 ?  18 ALA A HB2  4  
ATOM   2031 H HB3  . ALA A 1 18 ? -0.787  -8.762  4.403  1.00 0.99 ?  18 ALA A HB3  4  
ATOM   2032 N N    . ASN A 1 19 ? -0.985  -9.344  0.644  1.00 0.24 ?  19 ASN A N    4  
ATOM   2033 C CA   . ASN A 1 19 ? -0.732  -10.470 -0.251 1.00 0.24 ?  19 ASN A CA   4  
ATOM   2034 C C    . ASN A 1 19 ? 0.556   -10.237 -1.038 1.00 0.19 ?  19 ASN A C    4  
ATOM   2035 O O    . ASN A 1 19 ? 1.144   -11.167 -1.596 1.00 0.22 ?  19 ASN A O    4  
ATOM   2036 C CB   . ASN A 1 19 ? -1.907  -10.653 -1.214 1.00 0.31 ?  19 ASN A CB   4  
ATOM   2037 C CG   . ASN A 1 19 ? -1.778  -11.895 -2.079 1.00 0.36 ?  19 ASN A CG   4  
ATOM   2038 O OD1  . ASN A 1 19 ? -1.238  -12.916 -1.652 1.00 1.14 ?  19 ASN A OD1  4  
ATOM   2039 N ND2  . ASN A 1 19 ? -2.264  -11.814 -3.307 1.00 1.08 ?  19 ASN A ND2  4  
ATOM   2040 H H    . ASN A 1 19 ? -1.732  -8.735  0.448  1.00 0.25 ?  19 ASN A H    4  
ATOM   2041 H HA   . ASN A 1 19 ? -0.623  -11.357 0.351  1.00 0.27 ?  19 ASN A HA   4  
ATOM   2042 H HB2  . ASN A 1 19 ? -2.822  -10.731 -0.645 1.00 0.38 ?  19 ASN A HB2  4  
ATOM   2043 H HB3  . ASN A 1 19 ? -1.965  -9.791  -1.860 1.00 0.32 ?  19 ASN A HB3  4  
ATOM   2044 H HD21 . ASN A 1 19 ? -2.675  -10.967 -3.591 1.00 1.83 ?  19 ASN A HD21 4  
ATOM   2045 H HD22 . ASN A 1 19 ? -2.193  -12.602 -3.886 1.00 1.08 ?  19 ASN A HD22 4  
ATOM   2046 N N    . LEU A 1 20 ? 0.996   -8.985  -1.081 1.00 0.17 ?  20 LEU A N    4  
ATOM   2047 C CA   . LEU A 1 20 ? 2.233   -8.638  -1.754 1.00 0.17 ?  20 LEU A CA   4  
ATOM   2048 C C    . LEU A 1 20 ? 3.421   -8.935  -0.851 1.00 0.17 ?  20 LEU A C    4  
ATOM   2049 O O    . LEU A 1 20 ? 3.274   -9.032  0.368  1.00 0.18 ?  20 LEU A O    4  
ATOM   2050 C CB   . LEU A 1 20 ? 2.226   -7.160  -2.145 1.00 0.20 ?  20 LEU A CB   4  
ATOM   2051 C CG   . LEU A 1 20 ? 1.209   -6.781  -3.220 1.00 0.29 ?  20 LEU A CG   4  
ATOM   2052 C CD1  . LEU A 1 20 ? 1.196   -5.280  -3.432 1.00 0.32 ?  20 LEU A CD1  4  
ATOM   2053 C CD2  . LEU A 1 20 ? 1.522   -7.493  -4.527 1.00 0.41 ?  20 LEU A CD2  4  
ATOM   2054 H H    . LEU A 1 20 ? 0.476   -8.275  -0.641 1.00 0.19 ?  20 LEU A H    4  
ATOM   2055 H HA   . LEU A 1 20 ? 2.307   -9.240  -2.644 1.00 0.22 ?  20 LEU A HA   4  
ATOM   2056 H HB2  . LEU A 1 20 ? 2.021   -6.577  -1.259 1.00 0.19 ?  20 LEU A HB2  4  
ATOM   2057 H HB3  . LEU A 1 20 ? 3.209   -6.902  -2.503 1.00 0.24 ?  20 LEU A HB3  4  
ATOM   2058 H HG   . LEU A 1 20 ? 0.224   -7.084  -2.899 1.00 0.33 ?  20 LEU A HG   4  
ATOM   2059 H HD11 . LEU A 1 20 ? 0.900   -4.789  -2.514 1.00 1.04 ?  20 LEU A HD11 4  
ATOM   2060 H HD12 . LEU A 1 20 ? 0.495   -5.035  -4.215 1.00 1.05 ?  20 LEU A HD12 4  
ATOM   2061 H HD13 . LEU A 1 20 ? 2.184   -4.947  -3.715 1.00 1.10 ?  20 LEU A HD13 4  
ATOM   2062 H HD21 . LEU A 1 20 ? 1.445   -8.560  -4.384 1.00 1.10 ?  20 LEU A HD21 4  
ATOM   2063 H HD22 . LEU A 1 20 ? 2.527   -7.245  -4.838 1.00 0.88 ?  20 LEU A HD22 4  
ATOM   2064 H HD23 . LEU A 1 20 ? 0.822   -7.178  -5.285 1.00 1.17 ?  20 LEU A HD23 4  
ATOM   2065 N N    . PRO A 1 21 ? 4.615   -9.104  -1.434 1.00 0.23 ?  21 PRO A N    4  
ATOM   2066 C CA   . PRO A 1 21 ? 5.832   -9.368  -0.667 1.00 0.29 ?  21 PRO A CA   4  
ATOM   2067 C C    . PRO A 1 21 ? 6.215   -8.194  0.229  1.00 0.26 ?  21 PRO A C    4  
ATOM   2068 O O    . PRO A 1 21 ? 5.925   -7.041  -0.107 1.00 0.22 ?  21 PRO A O    4  
ATOM   2069 C CB   . PRO A 1 21 ? 6.907   -9.589  -1.735 1.00 0.38 ?  21 PRO A CB   4  
ATOM   2070 C CG   . PRO A 1 21 ? 6.167   -9.817  -3.009 1.00 0.43 ?  21 PRO A CG   4  
ATOM   2071 C CD   . PRO A 1 21 ? 4.876   -9.066  -2.881 1.00 0.30 ?  21 PRO A CD   4  
ATOM   2072 H HA   . PRO A 1 21 ? 5.732   -10.257 -0.065 1.00 0.32 ?  21 PRO A HA   4  
ATOM   2073 H HB2  . PRO A 1 21 ? 7.538   -8.712  -1.798 1.00 0.43 ?  21 PRO A HB2  4  
ATOM   2074 H HB3  . PRO A 1 21 ? 7.505   -10.447 -1.469 1.00 0.48 ?  21 PRO A HB3  4  
ATOM   2075 H HG2  . PRO A 1 21 ? 6.741   -9.434  -3.841 1.00 0.63 ?  21 PRO A HG2  4  
ATOM   2076 H HG3  . PRO A 1 21 ? 5.975   -10.873 -3.137 1.00 0.61 ?  21 PRO A HG3  4  
ATOM   2077 H HD2  . PRO A 1 21 ? 4.995   -8.050  -3.226 1.00 0.40 ?  21 PRO A HD2  4  
ATOM   2078 H HD3  . PRO A 1 21 ? 4.090   -9.562  -3.431 1.00 0.39 ?  21 PRO A HD3  4  
ATOM   2079 N N    . LEU A 1 22 ? 6.858   -8.478  1.353  1.00 0.30 ?  22 LEU A N    4  
ATOM   2080 C CA   . LEU A 1 22 ? 7.190   -7.445  2.334  1.00 0.31 ?  22 LEU A CA   4  
ATOM   2081 C C    . LEU A 1 22 ? 7.905   -6.260  1.691  1.00 0.28 ?  22 LEU A C    4  
ATOM   2082 O O    . LEU A 1 22 ? 7.542   -5.107  1.931  1.00 0.28 ?  22 LEU A O    4  
ATOM   2083 C CB   . LEU A 1 22 ? 8.047   -8.026  3.459  1.00 0.41 ?  22 LEU A CB   4  
ATOM   2084 C CG   . LEU A 1 22 ? 7.320   -8.973  4.415  1.00 1.07 ?  22 LEU A CG   4  
ATOM   2085 C CD1  . LEU A 1 22 ? 8.296   -9.554  5.422  1.00 1.64 ?  22 LEU A CD1  4  
ATOM   2086 C CD2  . LEU A 1 22 ? 6.188   -8.246  5.130  1.00 1.54 ?  22 LEU A CD2  4  
ATOM   2087 H H    . LEU A 1 22 ? 7.123   -9.408  1.529  1.00 0.34 ?  22 LEU A H    4  
ATOM   2088 H HA   . LEU A 1 22 ? 6.262   -7.090  2.755  1.00 0.30 ?  22 LEU A HA   4  
ATOM   2089 H HB2  . LEU A 1 22 ? 8.870   -8.565  3.011  1.00 1.00 ?  22 LEU A HB2  4  
ATOM   2090 H HB3  . LEU A 1 22 ? 8.449   -7.206  4.036  1.00 0.94 ?  22 LEU A HB3  4  
ATOM   2091 H HG   . LEU A 1 22 ? 6.893   -9.790  3.853  1.00 1.97 ?  22 LEU A HG   4  
ATOM   2092 H HD11 . LEU A 1 22 ? 7.769   -10.217 6.092  1.00 2.16 ?  22 LEU A HD11 4  
ATOM   2093 H HD12 . LEU A 1 22 ? 8.746   -8.752  5.989  1.00 1.77 ?  22 LEU A HD12 4  
ATOM   2094 H HD13 . LEU A 1 22 ? 9.065   -10.103 4.901  1.00 2.26 ?  22 LEU A HD13 4  
ATOM   2095 H HD21 . LEU A 1 22 ? 6.571   -7.341  5.580  1.00 2.09 ?  22 LEU A HD21 4  
ATOM   2096 H HD22 . LEU A 1 22 ? 5.782   -8.886  5.900  1.00 1.81 ?  22 LEU A HD22 4  
ATOM   2097 H HD23 . LEU A 1 22 ? 5.412   -7.999  4.422  1.00 2.05 ?  22 LEU A HD23 4  
ATOM   2098 N N    . TRP A 1 23 ? 8.896   -6.549  0.851  1.00 0.33 ?  23 TRP A N    4  
ATOM   2099 C CA   . TRP A 1 23 ? 9.670   -5.500  0.197  1.00 0.34 ?  23 TRP A CA   4  
ATOM   2100 C C    . TRP A 1 23 ? 8.776   -4.630  -0.689 1.00 0.27 ?  23 TRP A C    4  
ATOM   2101 O O    . TRP A 1 23 ? 9.008   -3.427  -0.834 1.00 0.25 ?  23 TRP A O    4  
ATOM   2102 C CB   . TRP A 1 23 ? 10.824  -6.102  -0.621 1.00 0.42 ?  23 TRP A CB   4  
ATOM   2103 C CG   . TRP A 1 23 ? 10.395  -7.015  -1.733 1.00 0.48 ?  23 TRP A CG   4  
ATOM   2104 C CD1  . TRP A 1 23 ? 10.255  -8.369  -1.674 1.00 0.56 ?  23 TRP A CD1  4  
ATOM   2105 C CD2  . TRP A 1 23 ? 10.063  -6.637  -3.073 1.00 0.51 ?  23 TRP A CD2  4  
ATOM   2106 N NE1  . TRP A 1 23 ? 9.857   -8.858  -2.895 1.00 0.62 ?  23 TRP A NE1  4  
ATOM   2107 C CE2  . TRP A 1 23 ? 9.727   -7.811  -3.769 1.00 0.60 ?  23 TRP A CE2  4  
ATOM   2108 C CE3  . TRP A 1 23 ? 10.014  -5.417  -3.747 1.00 0.49 ?  23 TRP A CE3  4  
ATOM   2109 C CZ2  . TRP A 1 23 ? 9.348   -7.800  -5.109 1.00 0.68 ?  23 TRP A CZ2  4  
ATOM   2110 C CZ3  . TRP A 1 23 ? 9.637   -5.405  -5.074 1.00 0.59 ?  23 TRP A CZ3  4  
ATOM   2111 C CH2  . TRP A 1 23 ? 9.308   -6.589  -5.744 1.00 0.68 ?  23 TRP A CH2  4  
ATOM   2112 H H    . TRP A 1 23 ? 9.111   -7.488  0.669  1.00 0.37 ?  23 TRP A H    4  
ATOM   2113 H HA   . TRP A 1 23 ? 10.086  -4.876  0.974  1.00 0.35 ?  23 TRP A HA   4  
ATOM   2114 H HB2  . TRP A 1 23 ? 11.394  -5.300  -1.061 1.00 0.42 ?  23 TRP A HB2  4  
ATOM   2115 H HB3  . TRP A 1 23 ? 11.466  -6.664  0.041  1.00 0.48 ?  23 TRP A HB3  4  
ATOM   2116 H HD1  . TRP A 1 23 ? 10.438  -8.959  -0.792 1.00 0.59 ?  23 TRP A HD1  4  
ATOM   2117 H HE1  . TRP A 1 23 ? 9.686   -9.806  -3.106 1.00 0.69 ?  23 TRP A HE1  4  
ATOM   2118 H HE3  . TRP A 1 23 ? 10.264  -4.494  -3.246 1.00 0.44 ?  23 TRP A HE3  4  
ATOM   2119 H HZ2  . TRP A 1 23 ? 9.089   -8.705  -5.637 1.00 0.76 ?  23 TRP A HZ2  4  
ATOM   2120 H HZ3  . TRP A 1 23 ? 9.595   -4.470  -5.610 1.00 0.61 ?  23 TRP A HZ3  4  
ATOM   2121 H HH2  . TRP A 1 23 ? 9.020   -6.531  -6.782 1.00 0.76 ?  23 TRP A HH2  4  
ATOM   2122 N N    . LYS A 1 24 ? 7.737   -5.239  -1.251 1.00 0.24 ?  24 LYS A N    4  
ATOM   2123 C CA   . LYS A 1 24 ? 6.809   -4.525  -2.111 1.00 0.22 ?  24 LYS A CA   4  
ATOM   2124 C C    . LYS A 1 24 ? 5.947   -3.606  -1.263 1.00 0.14 ?  24 LYS A C    4  
ATOM   2125 O O    . LYS A 1 24 ? 5.772   -2.432  -1.585 1.00 0.15 ?  24 LYS A O    4  
ATOM   2126 C CB   . LYS A 1 24 ? 5.930   -5.509  -2.892 1.00 0.26 ?  24 LYS A CB   4  
ATOM   2127 C CG   . LYS A 1 24 ? 4.959   -4.847  -3.859 1.00 0.35 ?  24 LYS A CG   4  
ATOM   2128 C CD   . LYS A 1 24 ? 5.683   -4.190  -5.023 1.00 0.97 ?  24 LYS A CD   4  
ATOM   2129 C CE   . LYS A 1 24 ? 4.705   -3.586  -6.019 1.00 0.98 ?  24 LYS A CE   4  
ATOM   2130 N NZ   . LYS A 1 24 ? 5.398   -3.006  -7.199 1.00 1.37 1  24 LYS A NZ   4  
ATOM   2131 H H    . LYS A 1 24 ? 7.575   -6.190  -1.059 1.00 0.26 ?  24 LYS A H    4  
ATOM   2132 H HA   . LYS A 1 24 ? 7.384   -3.929  -2.805 1.00 0.25 ?  24 LYS A HA   4  
ATOM   2133 H HB2  . LYS A 1 24 ? 6.571   -6.169  -3.458 1.00 0.33 ?  24 LYS A HB2  4  
ATOM   2134 H HB3  . LYS A 1 24 ? 5.358   -6.096  -2.188 1.00 0.24 ?  24 LYS A HB3  4  
ATOM   2135 H HG2  . LYS A 1 24 ? 4.285   -5.597  -4.246 1.00 0.83 ?  24 LYS A HG2  4  
ATOM   2136 H HG3  . LYS A 1 24 ? 4.395   -4.093  -3.326 1.00 0.96 ?  24 LYS A HG3  4  
ATOM   2137 H HD2  . LYS A 1 24 ? 6.323   -3.408  -4.643 1.00 1.51 ?  24 LYS A HD2  4  
ATOM   2138 H HD3  . LYS A 1 24 ? 6.282   -4.935  -5.527 1.00 1.43 ?  24 LYS A HD3  4  
ATOM   2139 H HE2  . LYS A 1 24 ? 4.029   -4.358  -6.352 1.00 1.17 ?  24 LYS A HE2  4  
ATOM   2140 H HE3  . LYS A 1 24 ? 4.143   -2.807  -5.524 1.00 1.36 ?  24 LYS A HE3  4  
ATOM   2141 H HZ1  . LYS A 1 24 ? 6.015   -2.221  -6.907 1.00 1.91 ?  24 LYS A HZ1  4  
ATOM   2142 H HZ2  . LYS A 1 24 ? 4.703   -2.650  -7.886 1.00 1.69 ?  24 LYS A HZ2  4  
ATOM   2143 H HZ3  . LYS A 1 24 ? 5.981   -3.733  -7.663 1.00 1.76 ?  24 LYS A HZ3  4  
ATOM   2144 N N    . GLN A 1 25 ? 5.434   -4.150  -0.164 1.00 0.11 ?  25 GLN A N    4  
ATOM   2145 C CA   . GLN A 1 25 ? 4.644   -3.379  0.789  1.00 0.09 ?  25 GLN A CA   4  
ATOM   2146 C C    . GLN A 1 25 ? 5.428   -2.165  1.275  1.00 0.09 ?  25 GLN A C    4  
ATOM   2147 O O    . GLN A 1 25 ? 4.905   -1.048  1.315  1.00 0.12 ?  25 GLN A O    4  
ATOM   2148 C CB   . GLN A 1 25 ? 4.259   -4.248  1.985  1.00 0.14 ?  25 GLN A CB   4  
ATOM   2149 C CG   . GLN A 1 25 ? 3.383   -5.435  1.629  1.00 0.16 ?  25 GLN A CG   4  
ATOM   2150 C CD   . GLN A 1 25 ? 3.016   -6.269  2.840  1.00 0.22 ?  25 GLN A CD   4  
ATOM   2151 O OE1  . GLN A 1 25 ? 2.893   -5.754  3.953  1.00 0.41 ?  25 GLN A OE1  4  
ATOM   2152 N NE2  . GLN A 1 25 ? 2.842   -7.563  2.634  1.00 0.24 ?  25 GLN A NE2  4  
ATOM   2153 H H    . GLN A 1 25 ? 5.593   -5.106  0.011  1.00 0.15 ?  25 GLN A H    4  
ATOM   2154 H HA   . GLN A 1 25 ? 3.746   -3.043  0.291  1.00 0.10 ?  25 GLN A HA   4  
ATOM   2155 H HB2  . GLN A 1 25 ? 5.161   -4.620  2.447  1.00 0.22 ?  25 GLN A HB2  4  
ATOM   2156 H HB3  . GLN A 1 25 ? 3.727   -3.638  2.699  1.00 0.18 ?  25 GLN A HB3  4  
ATOM   2157 H HG2  . GLN A 1 25 ? 2.476   -5.070  1.174  1.00 0.18 ?  25 GLN A HG2  4  
ATOM   2158 H HG3  . GLN A 1 25 ? 3.912   -6.060  0.925  1.00 0.21 ?  25 GLN A HG3  4  
ATOM   2159 H HE21 . GLN A 1 25 ? 2.955   -7.910  1.717  1.00 0.33 ?  25 GLN A HE21 4  
ATOM   2160 H HE22 . GLN A 1 25 ? 2.613   -8.128  3.403  1.00 0.27 ?  25 GLN A HE22 4  
ATOM   2161 N N    . GLN A 1 26 ? 6.685   -2.398  1.632  1.00 0.14 ?  26 GLN A N    4  
ATOM   2162 C CA   . GLN A 1 26 ? 7.563   -1.330  2.089  1.00 0.18 ?  26 GLN A CA   4  
ATOM   2163 C C    . GLN A 1 26 ? 7.724   -0.264  1.016  1.00 0.18 ?  26 GLN A C    4  
ATOM   2164 O O    . GLN A 1 26 ? 7.533   0.916   1.288  1.00 0.25 ?  26 GLN A O    4  
ATOM   2165 C CB   . GLN A 1 26 ? 8.933   -1.879  2.485  1.00 0.28 ?  26 GLN A CB   4  
ATOM   2166 C CG   . GLN A 1 26 ? 8.900   -2.796  3.696  1.00 0.38 ?  26 GLN A CG   4  
ATOM   2167 C CD   . GLN A 1 26 ? 10.284  -3.226  4.133  1.00 0.90 ?  26 GLN A CD   4  
ATOM   2168 O OE1  . GLN A 1 26 ? 11.202  -3.335  3.320  1.00 1.46 ?  26 GLN A OE1  4  
ATOM   2169 N NE2  . GLN A 1 26 ? 10.448  -3.464  5.422  1.00 1.59 ?  26 GLN A NE2  4  
ATOM   2170 H H    . GLN A 1 26 ? 7.029   -3.319  1.598  1.00 0.18 ?  26 GLN A H    4  
ATOM   2171 H HA   . GLN A 1 26 ? 7.105   -0.880  2.956  1.00 0.21 ?  26 GLN A HA   4  
ATOM   2172 H HB2  . GLN A 1 26 ? 9.340   -2.432  1.653  1.00 0.31 ?  26 GLN A HB2  4  
ATOM   2173 H HB3  . GLN A 1 26 ? 9.587   -1.050  2.707  1.00 0.31 ?  26 GLN A HB3  4  
ATOM   2174 H HG2  . GLN A 1 26 ? 8.425   -2.277  4.513  1.00 0.76 ?  26 GLN A HG2  4  
ATOM   2175 H HG3  . GLN A 1 26 ? 8.327   -3.679  3.450  1.00 0.60 ?  26 GLN A HG3  4  
ATOM   2176 H HE21 . GLN A 1 26 ? 9.675   -3.347  6.016  1.00 1.96 ?  26 GLN A HE21 4  
ATOM   2177 H HE22 . GLN A 1 26 ? 11.334  -3.751  5.731  1.00 1.99 ?  26 GLN A HE22 4  
ATOM   2178 N N    . ASN A 1 27 ? 8.060   -0.680  -0.204 1.00 0.19 ?  27 ASN A N    4  
ATOM   2179 C CA   . ASN A 1 27 ? 8.246   0.265   -1.307 1.00 0.26 ?  27 ASN A CA   4  
ATOM   2180 C C    . ASN A 1 27 ? 6.978   1.060   -1.581 1.00 0.22 ?  27 ASN A C    4  
ATOM   2181 O O    . ASN A 1 27 ? 7.035   2.250   -1.903 1.00 0.25 ?  27 ASN A O    4  
ATOM   2182 C CB   . ASN A 1 27 ? 8.686   -0.453  -2.583 1.00 0.38 ?  27 ASN A CB   4  
ATOM   2183 C CG   . ASN A 1 27 ? 10.153  -0.828  -2.564 1.00 0.98 ?  27 ASN A CG   4  
ATOM   2184 O OD1  . ASN A 1 27 ? 10.963  -0.168  -1.913 1.00 1.81 ?  27 ASN A OD1  4  
ATOM   2185 N ND2  . ASN A 1 27 ? 10.510  -1.875  -3.289 1.00 1.18 ?  27 ASN A ND2  4  
ATOM   2186 H H    . ASN A 1 27 ? 8.188   -1.644  -0.366 1.00 0.20 ?  27 ASN A H    4  
ATOM   2187 H HA   . ASN A 1 27 ? 9.023   0.954   -1.015 1.00 0.34 ?  27 ASN A HA   4  
ATOM   2188 H HB2  . ASN A 1 27 ? 8.106   -1.357  -2.696 1.00 0.77 ?  27 ASN A HB2  4  
ATOM   2189 H HB3  . ASN A 1 27 ? 8.508   0.191   -3.432 1.00 0.92 ?  27 ASN A HB3  4  
ATOM   2190 H HD21 . ASN A 1 27 ? 9.815   -2.346  -3.794 1.00 1.16 ?  27 ASN A HD21 4  
ATOM   2191 H HD22 . ASN A 1 27 ? 11.457  -2.131  -3.299 1.00 1.75 ?  27 ASN A HD22 4  
ATOM   2192 N N    . LEU A 1 28 ? 5.837   0.403   -1.450 1.00 0.19 ?  28 LEU A N    4  
ATOM   2193 C CA   . LEU A 1 28 ? 4.549   1.047   -1.654 1.00 0.24 ?  28 LEU A CA   4  
ATOM   2194 C C    . LEU A 1 28 ? 4.295   2.112   -0.596 1.00 0.24 ?  28 LEU A C    4  
ATOM   2195 O O    . LEU A 1 28 ? 3.979   3.258   -0.919 1.00 0.29 ?  28 LEU A O    4  
ATOM   2196 C CB   . LEU A 1 28 ? 3.435   0.002   -1.622 1.00 0.28 ?  28 LEU A CB   4  
ATOM   2197 C CG   . LEU A 1 28 ? 3.395   -0.946  -2.820 1.00 0.38 ?  28 LEU A CG   4  
ATOM   2198 C CD1  . LEU A 1 28 ? 2.420   -2.083  -2.566 1.00 0.88 ?  28 LEU A CD1  4  
ATOM   2199 C CD2  . LEU A 1 28 ? 3.004   -0.194  -4.080 1.00 0.72 ?  28 LEU A CD2  4  
ATOM   2200 H H    . LEU A 1 28 ? 5.861   -0.553  -1.212 1.00 0.18 ?  28 LEU A H    4  
ATOM   2201 H HA   . LEU A 1 28 ? 4.564   1.517   -2.623 1.00 0.30 ?  28 LEU A HA   4  
ATOM   2202 H HB2  . LEU A 1 28 ? 3.555   -0.590  -0.726 1.00 0.28 ?  28 LEU A HB2  4  
ATOM   2203 H HB3  . LEU A 1 28 ? 2.493   0.516   -1.567 1.00 0.33 ?  28 LEU A HB3  4  
ATOM   2204 H HG   . LEU A 1 28 ? 4.375   -1.371  -2.971 1.00 0.78 ?  28 LEU A HG   4  
ATOM   2205 H HD11 . LEU A 1 28 ? 1.438   -1.678  -2.377 1.00 1.30 ?  28 LEU A HD11 4  
ATOM   2206 H HD12 . LEU A 1 28 ? 2.748   -2.654  -1.710 1.00 1.54 ?  28 LEU A HD12 4  
ATOM   2207 H HD13 . LEU A 1 28 ? 2.384   -2.724  -3.434 1.00 1.23 ?  28 LEU A HD13 4  
ATOM   2208 H HD21 . LEU A 1 28 ? 2.041   0.273   -3.934 1.00 1.32 ?  28 LEU A HD21 4  
ATOM   2209 H HD22 . LEU A 1 28 ? 2.947   -0.887  -4.907 1.00 1.40 ?  28 LEU A HD22 4  
ATOM   2210 H HD23 . LEU A 1 28 ? 3.743   0.563   -4.294 1.00 1.20 ?  28 LEU A HD23 4  
ATOM   2211 N N    . LYS A 1 29 ? 4.443   1.734   0.667  1.00 0.24 ?  29 LYS A N    4  
ATOM   2212 C CA   . LYS A 1 29 ? 4.231   2.661   1.769  1.00 0.32 ?  29 LYS A CA   4  
ATOM   2213 C C    . LYS A 1 29 ? 5.232   3.813   1.702  1.00 0.34 ?  29 LYS A C    4  
ATOM   2214 O O    . LYS A 1 29 ? 4.890   4.969   1.958  1.00 0.40 ?  29 LYS A O    4  
ATOM   2215 C CB   . LYS A 1 29 ? 4.347   1.931   3.107  1.00 0.42 ?  29 LYS A CB   4  
ATOM   2216 C CG   . LYS A 1 29 ? 4.034   2.806   4.308  1.00 0.71 ?  29 LYS A CG   4  
ATOM   2217 C CD   . LYS A 1 29 ? 2.557   3.177   4.378  1.00 1.19 ?  29 LYS A CD   4  
ATOM   2218 C CE   . LYS A 1 29 ? 1.696   2.006   4.833  1.00 1.23 ?  29 LYS A CE   4  
ATOM   2219 N NZ   . LYS A 1 29 ? 2.062   1.549   6.198  1.00 1.39 1  29 LYS A NZ   4  
ATOM   2220 H H    . LYS A 1 29 ? 4.697   0.803   0.863  1.00 0.22 ?  29 LYS A H    4  
ATOM   2221 H HA   . LYS A 1 29 ? 3.235   3.064   1.672  1.00 0.36 ?  29 LYS A HA   4  
ATOM   2222 H HB2  . LYS A 1 29 ? 3.660   1.099   3.107  1.00 0.78 ?  29 LYS A HB2  4  
ATOM   2223 H HB3  . LYS A 1 29 ? 5.356   1.557   3.213  1.00 0.60 ?  29 LYS A HB3  4  
ATOM   2224 H HG2  . LYS A 1 29 ? 4.299   2.271   5.204  1.00 1.23 ?  29 LYS A HG2  4  
ATOM   2225 H HG3  . LYS A 1 29 ? 4.618   3.711   4.242  1.00 1.29 ?  29 LYS A HG3  4  
ATOM   2226 H HD2  . LYS A 1 29 ? 2.434   3.990   5.077  1.00 1.64 ?  29 LYS A HD2  4  
ATOM   2227 H HD3  . LYS A 1 29 ? 2.228   3.492   3.399  1.00 1.75 ?  29 LYS A HD3  4  
ATOM   2228 H HE2  . LYS A 1 29 ? 0.661   2.316   4.834  1.00 1.53 ?  29 LYS A HE2  4  
ATOM   2229 H HE3  . LYS A 1 29 ? 1.822   1.187   4.142  1.00 1.48 ?  29 LYS A HE3  4  
ATOM   2230 H HZ1  . LYS A 1 29 ? 3.066   1.285   6.232  1.00 2.04 ?  29 LYS A HZ1  4  
ATOM   2231 H HZ2  . LYS A 1 29 ? 1.492   0.723   6.463  1.00 1.56 ?  29 LYS A HZ2  4  
ATOM   2232 H HZ3  . LYS A 1 29 ? 1.892   2.309   6.889  1.00 1.51 ?  29 LYS A HZ3  4  
ATOM   2233 N N    . LYS A 1 30 ? 6.468   3.488   1.349  1.00 0.34 ?  30 LYS A N    4  
ATOM   2234 C CA   . LYS A 1 30 ? 7.501   4.495   1.166  1.00 0.43 ?  30 LYS A CA   4  
ATOM   2235 C C    . LYS A 1 30 ? 7.102   5.485   0.080  1.00 0.42 ?  30 LYS A C    4  
ATOM   2236 O O    . LYS A 1 30 ? 7.232   6.700   0.261  1.00 0.47 ?  30 LYS A O    4  
ATOM   2237 C CB   . LYS A 1 30 ? 8.838   3.837   0.814  1.00 0.54 ?  30 LYS A CB   4  
ATOM   2238 C CG   . LYS A 1 30 ? 9.496   3.134   1.990  1.00 1.28 ?  30 LYS A CG   4  
ATOM   2239 C CD   . LYS A 1 30 ? 10.837  2.528   1.603  1.00 1.67 ?  30 LYS A CD   4  
ATOM   2240 C CE   . LYS A 1 30 ? 11.453  1.746   2.758  1.00 2.49 ?  30 LYS A CE   4  
ATOM   2241 N NZ   . LYS A 1 30 ? 11.734  2.611   3.935  1.00 3.14 1  30 LYS A NZ   4  
ATOM   2242 H H    . LYS A 1 30 ? 6.693   2.542   1.215  1.00 0.33 ?  30 LYS A H    4  
ATOM   2243 H HA   . LYS A 1 30 ? 7.610   5.028   2.097  1.00 0.48 ?  30 LYS A HA   4  
ATOM   2244 H HB2  . LYS A 1 30 ? 8.668   3.108   0.035  1.00 0.89 ?  30 LYS A HB2  4  
ATOM   2245 H HB3  . LYS A 1 30 ? 9.513   4.593   0.446  1.00 1.06 ?  30 LYS A HB3  4  
ATOM   2246 H HG2  . LYS A 1 30 ? 9.650   3.849   2.783  1.00 1.89 ?  30 LYS A HG2  4  
ATOM   2247 H HG3  . LYS A 1 30 ? 8.841   2.346   2.336  1.00 1.85 ?  30 LYS A HG3  4  
ATOM   2248 H HD2  . LYS A 1 30 ? 10.690  1.861   0.766  1.00 2.02 ?  30 LYS A HD2  4  
ATOM   2249 H HD3  . LYS A 1 30 ? 11.511  3.324   1.319  1.00 1.96 ?  30 LYS A HD3  4  
ATOM   2250 H HE2  . LYS A 1 30 ? 10.767  0.965   3.054  1.00 2.89 ?  30 LYS A HE2  4  
ATOM   2251 H HE3  . LYS A 1 30 ? 12.377  1.299   2.421  1.00 2.91 ?  30 LYS A HE3  4  
ATOM   2252 H HZ1  . LYS A 1 30 ? 10.863  3.080   4.256  1.00 3.57 ?  30 LYS A HZ1  4  
ATOM   2253 H HZ2  . LYS A 1 30 ? 12.434  3.340   3.690  1.00 3.62 ?  30 LYS A HZ2  4  
ATOM   2254 H HZ3  . LYS A 1 30 ? 12.110  2.037   4.716  1.00 3.29 ?  30 LYS A HZ3  4  
ATOM   2255 N N    . GLU A 1 31 ? 6.595   4.956   -1.033 1.00 0.42 ?  31 GLU A N    4  
ATOM   2256 C CA   . GLU A 1 31 ? 6.178   5.785   -2.156 1.00 0.49 ?  31 GLU A CA   4  
ATOM   2257 C C    . GLU A 1 31 ? 5.001   6.671   -1.764 1.00 0.52 ?  31 GLU A C    4  
ATOM   2258 O O    . GLU A 1 31 ? 4.915   7.822   -2.198 1.00 0.70 ?  31 GLU A O    4  
ATOM   2259 C CB   . GLU A 1 31 ? 5.802   4.915   -3.359 1.00 0.52 ?  31 GLU A CB   4  
ATOM   2260 C CG   . GLU A 1 31 ? 5.596   5.711   -4.638 1.00 0.87 ?  31 GLU A CG   4  
ATOM   2261 C CD   . GLU A 1 31 ? 5.208   4.847   -5.819 1.00 1.47 ?  31 GLU A CD   4  
ATOM   2262 O OE1  . GLU A 1 31 ? 5.946   3.888   -6.127 1.00 1.67 ?  31 GLU A OE1  4  
ATOM   2263 O OE2  . GLU A 1 31 ? 4.174   5.136   -6.460 1.00 2.30 -1 31 GLU A OE2  4  
ATOM   2264 H H    . GLU A 1 31 ? 6.505   3.979   -1.100 1.00 0.41 ?  31 GLU A H    4  
ATOM   2265 H HA   . GLU A 1 31 ? 7.010   6.415   -2.425 1.00 0.57 ?  31 GLU A HA   4  
ATOM   2266 H HB2  . GLU A 1 31 ? 6.588   4.195   -3.530 1.00 0.87 ?  31 GLU A HB2  4  
ATOM   2267 H HB3  . GLU A 1 31 ? 4.886   4.389   -3.136 1.00 0.80 ?  31 GLU A HB3  4  
ATOM   2268 H HG2  . GLU A 1 31 ? 4.816   6.436   -4.472 1.00 1.45 ?  31 GLU A HG2  4  
ATOM   2269 H HG3  . GLU A 1 31 ? 6.515   6.226   -4.877 1.00 1.49 ?  31 GLU A HG3  4  
ATOM   2270 N N    . LYS A 1 32 ? 4.101   6.127   -0.945 1.00 0.43 ?  32 LYS A N    4  
ATOM   2271 C CA   . LYS A 1 32 ? 2.949   6.883   -0.456 1.00 0.55 ?  32 LYS A CA   4  
ATOM   2272 C C    . LYS A 1 32 ? 3.392   8.200   0.176  1.00 0.66 ?  32 LYS A C    4  
ATOM   2273 O O    . LYS A 1 32 ? 3.071   9.279   -0.325 1.00 1.23 ?  32 LYS A O    4  
ATOM   2274 C CB   . LYS A 1 32 ? 2.145   6.059   0.558  1.00 0.74 ?  32 LYS A CB   4  
ATOM   2275 C CG   . LYS A 1 32 ? 1.037   6.858   1.229  1.00 1.46 ?  32 LYS A CG   4  
ATOM   2276 C CD   . LYS A 1 32 ? 0.243   6.025   2.219  1.00 2.20 ?  32 LYS A CD   4  
ATOM   2277 C CE   . LYS A 1 32 ? -0.733  6.888   3.008  1.00 3.14 ?  32 LYS A CE   4  
ATOM   2278 N NZ   . LYS A 1 32 ? -1.653  7.659   2.126  1.00 3.91 1  32 LYS A NZ   4  
ATOM   2279 H H    . LYS A 1 32 ? 4.210   5.189   -0.672 1.00 0.38 ?  32 LYS A H    4  
ATOM   2280 H HA   . LYS A 1 32 ? 2.319   7.102   -1.303 1.00 0.79 ?  32 LYS A HA   4  
ATOM   2281 H HB2  . LYS A 1 32 ? 1.700   5.217   0.050  1.00 1.02 ?  32 LYS A HB2  4  
ATOM   2282 H HB3  . LYS A 1 32 ? 2.814   5.695   1.324  1.00 1.25 ?  32 LYS A HB3  4  
ATOM   2283 H HG2  . LYS A 1 32 ? 1.478   7.692   1.753  1.00 2.11 ?  32 LYS A HG2  4  
ATOM   2284 H HG3  . LYS A 1 32 ? 0.369   7.225   0.467  1.00 1.77 ?  32 LYS A HG3  4  
ATOM   2285 H HD2  . LYS A 1 32 ? -0.310  5.270   1.682  1.00 2.36 ?  32 LYS A HD2  4  
ATOM   2286 H HD3  . LYS A 1 32 ? 0.928   5.552   2.907  1.00 2.67 ?  32 LYS A HD3  4  
ATOM   2287 H HE2  . LYS A 1 32 ? -1.320  6.247   3.648  1.00 3.54 ?  32 LYS A HE2  4  
ATOM   2288 H HE3  . LYS A 1 32 ? -0.168  7.578   3.616  1.00 3.37 ?  32 LYS A HE3  4  
ATOM   2289 H HZ1  . LYS A 1 32 ? -1.107  8.248   1.462  1.00 3.96 ?  32 LYS A HZ1  4  
ATOM   2290 H HZ2  . LYS A 1 32 ? -2.260  8.280   2.699  1.00 4.35 ?  32 LYS A HZ2  4  
ATOM   2291 H HZ3  . LYS A 1 32 ? -2.257  7.014   1.583  1.00 4.36 ?  32 LYS A HZ3  4  
ATOM   2292 N N    . GLY A 1 33 ? 4.123   8.109   1.276  1.00 0.94 ?  33 GLY A N    4  
ATOM   2293 C CA   . GLY A 1 33 ? 4.641   9.304   1.910  1.00 1.34 ?  33 GLY A CA   4  
ATOM   2294 C C    . GLY A 1 33 ? 5.565   9.008   3.071  1.00 1.43 ?  33 GLY A C    4  
ATOM   2295 O O    . GLY A 1 33 ? 5.887   9.900   3.856  1.00 1.99 ?  33 GLY A O    4  
ATOM   2296 H H    . GLY A 1 33 ? 4.293   7.228   1.668  1.00 1.26 ?  33 GLY A H    4  
ATOM   2297 H HA2  . GLY A 1 33 ? 5.180   9.880   1.176  1.00 1.68 ?  33 GLY A HA2  4  
ATOM   2298 H HA3  . GLY A 1 33 ? 3.811   9.892   2.269  1.00 1.72 ?  33 GLY A HA3  4  
ATOM   2299 N N    . LEU A 1 34 ? 6.004   7.764   3.186  1.00 1.27 ?  34 LEU A N    4  
ATOM   2300 C CA   . LEU A 1 34 ? 6.880   7.373   4.278  1.00 1.73 ?  34 LEU A CA   4  
ATOM   2301 C C    . LEU A 1 34 ? 8.338   7.570   3.880  1.00 1.86 ?  34 LEU A C    4  
ATOM   2302 O O    . LEU A 1 34 ? 9.234   7.567   4.723  1.00 2.56 ?  34 LEU A O    4  
ATOM   2303 C CB   . LEU A 1 34 ? 6.617   5.916   4.670  1.00 1.91 ?  34 LEU A CB   4  
ATOM   2304 C CG   . LEU A 1 34 ? 7.290   5.443   5.961  1.00 2.29 ?  34 LEU A CG   4  
ATOM   2305 C CD1  . LEU A 1 34 ? 6.758   6.214   7.160  1.00 2.76 ?  34 LEU A CD1  4  
ATOM   2306 C CD2  . LEU A 1 34 ? 7.078   3.950   6.154  1.00 3.08 ?  34 LEU A CD2  4  
ATOM   2307 H H    . LEU A 1 34 ? 5.733   7.094   2.526  1.00 1.11 ?  34 LEU A H    4  
ATOM   2308 H HA   . LEU A 1 34 ? 6.660   8.011   5.119  1.00 2.15 ?  34 LEU A HA   4  
ATOM   2309 H HB2  . LEU A 1 34 ? 5.551   5.786   4.780  1.00 2.24 ?  34 LEU A HB2  4  
ATOM   2310 H HB3  . LEU A 1 34 ? 6.956   5.284   3.865  1.00 2.03 ?  34 LEU A HB3  4  
ATOM   2311 H HG   . LEU A 1 34 ? 8.353   5.624   5.894  1.00 2.45 ?  34 LEU A HG   4  
ATOM   2312 H HD11 . LEU A 1 34 ? 7.015   7.258   7.062  1.00 3.05 ?  34 LEU A HD11 4  
ATOM   2313 H HD12 . LEU A 1 34 ? 7.195   5.818   8.066  1.00 3.27 ?  34 LEU A HD12 4  
ATOM   2314 H HD13 . LEU A 1 34 ? 5.683   6.110   7.205  1.00 2.92 ?  34 LEU A HD13 4  
ATOM   2315 H HD21 . LEU A 1 34 ? 6.019   3.742   6.212  1.00 3.53 ?  34 LEU A HD21 4  
ATOM   2316 H HD22 . LEU A 1 34 ? 7.556   3.633   7.070  1.00 3.41 ?  34 LEU A HD22 4  
ATOM   2317 H HD23 . LEU A 1 34 ? 7.505   3.414   5.321  1.00 3.42 ?  34 LEU A HD23 4  
ATOM   2318 N N    . PHE A 1 35 ? 8.570   7.741   2.588  1.00 1.42 ?  35 PHE A N    4  
ATOM   2319 C CA   . PHE A 1 35 ? 9.906   7.997   2.079  1.00 1.78 ?  35 PHE A CA   4  
ATOM   2320 C C    . PHE A 1 35 ? 9.932   9.335   1.354  1.00 2.17 ?  35 PHE A C    4  
ATOM   2321 O O    . PHE A 1 35 ? 10.488  10.314  1.847  1.00 2.84 ?  35 PHE A O    4  
ATOM   2322 C CB   . PHE A 1 35 ? 10.340  6.867   1.144  1.00 1.55 ?  35 PHE A CB   4  
ATOM   2323 C CG   . PHE A 1 35 ? 11.776  6.939   0.709  1.00 1.48 ?  35 PHE A CG   4  
ATOM   2324 C CD1  . PHE A 1 35 ? 12.782  6.374   1.477  1.00 1.95 ?  35 PHE A CD1  4  
ATOM   2325 C CD2  . PHE A 1 35 ? 12.119  7.582   -0.467 1.00 1.61 ?  35 PHE A CD2  4  
ATOM   2326 C CE1  . PHE A 1 35 ? 14.101  6.448   1.076  1.00 2.46 ?  35 PHE A CE1  4  
ATOM   2327 C CE2  . PHE A 1 35 ? 13.436  7.658   -0.873 1.00 1.99 ?  35 PHE A CE2  4  
ATOM   2328 C CZ   . PHE A 1 35 ? 14.433  7.054   -0.089 1.00 2.41 ?  35 PHE A CZ   4  
ATOM   2329 H H    . PHE A 1 35 ? 7.819   7.694   1.954  1.00 1.04 ?  35 PHE A H    4  
ATOM   2330 H HA   . PHE A 1 35 ? 10.581  8.043   2.919  1.00 2.31 ?  35 PHE A HA   4  
ATOM   2331 H HB2  . PHE A 1 35 ? 10.199  5.925   1.650  1.00 1.53 ?  35 PHE A HB2  4  
ATOM   2332 H HB3  . PHE A 1 35 ? 9.722   6.887   0.259  1.00 1.88 ?  35 PHE A HB3  4  
ATOM   2333 H HD1  . PHE A 1 35 ? 12.526  5.869   2.397  1.00 2.21 ?  35 PHE A HD1  4  
ATOM   2334 H HD2  . PHE A 1 35 ? 11.344  8.026   -1.073 1.00 1.82 ?  35 PHE A HD2  4  
ATOM   2335 H HE1  . PHE A 1 35 ? 14.875  6.005   1.684  1.00 3.08 ?  35 PHE A HE1  4  
ATOM   2336 H HE2  . PHE A 1 35 ? 13.689  8.159   -1.793 1.00 2.26 ?  35 PHE A HE2  4  
ATOM   2337 H HZ   . PHE A 1 35 ? 15.466  7.098   -0.399 1.00 2.93 ?  35 PHE A HZ   4  
HETATM 2338 N N    . NH2 A 1 36 ? 9.303   9.382   0.192  1.00 2.32 ?  36 NH2 A N    4  
HETATM 2339 H HN1  . NH2 A 1 36 ? 8.880   8.561   -0.144 1.00 2.41 ?  36 NH2 A HN1  4  
HETATM 2340 H HN2  . NH2 A 1 36 ? 9.279   10.236  -0.286 1.00 2.69 ?  36 NH2 A HN2  4  
ATOM   2341 N N    . LEU A 1 1  ? -8.573  4.931   7.550  1.00 1.11 ?  1  LEU A N    5  
ATOM   2342 C CA   . LEU A 1 1  ? -8.055  4.453   6.250  1.00 0.77 ?  1  LEU A CA   5  
ATOM   2343 C C    . LEU A 1 1  ? -8.881  3.264   5.765  1.00 0.62 ?  1  LEU A C    5  
ATOM   2344 O O    . LEU A 1 1  ? -8.450  2.115   5.858  1.00 0.66 ?  1  LEU A O    5  
ATOM   2345 C CB   . LEU A 1 1  ? -6.577  4.068   6.389  1.00 0.91 ?  1  LEU A CB   5  
ATOM   2346 C CG   . LEU A 1 1  ? -5.863  3.674   5.093  1.00 1.01 ?  1  LEU A CG   5  
ATOM   2347 C CD1  . LEU A 1 1  ? -5.888  4.817   4.091  1.00 1.23 ?  1  LEU A CD1  5  
ATOM   2348 C CD2  . LEU A 1 1  ? -4.429  3.260   5.388  1.00 1.78 ?  1  LEU A CD2  5  
ATOM   2349 H H1   . LEU A 1 1  ? -8.002  5.727   7.895  1.00 1.40 ?  1  LEU A H1   5  
ATOM   2350 H H2   . LEU A 1 1  ? -8.540  4.165   8.252  1.00 1.62 ?  1  LEU A H2   5  
ATOM   2351 H H3   . LEU A 1 1  ? -9.557  5.245   7.448  1.00 1.61 ?  1  LEU A H3   5  
ATOM   2352 H HA   . LEU A 1 1  ? -8.146  5.253   5.534  1.00 0.75 ?  1  LEU A HA   5  
ATOM   2353 H HB2  . LEU A 1 1  ? -6.052  4.906   6.822  1.00 1.23 ?  1  LEU A HB2  5  
ATOM   2354 H HB3  . LEU A 1 1  ? -6.511  3.237   7.073  1.00 1.43 ?  1  LEU A HB3  5  
ATOM   2355 H HG   . LEU A 1 1  ? -6.372  2.832   4.649  1.00 1.75 ?  1  LEU A HG   5  
ATOM   2356 H HD11 . LEU A 1 1  ? -5.329  4.536   3.210  1.00 1.48 ?  1  LEU A HD11 5  
ATOM   2357 H HD12 . LEU A 1 1  ? -5.442  5.695   4.535  1.00 1.80 ?  1  LEU A HD12 5  
ATOM   2358 H HD13 . LEU A 1 1  ? -6.909  5.032   3.814  1.00 1.91 ?  1  LEU A HD13 5  
ATOM   2359 H HD21 . LEU A 1 1  ? -3.944  2.969   4.469  1.00 2.17 ?  1  LEU A HD21 5  
ATOM   2360 H HD22 . LEU A 1 1  ? -4.429  2.429   6.076  1.00 2.45 ?  1  LEU A HD22 5  
ATOM   2361 H HD23 . LEU A 1 1  ? -3.897  4.091   5.827  1.00 2.19 ?  1  LEU A HD23 5  
ATOM   2362 N N    . SER A 1 2  ? -10.074 3.552   5.249  1.00 0.58 ?  2  SER A N    5  
ATOM   2363 C CA   . SER A 1 2  ? -11.012 2.512   4.828  1.00 0.59 ?  2  SER A CA   5  
ATOM   2364 C C    . SER A 1 2  ? -10.506 1.775   3.590  1.00 0.53 ?  2  SER A C    5  
ATOM   2365 O O    . SER A 1 2  ? -9.716  2.325   2.833  1.00 0.45 ?  2  SER A O    5  
ATOM   2366 C CB   . SER A 1 2  ? -12.379 3.132   4.552  1.00 0.72 ?  2  SER A CB   5  
ATOM   2367 O OG   . SER A 1 2  ? -12.858 3.832   5.688  1.00 1.28 ?  2  SER A OG   5  
ATOM   2368 H H    . SER A 1 2  ? -10.326 4.493   5.133  1.00 0.63 ?  2  SER A H    5  
ATOM   2369 H HA   . SER A 1 2  ? -11.106 1.804   5.638  1.00 0.67 ?  2  SER A HA   5  
ATOM   2370 H HB2  . SER A 1 2  ? -12.295 3.823   3.728  1.00 1.39 ?  2  SER A HB2  5  
ATOM   2371 H HB3  . SER A 1 2  ? -13.083 2.353   4.301  1.00 1.05 ?  2  SER A HB3  5  
ATOM   2372 H HG   . SER A 1 2  ? -12.110 4.109   6.233  1.00 1.66 ?  2  SER A HG   5  
ATOM   2373 N N    . ASP A 1 3  ? -10.974 0.543   3.387  1.00 0.61 ?  3  ASP A N    5  
ATOM   2374 C CA   . ASP A 1 3  ? -10.445 -0.339  2.336  1.00 0.60 ?  3  ASP A CA   5  
ATOM   2375 C C    . ASP A 1 3  ? -10.392 0.339   0.971  1.00 0.49 ?  3  ASP A C    5  
ATOM   2376 O O    . ASP A 1 3  ? -9.366  0.298   0.288  1.00 0.40 ?  3  ASP A O    5  
ATOM   2377 C CB   . ASP A 1 3  ? -11.277 -1.619  2.223  1.00 0.76 ?  3  ASP A CB   5  
ATOM   2378 C CG   . ASP A 1 3  ? -11.060 -2.571  3.380  1.00 1.42 ?  3  ASP A CG   5  
ATOM   2379 O OD1  . ASP A 1 3  ? -10.048 -3.301  3.374  1.00 1.93 ?  3  ASP A OD1  5  
ATOM   2380 O OD2  . ASP A 1 3  ? -11.891 -2.585  4.308  1.00 2.11 -1 3  ASP A OD2  5  
ATOM   2381 H H    . ASP A 1 3  ? -11.707 0.218   3.953  1.00 0.71 ?  3  ASP A H    5  
ATOM   2382 H HA   . ASP A 1 3  ? -9.440  -0.610  2.619  1.00 0.62 ?  3  ASP A HA   5  
ATOM   2383 H HB2  . ASP A 1 3  ? -12.323 -1.358  2.192  1.00 1.30 ?  3  ASP A HB2  5  
ATOM   2384 H HB3  . ASP A 1 3  ? -11.013 -2.128  1.309  1.00 1.20 ?  3  ASP A HB3  5  
ATOM   2385 N N    . GLU A 1 4  ? -11.492 0.970   0.580  1.00 0.58 ?  4  GLU A N    5  
ATOM   2386 C CA   . GLU A 1 4  ? -11.576 1.615   -0.726 1.00 0.58 ?  4  GLU A CA   5  
ATOM   2387 C C    . GLU A 1 4  ? -10.656 2.824   -0.804 1.00 0.43 ?  4  GLU A C    5  
ATOM   2388 O O    . GLU A 1 4  ? -10.148 3.160   -1.877 1.00 0.38 ?  4  GLU A O    5  
ATOM   2389 C CB   . GLU A 1 4  ? -13.015 2.026   -1.034 1.00 0.80 ?  4  GLU A CB   5  
ATOM   2390 C CG   . GLU A 1 4  ? -13.940 0.847   -1.276 1.00 1.35 ?  4  GLU A CG   5  
ATOM   2391 C CD   . GLU A 1 4  ? -15.357 1.275   -1.588 1.00 1.81 ?  4  GLU A CD   5  
ATOM   2392 O OE1  . GLU A 1 4  ? -16.227 1.147   -0.700 1.00 2.46 ?  4  GLU A OE1  5  
ATOM   2393 O OE2  . GLU A 1 4  ? -15.610 1.737   -2.720 1.00 2.08 -1 4  GLU A OE2  5  
ATOM   2394 H H    . GLU A 1 4  ? -12.263 1.005   1.185  1.00 0.68 ?  4  GLU A H    5  
ATOM   2395 H HA   . GLU A 1 4  ? -11.259 0.894   -1.463 1.00 0.59 ?  4  GLU A HA   5  
ATOM   2396 H HB2  . GLU A 1 4  ? -13.401 2.593   -0.201 1.00 1.07 ?  4  GLU A HB2  5  
ATOM   2397 H HB3  . GLU A 1 4  ? -13.019 2.649   -1.916 1.00 1.03 ?  4  GLU A HB3  5  
ATOM   2398 H HG2  . GLU A 1 4  ? -13.562 0.275   -2.111 1.00 1.90 ?  4  GLU A HG2  5  
ATOM   2399 H HG3  . GLU A 1 4  ? -13.952 0.227   -0.393 1.00 1.77 ?  4  GLU A HG3  5  
ATOM   2400 N N    . ASP A 1 5  ? -10.419 3.461   0.334  1.00 0.44 ?  5  ASP A N    5  
ATOM   2401 C CA   . ASP A 1 5  ? -9.537  4.618   0.382  1.00 0.40 ?  5  ASP A CA   5  
ATOM   2402 C C    . ASP A 1 5  ? -8.094  4.149   0.330  1.00 0.28 ?  5  ASP A C    5  
ATOM   2403 O O    . ASP A 1 5  ? -7.247  4.765   -0.305 1.00 0.29 ?  5  ASP A O    5  
ATOM   2404 C CB   . ASP A 1 5  ? -9.794  5.436   1.645  1.00 0.52 ?  5  ASP A CB   5  
ATOM   2405 C CG   . ASP A 1 5  ? -8.926  6.673   1.720  1.00 1.11 ?  5  ASP A CG   5  
ATOM   2406 O OD1  . ASP A 1 5  ? -9.090  7.568   0.871  1.00 1.17 ?  5  ASP A OD1  5  
ATOM   2407 O OD2  . ASP A 1 5  ? -8.066  6.750   2.623  1.00 1.82 -1 5  ASP A OD2  5  
ATOM   2408 H H    . ASP A 1 5  ? -10.825 3.131   1.167  1.00 0.51 ?  5  ASP A H    5  
ATOM   2409 H HA   . ASP A 1 5  ? -9.739  5.226   -0.487 1.00 0.43 ?  5  ASP A HA   5  
ATOM   2410 H HB2  . ASP A 1 5  ? -10.829 5.745   1.664  1.00 1.00 ?  5  ASP A HB2  5  
ATOM   2411 H HB3  . ASP A 1 5  ? -9.590  4.823   2.510  1.00 0.82 ?  5  ASP A HB3  5  
ATOM   2412 N N    . PHE A 1 6  ? -7.842  3.024   0.983  1.00 0.24 ?  6  PHE A N    5  
ATOM   2413 C CA   . PHE A 1 6  ? -6.559  2.348   0.927  1.00 0.18 ?  6  PHE A CA   5  
ATOM   2414 C C    . PHE A 1 6  ? -6.246  2.004   -0.523 1.00 0.13 ?  6  PHE A C    5  
ATOM   2415 O O    . PHE A 1 6  ? -5.129  2.206   -1.003 1.00 0.15 ?  6  PHE A O    5  
ATOM   2416 C CB   . PHE A 1 6  ? -6.632  1.074   1.777  1.00 0.23 ?  6  PHE A CB   5  
ATOM   2417 C CG   . PHE A 1 6  ? -5.310  0.430   2.072  1.00 0.25 ?  6  PHE A CG   5  
ATOM   2418 C CD1  . PHE A 1 6  ? -4.811  0.418   3.361  1.00 0.43 ?  6  PHE A CD1  5  
ATOM   2419 C CD2  . PHE A 1 6  ? -4.577  -0.179  1.070  1.00 0.25 ?  6  PHE A CD2  5  
ATOM   2420 C CE1  . PHE A 1 6  ? -3.602  -0.182  3.648  1.00 0.50 ?  6  PHE A CE1  5  
ATOM   2421 C CE2  . PHE A 1 6  ? -3.368  -0.778  1.347  1.00 0.35 ?  6  PHE A CE2  5  
ATOM   2422 C CZ   . PHE A 1 6  ? -2.880  -0.783  2.637  1.00 0.43 ?  6  PHE A CZ   5  
ATOM   2423 H H    . PHE A 1 6  ? -8.555  2.632   1.529  1.00 0.29 ?  6  PHE A H    5  
ATOM   2424 H HA   . PHE A 1 6  ? -5.798  3.008   1.317  1.00 0.23 ?  6  PHE A HA   5  
ATOM   2425 H HB2  . PHE A 1 6  ? -7.093  1.313   2.722  1.00 0.31 ?  6  PHE A HB2  5  
ATOM   2426 H HB3  . PHE A 1 6  ? -7.245  0.351   1.262  1.00 0.27 ?  6  PHE A HB3  5  
ATOM   2427 H HD1  . PHE A 1 6  ? -5.378  0.889   4.149  1.00 0.55 ?  6  PHE A HD1  5  
ATOM   2428 H HD2  . PHE A 1 6  ? -4.959  -0.177  0.059  1.00 0.29 ?  6  PHE A HD2  5  
ATOM   2429 H HE1  . PHE A 1 6  ? -3.226  -0.185  4.660  1.00 0.65 ?  6  PHE A HE1  5  
ATOM   2430 H HE2  . PHE A 1 6  ? -2.805  -1.244  0.554  1.00 0.43 ?  6  PHE A HE2  5  
ATOM   2431 H HZ   . PHE A 1 6  ? -1.934  -1.256  2.855  1.00 0.51 ?  6  PHE A HZ   5  
ATOM   2432 N N    . LYS A 1 7  ? -7.260  1.500   -1.217 1.00 0.13 ?  7  LYS A N    5  
ATOM   2433 C CA   . LYS A 1 7  ? -7.148  1.190   -2.631 1.00 0.15 ?  7  LYS A CA   5  
ATOM   2434 C C    . LYS A 1 7  ? -6.904  2.460   -3.435 1.00 0.19 ?  7  LYS A C    5  
ATOM   2435 O O    . LYS A 1 7  ? -6.145  2.462   -4.394 1.00 0.23 ?  7  LYS A O    5  
ATOM   2436 C CB   . LYS A 1 7  ? -8.417  0.502   -3.126 1.00 0.23 ?  7  LYS A CB   5  
ATOM   2437 C CG   . LYS A 1 7  ? -8.323  0.022   -4.566 1.00 0.30 ?  7  LYS A CG   5  
ATOM   2438 C CD   . LYS A 1 7  ? -9.639  -0.560  -5.057 1.00 0.44 ?  7  LYS A CD   5  
ATOM   2439 C CE   . LYS A 1 7  ? -10.729 0.498   -5.134 1.00 1.26 ?  7  LYS A CE   5  
ATOM   2440 N NZ   . LYS A 1 7  ? -12.005 -0.057  -5.649 1.00 2.06 1  7  LYS A NZ   5  
ATOM   2441 H H    . LYS A 1 7  ? -8.109  1.320   -0.755 1.00 0.18 ?  7  LYS A H    5  
ATOM   2442 H HA   . LYS A 1 7  ? -6.308  0.524   -2.761 1.00 0.15 ?  7  LYS A HA   5  
ATOM   2443 H HB2  . LYS A 1 7  ? -8.623  -0.348  -2.494 1.00 0.28 ?  7  LYS A HB2  5  
ATOM   2444 H HB3  . LYS A 1 7  ? -9.235  1.201   -3.055 1.00 0.25 ?  7  LYS A HB3  5  
ATOM   2445 H HG2  . LYS A 1 7  ? -8.055  0.858   -5.192 1.00 0.31 ?  7  LYS A HG2  5  
ATOM   2446 H HG3  . LYS A 1 7  ? -7.558  -0.736  -4.633 1.00 0.36 ?  7  LYS A HG3  5  
ATOM   2447 H HD2  . LYS A 1 7  ? -9.490  -0.980  -6.040 1.00 1.10 ?  7  LYS A HD2  5  
ATOM   2448 H HD3  . LYS A 1 7  ? -9.953  -1.337  -4.376 1.00 0.92 ?  7  LYS A HD3  5  
ATOM   2449 H HE2  . LYS A 1 7  ? -10.897 0.901   -4.145 1.00 1.83 ?  7  LYS A HE2  5  
ATOM   2450 H HE3  . LYS A 1 7  ? -10.401 1.290   -5.791 1.00 1.84 ?  7  LYS A HE3  5  
ATOM   2451 H HZ1  . LYS A 1 7  ? -11.858 -0.478  -6.589 1.00 2.69 ?  7  LYS A HZ1  5  
ATOM   2452 H HZ2  . LYS A 1 7  ? -12.718 0.694   -5.727 1.00 2.55 ?  7  LYS A HZ2  5  
ATOM   2453 H HZ3  . LYS A 1 7  ? -12.362 -0.791  -5.006 1.00 2.30 ?  7  LYS A HZ3  5  
ATOM   2454 N N    . ALA A 1 8  ? -7.557  3.541   -3.037 1.00 0.22 ?  8  ALA A N    5  
ATOM   2455 C CA   . ALA A 1 8  ? -7.359  4.829   -3.686 1.00 0.30 ?  8  ALA A CA   5  
ATOM   2456 C C    . ALA A 1 8  ? -5.930  5.328   -3.484 1.00 0.35 ?  8  ALA A C    5  
ATOM   2457 O O    . ALA A 1 8  ? -5.374  6.016   -4.340 1.00 0.45 ?  8  ALA A O    5  
ATOM   2458 C CB   . ALA A 1 8  ? -8.358  5.848   -3.159 1.00 0.35 ?  8  ALA A CB   5  
ATOM   2459 H H    . ALA A 1 8  ? -8.198  3.470   -2.293 1.00 0.22 ?  8  ALA A H    5  
ATOM   2460 H HA   . ALA A 1 8  ? -7.537  4.700   -4.743 1.00 0.34 ?  8  ALA A HA   5  
ATOM   2461 H HB1  . ALA A 1 8  ? -9.360  5.462   -3.278 1.00 1.02 ?  8  ALA A HB1  5  
ATOM   2462 H HB2  . ALA A 1 8  ? -8.260  6.771   -3.711 1.00 1.02 ?  8  ALA A HB2  5  
ATOM   2463 H HB3  . ALA A 1 8  ? -8.165  6.030   -2.113 1.00 1.04 ?  8  ALA A HB3  5  
ATOM   2464 N N    . VAL A 1 9  ? -5.345  4.983   -2.344 1.00 0.31 ?  9  VAL A N    5  
ATOM   2465 C CA   . VAL A 1 9  ? -3.976  5.375   -2.033 1.00 0.39 ?  9  VAL A CA   5  
ATOM   2466 C C    . VAL A 1 9  ? -2.961  4.525   -2.798 1.00 0.38 ?  9  VAL A C    5  
ATOM   2467 O O    . VAL A 1 9  ? -2.190  5.042   -3.603 1.00 0.49 ?  9  VAL A O    5  
ATOM   2468 C CB   . VAL A 1 9  ? -3.683  5.265   -0.517 1.00 0.42 ?  9  VAL A CB   5  
ATOM   2469 C CG1  . VAL A 1 9  ? -2.239  5.638   -0.219 1.00 0.52 ?  9  VAL A CG1  5  
ATOM   2470 C CG2  . VAL A 1 9  ? -4.626  6.148   0.285  1.00 0.50 ?  9  VAL A CG2  5  
ATOM   2471 H H    . VAL A 1 9  ? -5.856  4.464   -1.681 1.00 0.26 ?  9  VAL A H    5  
ATOM   2472 H HA   . VAL A 1 9  ? -3.854  6.406   -2.325 1.00 0.47 ?  9  VAL A HA   5  
ATOM   2473 H HB   . VAL A 1 9  ? -3.838  4.240   -0.211 1.00 0.37 ?  9  VAL A HB   5  
ATOM   2474 H HG11 . VAL A 1 9  ? -2.059  6.655   -0.531 1.00 0.97 ?  9  VAL A HG11 5  
ATOM   2475 H HG12 . VAL A 1 9  ? -1.579  4.974   -0.757 1.00 0.84 ?  9  VAL A HG12 5  
ATOM   2476 H HG13 . VAL A 1 9  ? -2.054  5.548   0.841  1.00 1.18 ?  9  VAL A HG13 5  
ATOM   2477 H HG21 . VAL A 1 9  ? -5.647  5.860   0.085  1.00 0.95 ?  9  VAL A HG21 5  
ATOM   2478 H HG22 . VAL A 1 9  ? -4.481  7.180   0.004  1.00 0.76 ?  9  VAL A HG22 5  
ATOM   2479 H HG23 . VAL A 1 9  ? -4.419  6.029   1.339  1.00 0.91 ?  9  VAL A HG23 5  
ATOM   2480 N N    . PHE A 1 10 ? -2.977  3.220   -2.552 1.00 0.29 ?  10 PHE A N    5  
ATOM   2481 C CA   . PHE A 1 10 ? -1.938  2.330   -3.062 1.00 0.33 ?  10 PHE A CA   5  
ATOM   2482 C C    . PHE A 1 10 ? -2.306  1.697   -4.398 1.00 0.35 ?  10 PHE A C    5  
ATOM   2483 O O    . PHE A 1 10 ? -1.432  1.246   -5.136 1.00 0.45 ?  10 PHE A O    5  
ATOM   2484 C CB   . PHE A 1 10 ? -1.644  1.236   -2.038 1.00 0.32 ?  10 PHE A CB   5  
ATOM   2485 C CG   . PHE A 1 10 ? -0.961  1.745   -0.807 1.00 0.33 ?  10 PHE A CG   5  
ATOM   2486 C CD1  . PHE A 1 10 ? -1.682  2.048   0.335  1.00 0.39 ?  10 PHE A CD1  5  
ATOM   2487 C CD2  . PHE A 1 10 ? 0.410   1.924   -0.798 1.00 0.39 ?  10 PHE A CD2  5  
ATOM   2488 C CE1  . PHE A 1 10 ? -1.045  2.517   1.466  1.00 0.41 ?  10 PHE A CE1  5  
ATOM   2489 C CE2  . PHE A 1 10 ? 1.055   2.392   0.327  1.00 0.42 ?  10 PHE A CE2  5  
ATOM   2490 C CZ   . PHE A 1 10 ? 0.327   2.690   1.462  1.00 0.37 ?  10 PHE A CZ   5  
ATOM   2491 H H    . PHE A 1 10 ? -3.705  2.845   -2.008 1.00 0.22 ?  10 PHE A H    5  
ATOM   2492 H HA   . PHE A 1 10 ? -1.045  2.919   -3.197 1.00 0.39 ?  10 PHE A HA   5  
ATOM   2493 H HB2  . PHE A 1 10 ? -2.574  0.776   -1.736 1.00 0.30 ?  10 PHE A HB2  5  
ATOM   2494 H HB3  . PHE A 1 10 ? -1.007  0.490   -2.490 1.00 0.37 ?  10 PHE A HB3  5  
ATOM   2495 H HD1  . PHE A 1 10 ? -2.754  1.910   0.339  1.00 0.48 ?  10 PHE A HD1  5  
ATOM   2496 H HD2  . PHE A 1 10 ? 0.977   1.692   -1.686 1.00 0.47 ?  10 PHE A HD2  5  
ATOM   2497 H HE1  . PHE A 1 10 ? -1.618  2.752   2.351  1.00 0.50 ?  10 PHE A HE1  5  
ATOM   2498 H HE2  . PHE A 1 10 ? 2.126   2.524   0.319  1.00 0.52 ?  10 PHE A HE2  5  
ATOM   2499 H HZ   . PHE A 1 10 ? 0.830   3.056   2.343  1.00 0.39 ?  10 PHE A HZ   5  
ATOM   2500 N N    . GLY A 1 11 ? -3.589  1.656   -4.710 1.00 0.28 ?  11 GLY A N    5  
ATOM   2501 C CA   . GLY A 1 11 ? -4.031  1.026   -5.941 1.00 0.31 ?  11 GLY A CA   5  
ATOM   2502 C C    . GLY A 1 11 ? -4.717  -0.297  -5.682 1.00 0.29 ?  11 GLY A C    5  
ATOM   2503 O O    . GLY A 1 11 ? -5.411  -0.834  -6.546 1.00 0.36 ?  11 GLY A O    5  
ATOM   2504 H H    . GLY A 1 11 ? -4.250  2.062   -4.108 1.00 0.24 ?  11 GLY A H    5  
ATOM   2505 H HA2  . GLY A 1 11 ? -4.720  1.687   -6.445 1.00 0.32 ?  11 GLY A HA2  5  
ATOM   2506 H HA3  . GLY A 1 11 ? -3.175  0.859   -6.576 1.00 0.35 ?  11 GLY A HA3  5  
HETATM 2507 N N    . NLE A 1 12 ? -4.533  -0.817  -4.479 1.00 0.24 ?  12 NLE A N    5  
HETATM 2508 C CA   . NLE A 1 12 ? -5.105  -2.096  -4.100 1.00 0.24 ?  12 NLE A CA   5  
HETATM 2509 C C    . NLE A 1 12 ? -5.630  -2.029  -2.671 1.00 0.21 ?  12 NLE A C    5  
HETATM 2510 O O    . NLE A 1 12 ? -5.213  -1.172  -1.892 1.00 0.22 ?  12 NLE A O    5  
HETATM 2511 C CB   . NLE A 1 12 ? -4.072  -3.227  -4.241 1.00 0.27 ?  12 NLE A CB   5  
HETATM 2512 C CG   . NLE A 1 12 ? -2.880  -3.139  -3.290 1.00 0.64 ?  12 NLE A CG   5  
HETATM 2513 C CD   . NLE A 1 12 ? -1.879  -2.062  -3.694 1.00 0.33 ?  12 NLE A CD   5  
HETATM 2514 C CE   . NLE A 1 12 ? -1.257  -2.383  -5.038 1.00 0.64 ?  12 NLE A CE   5  
HETATM 2515 H H    . NLE A 1 12 ? -4.005  -0.319  -3.822 1.00 0.26 ?  12 NLE A H    5  
HETATM 2516 H HA   . NLE A 1 12 ? -5.932  -2.294  -4.763 1.00 0.26 ?  12 NLE A HA   5  
HETATM 2517 H HB2  . NLE A 1 12 ? -3.697  -3.224  -5.252 1.00 0.51 ?  12 NLE A HB2  5  
HETATM 2518 H HB3  . NLE A 1 12 ? -4.569  -4.166  -4.062 1.00 0.31 ?  12 NLE A HB3  5  
HETATM 2519 H HG2  . NLE A 1 12 ? -2.377  -4.096  -3.276 1.00 1.24 ?  12 NLE A HG2  5  
HETATM 2520 H HG3  . NLE A 1 12 ? -3.246  -2.914  -2.300 1.00 1.24 ?  12 NLE A HG3  5  
HETATM 2521 H HD2  . NLE A 1 12 ? -1.094  -2.008  -2.955 1.00 0.70 ?  12 NLE A HD2  5  
HETATM 2522 H HD3  . NLE A 1 12 ? -2.384  -1.112  -3.765 1.00 0.43 ?  12 NLE A HD3  5  
HETATM 2523 H HE1  . NLE A 1 12 ? -2.024  -2.392  -5.797 1.00 1.10 ?  12 NLE A HE1  5  
HETATM 2524 H HE2  . NLE A 1 12 ? -0.785  -3.353  -4.993 1.00 1.19 ?  12 NLE A HE2  5  
HETATM 2525 H HE3  . NLE A 1 12 ? -0.518  -1.635  -5.282 1.00 1.26 ?  12 NLE A HE3  5  
ATOM   2526 N N    . THR A 1 13 ? -6.550  -2.924  -2.341 1.00 0.24 ?  13 THR A N    5  
ATOM   2527 C CA   . THR A 1 13 ? -7.156  -2.956  -1.017 1.00 0.27 ?  13 THR A CA   5  
ATOM   2528 C C    . THR A 1 13 ? -6.195  -3.526  0.018  1.00 0.24 ?  13 THR A C    5  
ATOM   2529 O O    . THR A 1 13 ? -5.183  -4.131  -0.346 1.00 0.23 ?  13 THR A O    5  
ATOM   2530 C CB   . THR A 1 13 ? -8.449  -3.793  -1.024 1.00 0.34 ?  13 THR A CB   5  
ATOM   2531 O OG1  . THR A 1 13 ? -8.207  -5.048  -1.678 1.00 0.36 ?  13 THR A OG1  5  
ATOM   2532 C CG2  . THR A 1 13 ? -9.574  -3.047  -1.726 1.00 0.43 ?  13 THR A CG2  5  
ATOM   2533 H H    . THR A 1 13 ? -6.829  -3.591  -3.006 1.00 0.27 ?  13 THR A H    5  
ATOM   2534 H HA   . THR A 1 13 ? -7.409  -1.943  -0.738 1.00 0.30 ?  13 THR A HA   5  
ATOM   2535 H HB   . THR A 1 13 ? -8.743  -3.982  0.000  1.00 0.34 ?  13 THR A HB   5  
ATOM   2536 H HG1  . THR A 1 13 ? -9.003  -5.333  -2.138 1.00 0.58 ?  13 THR A HG1  5  
ATOM   2537 H HG21 . THR A 1 13 ? -10.473 -3.646  -1.707 1.00 0.92 ?  13 THR A HG21 5  
ATOM   2538 H HG22 . THR A 1 13 ? -9.293  -2.854  -2.751 1.00 1.34 ?  13 THR A HG22 5  
ATOM   2539 H HG23 . THR A 1 13 ? -9.755  -2.110  -1.219 1.00 1.02 ?  13 THR A HG23 5  
ATOM   2540 N N    . ARG A 1 14 ? -6.523  -3.343  1.299  1.00 0.29 ?  14 ARG A N    5  
ATOM   2541 C CA   . ARG A 1 14 ? -5.680  -3.816  2.401  1.00 0.32 ?  14 ARG A CA   5  
ATOM   2542 C C    . ARG A 1 14 ? -5.225  -5.254  2.162  1.00 0.30 ?  14 ARG A C    5  
ATOM   2543 O O    . ARG A 1 14 ? -4.031  -5.560  2.232  1.00 0.31 ?  14 ARG A O    5  
ATOM   2544 C CB   . ARG A 1 14 ? -6.445  -3.766  3.724  1.00 0.42 ?  14 ARG A CB   5  
ATOM   2545 C CG   . ARG A 1 14 ? -6.865  -2.379  4.185  1.00 0.53 ?  14 ARG A CG   5  
ATOM   2546 C CD   . ARG A 1 14 ? -7.766  -2.487  5.407  1.00 0.77 ?  14 ARG A CD   5  
ATOM   2547 N NE   . ARG A 1 14 ? -8.237  -1.197  5.902  1.00 1.30 ?  14 ARG A NE   5  
ATOM   2548 C CZ   . ARG A 1 14 ? -9.353  -1.052  6.623  1.00 1.88 ?  14 ARG A CZ   5  
ATOM   2549 N NH1  . ARG A 1 14 ? -10.123 -2.104  6.877  1.00 2.02 1  14 ARG A NH1  5  
ATOM   2550 N NH2  . ARG A 1 14 ? -9.704  0.139   7.081  1.00 2.82 ?  14 ARG A NH2  5  
ATOM   2551 H H    . ARG A 1 14 ? -7.361  -2.881  1.509  1.00 0.32 ?  14 ARG A H    5  
ATOM   2552 H HA   . ARG A 1 14 ? -4.813  -3.174  2.465  1.00 0.34 ?  14 ARG A HA   5  
ATOM   2553 H HB2  . ARG A 1 14 ? -7.337  -4.363  3.627  1.00 0.43 ?  14 ARG A HB2  5  
ATOM   2554 H HB3  . ARG A 1 14 ? -5.823  -4.198  4.491  1.00 0.46 ?  14 ARG A HB3  5  
ATOM   2555 H HG2  . ARG A 1 14 ? -5.981  -1.812  4.445  1.00 0.58 ?  14 ARG A HG2  5  
ATOM   2556 H HG3  . ARG A 1 14 ? -7.401  -1.884  3.389  1.00 0.53 ?  14 ARG A HG3  5  
ATOM   2557 H HD2  . ARG A 1 14 ? -8.622  -3.087  5.146  1.00 1.48 ?  14 ARG A HD2  5  
ATOM   2558 H HD3  . ARG A 1 14 ? -7.216  -2.978  6.194  1.00 1.15 ?  14 ARG A HD3  5  
ATOM   2559 H HE   . ARG A 1 14 ? -7.682  -0.405  5.714  1.00 1.80 ?  14 ARG A HE   5  
ATOM   2560 H HH11 . ARG A 1 14 ? -10.962 -1.997  7.418  1.00 2.60 ?  14 ARG A HH11 5  
ATOM   2561 H HH12 . ARG A 1 14 ? -9.873  -3.007  6.524  1.00 1.94 ?  14 ARG A HH12 5  
ATOM   2562 H HH21 . ARG A 1 14 ? -9.127  0.945   6.893  1.00 3.23 ?  14 ARG A HH21 5  
ATOM   2563 H HH22 . ARG A 1 14 ? -10.547 0.247   7.615  1.00 3.30 ?  14 ARG A HH22 5  
HETATM 2564 N N    . AIB A 1 15 ? -6.195  -6.117  1.858  1.00 0.31 ?  15 AIB A N    5  
HETATM 2565 C CA   . AIB A 1 15 ? -5.953  -7.544  1.623  1.00 0.33 ?  15 AIB A CA   5  
HETATM 2566 C C    . AIB A 1 15 ? -4.905  -7.724  0.519  1.00 0.30 ?  15 AIB A C    5  
HETATM 2567 O O    . AIB A 1 15 ? -3.967  -8.518  0.653  1.00 0.30 ?  15 AIB A O    5  
HETATM 2568 C CB1  . AIB A 1 15 ? -7.247  -8.207  1.199  1.00 0.37 ?  15 AIB A CB1  5  
HETATM 2569 C CB2  . AIB A 1 15 ? -5.498  -8.217  2.906  1.00 0.37 ?  15 AIB A CB2  5  
HETATM 2570 H H    . AIB A 1 15 ? -7.116  -5.780  1.791  1.00 0.31 ?  15 AIB A H    5  
HETATM 2571 H HB11 . AIB A 1 15 ? -7.987  -8.080  1.975  1.00 1.00 ?  15 AIB A HB11 5  
HETATM 2572 H HB12 . AIB A 1 15 ? -7.076  -9.261  1.033  1.00 1.13 ?  15 AIB A HB12 5  
HETATM 2573 H HB13 . AIB A 1 15 ? -7.600  -7.752  0.286  1.00 1.02 ?  15 AIB A HB13 5  
HETATM 2574 H HB21 . AIB A 1 15 ? -4.580  -7.760  3.243  1.00 1.07 ?  15 AIB A HB21 5  
HETATM 2575 H HB22 . AIB A 1 15 ? -5.332  -9.268  2.722  1.00 1.16 ?  15 AIB A HB22 5  
HETATM 2576 H HB23 . AIB A 1 15 ? -6.257  -8.098  3.663  1.00 1.01 ?  15 AIB A HB23 5  
ATOM   2577 N N    . ALA A 1 16 ? -5.053  -6.956  -0.554 1.00 0.27 ?  16 ALA A N    5  
ATOM   2578 C CA   . ALA A 1 16 ? -4.206  -7.109  -1.726 1.00 0.26 ?  16 ALA A CA   5  
ATOM   2579 C C    . ALA A 1 16 ? -2.819  -6.548  -1.462 1.00 0.23 ?  16 ALA A C    5  
ATOM   2580 O O    . ALA A 1 16 ? -1.831  -7.006  -2.036 1.00 0.25 ?  16 ALA A O    5  
ATOM   2581 C CB   . ALA A 1 16 ? -4.845  -6.427  -2.924 1.00 0.28 ?  16 ALA A CB   5  
ATOM   2582 H H    . ALA A 1 16 ? -5.729  -6.243  -0.543 1.00 0.27 ?  16 ALA A H    5  
ATOM   2583 H HA   . ALA A 1 16 ? -4.124  -8.164  -1.943 1.00 0.29 ?  16 ALA A HA   5  
ATOM   2584 H HB1  . ALA A 1 16 ? -5.781  -6.913  -3.158 1.00 0.90 ?  16 ALA A HB1  5  
ATOM   2585 H HB2  . ALA A 1 16 ? -4.182  -6.491  -3.774 1.00 0.96 ?  16 ALA A HB2  5  
ATOM   2586 H HB3  . ALA A 1 16 ? -5.031  -5.390  -2.687 1.00 0.89 ?  16 ALA A HB3  5  
ATOM   2587 N N    . PHE A 1 17 ? -2.751  -5.555  -0.590 1.00 0.20 ?  17 PHE A N    5  
ATOM   2588 C CA   . PHE A 1 17 ? -1.482  -4.984  -0.180 1.00 0.19 ?  17 PHE A CA   5  
ATOM   2589 C C    . PHE A 1 17 ? -0.715  -5.988  0.670  1.00 0.20 ?  17 PHE A C    5  
ATOM   2590 O O    . PHE A 1 17 ? 0.460   -6.255  0.427  1.00 0.20 ?  17 PHE A O    5  
ATOM   2591 C CB   . PHE A 1 17 ? -1.720  -3.697  0.605  1.00 0.22 ?  17 PHE A CB   5  
ATOM   2592 C CG   . PHE A 1 17 ? -0.471  -2.919  0.905  1.00 0.24 ?  17 PHE A CG   5  
ATOM   2593 C CD1  . PHE A 1 17 ? 0.099   -2.094  -0.052 1.00 0.28 ?  17 PHE A CD1  5  
ATOM   2594 C CD2  . PHE A 1 17 ? 0.140   -3.021  2.144  1.00 0.28 ?  17 PHE A CD2  5  
ATOM   2595 C CE1  . PHE A 1 17 ? 1.254   -1.388  0.224  1.00 0.33 ?  17 PHE A CE1  5  
ATOM   2596 C CE2  . PHE A 1 17 ? 1.292   -2.316  2.423  1.00 0.32 ?  17 PHE A CE2  5  
ATOM   2597 C CZ   . PHE A 1 17 ? 1.827   -1.459  1.455  1.00 0.33 ?  17 PHE A CZ   5  
ATOM   2598 H H    . PHE A 1 17 ? -3.586  -5.190  -0.215 1.00 0.21 ?  17 PHE A H    5  
ATOM   2599 H HA   . PHE A 1 17 ? -0.911  -4.759  -1.066 1.00 0.19 ?  17 PHE A HA   5  
ATOM   2600 H HB2  . PHE A 1 17 ? -2.375  -3.060  0.035  1.00 0.22 ?  17 PHE A HB2  5  
ATOM   2601 H HB3  . PHE A 1 17 ? -2.193  -3.941  1.543  1.00 0.24 ?  17 PHE A HB3  5  
ATOM   2602 H HD1  . PHE A 1 17 ? -0.371  -2.005  -1.021 1.00 0.30 ?  17 PHE A HD1  5  
ATOM   2603 H HD2  . PHE A 1 17 ? -0.293  -3.659  2.897  1.00 0.30 ?  17 PHE A HD2  5  
ATOM   2604 H HE1  . PHE A 1 17 ? 1.690   -0.749  -0.528 1.00 0.38 ?  17 PHE A HE1  5  
ATOM   2605 H HE2  . PHE A 1 17 ? 1.757   -2.405  3.393  1.00 0.36 ?  17 PHE A HE2  5  
ATOM   2606 H HZ   . PHE A 1 17 ? 2.723   -0.893  1.666  1.00 0.37 ?  17 PHE A HZ   5  
ATOM   2607 N N    . ALA A 1 18 ? -1.399  -6.563  1.651  1.00 0.23 ?  18 ALA A N    5  
ATOM   2608 C CA   . ALA A 1 18 ? -0.798  -7.566  2.518  1.00 0.25 ?  18 ALA A CA   5  
ATOM   2609 C C    . ALA A 1 18 ? -0.471  -8.835  1.735  1.00 0.23 ?  18 ALA A C    5  
ATOM   2610 O O    . ALA A 1 18 ? 0.382   -9.627  2.141  1.00 0.23 ?  18 ALA A O    5  
ATOM   2611 C CB   . ALA A 1 18 ? -1.717  -7.881  3.685  1.00 0.30 ?  18 ALA A CB   5  
ATOM   2612 H H    . ALA A 1 18 ? -2.335  -6.298  1.800  1.00 0.25 ?  18 ALA A H    5  
ATOM   2613 H HA   . ALA A 1 18 ? 0.120   -7.155  2.913  1.00 0.27 ?  18 ALA A HA   5  
ATOM   2614 H HB1  . ALA A 1 18 ? -1.961  -6.967  4.207  1.00 1.06 ?  18 ALA A HB1  5  
ATOM   2615 H HB2  . ALA A 1 18 ? -1.219  -8.560  4.362  1.00 0.87 ?  18 ALA A HB2  5  
ATOM   2616 H HB3  . ALA A 1 18 ? -2.622  -8.338  3.315  1.00 0.99 ?  18 ALA A HB3  5  
ATOM   2617 N N    . ASN A 1 19 ? -1.172  -9.030  0.623  1.00 0.24 ?  19 ASN A N    5  
ATOM   2618 C CA   . ASN A 1 19 ? -0.879  -10.130 -0.292 1.00 0.24 ?  19 ASN A CA   5  
ATOM   2619 C C    . ASN A 1 19 ? 0.496   -9.943  -0.926 1.00 0.19 ?  19 ASN A C    5  
ATOM   2620 O O    . ASN A 1 19 ? 1.167   -10.912 -1.285 1.00 0.22 ?  19 ASN A O    5  
ATOM   2621 C CB   . ASN A 1 19 ? -1.954  -10.214 -1.382 1.00 0.31 ?  19 ASN A CB   5  
ATOM   2622 C CG   . ASN A 1 19 ? -1.696  -11.331 -2.380 1.00 0.36 ?  19 ASN A CG   5  
ATOM   2623 O OD1  . ASN A 1 19 ? -1.040  -11.128 -3.403 1.00 1.14 ?  19 ASN A OD1  5  
ATOM   2624 N ND2  . ASN A 1 19 ? -2.215  -12.515 -2.097 1.00 1.08 ?  19 ASN A ND2  5  
ATOM   2625 H H    . ASN A 1 19 ? -1.922  -8.426  0.420  1.00 0.25 ?  19 ASN A H    5  
ATOM   2626 H HA   . ASN A 1 19 ? -0.880  -11.045 0.280  1.00 0.27 ?  19 ASN A HA   5  
ATOM   2627 H HB2  . ASN A 1 19 ? -2.914  -10.385 -0.918 1.00 0.38 ?  19 ASN A HB2  5  
ATOM   2628 H HB3  . ASN A 1 19 ? -1.984  -9.278  -1.920 1.00 0.32 ?  19 ASN A HB3  5  
ATOM   2629 H HD21 . ASN A 1 19 ? -2.734  -12.611 -1.268 1.00 1.83 ?  19 ASN A HD21 5  
ATOM   2630 H HD22 . ASN A 1 19 ? -2.062  -13.252 -2.727 1.00 1.08 ?  19 ASN A HD22 5  
ATOM   2631 N N    . LEU A 1 20 ? 0.918   -8.689  -1.042 1.00 0.17 ?  20 LEU A N    5  
ATOM   2632 C CA   . LEU A 1 20 ? 2.205   -8.366  -1.632 1.00 0.17 ?  20 LEU A CA   5  
ATOM   2633 C C    . LEU A 1 20 ? 3.334   -8.766  -0.693 1.00 0.17 ?  20 LEU A C    5  
ATOM   2634 O O    . LEU A 1 20 ? 3.144   -8.834  0.525  1.00 0.18 ?  20 LEU A O    5  
ATOM   2635 C CB   . LEU A 1 20 ? 2.290   -6.868  -1.927 1.00 0.20 ?  20 LEU A CB   5  
ATOM   2636 C CG   . LEU A 1 20 ? 1.313   -6.355  -2.982 1.00 0.29 ?  20 LEU A CG   5  
ATOM   2637 C CD1  . LEU A 1 20 ? 1.303   -4.837  -3.001 1.00 0.32 ?  20 LEU A CD1  5  
ATOM   2638 C CD2  . LEU A 1 20 ? 1.686   -6.898  -4.352 1.00 0.41 ?  20 LEU A CD2  5  
ATOM   2639 H H    . LEU A 1 20 ? 0.353   -7.960  -0.700 1.00 0.19 ?  20 LEU A H    5  
ATOM   2640 H HA   . LEU A 1 20 ? 2.297   -8.915  -2.554 1.00 0.22 ?  20 LEU A HA   5  
ATOM   2641 H HB2  . LEU A 1 20 ? 2.109   -6.332  -1.007 1.00 0.19 ?  20 LEU A HB2  5  
ATOM   2642 H HB3  . LEU A 1 20 ? 3.293   -6.648  -2.260 1.00 0.24 ?  20 LEU A HB3  5  
ATOM   2643 H HG   . LEU A 1 20 ? 0.318   -6.696  -2.741 1.00 0.33 ?  20 LEU A HG   5  
ATOM   2644 H HD11 . LEU A 1 20 ? 0.580   -4.491  -3.724 1.00 1.04 ?  20 LEU A HD11 5  
ATOM   2645 H HD12 . LEU A 1 20 ? 2.284   -4.474  -3.272 1.00 1.05 ?  20 LEU A HD12 5  
ATOM   2646 H HD13 . LEU A 1 20 ? 1.039   -4.465  -2.022 1.00 1.10 ?  20 LEU A HD13 5  
ATOM   2647 H HD21 . LEU A 1 20 ? 1.604   -7.974  -4.346 1.00 1.10 ?  20 LEU A HD21 5  
ATOM   2648 H HD22 . LEU A 1 20 ? 2.702   -6.616  -4.587 1.00 0.88 ?  20 LEU A HD22 5  
ATOM   2649 H HD23 . LEU A 1 20 ? 1.018   -6.490  -5.096 1.00 1.17 ?  20 LEU A HD23 5  
ATOM   2650 N N    . PRO A 1 21 ? 4.522   -9.053  -1.246 1.00 0.23 ?  21 PRO A N    5  
ATOM   2651 C CA   . PRO A 1 21 ? 5.701   -9.377  -0.447 1.00 0.29 ?  21 PRO A CA   5  
ATOM   2652 C C    . PRO A 1 21 ? 6.135   -8.200  0.415  1.00 0.26 ?  21 PRO A C    5  
ATOM   2653 O O    . PRO A 1 21 ? 5.897   -7.045  0.045  1.00 0.22 ?  21 PRO A O    5  
ATOM   2654 C CB   . PRO A 1 21 ? 6.783   -9.700  -1.483 1.00 0.38 ?  21 PRO A CB   5  
ATOM   2655 C CG   . PRO A 1 21 ? 6.055   -9.918  -2.766 1.00 0.43 ?  21 PRO A CG   5  
ATOM   2656 C CD   . PRO A 1 21 ? 4.808   -9.088  -2.688 1.00 0.30 ?  21 PRO A CD   5  
ATOM   2657 H HA   . PRO A 1 21 ? 5.528   -10.237 0.181  1.00 0.32 ?  21 PRO A HA   5  
ATOM   2658 H HB2  . PRO A 1 21 ? 7.470   -8.868  -1.556 1.00 0.43 ?  21 PRO A HB2  5  
ATOM   2659 H HB3  . PRO A 1 21 ? 7.320   -10.587 -1.178 1.00 0.48 ?  21 PRO A HB3  5  
ATOM   2660 H HG2  . PRO A 1 21 ? 6.667   -9.590  -3.594 1.00 0.63 ?  21 PRO A HG2  5  
ATOM   2661 H HG3  . PRO A 1 21 ? 5.804   -10.964 -2.873 1.00 0.61 ?  21 PRO A HG3  5  
ATOM   2662 H HD2  . PRO A 1 21 ? 4.991   -8.094  -3.067 1.00 0.40 ?  21 PRO A HD2  5  
ATOM   2663 H HD3  . PRO A 1 21 ? 4.002   -9.559  -3.231 1.00 0.39 ?  21 PRO A HD3  5  
ATOM   2664 N N    . LEU A 1 22 ? 6.764   -8.479  1.548  1.00 0.30 ?  22 LEU A N    5  
ATOM   2665 C CA   . LEU A 1 22 ? 7.111   -7.433  2.508  1.00 0.31 ?  22 LEU A CA   5  
ATOM   2666 C C    . LEU A 1 22 ? 7.874   -6.290  1.844  1.00 0.28 ?  22 LEU A C    5  
ATOM   2667 O O    . LEU A 1 22 ? 7.557   -5.119  2.057  1.00 0.28 ?  22 LEU A O    5  
ATOM   2668 C CB   . LEU A 1 22 ? 7.928   -8.011  3.667  1.00 0.41 ?  22 LEU A CB   5  
ATOM   2669 C CG   . LEU A 1 22 ? 7.164   -8.955  4.600  1.00 1.07 ?  22 LEU A CG   5  
ATOM   2670 C CD1  . LEU A 1 22 ? 8.097   -9.530  5.652  1.00 1.64 ?  22 LEU A CD1  5  
ATOM   2671 C CD2  . LEU A 1 22 ? 5.999   -8.230  5.261  1.00 1.54 ?  22 LEU A CD2  5  
ATOM   2672 H H    . LEU A 1 22 ? 7.008   -9.410  1.742  1.00 0.34 ?  22 LEU A H    5  
ATOM   2673 H HA   . LEU A 1 22 ? 6.188   -7.037  2.900  1.00 0.30 ?  22 LEU A HA   5  
ATOM   2674 H HB2  . LEU A 1 22 ? 8.764   -8.553  3.252  1.00 1.00 ?  22 LEU A HB2  5  
ATOM   2675 H HB3  . LEU A 1 22 ? 8.309   -7.190  4.255  1.00 0.94 ?  22 LEU A HB3  5  
ATOM   2676 H HG   . LEU A 1 22 ? 6.764   -9.778  4.025  1.00 1.97 ?  22 LEU A HG   5  
ATOM   2677 H HD11 . LEU A 1 22 ? 7.544   -10.200 6.295  1.00 2.16 ?  22 LEU A HD11 5  
ATOM   2678 H HD12 . LEU A 1 22 ? 8.513   -8.727  6.242  1.00 1.77 ?  22 LEU A HD12 5  
ATOM   2679 H HD13 . LEU A 1 22 ? 8.894   -10.072 5.167  1.00 2.26 ?  22 LEU A HD13 5  
ATOM   2680 H HD21 . LEU A 1 22 ? 6.360   -7.336  5.748  1.00 2.09 ?  22 LEU A HD21 5  
ATOM   2681 H HD22 . LEU A 1 22 ? 5.544   -8.879  5.995  1.00 1.81 ?  22 LEU A HD22 5  
ATOM   2682 H HD23 . LEU A 1 22 ? 5.268   -7.965  4.514  1.00 2.05 ?  22 LEU A HD23 5  
ATOM   2683 N N    . TRP A 1 23 ? 8.848   -6.634  1.007  1.00 0.33 ?  23 TRP A N    5  
ATOM   2684 C CA   . TRP A 1 23 ? 9.655   -5.629  0.330  1.00 0.34 ?  23 TRP A CA   5  
ATOM   2685 C C    . TRP A 1 23 ? 8.805   -4.750  -0.585 1.00 0.27 ?  23 TRP A C    5  
ATOM   2686 O O    . TRP A 1 23 ? 9.111   -3.579  -0.784 1.00 0.25 ?  23 TRP A O    5  
ATOM   2687 C CB   . TRP A 1 23 ? 10.793  -6.283  -0.465 1.00 0.42 ?  23 TRP A CB   5  
ATOM   2688 C CG   . TRP A 1 23 ? 10.346  -7.173  -1.588 1.00 0.48 ?  23 TRP A CG   5  
ATOM   2689 C CD1  . TRP A 1 23 ? 10.134  -8.520  -1.534 1.00 0.56 ?  23 TRP A CD1  5  
ATOM   2690 C CD2  . TRP A 1 23 ? 10.070  -6.779  -2.938 1.00 0.51 ?  23 TRP A CD2  5  
ATOM   2691 N NE1  . TRP A 1 23 ? 9.744   -8.986  -2.765 1.00 0.62 ?  23 TRP A NE1  5  
ATOM   2692 C CE2  . TRP A 1 23 ? 9.695   -7.936  -3.642 1.00 0.60 ?  23 TRP A CE2  5  
ATOM   2693 C CE3  . TRP A 1 23 ? 10.102  -5.558  -3.617 1.00 0.49 ?  23 TRP A CE3  5  
ATOM   2694 C CZ2  . TRP A 1 23 ? 9.356   -7.910  -4.990 1.00 0.68 ?  23 TRP A CZ2  5  
ATOM   2695 C CZ3  . TRP A 1 23 ? 9.764   -5.533  -4.956 1.00 0.59 ?  23 TRP A CZ3  5  
ATOM   2696 C CH2  . TRP A 1 23 ? 9.395   -6.702  -5.629 1.00 0.68 ?  23 TRP A CH2  5  
ATOM   2697 H H    . TRP A 1 23 ? 9.034   -7.584  0.852  1.00 0.37 ?  23 TRP A H    5  
ATOM   2698 H HA   . TRP A 1 23 ? 10.088  -5.000  1.093  1.00 0.35 ?  23 TRP A HA   5  
ATOM   2699 H HB2  . TRP A 1 23 ? 11.408  -5.508  -0.891 1.00 0.42 ?  23 TRP A HB2  5  
ATOM   2700 H HB3  . TRP A 1 23 ? 11.394  -6.875  0.208  1.00 0.48 ?  23 TRP A HB3  5  
ATOM   2701 H HD1  . TRP A 1 23 ? 10.259  -9.119  -0.644 1.00 0.59 ?  23 TRP A HD1  5  
ATOM   2702 H HE1  . TRP A 1 23 ? 9.535   -9.922  -2.983 1.00 0.69 ?  23 TRP A HE1  5  
ATOM   2703 H HE3  . TRP A 1 23 ? 10.382  -4.645  -3.112 1.00 0.44 ?  23 TRP A HE3  5  
ATOM   2704 H HZ2  . TRP A 1 23 ? 9.070   -8.802  -5.525 1.00 0.76 ?  23 TRP A HZ2  5  
ATOM   2705 H HZ3  . TRP A 1 23 ? 9.782   -4.599  -5.497 1.00 0.61 ?  23 TRP A HZ3  5  
ATOM   2706 H HH2  . TRP A 1 23 ? 9.140   -6.635  -6.676 1.00 0.76 ?  23 TRP A HH2  5  
ATOM   2707 N N    . LYS A 1 24 ? 7.727   -5.309  -1.127 1.00 0.24 ?  24 LYS A N    5  
ATOM   2708 C CA   . LYS A 1 24 ? 6.867   -4.558  -2.027 1.00 0.22 ?  24 LYS A CA   5  
ATOM   2709 C C    . LYS A 1 24 ? 5.959   -3.642  -1.224 1.00 0.14 ?  24 LYS A C    5  
ATOM   2710 O O    . LYS A 1 24 ? 5.673   -2.519  -1.635 1.00 0.15 ?  24 LYS A O    5  
ATOM   2711 C CB   . LYS A 1 24 ? 6.035   -5.496  -2.905 1.00 0.26 ?  24 LYS A CB   5  
ATOM   2712 C CG   . LYS A 1 24 ? 5.183   -4.770  -3.939 1.00 0.35 ?  24 LYS A CG   5  
ATOM   2713 C CD   . LYS A 1 24 ? 6.043   -3.963  -4.900 1.00 0.97 ?  24 LYS A CD   5  
ATOM   2714 C CE   . LYS A 1 24 ? 5.207   -3.257  -5.957 1.00 0.98 ?  24 LYS A CE   5  
ATOM   2715 N NZ   . LYS A 1 24 ? 4.583   -4.211  -6.911 1.00 1.37 1  24 LYS A NZ   5  
ATOM   2716 H H    . LYS A 1 24 ? 7.496   -6.236  -0.898 1.00 0.26 ?  24 LYS A H    5  
ATOM   2717 H HA   . LYS A 1 24 ? 7.501   -3.952  -2.658 1.00 0.25 ?  24 LYS A HA   5  
ATOM   2718 H HB2  . LYS A 1 24 ? 6.704   -6.165  -3.428 1.00 0.33 ?  24 LYS A HB2  5  
ATOM   2719 H HB3  . LYS A 1 24 ? 5.381   -6.076  -2.272 1.00 0.24 ?  24 LYS A HB3  5  
ATOM   2720 H HG2  . LYS A 1 24 ? 4.615   -5.495  -4.501 1.00 0.83 ?  24 LYS A HG2  5  
ATOM   2721 H HG3  . LYS A 1 24 ? 4.507   -4.099  -3.425 1.00 0.96 ?  24 LYS A HG3  5  
ATOM   2722 H HD2  . LYS A 1 24 ? 6.592   -3.222  -4.339 1.00 1.51 ?  24 LYS A HD2  5  
ATOM   2723 H HD3  . LYS A 1 24 ? 6.736   -4.630  -5.389 1.00 1.43 ?  24 LYS A HD3  5  
ATOM   2724 H HE2  . LYS A 1 24 ? 4.428   -2.696  -5.465 1.00 1.17 ?  24 LYS A HE2  5  
ATOM   2725 H HE3  . LYS A 1 24 ? 5.845   -2.579  -6.504 1.00 1.36 ?  24 LYS A HE3  5  
ATOM   2726 H HZ1  . LYS A 1 24 ? 5.320   -4.747  -7.415 1.00 1.91 ?  24 LYS A HZ1  5  
ATOM   2727 H HZ2  . LYS A 1 24 ? 4.010   -3.697  -7.610 1.00 1.69 ?  24 LYS A HZ2  5  
ATOM   2728 H HZ3  . LYS A 1 24 ? 3.970   -4.880  -6.404 1.00 1.76 ?  24 LYS A HZ3  5  
ATOM   2729 N N    . GLN A 1 25 ? 5.511   -4.133  -0.075 1.00 0.11 ?  25 GLN A N    5  
ATOM   2730 C CA   . GLN A 1 25 ? 4.741   -3.319  0.856  1.00 0.09 ?  25 GLN A CA   5  
ATOM   2731 C C    . GLN A 1 25 ? 5.564   -2.115  1.296  1.00 0.09 ?  25 GLN A C    5  
ATOM   2732 O O    . GLN A 1 25 ? 5.090   -0.979  1.276  1.00 0.12 ?  25 GLN A O    5  
ATOM   2733 C CB   . GLN A 1 25 ? 4.335   -4.139  2.078  1.00 0.14 ?  25 GLN A CB   5  
ATOM   2734 C CG   . GLN A 1 25 ? 3.394   -5.288  1.766  1.00 0.16 ?  25 GLN A CG   5  
ATOM   2735 C CD   . GLN A 1 25 ? 3.012   -6.079  3.001  1.00 0.22 ?  25 GLN A CD   5  
ATOM   2736 O OE1  . GLN A 1 25 ? 2.954   -5.541  4.108  1.00 0.41 ?  25 GLN A OE1  5  
ATOM   2737 N NE2  . GLN A 1 25 ? 2.750   -7.362  2.824  1.00 0.24 ?  25 GLN A NE2  5  
ATOM   2738 H H    . GLN A 1 25 ? 5.699   -5.073  0.150  1.00 0.15 ?  25 GLN A H    5  
ATOM   2739 H HA   . GLN A 1 25 ? 3.852   -2.973  0.346  1.00 0.10 ?  25 GLN A HA   5  
ATOM   2740 H HB2  . GLN A 1 25 ? 5.223   -4.545  2.536  1.00 0.22 ?  25 GLN A HB2  5  
ATOM   2741 H HB3  . GLN A 1 25 ? 3.845   -3.487  2.783  1.00 0.18 ?  25 GLN A HB3  5  
ATOM   2742 H HG2  . GLN A 1 25 ? 2.496   -4.887  1.324  1.00 0.18 ?  25 GLN A HG2  5  
ATOM   2743 H HG3  . GLN A 1 25 ? 3.877   -5.952  1.063  1.00 0.21 ?  25 GLN A HG3  5  
ATOM   2744 H HE21 . GLN A 1 25 ? 2.813   -7.730  1.911  1.00 0.33 ?  25 GLN A HE21 5  
ATOM   2745 H HE22 . GLN A 1 25 ? 2.509   -7.897  3.609  1.00 0.27 ?  25 GLN A HE22 5  
ATOM   2746 N N    . GLN A 1 26 ? 6.808   -2.378  1.680  1.00 0.14 ?  26 GLN A N    5  
ATOM   2747 C CA   . GLN A 1 26 ? 7.731   -1.325  2.084  1.00 0.18 ?  26 GLN A CA   5  
ATOM   2748 C C    . GLN A 1 26 ? 8.016   -0.385  0.920  1.00 0.18 ?  26 GLN A C    5  
ATOM   2749 O O    . GLN A 1 26 ? 8.074   0.830   1.093  1.00 0.25 ?  26 GLN A O    5  
ATOM   2750 C CB   . GLN A 1 26 ? 9.045   -1.920  2.583  1.00 0.28 ?  26 GLN A CB   5  
ATOM   2751 C CG   . GLN A 1 26 ? 8.902   -2.808  3.807  1.00 0.38 ?  26 GLN A CG   5  
ATOM   2752 C CD   . GLN A 1 26 ? 10.234  -3.367  4.269  1.00 0.90 ?  26 GLN A CD   5  
ATOM   2753 O OE1  . GLN A 1 26 ? 10.304  -4.471  4.813  1.00 1.46 ?  26 GLN A OE1  5  
ATOM   2754 N NE2  . GLN A 1 26 ? 11.303  -2.613  4.055  1.00 1.59 ?  26 GLN A NE2  5  
ATOM   2755 H H    . GLN A 1 26 ? 7.111   -3.313  1.700  1.00 0.18 ?  26 GLN A H    5  
ATOM   2756 H HA   . GLN A 1 26 ? 7.271   -0.765  2.882  1.00 0.21 ?  26 GLN A HA   5  
ATOM   2757 H HB2  . GLN A 1 26 ? 9.482   -2.506  1.791  1.00 0.31 ?  26 GLN A HB2  5  
ATOM   2758 H HB3  . GLN A 1 26 ? 9.716   -1.114  2.829  1.00 0.31 ?  26 GLN A HB3  5  
ATOM   2759 H HG2  . GLN A 1 26 ? 8.472   -2.229  4.611  1.00 0.76 ?  26 GLN A HG2  5  
ATOM   2760 H HG3  . GLN A 1 26 ? 8.246   -3.632  3.568  1.00 0.60 ?  26 GLN A HG3  5  
ATOM   2761 H HE21 . GLN A 1 26 ? 11.180  -1.744  3.618  1.00 1.96 ?  26 GLN A HE21 5  
ATOM   2762 H HE22 . GLN A 1 26 ? 12.178  -2.954  4.342  1.00 1.99 ?  26 GLN A HE22 5  
ATOM   2763 N N    . ASN A 1 27 ? 8.199   -0.961  -0.263 1.00 0.19 ?  27 ASN A N    5  
ATOM   2764 C CA   . ASN A 1 27 ? 8.455   -0.189  -1.474 1.00 0.26 ?  27 ASN A CA   5  
ATOM   2765 C C    . ASN A 1 27 ? 7.313   0.788   -1.734 1.00 0.22 ?  27 ASN A C    5  
ATOM   2766 O O    . ASN A 1 27 ? 7.540   1.975   -1.952 1.00 0.25 ?  27 ASN A O    5  
ATOM   2767 C CB   . ASN A 1 27 ? 8.636   -1.141  -2.667 1.00 0.38 ?  27 ASN A CB   5  
ATOM   2768 C CG   . ASN A 1 27 ? 9.045   -0.449  -3.962 1.00 0.98 ?  27 ASN A CG   5  
ATOM   2769 O OD1  . ASN A 1 27 ? 8.666   0.688   -4.240 1.00 1.81 ?  27 ASN A OD1  5  
ATOM   2770 N ND2  . ASN A 1 27 ? 9.831   -1.143  -4.767 1.00 1.18 ?  27 ASN A ND2  5  
ATOM   2771 H H    . ASN A 1 27 ? 8.174   -1.942  -0.322 1.00 0.20 ?  27 ASN A H    5  
ATOM   2772 H HA   . ASN A 1 27 ? 9.365   0.369   -1.326 1.00 0.34 ?  27 ASN A HA   5  
ATOM   2773 H HB2  . ASN A 1 27 ? 9.398   -1.863  -2.421 1.00 0.77 ?  27 ASN A HB2  5  
ATOM   2774 H HB3  . ASN A 1 27 ? 7.705   -1.660  -2.840 1.00 0.92 ?  27 ASN A HB3  5  
ATOM   2775 H HD21 . ASN A 1 27 ? 10.101  -2.046  -4.489 1.00 1.16 ?  27 ASN A HD21 5  
ATOM   2776 H HD22 . ASN A 1 27 ? 10.119  -0.728  -5.607 1.00 1.75 ?  27 ASN A HD22 5  
ATOM   2777 N N    . LEU A 1 28 ? 6.088   0.283   -1.678 1.00 0.19 ?  28 LEU A N    5  
ATOM   2778 C CA   . LEU A 1 28 ? 4.905   1.099   -1.917 1.00 0.24 ?  28 LEU A CA   5  
ATOM   2779 C C    . LEU A 1 28 ? 4.722   2.150   -0.827 1.00 0.24 ?  28 LEU A C    5  
ATOM   2780 O O    . LEU A 1 28 ? 4.410   3.307   -1.117 1.00 0.29 ?  28 LEU A O    5  
ATOM   2781 C CB   . LEU A 1 28 ? 3.664   0.216   -2.001 1.00 0.28 ?  28 LEU A CB   5  
ATOM   2782 C CG   . LEU A 1 28 ? 3.560   -0.653  -3.254 1.00 0.38 ?  28 LEU A CG   5  
ATOM   2783 C CD1  . LEU A 1 28 ? 2.320   -1.525  -3.191 1.00 0.88 ?  28 LEU A CD1  5  
ATOM   2784 C CD2  . LEU A 1 28 ? 3.531   0.211   -4.504 1.00 0.72 ?  28 LEU A CD2  5  
ATOM   2785 H H    . LEU A 1 28 ? 5.973   -0.673  -1.470 1.00 0.18 ?  28 LEU A H    5  
ATOM   2786 H HA   . LEU A 1 28 ? 5.041   1.602   -2.860 1.00 0.30 ?  28 LEU A HA   5  
ATOM   2787 H HB2  . LEU A 1 28 ? 3.656   -0.432  -1.138 1.00 0.28 ?  28 LEU A HB2  5  
ATOM   2788 H HB3  . LEU A 1 28 ? 2.796   0.850   -1.957 1.00 0.33 ?  28 LEU A HB3  5  
ATOM   2789 H HG   . LEU A 1 28 ? 4.422   -1.300  -3.311 1.00 0.78 ?  28 LEU A HG   5  
ATOM   2790 H HD11 . LEU A 1 28 ? 2.234   -2.096  -4.104 1.00 1.30 ?  28 LEU A HD11 5  
ATOM   2791 H HD12 . LEU A 1 28 ? 1.447   -0.900  -3.074 1.00 1.54 ?  28 LEU A HD12 5  
ATOM   2792 H HD13 . LEU A 1 28 ? 2.395   -2.201  -2.352 1.00 1.23 ?  28 LEU A HD13 5  
ATOM   2793 H HD21 . LEU A 1 28 ? 3.386   -0.416  -5.371 1.00 1.32 ?  28 LEU A HD21 5  
ATOM   2794 H HD22 . LEU A 1 28 ? 4.466   0.742   -4.598 1.00 1.40 ?  28 LEU A HD22 5  
ATOM   2795 H HD23 . LEU A 1 28 ? 2.719   0.919   -4.431 1.00 1.20 ?  28 LEU A HD23 5  
ATOM   2796 N N    . LYS A 1 29 ? 4.913   1.741   0.422  1.00 0.24 ?  29 LYS A N    5  
ATOM   2797 C CA   . LYS A 1 29 ? 4.796   2.652   1.553  1.00 0.32 ?  29 LYS A CA   5  
ATOM   2798 C C    . LYS A 1 29 ? 5.817   3.780   1.436  1.00 0.34 ?  29 LYS A C    5  
ATOM   2799 O O    . LYS A 1 29 ? 5.504   4.946   1.685  1.00 0.40 ?  29 LYS A O    5  
ATOM   2800 C CB   . LYS A 1 29 ? 4.987   1.891   2.869  1.00 0.42 ?  29 LYS A CB   5  
ATOM   2801 C CG   . LYS A 1 29 ? 4.819   2.753   4.110  1.00 0.71 ?  29 LYS A CG   5  
ATOM   2802 C CD   . LYS A 1 29 ? 3.375   3.197   4.313  1.00 1.19 ?  29 LYS A CD   5  
ATOM   2803 C CE   . LYS A 1 29 ? 2.481   2.042   4.745  1.00 1.23 ?  29 LYS A CE   5  
ATOM   2804 N NZ   . LYS A 1 29 ? 1.107   2.499   5.077  1.00 1.39 1  29 LYS A NZ   5  
ATOM   2805 H H    . LYS A 1 29 ? 5.132   0.795   0.587  1.00 0.22 ?  29 LYS A H    5  
ATOM   2806 H HA   . LYS A 1 29 ? 3.804   3.078   1.533  1.00 0.36 ?  29 LYS A HA   5  
ATOM   2807 H HB2  . LYS A 1 29 ? 4.262   1.093   2.914  1.00 0.78 ?  29 LYS A HB2  5  
ATOM   2808 H HB3  . LYS A 1 29 ? 5.981   1.465   2.883  1.00 0.60 ?  29 LYS A HB3  5  
ATOM   2809 H HG2  . LYS A 1 29 ? 5.130   2.183   4.971  1.00 1.23 ?  29 LYS A HG2  5  
ATOM   2810 H HG3  . LYS A 1 29 ? 5.444   3.628   4.013  1.00 1.29 ?  29 LYS A HG3  5  
ATOM   2811 H HD2  . LYS A 1 29 ? 3.348   3.960   5.076  1.00 1.64 ?  29 LYS A HD2  5  
ATOM   2812 H HD3  . LYS A 1 29 ? 3.000   3.600   3.384  1.00 1.75 ?  29 LYS A HD3  5  
ATOM   2813 H HE2  . LYS A 1 29 ? 2.423   1.324   3.940  1.00 1.53 ?  29 LYS A HE2  5  
ATOM   2814 H HE3  . LYS A 1 29 ? 2.916   1.572   5.615  1.00 1.48 ?  29 LYS A HE3  5  
ATOM   2815 H HZ1  . LYS A 1 29 ? 0.657   2.932   4.247  1.00 2.04 ?  29 LYS A HZ1  5  
ATOM   2816 H HZ2  . LYS A 1 29 ? 1.139   3.198   5.844  1.00 1.56 ?  29 LYS A HZ2  5  
ATOM   2817 H HZ3  . LYS A 1 29 ? 0.528   1.693   5.389  1.00 1.51 ?  29 LYS A HZ3  5  
ATOM   2818 N N    . LYS A 1 30 ? 7.033   3.424   1.038  1.00 0.34 ?  30 LYS A N    5  
ATOM   2819 C CA   . LYS A 1 30 ? 8.088   4.403   0.819  1.00 0.43 ?  30 LYS A CA   5  
ATOM   2820 C C    . LYS A 1 30 ? 7.724   5.314   -0.346 1.00 0.42 ?  30 LYS A C    5  
ATOM   2821 O O    . LYS A 1 30 ? 7.871   6.526   -0.260 1.00 0.47 ?  30 LYS A O    5  
ATOM   2822 C CB   . LYS A 1 30 ? 9.423   3.702   0.542  1.00 0.54 ?  30 LYS A CB   5  
ATOM   2823 C CG   . LYS A 1 30 ? 10.587  4.663   0.330  1.00 1.28 ?  30 LYS A CG   5  
ATOM   2824 C CD   . LYS A 1 30 ? 11.885  3.924   0.030  1.00 1.67 ?  30 LYS A CD   5  
ATOM   2825 C CE   . LYS A 1 30 ? 12.259  2.968   1.152  1.00 2.49 ?  30 LYS A CE   5  
ATOM   2826 N NZ   . LYS A 1 30 ? 13.529  2.247   0.879  1.00 3.14 1  30 LYS A NZ   5  
ATOM   2827 H H    . LYS A 1 30 ? 7.229   2.471   0.892  1.00 0.33 ?  30 LYS A H    5  
ATOM   2828 H HA   . LYS A 1 30 ? 8.180   5.000   1.713  1.00 0.48 ?  30 LYS A HA   5  
ATOM   2829 H HB2  . LYS A 1 30 ? 9.659   3.065   1.381  1.00 0.89 ?  30 LYS A HB2  5  
ATOM   2830 H HB3  . LYS A 1 30 ? 9.321   3.093   -0.345 1.00 1.06 ?  30 LYS A HB3  5  
ATOM   2831 H HG2  . LYS A 1 30 ? 10.356  5.312   -0.500 1.00 1.89 ?  30 LYS A HG2  5  
ATOM   2832 H HG3  . LYS A 1 30 ? 10.718  5.255   1.224  1.00 1.85 ?  30 LYS A HG3  5  
ATOM   2833 H HD2  . LYS A 1 30 ? 11.764  3.362   -0.883 1.00 2.02 ?  30 LYS A HD2  5  
ATOM   2834 H HD3  . LYS A 1 30 ? 12.677  4.648   -0.094 1.00 1.96 ?  30 LYS A HD3  5  
ATOM   2835 H HE2  . LYS A 1 30 ? 12.369  3.532   2.065  1.00 2.89 ?  30 LYS A HE2  5  
ATOM   2836 H HE3  . LYS A 1 30 ? 11.465  2.246   1.271  1.00 2.91 ?  30 LYS A HE3  5  
ATOM   2837 H HZ1  . LYS A 1 30 ? 13.751  1.604   1.663  1.00 3.57 ?  30 LYS A HZ1  5  
ATOM   2838 H HZ2  . LYS A 1 30 ? 14.310  2.923   0.772  1.00 3.62 ?  30 LYS A HZ2  5  
ATOM   2839 H HZ3  . LYS A 1 30 ? 13.445  1.691   0.003  1.00 3.29 ?  30 LYS A HZ3  5  
ATOM   2840 N N    . GLU A 1 31 ? 7.231   4.711   -1.418 1.00 0.42 ?  31 GLU A N    5  
ATOM   2841 C CA   . GLU A 1 31 ? 6.828   5.440   -2.613 1.00 0.49 ?  31 GLU A CA   5  
ATOM   2842 C C    . GLU A 1 31 ? 5.738   6.462   -2.298 1.00 0.52 ?  31 GLU A C    5  
ATOM   2843 O O    . GLU A 1 31 ? 5.684   7.540   -2.894 1.00 0.70 ?  31 GLU A O    5  
ATOM   2844 C CB   . GLU A 1 31 ? 6.318   4.450   -3.663 1.00 0.52 ?  31 GLU A CB   5  
ATOM   2845 C CG   . GLU A 1 31 ? 5.845   5.097   -4.952 1.00 0.87 ?  31 GLU A CG   5  
ATOM   2846 C CD   . GLU A 1 31 ? 5.155   4.113   -5.871 1.00 1.47 ?  31 GLU A CD   5  
ATOM   2847 O OE1  . GLU A 1 31 ? 5.855   3.460   -6.673 1.00 1.67 ?  31 GLU A OE1  5  
ATOM   2848 O OE2  . GLU A 1 31 ? 3.914   3.991   -5.796 1.00 2.30 -1 31 GLU A OE2  5  
ATOM   2849 H H    . GLU A 1 31 ? 7.140   3.731   -1.409 1.00 0.41 ?  31 GLU A H    5  
ATOM   2850 H HA   . GLU A 1 31 ? 7.692   5.955   -3.001 1.00 0.57 ?  31 GLU A HA   5  
ATOM   2851 H HB2  . GLU A 1 31 ? 7.112   3.761   -3.905 1.00 0.87 ?  31 GLU A HB2  5  
ATOM   2852 H HB3  . GLU A 1 31 ? 5.492   3.895   -3.242 1.00 0.80 ?  31 GLU A HB3  5  
ATOM   2853 H HG2  . GLU A 1 31 ? 5.153   5.888   -4.712 1.00 1.45 ?  31 GLU A HG2  5  
ATOM   2854 H HG3  . GLU A 1 31 ? 6.697   5.511   -5.467 1.00 1.49 ?  31 GLU A HG3  5  
ATOM   2855 N N    . LYS A 1 32 ? 4.867   6.116   -1.364 1.00 0.43 ?  32 LYS A N    5  
ATOM   2856 C CA   . LYS A 1 32 ? 3.740   6.969   -1.031 1.00 0.55 ?  32 LYS A CA   5  
ATOM   2857 C C    . LYS A 1 32 ? 4.080   7.961   0.080  1.00 0.66 ?  32 LYS A C    5  
ATOM   2858 O O    . LYS A 1 32 ? 4.118   9.168   -0.147 1.00 1.23 ?  32 LYS A O    5  
ATOM   2859 C CB   . LYS A 1 32 ? 2.542   6.120   -0.613 1.00 0.74 ?  32 LYS A CB   5  
ATOM   2860 C CG   . LYS A 1 32 ? 1.252   6.915   -0.498 1.00 1.46 ?  32 LYS A CG   5  
ATOM   2861 C CD   . LYS A 1 32 ? 0.804   7.458   -1.849 1.00 2.20 ?  32 LYS A CD   5  
ATOM   2862 C CE   . LYS A 1 32 ? 0.552   6.334   -2.842 1.00 3.14 ?  32 LYS A CE   5  
ATOM   2863 N NZ   . LYS A 1 32 ? 0.104   6.844   -4.163 1.00 3.91 1  32 LYS A NZ   5  
ATOM   2864 H H    . LYS A 1 32 ? 4.978   5.256   -0.900 1.00 0.38 ?  32 LYS A H    5  
ATOM   2865 H HA   . LYS A 1 32 ? 3.477   7.524   -1.917 1.00 0.79 ?  32 LYS A HA   5  
ATOM   2866 H HB2  . LYS A 1 32 ? 2.397   5.337   -1.342 1.00 1.02 ?  32 LYS A HB2  5  
ATOM   2867 H HB3  . LYS A 1 32 ? 2.750   5.671   0.347  1.00 1.25 ?  32 LYS A HB3  5  
ATOM   2868 H HG2  . LYS A 1 32 ? 0.480   6.274   -0.103 1.00 2.11 ?  32 LYS A HG2  5  
ATOM   2869 H HG3  . LYS A 1 32 ? 1.415   7.744   0.175  1.00 1.77 ?  32 LYS A HG3  5  
ATOM   2870 H HD2  . LYS A 1 32 ? -0.108  8.018   -1.716 1.00 2.36 ?  32 LYS A HD2  5  
ATOM   2871 H HD3  . LYS A 1 32 ? 1.573   8.107   -2.239 1.00 2.67 ?  32 LYS A HD3  5  
ATOM   2872 H HE2  . LYS A 1 32 ? 1.468   5.782   -2.978 1.00 3.54 ?  32 LYS A HE2  5  
ATOM   2873 H HE3  . LYS A 1 32 ? -0.206  5.679   -2.441 1.00 3.37 ?  32 LYS A HE3  5  
ATOM   2874 H HZ1  . LYS A 1 32 ? -0.756  7.415   -4.056 1.00 3.96 ?  32 LYS A HZ1  5  
ATOM   2875 H HZ2  . LYS A 1 32 ? -0.101  6.048   -4.800 1.00 4.35 ?  32 LYS A HZ2  5  
ATOM   2876 H HZ3  . LYS A 1 32 ? 0.847   7.429   -4.594 1.00 4.36 ?  32 LYS A HZ3  5  
ATOM   2877 N N    . GLY A 1 33 ? 4.338   7.443   1.272  1.00 0.94 ?  33 GLY A N    5  
ATOM   2878 C CA   . GLY A 1 33 ? 4.477   8.294   2.440  1.00 1.34 ?  33 GLY A CA   5  
ATOM   2879 C C    . GLY A 1 33 ? 5.828   8.975   2.550  1.00 1.43 ?  33 GLY A C    5  
ATOM   2880 O O    . GLY A 1 33 ? 5.925   10.085  3.073  1.00 1.99 ?  33 GLY A O    5  
ATOM   2881 H H    . GLY A 1 33 ? 4.438   6.471   1.364  1.00 1.26 ?  33 GLY A H    5  
ATOM   2882 H HA2  . GLY A 1 33 ? 3.713   9.054   2.404  1.00 1.68 ?  33 GLY A HA2  5  
ATOM   2883 H HA3  . GLY A 1 33 ? 4.322   7.693   3.323  1.00 1.72 ?  33 GLY A HA3  5  
ATOM   2884 N N    . LEU A 1 34 ? 6.872   8.323   2.061  1.00 1.27 ?  34 LEU A N    5  
ATOM   2885 C CA   . LEU A 1 34 ? 8.223   8.847   2.212  1.00 1.73 ?  34 LEU A CA   5  
ATOM   2886 C C    . LEU A 1 34 ? 8.665   9.639   0.983  1.00 1.86 ?  34 LEU A C    5  
ATOM   2887 O O    . LEU A 1 34 ? 8.585   10.871  0.959  1.00 2.56 ?  34 LEU A O    5  
ATOM   2888 C CB   . LEU A 1 34 ? 9.210   7.709   2.493  1.00 1.91 ?  34 LEU A CB   5  
ATOM   2889 C CG   . LEU A 1 34 ? 8.960   6.922   3.782  1.00 2.29 ?  34 LEU A CG   5  
ATOM   2890 C CD1  . LEU A 1 34 ? 9.985   5.811   3.933  1.00 2.76 ?  34 LEU A CD1  5  
ATOM   2891 C CD2  . LEU A 1 34 ? 8.998   7.844   4.989  1.00 3.08 ?  34 LEU A CD2  5  
ATOM   2892 H H    . LEU A 1 34 ? 6.734   7.478   1.586  1.00 1.11 ?  34 LEU A H    5  
ATOM   2893 H HA   . LEU A 1 34 ? 8.217   9.513   3.059  1.00 2.15 ?  34 LEU A HA   5  
ATOM   2894 H HB2  . LEU A 1 34 ? 9.173   7.018   1.663  1.00 2.24 ?  34 LEU A HB2  5  
ATOM   2895 H HB3  . LEU A 1 34 ? 10.204  8.128   2.543  1.00 2.03 ?  34 LEU A HB3  5  
ATOM   2896 H HG   . LEU A 1 34 ? 7.981   6.470   3.735  1.00 2.45 ?  34 LEU A HG   5  
ATOM   2897 H HD11 . LEU A 1 34 ? 9.876   5.107   3.122  1.00 3.05 ?  34 LEU A HD11 5  
ATOM   2898 H HD12 . LEU A 1 34 ? 9.830   5.303   4.874  1.00 3.27 ?  34 LEU A HD12 5  
ATOM   2899 H HD13 . LEU A 1 34 ? 10.979  6.233   3.912  1.00 2.92 ?  34 LEU A HD13 5  
ATOM   2900 H HD21 . LEU A 1 34 ? 8.195   8.562   4.920  1.00 3.53 ?  34 LEU A HD21 5  
ATOM   2901 H HD22 . LEU A 1 34 ? 9.945   8.364   5.014  1.00 3.41 ?  34 LEU A HD22 5  
ATOM   2902 H HD23 . LEU A 1 34 ? 8.884   7.262   5.891  1.00 3.42 ?  34 LEU A HD23 5  
ATOM   2903 N N    . PHE A 1 35 ? 9.110   8.923   -0.036 1.00 1.42 ?  35 PHE A N    5  
ATOM   2904 C CA   . PHE A 1 35 ? 9.671   9.531   -1.228 1.00 1.78 ?  35 PHE A CA   5  
ATOM   2905 C C    . PHE A 1 35 ? 9.061   8.898   -2.470 1.00 2.17 ?  35 PHE A C    5  
ATOM   2906 O O    . PHE A 1 35 ? 9.584   7.925   -3.011 1.00 2.84 ?  35 PHE A O    5  
ATOM   2907 C CB   . PHE A 1 35 ? 11.193  9.352   -1.248 1.00 1.55 ?  35 PHE A CB   5  
ATOM   2908 C CG   . PHE A 1 35 ? 11.884  9.871   -0.017 1.00 1.48 ?  35 PHE A CG   5  
ATOM   2909 C CD1  . PHE A 1 35 ? 12.305  9.003   0.977  1.00 1.95 ?  35 PHE A CD1  5  
ATOM   2910 C CD2  . PHE A 1 35 ? 12.111  11.228  0.144  1.00 1.61 ?  35 PHE A CD2  5  
ATOM   2911 C CE1  . PHE A 1 35 ? 12.943  9.477   2.106  1.00 2.46 ?  35 PHE A CE1  5  
ATOM   2912 C CE2  . PHE A 1 35 ? 12.747  11.708  1.272  1.00 1.99 ?  35 PHE A CE2  5  
ATOM   2913 C CZ   . PHE A 1 35 ? 13.161  10.825  2.258  1.00 2.41 ?  35 PHE A CZ   5  
ATOM   2914 H H    . PHE A 1 35 ? 9.039   7.946   0.005  1.00 1.04 ?  35 PHE A H    5  
ATOM   2915 H HA   . PHE A 1 35 ? 9.434   10.584  -1.215 1.00 2.31 ?  35 PHE A HA   5  
ATOM   2916 H HB2  . PHE A 1 35 ? 11.420  8.300   -1.337 1.00 1.53 ?  35 PHE A HB2  5  
ATOM   2917 H HB3  . PHE A 1 35 ? 11.597  9.873   -2.103 1.00 1.88 ?  35 PHE A HB3  5  
ATOM   2918 H HD1  . PHE A 1 35 ? 12.135  7.943   0.862  1.00 2.21 ?  35 PHE A HD1  5  
ATOM   2919 H HD2  . PHE A 1 35 ? 11.785  11.916  -0.623 1.00 1.82 ?  35 PHE A HD2  5  
ATOM   2920 H HE1  . PHE A 1 35 ? 13.265  8.789   2.874  1.00 3.08 ?  35 PHE A HE1  5  
ATOM   2921 H HE2  . PHE A 1 35 ? 12.918  12.769  1.384  1.00 2.26 ?  35 PHE A HE2  5  
ATOM   2922 H HZ   . PHE A 1 35 ? 13.656  11.197  3.142  1.00 2.93 ?  35 PHE A HZ   5  
HETATM 2923 N N    . NH2 A 1 36 ? 7.942   9.439   -2.907 1.00 2.32 ?  36 NH2 A N    5  
HETATM 2924 H HN1  . NH2 A 1 36 ? 7.583   10.215  -2.426 1.00 2.41 ?  36 NH2 A HN1  5  
HETATM 2925 H HN2  . NH2 A 1 36 ? 7.511   9.038   -3.689 1.00 2.69 ?  36 NH2 A HN2  5  
ATOM   2926 N N    . LEU A 1 1  ? -5.927  5.184   6.899  1.00 1.11 ?  1  LEU A N    6  
ATOM   2927 C CA   . LEU A 1 1  ? -6.675  5.008   5.633  1.00 0.77 ?  1  LEU A CA   6  
ATOM   2928 C C    . LEU A 1 1  ? -7.597  3.801   5.723  1.00 0.62 ?  1  LEU A C    6  
ATOM   2929 O O    . LEU A 1 1  ? -7.171  2.720   6.129  1.00 0.66 ?  1  LEU A O    6  
ATOM   2930 C CB   . LEU A 1 1  ? -5.706  4.816   4.458  1.00 0.91 ?  1  LEU A CB   6  
ATOM   2931 C CG   . LEU A 1 1  ? -4.830  6.024   4.110  1.00 1.01 ?  1  LEU A CG   6  
ATOM   2932 C CD1  . LEU A 1 1  ? -3.772  5.629   3.092  1.00 1.23 ?  1  LEU A CD1  6  
ATOM   2933 C CD2  . LEU A 1 1  ? -5.677  7.164   3.564  1.00 1.78 ?  1  LEU A CD2  6  
ATOM   2934 H H1   . LEU A 1 1  ? -5.291  6.004   6.831  1.00 1.40 ?  1  LEU A H1   6  
ATOM   2935 H H2   . LEU A 1 1  ? -5.365  4.335   7.105  1.00 1.62 ?  1  LEU A H2   6  
ATOM   2936 H H3   . LEU A 1 1  ? -6.591  5.340   7.682  1.00 1.61 ?  1  LEU A H3   6  
ATOM   2937 H HA   . LEU A 1 1  ? -7.273  5.891   5.462  1.00 0.75 ?  1  LEU A HA   6  
ATOM   2938 H HB2  . LEU A 1 1  ? -5.057  3.986   4.691  1.00 1.23 ?  1  LEU A HB2  6  
ATOM   2939 H HB3  . LEU A 1 1  ? -6.285  4.559   3.583  1.00 1.43 ?  1  LEU A HB3  6  
ATOM   2940 H HG   . LEU A 1 1  ? -4.329  6.369   5.002  1.00 1.75 ?  1  LEU A HG   6  
ATOM   2941 H HD11 . LEU A 1 1  ? -3.146  4.854   3.506  1.00 1.48 ?  1  LEU A HD11 6  
ATOM   2942 H HD12 . LEU A 1 1  ? -3.167  6.491   2.850  1.00 1.80 ?  1  LEU A HD12 6  
ATOM   2943 H HD13 . LEU A 1 1  ? -4.253  5.263   2.197  1.00 1.91 ?  1  LEU A HD13 6  
ATOM   2944 H HD21 . LEU A 1 1  ? -5.046  8.019   3.373  1.00 2.17 ?  1  LEU A HD21 6  
ATOM   2945 H HD22 . LEU A 1 1  ? -6.435  7.430   4.284  1.00 2.45 ?  1  LEU A HD22 6  
ATOM   2946 H HD23 . LEU A 1 1  ? -6.148  6.853   2.643  1.00 2.19 ?  1  LEU A HD23 6  
ATOM   2947 N N    . SER A 1 2  ? -8.860  3.988   5.360  1.00 0.58 ?  2  SER A N    6  
ATOM   2948 C CA   . SER A 1 2  ? -9.789  2.873   5.265  1.00 0.59 ?  2  SER A CA   6  
ATOM   2949 C C    . SER A 1 2  ? -9.538  2.147   3.951  1.00 0.53 ?  2  SER A C    6  
ATOM   2950 O O    . SER A 1 2  ? -8.923  2.719   3.056  1.00 0.45 ?  2  SER A O    6  
ATOM   2951 C CB   . SER A 1 2  ? -11.239 3.363   5.346  1.00 0.72 ?  2  SER A CB   6  
ATOM   2952 O OG   . SER A 1 2  ? -12.141 2.280   5.511  1.00 1.28 ?  2  SER A OG   6  
ATOM   2953 H H    . SER A 1 2  ? -9.173  4.893   5.148  1.00 0.63 ?  2  SER A H    6  
ATOM   2954 H HA   . SER A 1 2  ? -9.591  2.199   6.082  1.00 0.67 ?  2  SER A HA   6  
ATOM   2955 H HB2  . SER A 1 2  ? -11.342 4.030   6.189  1.00 1.39 ?  2  SER A HB2  6  
ATOM   2956 H HB3  . SER A 1 2  ? -11.489 3.889   4.436  1.00 1.05 ?  2  SER A HB3  6  
ATOM   2957 H HG   . SER A 1 2  ? -12.845 2.341   4.849  1.00 1.66 ?  2  SER A HG   6  
ATOM   2958 N N    . ASP A 1 3  ? -10.010 0.909   3.830  1.00 0.61 ?  3  ASP A N    6  
ATOM   2959 C CA   . ASP A 1 3  ? -9.692  0.066   2.670  1.00 0.60 ?  3  ASP A CA   6  
ATOM   2960 C C    . ASP A 1 3  ? -9.919  0.792   1.346  1.00 0.49 ?  3  ASP A C    6  
ATOM   2961 O O    . ASP A 1 3  ? -9.115  0.674   0.420  1.00 0.40 ?  3  ASP A O    6  
ATOM   2962 C CB   . ASP A 1 3  ? -10.504 -1.230  2.692  1.00 0.76 ?  3  ASP A CB   6  
ATOM   2963 C CG   . ASP A 1 3  ? -10.003 -2.215  3.728  1.00 1.42 ?  3  ASP A CG   6  
ATOM   2964 O OD1  . ASP A 1 3  ? -9.000  -2.906  3.460  1.00 1.93 ?  3  ASP A OD1  6  
ATOM   2965 O OD2  . ASP A 1 3  ? -10.612 -2.305  4.815  1.00 2.11 -1 3  ASP A OD2  6  
ATOM   2966 H H    . ASP A 1 3  ? -10.591 0.551   4.535  1.00 0.71 ?  3  ASP A H    6  
ATOM   2967 H HA   . ASP A 1 3  ? -8.645  -0.187  2.739  1.00 0.62 ?  3  ASP A HA   6  
ATOM   2968 H HB2  . ASP A 1 3  ? -11.534 -0.998  2.913  1.00 1.30 ?  3  ASP A HB2  6  
ATOM   2969 H HB3  . ASP A 1 3  ? -10.447 -1.696  1.721  1.00 1.20 ?  3  ASP A HB3  6  
ATOM   2970 N N    . GLU A 1 4  ? -10.997 1.562   1.270  1.00 0.58 ?  4  GLU A N    6  
ATOM   2971 C CA   . GLU A 1 4  ? -11.320 2.304   0.056  1.00 0.58 ?  4  GLU A CA   6  
ATOM   2972 C C    . GLU A 1 4  ? -10.268 3.376   -0.225 1.00 0.43 ?  4  GLU A C    6  
ATOM   2973 O O    . GLU A 1 4  ? -9.806  3.529   -1.362 1.00 0.38 ?  4  GLU A O    6  
ATOM   2974 C CB   . GLU A 1 4  ? -12.708 2.937   0.167  1.00 0.80 ?  4  GLU A CB   6  
ATOM   2975 C CG   . GLU A 1 4  ? -13.828 1.919   0.317  1.00 1.35 ?  4  GLU A CG   6  
ATOM   2976 C CD   . GLU A 1 4  ? -15.203 2.554   0.315  1.00 1.81 ?  4  GLU A CD   6  
ATOM   2977 O OE1  . GLU A 1 4  ? -15.656 3.002   1.389  1.00 2.46 ?  4  GLU A OE1  6  
ATOM   2978 O OE2  . GLU A 1 4  ? -15.833 2.624   -0.764 1.00 2.08 -1 4  GLU A OE2  6  
ATOM   2979 H H    . GLU A 1 4  ? -11.587 1.635   2.048  1.00 0.68 ?  4  GLU A H    6  
ATOM   2980 H HA   . GLU A 1 4  ? -11.320 1.601   -0.763 1.00 0.59 ?  4  GLU A HA   6  
ATOM   2981 H HB2  . GLU A 1 4  ? -12.727 3.592   1.025  1.00 1.07 ?  4  GLU A HB2  6  
ATOM   2982 H HB3  . GLU A 1 4  ? -12.898 3.518   -0.724 1.00 1.03 ?  4  GLU A HB3  6  
ATOM   2983 H HG2  . GLU A 1 4  ? -13.772 1.219   -0.503 1.00 1.90 ?  4  GLU A HG2  6  
ATOM   2984 H HG3  . GLU A 1 4  ? -13.695 1.388   1.249  1.00 1.77 ?  4  GLU A HG3  6  
ATOM   2985 N N    . ASP A 1 5  ? -9.861  4.089   0.821  1.00 0.44 ?  5  ASP A N    6  
ATOM   2986 C CA   . ASP A 1 5  ? -8.877  5.156   0.683  1.00 0.40 ?  5  ASP A CA   6  
ATOM   2987 C C    . ASP A 1 5  ? -7.535  4.545   0.338  1.00 0.28 ?  5  ASP A C    6  
ATOM   2988 O O    . ASP A 1 5  ? -6.769  5.077   -0.465 1.00 0.29 ?  5  ASP A O    6  
ATOM   2989 C CB   . ASP A 1 5  ? -8.739  5.950   1.986  1.00 0.52 ?  5  ASP A CB   6  
ATOM   2990 C CG   . ASP A 1 5  ? -10.058 6.463   2.519  1.00 1.11 ?  5  ASP A CG   6  
ATOM   2991 O OD1  . ASP A 1 5  ? -10.454 7.586   2.143  1.00 1.17 ?  5  ASP A OD1  6  
ATOM   2992 O OD2  . ASP A 1 5  ? -10.714 5.744   3.299  1.00 1.82 -1 5  ASP A OD2  6  
ATOM   2993 H H    . ASP A 1 5  ? -10.205 3.869   1.714  1.00 0.51 ?  5  ASP A H    6  
ATOM   2994 H HA   . ASP A 1 5  ? -9.189  5.812   -0.114 1.00 0.43 ?  5  ASP A HA   6  
ATOM   2995 H HB2  . ASP A 1 5  ? -8.296  5.316   2.737  1.00 1.00 ?  5  ASP A HB2  6  
ATOM   2996 H HB3  . ASP A 1 5  ? -8.092  6.796   1.812  1.00 0.82 ?  5  ASP A HB3  6  
ATOM   2997 N N    . PHE A 1 6  ? -7.282  3.404   0.952  1.00 0.24 ?  6  PHE A N    6  
ATOM   2998 C CA   . PHE A 1 6  ? -6.058  2.663   0.757  1.00 0.18 ?  6  PHE A CA   6  
ATOM   2999 C C    . PHE A 1 6  ? -5.941  2.223   -0.693 1.00 0.13 ?  6  PHE A C    6  
ATOM   3000 O O    . PHE A 1 6  ? -4.889  2.366   -1.305 1.00 0.15 ?  6  PHE A O    6  
ATOM   3001 C CB   . PHE A 1 6  ? -6.050  1.455   1.689  1.00 0.23 ?  6  PHE A CB   6  
ATOM   3002 C CG   . PHE A 1 6  ? -4.727  0.758   1.780  1.00 0.25 ?  6  PHE A CG   6  
ATOM   3003 C CD1  . PHE A 1 6  ? -3.860  1.026   2.821  1.00 0.43 ?  6  PHE A CD1  6  
ATOM   3004 C CD2  . PHE A 1 6  ? -4.348  -0.154  0.812  1.00 0.25 ?  6  PHE A CD2  6  
ATOM   3005 C CE1  . PHE A 1 6  ? -2.638  0.397   2.897  1.00 0.50 ?  6  PHE A CE1  6  
ATOM   3006 C CE2  . PHE A 1 6  ? -3.125  -0.789  0.882  1.00 0.35 ?  6  PHE A CE2  6  
ATOM   3007 C CZ   . PHE A 1 6  ? -2.290  -0.550  1.969  1.00 0.43 ?  6  PHE A CZ   6  
ATOM   3008 H H    . PHE A 1 6  ? -7.956  3.041   1.565  1.00 0.29 ?  6  PHE A H    6  
ATOM   3009 H HA   . PHE A 1 6  ? -5.227  3.308   0.998  1.00 0.23 ?  6  PHE A HA   6  
ATOM   3010 H HB2  . PHE A 1 6  ? -6.319  1.778   2.683  1.00 0.31 ?  6  PHE A HB2  6  
ATOM   3011 H HB3  . PHE A 1 6  ? -6.779  0.740   1.340  1.00 0.27 ?  6  PHE A HB3  6  
ATOM   3012 H HD1  . PHE A 1 6  ? -4.148  1.737   3.581  1.00 0.55 ?  6  PHE A HD1  6  
ATOM   3013 H HD2  . PHE A 1 6  ? -5.021  -0.371  -0.004 1.00 0.29 ?  6  PHE A HD2  6  
ATOM   3014 H HE1  . PHE A 1 6  ? -1.971  0.613   3.715  1.00 0.65 ?  6  PHE A HE1  6  
ATOM   3015 H HE2  . PHE A 1 6  ? -2.840  -1.499  0.121  1.00 0.43 ?  6  PHE A HE2  6  
ATOM   3016 H HZ   . PHE A 1 6  ? -1.342  -1.063  2.040  1.00 0.51 ?  6  PHE A HZ   6  
ATOM   3017 N N    . LYS A 1 7  ? -7.027  1.699   -1.248 1.00 0.13 ?  7  LYS A N    6  
ATOM   3018 C CA   . LYS A 1 7  ? -7.030  1.302   -2.646 1.00 0.15 ?  7  LYS A CA   6  
ATOM   3019 C C    . LYS A 1 7  ? -6.873  2.522   -3.548 1.00 0.19 ?  7  LYS A C    6  
ATOM   3020 O O    . LYS A 1 7  ? -6.246  2.446   -4.600 1.00 0.23 ?  7  LYS A O    6  
ATOM   3021 C CB   . LYS A 1 7  ? -8.311  0.551   -3.014 1.00 0.23 ?  7  LYS A CB   6  
ATOM   3022 C CG   . LYS A 1 7  ? -8.303  0.052   -4.453 1.00 0.30 ?  7  LYS A CG   6  
ATOM   3023 C CD   . LYS A 1 7  ? -9.547  -0.746  -4.795 1.00 0.44 ?  7  LYS A CD   6  
ATOM   3024 C CE   . LYS A 1 7  ? -9.531  -1.193  -6.252 1.00 1.26 ?  7  LYS A CE   6  
ATOM   3025 N NZ   . LYS A 1 7  ? -8.341  -2.028  -6.571 1.00 2.06 1  7  LYS A NZ   6  
ATOM   3026 H H    . LYS A 1 7  ? -7.835  1.563   -0.702 1.00 0.18 ?  7  LYS A H    6  
ATOM   3027 H HA   . LYS A 1 7  ? -6.184  0.649   -2.800 1.00 0.15 ?  7  LYS A HA   6  
ATOM   3028 H HB2  . LYS A 1 7  ? -8.425  -0.297  -2.356 1.00 0.28 ?  7  LYS A HB2  6  
ATOM   3029 H HB3  . LYS A 1 7  ? -9.153  1.212   -2.890 1.00 0.25 ?  7  LYS A HB3  6  
ATOM   3030 H HG2  . LYS A 1 7  ? -8.244  0.902   -5.114 1.00 0.31 ?  7  LYS A HG2  6  
ATOM   3031 H HG3  . LYS A 1 7  ? -7.435  -0.575  -4.599 1.00 0.36 ?  7  LYS A HG3  6  
ATOM   3032 H HD2  . LYS A 1 7  ? -9.587  -1.620  -4.162 1.00 1.10 ?  7  LYS A HD2  6  
ATOM   3033 H HD3  . LYS A 1 7  ? -10.418 -0.132  -4.623 1.00 0.92 ?  7  LYS A HD3  6  
ATOM   3034 H HE2  . LYS A 1 7  ? -10.423 -1.767  -6.449 1.00 1.83 ?  7  LYS A HE2  6  
ATOM   3035 H HE3  . LYS A 1 7  ? -9.525  -0.316  -6.883 1.00 1.84 ?  7  LYS A HE3  6  
ATOM   3036 H HZ1  . LYS A 1 7  ? -7.465  -1.480  -6.432 1.00 2.69 ?  7  LYS A HZ1  6  
ATOM   3037 H HZ2  . LYS A 1 7  ? -8.380  -2.343  -7.561 1.00 2.55 ?  7  LYS A HZ2  6  
ATOM   3038 H HZ3  . LYS A 1 7  ? -8.314  -2.865  -5.958 1.00 2.30 ?  7  LYS A HZ3  6  
ATOM   3039 N N    . ALA A 1 8  ? -7.445  3.643   -3.135 1.00 0.22 ?  8  ALA A N    6  
ATOM   3040 C CA   . ALA A 1 8  ? -7.320  4.882   -3.891 1.00 0.30 ?  8  ALA A CA   6  
ATOM   3041 C C    . ALA A 1 8  ? -5.867  5.363   -3.933 1.00 0.35 ?  8  ALA A C    6  
ATOM   3042 O O    . ALA A 1 8  ? -5.403  5.882   -4.950 1.00 0.45 ?  8  ALA A O    6  
ATOM   3043 C CB   . ALA A 1 8  ? -8.218  5.955   -3.295 1.00 0.35 ?  8  ALA A CB   6  
ATOM   3044 H H    . ALA A 1 8  ? -7.978  3.637   -2.305 1.00 0.22 ?  8  ALA A H    6  
ATOM   3045 H HA   . ALA A 1 8  ? -7.651  4.690   -4.901 1.00 0.34 ?  8  ALA A HA   6  
ATOM   3046 H HB1  . ALA A 1 8  ? -7.898  6.173   -2.287 1.00 1.02 ?  8  ALA A HB1  6  
ATOM   3047 H HB2  . ALA A 1 8  ? -9.239  5.603   -3.280 1.00 1.02 ?  8  ALA A HB2  6  
ATOM   3048 H HB3  . ALA A 1 8  ? -8.156  6.852   -3.895 1.00 1.04 ?  8  ALA A HB3  6  
ATOM   3049 N N    . VAL A 1 9  ? -5.157  5.186   -2.826 1.00 0.31 ?  9  VAL A N    6  
ATOM   3050 C CA   . VAL A 1 9  ? -3.767  5.617   -2.729 1.00 0.39 ?  9  VAL A CA   6  
ATOM   3051 C C    . VAL A 1 9  ? -2.814  4.607   -3.373 1.00 0.38 ?  9  VAL A C    6  
ATOM   3052 O O    . VAL A 1 9  ? -2.015  4.954   -4.242 1.00 0.49 ?  9  VAL A O    6  
ATOM   3053 C CB   . VAL A 1 9  ? -3.350  5.834   -1.257 1.00 0.42 ?  9  VAL A CB   6  
ATOM   3054 C CG1  . VAL A 1 9  ? -1.880  6.212   -1.158 1.00 0.52 ?  9  VAL A CG1  6  
ATOM   3055 C CG2  . VAL A 1 9  ? -4.214  6.897   -0.604 1.00 0.50 ?  9  VAL A CG2  6  
ATOM   3056 H H    . VAL A 1 9  ? -5.586  4.766   -2.042 1.00 0.26 ?  9  VAL A H    6  
ATOM   3057 H HA   . VAL A 1 9  ? -3.676  6.560   -3.247 1.00 0.47 ?  9  VAL A HA   6  
ATOM   3058 H HB   . VAL A 1 9  ? -3.496  4.906   -0.722 1.00 0.37 ?  9  VAL A HB   6  
ATOM   3059 H HG11 . VAL A 1 9  ? -1.618  6.371   -0.123 1.00 0.97 ?  9  VAL A HG11 6  
ATOM   3060 H HG12 . VAL A 1 9  ? -1.706  7.120   -1.718 1.00 0.84 ?  9  VAL A HG12 6  
ATOM   3061 H HG13 . VAL A 1 9  ? -1.275  5.416   -1.566 1.00 1.18 ?  9  VAL A HG13 6  
ATOM   3062 H HG21 . VAL A 1 9  ? -5.248  6.587   -0.633 1.00 0.95 ?  9  VAL A HG21 6  
ATOM   3063 H HG22 . VAL A 1 9  ? -4.102  7.830   -1.136 1.00 0.76 ?  9  VAL A HG22 6  
ATOM   3064 H HG23 . VAL A 1 9  ? -3.907  7.028   0.423  1.00 0.91 ?  9  VAL A HG23 6  
ATOM   3065 N N    . PHE A 1 10 ? -2.916  3.359   -2.949 1.00 0.29 ?  10 PHE A N    6  
ATOM   3066 C CA   . PHE A 1 10 ? -1.974  2.323   -3.354 1.00 0.33 ?  10 PHE A CA   6  
ATOM   3067 C C    . PHE A 1 10 ? -2.370  1.669   -4.673 1.00 0.35 ?  10 PHE A C    6  
ATOM   3068 O O    . PHE A 1 10 ? -1.510  1.288   -5.466 1.00 0.45 ?  10 PHE A O    6  
ATOM   3069 C CB   . PHE A 1 10 ? -1.867  1.260   -2.259 1.00 0.32 ?  10 PHE A CB   6  
ATOM   3070 C CG   . PHE A 1 10 ? -1.194  1.749   -1.009 1.00 0.33 ?  10 PHE A CG   6  
ATOM   3071 C CD1  . PHE A 1 10 ? -1.884  2.507   -0.077 1.00 0.39 ?  10 PHE A CD1  6  
ATOM   3072 C CD2  . PHE A 1 10 ? 0.132   1.445   -0.768 1.00 0.39 ?  10 PHE A CD2  6  
ATOM   3073 C CE1  . PHE A 1 10 ? -1.261  2.950   1.072  1.00 0.41 ?  10 PHE A CE1  6  
ATOM   3074 C CE2  . PHE A 1 10 ? 0.761   1.884   0.378  1.00 0.42 ?  10 PHE A CE2  6  
ATOM   3075 C CZ   . PHE A 1 10 ? 0.065   2.638   1.300  1.00 0.37 ?  10 PHE A CZ   6  
ATOM   3076 H H    . PHE A 1 10 ? -3.647  3.123   -2.338 1.00 0.22 ?  10 PHE A H    6  
ATOM   3077 H HA   . PHE A 1 10 ? -1.009  2.790   -3.476 1.00 0.39 ?  10 PHE A HA   6  
ATOM   3078 H HB2  . PHE A 1 10 ? -2.859  0.929   -1.991 1.00 0.30 ?  10 PHE A HB2  6  
ATOM   3079 H HB3  . PHE A 1 10 ? -1.300  0.421   -2.636 1.00 0.37 ?  10 PHE A HB3  6  
ATOM   3080 H HD1  . PHE A 1 10 ? -2.922  2.747   -0.253 1.00 0.48 ?  10 PHE A HD1  6  
ATOM   3081 H HD2  . PHE A 1 10 ? 0.676   0.856   -1.489 1.00 0.47 ?  10 PHE A HD2  6  
ATOM   3082 H HE1  . PHE A 1 10 ? -1.811  3.542   1.789  1.00 0.50 ?  10 PHE A HE1  6  
ATOM   3083 H HE2  . PHE A 1 10 ? 1.798   1.637   0.552  1.00 0.52 ?  10 PHE A HE2  6  
ATOM   3084 H HZ   . PHE A 1 10 ? 0.554   2.983   2.197  1.00 0.39 ?  10 PHE A HZ   6  
ATOM   3085 N N    . GLY A 1 11 ? -3.666  1.542   -4.905 1.00 0.28 ?  11 GLY A N    6  
ATOM   3086 C CA   . GLY A 1 11 ? -4.145  0.872   -6.097 1.00 0.31 ?  11 GLY A CA   6  
ATOM   3087 C C    . GLY A 1 11 ? -4.874  -0.414  -5.768 1.00 0.29 ?  11 GLY A C    6  
ATOM   3088 O O    . GLY A 1 11 ? -5.736  -0.865  -6.523 1.00 0.36 ?  11 GLY A O    6  
ATOM   3089 H H    . GLY A 1 11 ? -4.312  1.922   -4.271 1.00 0.24 ?  11 GLY A H    6  
ATOM   3090 H HA2  . GLY A 1 11 ? -4.819  1.532   -6.621 1.00 0.32 ?  11 GLY A HA2  6  
ATOM   3091 H HA3  . GLY A 1 11 ? -3.305  0.646   -6.735 1.00 0.35 ?  11 GLY A HA3  6  
HETATM 3092 N N    . NLE A 1 12 ? -4.549  -0.988  -4.621 1.00 0.24 ?  12 NLE A N    6  
HETATM 3093 C CA   . NLE A 1 12 ? -5.138  -2.249  -4.200 1.00 0.24 ?  12 NLE A CA   6  
HETATM 3094 C C    . NLE A 1 12 ? -5.623  -2.145  -2.763 1.00 0.21 ?  12 NLE A C    6  
HETATM 3095 O O    . NLE A 1 12 ? -5.220  -1.242  -2.029 1.00 0.22 ?  12 NLE A O    6  
HETATM 3096 C CB   . NLE A 1 12 ? -4.135  -3.408  -4.332 1.00 0.27 ?  12 NLE A CB   6  
HETATM 3097 C CG   . NLE A 1 12 ? -2.959  -3.365  -3.356 1.00 0.64 ?  12 NLE A CG   6  
HETATM 3098 C CD   . NLE A 1 12 ? -1.939  -2.284  -3.697 1.00 0.33 ?  12 NLE A CD   6  
HETATM 3099 C CE   . NLE A 1 12 ? -1.298  -2.560  -5.042 1.00 0.64 ?  12 NLE A CE   6  
HETATM 3100 H H    . NLE A 1 12 ? -3.909  -0.544  -4.031 1.00 0.26 ?  12 NLE A H    6  
HETATM 3101 H HA   . NLE A 1 12 ? -5.987  -2.446  -4.837 1.00 0.26 ?  12 NLE A HA   6  
HETATM 3102 H HB2  . NLE A 1 12 ? -3.739  -3.405  -5.335 1.00 0.51 ?  12 NLE A HB2  6  
HETATM 3103 H HB3  . NLE A 1 12 ? -4.662  -4.334  -4.174 1.00 0.31 ?  12 NLE A HB3  6  
HETATM 3104 H HG2  . NLE A 1 12 ? -2.466  -4.327  -3.371 1.00 1.24 ?  12 NLE A HG2  6  
HETATM 3105 H HG3  . NLE A 1 12 ? -3.340  -3.177  -2.364 1.00 1.24 ?  12 NLE A HG3  6  
HETATM 3106 H HD2  . NLE A 1 12 ? -1.168  -2.269  -2.943 1.00 0.70 ?  12 NLE A HD2  6  
HETATM 3107 H HD3  . NLE A 1 12 ? -2.431  -1.326  -3.739 1.00 0.43 ?  12 NLE A HD3  6  
HETATM 3108 H HE1  . NLE A 1 12 ? -0.837  -3.536  -5.028 1.00 1.10 ?  12 NLE A HE1  6  
HETATM 3109 H HE2  . NLE A 1 12 ? -0.547  -1.810  -5.242 1.00 1.19 ?  12 NLE A HE2  6  
HETATM 3110 H HE3  . NLE A 1 12 ? -2.051  -2.529  -5.814 1.00 1.26 ?  12 NLE A HE3  6  
ATOM   3111 N N    . THR A 1 13 ? -6.494  -3.061  -2.375 1.00 0.24 ?  13 THR A N    6  
ATOM   3112 C CA   . THR A 1 13 ? -7.027  -3.091  -1.026 1.00 0.27 ?  13 THR A CA   6  
ATOM   3113 C C    . THR A 1 13 ? -5.993  -3.620  -0.044 1.00 0.24 ?  13 THR A C    6  
ATOM   3114 O O    . THR A 1 13 ? -5.046  -4.296  -0.452 1.00 0.23 ?  13 THR A O    6  
ATOM   3115 C CB   . THR A 1 13 ? -8.294  -3.956  -0.953 1.00 0.34 ?  13 THR A CB   6  
ATOM   3116 O OG1  . THR A 1 13 ? -8.064  -5.206  -1.619 1.00 0.36 ?  13 THR A OG1  6  
ATOM   3117 C CG2  . THR A 1 13 ? -9.472  -3.235  -1.589 1.00 0.43 ?  13 THR A CG2  6  
ATOM   3118 H H    . THR A 1 13 ? -6.786  -3.746  -3.014 1.00 0.27 ?  13 THR A H    6  
ATOM   3119 H HA   . THR A 1 13 ? -7.288  -2.081  -0.747 1.00 0.30 ?  13 THR A HA   6  
ATOM   3120 H HB   . THR A 1 13 ? -8.522  -4.146  0.087  1.00 0.34 ?  13 THR A HB   6  
ATOM   3121 H HG1  . THR A 1 13 ? -8.909  -5.638  -1.800 1.00 0.58 ?  13 THR A HG1  6  
ATOM   3122 H HG21 . THR A 1 13 ? -10.358 -3.847  -1.511 1.00 0.92 ?  13 THR A HG21 6  
ATOM   3123 H HG22 . THR A 1 13 ? -9.256  -3.043  -2.629 1.00 1.34 ?  13 THR A HG22 6  
ATOM   3124 H HG23 . THR A 1 13 ? -9.636  -2.297  -1.077 1.00 1.02 ?  13 THR A HG23 6  
ATOM   3125 N N    . ARG A 1 14 ? -6.172  -3.330  1.235  1.00 0.29 ?  14 ARG A N    6  
ATOM   3126 C CA   . ARG A 1 14 ? -5.182  -3.698  2.241  1.00 0.32 ?  14 ARG A CA   6  
ATOM   3127 C C    . ARG A 1 14 ? -4.899  -5.198  2.207  1.00 0.30 ?  14 ARG A C    6  
ATOM   3128 O O    . ARG A 1 14 ? -3.748  -5.621  2.333  1.00 0.31 ?  14 ARG A O    6  
ATOM   3129 C CB   . ARG A 1 14 ? -5.654  -3.273  3.626  1.00 0.42 ?  14 ARG A CB   6  
ATOM   3130 C CG   . ARG A 1 14 ? -5.919  -1.780  3.736  1.00 0.53 ?  14 ARG A CG   6  
ATOM   3131 C CD   . ARG A 1 14 ? -6.283  -1.378  5.152  1.00 0.77 ?  14 ARG A CD   6  
ATOM   3132 N NE   . ARG A 1 14 ? -5.159  -1.538  6.067  1.00 1.30 ?  14 ARG A NE   6  
ATOM   3133 C CZ   . ARG A 1 14 ? -5.225  -2.185  7.229  1.00 1.88 ?  14 ARG A CZ   6  
ATOM   3134 N NH1  . ARG A 1 14 ? -6.354  -2.771  7.613  1.00 2.02 1  14 ARG A NH1  6  
ATOM   3135 N NH2  . ARG A 1 14 ? -4.152  -2.254  8.002  1.00 2.82 ?  14 ARG A NH2  6  
ATOM   3136 H H    . ARG A 1 14 ? -6.990  -2.869  1.513  1.00 0.32 ?  14 ARG A H    6  
ATOM   3137 H HA   . ARG A 1 14 ? -4.268  -3.172  2.006  1.00 0.34 ?  14 ARG A HA   6  
ATOM   3138 H HB2  . ARG A 1 14 ? -6.566  -3.798  3.859  1.00 0.43 ?  14 ARG A HB2  6  
ATOM   3139 H HB3  . ARG A 1 14 ? -4.899  -3.537  4.349  1.00 0.46 ?  14 ARG A HB3  6  
ATOM   3140 H HG2  . ARG A 1 14 ? -5.029  -1.245  3.439  1.00 0.58 ?  14 ARG A HG2  6  
ATOM   3141 H HG3  . ARG A 1 14 ? -6.735  -1.521  3.077  1.00 0.53 ?  14 ARG A HG3  6  
ATOM   3142 H HD2  . ARG A 1 14 ? -6.587  -0.342  5.153  1.00 1.48 ?  14 ARG A HD2  6  
ATOM   3143 H HD3  . ARG A 1 14 ? -7.102  -1.993  5.490  1.00 1.15 ?  14 ARG A HD3  6  
ATOM   3144 H HE   . ARG A 1 14 ? -4.303  -1.129  5.802  1.00 1.80 ?  14 ARG A HE   6  
ATOM   3145 H HH11 . ARG A 1 14 ? -6.396  -3.256  8.489  1.00 2.60 ?  14 ARG A HH11 6  
ATOM   3146 H HH12 . ARG A 1 14 ? -7.171  -2.734  7.028  1.00 1.94 ?  14 ARG A HH12 6  
ATOM   3147 H HH21 . ARG A 1 14 ? -3.292  -1.823  7.712  1.00 3.23 ?  14 ARG A HH21 6  
ATOM   3148 H HH22 . ARG A 1 14 ? -4.194  -2.741  8.879  1.00 3.30 ?  14 ARG A HH22 6  
HETATM 3149 N N    . AIB A 1 15 ? -5.953  -5.990  2.000  1.00 0.31 ?  15 AIB A N    6  
HETATM 3150 C CA   . AIB A 1 15 ? -5.834  -7.448  1.877  1.00 0.33 ?  15 AIB A CA   6  
HETATM 3151 C C    . AIB A 1 15 ? -4.845  -7.785  0.752  1.00 0.30 ?  15 AIB A C    6  
HETATM 3152 O O    . AIB A 1 15 ? -3.940  -8.615  0.917  1.00 0.30 ?  15 AIB A O    6  
HETATM 3153 C CB1  . AIB A 1 15 ? -7.189  -8.040  1.551  1.00 0.37 ?  15 AIB A CB1  6  
HETATM 3154 C CB2  . AIB A 1 15 ? -5.374  -8.053  3.192  1.00 0.37 ?  15 AIB A CB2  6  
HETATM 3155 H H    . AIB A 1 15 ? -6.844  -5.580  1.930  1.00 0.31 ?  15 AIB A H    6  
HETATM 3156 H HB11 . AIB A 1 15 ? -7.101  -9.113  1.462  1.00 1.00 ?  15 AIB A HB11 6  
HETATM 3157 H HB12 . AIB A 1 15 ? -7.545  -7.629  0.618  1.00 1.13 ?  15 AIB A HB12 6  
HETATM 3158 H HB13 . AIB A 1 15 ? -7.886  -7.800  2.339  1.00 1.02 ?  15 AIB A HB13 6  
HETATM 3159 H HB21 . AIB A 1 15 ? -4.414  -7.640  3.462  1.00 1.07 ?  15 AIB A HB21 6  
HETATM 3160 H HB22 . AIB A 1 15 ? -5.289  -9.124  3.084  1.00 1.16 ?  15 AIB A HB22 6  
HETATM 3161 H HB23 . AIB A 1 15 ? -6.094  -7.826  3.964  1.00 1.01 ?  15 AIB A HB23 6  
ATOM   3162 N N    . ALA A 1 16 ? -5.005  -7.105  -0.379 1.00 0.27 ?  16 ALA A N    6  
ATOM   3163 C CA   . ALA A 1 16 ? -4.182  -7.366  -1.550 1.00 0.26 ?  16 ALA A CA   6  
ATOM   3164 C C    . ALA A 1 16 ? -2.765  -6.872  -1.315 1.00 0.23 ?  16 ALA A C    6  
ATOM   3165 O O    . ALA A 1 16 ? -1.800  -7.445  -1.821 1.00 0.25 ?  16 ALA A O    6  
ATOM   3166 C CB   . ALA A 1 16 ? -4.784  -6.699  -2.778 1.00 0.28 ?  16 ALA A CB   6  
ATOM   3167 H H    . ALA A 1 16 ? -5.675  -6.384  -0.417 1.00 0.27 ?  16 ALA A H    6  
ATOM   3168 H HA   . ALA A 1 16 ? -4.163  -8.432  -1.715 1.00 0.29 ?  16 ALA A HA   6  
ATOM   3169 H HB1  . ALA A 1 16 ? -5.786  -7.072  -2.935 1.00 0.90 ?  16 ALA A HB1  6  
ATOM   3170 H HB2  . ALA A 1 16 ? -4.177  -6.922  -3.642 1.00 0.96 ?  16 ALA A HB2  6  
ATOM   3171 H HB3  . ALA A 1 16 ? -4.818  -5.631  -2.626 1.00 0.89 ?  16 ALA A HB3  6  
ATOM   3172 N N    . PHE A 1 17 ? -2.658  -5.812  -0.531 1.00 0.20 ?  17 PHE A N    6  
ATOM   3173 C CA   . PHE A 1 17 ? -1.376  -5.243  -0.159 1.00 0.19 ?  17 PHE A CA   6  
ATOM   3174 C C    . PHE A 1 17 ? -0.587  -6.223  0.699  1.00 0.20 ?  17 PHE A C    6  
ATOM   3175 O O    . PHE A 1 17 ? 0.578   -6.502  0.433  1.00 0.20 ?  17 PHE A O    6  
ATOM   3176 C CB   . PHE A 1 17 ? -1.607  -3.941  0.598  1.00 0.22 ?  17 PHE A CB   6  
ATOM   3177 C CG   . PHE A 1 17 ? -0.357  -3.183  0.917  1.00 0.24 ?  17 PHE A CG   6  
ATOM   3178 C CD1  . PHE A 1 17 ? 0.276   -2.420  -0.050 1.00 0.28 ?  17 PHE A CD1  6  
ATOM   3179 C CD2  . PHE A 1 17 ? 0.193   -3.247  2.182  1.00 0.28 ?  17 PHE A CD2  6  
ATOM   3180 C CE1  . PHE A 1 17 ? 1.439   -1.736  0.244  1.00 0.33 ?  17 PHE A CE1  6  
ATOM   3181 C CE2  . PHE A 1 17 ? 1.350   -2.564  2.482  1.00 0.32 ?  17 PHE A CE2  6  
ATOM   3182 C CZ   . PHE A 1 17 ? 1.940   -1.746  1.505  1.00 0.33 ?  17 PHE A CZ   6  
ATOM   3183 H H    . PHE A 1 17 ? -3.480  -5.387  -0.195 1.00 0.21 ?  17 PHE A H    6  
ATOM   3184 H HA   . PHE A 1 17 ? -0.823  -5.034  -1.060 1.00 0.19 ?  17 PHE A HA   6  
ATOM   3185 H HB2  . PHE A 1 17 ? -2.233  -3.304  0.002  1.00 0.22 ?  17 PHE A HB2  6  
ATOM   3186 H HB3  . PHE A 1 17 ? -2.109  -4.162  1.528  1.00 0.24 ?  17 PHE A HB3  6  
ATOM   3187 H HD1  . PHE A 1 17 ? -0.150  -2.363  -1.041 1.00 0.30 ?  17 PHE A HD1  6  
ATOM   3188 H HD2  . PHE A 1 17 ? -0.294  -3.837  2.944  1.00 0.30 ?  17 PHE A HD2  6  
ATOM   3189 H HE1  . PHE A 1 17 ? 1.927   -1.145  -0.516 1.00 0.38 ?  17 PHE A HE1  6  
ATOM   3190 H HE2  . PHE A 1 17 ? 1.766   -2.624  3.472  1.00 0.36 ?  17 PHE A HE2  6  
ATOM   3191 H HZ   . PHE A 1 17 ? 2.835   -1.187  1.728  1.00 0.37 ?  17 PHE A HZ   6  
ATOM   3192 N N    . ALA A 1 18 ? -1.241  -6.757  1.722  1.00 0.23 ?  18 ALA A N    6  
ATOM   3193 C CA   . ALA A 1 18 ? -0.615  -7.731  2.604  1.00 0.25 ?  18 ALA A CA   6  
ATOM   3194 C C    . ALA A 1 18 ? -0.310  -9.022  1.853  1.00 0.23 ?  18 ALA A C    6  
ATOM   3195 O O    . ALA A 1 18 ? 0.588   -9.776  2.230  1.00 0.23 ?  18 ALA A O    6  
ATOM   3196 C CB   . ALA A 1 18 ? -1.500  -8.004  3.810  1.00 0.30 ?  18 ALA A CB   6  
ATOM   3197 H H    . ALA A 1 18 ? -2.168  -6.480  1.895  1.00 0.25 ?  18 ALA A H    6  
ATOM   3198 H HA   . ALA A 1 18 ? 0.314   -7.306  2.958  1.00 0.27 ?  18 ALA A HA   6  
ATOM   3199 H HB1  . ALA A 1 18 ? -1.704  -7.076  4.323  1.00 1.06 ?  18 ALA A HB1  6  
ATOM   3200 H HB2  . ALA A 1 18 ? -0.995  -8.683  4.480  1.00 0.87 ?  18 ALA A HB2  6  
ATOM   3201 H HB3  . ALA A 1 18 ? -2.429  -8.446  3.481  1.00 0.99 ?  18 ALA A HB3  6  
ATOM   3202 N N    . ASN A 1 19 ? -1.068  -9.272  0.787  1.00 0.24 ?  19 ASN A N    6  
ATOM   3203 C CA   . ASN A 1 19 ? -0.821  -10.426 -0.072 1.00 0.24 ?  19 ASN A CA   6  
ATOM   3204 C C    . ASN A 1 19 ? 0.451   -10.223 -0.904 1.00 0.19 ?  19 ASN A C    6  
ATOM   3205 O O    . ASN A 1 19 ? 0.991   -11.169 -1.480 1.00 0.22 ?  19 ASN A O    6  
ATOM   3206 C CB   . ASN A 1 19 ? -2.022  -10.670 -0.993 1.00 0.31 ?  19 ASN A CB   6  
ATOM   3207 C CG   . ASN A 1 19 ? -1.906  -11.967 -1.777 1.00 0.36 ?  19 ASN A CG   6  
ATOM   3208 O OD1  . ASN A 1 19 ? -1.314  -12.937 -1.310 1.00 1.14 ?  19 ASN A OD1  6  
ATOM   3209 N ND2  . ASN A 1 19 ? -2.473  -11.994 -2.974 1.00 1.08 ?  19 ASN A ND2  6  
ATOM   3210 H H    . ASN A 1 19 ? -1.826  -8.676  0.588  1.00 0.25 ?  19 ASN A H    6  
ATOM   3211 H HA   . ASN A 1 19 ? -0.685  -11.286 0.564  1.00 0.27 ?  19 ASN A HA   6  
ATOM   3212 H HB2  . ASN A 1 19 ? -2.921  -10.711 -0.396 1.00 0.38 ?  19 ASN A HB2  6  
ATOM   3213 H HB3  . ASN A 1 19 ? -2.097  -9.851  -1.693 1.00 0.32 ?  19 ASN A HB3  6  
ATOM   3214 H HD21 . ASN A 1 19 ? -2.933  -11.189 -3.291 1.00 1.83 ?  19 ASN A HD21 6  
ATOM   3215 H HD22 . ASN A 1 19 ? -2.411  -12.823 -3.495 1.00 1.08 ?  19 ASN A HD22 6  
ATOM   3216 N N    . LEU A 1 20 ? 0.924   -8.986  -0.966 1.00 0.17 ?  20 LEU A N    6  
ATOM   3217 C CA   . LEU A 1 20 ? 2.160   -8.670  -1.670 1.00 0.17 ?  20 LEU A CA   6  
ATOM   3218 C C    . LEU A 1 20 ? 3.362   -8.987  -0.791 1.00 0.17 ?  20 LEU A C    6  
ATOM   3219 O O    . LEU A 1 20 ? 3.252   -9.001  0.436  1.00 0.18 ?  20 LEU A O    6  
ATOM   3220 C CB   . LEU A 1 20 ? 2.195   -7.188  -2.053 1.00 0.20 ?  20 LEU A CB   6  
ATOM   3221 C CG   . LEU A 1 20 ? 1.157   -6.747  -3.083 1.00 0.29 ?  20 LEU A CG   6  
ATOM   3222 C CD1  . LEU A 1 20 ? 1.117   -5.231  -3.179 1.00 0.32 ?  20 LEU A CD1  6  
ATOM   3223 C CD2  . LEU A 1 20 ? 1.472   -7.353  -4.443 1.00 0.41 ?  20 LEU A CD2  6  
ATOM   3224 H H    . LEU A 1 20 ? 0.438   -8.262  -0.511 1.00 0.19 ?  20 LEU A H    6  
ATOM   3225 H HA   . LEU A 1 20 ? 2.204   -9.273  -2.563 1.00 0.22 ?  20 LEU A HA   6  
ATOM   3226 H HB2  . LEU A 1 20 ? 2.050   -6.606  -1.155 1.00 0.19 ?  20 LEU A HB2  6  
ATOM   3227 H HB3  . LEU A 1 20 ? 3.176   -6.968  -2.446 1.00 0.24 ?  20 LEU A HB3  6  
ATOM   3228 H HG   . LEU A 1 20 ? 0.180   -7.093  -2.777 1.00 0.33 ?  20 LEU A HG   6  
ATOM   3229 H HD11 . LEU A 1 20 ? 0.907   -4.813  -2.205 1.00 1.04 ?  20 LEU A HD11 6  
ATOM   3230 H HD12 . LEU A 1 20 ? 0.346   -4.935  -3.872 1.00 1.05 ?  20 LEU A HD12 6  
ATOM   3231 H HD13 . LEU A 1 20 ? 2.073   -4.867  -3.526 1.00 1.10 ?  20 LEU A HD13 6  
ATOM   3232 H HD21 . LEU A 1 20 ? 2.454   -7.032  -4.760 1.00 1.10 ?  20 LEU A HD21 6  
ATOM   3233 H HD22 . LEU A 1 20 ? 0.737   -7.024  -5.163 1.00 0.88 ?  20 LEU A HD22 6  
ATOM   3234 H HD23 . LEU A 1 20 ? 1.451   -8.430  -4.372 1.00 1.17 ?  20 LEU A HD23 6  
ATOM   3235 N N    . PRO A 1 21 ? 4.520   -9.263  -1.407 1.00 0.23 ?  21 PRO A N    6  
ATOM   3236 C CA   . PRO A 1 21 ? 5.767   -9.471  -0.675 1.00 0.29 ?  21 PRO A CA   6  
ATOM   3237 C C    . PRO A 1 21 ? 6.131   -8.239  0.148  1.00 0.26 ?  21 PRO A C    6  
ATOM   3238 O O    . PRO A 1 21 ? 5.910   -7.099  -0.272 1.00 0.22 ?  21 PRO A O    6  
ATOM   3239 C CB   . PRO A 1 21 ? 6.811   -9.717  -1.771 1.00 0.38 ?  21 PRO A CB   6  
ATOM   3240 C CG   . PRO A 1 21 ? 6.180   -9.267  -3.046 1.00 0.43 ?  21 PRO A CG   6  
ATOM   3241 C CD   . PRO A 1 21 ? 4.696   -9.405  -2.860 1.00 0.30 ?  21 PRO A CD   6  
ATOM   3242 H HA   . PRO A 1 21 ? 5.706   -10.332 -0.026 1.00 0.32 ?  21 PRO A HA   6  
ATOM   3243 H HB2  . PRO A 1 21 ? 7.701   -9.143  -1.553 1.00 0.43 ?  21 PRO A HB2  6  
ATOM   3244 H HB3  . PRO A 1 21 ? 7.057   -10.767 -1.803 1.00 0.48 ?  21 PRO A HB3  6  
ATOM   3245 H HG2  . PRO A 1 21 ? 6.435   -8.234  -3.236 1.00 0.63 ?  21 PRO A HG2  6  
ATOM   3246 H HG3  . PRO A 1 21 ? 6.515   -9.893  -3.861 1.00 0.61 ?  21 PRO A HG3  6  
ATOM   3247 H HD2  . PRO A 1 21 ? 4.178   -8.620  -3.388 1.00 0.40 ?  21 PRO A HD2  6  
ATOM   3248 H HD3  . PRO A 1 21 ? 4.356   -10.373 -3.197 1.00 0.39 ?  21 PRO A HD3  6  
ATOM   3249 N N    . LEU A 1 22 ? 6.696   -8.493  1.325  1.00 0.30 ?  22 LEU A N    6  
ATOM   3250 C CA   . LEU A 1 22 ? 6.953   -7.460  2.321  1.00 0.31 ?  22 LEU A CA   6  
ATOM   3251 C C    . LEU A 1 22 ? 7.817   -6.332  1.771  1.00 0.28 ?  22 LEU A C    6  
ATOM   3252 O O    . LEU A 1 22 ? 7.646   -5.179  2.160  1.00 0.28 ?  22 LEU A O    6  
ATOM   3253 C CB   . LEU A 1 22 ? 7.622   -8.074  3.553  1.00 0.41 ?  22 LEU A CB   6  
ATOM   3254 C CG   . LEU A 1 22 ? 7.916   -7.097  4.695  1.00 1.07 ?  22 LEU A CG   6  
ATOM   3255 C CD1  . LEU A 1 22 ? 6.626   -6.512  5.256  1.00 1.64 ?  22 LEU A CD1  6  
ATOM   3256 C CD2  . LEU A 1 22 ? 8.713   -7.783  5.793  1.00 1.54 ?  22 LEU A CD2  6  
ATOM   3257 H H    . LEU A 1 22 ? 6.953   -9.419  1.535  1.00 0.34 ?  22 LEU A H    6  
ATOM   3258 H HA   . LEU A 1 22 ? 6.001   -7.051  2.615  1.00 0.30 ?  22 LEU A HA   6  
ATOM   3259 H HB2  . LEU A 1 22 ? 6.980   -8.856  3.932  1.00 1.00 ?  22 LEU A HB2  6  
ATOM   3260 H HB3  . LEU A 1 22 ? 8.556   -8.519  3.242  1.00 0.94 ?  22 LEU A HB3  6  
ATOM   3261 H HG   . LEU A 1 22 ? 8.509   -6.281  4.311  1.00 1.97 ?  22 LEU A HG   6  
ATOM   3262 H HD11 . LEU A 1 22 ? 5.984   -7.313  5.593  1.00 2.16 ?  22 LEU A HD11 6  
ATOM   3263 H HD12 . LEU A 1 22 ? 6.122   -5.946  4.486  1.00 1.77 ?  22 LEU A HD12 6  
ATOM   3264 H HD13 . LEU A 1 22 ? 6.856   -5.862  6.087  1.00 2.26 ?  22 LEU A HD13 6  
ATOM   3265 H HD21 . LEU A 1 22 ? 8.920   -7.076  6.583  1.00 2.09 ?  22 LEU A HD21 6  
ATOM   3266 H HD22 . LEU A 1 22 ? 9.643   -8.152  5.386  1.00 1.81 ?  22 LEU A HD22 6  
ATOM   3267 H HD23 . LEU A 1 22 ? 8.141   -8.608  6.190  1.00 2.05 ?  22 LEU A HD23 6  
ATOM   3268 N N    . TRP A 1 23 ? 8.741   -6.655  0.871  1.00 0.33 ?  23 TRP A N    6  
ATOM   3269 C CA   . TRP A 1 23 ? 9.586   -5.630  0.272  1.00 0.34 ?  23 TRP A CA   6  
ATOM   3270 C C    . TRP A 1 23 ? 8.758   -4.717  -0.629 1.00 0.27 ?  23 TRP A C    6  
ATOM   3271 O O    . TRP A 1 23 ? 9.010   -3.513  -0.715 1.00 0.25 ?  23 TRP A O    6  
ATOM   3272 C CB   . TRP A 1 23 ? 10.760  -6.251  -0.503 1.00 0.42 ?  23 TRP A CB   6  
ATOM   3273 C CG   . TRP A 1 23 ? 10.368  -7.115  -1.664 1.00 0.48 ?  23 TRP A CG   6  
ATOM   3274 C CD1  . TRP A 1 23 ? 10.212  -8.469  -1.665 1.00 0.56 ?  23 TRP A CD1  6  
ATOM   3275 C CD2  . TRP A 1 23 ? 10.102  -6.682  -3.003 1.00 0.51 ?  23 TRP A CD2  6  
ATOM   3276 N NE1  . TRP A 1 23 ? 9.862   -8.902  -2.920 1.00 0.62 ?  23 TRP A NE1  6  
ATOM   3277 C CE2  . TRP A 1 23 ? 9.785   -7.823  -3.758 1.00 0.60 ?  23 TRP A CE2  6  
ATOM   3278 C CE3  . TRP A 1 23 ? 10.095  -5.437  -3.633 1.00 0.49 ?  23 TRP A CE3  6  
ATOM   3279 C CZ2  . TRP A 1 23 ? 9.466   -7.756  -5.111 1.00 0.68 ?  23 TRP A CZ2  6  
ATOM   3280 C CZ3  . TRP A 1 23 ? 9.778   -5.371  -4.974 1.00 0.59 ?  23 TRP A CZ3  6  
ATOM   3281 C CH2  . TRP A 1 23 ? 9.467   -6.523  -5.701 1.00 0.68 ?  23 TRP A CH2  6  
ATOM   3282 H H    . TRP A 1 23 ? 8.859   -7.594  0.614  1.00 0.37 ?  23 TRP A H    6  
ATOM   3283 H HA   . TRP A 1 23 ? 9.984   -5.033  1.080  1.00 0.35 ?  23 TRP A HA   6  
ATOM   3284 H HB2  . TRP A 1 23 ? 11.382  -5.459  -0.885 1.00 0.42 ?  23 TRP A HB2  6  
ATOM   3285 H HB3  . TRP A 1 23 ? 11.344  -6.856  0.176  1.00 0.48 ?  23 TRP A HB3  6  
ATOM   3286 H HD1  . TRP A 1 23 ? 10.348  -9.095  -0.798 1.00 0.59 ?  23 TRP A HD1  6  
ATOM   3287 H HE1  . TRP A 1 23 ? 9.693   -9.836  -3.175 1.00 0.69 ?  23 TRP A HE1  6  
ATOM   3288 H HE3  . TRP A 1 23 ? 10.331  -4.536  -3.086 1.00 0.44 ?  23 TRP A HE3  6  
ATOM   3289 H HZ2  . TRP A 1 23 ? 9.222   -8.638  -5.685 1.00 0.76 ?  23 TRP A HZ2  6  
ATOM   3290 H HZ3  . TRP A 1 23 ? 9.768   -4.416  -5.477 1.00 0.61 ?  23 TRP A HZ3  6  
ATOM   3291 H HH2  . TRP A 1 23 ? 9.227   -6.422  -6.748 1.00 0.76 ?  23 TRP A HH2  6  
ATOM   3292 N N    . LYS A 1 24 ? 7.743   -5.291  -1.269 1.00 0.24 ?  24 LYS A N    6  
ATOM   3293 C CA   . LYS A 1 24 ? 6.855   -4.529  -2.131 1.00 0.22 ?  24 LYS A CA   6  
ATOM   3294 C C    . LYS A 1 24 ? 5.992   -3.624  -1.273 1.00 0.14 ?  24 LYS A C    6  
ATOM   3295 O O    . LYS A 1 24 ? 5.766   -2.462  -1.605 1.00 0.15 ?  24 LYS A O    6  
ATOM   3296 C CB   . LYS A 1 24 ? 5.974   -5.463  -2.970 1.00 0.26 ?  24 LYS A CB   6  
ATOM   3297 C CG   . LYS A 1 24 ? 5.078   -4.735  -3.961 1.00 0.35 ?  24 LYS A CG   6  
ATOM   3298 C CD   . LYS A 1 24 ? 5.893   -4.029  -5.033 1.00 0.97 ?  24 LYS A CD   6  
ATOM   3299 C CE   . LYS A 1 24 ? 5.002   -3.277  -6.009 1.00 0.98 ?  24 LYS A CE   6  
ATOM   3300 N NZ   . LYS A 1 24 ? 5.789   -2.607  -7.074 1.00 1.37 1  24 LYS A NZ   6  
ATOM   3301 H H    . LYS A 1 24 ? 7.573   -6.250  -1.136 1.00 0.26 ?  24 LYS A H    6  
ATOM   3302 H HA   . LYS A 1 24 ? 7.464   -3.922  -2.786 1.00 0.25 ?  24 LYS A HA   6  
ATOM   3303 H HB2  . LYS A 1 24 ? 6.610   -6.138  -3.522 1.00 0.33 ?  24 LYS A HB2  6  
ATOM   3304 H HB3  . LYS A 1 24 ? 5.344   -6.037  -2.305 1.00 0.24 ?  24 LYS A HB3  6  
ATOM   3305 H HG2  . LYS A 1 24 ? 4.422   -5.452  -4.435 1.00 0.83 ?  24 LYS A HG2  6  
ATOM   3306 H HG3  . LYS A 1 24 ? 4.491   -4.001  -3.427 1.00 0.96 ?  24 LYS A HG3  6  
ATOM   3307 H HD2  . LYS A 1 24 ? 6.559   -3.327  -4.559 1.00 1.51 ?  24 LYS A HD2  6  
ATOM   3308 H HD3  . LYS A 1 24 ? 6.467   -4.765  -5.576 1.00 1.43 ?  24 LYS A HD3  6  
ATOM   3309 H HE2  . LYS A 1 24 ? 4.319   -3.978  -6.466 1.00 1.17 ?  24 LYS A HE2  6  
ATOM   3310 H HE3  . LYS A 1 24 ? 4.441   -2.533  -5.464 1.00 1.36 ?  24 LYS A HE3  6  
ATOM   3311 H HZ1  . LYS A 1 24 ? 6.470   -1.942  -6.656 1.00 1.91 ?  24 LYS A HZ1  6  
ATOM   3312 H HZ2  . LYS A 1 24 ? 5.158   -2.081  -7.711 1.00 1.69 ?  24 LYS A HZ2  6  
ATOM   3313 H HZ3  . LYS A 1 24 ? 6.312   -3.313  -7.631 1.00 1.76 ?  24 LYS A HZ3  6  
ATOM   3314 N N    . GLN A 1 25 ? 5.526   -4.174  -0.158 1.00 0.11 ?  25 GLN A N    6  
ATOM   3315 C CA   . GLN A 1 25 ? 4.775   -3.404  0.823  1.00 0.09 ?  25 GLN A CA   6  
ATOM   3316 C C    . GLN A 1 25 ? 5.590   -2.207  1.296  1.00 0.09 ?  25 GLN A C    6  
ATOM   3317 O O    . GLN A 1 25 ? 5.091   -1.083  1.338  1.00 0.12 ?  25 GLN A O    6  
ATOM   3318 C CB   . GLN A 1 25 ? 4.406   -4.275  2.023  1.00 0.14 ?  25 GLN A CB   6  
ATOM   3319 C CG   . GLN A 1 25 ? 3.478   -5.428  1.688  1.00 0.16 ?  25 GLN A CG   6  
ATOM   3320 C CD   . GLN A 1 25 ? 3.096   -6.231  2.916  1.00 0.22 ?  25 GLN A CD   6  
ATOM   3321 O OE1  . GLN A 1 25 ? 3.026   -5.698  4.023  1.00 0.41 ?  25 GLN A OE1  6  
ATOM   3322 N NE2  . GLN A 1 25 ? 2.845   -7.516  2.731  1.00 0.24 ?  25 GLN A NE2  6  
ATOM   3323 H H    . GLN A 1 25 ? 5.686   -5.132  0.005  1.00 0.15 ?  25 GLN A H    6  
ATOM   3324 H HA   . GLN A 1 25 ? 3.871   -3.050  0.349  1.00 0.10 ?  25 GLN A HA   6  
ATOM   3325 H HB2  . GLN A 1 25 ? 5.310   -4.684  2.447  1.00 0.22 ?  25 GLN A HB2  6  
ATOM   3326 H HB3  . GLN A 1 25 ? 3.921   -3.657  2.761  1.00 0.18 ?  25 GLN A HB3  6  
ATOM   3327 H HG2  . GLN A 1 25 ? 2.579   -5.028  1.243  1.00 0.18 ?  25 GLN A HG2  6  
ATOM   3328 H HG3  . GLN A 1 25 ? 3.969   -6.081  0.983  1.00 0.21 ?  25 GLN A HG3  6  
ATOM   3329 H HE21 . GLN A 1 25 ? 2.916   -7.879  1.817  1.00 0.33 ?  25 GLN A HE21 6  
ATOM   3330 H HE22 . GLN A 1 25 ? 2.601   -8.056  3.511  1.00 0.27 ?  25 GLN A HE22 6  
ATOM   3331 N N    . GLN A 1 26 ? 6.849   -2.460  1.642  1.00 0.14 ?  26 GLN A N    6  
ATOM   3332 C CA   . GLN A 1 26 ? 7.753   -1.403  2.083  1.00 0.18 ?  26 GLN A CA   6  
ATOM   3333 C C    . GLN A 1 26 ? 7.876   -0.313  1.026  1.00 0.18 ?  26 GLN A C    6  
ATOM   3334 O O    . GLN A 1 26 ? 7.695   0.869   1.320  1.00 0.25 ?  26 GLN A O    6  
ATOM   3335 C CB   . GLN A 1 26 ? 9.140   -1.965  2.393  1.00 0.28 ?  26 GLN A CB   6  
ATOM   3336 C CG   . GLN A 1 26 ? 9.189   -2.881  3.605  1.00 0.38 ?  26 GLN A CG   6  
ATOM   3337 C CD   . GLN A 1 26 ? 10.585  -3.408  3.869  1.00 0.90 ?  26 GLN A CD   6  
ATOM   3338 O OE1  . GLN A 1 26 ? 11.581  -2.748  3.565  1.00 1.46 ?  26 GLN A OE1  6  
ATOM   3339 N NE2  . GLN A 1 26 ? 10.670  -4.601  4.434  1.00 1.59 ?  26 GLN A NE2  6  
ATOM   3340 H H    . GLN A 1 26 ? 7.175   -3.388  1.607  1.00 0.18 ?  26 GLN A H    6  
ATOM   3341 H HA   . GLN A 1 26 ? 7.341   -0.970  2.981  1.00 0.21 ?  26 GLN A HA   6  
ATOM   3342 H HB2  . GLN A 1 26 ? 9.486   -2.522  1.538  1.00 0.31 ?  26 GLN A HB2  6  
ATOM   3343 H HB3  . GLN A 1 26 ? 9.815   -1.140  2.568  1.00 0.31 ?  26 GLN A HB3  6  
ATOM   3344 H HG2  . GLN A 1 26 ? 8.859   -2.330  4.472  1.00 0.76 ?  26 GLN A HG2  6  
ATOM   3345 H HG3  . GLN A 1 26 ? 8.528   -3.719  3.437  1.00 0.60 ?  26 GLN A HG3  6  
ATOM   3346 H HE21 . GLN A 1 26 ? 9.838   -5.072  4.648  1.00 1.96 ?  26 GLN A HE21 6  
ATOM   3347 H HE22 . GLN A 1 26 ? 11.564  -4.967  4.609  1.00 1.99 ?  26 GLN A HE22 6  
ATOM   3348 N N    . ASN A 1 27 ? 8.170   -0.717  -0.207 1.00 0.19 ?  27 ASN A N    6  
ATOM   3349 C CA   . ASN A 1 27 ? 8.376   0.234   -1.297 1.00 0.26 ?  27 ASN A CA   6  
ATOM   3350 C C    . ASN A 1 27 ? 7.116   1.043   -1.578 1.00 0.22 ?  27 ASN A C    6  
ATOM   3351 O O    . ASN A 1 27 ? 7.183   2.257   -1.767 1.00 0.25 ?  27 ASN A O    6  
ATOM   3352 C CB   . ASN A 1 27 ? 8.826   -0.484  -2.568 1.00 0.38 ?  27 ASN A CB   6  
ATOM   3353 C CG   . ASN A 1 27 ? 10.204  -1.096  -2.433 1.00 0.98 ?  27 ASN A CG   6  
ATOM   3354 O OD1  . ASN A 1 27 ? 11.039  -0.615  -1.670 1.00 1.81 ?  27 ASN A OD1  6  
ATOM   3355 N ND2  . ASN A 1 27 ? 10.459  -2.152  -3.185 1.00 1.18 ?  27 ASN A ND2  6  
ATOM   3356 H H    . ASN A 1 27 ? 8.258   -1.681  -0.387 1.00 0.20 ?  27 ASN A H    6  
ATOM   3357 H HA   . ASN A 1 27 ? 9.156   0.914   -0.991 1.00 0.34 ?  27 ASN A HA   6  
ATOM   3358 H HB2  . ASN A 1 27 ? 8.124   -1.273  -2.791 1.00 0.77 ?  27 ASN A HB2  6  
ATOM   3359 H HB3  . ASN A 1 27 ? 8.841   0.221   -3.386 1.00 0.92 ?  27 ASN A HB3  6  
ATOM   3360 H HD21 . ASN A 1 27 ? 9.753   -2.476  -3.784 1.00 1.16 ?  27 ASN A HD21 6  
ATOM   3361 H HD22 . ASN A 1 27 ? 11.346  -2.566  -3.117 1.00 1.75 ?  27 ASN A HD22 6  
ATOM   3362 N N    . LEU A 1 28 ? 5.974   0.372   -1.599 1.00 0.19 ?  28 LEU A N    6  
ATOM   3363 C CA   . LEU A 1 28 ? 4.697   1.033   -1.843 1.00 0.24 ?  28 LEU A CA   6  
ATOM   3364 C C    . LEU A 1 28 ? 4.370   2.021   -0.729 1.00 0.24 ?  28 LEU A C    6  
ATOM   3365 O O    . LEU A 1 28 ? 3.983   3.161   -0.989 1.00 0.29 ?  28 LEU A O    6  
ATOM   3366 C CB   . LEU A 1 28 ? 3.582   -0.004  -1.959 1.00 0.28 ?  28 LEU A CB   6  
ATOM   3367 C CG   . LEU A 1 28 ? 3.568   -0.816  -3.255 1.00 0.38 ?  28 LEU A CG   6  
ATOM   3368 C CD1  . LEU A 1 28 ? 2.537   -1.928  -3.174 1.00 0.88 ?  28 LEU A CD1  6  
ATOM   3369 C CD2  . LEU A 1 28 ? 3.274   0.083   -4.444 1.00 0.72 ?  28 LEU A CD2  6  
ATOM   3370 H H    . LEU A 1 28 ? 5.987   -0.600  -1.449 1.00 0.18 ?  28 LEU A H    6  
ATOM   3371 H HA   . LEU A 1 28 ? 4.776   1.571   -2.773 1.00 0.30 ?  28 LEU A HA   6  
ATOM   3372 H HB2  . LEU A 1 28 ? 3.681   -0.691  -1.134 1.00 0.28 ?  28 LEU A HB2  6  
ATOM   3373 H HB3  . LEU A 1 28 ? 2.639   0.505   -1.870 1.00 0.33 ?  28 LEU A HB3  6  
ATOM   3374 H HG   . LEU A 1 28 ? 4.538   -1.267  -3.403 1.00 0.78 ?  28 LEU A HG   6  
ATOM   3375 H HD11 . LEU A 1 28 ? 1.561   -1.502  -2.995 1.00 1.30 ?  28 LEU A HD11 6  
ATOM   3376 H HD12 . LEU A 1 28 ? 2.792   -2.598  -2.366 1.00 1.54 ?  28 LEU A HD12 6  
ATOM   3377 H HD13 . LEU A 1 28 ? 2.526   -2.476  -4.104 1.00 1.23 ?  28 LEU A HD13 6  
ATOM   3378 H HD21 . LEU A 1 28 ? 3.200   -0.517  -5.338 1.00 1.32 ?  28 LEU A HD21 6  
ATOM   3379 H HD22 . LEU A 1 28 ? 4.071   0.802   -4.558 1.00 1.40 ?  28 LEU A HD22 6  
ATOM   3380 H HD23 . LEU A 1 28 ? 2.342   0.601   -4.279 1.00 1.20 ?  28 LEU A HD23 6  
ATOM   3381 N N    . LYS A 1 29 ? 4.540   1.579   0.507  1.00 0.24 ?  29 LYS A N    6  
ATOM   3382 C CA   . LYS A 1 29 ? 4.274   2.418   1.667  1.00 0.32 ?  29 LYS A CA   6  
ATOM   3383 C C    . LYS A 1 29 ? 5.248   3.591   1.719  1.00 0.34 ?  29 LYS A C    6  
ATOM   3384 O O    . LYS A 1 29 ? 4.905   4.674   2.187  1.00 0.40 ?  29 LYS A O    6  
ATOM   3385 C CB   . LYS A 1 29 ? 4.363   1.583   2.946  1.00 0.42 ?  29 LYS A CB   6  
ATOM   3386 C CG   . LYS A 1 29 ? 4.062   2.362   4.213  1.00 0.71 ?  29 LYS A CG   6  
ATOM   3387 C CD   . LYS A 1 29 ? 4.102   1.469   5.444  1.00 1.19 ?  29 LYS A CD   6  
ATOM   3388 C CE   . LYS A 1 29 ? 2.963   0.456   5.453  1.00 1.23 ?  29 LYS A CE   6  
ATOM   3389 N NZ   . LYS A 1 29 ? 2.982   -0.391  6.673  1.00 1.39 1  29 LYS A NZ   6  
ATOM   3390 H H    . LYS A 1 29 ? 4.850   0.656   0.646  1.00 0.22 ?  29 LYS A H    6  
ATOM   3391 H HA   . LYS A 1 29 ? 3.272   2.806   1.573  1.00 0.36 ?  29 LYS A HA   6  
ATOM   3392 H HB2  . LYS A 1 29 ? 3.656   0.773   2.876  1.00 0.78 ?  29 LYS A HB2  6  
ATOM   3393 H HB3  . LYS A 1 29 ? 5.361   1.176   3.028  1.00 0.60 ?  29 LYS A HB3  6  
ATOM   3394 H HG2  . LYS A 1 29 ? 4.798   3.145   4.324  1.00 1.23 ?  29 LYS A HG2  6  
ATOM   3395 H HG3  . LYS A 1 29 ? 3.079   2.800   4.127  1.00 1.29 ?  29 LYS A HG3  6  
ATOM   3396 H HD2  . LYS A 1 29 ? 5.039   0.935   5.454  1.00 1.64 ?  29 LYS A HD2  6  
ATOM   3397 H HD3  . LYS A 1 29 ? 4.028   2.088   6.325  1.00 1.75 ?  29 LYS A HD3  6  
ATOM   3398 H HE2  . LYS A 1 29 ? 2.026   0.985   5.410  1.00 1.53 ?  29 LYS A HE2  6  
ATOM   3399 H HE3  . LYS A 1 29 ? 3.055   -0.180  4.587  1.00 1.48 ?  29 LYS A HE3  6  
ATOM   3400 H HZ1  . LYS A 1 29 ? 3.853   -0.960  6.700  1.00 2.04 ?  29 LYS A HZ1  6  
ATOM   3401 H HZ2  . LYS A 1 29 ? 2.166   -1.033  6.677  1.00 1.56 ?  29 LYS A HZ2  6  
ATOM   3402 H HZ3  . LYS A 1 29 ? 2.946   0.203   7.524  1.00 1.51 ?  29 LYS A HZ3  6  
ATOM   3403 N N    . LYS A 1 30 ? 6.454   3.373   1.220  1.00 0.34 ?  30 LYS A N    6  
ATOM   3404 C CA   . LYS A 1 30 ? 7.449   4.430   1.135  1.00 0.43 ?  30 LYS A CA   6  
ATOM   3405 C C    . LYS A 1 30 ? 7.097   5.388   0.002  1.00 0.42 ?  30 LYS A C    6  
ATOM   3406 O O    . LYS A 1 30 ? 7.352   6.588   0.079  1.00 0.47 ?  30 LYS A O    6  
ATOM   3407 C CB   . LYS A 1 30 ? 8.833   3.827   0.890  1.00 0.54 ?  30 LYS A CB   6  
ATOM   3408 C CG   . LYS A 1 30 ? 9.985   4.749   1.255  1.00 1.28 ?  30 LYS A CG   6  
ATOM   3409 C CD   . LYS A 1 30 ? 10.135  4.881   2.763  1.00 1.67 ?  30 LYS A CD   6  
ATOM   3410 C CE   . LYS A 1 30 ? 11.397  5.647   3.137  1.00 2.49 ?  30 LYS A CE   6  
ATOM   3411 N NZ   . LYS A 1 30 ? 11.617  5.672   4.608  1.00 3.14 1  30 LYS A NZ   6  
ATOM   3412 H H    . LYS A 1 30 ? 6.688   2.468   0.914  1.00 0.33 ?  30 LYS A H    6  
ATOM   3413 H HA   . LYS A 1 30 ? 7.454   4.969   2.069  1.00 0.48 ?  30 LYS A HA   6  
ATOM   3414 H HB2  . LYS A 1 30 ? 8.926   2.924   1.473  1.00 0.89 ?  30 LYS A HB2  6  
ATOM   3415 H HB3  . LYS A 1 30 ? 8.920   3.576   -0.157 1.00 1.06 ?  30 LYS A HB3  6  
ATOM   3416 H HG2  . LYS A 1 30 ? 10.899  4.347   0.844  1.00 1.89 ?  30 LYS A HG2  6  
ATOM   3417 H HG3  . LYS A 1 30 ? 9.796   5.726   0.834  1.00 1.85 ?  30 LYS A HG3  6  
ATOM   3418 H HD2  . LYS A 1 30 ? 9.277   5.406   3.156  1.00 2.02 ?  30 LYS A HD2  6  
ATOM   3419 H HD3  . LYS A 1 30 ? 10.182  3.893   3.198  1.00 1.96 ?  30 LYS A HD3  6  
ATOM   3420 H HE2  . LYS A 1 30 ? 12.244  5.174   2.665  1.00 2.89 ?  30 LYS A HE2  6  
ATOM   3421 H HE3  . LYS A 1 30 ? 11.308  6.663   2.778  1.00 2.91 ?  30 LYS A HE3  6  
ATOM   3422 H HZ1  . LYS A 1 30 ? 10.813  6.125   5.085  1.00 3.57 ?  30 LYS A HZ1  6  
ATOM   3423 H HZ2  . LYS A 1 30 ? 12.482  6.207   4.831  1.00 3.62 ?  30 LYS A HZ2  6  
ATOM   3424 H HZ3  . LYS A 1 30 ? 11.720  4.703   4.969  1.00 3.29 ?  30 LYS A HZ3  6  
ATOM   3425 N N    . GLU A 1 31 ? 6.500   4.839   -1.049 1.00 0.42 ?  31 GLU A N    6  
ATOM   3426 C CA   . GLU A 1 31 ? 6.159   5.605   -2.239 1.00 0.49 ?  31 GLU A CA   6  
ATOM   3427 C C    . GLU A 1 31 ? 4.940   6.491   -2.007 1.00 0.52 ?  31 GLU A C    6  
ATOM   3428 O O    . GLU A 1 31 ? 4.855   7.596   -2.542 1.00 0.70 ?  31 GLU A O    6  
ATOM   3429 C CB   . GLU A 1 31 ? 5.894   4.656   -3.408 1.00 0.52 ?  31 GLU A CB   6  
ATOM   3430 C CG   . GLU A 1 31 ? 5.747   5.359   -4.744 1.00 0.87 ?  31 GLU A CG   6  
ATOM   3431 C CD   . GLU A 1 31 ? 5.406   4.404   -5.865 1.00 1.47 ?  31 GLU A CD   6  
ATOM   3432 O OE1  . GLU A 1 31 ? 6.336   3.790   -6.427 1.00 1.67 ?  31 GLU A OE1  6  
ATOM   3433 O OE2  . GLU A 1 31 ? 4.206   4.258   -6.183 1.00 2.30 -1 31 GLU A OE2  6  
ATOM   3434 H H    . GLU A 1 31 ? 6.295   3.876   -1.029 1.00 0.41 ?  31 GLU A H    6  
ATOM   3435 H HA   . GLU A 1 31 ? 7.004   6.231   -2.481 1.00 0.57 ?  31 GLU A HA   6  
ATOM   3436 H HB2  . GLU A 1 31 ? 6.711   3.956   -3.482 1.00 0.87 ?  31 GLU A HB2  6  
ATOM   3437 H HB3  . GLU A 1 31 ? 4.982   4.112   -3.211 1.00 0.80 ?  31 GLU A HB3  6  
ATOM   3438 H HG2  . GLU A 1 31 ? 4.961   6.093   -4.667 1.00 1.45 ?  31 GLU A HG2  6  
ATOM   3439 H HG3  . GLU A 1 31 ? 6.676   5.853   -4.982 1.00 1.49 ?  31 GLU A HG3  6  
ATOM   3440 N N    . LYS A 1 32 ? 4.001   6.001   -1.209 1.00 0.43 ?  32 LYS A N    6  
ATOM   3441 C CA   . LYS A 1 32 ? 2.756   6.722   -0.953 1.00 0.55 ?  32 LYS A CA   6  
ATOM   3442 C C    . LYS A 1 32 ? 2.995   7.990   -0.130 1.00 0.66 ?  32 LYS A C    6  
ATOM   3443 O O    . LYS A 1 32 ? 2.090   8.810   0.031  1.00 1.23 ?  32 LYS A O    6  
ATOM   3444 C CB   . LYS A 1 32 ? 1.748   5.805   -0.239 1.00 0.74 ?  32 LYS A CB   6  
ATOM   3445 C CG   . LYS A 1 32 ? 2.149   5.412   1.178  1.00 1.46 ?  32 LYS A CG   6  
ATOM   3446 C CD   . LYS A 1 32 ? 1.544   6.338   2.226  1.00 2.20 ?  32 LYS A CD   6  
ATOM   3447 C CE   . LYS A 1 32 ? 2.049   6.011   3.624  1.00 3.14 ?  32 LYS A CE   6  
ATOM   3448 N NZ   . LYS A 1 32 ? 3.490   6.344   3.793  1.00 3.91 1  32 LYS A NZ   6  
ATOM   3449 H H    . LYS A 1 32 ? 4.138   5.117   -0.797 1.00 0.38 ?  32 LYS A H    6  
ATOM   3450 H HA   . LYS A 1 32 ? 2.344   7.007   -1.907 1.00 0.79 ?  32 LYS A HA   6  
ATOM   3451 H HB2  . LYS A 1 32 ? 0.794   6.309   -0.191 1.00 1.02 ?  32 LYS A HB2  6  
ATOM   3452 H HB3  . LYS A 1 32 ? 1.635   4.901   -0.819 1.00 1.25 ?  32 LYS A HB3  6  
ATOM   3453 H HG2  . LYS A 1 32 ? 1.812   4.406   1.369  1.00 2.11 ?  32 LYS A HG2  6  
ATOM   3454 H HG3  . LYS A 1 32 ? 3.225   5.452   1.256  1.00 1.77 ?  32 LYS A HG3  6  
ATOM   3455 H HD2  . LYS A 1 32 ? 1.809   7.357   1.987  1.00 2.36 ?  32 LYS A HD2  6  
ATOM   3456 H HD3  . LYS A 1 32 ? 0.469   6.231   2.207  1.00 2.67 ?  32 LYS A HD3  6  
ATOM   3457 H HE2  . LYS A 1 32 ? 1.474   6.576   4.341  1.00 3.54 ?  32 LYS A HE2  6  
ATOM   3458 H HE3  . LYS A 1 32 ? 1.911   4.955   3.805  1.00 3.37 ?  32 LYS A HE3  6  
ATOM   3459 H HZ1  . LYS A 1 32 ? 4.065   5.832   3.090  1.00 3.96 ?  32 LYS A HZ1  6  
ATOM   3460 H HZ2  . LYS A 1 32 ? 3.811   6.075   4.744  1.00 4.35 ?  32 LYS A HZ2  6  
ATOM   3461 H HZ3  . LYS A 1 32 ? 3.640   7.367   3.670  1.00 4.36 ?  32 LYS A HZ3  6  
ATOM   3462 N N    . GLY A 1 33 ? 4.205   8.150   0.389  1.00 0.94 ?  33 GLY A N    6  
ATOM   3463 C CA   . GLY A 1 33 ? 4.488   9.287   1.235  1.00 1.34 ?  33 GLY A CA   6  
ATOM   3464 C C    . GLY A 1 33 ? 5.767   10.007  0.865  1.00 1.43 ?  33 GLY A C    6  
ATOM   3465 O O    . GLY A 1 33 ? 5.731   11.144  0.390  1.00 1.99 ?  33 GLY A O    6  
ATOM   3466 H H    . GLY A 1 33 ? 4.911   7.500   0.187  1.00 1.26 ?  33 GLY A H    6  
ATOM   3467 H HA2  . GLY A 1 33 ? 3.669   9.982   1.162  1.00 1.68 ?  33 GLY A HA2  6  
ATOM   3468 H HA3  . GLY A 1 33 ? 4.564   8.950   2.257  1.00 1.72 ?  33 GLY A HA3  6  
ATOM   3469 N N    . LEU A 1 34 ? 6.896   9.350   1.077  1.00 1.27 ?  34 LEU A N    6  
ATOM   3470 C CA   . LEU A 1 34 ? 8.191   9.992   0.911  1.00 1.73 ?  34 LEU A CA   6  
ATOM   3471 C C    . LEU A 1 34 ? 8.721   9.853   -0.512 1.00 1.86 ?  34 LEU A C    6  
ATOM   3472 O O    . LEU A 1 34 ? 8.868   10.845  -1.226 1.00 2.56 ?  34 LEU A O    6  
ATOM   3473 C CB   . LEU A 1 34 ? 9.198   9.408   1.905  1.00 1.91 ?  34 LEU A CB   6  
ATOM   3474 C CG   . LEU A 1 34 ? 8.826   9.557   3.383  1.00 2.29 ?  34 LEU A CG   6  
ATOM   3475 C CD1  . LEU A 1 34 ? 9.911   8.962   4.264  1.00 2.76 ?  34 LEU A CD1  6  
ATOM   3476 C CD2  . LEU A 1 34 ? 8.595   11.018  3.742  1.00 3.08 ?  34 LEU A CD2  6  
ATOM   3477 H H    . LEU A 1 34 ? 6.860   8.408   1.355  1.00 1.11 ?  34 LEU A H    6  
ATOM   3478 H HA   . LEU A 1 34 ? 8.063   11.041  1.126  1.00 2.15 ?  34 LEU A HA   6  
ATOM   3479 H HB2  . LEU A 1 34 ? 9.309   8.355   1.689  1.00 2.24 ?  34 LEU A HB2  6  
ATOM   3480 H HB3  . LEU A 1 34 ? 10.148  9.892   1.745  1.00 2.03 ?  34 LEU A HB3  6  
ATOM   3481 H HG   . LEU A 1 34 ? 7.910   9.018   3.572  1.00 2.45 ?  34 LEU A HG   6  
ATOM   3482 H HD11 . LEU A 1 34 ? 9.647   9.100   5.303  1.00 3.05 ?  34 LEU A HD11 6  
ATOM   3483 H HD12 . LEU A 1 34 ? 10.850  9.455   4.062  1.00 3.27 ?  34 LEU A HD12 6  
ATOM   3484 H HD13 . LEU A 1 34 ? 10.005  7.907   4.055  1.00 2.92 ?  34 LEU A HD13 6  
ATOM   3485 H HD21 . LEU A 1 34 ? 9.472   11.594  3.489  1.00 3.53 ?  34 LEU A HD21 6  
ATOM   3486 H HD22 . LEU A 1 34 ? 8.403   11.102  4.801  1.00 3.41 ?  34 LEU A HD22 6  
ATOM   3487 H HD23 . LEU A 1 34 ? 7.744   11.395  3.193  1.00 3.42 ?  34 LEU A HD23 6  
ATOM   3488 N N    . PHE A 1 35 ? 8.991   8.626   -0.930 1.00 1.42 ?  35 PHE A N    6  
ATOM   3489 C CA   . PHE A 1 35 ? 9.653   8.389   -2.204 1.00 1.78 ?  35 PHE A CA   6  
ATOM   3490 C C    . PHE A 1 35 ? 8.765   7.574   -3.135 1.00 2.17 ?  35 PHE A C    6  
ATOM   3491 O O    . PHE A 1 35 ? 8.936   6.363   -3.285 1.00 2.84 ?  35 PHE A O    6  
ATOM   3492 C CB   . PHE A 1 35 ? 10.987  7.670   -1.983 1.00 1.55 ?  35 PHE A CB   6  
ATOM   3493 C CG   . PHE A 1 35 ? 11.893  8.367   -1.005 1.00 1.48 ?  35 PHE A CG   6  
ATOM   3494 C CD1  . PHE A 1 35 ? 12.165  7.805   0.232  1.00 1.95 ?  35 PHE A CD1  6  
ATOM   3495 C CD2  . PHE A 1 35 ? 12.472  9.585   -1.326 1.00 1.61 ?  35 PHE A CD2  6  
ATOM   3496 C CE1  . PHE A 1 35 ? 13.000  8.444   1.129  1.00 2.46 ?  35 PHE A CE1  6  
ATOM   3497 C CE2  . PHE A 1 35 ? 13.307  10.227  -0.432 1.00 1.99 ?  35 PHE A CE2  6  
ATOM   3498 C CZ   . PHE A 1 35 ? 13.562  9.656   0.805  1.00 2.41 ?  35 PHE A CZ   6  
ATOM   3499 H H    . PHE A 1 35 ? 8.717   7.860   -0.381 1.00 1.04 ?  35 PHE A H    6  
ATOM   3500 H HA   . PHE A 1 35 ? 9.843   9.348   -2.660 1.00 2.31 ?  35 PHE A HA   6  
ATOM   3501 H HB2  . PHE A 1 35 ? 10.794  6.678   -1.606 1.00 1.53 ?  35 PHE A HB2  6  
ATOM   3502 H HB3  . PHE A 1 35 ? 11.508  7.595   -2.926 1.00 1.88 ?  35 PHE A HB3  6  
ATOM   3503 H HD1  . PHE A 1 35 ? 11.721  6.858   0.494  1.00 2.21 ?  35 PHE A HD1  6  
ATOM   3504 H HD2  . PHE A 1 35 ? 12.266  10.034  -2.286 1.00 1.82 ?  35 PHE A HD2  6  
ATOM   3505 H HE1  . PHE A 1 35 ? 13.206  7.996   2.090  1.00 3.08 ?  35 PHE A HE1  6  
ATOM   3506 H HE2  . PHE A 1 35 ? 13.754  11.175  -0.696 1.00 2.26 ?  35 PHE A HE2  6  
ATOM   3507 H HZ   . PHE A 1 35 ? 14.210  10.157  1.509  1.00 2.93 ?  35 PHE A HZ   6  
HETATM 3508 N N    . NH2 A 1 36 ? 7.822   8.244   -3.768 1.00 2.32 ?  36 NH2 A N    6  
HETATM 3509 H HN1  . NH2 A 1 36 ? 7.746   9.207   -3.597 1.00 2.41 ?  36 NH2 A HN1  6  
HETATM 3510 H HN2  . NH2 A 1 36 ? 7.241   7.756   -4.386 1.00 2.69 ?  36 NH2 A HN2  6  
ATOM   3511 N N    . LEU A 1 1  ? -6.556  4.621   7.297  1.00 1.11 ?  1  LEU A N    7  
ATOM   3512 C CA   . LEU A 1 1  ? -7.066  4.714   5.912  1.00 0.77 ?  1  LEU A CA   7  
ATOM   3513 C C    . LEU A 1 1  ? -8.311  3.854   5.751  1.00 0.62 ?  1  LEU A C    7  
ATOM   3514 O O    . LEU A 1 1  ? -8.342  2.711   6.205  1.00 0.66 ?  1  LEU A O    7  
ATOM   3515 C CB   . LEU A 1 1  ? -5.999  4.248   4.914  1.00 0.91 ?  1  LEU A CB   7  
ATOM   3516 C CG   . LEU A 1 1  ? -4.669  5.003   4.967  1.00 1.01 ?  1  LEU A CG   7  
ATOM   3517 C CD1  . LEU A 1 1  ? -3.656  4.362   4.031  1.00 1.23 ?  1  LEU A CD1  7  
ATOM   3518 C CD2  . LEU A 1 1  ? -4.869  6.463   4.601  1.00 1.78 ?  1  LEU A CD2  7  
ATOM   3519 H H1   . LEU A 1 1  ? -7.274  4.967   7.964  1.00 1.40 ?  1  LEU A H1   7  
ATOM   3520 H H2   . LEU A 1 1  ? -5.697  5.195   7.404  1.00 1.62 ?  1  LEU A H2   7  
ATOM   3521 H H3   . LEU A 1 1  ? -6.332  3.635   7.528  1.00 1.61 ?  1  LEU A H3   7  
ATOM   3522 H HA   . LEU A 1 1  ? -7.320  5.741   5.710  1.00 0.75 ?  1  LEU A HA   7  
ATOM   3523 H HB2  . LEU A 1 1  ? -5.803  3.204   5.094  1.00 1.23 ?  1  LEU A HB2  7  
ATOM   3524 H HB3  . LEU A 1 1  ? -6.404  4.352   3.917  1.00 1.43 ?  1  LEU A HB3  7  
ATOM   3525 H HG   . LEU A 1 1  ? -4.272  4.958   5.970  1.00 1.75 ?  1  LEU A HG   7  
ATOM   3526 H HD11 . LEU A 1 1  ? -2.735  4.925   4.058  1.00 1.48 ?  1  LEU A HD11 7  
ATOM   3527 H HD12 . LEU A 1 1  ? -4.048  4.360   3.025  1.00 1.80 ?  1  LEU A HD12 7  
ATOM   3528 H HD13 . LEU A 1 1  ? -3.466  3.348   4.347  1.00 1.91 ?  1  LEU A HD13 7  
ATOM   3529 H HD21 . LEU A 1 1  ? -5.282  6.531   3.607  1.00 2.17 ?  1  LEU A HD21 7  
ATOM   3530 H HD22 . LEU A 1 1  ? -3.918  6.975   4.632  1.00 2.45 ?  1  LEU A HD22 7  
ATOM   3531 H HD23 . LEU A 1 1  ? -5.547  6.921   5.306  1.00 2.19 ?  1  LEU A HD23 7  
ATOM   3532 N N    . SER A 1 2  ? -9.338  4.408   5.123  1.00 0.58 ?  2  SER A N    7  
ATOM   3533 C CA   . SER A 1 2  ? -10.540 3.650   4.808  1.00 0.59 ?  2  SER A CA   7  
ATOM   3534 C C    . SER A 1 2  ? -10.271 2.729   3.618  1.00 0.53 ?  2  SER A C    7  
ATOM   3535 O O    . SER A 1 2  ? -9.375  3.004   2.831  1.00 0.45 ?  2  SER A O    7  
ATOM   3536 C CB   . SER A 1 2  ? -11.690 4.605   4.499  1.00 0.72 ?  2  SER A CB   7  
ATOM   3537 O OG   . SER A 1 2  ? -11.905 5.503   5.577  1.00 1.28 ?  2  SER A OG   7  
ATOM   3538 H H    . SER A 1 2  ? -9.287  5.355   4.863  1.00 0.63 ?  2  SER A H    7  
ATOM   3539 H HA   . SER A 1 2  ? -10.794 3.050   5.668  1.00 0.67 ?  2  SER A HA   7  
ATOM   3540 H HB2  . SER A 1 2  ? -11.451 5.176   3.616  1.00 1.39 ?  2  SER A HB2  7  
ATOM   3541 H HB3  . SER A 1 2  ? -12.594 4.039   4.333  1.00 1.05 ?  2  SER A HB3  7  
ATOM   3542 H HG   . SER A 1 2  ? -11.766 5.036   6.413  1.00 1.66 ?  2  SER A HG   7  
ATOM   3543 N N    . ASP A 1 3  ? -11.052 1.658   3.486  1.00 0.61 ?  3  ASP A N    7  
ATOM   3544 C CA   . ASP A 1 3  ? -10.806 0.621   2.469  1.00 0.60 ?  3  ASP A CA   7  
ATOM   3545 C C    . ASP A 1 3  ? -10.558 1.216   1.080  1.00 0.49 ?  3  ASP A C    7  
ATOM   3546 O O    . ASP A 1 3  ? -9.525  0.955   0.452  1.00 0.40 ?  3  ASP A O    7  
ATOM   3547 C CB   . ASP A 1 3  ? -11.989 -0.352  2.410  1.00 0.76 ?  3  ASP A CB   7  
ATOM   3548 C CG   . ASP A 1 3  ? -11.822 -1.429  1.353  1.00 1.42 ?  3  ASP A CG   7  
ATOM   3549 O OD1  . ASP A 1 3  ? -11.172 -2.456  1.643  1.00 1.93 ?  3  ASP A OD1  7  
ATOM   3550 O OD2  . ASP A 1 3  ? -12.324 -1.244  0.223  1.00 2.11 -1 3  ASP A OD2  7  
ATOM   3551 H H    . ASP A 1 3  ? -11.822 1.558   4.087  1.00 0.71 ?  3  ASP A H    7  
ATOM   3552 H HA   . ASP A 1 3  ? -9.924  0.076   2.766  1.00 0.62 ?  3  ASP A HA   7  
ATOM   3553 H HB2  . ASP A 1 3  ? -12.097 -0.834  3.369  1.00 1.30 ?  3  ASP A HB2  7  
ATOM   3554 H HB3  . ASP A 1 3  ? -12.887 0.203   2.189  1.00 1.20 ?  3  ASP A HB3  7  
ATOM   3555 N N    . GLU A 1 4  ? -11.489 2.040   0.616  1.00 0.58 ?  4  GLU A N    7  
ATOM   3556 C CA   . GLU A 1 4  ? -11.396 2.608   -0.722 1.00 0.58 ?  4  GLU A CA   7  
ATOM   3557 C C    . GLU A 1 4  ? -10.296 3.662   -0.805 1.00 0.43 ?  4  GLU A C    7  
ATOM   3558 O O    . GLU A 1 4  ? -9.758  3.924   -1.879 1.00 0.38 ?  4  GLU A O    7  
ATOM   3559 C CB   . GLU A 1 4  ? -12.734 3.202   -1.155 1.00 0.80 ?  4  GLU A CB   7  
ATOM   3560 C CG   . GLU A 1 4  ? -13.823 2.159   -1.328 1.00 1.35 ?  4  GLU A CG   7  
ATOM   3561 C CD   . GLU A 1 4  ? -15.104 2.736   -1.889 1.00 1.81 ?  4  GLU A CD   7  
ATOM   3562 O OE1  . GLU A 1 4  ? -16.009 3.072   -1.096 1.00 2.46 ?  4  GLU A OE1  7  
ATOM   3563 O OE2  . GLU A 1 4  ? -15.216 2.850   -3.127 1.00 2.08 -1 4  GLU A OE2  7  
ATOM   3564 H H    . GLU A 1 4  ? -12.253 2.273   1.187  1.00 0.68 ?  4  GLU A H    7  
ATOM   3565 H HA   . GLU A 1 4  ? -11.145 1.802   -1.395 1.00 0.59 ?  4  GLU A HA   7  
ATOM   3566 H HB2  . GLU A 1 4  ? -13.059 3.912   -0.409 1.00 1.07 ?  4  GLU A HB2  7  
ATOM   3567 H HB3  . GLU A 1 4  ? -12.602 3.715   -2.096 1.00 1.03 ?  4  GLU A HB3  7  
ATOM   3568 H HG2  . GLU A 1 4  ? -13.466 1.395   -2.000 1.00 1.90 ?  4  GLU A HG2  7  
ATOM   3569 H HG3  . GLU A 1 4  ? -14.036 1.717   -0.365 1.00 1.77 ?  4  GLU A HG3  7  
ATOM   3570 N N    . ASP A 1 5  ? -9.939  4.243   0.331  1.00 0.44 ?  5  ASP A N    7  
ATOM   3571 C CA   . ASP A 1 5  ? -8.903  5.265   0.355  1.00 0.40 ?  5  ASP A CA   7  
ATOM   3572 C C    . ASP A 1 5  ? -7.535  4.605   0.310  1.00 0.28 ?  5  ASP A C    7  
ATOM   3573 O O    . ASP A 1 5  ? -6.611  5.099   -0.326 1.00 0.29 ?  5  ASP A O    7  
ATOM   3574 C CB   . ASP A 1 5  ? -9.034  6.142   1.598  1.00 0.52 ?  5  ASP A CB   7  
ATOM   3575 C CG   . ASP A 1 5  ? -8.033  7.278   1.611  1.00 1.11 ?  5  ASP A CG   7  
ATOM   3576 O OD1  . ASP A 1 5  ? -8.186  8.217   0.805  1.00 1.17 ?  5  ASP A OD1  7  
ATOM   3577 O OD2  . ASP A 1 5  ? -7.080  7.231   2.418  1.00 1.82 -1 5  ASP A OD2  7  
ATOM   3578 H H    . ASP A 1 5  ? -10.359 3.962   1.174  1.00 0.51 ?  5  ASP A H    7  
ATOM   3579 H HA   . ASP A 1 5  ? -9.022  5.878   -0.526 1.00 0.43 ?  5  ASP A HA   7  
ATOM   3580 H HB2  . ASP A 1 5  ? -10.027 6.562   1.632  1.00 1.00 ?  5  ASP A HB2  7  
ATOM   3581 H HB3  . ASP A 1 5  ? -8.873  5.535   2.476  1.00 0.82 ?  5  ASP A HB3  7  
ATOM   3582 N N    . PHE A 1 6  ? -7.431  3.462   0.974  1.00 0.24 ?  6  PHE A N    7  
ATOM   3583 C CA   . PHE A 1 6  ? -6.237  2.639   0.916  1.00 0.18 ?  6  PHE A CA   7  
ATOM   3584 C C    . PHE A 1 6  ? -6.022  2.194   -0.523 1.00 0.13 ?  6  PHE A C    7  
ATOM   3585 O O    . PHE A 1 6  ? -4.905  2.231   -1.041 1.00 0.15 ?  6  PHE A O    7  
ATOM   3586 C CB   . PHE A 1 6  ? -6.402  1.427   1.838  1.00 0.23 ?  6  PHE A CB   7  
ATOM   3587 C CG   . PHE A 1 6  ? -5.141  0.639   2.063  1.00 0.25 ?  6  PHE A CG   7  
ATOM   3588 C CD1  . PHE A 1 6  ? -4.414  0.795   3.232  1.00 0.43 ?  6  PHE A CD1  7  
ATOM   3589 C CD2  . PHE A 1 6  ? -4.688  -0.259  1.115  1.00 0.25 ?  6  PHE A CD2  7  
ATOM   3590 C CE1  . PHE A 1 6  ? -3.261  0.067   3.450  1.00 0.50 ?  6  PHE A CE1  7  
ATOM   3591 C CE2  . PHE A 1 6  ? -3.536  -0.987  1.325  1.00 0.35 ?  6  PHE A CE2  7  
ATOM   3592 C CZ   . PHE A 1 6  ? -2.820  -0.825  2.493  1.00 0.43 ?  6  PHE A CZ   7  
ATOM   3593 H H    . PHE A 1 6  ? -8.186  3.162   1.522  1.00 0.29 ?  6  PHE A H    7  
ATOM   3594 H HA   . PHE A 1 6  ? -5.395  3.232   1.239  1.00 0.23 ?  6  PHE A HA   7  
ATOM   3595 H HB2  . PHE A 1 6  ? -6.753  1.765   2.801  1.00 0.31 ?  6  PHE A HB2  7  
ATOM   3596 H HB3  . PHE A 1 6  ? -7.137  0.761   1.411  1.00 0.27 ?  6  PHE A HB3  7  
ATOM   3597 H HD1  . PHE A 1 6  ? -4.760  1.492   3.978  1.00 0.55 ?  6  PHE A HD1  7  
ATOM   3598 H HD2  . PHE A 1 6  ? -5.245  -0.386  0.199  1.00 0.29 ?  6  PHE A HD2  7  
ATOM   3599 H HE1  . PHE A 1 6  ? -2.705  0.197   4.366  1.00 0.65 ?  6  PHE A HE1  7  
ATOM   3600 H HE2  . PHE A 1 6  ? -3.194  -1.683  0.576  1.00 0.43 ?  6  PHE A HE2  7  
ATOM   3601 H HZ   . PHE A 1 6  ? -1.918  -1.395  2.660  1.00 0.51 ?  6  PHE A HZ   7  
ATOM   3602 N N    . LYS A 1 7  ? -7.115  1.790   -1.166 1.00 0.13 ?  7  LYS A N    7  
ATOM   3603 C CA   . LYS A 1 7  ? -7.094  1.465   -2.584 1.00 0.15 ?  7  LYS A CA   7  
ATOM   3604 C C    . LYS A 1 7  ? -6.669  2.680   -3.408 1.00 0.19 ?  7  LYS A C    7  
ATOM   3605 O O    . LYS A 1 7  ? -5.907  2.556   -4.359 1.00 0.23 ?  7  LYS A O    7  
ATOM   3606 C CB   . LYS A 1 7  ? -8.472  0.985   -3.039 1.00 0.23 ?  7  LYS A CB   7  
ATOM   3607 C CG   . LYS A 1 7  ? -8.546  0.660   -4.521 1.00 0.30 ?  7  LYS A CG   7  
ATOM   3608 C CD   . LYS A 1 7  ? -9.946  0.234   -4.927 1.00 0.44 ?  7  LYS A CD   7  
ATOM   3609 C CE   . LYS A 1 7  ? -10.066 0.082   -6.435 1.00 1.26 ?  7  LYS A CE   7  
ATOM   3610 N NZ   . LYS A 1 7  ? -9.917  1.386   -7.138 1.00 2.06 1  7  LYS A NZ   7  
ATOM   3611 H H    . LYS A 1 7  ? -7.959  1.693   -0.662 1.00 0.18 ?  7  LYS A H    7  
ATOM   3612 H HA   . LYS A 1 7  ? -6.377  0.673   -2.732 1.00 0.15 ?  7  LYS A HA   7  
ATOM   3613 H HB2  . LYS A 1 7  ? -8.736  0.098   -2.483 1.00 0.28 ?  7  LYS A HB2  7  
ATOM   3614 H HB3  . LYS A 1 7  ? -9.195  1.758   -2.828 1.00 0.25 ?  7  LYS A HB3  7  
ATOM   3615 H HG2  . LYS A 1 7  ? -8.267  1.536   -5.087 1.00 0.31 ?  7  LYS A HG2  7  
ATOM   3616 H HG3  . LYS A 1 7  ? -7.857  -0.144  -4.738 1.00 0.36 ?  7  LYS A HG3  7  
ATOM   3617 H HD2  . LYS A 1 7  ? -10.171 -0.714  -4.460 1.00 1.10 ?  7  LYS A HD2  7  
ATOM   3618 H HD3  . LYS A 1 7  ? -10.651 0.980   -4.590 1.00 0.92 ?  7  LYS A HD3  7  
ATOM   3619 H HE2  . LYS A 1 7  ? -9.296  -0.590  -6.779 1.00 1.83 ?  7  LYS A HE2  7  
ATOM   3620 H HE3  . LYS A 1 7  ? -11.035 -0.334  -6.667 1.00 1.84 ?  7  LYS A HE3  7  
ATOM   3621 H HZ1  . LYS A 1 7  ? -8.965  1.776   -6.978 1.00 2.69 ?  7  LYS A HZ1  7  
ATOM   3622 H HZ2  . LYS A 1 7  ? -10.620 2.066   -6.787 1.00 2.55 ?  7  LYS A HZ2  7  
ATOM   3623 H HZ3  . LYS A 1 7  ? -10.059 1.261   -8.160 1.00 2.30 ?  7  LYS A HZ3  7  
ATOM   3624 N N    . ALA A 1 8  ? -7.162  3.851   -3.033 1.00 0.22 ?  8  ALA A N    7  
ATOM   3625 C CA   . ALA A 1 8  ? -6.816  5.086   -3.728 1.00 0.30 ?  8  ALA A CA   7  
ATOM   3626 C C    . ALA A 1 8  ? -5.334  5.422   -3.576 1.00 0.35 ?  8  ALA A C    7  
ATOM   3627 O O    . ALA A 1 8  ? -4.719  5.989   -4.482 1.00 0.45 ?  8  ALA A O    7  
ATOM   3628 C CB   . ALA A 1 8  ? -7.673  6.231   -3.217 1.00 0.35 ?  8  ALA A CB   7  
ATOM   3629 H H    . ALA A 1 8  ? -7.794  3.886   -2.281 1.00 0.22 ?  8  ALA A H    7  
ATOM   3630 H HA   . ALA A 1 8  ? -7.034  4.948   -4.775 1.00 0.34 ?  8  ALA A HA   7  
ATOM   3631 H HB1  . ALA A 1 8  ? -8.716  5.966   -3.301 1.00 1.02 ?  8  ALA A HB1  7  
ATOM   3632 H HB2  . ALA A 1 8  ? -7.479  7.116   -3.804 1.00 1.02 ?  8  ALA A HB2  7  
ATOM   3633 H HB3  . ALA A 1 8  ? -7.433  6.426   -2.182 1.00 1.04 ?  8  ALA A HB3  7  
ATOM   3634 N N    . VAL A 1 9  ? -4.764  5.081   -2.430 1.00 0.31 ?  9  VAL A N    7  
ATOM   3635 C CA   . VAL A 1 9  ? -3.357  5.351   -2.167 1.00 0.39 ?  9  VAL A CA   7  
ATOM   3636 C C    . VAL A 1 9  ? -2.451  4.345   -2.872 1.00 0.38 ?  9  VAL A C    7  
ATOM   3637 O O    . VAL A 1 9  ? -1.543  4.722   -3.611 1.00 0.49 ?  9  VAL A O    7  
ATOM   3638 C CB   . VAL A 1 9  ? -3.042  5.320   -0.653 1.00 0.42 ?  9  VAL A CB   7  
ATOM   3639 C CG1  . VAL A 1 9  ? -1.558  5.554   -0.404 1.00 0.52 ?  9  VAL A CG1  7  
ATOM   3640 C CG2  . VAL A 1 9  ? -3.874  6.352   0.091  1.00 0.50 ?  9  VAL A CG2  7  
ATOM   3641 H H    . VAL A 1 9  ? -5.311  4.650   -1.733 1.00 0.26 ?  9  VAL A H    7  
ATOM   3642 H HA   . VAL A 1 9  ? -3.134  6.339   -2.538 1.00 0.47 ?  9  VAL A HA   7  
ATOM   3643 H HB   . VAL A 1 9  ? -3.298  4.341   -0.271 1.00 0.37 ?  9  VAL A HB   7  
ATOM   3644 H HG11 . VAL A 1 9  ? -1.360  5.528   0.657  1.00 0.97 ?  9  VAL A HG11 7  
ATOM   3645 H HG12 . VAL A 1 9  ? -1.273  6.518   -0.800 1.00 0.84 ?  9  VAL A HG12 7  
ATOM   3646 H HG13 . VAL A 1 9  ? -0.986  4.781   -0.896 1.00 1.18 ?  9  VAL A HG13 7  
ATOM   3647 H HG21 . VAL A 1 9  ? -4.924  6.145   -0.059 1.00 0.95 ?  9  VAL A HG21 7  
ATOM   3648 H HG22 . VAL A 1 9  ? -3.644  7.338   -0.283 1.00 0.76 ?  9  VAL A HG22 7  
ATOM   3649 H HG23 . VAL A 1 9  ? -3.646  6.304   1.145  1.00 0.91 ?  9  VAL A HG23 7  
ATOM   3650 N N    . PHE A 1 10 ? -2.707  3.069   -2.646 1.00 0.29 ?  10 PHE A N    7  
ATOM   3651 C CA   . PHE A 1 10 ? -1.787  2.024   -3.069 1.00 0.33 ?  10 PHE A CA   7  
ATOM   3652 C C    . PHE A 1 10 ? -2.189  1.375   -4.388 1.00 0.35 ?  10 PHE A C    7  
ATOM   3653 O O    . PHE A 1 10 ? -1.367  0.742   -5.047 1.00 0.45 ?  10 PHE A O    7  
ATOM   3654 C CB   . PHE A 1 10 ? -1.683  0.973   -1.970 1.00 0.32 ?  10 PHE A CB   7  
ATOM   3655 C CG   . PHE A 1 10 ? -1.064  1.509   -0.716 1.00 0.33 ?  10 PHE A CG   7  
ATOM   3656 C CD1  . PHE A 1 10 ? -1.860  1.836   0.360  1.00 0.39 ?  10 PHE A CD1  7  
ATOM   3657 C CD2  . PHE A 1 10 ? 0.305   1.683   -0.611 1.00 0.39 ?  10 PHE A CD2  7  
ATOM   3658 C CE1  . PHE A 1 10 ? -1.311  2.328   1.524  1.00 0.41 ?  10 PHE A CE1  7  
ATOM   3659 C CE2  . PHE A 1 10 ? 0.864   2.174   0.552  1.00 0.42 ?  10 PHE A CE2  7  
ATOM   3660 C CZ   . PHE A 1 10 ? 0.114   2.508   1.588  1.00 0.37 ?  10 PHE A CZ   7  
ATOM   3661 H H    . PHE A 1 10 ? -3.531  2.821   -2.169 1.00 0.22 ?  10 PHE A H    7  
ATOM   3662 H HA   . PHE A 1 10 ? -0.818  2.480   -3.196 1.00 0.39 ?  10 PHE A HA   7  
ATOM   3663 H HB2  . PHE A 1 10 ? -2.673  0.612   -1.727 1.00 0.30 ?  10 PHE A HB2  7  
ATOM   3664 H HB3  . PHE A 1 10 ? -1.077  0.151   -2.319 1.00 0.37 ?  10 PHE A HB3  7  
ATOM   3665 H HD1  . PHE A 1 10 ? -2.924  1.698   0.285  1.00 0.48 ?  10 PHE A HD1  7  
ATOM   3666 H HD2  . PHE A 1 10 ? 0.939   1.429   -1.448 1.00 0.47 ?  10 PHE A HD2  7  
ATOM   3667 H HE1  . PHE A 1 10 ? -1.950  2.580   2.357  1.00 0.50 ?  10 PHE A HE1  7  
ATOM   3668 H HE2  . PHE A 1 10 ? 1.934   2.302   0.625  1.00 0.52 ?  10 PHE A HE2  7  
ATOM   3669 H HZ   . PHE A 1 10 ? 0.574   2.895   2.484  1.00 0.39 ?  10 PHE A HZ   7  
ATOM   3670 N N    . GLY A 1 11 ? -3.442  1.529   -4.773 1.00 0.28 ?  11 GLY A N    7  
ATOM   3671 C CA   . GLY A 1 11 ? -3.919  0.914   -5.996 1.00 0.31 ?  11 GLY A CA   7  
ATOM   3672 C C    . GLY A 1 11 ? -4.626  -0.398  -5.731 1.00 0.29 ?  11 GLY A C    7  
ATOM   3673 O O    . GLY A 1 11 ? -5.196  -1.004  -6.641 1.00 0.36 ?  11 GLY A O    7  
ATOM   3674 H H    . GLY A 1 11 ? -4.056  2.070   -4.230 1.00 0.24 ?  11 GLY A H    7  
ATOM   3675 H HA2  . GLY A 1 11 ? -4.605  1.591   -6.483 1.00 0.32 ?  11 GLY A HA2  7  
ATOM   3676 H HA3  . GLY A 1 11 ? -3.079  0.735   -6.649 1.00 0.35 ?  11 GLY A HA3  7  
HETATM 3677 N N    . NLE A 1 12 ? -4.586  -0.836  -4.482 1.00 0.24 ?  12 NLE A N    7  
HETATM 3678 C CA   . NLE A 1 12 ? -5.227  -2.075  -4.073 1.00 0.24 ?  12 NLE A CA   7  
HETATM 3679 C C    . NLE A 1 12 ? -5.628  -1.978  -2.609 1.00 0.21 ?  12 NLE A C    7  
HETATM 3680 O O    . NLE A 1 12 ? -5.154  -1.099  -1.890 1.00 0.22 ?  12 NLE A O    7  
HETATM 3681 C CB   . NLE A 1 12 ? -4.301  -3.286  -4.286 1.00 0.27 ?  12 NLE A CB   7  
HETATM 3682 C CG   . NLE A 1 12 ? -3.113  -3.364  -3.327 1.00 0.64 ?  12 NLE A CG   7  
HETATM 3683 C CD   . NLE A 1 12 ? -2.038  -2.332  -3.637 1.00 0.33 ?  12 NLE A CD   7  
HETATM 3684 C CE   . NLE A 1 12 ? -1.400  -2.608  -4.982 1.00 0.64 ?  12 NLE A CE   7  
HETATM 3685 H H    . NLE A 1 12 ? -4.118  -0.303  -3.808 1.00 0.26 ?  12 NLE A H    7  
HETATM 3686 H HA   . NLE A 1 12 ? -6.118  -2.201  -4.670 1.00 0.26 ?  12 NLE A HA   7  
HETATM 3687 H HB2  . NLE A 1 12 ? -3.920  -3.256  -5.294 1.00 0.51 ?  12 NLE A HB2  7  
HETATM 3688 H HB3  . NLE A 1 12 ? -4.884  -4.185  -4.164 1.00 0.31 ?  12 NLE A HB3  7  
HETATM 3689 H HG2  . NLE A 1 12 ? -2.680  -4.352  -3.395 1.00 1.24 ?  12 NLE A HG2  7  
HETATM 3690 H HG3  . NLE A 1 12 ? -3.470  -3.198  -2.323 1.00 1.24 ?  12 NLE A HG3  7  
HETATM 3691 H HD2  . NLE A 1 12 ? -1.274  -2.373  -2.875 1.00 0.70 ?  12 NLE A HD2  7  
HETATM 3692 H HD3  . NLE A 1 12 ? -2.483  -1.349  -3.660 1.00 0.43 ?  12 NLE A HD3  7  
HETATM 3693 H HE1  . NLE A 1 12 ? -0.983  -3.604  -4.985 1.00 1.10 ?  12 NLE A HE1  7  
HETATM 3694 H HE2  . NLE A 1 12 ? -0.613  -1.890  -5.160 1.00 1.19 ?  12 NLE A HE2  7  
HETATM 3695 H HE3  . NLE A 1 12 ? -2.143  -2.525  -5.760 1.00 1.26 ?  12 NLE A HE3  7  
ATOM   3696 N N    . THR A 1 13 ? -6.499  -2.874  -2.180 1.00 0.24 ?  13 THR A N    7  
ATOM   3697 C CA   . THR A 1 13 ? -6.980  -2.875  -0.809 1.00 0.27 ?  13 THR A CA   7  
ATOM   3698 C C    . THR A 1 13 ? -6.039  -3.654  0.104  1.00 0.24 ?  13 THR A C    7  
ATOM   3699 O O    . THR A 1 13 ? -5.187  -4.405  -0.382 1.00 0.23 ?  13 THR A O    7  
ATOM   3700 C CB   . THR A 1 13 ? -8.396  -3.466  -0.733 1.00 0.34 ?  13 THR A CB   7  
ATOM   3701 O OG1  . THR A 1 13 ? -8.440  -4.721  -1.429 1.00 0.36 ?  13 THR A OG1  7  
ATOM   3702 C CG2  . THR A 1 13 ? -9.407  -2.502  -1.336 1.00 0.43 ?  13 THR A CG2  7  
ATOM   3703 H H    . THR A 1 13 ? -6.830  -3.555  -2.802 1.00 0.27 ?  13 THR A H    7  
ATOM   3704 H HA   . THR A 1 13 ? -7.023  -1.851  -0.470 1.00 0.30 ?  13 THR A HA   7  
ATOM   3705 H HB   . THR A 1 13 ? -8.647  -3.628  0.306  1.00 0.34 ?  13 THR A HB   7  
ATOM   3706 H HG1  . THR A 1 13 ? -9.343  -5.069  -1.412 1.00 0.58 ?  13 THR A HG1  7  
ATOM   3707 H HG21 . THR A 1 13 ? -9.141  -2.298  -2.362 1.00 0.92 ?  13 THR A HG21 7  
ATOM   3708 H HG22 . THR A 1 13 ? -9.405  -1.579  -0.773 1.00 1.34 ?  13 THR A HG22 7  
ATOM   3709 H HG23 . THR A 1 13 ? -10.392 -2.940  -1.300 1.00 1.02 ?  13 THR A HG23 7  
ATOM   3710 N N    . ARG A 1 14 ? -6.194  -3.487  1.418  1.00 0.29 ?  14 ARG A N    7  
ATOM   3711 C CA   . ARG A 1 14 ? -5.244  -4.043  2.383  1.00 0.32 ?  14 ARG A CA   7  
ATOM   3712 C C    . ARG A 1 14 ? -4.997  -5.530  2.160  1.00 0.30 ?  14 ARG A C    7  
ATOM   3713 O O    . ARG A 1 14 ? -3.861  -5.986  2.267  1.00 0.31 ?  14 ARG A O    7  
ATOM   3714 C CB   . ARG A 1 14 ? -5.710  -3.812  3.819  1.00 0.42 ?  14 ARG A CB   7  
ATOM   3715 C CG   . ARG A 1 14 ? -5.746  -2.350  4.230  1.00 0.53 ?  14 ARG A CG   7  
ATOM   3716 C CD   . ARG A 1 14 ? -5.594  -2.192  5.736  1.00 0.77 ?  14 ARG A CD   7  
ATOM   3717 N NE   . ARG A 1 14 ? -4.251  -2.560  6.186  1.00 1.30 ?  14 ARG A NE   7  
ATOM   3718 C CZ   . ARG A 1 14 ? -3.972  -3.618  6.948  1.00 1.88 ?  14 ARG A CZ   7  
ATOM   3719 N NH1  . ARG A 1 14 ? -4.936  -4.445  7.335  1.00 2.02 1  14 ARG A NH1  7  
ATOM   3720 N NH2  . ARG A 1 14 ? -2.719  -3.848  7.316  1.00 2.82 ?  14 ARG A NH2  7  
ATOM   3721 H H    . ARG A 1 14 ? -6.967  -2.980  1.748  1.00 0.32 ?  14 ARG A H    7  
ATOM   3722 H HA   . ARG A 1 14 ? -4.307  -3.523  2.241  1.00 0.34 ?  14 ARG A HA   7  
ATOM   3723 H HB2  . ARG A 1 14 ? -6.704  -4.218  3.930  1.00 0.43 ?  14 ARG A HB2  7  
ATOM   3724 H HB3  . ARG A 1 14 ? -5.043  -4.333  4.486  1.00 0.46 ?  14 ARG A HB3  7  
ATOM   3725 H HG2  . ARG A 1 14 ? -4.935  -1.828  3.739  1.00 0.58 ?  14 ARG A HG2  7  
ATOM   3726 H HG3  . ARG A 1 14 ? -6.690  -1.922  3.925  1.00 0.53 ?  14 ARG A HG3  7  
ATOM   3727 H HD2  . ARG A 1 14 ? -5.777  -1.162  5.998  1.00 1.48 ?  14 ARG A HD2  7  
ATOM   3728 H HD3  . ARG A 1 14 ? -6.316  -2.824  6.228  1.00 1.15 ?  14 ARG A HD3  7  
ATOM   3729 H HE   . ARG A 1 14 ? -3.512  -1.972  5.910  1.00 1.80 ?  14 ARG A HE   7  
ATOM   3730 H HH11 . ARG A 1 14 ? -4.718  -5.239  7.909  1.00 2.60 ?  14 ARG A HH11 7  
ATOM   3731 H HH12 . ARG A 1 14 ? -5.886  -4.283  7.058  1.00 1.94 ?  14 ARG A HH12 7  
ATOM   3732 H HH21 . ARG A 1 14 ? -1.985  -3.228  7.022  1.00 3.23 ?  14 ARG A HH21 7  
ATOM   3733 H HH22 . ARG A 1 14 ? -2.499  -4.644  7.887  1.00 3.30 ?  14 ARG A HH22 7  
HETATM 3734 N N    . AIB A 1 15 ? -6.054  -6.272  1.836  1.00 0.31 ?  15 AIB A N    7  
HETATM 3735 C CA   . AIB A 1 15 ? -5.953  -7.716  1.578  1.00 0.33 ?  15 AIB A CA   7  
HETATM 3736 C C    . AIB A 1 15 ? -4.913  -7.969  0.477  1.00 0.30 ?  15 AIB A C    7  
HETATM 3737 O O    . AIB A 1 15 ? -4.010  -8.805  0.621  1.00 0.30 ?  15 AIB A O    7  
HETATM 3738 C CB1  . AIB A 1 15 ? -7.301  -8.242  1.132  1.00 0.37 ?  15 AIB A CB1  7  
HETATM 3739 C CB2  . AIB A 1 15 ? -5.570  -8.457  2.850  1.00 0.37 ?  15 AIB A CB2  7  
HETATM 3740 H H    . AIB A 1 15 ? -6.932  -5.837  1.766  1.00 0.31 ?  15 AIB A H    7  
HETATM 3741 H HB11 . AIB A 1 15 ? -7.235  -9.306  0.963  1.00 1.00 ?  15 AIB A HB11 7  
HETATM 3742 H HB12 . AIB A 1 15 ? -7.594  -7.750  0.216  1.00 1.13 ?  15 AIB A HB12 7  
HETATM 3743 H HB13 . AIB A 1 15 ? -8.035  -8.044  1.898  1.00 1.02 ?  15 AIB A HB13 7  
HETATM 3744 H HB21 . AIB A 1 15 ? -5.501  -9.514  2.643  1.00 1.07 ?  15 AIB A HB21 7  
HETATM 3745 H HB22 . AIB A 1 15 ? -6.320  -8.284  3.606  1.00 1.16 ?  15 AIB A HB22 7  
HETATM 3746 H HB23 . AIB A 1 15 ? -4.615  -8.096  3.201  1.00 1.01 ?  15 AIB A HB23 7  
ATOM   3747 N N    . ALA A 1 16 ? -5.025  -7.209  -0.605 1.00 0.27 ?  16 ALA A N    7  
ATOM   3748 C CA   . ALA A 1 16 ? -4.161  -7.391  -1.758 1.00 0.26 ?  16 ALA A CA   7  
ATOM   3749 C C    . ALA A 1 16 ? -2.763  -6.872  -1.458 1.00 0.23 ?  16 ALA A C    7  
ATOM   3750 O O    . ALA A 1 16 ? -1.770  -7.373  -1.987 1.00 0.25 ?  16 ALA A O    7  
ATOM   3751 C CB   . ALA A 1 16 ? -4.747  -6.688  -2.970 1.00 0.28 ?  16 ALA A CB   7  
ATOM   3752 H H    . ALA A 1 16 ? -5.689  -6.483  -0.615 1.00 0.27 ?  16 ALA A H    7  
ATOM   3753 H HA   . ALA A 1 16 ? -4.106  -8.448  -1.972 1.00 0.29 ?  16 ALA A HA   7  
ATOM   3754 H HB1  . ALA A 1 16 ? -5.726  -7.092  -3.181 1.00 0.90 ?  16 ALA A HB1  7  
ATOM   3755 H HB2  . ALA A 1 16 ? -4.103  -6.839  -3.823 1.00 0.96 ?  16 ALA A HB2  7  
ATOM   3756 H HB3  . ALA A 1 16 ? -4.832  -5.631  -2.764 1.00 0.89 ?  16 ALA A HB3  7  
ATOM   3757 N N    . PHE A 1 17 ? -2.706  -5.863  -0.602 1.00 0.20 ?  17 PHE A N    7  
ATOM   3758 C CA   . PHE A 1 17 ? -1.446  -5.285  -0.163 1.00 0.19 ?  17 PHE A CA   7  
ATOM   3759 C C    . PHE A 1 17 ? -0.659  -6.294  0.672  1.00 0.20 ?  17 PHE A C    7  
ATOM   3760 O O    . PHE A 1 17 ? 0.519   -6.534  0.424  1.00 0.20 ?  17 PHE A O    7  
ATOM   3761 C CB   . PHE A 1 17 ? -1.730  -4.024  0.650  1.00 0.22 ?  17 PHE A CB   7  
ATOM   3762 C CG   . PHE A 1 17 ? -0.511  -3.235  1.025  1.00 0.24 ?  17 PHE A CG   7  
ATOM   3763 C CD1  . PHE A 1 17 ? 0.078   -2.367  0.120  1.00 0.28 ?  17 PHE A CD1  7  
ATOM   3764 C CD2  . PHE A 1 17 ? 0.054   -3.372  2.280  1.00 0.28 ?  17 PHE A CD2  7  
ATOM   3765 C CE1  . PHE A 1 17 ? 1.209   -1.651  0.465  1.00 0.33 ?  17 PHE A CE1  7  
ATOM   3766 C CE2  . PHE A 1 17 ? 1.180   -2.658  2.629  1.00 0.32 ?  17 PHE A CE2  7  
ATOM   3767 C CZ   . PHE A 1 17 ? 1.730   -1.749  1.713  1.00 0.33 ?  17 PHE A CZ   7  
ATOM   3768 H H    . PHE A 1 17 ? -3.546  -5.484  -0.258 1.00 0.21 ?  17 PHE A H    7  
ATOM   3769 H HA   . PHE A 1 17 ? -0.872  -5.022  -1.036 1.00 0.19 ?  17 PHE A HA   7  
ATOM   3770 H HB2  . PHE A 1 17 ? -2.373  -3.379  0.075  1.00 0.22 ?  17 PHE A HB2  7  
ATOM   3771 H HB3  . PHE A 1 17 ? -2.237  -4.302  1.562  1.00 0.24 ?  17 PHE A HB3  7  
ATOM   3772 H HD1  . PHE A 1 17 ? -0.355  -2.250  -0.863 1.00 0.30 ?  17 PHE A HD1  7  
ATOM   3773 H HD2  . PHE A 1 17 ? -0.399  -4.046  2.993  1.00 0.30 ?  17 PHE A HD2  7  
ATOM   3774 H HE1  . PHE A 1 17 ? 1.662   -0.979  -0.247 1.00 0.38 ?  17 PHE A HE1  7  
ATOM   3775 H HE2  . PHE A 1 17 ? 1.608   -2.775  3.611  1.00 0.36 ?  17 PHE A HE2  7  
ATOM   3776 H HZ   . PHE A 1 17 ? 2.604   -1.171  1.977  1.00 0.37 ?  17 PHE A HZ   7  
ATOM   3777 N N    . ALA A 1 18 ? -1.332  -6.899  1.642  1.00 0.23 ?  18 ALA A N    7  
ATOM   3778 C CA   . ALA A 1 18 ? -0.705  -7.878  2.518  1.00 0.25 ?  18 ALA A CA   7  
ATOM   3779 C C    . ALA A 1 18 ? -0.338  -9.139  1.749  1.00 0.23 ?  18 ALA A C    7  
ATOM   3780 O O    . ALA A 1 18 ? 0.572   -9.875  2.138  1.00 0.23 ?  18 ALA A O    7  
ATOM   3781 C CB   . ALA A 1 18 ? -1.623  -8.210  3.683  1.00 0.30 ?  18 ALA A CB   7  
ATOM   3782 H H    . ALA A 1 18 ? -2.280  -6.679  1.773  1.00 0.25 ?  18 ALA A H    7  
ATOM   3783 H HA   . ALA A 1 18 ? 0.196   -7.436  2.917  1.00 0.27 ?  18 ALA A HA   7  
ATOM   3784 H HB1  . ALA A 1 18 ? -2.509  -8.705  3.313  1.00 1.06 ?  18 ALA A HB1  7  
ATOM   3785 H HB2  . ALA A 1 18 ? -1.904  -7.300  4.192  1.00 0.87 ?  18 ALA A HB2  7  
ATOM   3786 H HB3  . ALA A 1 18 ? -1.107  -8.863  4.371  1.00 0.99 ?  18 ALA A HB3  7  
ATOM   3787 N N    . ASN A 1 19 ? -1.065  -9.392  0.663  1.00 0.24 ?  19 ASN A N    7  
ATOM   3788 C CA   . ASN A 1 19 ? -0.738  -10.492 -0.240 1.00 0.24 ?  19 ASN A CA   7  
ATOM   3789 C C    . ASN A 1 19 ? 0.603   -10.246 -0.936 1.00 0.19 ?  19 ASN A C    7  
ATOM   3790 O O    . ASN A 1 19 ? 1.269   -11.184 -1.380 1.00 0.22 ?  19 ASN A O    7  
ATOM   3791 C CB   . ASN A 1 19 ? -1.851  -10.676 -1.279 1.00 0.31 ?  19 ASN A CB   7  
ATOM   3792 C CG   . ASN A 1 19 ? -1.564  -11.800 -2.259 1.00 0.36 ?  19 ASN A CG   7  
ATOM   3793 O OD1  . ASN A 1 19 ? -0.991  -11.578 -3.325 1.00 1.14 ?  19 ASN A OD1  7  
ATOM   3794 N ND2  . ASN A 1 19 ? -1.968  -13.011 -1.910 1.00 1.08 ?  19 ASN A ND2  7  
ATOM   3795 H H    . ASN A 1 19 ? -1.859  -8.839  0.478  1.00 0.25 ?  19 ASN A H    7  
ATOM   3796 H HA   . ASN A 1 19 ? -0.661  -11.389 0.352  1.00 0.27 ?  19 ASN A HA   7  
ATOM   3797 H HB2  . ASN A 1 19 ? -2.777  -10.899 -0.771 1.00 0.38 ?  19 ASN A HB2  7  
ATOM   3798 H HB3  . ASN A 1 19 ? -1.965  -9.759  -1.838 1.00 0.32 ?  19 ASN A HB3  7  
ATOM   3799 H HD21 . ASN A 1 19 ? -2.429  -13.120 -1.051 1.00 1.83 ?  19 ASN A HD21 7  
ATOM   3800 H HD22 . ASN A 1 19 ? -1.787  -13.752 -2.524 1.00 1.08 ?  19 ASN A HD22 7  
ATOM   3801 N N    . LEU A 1 20 ? 1.004   -8.982  -1.015 1.00 0.17 ?  20 LEU A N    7  
ATOM   3802 C CA   . LEU A 1 20 ? 2.256   -8.616  -1.658 1.00 0.17 ?  20 LEU A CA   7  
ATOM   3803 C C    . LEU A 1 20 ? 3.436   -8.899  -0.736 1.00 0.17 ?  20 LEU A C    7  
ATOM   3804 O O    . LEU A 1 20 ? 3.286   -8.912  0.489  1.00 0.18 ?  20 LEU A O    7  
ATOM   3805 C CB   . LEU A 1 20 ? 2.246   -7.134  -2.037 1.00 0.20 ?  20 LEU A CB   7  
ATOM   3806 C CG   . LEU A 1 20 ? 1.219   -6.740  -3.096 1.00 0.29 ?  20 LEU A CG   7  
ATOM   3807 C CD1  . LEU A 1 20 ? 1.127   -5.228  -3.206 1.00 0.32 ?  20 LEU A CD1  7  
ATOM   3808 C CD2  . LEU A 1 20 ? 1.587   -7.347  -4.441 1.00 0.41 ?  20 LEU A CD2  7  
ATOM   3809 H H    . LEU A 1 20 ? 0.450   -8.276  -0.612 1.00 0.19 ?  20 LEU A H    7  
ATOM   3810 H HA   . LEU A 1 20 ? 2.356   -9.208  -2.551 1.00 0.22 ?  20 LEU A HA   7  
ATOM   3811 H HB2  . LEU A 1 20 ? 2.055   -6.556  -1.145 1.00 0.19 ?  20 LEU A HB2  7  
ATOM   3812 H HB3  . LEU A 1 20 ? 3.226   -6.875  -2.409 1.00 0.24 ?  20 LEU A HB3  7  
ATOM   3813 H HG   . LEU A 1 20 ? 0.247   -7.118  -2.809 1.00 0.33 ?  20 LEU A HG   7  
ATOM   3814 H HD11 . LEU A 1 20 ? 0.374   -4.966  -3.934 1.00 1.04 ?  20 LEU A HD11 7  
ATOM   3815 H HD12 . LEU A 1 20 ? 2.081   -4.832  -3.517 1.00 1.05 ?  20 LEU A HD12 7  
ATOM   3816 H HD13 . LEU A 1 20 ? 0.860   -4.811  -2.246 1.00 1.10 ?  20 LEU A HD13 7  
ATOM   3817 H HD21 . LEU A 1 20 ? 2.570   -7.003  -4.734 1.00 1.10 ?  20 LEU A HD21 7  
ATOM   3818 H HD22 . LEU A 1 20 ? 0.864   -7.043  -5.184 1.00 0.88 ?  20 LEU A HD22 7  
ATOM   3819 H HD23 . LEU A 1 20 ? 1.592   -8.423  -4.363 1.00 1.17 ?  20 LEU A HD23 7  
ATOM   3820 N N    . PRO A 1 21 ? 4.621   -9.146  -1.316 1.00 0.23 ?  21 PRO A N    7  
ATOM   3821 C CA   . PRO A 1 21 ? 5.852   -9.348  -0.546 1.00 0.29 ?  21 PRO A CA   7  
ATOM   3822 C C    . PRO A 1 21 ? 6.181   -8.128  0.308  1.00 0.26 ?  21 PRO A C    7  
ATOM   3823 O O    . PRO A 1 21 ? 5.870   -6.994  -0.059 1.00 0.22 ?  21 PRO A O    7  
ATOM   3824 C CB   . PRO A 1 21 ? 6.926   -9.555  -1.620 1.00 0.38 ?  21 PRO A CB   7  
ATOM   3825 C CG   . PRO A 1 21 ? 6.179   -9.965  -2.840 1.00 0.43 ?  21 PRO A CG   7  
ATOM   3826 C CD   . PRO A 1 21 ? 4.856   -9.260  -2.765 1.00 0.30 ?  21 PRO A CD   7  
ATOM   3827 H HA   . PRO A 1 21 ? 5.787   -10.223 0.083  1.00 0.32 ?  21 PRO A HA   7  
ATOM   3828 H HB2  . PRO A 1 21 ? 7.462   -8.630  -1.777 1.00 0.43 ?  21 PRO A HB2  7  
ATOM   3829 H HB3  . PRO A 1 21 ? 7.614   -10.325 -1.300 1.00 0.48 ?  21 PRO A HB3  7  
ATOM   3830 H HG2  . PRO A 1 21 ? 6.719   -9.656  -3.725 1.00 0.63 ?  21 PRO A HG2  7  
ATOM   3831 H HG3  . PRO A 1 21 ? 6.034   -11.037 -2.840 1.00 0.61 ?  21 PRO A HG3  7  
ATOM   3832 H HD2  . PRO A 1 21 ? 4.923   -8.284  -3.223 1.00 0.40 ?  21 PRO A HD2  7  
ATOM   3833 H HD3  . PRO A 1 21 ? 4.083   -9.848  -3.238 1.00 0.39 ?  21 PRO A HD3  7  
ATOM   3834 N N    . LEU A 1 22 ? 6.826   -8.382  1.443  1.00 0.30 ?  22 LEU A N    7  
ATOM   3835 C CA   . LEU A 1 22 ? 7.143   -7.346  2.421  1.00 0.31 ?  22 LEU A CA   7  
ATOM   3836 C C    . LEU A 1 22 ? 7.949   -6.211  1.806  1.00 0.28 ?  22 LEU A C    7  
ATOM   3837 O O    . LEU A 1 22 ? 7.768   -5.052  2.178  1.00 0.28 ?  22 LEU A O    7  
ATOM   3838 C CB   . LEU A 1 22 ? 7.911   -7.944  3.602  1.00 0.41 ?  22 LEU A CB   7  
ATOM   3839 C CG   . LEU A 1 22 ? 7.101   -8.869  4.514  1.00 1.07 ?  22 LEU A CG   7  
ATOM   3840 C CD1  . LEU A 1 22 ? 8.010   -9.544  5.524  1.00 1.64 ?  22 LEU A CD1  7  
ATOM   3841 C CD2  . LEU A 1 22 ? 6.005   -8.089  5.224  1.00 1.54 ?  22 LEU A CD2  7  
ATOM   3842 H H    . LEU A 1 22 ? 7.106   -9.306  1.627  1.00 0.34 ?  22 LEU A H    7  
ATOM   3843 H HA   . LEU A 1 22 ? 6.209   -6.945  2.783  1.00 0.30 ?  22 LEU A HA   7  
ATOM   3844 H HB2  . LEU A 1 22 ? 8.748   -8.504  3.209  1.00 1.00 ?  22 LEU A HB2  7  
ATOM   3845 H HB3  . LEU A 1 22 ? 8.295   -7.132  4.200  1.00 0.94 ?  22 LEU A HB3  7  
ATOM   3846 H HG   . LEU A 1 22 ? 6.634   -9.638  3.918  1.00 1.97 ?  22 LEU A HG   7  
ATOM   3847 H HD11 . LEU A 1 22 ? 7.426   -10.194 6.157  1.00 2.16 ?  22 LEU A HD11 7  
ATOM   3848 H HD12 . LEU A 1 22 ? 8.495   -8.793  6.128  1.00 1.77 ?  22 LEU A HD12 7  
ATOM   3849 H HD13 . LEU A 1 22 ? 8.757   -10.125 5.004  1.00 2.26 ?  22 LEU A HD13 7  
ATOM   3850 H HD21 . LEU A 1 22 ? 6.439   -7.241  5.735  1.00 2.09 ?  22 LEU A HD21 7  
ATOM   3851 H HD22 . LEU A 1 22 ? 5.518   -8.730  5.946  1.00 1.81 ?  22 LEU A HD22 7  
ATOM   3852 H HD23 . LEU A 1 22 ? 5.280   -7.743  4.503  1.00 2.05 ?  22 LEU A HD23 7  
ATOM   3853 N N    . TRP A 1 23 ? 8.836   -6.536  0.868  1.00 0.33 ?  23 TRP A N    7  
ATOM   3854 C CA   . TRP A 1 23 ? 9.626   -5.508  0.209  1.00 0.34 ?  23 TRP A CA   7  
ATOM   3855 C C    . TRP A 1 23 ? 8.727   -4.626  -0.649 1.00 0.27 ?  23 TRP A C    7  
ATOM   3856 O O    . TRP A 1 23 ? 8.967   -3.430  -0.787 1.00 0.25 ?  23 TRP A O    7  
ATOM   3857 C CB   . TRP A 1 23 ? 10.758  -6.116  -0.640 1.00 0.42 ?  23 TRP A CB   7  
ATOM   3858 C CG   . TRP A 1 23 ? 10.310  -6.782  -1.909 1.00 0.48 ?  23 TRP A CG   7  
ATOM   3859 C CD1  . TRP A 1 23 ? 10.083  -8.112  -2.103 1.00 0.56 ?  23 TRP A CD1  7  
ATOM   3860 C CD2  . TRP A 1 23 ? 10.052  -6.145  -3.166 1.00 0.51 ?  23 TRP A CD2  7  
ATOM   3861 N NE1  . TRP A 1 23 ? 9.692   -8.340  -3.399 1.00 0.62 ?  23 TRP A NE1  7  
ATOM   3862 C CE2  . TRP A 1 23 ? 9.663   -7.147  -4.071 1.00 0.60 ?  23 TRP A CE2  7  
ATOM   3863 C CE3  . TRP A 1 23 ? 10.107  -4.821  -3.611 1.00 0.49 ?  23 TRP A CE3  7  
ATOM   3864 C CZ2  . TRP A 1 23 ? 9.332   -6.868  -5.395 1.00 0.68 ?  23 TRP A CZ2  7  
ATOM   3865 C CZ3  . TRP A 1 23 ? 9.777   -4.545  -4.921 1.00 0.59 ?  23 TRP A CZ3  7  
ATOM   3866 C CH2  . TRP A 1 23 ? 9.394   -5.562  -5.801 1.00 0.68 ?  23 TRP A CH2  7  
ATOM   3867 H H    . TRP A 1 23 ? 8.964   -7.480  0.627  1.00 0.37 ?  23 TRP A H    7  
ATOM   3868 H HA   . TRP A 1 23 ? 10.064  -4.894  0.982  1.00 0.35 ?  23 TRP A HA   7  
ATOM   3869 H HB2  . TRP A 1 23 ? 11.444  -5.331  -0.913 1.00 0.42 ?  23 TRP A HB2  7  
ATOM   3870 H HB3  . TRP A 1 23 ? 11.283  -6.850  -0.046 1.00 0.48 ?  23 TRP A HB3  7  
ATOM   3871 H HD1  . TRP A 1 23 ? 10.196  -8.865  -1.339 1.00 0.59 ?  23 TRP A HD1  7  
ATOM   3872 H HE1  . TRP A 1 23 ? 9.468   -9.216  -3.782 1.00 0.69 ?  23 TRP A HE1  7  
ATOM   3873 H HE3  . TRP A 1 23 ? 10.397  -4.021  -2.946 1.00 0.44 ?  23 TRP A HE3  7  
ATOM   3874 H HZ2  . TRP A 1 23 ? 9.034   -7.643  -6.085 1.00 0.76 ?  23 TRP A HZ2  7  
ATOM   3875 H HZ3  . TRP A 1 23 ? 9.814   -3.527  -5.279 1.00 0.61 ?  23 TRP A HZ3  7  
ATOM   3876 H HH2  . TRP A 1 23 ? 9.147   -5.299  -6.819 1.00 0.76 ?  23 TRP A HH2  7  
ATOM   3877 N N    . LYS A 1 24 ? 7.674   -5.222  -1.202 1.00 0.24 ?  24 LYS A N    7  
ATOM   3878 C CA   . LYS A 1 24 ? 6.744   -4.497  -2.053 1.00 0.22 ?  24 LYS A CA   7  
ATOM   3879 C C    . LYS A 1 24 ? 5.843   -3.629  -1.194 1.00 0.14 ?  24 LYS A C    7  
ATOM   3880 O O    . LYS A 1 24 ? 5.499   -2.512  -1.569 1.00 0.15 ?  24 LYS A O    7  
ATOM   3881 C CB   . LYS A 1 24 ? 5.906   -5.469  -2.894 1.00 0.26 ?  24 LYS A CB   7  
ATOM   3882 C CG   . LYS A 1 24 ? 4.887   -4.787  -3.798 1.00 0.35 ?  24 LYS A CG   7  
ATOM   3883 C CD   . LYS A 1 24 ? 5.559   -3.943  -4.870 1.00 0.97 ?  24 LYS A CD   7  
ATOM   3884 C CE   . LYS A 1 24 ? 4.534   -3.235  -5.743 1.00 0.98 ?  24 LYS A CE   7  
ATOM   3885 N NZ   . LYS A 1 24 ? 5.174   -2.402  -6.793 1.00 1.37 1  24 LYS A NZ   7  
ATOM   3886 H H    . LYS A 1 24 ? 7.507   -6.172  -1.013 1.00 0.26 ?  24 LYS A H    7  
ATOM   3887 H HA   . LYS A 1 24 ? 7.322   -3.861  -2.710 1.00 0.25 ?  24 LYS A HA   7  
ATOM   3888 H HB2  . LYS A 1 24 ? 6.570   -6.051  -3.515 1.00 0.33 ?  24 LYS A HB2  7  
ATOM   3889 H HB3  . LYS A 1 24 ? 5.374   -6.136  -2.229 1.00 0.24 ?  24 LYS A HB3  7  
ATOM   3890 H HG2  . LYS A 1 24 ? 4.281   -5.542  -4.276 1.00 0.83 ?  24 LYS A HG2  7  
ATOM   3891 H HG3  . LYS A 1 24 ? 4.259   -4.147  -3.192 1.00 0.96 ?  24 LYS A HG3  7  
ATOM   3892 H HD2  . LYS A 1 24 ? 6.184   -3.204  -4.394 1.00 1.51 ?  24 LYS A HD2  7  
ATOM   3893 H HD3  . LYS A 1 24 ? 6.165   -4.586  -5.490 1.00 1.43 ?  24 LYS A HD3  7  
ATOM   3894 H HE2  . LYS A 1 24 ? 3.909   -3.977  -6.216 1.00 1.17 ?  24 LYS A HE2  7  
ATOM   3895 H HE3  . LYS A 1 24 ? 3.924   -2.601  -5.116 1.00 1.36 ?  24 LYS A HE3  7  
ATOM   3896 H HZ1  . LYS A 1 24 ? 5.783   -1.681  -6.359 1.00 1.91 ?  24 LYS A HZ1  7  
ATOM   3897 H HZ2  . LYS A 1 24 ? 4.451   -1.924  -7.367 1.00 1.69 ?  24 LYS A HZ2  7  
ATOM   3898 H HZ3  . LYS A 1 24 ? 5.756   -2.997  -7.417 1.00 1.76 ?  24 LYS A HZ3  7  
ATOM   3899 N N    . GLN A 1 25 ? 5.468   -4.154  -0.035 1.00 0.11 ?  25 GLN A N    7  
ATOM   3900 C CA   . GLN A 1 25 ? 4.691   -3.393  0.931  1.00 0.09 ?  25 GLN A CA   7  
ATOM   3901 C C    . GLN A 1 25 ? 5.468   -2.164  1.383  1.00 0.09 ?  25 GLN A C    7  
ATOM   3902 O O    . GLN A 1 25 ? 4.930   -1.059  1.412  1.00 0.12 ?  25 GLN A O    7  
ATOM   3903 C CB   . GLN A 1 25 ? 4.338   -4.254  2.141  1.00 0.14 ?  25 GLN A CB   7  
ATOM   3904 C CG   . GLN A 1 25 ? 3.422   -5.417  1.815  1.00 0.16 ?  25 GLN A CG   7  
ATOM   3905 C CD   . GLN A 1 25 ? 3.018   -6.202  3.046  1.00 0.22 ?  25 GLN A CD   7  
ATOM   3906 O OE1  . GLN A 1 25 ? 2.919   -5.652  4.149  1.00 0.41 ?  25 GLN A OE1  7  
ATOM   3907 N NE2  . GLN A 1 25 ? 2.777   -7.490  2.871  1.00 0.24 ?  25 GLN A NE2  7  
ATOM   3908 H H    . GLN A 1 25 ? 5.712   -5.085  0.170  1.00 0.15 ?  25 GLN A H    7  
ATOM   3909 H HA   . GLN A 1 25 ? 3.779   -3.073  0.446  1.00 0.10 ?  25 GLN A HA   7  
ATOM   3910 H HB2  . GLN A 1 25 ? 5.249   -4.648  2.566  1.00 0.22 ?  25 GLN A HB2  7  
ATOM   3911 H HB3  . GLN A 1 25 ? 3.848   -3.634  2.874  1.00 0.18 ?  25 GLN A HB3  7  
ATOM   3912 H HG2  . GLN A 1 25 ? 2.529   -5.031  1.344  1.00 0.18 ?  25 GLN A HG2  7  
ATOM   3913 H HG3  . GLN A 1 25 ? 3.929   -6.081  1.132  1.00 0.21 ?  25 GLN A HG3  7  
ATOM   3914 H HE21 . GLN A 1 25 ? 2.870   -7.861  1.961  1.00 0.33 ?  25 GLN A HE21 7  
ATOM   3915 H HE22 . GLN A 1 25 ? 2.518   -8.023  3.650  1.00 0.27 ?  25 GLN A HE22 7  
ATOM   3916 N N    . GLN A 1 26 ? 6.736   -2.363  1.729  1.00 0.14 ?  26 GLN A N    7  
ATOM   3917 C CA   . GLN A 1 26 ? 7.597   -1.256  2.126  1.00 0.18 ?  26 GLN A CA   7  
ATOM   3918 C C    . GLN A 1 26 ? 7.777   -0.277  0.971  1.00 0.18 ?  26 GLN A C    7  
ATOM   3919 O O    . GLN A 1 26 ? 7.670   0.934   1.155  1.00 0.25 ?  26 GLN A O    7  
ATOM   3920 C CB   . GLN A 1 26 ? 8.960   -1.764  2.598  1.00 0.28 ?  26 GLN A CB   7  
ATOM   3921 C CG   . GLN A 1 26 ? 8.893   -2.629  3.847  1.00 0.38 ?  26 GLN A CG   7  
ATOM   3922 C CD   . GLN A 1 26 ? 10.266  -3.021  4.355  1.00 0.90 ?  26 GLN A CD   7  
ATOM   3923 O OE1  . GLN A 1 26 ? 11.236  -2.282  4.189  1.00 1.46 ?  26 GLN A OE1  7  
ATOM   3924 N NE2  . GLN A 1 26 ? 10.358  -4.183  4.978  1.00 1.59 ?  26 GLN A NE2  7  
ATOM   3925 H H    . GLN A 1 26 ? 7.098   -3.280  1.724  1.00 0.18 ?  26 GLN A H    7  
ATOM   3926 H HA   . GLN A 1 26 ? 7.114   -0.741  2.942  1.00 0.21 ?  26 GLN A HA   7  
ATOM   3927 H HB2  . GLN A 1 26 ? 9.406   -2.347  1.807  1.00 0.31 ?  26 GLN A HB2  7  
ATOM   3928 H HB3  . GLN A 1 26 ? 9.594   -0.916  2.808  1.00 0.31 ?  26 GLN A HB3  7  
ATOM   3929 H HG2  . GLN A 1 26 ? 8.384   -2.080  4.623  1.00 0.76 ?  26 GLN A HG2  7  
ATOM   3930 H HG3  . GLN A 1 26 ? 8.339   -3.529  3.621  1.00 0.60 ?  26 GLN A HG3  7  
ATOM   3931 H HE21 . GLN A 1 26 ? 9.542   -4.721  5.077  1.00 1.96 ?  26 GLN A HE21 7  
ATOM   3932 H HE22 . GLN A 1 26 ? 11.238  -4.461  5.315  1.00 1.99 ?  26 GLN A HE22 7  
ATOM   3933 N N    . ASN A 1 27 ? 8.034   -0.818  -0.216 1.00 0.19 ?  27 ASN A N    7  
ATOM   3934 C CA   . ASN A 1 27 ? 8.207   -0.014  -1.424 1.00 0.26 ?  27 ASN A CA   7  
ATOM   3935 C C    . ASN A 1 27 ? 6.992   0.881   -1.651 1.00 0.22 ?  27 ASN A C    7  
ATOM   3936 O O    . ASN A 1 27 ? 7.122   2.084   -1.875 1.00 0.25 ?  27 ASN A O    7  
ATOM   3937 C CB   . ASN A 1 27 ? 8.403   -0.932  -2.636 1.00 0.38 ?  27 ASN A CB   7  
ATOM   3938 C CG   . ASN A 1 27 ? 8.689   -0.175  -3.917 1.00 0.98 ?  27 ASN A CG   7  
ATOM   3939 O OD1  . ASN A 1 27 ? 7.775   0.287   -4.600 1.00 1.81 ?  27 ASN A OD1  7  
ATOM   3940 N ND2  . ASN A 1 27 ? 9.957   -0.074  -4.272 1.00 1.18 ?  27 ASN A ND2  7  
ATOM   3941 H H    . ASN A 1 27 ? 8.120   -1.795  -0.282 1.00 0.20 ?  27 ASN A H    7  
ATOM   3942 H HA   . ASN A 1 27 ? 9.082   0.603   -1.298 1.00 0.34 ?  27 ASN A HA   7  
ATOM   3943 H HB2  . ASN A 1 27 ? 9.234   -1.593  -2.442 1.00 0.77 ?  27 ASN A HB2  7  
ATOM   3944 H HB3  . ASN A 1 27 ? 7.510   -1.520  -2.779 1.00 0.92 ?  27 ASN A HB3  7  
ATOM   3945 H HD21 . ASN A 1 27 ? 10.634  -0.489  -3.692 1.00 1.16 ?  27 ASN A HD21 7  
ATOM   3946 H HD22 . ASN A 1 27 ? 10.172  0.405   -5.101 1.00 1.75 ?  27 ASN A HD22 7  
ATOM   3947 N N    . LEU A 1 28 ? 5.815   0.279   -1.573 1.00 0.19 ?  28 LEU A N    7  
ATOM   3948 C CA   . LEU A 1 28 ? 4.562   0.991   -1.759 1.00 0.24 ?  28 LEU A CA   7  
ATOM   3949 C C    . LEU A 1 28 ? 4.327   2.008   -0.648 1.00 0.24 ?  28 LEU A C    7  
ATOM   3950 O O    . LEU A 1 28 ? 3.851   3.115   -0.894 1.00 0.29 ?  28 LEU A O    7  
ATOM   3951 C CB   . LEU A 1 28 ? 3.407   -0.004  -1.802 1.00 0.28 ?  28 LEU A CB   7  
ATOM   3952 C CG   . LEU A 1 28 ? 3.245   -0.766  -3.117 1.00 0.38 ?  28 LEU A CG   7  
ATOM   3953 C CD1  . LEU A 1 28 ? 2.203   -1.861  -2.972 1.00 0.88 ?  28 LEU A CD1  7  
ATOM   3954 C CD2  . LEU A 1 28 ? 2.851   0.186   -4.235 1.00 0.72 ?  28 LEU A CD2  7  
ATOM   3955 H H    . LEU A 1 28 ? 5.787   -0.685  -1.386 1.00 0.18 ?  28 LEU A H    7  
ATOM   3956 H HA   . LEU A 1 28 ? 4.612   1.511   -2.701 1.00 0.30 ?  28 LEU A HA   7  
ATOM   3957 H HB2  . LEU A 1 28 ? 3.557   -0.724  -1.012 1.00 0.28 ?  28 LEU A HB2  7  
ATOM   3958 H HB3  . LEU A 1 28 ? 2.498   0.529   -1.607 1.00 0.33 ?  28 LEU A HB3  7  
ATOM   3959 H HG   . LEU A 1 28 ? 4.185   -1.226  -3.380 1.00 0.78 ?  28 LEU A HG   7  
ATOM   3960 H HD11 . LEU A 1 28 ? 2.517   -2.561  -2.211 1.00 1.30 ?  28 LEU A HD11 7  
ATOM   3961 H HD12 . LEU A 1 28 ? 2.092   -2.379  -3.913 1.00 1.54 ?  28 LEU A HD12 7  
ATOM   3962 H HD13 . LEU A 1 28 ? 1.258   -1.423  -2.689 1.00 1.23 ?  28 LEU A HD13 7  
ATOM   3963 H HD21 . LEU A 1 28 ? 3.642   0.901   -4.397 1.00 1.32 ?  28 LEU A HD21 7  
ATOM   3964 H HD22 . LEU A 1 28 ? 1.946   0.707   -3.958 1.00 1.40 ?  28 LEU A HD22 7  
ATOM   3965 H HD23 . LEU A 1 28 ? 2.680   -0.376  -5.141 1.00 1.20 ?  28 LEU A HD23 7  
ATOM   3966 N N    . LYS A 1 29 ? 4.661   1.624   0.575  1.00 0.24 ?  29 LYS A N    7  
ATOM   3967 C CA   . LYS A 1 29 ? 4.505   2.503   1.724  1.00 0.32 ?  29 LYS A CA   7  
ATOM   3968 C C    . LYS A 1 29 ? 5.408   3.726   1.588  1.00 0.34 ?  29 LYS A C    7  
ATOM   3969 O O    . LYS A 1 29 ? 5.088   4.807   2.080  1.00 0.40 ?  29 LYS A O    7  
ATOM   3970 C CB   . LYS A 1 29 ? 4.806   1.740   3.010  1.00 0.42 ?  29 LYS A CB   7  
ATOM   3971 C CG   . LYS A 1 29 ? 4.485   2.516   4.274  1.00 0.71 ?  29 LYS A CG   7  
ATOM   3972 C CD   . LYS A 1 29 ? 4.739   1.687   5.524  1.00 1.19 ?  29 LYS A CD   7  
ATOM   3973 C CE   . LYS A 1 29 ? 3.818   0.477   5.600  1.00 1.23 ?  29 LYS A CE   7  
ATOM   3974 N NZ   . LYS A 1 29 ? 3.996   -0.277  6.867  1.00 1.39 1  29 LYS A NZ   7  
ATOM   3975 H H    . LYS A 1 29 ? 5.014   0.716   0.710  1.00 0.22 ?  29 LYS A H    7  
ATOM   3976 H HA   . LYS A 1 29 ? 3.479   2.837   1.748  1.00 0.36 ?  29 LYS A HA   7  
ATOM   3977 H HB2  . LYS A 1 29 ? 4.220   0.835   3.015  1.00 0.78 ?  29 LYS A HB2  7  
ATOM   3978 H HB3  . LYS A 1 29 ? 5.857   1.481   3.027  1.00 0.60 ?  29 LYS A HB3  7  
ATOM   3979 H HG2  . LYS A 1 29 ? 5.104   3.400   4.307  1.00 1.23 ?  29 LYS A HG2  7  
ATOM   3980 H HG3  . LYS A 1 29 ? 3.444   2.804   4.248  1.00 1.29 ?  29 LYS A HG3  7  
ATOM   3981 H HD2  . LYS A 1 29 ? 5.762   1.345   5.511  1.00 1.64 ?  29 LYS A HD2  7  
ATOM   3982 H HD3  . LYS A 1 29 ? 4.575   2.309   6.391  1.00 1.75 ?  29 LYS A HD3  7  
ATOM   3983 H HE2  . LYS A 1 29 ? 2.794   0.814   5.533  1.00 1.53 ?  29 LYS A HE2  7  
ATOM   3984 H HE3  . LYS A 1 29 ? 4.034   -0.180  4.771  1.00 1.48 ?  29 LYS A HE3  7  
ATOM   3985 H HZ1  . LYS A 1 29 ? 4.985   -0.572  6.974  1.00 2.04 ?  29 LYS A HZ1  7  
ATOM   3986 H HZ2  . LYS A 1 29 ? 3.396   -1.125  6.866  1.00 1.56 ?  29 LYS A HZ2  7  
ATOM   3987 H HZ3  . LYS A 1 29 ? 3.732   0.316   7.677  1.00 1.51 ?  29 LYS A HZ3  7  
ATOM   3988 N N    . LYS A 1 30 ? 6.532   3.551   0.910  1.00 0.34 ?  30 LYS A N    7  
ATOM   3989 C CA   . LYS A 1 30 ? 7.408   4.667   0.587  1.00 0.43 ?  30 LYS A CA   7  
ATOM   3990 C C    . LYS A 1 30 ? 6.806   5.495   -0.545 1.00 0.42 ?  30 LYS A C    7  
ATOM   3991 O O    . LYS A 1 30 ? 6.798   6.726   -0.489 1.00 0.47 ?  30 LYS A O    7  
ATOM   3992 C CB   . LYS A 1 30 ? 8.793   4.154   0.193  1.00 0.54 ?  30 LYS A CB   7  
ATOM   3993 C CG   . LYS A 1 30 ? 9.469   3.360   1.295  1.00 1.28 ?  30 LYS A CG   7  
ATOM   3994 C CD   . LYS A 1 30 ? 10.770  2.732   0.825  1.00 1.67 ?  30 LYS A CD   7  
ATOM   3995 C CE   . LYS A 1 30 ? 11.313  1.747   1.853  1.00 2.49 ?  30 LYS A CE   7  
ATOM   3996 N NZ   . LYS A 1 30 ? 11.567  2.396   3.167  1.00 3.14 1  30 LYS A NZ   7  
ATOM   3997 H H    . LYS A 1 30 ? 6.790   2.640   0.634  1.00 0.33 ?  30 LYS A H    7  
ATOM   3998 H HA   . LYS A 1 30 ? 7.495   5.287   1.466  1.00 0.48 ?  30 LYS A HA   7  
ATOM   3999 H HB2  . LYS A 1 30 ? 8.696   3.519   -0.675 1.00 0.89 ?  30 LYS A HB2  7  
ATOM   4000 H HB3  . LYS A 1 30 ? 9.420   4.996   -0.053 1.00 1.06 ?  30 LYS A HB3  7  
ATOM   4001 H HG2  . LYS A 1 30 ? 9.682   4.021   2.121  1.00 1.89 ?  30 LYS A HG2  7  
ATOM   4002 H HG3  . LYS A 1 30 ? 8.799   2.578   1.623  1.00 1.85 ?  30 LYS A HG3  7  
ATOM   4003 H HD2  . LYS A 1 30 ? 10.594  2.211   -0.105 1.00 2.02 ?  30 LYS A HD2  7  
ATOM   4004 H HD3  . LYS A 1 30 ? 11.499  3.515   0.669  1.00 1.96 ?  30 LYS A HD3  7  
ATOM   4005 H HE2  . LYS A 1 30 ? 10.594  0.953   1.989  1.00 2.89 ?  30 LYS A HE2  7  
ATOM   4006 H HE3  . LYS A 1 30 ? 12.239  1.331   1.482  1.00 2.91 ?  30 LYS A HE3  7  
ATOM   4007 H HZ1  . LYS A 1 30 ? 12.259  3.165   3.060  1.00 3.57 ?  30 LYS A HZ1  7  
ATOM   4008 H HZ2  . LYS A 1 30 ? 11.947  1.701   3.841  1.00 3.62 ?  30 LYS A HZ2  7  
ATOM   4009 H HZ3  . LYS A 1 30 ? 10.686  2.788   3.552  1.00 3.29 ?  30 LYS A HZ3  7  
ATOM   4010 N N    . GLU A 1 31 ? 6.285   4.806   -1.559 1.00 0.42 ?  31 GLU A N    7  
ATOM   4011 C CA   . GLU A 1 31 ? 5.639   5.454   -2.703 1.00 0.49 ?  31 GLU A CA   7  
ATOM   4012 C C    . GLU A 1 31 ? 4.374   6.204   -2.292 1.00 0.52 ?  31 GLU A C    7  
ATOM   4013 O O    . GLU A 1 31 ? 3.864   7.031   -3.051 1.00 0.70 ?  31 GLU A O    7  
ATOM   4014 C CB   . GLU A 1 31 ? 5.301   4.418   -3.773 1.00 0.52 ?  31 GLU A CB   7  
ATOM   4015 C CG   . GLU A 1 31 ? 6.490   4.006   -4.622 1.00 0.87 ?  31 GLU A CG   7  
ATOM   4016 C CD   . GLU A 1 31 ? 6.904   5.088   -5.600 1.00 1.47 ?  31 GLU A CD   7  
ATOM   4017 O OE1  . GLU A 1 31 ? 7.634   6.018   -5.200 1.00 1.67 ?  31 GLU A OE1  7  
ATOM   4018 O OE2  . GLU A 1 31 ? 6.489   5.020   -6.778 1.00 2.30 -1 31 GLU A OE2  7  
ATOM   4019 H H    . GLU A 1 31 ? 6.344   3.823   -1.545 1.00 0.41 ?  31 GLU A H    7  
ATOM   4020 H HA   . GLU A 1 31 ? 6.341   6.162   -3.116 1.00 0.57 ?  31 GLU A HA   7  
ATOM   4021 H HB2  . GLU A 1 31 ? 4.908   3.536   -3.290 1.00 0.87 ?  31 GLU A HB2  7  
ATOM   4022 H HB3  . GLU A 1 31 ? 4.543   4.824   -4.423 1.00 0.80 ?  31 GLU A HB3  7  
ATOM   4023 H HG2  . GLU A 1 31 ? 7.323   3.790   -3.973 1.00 1.45 ?  31 GLU A HG2  7  
ATOM   4024 H HG3  . GLU A 1 31 ? 6.230   3.119   -5.178 1.00 1.49 ?  31 GLU A HG3  7  
ATOM   4025 N N    . LYS A 1 32 ? 3.862   5.884   -1.108 1.00 0.43 ?  32 LYS A N    7  
ATOM   4026 C CA   . LYS A 1 32 ? 2.737   6.605   -0.517 1.00 0.55 ?  32 LYS A CA   7  
ATOM   4027 C C    . LYS A 1 32 ? 2.946   8.119   -0.597 1.00 0.66 ?  32 LYS A C    7  
ATOM   4028 O O    . LYS A 1 32 ? 2.008   8.866   -0.878 1.00 1.23 ?  32 LYS A O    7  
ATOM   4029 C CB   . LYS A 1 32 ? 2.551   6.181   0.943  1.00 0.74 ?  32 LYS A CB   7  
ATOM   4030 C CG   . LYS A 1 32 ? 1.535   7.021   1.705  1.00 1.46 ?  32 LYS A CG   7  
ATOM   4031 C CD   . LYS A 1 32 ? 1.666   6.835   3.211  1.00 2.20 ?  32 LYS A CD   7  
ATOM   4032 C CE   . LYS A 1 32 ? 1.247   5.443   3.658  1.00 3.14 ?  32 LYS A CE   7  
ATOM   4033 N NZ   . LYS A 1 32 ? -0.229  5.269   3.617  1.00 3.91 1  32 LYS A NZ   7  
ATOM   4034 H H    . LYS A 1 32 ? 4.234   5.109   -0.629 1.00 0.38 ?  32 LYS A H    7  
ATOM   4035 H HA   . LYS A 1 32 ? 1.849   6.346   -1.072 1.00 0.79 ?  32 LYS A HA   7  
ATOM   4036 H HB2  . LYS A 1 32 ? 2.222   5.154   0.966  1.00 1.02 ?  32 LYS A HB2  7  
ATOM   4037 H HB3  . LYS A 1 32 ? 3.500   6.256   1.450  1.00 1.25 ?  32 LYS A HB3  7  
ATOM   4038 H HG2  . LYS A 1 32 ? 1.694   8.061   1.465  1.00 2.11 ?  32 LYS A HG2  7  
ATOM   4039 H HG3  . LYS A 1 32 ? 0.543   6.725   1.399  1.00 1.77 ?  32 LYS A HG3  7  
ATOM   4040 H HD2  . LYS A 1 32 ? 2.696   6.995   3.494  1.00 2.36 ?  32 LYS A HD2  7  
ATOM   4041 H HD3  . LYS A 1 32 ? 1.041   7.565   3.705  1.00 2.67 ?  32 LYS A HD3  7  
ATOM   4042 H HE2  . LYS A 1 32 ? 1.705   4.715   3.006  1.00 3.54 ?  32 LYS A HE2  7  
ATOM   4043 H HE3  . LYS A 1 32 ? 1.592   5.286   4.670  1.00 3.37 ?  32 LYS A HE3  7  
ATOM   4044 H HZ1  . LYS A 1 32 ? -0.680  5.895   4.314  1.00 3.96 ?  32 LYS A HZ1  7  
ATOM   4045 H HZ2  . LYS A 1 32 ? -0.482  4.286   3.837  1.00 4.35 ?  32 LYS A HZ2  7  
ATOM   4046 H HZ3  . LYS A 1 32 ? -0.593  5.508   2.673  1.00 4.36 ?  32 LYS A HZ3  7  
ATOM   4047 N N    . GLY A 1 33 ? 4.174   8.568   -0.367 1.00 0.94 ?  33 GLY A N    7  
ATOM   4048 C CA   . GLY A 1 33 ? 4.447   9.989   -0.432 1.00 1.34 ?  33 GLY A CA   7  
ATOM   4049 C C    . GLY A 1 33 ? 5.842   10.366  0.026  1.00 1.43 ?  33 GLY A C    7  
ATOM   4050 O O    . GLY A 1 33 ? 6.379   11.386  -0.403 1.00 1.99 ?  33 GLY A O    7  
ATOM   4051 H H    . GLY A 1 33 ? 4.893   7.933   -0.168 1.00 1.26 ?  33 GLY A H    7  
ATOM   4052 H HA2  . GLY A 1 33 ? 4.321   10.315  -1.452 1.00 1.68 ?  33 GLY A HA2  7  
ATOM   4053 H HA3  . GLY A 1 33 ? 3.728   10.506  0.184  1.00 1.72 ?  33 GLY A HA3  7  
ATOM   4054 N N    . LEU A 1 34 ? 6.435   9.553   0.890  1.00 1.27 ?  34 LEU A N    7  
ATOM   4055 C CA   . LEU A 1 34 ? 7.755   9.858   1.431  1.00 1.73 ?  34 LEU A CA   7  
ATOM   4056 C C    . LEU A 1 34 ? 8.823   9.787   0.343  1.00 1.86 ?  34 LEU A C    7  
ATOM   4057 O O    . LEU A 1 34 ? 9.599   10.726  0.162  1.00 2.56 ?  34 LEU A O    7  
ATOM   4058 C CB   . LEU A 1 34 ? 8.097   8.898   2.573  1.00 1.91 ?  34 LEU A CB   7  
ATOM   4059 C CG   . LEU A 1 34 ? 9.404   9.196   3.311  1.00 2.29 ?  34 LEU A CG   7  
ATOM   4060 C CD1  . LEU A 1 34 ? 9.361   10.576  3.949  1.00 2.76 ?  34 LEU A CD1  7  
ATOM   4061 C CD2  . LEU A 1 34 ? 9.666   8.136   4.364  1.00 3.08 ?  34 LEU A CD2  7  
ATOM   4062 H H    . LEU A 1 34 ? 5.976   8.737   1.179  1.00 1.11 ?  34 LEU A H    7  
ATOM   4063 H HA   . LEU A 1 34 ? 7.724   10.864  1.818  1.00 2.15 ?  34 LEU A HA   7  
ATOM   4064 H HB2  . LEU A 1 34 ? 7.289   8.925   3.290  1.00 2.24 ?  34 LEU A HB2  7  
ATOM   4065 H HB3  . LEU A 1 34 ? 8.160   7.899   2.166  1.00 2.03 ?  34 LEU A HB3  7  
ATOM   4066 H HG   . LEU A 1 34 ? 10.220  9.179   2.606  1.00 2.45 ?  34 LEU A HG   7  
ATOM   4067 H HD11 . LEU A 1 34 ? 8.511   10.640  4.612  1.00 3.05 ?  34 LEU A HD11 7  
ATOM   4068 H HD12 . LEU A 1 34 ? 9.274   11.329  3.179  1.00 3.27 ?  34 LEU A HD12 7  
ATOM   4069 H HD13 . LEU A 1 34 ? 10.269  10.740  4.511  1.00 2.92 ?  34 LEU A HD13 7  
ATOM   4070 H HD21 . LEU A 1 34 ? 10.596  8.354   4.870  1.00 3.53 ?  34 LEU A HD21 7  
ATOM   4071 H HD22 . LEU A 1 34 ? 9.730   7.167   3.893  1.00 3.41 ?  34 LEU A HD22 7  
ATOM   4072 H HD23 . LEU A 1 34 ? 8.859   8.135   5.082  1.00 3.42 ?  34 LEU A HD23 7  
ATOM   4073 N N    . PHE A 1 35 ? 8.853   8.677   -0.382 1.00 1.42 ?  35 PHE A N    7  
ATOM   4074 C CA   . PHE A 1 35 ? 9.809   8.496   -1.464 1.00 1.78 ?  35 PHE A CA   7  
ATOM   4075 C C    . PHE A 1 35 ? 9.074   8.144   -2.749 1.00 2.17 ?  35 PHE A C    7  
ATOM   4076 O O    . PHE A 1 35 ? 8.562   9.020   -3.446 1.00 2.84 ?  35 PHE A O    7  
ATOM   4077 C CB   . PHE A 1 35 ? 10.825  7.398   -1.124 1.00 1.55 ?  35 PHE A CB   7  
ATOM   4078 C CG   . PHE A 1 35 ? 11.651  7.664   0.104  1.00 1.48 ?  35 PHE A CG   7  
ATOM   4079 C CD1  . PHE A 1 35 ? 11.599  6.802   1.189  1.00 1.95 ?  35 PHE A CD1  7  
ATOM   4080 C CD2  . PHE A 1 35 ? 12.485  8.768   0.172  1.00 1.61 ?  35 PHE A CD2  7  
ATOM   4081 C CE1  . PHE A 1 35 ? 12.362  7.035   2.316  1.00 2.46 ?  35 PHE A CE1  7  
ATOM   4082 C CE2  . PHE A 1 35 ? 13.250  9.009   1.298  1.00 1.99 ?  35 PHE A CE2  7  
ATOM   4083 C CZ   . PHE A 1 35 ? 13.188  8.141   2.371  1.00 2.41 ?  35 PHE A CZ   7  
ATOM   4084 H H    . PHE A 1 35 ? 8.200   7.968   -0.198 1.00 1.04 ?  35 PHE A H    7  
ATOM   4085 H HA   . PHE A 1 35 ? 10.329  9.430   -1.606 1.00 2.31 ?  35 PHE A HA   7  
ATOM   4086 H HB2  . PHE A 1 35 ? 10.295  6.473   -0.968 1.00 1.53 ?  35 PHE A HB2  7  
ATOM   4087 H HB3  . PHE A 1 35 ? 11.499  7.278   -1.957 1.00 1.88 ?  35 PHE A HB3  7  
ATOM   4088 H HD1  . PHE A 1 35 ? 10.954  5.937   1.148  1.00 2.21 ?  35 PHE A HD1  7  
ATOM   4089 H HD2  . PHE A 1 35 ? 12.534  9.447   -0.665 1.00 1.82 ?  35 PHE A HD2  7  
ATOM   4090 H HE1  . PHE A 1 35 ? 12.311  6.356   3.153  1.00 3.08 ?  35 PHE A HE1  7  
ATOM   4091 H HE2  . PHE A 1 35 ? 13.895  9.873   1.340  1.00 2.26 ?  35 PHE A HE2  7  
ATOM   4092 H HZ   . PHE A 1 35 ? 13.786  8.325   3.252  1.00 2.93 ?  35 PHE A HZ   7  
HETATM 4093 N N    . NH2 A 1 36 ? 8.991   6.857   -3.046 1.00 2.32 ?  36 NH2 A N    7  
HETATM 4094 H HN1  . NH2 A 1 36 ? 9.423   6.214   -2.447 1.00 2.41 ?  36 NH2 A HN1  7  
HETATM 4095 H HN2  . NH2 A 1 36 ? 8.497   6.596   -3.861 1.00 2.69 ?  36 NH2 A HN2  7  
ATOM   4096 N N    . LEU A 1 1  ? -5.519  5.299   7.195  1.00 1.11 ?  1  LEU A N    8  
ATOM   4097 C CA   . LEU A 1 1  ? -6.050  4.956   5.855  1.00 0.77 ?  1  LEU A CA   8  
ATOM   4098 C C    . LEU A 1 1  ? -7.073  3.831   5.947  1.00 0.62 ?  1  LEU A C    8  
ATOM   4099 O O    . LEU A 1 1  ? -6.718  2.683   6.221  1.00 0.66 ?  1  LEU A O    8  
ATOM   4100 C CB   . LEU A 1 1  ? -4.917  4.527   4.915  1.00 0.91 ?  1  LEU A CB   8  
ATOM   4101 C CG   . LEU A 1 1  ? -3.904  5.614   4.554  1.00 1.01 ?  1  LEU A CG   8  
ATOM   4102 C CD1  . LEU A 1 1  ? -2.772  5.029   3.727  1.00 1.23 ?  1  LEU A CD1  8  
ATOM   4103 C CD2  . LEU A 1 1  ? -4.580  6.745   3.796  1.00 1.78 ?  1  LEU A CD2  8  
ATOM   4104 H H1   . LEU A 1 1  ? -6.292  5.608   7.817  1.00 1.40 ?  1  LEU A H1   8  
ATOM   4105 H H2   . LEU A 1 1  ? -4.823  6.068   7.121  1.00 1.62 ?  1  LEU A H2   8  
ATOM   4106 H H3   . LEU A 1 1  ? -5.057  4.470   7.623  1.00 1.61 ?  1  LEU A H3   8  
ATOM   4107 H HA   . LEU A 1 1  ? -6.533  5.830   5.448  1.00 0.75 ?  1  LEU A HA   8  
ATOM   4108 H HB2  . LEU A 1 1  ? -4.384  3.712   5.382  1.00 1.23 ?  1  LEU A HB2  8  
ATOM   4109 H HB3  . LEU A 1 1  ? -5.361  4.164   3.999  1.00 1.43 ?  1  LEU A HB3  8  
ATOM   4110 H HG   . LEU A 1 1  ? -3.481  6.020   5.461  1.00 1.75 ?  1  LEU A HG   8  
ATOM   4111 H HD11 . LEU A 1 1  ? -3.172  4.606   2.818  1.00 1.48 ?  1  LEU A HD11 8  
ATOM   4112 H HD12 . LEU A 1 1  ? -2.272  4.257   4.293  1.00 1.80 ?  1  LEU A HD12 8  
ATOM   4113 H HD13 . LEU A 1 1  ? -2.066  5.809   3.482  1.00 1.91 ?  1  LEU A HD13 8  
ATOM   4114 H HD21 . LEU A 1 1  ? -3.839  7.469   3.492  1.00 2.17 ?  1  LEU A HD21 8  
ATOM   4115 H HD22 . LEU A 1 1  ? -5.307  7.224   4.435  1.00 2.45 ?  1  LEU A HD22 8  
ATOM   4116 H HD23 . LEU A 1 1  ? -5.075  6.347   2.922  1.00 2.19 ?  1  LEU A HD23 8  
ATOM   4117 N N    . SER A 1 2  ? -8.336  4.161   5.718  1.00 0.58 ?  2  SER A N    8  
ATOM   4118 C CA   . SER A 1 2  ? -9.392  3.159   5.653  1.00 0.59 ?  2  SER A CA   8  
ATOM   4119 C C    . SER A 1 2  ? -9.222  2.340   4.376  1.00 0.53 ?  2  SER A C    8  
ATOM   4120 O O    . SER A 1 2  ? -8.740  2.864   3.381  1.00 0.45 ?  2  SER A O    8  
ATOM   4121 C CB   . SER A 1 2  ? -10.762 3.839   5.687  1.00 0.72 ?  2  SER A CB   8  
ATOM   4122 O OG   . SER A 1 2  ? -11.817 2.892   5.675  1.00 1.28 ?  2  SER A OG   8  
ATOM   4123 H H    . SER A 1 2  ? -8.567  5.106   5.585  1.00 0.63 ?  2  SER A H    8  
ATOM   4124 H HA   . SER A 1 2  ? -9.293  2.507   6.508  1.00 0.67 ?  2  SER A HA   8  
ATOM   4125 H HB2  . SER A 1 2  ? -10.842 4.432   6.585  1.00 1.39 ?  2  SER A HB2  8  
ATOM   4126 H HB3  . SER A 1 2  ? -10.862 4.480   4.824  1.00 1.05 ?  2  SER A HB3  8  
ATOM   4127 H HG   . SER A 1 2  ? -12.637 3.333   5.419  1.00 1.66 ?  2  SER A HG   8  
ATOM   4128 N N    . ASP A 1 3  ? -9.622  1.072   4.413  1.00 0.61 ?  3  ASP A N    8  
ATOM   4129 C CA   . ASP A 1 3  ? -9.342  0.115   3.327  1.00 0.60 ?  3  ASP A CA   8  
ATOM   4130 C C    . ASP A 1 3  ? -9.651  0.670   1.935  1.00 0.49 ?  3  ASP A C    8  
ATOM   4131 O O    . ASP A 1 3  ? -8.847  0.524   1.014  1.00 0.40 ?  3  ASP A O    8  
ATOM   4132 C CB   . ASP A 1 3  ? -10.127 -1.177  3.553  1.00 0.76 ?  3  ASP A CB   8  
ATOM   4133 C CG   . ASP A 1 3  ? -10.031 -2.143  2.386  1.00 1.42 ?  3  ASP A CG   8  
ATOM   4134 O OD1  . ASP A 1 3  ? -8.943  -2.732  2.192  1.00 1.93 ?  3  ASP A OD1  8  
ATOM   4135 O OD2  . ASP A 1 3  ? -11.030 -2.302  1.649  1.00 2.11 -1 3  ASP A OD2  8  
ATOM   4136 H H    . ASP A 1 3  ? -10.131 0.760   5.195  1.00 0.71 ?  3  ASP A H    8  
ATOM   4137 H HA   . ASP A 1 3  ? -8.290  -0.115  3.371  1.00 0.62 ?  3  ASP A HA   8  
ATOM   4138 H HB2  . ASP A 1 3  ? -9.749  -1.671  4.435  1.00 1.30 ?  3  ASP A HB2  8  
ATOM   4139 H HB3  . ASP A 1 3  ? -11.165 -0.930  3.705  1.00 1.20 ?  3  ASP A HB3  8  
ATOM   4140 N N    . GLU A 1 4  ? -10.791 1.322   1.783  1.00 0.58 ?  4  GLU A N    8  
ATOM   4141 C CA   . GLU A 1 4  ? -11.203 1.821   0.476  1.00 0.58 ?  4  GLU A CA   8  
ATOM   4142 C C    . GLU A 1 4  ? -10.389 3.048   0.059  1.00 0.43 ?  4  GLU A C    8  
ATOM   4143 O O    . GLU A 1 4  ? -10.137 3.265   -1.130 1.00 0.38 ?  4  GLU A O    8  
ATOM   4144 C CB   . GLU A 1 4  ? -12.696 2.138   0.468  1.00 0.80 ?  4  GLU A CB   8  
ATOM   4145 C CG   . GLU A 1 4  ? -13.569 0.907   0.646  1.00 1.35 ?  4  GLU A CG   8  
ATOM   4146 C CD   . GLU A 1 4  ? -15.044 1.232   0.632  1.00 1.81 ?  4  GLU A CD   8  
ATOM   4147 O OE1  . GLU A 1 4  ? -15.629 1.409   1.721  1.00 2.46 ?  4  GLU A OE1  8  
ATOM   4148 O OE2  . GLU A 1 4  ? -15.632 1.307   -0.470 1.00 2.08 -1 4  GLU A OE2  8  
ATOM   4149 H H    . GLU A 1 4  ? -11.365 1.475   2.563  1.00 0.68 ?  4  GLU A H    8  
ATOM   4150 H HA   . GLU A 1 4  ? -11.018 1.034   -0.239 1.00 0.59 ?  4  GLU A HA   8  
ATOM   4151 H HB2  . GLU A 1 4  ? -12.913 2.826   1.269  1.00 1.07 ?  4  GLU A HB2  8  
ATOM   4152 H HB3  . GLU A 1 4  ? -12.951 2.599   -0.474 1.00 1.03 ?  4  GLU A HB3  8  
ATOM   4153 H HG2  . GLU A 1 4  ? -13.361 0.217   -0.156 1.00 1.90 ?  4  GLU A HG2  8  
ATOM   4154 H HG3  . GLU A 1 4  ? -13.326 0.444   1.591  1.00 1.77 ?  4  GLU A HG3  8  
ATOM   4155 N N    . ASP A 1 5  ? -9.955  3.834   1.035  1.00 0.44 ?  5  ASP A N    8  
ATOM   4156 C CA   . ASP A 1 5  ? -9.130  5.004   0.755  1.00 0.40 ?  5  ASP A CA   8  
ATOM   4157 C C    . ASP A 1 5  ? -7.706  4.548   0.485  1.00 0.28 ?  5  ASP A C    8  
ATOM   4158 O O    . ASP A 1 5  ? -6.974  5.146   -0.299 1.00 0.29 ?  5  ASP A O    8  
ATOM   4159 C CB   . ASP A 1 5  ? -9.157  5.983   1.931  1.00 0.52 ?  5  ASP A CB   8  
ATOM   4160 C CG   . ASP A 1 5  ? -8.439  7.279   1.617  1.00 1.11 ?  5  ASP A CG   8  
ATOM   4161 O OD1  . ASP A 1 5  ? -8.998  8.104   0.860  1.00 1.17 ?  5  ASP A OD1  8  
ATOM   4162 O OD2  . ASP A 1 5  ? -7.322  7.487   2.132  1.00 1.82 -1 5  ASP A OD2  8  
ATOM   4163 H H    . ASP A 1 5  ? -10.179 3.616   1.968  1.00 0.51 ?  5  ASP A H    8  
ATOM   4164 H HA   . ASP A 1 5  ? -9.520  5.488   -0.126 1.00 0.43 ?  5  ASP A HA   8  
ATOM   4165 H HB2  . ASP A 1 5  ? -10.181 6.211   2.179  1.00 1.00 ?  5  ASP A HB2  8  
ATOM   4166 H HB3  . ASP A 1 5  ? -8.677  5.524   2.784  1.00 0.82 ?  5  ASP A HB3  8  
ATOM   4167 N N    . PHE A 1 6  ? -7.348  3.464   1.145  1.00 0.24 ?  6  PHE A N    8  
ATOM   4168 C CA   . PHE A 1 6  ? -6.086  2.787   0.937  1.00 0.18 ?  6  PHE A CA   8  
ATOM   4169 C C    . PHE A 1 6  ? -6.029  2.262   -0.491 1.00 0.13 ?  6  PHE A C    8  
ATOM   4170 O O    . PHE A 1 6  ? -5.013  2.385   -1.174 1.00 0.15 ?  6  PHE A O    8  
ATOM   4171 C CB   . PHE A 1 6  ? -5.979  1.645   1.950  1.00 0.23 ?  6  PHE A CB   8  
ATOM   4172 C CG   . PHE A 1 6  ? -4.693  0.885   1.913  1.00 0.25 ?  6  PHE A CG   8  
ATOM   4173 C CD1  . PHE A 1 6  ? -3.630  1.265   2.712  1.00 0.43 ?  6  PHE A CD1  8  
ATOM   4174 C CD2  . PHE A 1 6  ? -4.555  -0.218  1.096  1.00 0.25 ?  6  PHE A CD2  8  
ATOM   4175 C CE1  . PHE A 1 6  ? -2.449  0.554   2.695  1.00 0.50 ?  6  PHE A CE1  8  
ATOM   4176 C CE2  . PHE A 1 6  ? -3.379  -0.929  1.071  1.00 0.35 ?  6  PHE A CE2  8  
ATOM   4177 C CZ   . PHE A 1 6  ? -2.322  -0.545  1.872  1.00 0.43 ?  6  PHE A CZ   8  
ATOM   4178 H H    . PHE A 1 6  ? -7.968  3.100   1.810  1.00 0.29 ?  6  PHE A H    8  
ATOM   4179 H HA   . PHE A 1 6  ? -5.283  3.491   1.095  1.00 0.23 ?  6  PHE A HA   8  
ATOM   4180 H HB2  . PHE A 1 6  ? -6.088  2.051   2.944  1.00 0.31 ?  6  PHE A HB2  8  
ATOM   4181 H HB3  . PHE A 1 6  ? -6.780  0.944   1.769  1.00 0.27 ?  6  PHE A HB3  8  
ATOM   4182 H HD1  . PHE A 1 6  ? -3.731  2.127   3.353  1.00 0.55 ?  6  PHE A HD1  8  
ATOM   4183 H HD2  . PHE A 1 6  ? -5.380  -0.520  0.469  1.00 0.29 ?  6  PHE A HD2  8  
ATOM   4184 H HE1  . PHE A 1 6  ? -1.625  0.859   3.322  1.00 0.65 ?  6  PHE A HE1  8  
ATOM   4185 H HE2  . PHE A 1 6  ? -3.285  -1.788  0.428  1.00 0.43 ?  6  PHE A HE2  8  
ATOM   4186 H HZ   . PHE A 1 6  ? -1.400  -1.106  1.854  1.00 0.51 ?  6  PHE A HZ   8  
ATOM   4187 N N    . LYS A 1 7  ? -7.144  1.686   -0.935 1.00 0.13 ?  7  LYS A N    8  
ATOM   4188 C CA   . LYS A 1 7  ? -7.294  1.272   -2.320 1.00 0.15 ?  7  LYS A CA   8  
ATOM   4189 C C    . LYS A 1 7  ? -7.176  2.479   -3.240 1.00 0.19 ?  7  LYS A C    8  
ATOM   4190 O O    . LYS A 1 7  ? -6.554  2.411   -4.292 1.00 0.23 ?  7  LYS A O    8  
ATOM   4191 C CB   . LYS A 1 7  ? -8.650  0.599   -2.537 1.00 0.23 ?  7  LYS A CB   8  
ATOM   4192 C CG   . LYS A 1 7  ? -8.852  0.076   -3.951 1.00 0.30 ?  7  LYS A CG   8  
ATOM   4193 C CD   . LYS A 1 7  ? -10.278 -0.394  -4.169 1.00 0.44 ?  7  LYS A CD   8  
ATOM   4194 C CE   . LYS A 1 7  ? -10.482 -0.928  -5.578 1.00 1.26 ?  7  LYS A CE   8  
ATOM   4195 N NZ   . LYS A 1 7  ? -11.894 -1.322  -5.820 1.00 2.06 1  7  LYS A NZ   8  
ATOM   4196 H H    . LYS A 1 7  ? -7.879  1.520   -0.303 1.00 0.18 ?  7  LYS A H    8  
ATOM   4197 H HA   . LYS A 1 7  ? -6.505  0.572   -2.551 1.00 0.15 ?  7  LYS A HA   8  
ATOM   4198 H HB2  . LYS A 1 7  ? -8.744  -0.227  -1.849 1.00 0.28 ?  7  LYS A HB2  8  
ATOM   4199 H HB3  . LYS A 1 7  ? -9.429  1.317   -2.328 1.00 0.25 ?  7  LYS A HB3  8  
ATOM   4200 H HG2  . LYS A 1 7  ? -8.630  0.867   -4.651 1.00 0.31 ?  7  LYS A HG2  8  
ATOM   4201 H HG3  . LYS A 1 7  ? -8.180  -0.753  -4.116 1.00 0.36 ?  7  LYS A HG3  8  
ATOM   4202 H HD2  . LYS A 1 7  ? -10.501 -1.179  -3.463 1.00 1.10 ?  7  LYS A HD2  8  
ATOM   4203 H HD3  . LYS A 1 7  ? -10.949 0.438   -4.008 1.00 0.92 ?  7  LYS A HD3  8  
ATOM   4204 H HE2  . LYS A 1 7  ? -10.206 -0.159  -6.286 1.00 1.83 ?  7  LYS A HE2  8  
ATOM   4205 H HE3  . LYS A 1 7  ? -9.846  -1.789  -5.720 1.00 1.84 ?  7  LYS A HE3  8  
ATOM   4206 H HZ1  . LYS A 1 7  ? -12.519 -0.497  -5.720 1.00 2.69 ?  7  LYS A HZ1  8  
ATOM   4207 H HZ2  . LYS A 1 7  ? -12.186 -2.047  -5.136 1.00 2.55 ?  7  LYS A HZ2  8  
ATOM   4208 H HZ3  . LYS A 1 7  ? -12.001 -1.707  -6.781 1.00 2.30 ?  7  LYS A HZ3  8  
ATOM   4209 N N    . ALA A 1 8  ? -7.783  3.582   -2.827 1.00 0.22 ?  8  ALA A N    8  
ATOM   4210 C CA   . ALA A 1 8  ? -7.726  4.822   -3.588 1.00 0.30 ?  8  ALA A CA   8  
ATOM   4211 C C    . ALA A 1 8  ? -6.291  5.324   -3.735 1.00 0.35 ?  8  ALA A C    8  
ATOM   4212 O O    . ALA A 1 8  ? -5.918  5.866   -4.774 1.00 0.45 ?  8  ALA A O    8  
ATOM   4213 C CB   . ALA A 1 8  ? -8.589  5.880   -2.921 1.00 0.35 ?  8  ALA A CB   8  
ATOM   4214 H H    . ALA A 1 8  ? -8.301  3.557   -1.990 1.00 0.22 ?  8  ALA A H    8  
ATOM   4215 H HA   . ALA A 1 8  ? -8.132  4.630   -4.570 1.00 0.34 ?  8  ALA A HA   8  
ATOM   4216 H HB1  . ALA A 1 8  ? -9.607  5.527   -2.858 1.00 1.02 ?  8  ALA A HB1  8  
ATOM   4217 H HB2  . ALA A 1 8  ? -8.557  6.789   -3.499 1.00 1.02 ?  8  ALA A HB2  8  
ATOM   4218 H HB3  . ALA A 1 8  ? -8.214  6.073   -1.927 1.00 1.04 ?  8  ALA A HB3  8  
ATOM   4219 N N    . VAL A 1 9  ? -5.490  5.142   -2.692 1.00 0.31 ?  9  VAL A N    8  
ATOM   4220 C CA   . VAL A 1 9  ? -4.099  5.583   -2.714 1.00 0.39 ?  9  VAL A CA   8  
ATOM   4221 C C    . VAL A 1 9  ? -3.218  4.628   -3.519 1.00 0.38 ?  9  VAL A C    8  
ATOM   4222 O O    . VAL A 1 9  ? -2.592  5.022   -4.503 1.00 0.49 ?  9  VAL A O    8  
ATOM   4223 C CB   . VAL A 1 9  ? -3.511  5.708   -1.289 1.00 0.42 ?  9  VAL A CB   8  
ATOM   4224 C CG1  . VAL A 1 9  ? -2.053  6.136   -1.348 1.00 0.52 ?  9  VAL A CG1  8  
ATOM   4225 C CG2  . VAL A 1 9  ? -4.315  6.686   -0.449 1.00 0.50 ?  9  VAL A CG2  8  
ATOM   4226 H H    . VAL A 1 9  ? -5.848  4.714   -1.881 1.00 0.26 ?  9  VAL A H    8  
ATOM   4227 H HA   . VAL A 1 9  ? -4.069  6.557   -3.176 1.00 0.47 ?  9  VAL A HA   8  
ATOM   4228 H HB   . VAL A 1 9  ? -3.558  4.737   -0.816 1.00 0.37 ?  9  VAL A HB   8  
ATOM   4229 H HG11 . VAL A 1 9  ? -1.485  5.404   -1.902 1.00 0.97 ?  9  VAL A HG11 8  
ATOM   4230 H HG12 . VAL A 1 9  ? -1.660  6.215   -0.345 1.00 0.84 ?  9  VAL A HG12 8  
ATOM   4231 H HG13 . VAL A 1 9  ? -1.980  7.095   -1.840 1.00 1.18 ?  9  VAL A HG13 8  
ATOM   4232 H HG21 . VAL A 1 9  ? -5.337  6.347   -0.384 1.00 0.95 ?  9  VAL A HG21 8  
ATOM   4233 H HG22 . VAL A 1 9  ? -4.285  7.663   -0.906 1.00 0.76 ?  9  VAL A HG22 8  
ATOM   4234 H HG23 . VAL A 1 9  ? -3.890  6.739   0.543  1.00 0.91 ?  9  VAL A HG23 8  
ATOM   4235 N N    . PHE A 1 10 ? -3.185  3.373   -3.098 1.00 0.29 ?  10 PHE A N    8  
ATOM   4236 C CA   . PHE A 1 10 ? -2.240  2.405   -3.641 1.00 0.33 ?  10 PHE A CA   8  
ATOM   4237 C C    . PHE A 1 10 ? -2.736  1.781   -4.940 1.00 0.35 ?  10 PHE A C    8  
ATOM   4238 O O    . PHE A 1 10 ? -1.936  1.404   -5.798 1.00 0.45 ?  10 PHE A O    8  
ATOM   4239 C CB   . PHE A 1 10 ? -1.955  1.315   -2.606 1.00 0.32 ?  10 PHE A CB   8  
ATOM   4240 C CG   . PHE A 1 10 ? -1.148  1.800   -1.437 1.00 0.33 ?  10 PHE A CG   8  
ATOM   4241 C CD1  . PHE A 1 10 ? -1.759  2.432   -0.368 1.00 0.39 ?  10 PHE A CD1  8  
ATOM   4242 C CD2  . PHE A 1 10 ? 0.225   1.626   -1.412 1.00 0.39 ?  10 PHE A CD2  8  
ATOM   4243 C CE1  . PHE A 1 10 ? -1.017  2.882   0.704  1.00 0.41 ?  10 PHE A CE1  8  
ATOM   4244 C CE2  . PHE A 1 10 ? 0.973   2.073   -0.341 1.00 0.42 ?  10 PHE A CE2  8  
ATOM   4245 C CZ   . PHE A 1 10 ? 0.350   2.701   0.717  1.00 0.37 ?  10 PHE A CZ   8  
ATOM   4246 H H    . PHE A 1 10 ? -3.816  3.086   -2.401 1.00 0.22 ?  10 PHE A H    8  
ATOM   4247 H HA   . PHE A 1 10 ? -1.320  2.930   -3.845 1.00 0.39 ?  10 PHE A HA   8  
ATOM   4248 H HB2  . PHE A 1 10 ? -2.892  0.933   -2.226 1.00 0.30 ?  10 PHE A HB2  8  
ATOM   4249 H HB3  . PHE A 1 10 ? -1.408  0.512   -3.078 1.00 0.37 ?  10 PHE A HB3  8  
ATOM   4250 H HD1  . PHE A 1 10 ? -2.830  2.571   -0.374 1.00 0.48 ?  10 PHE A HD1  8  
ATOM   4251 H HD2  . PHE A 1 10 ? 0.713   1.133   -2.241 1.00 0.47 ?  10 PHE A HD2  8  
ATOM   4252 H HE1  . PHE A 1 10 ? -1.506  3.377   1.529  1.00 0.50 ?  10 PHE A HE1  8  
ATOM   4253 H HE2  . PHE A 1 10 ? 2.043   1.929   -0.331 1.00 0.52 ?  10 PHE A HE2  8  
ATOM   4254 H HZ   . PHE A 1 10 ? 0.934   3.052   1.553  1.00 0.39 ?  10 PHE A HZ   8  
ATOM   4255 N N    . GLY A 1 11 ? -4.047  1.681   -5.086 1.00 0.28 ?  11 GLY A N    8  
ATOM   4256 C CA   . GLY A 1 11 ? -4.617  1.053   -6.260 1.00 0.31 ?  11 GLY A CA   8  
ATOM   4257 C C    . GLY A 1 11 ? -5.235  -0.289  -5.939 1.00 0.29 ?  11 GLY A C    8  
ATOM   4258 O O    . GLY A 1 11 ? -5.988  -0.844  -6.738 1.00 0.36 ?  11 GLY A O    8  
ATOM   4259 H H    . GLY A 1 11 ? -4.644  2.053   -4.398 1.00 0.24 ?  11 GLY A H    8  
ATOM   4260 H HA2  . GLY A 1 11 ? -5.377  1.700   -6.670 1.00 0.32 ?  11 GLY A HA2  8  
ATOM   4261 H HA3  . GLY A 1 11 ? -3.839  0.915   -6.995 1.00 0.35 ?  11 GLY A HA3  8  
HETATM 4262 N N    . NLE A 1 12 ? -4.913  -0.808  -4.763 1.00 0.24 ?  12 NLE A N    8  
HETATM 4263 C CA   . NLE A 1 12 ? -5.430  -2.091  -4.310 1.00 0.24 ?  12 NLE A CA   8  
HETATM 4264 C C    . NLE A 1 12 ? -5.746  -2.041  -2.822 1.00 0.21 ?  12 NLE A C    8  
HETATM 4265 O O    . NLE A 1 12 ? -5.227  -1.192  -2.097 1.00 0.22 ?  12 NLE A O    8  
HETATM 4266 C CB   . NLE A 1 12 ? -4.443  -3.233  -4.613 1.00 0.27 ?  12 NLE A CB   8  
HETATM 4267 C CG   . NLE A 1 12 ? -3.019  -2.795  -4.933 1.00 0.64 ?  12 NLE A CG   8  
HETATM 4268 C CD   . NLE A 1 12 ? -2.293  -2.236  -3.721 1.00 0.33 ?  12 NLE A CD   8  
HETATM 4269 C CE   . NLE A 1 12 ? -0.891  -1.822  -4.116 1.00 0.64 ?  12 NLE A CE   8  
HETATM 4270 H H    . NLE A 1 12 ? -4.311  -0.310  -4.174 1.00 0.26 ?  12 NLE A H    8  
HETATM 4271 H HA   . NLE A 1 12 ? -6.349  -2.277  -4.846 1.00 0.26 ?  12 NLE A HA   8  
HETATM 4272 H HB2  . NLE A 1 12 ? -4.819  -3.798  -5.454 1.00 0.51 ?  12 NLE A HB2  8  
HETATM 4273 H HB3  . NLE A 1 12 ? -4.401  -3.880  -3.753 1.00 0.31 ?  12 NLE A HB3  8  
HETATM 4274 H HG2  . NLE A 1 12 ? -3.053  -2.035  -5.700 1.00 1.24 ?  12 NLE A HG2  8  
HETATM 4275 H HG3  . NLE A 1 12 ? -2.468  -3.648  -5.298 1.00 1.24 ?  12 NLE A HG3  8  
HETATM 4276 H HD2  . NLE A 1 12 ? -2.231  -2.996  -2.956 1.00 0.70 ?  12 NLE A HD2  8  
HETATM 4277 H HD3  . NLE A 1 12 ? -2.822  -1.373  -3.348 1.00 0.43 ?  12 NLE A HD3  8  
HETATM 4278 H HE1  . NLE A 1 12 ? -0.337  -2.692  -4.439 1.00 1.10 ?  12 NLE A HE1  8  
HETATM 4279 H HE2  . NLE A 1 12 ? -0.395  -1.370  -3.272 1.00 1.19 ?  12 NLE A HE2  8  
HETATM 4280 H HE3  . NLE A 1 12 ? -0.942  -1.111  -4.928 1.00 1.26 ?  12 NLE A HE3  8  
ATOM   4281 N N    . THR A 1 13 ? -6.603  -2.950  -2.382 1.00 0.24 ?  13 THR A N    8  
ATOM   4282 C CA   . THR A 1 13 ? -7.073  -2.972  -1.007 1.00 0.27 ?  13 THR A CA   8  
ATOM   4283 C C    . THR A 1 13 ? -6.050  -3.593  -0.065 1.00 0.24 ?  13 THR A C    8  
ATOM   4284 O O    . THR A 1 13 ? -5.083  -4.216  -0.518 1.00 0.23 ?  13 THR A O    8  
ATOM   4285 C CB   . THR A 1 13 ? -8.396  -3.748  -0.901 1.00 0.34 ?  13 THR A CB   8  
ATOM   4286 O OG1  . THR A 1 13 ? -8.303  -4.971  -1.648 1.00 0.36 ?  13 THR A OG1  8  
ATOM   4287 C CG2  . THR A 1 13 ? -9.556  -2.915  -1.420 1.00 0.43 ?  13 THR A CG2  8  
ATOM   4288 H H    . THR A 1 13 ? -6.930  -3.636  -3.001 1.00 0.27 ?  13 THR A H    8  
ATOM   4289 H HA   . THR A 1 13 ? -7.254  -1.954  -0.699 1.00 0.30 ?  13 THR A HA   8  
ATOM   4290 H HB   . THR A 1 13 ? -8.574  -3.984  0.139  1.00 0.34 ?  13 THR A HB   8  
ATOM   4291 H HG1  . THR A 1 13 ? -9.180  -5.365  -1.728 1.00 0.58 ?  13 THR A HG1  8  
ATOM   4292 H HG21 . THR A 1 13 ? -9.379  -2.659  -2.453 1.00 0.92 ?  13 THR A HG21 8  
ATOM   4293 H HG22 . THR A 1 13 ? -9.641  -2.011  -0.833 1.00 1.34 ?  13 THR A HG22 8  
ATOM   4294 H HG23 . THR A 1 13 ? -10.471 -3.482  -1.340 1.00 1.02 ?  13 THR A HG23 8  
ATOM   4295 N N    . ARG A 1 14 ? -6.279  -3.439  1.238  1.00 0.29 ?  14 ARG A N    8  
ATOM   4296 C CA   . ARG A 1 14 ? -5.350  -3.934  2.252  1.00 0.32 ?  14 ARG A CA   8  
ATOM   4297 C C    . ARG A 1 14 ? -4.980  -5.387  1.995  1.00 0.30 ?  14 ARG A C    8  
ATOM   4298 O O    . ARG A 1 14 ? -3.805  -5.748  2.032  1.00 0.31 ?  14 ARG A O    8  
ATOM   4299 C CB   . ARG A 1 14 ? -5.958  -3.819  3.647  1.00 0.42 ?  14 ARG A CB   8  
ATOM   4300 C CG   . ARG A 1 14 ? -6.143  -2.396  4.136  1.00 0.53 ?  14 ARG A CG   8  
ATOM   4301 C CD   . ARG A 1 14 ? -6.871  -2.382  5.470  1.00 0.77 ?  14 ARG A CD   8  
ATOM   4302 N NE   . ARG A 1 14 ? -7.010  -1.038  6.022  1.00 1.30 ?  14 ARG A NE   8  
ATOM   4303 C CZ   . ARG A 1 14 ? -7.937  -0.704  6.919  1.00 1.88 ?  14 ARG A CZ   8  
ATOM   4304 N NH1  . ARG A 1 14 ? -8.827  -1.599  7.323  1.00 2.02 1  14 ARG A NH1  8  
ATOM   4305 N NH2  . ARG A 1 14 ? -7.984  0.527   7.408  1.00 2.82 ?  14 ARG A NH2  8  
ATOM   4306 H H    . ARG A 1 14 ? -7.107  -2.988  1.526  1.00 0.32 ?  14 ARG A H    8  
ATOM   4307 H HA   . ARG A 1 14 ? -4.455  -3.331  2.206  1.00 0.34 ?  14 ARG A HA   8  
ATOM   4308 H HB2  . ARG A 1 14 ? -6.925  -4.299  3.645  1.00 0.43 ?  14 ARG A HB2  8  
ATOM   4309 H HB3  . ARG A 1 14 ? -5.315  -4.333  4.343  1.00 0.46 ?  14 ARG A HB3  8  
ATOM   4310 H HG2  . ARG A 1 14 ? -5.171  -1.935  4.256  1.00 0.58 ?  14 ARG A HG2  8  
ATOM   4311 H HG3  . ARG A 1 14 ? -6.723  -1.844  3.411  1.00 0.53 ?  14 ARG A HG3  8  
ATOM   4312 H HD2  . ARG A 1 14 ? -7.855  -2.802  5.329  1.00 1.48 ?  14 ARG A HD2  8  
ATOM   4313 H HD3  . ARG A 1 14 ? -6.320  -2.993  6.171  1.00 1.15 ?  14 ARG A HD3  8  
ATOM   4314 H HE   . ARG A 1 14 ? -6.367  -0.358  5.721  1.00 1.80 ?  14 ARG A HE   8  
ATOM   4315 H HH11 . ARG A 1 14 ? -9.523  -1.344  8.000  1.00 2.60 ?  14 ARG A HH11 8  
ATOM   4316 H HH12 . ARG A 1 14 ? -8.814  -2.530  6.952  1.00 1.94 ?  14 ARG A HH12 8  
ATOM   4317 H HH21 . ARG A 1 14 ? -7.322  1.222   7.105  1.00 3.23 ?  14 ARG A HH21 8  
ATOM   4318 H HH22 . ARG A 1 14 ? -8.680  0.771   8.092  1.00 3.30 ?  14 ARG A HH22 8  
HETATM 4319 N N    . AIB A 1 15 ? -5.997  -6.199  1.712  1.00 0.31 ?  15 AIB A N    8  
HETATM 4320 C CA   . AIB A 1 15 ? -5.823  -7.633  1.469  1.00 0.33 ?  15 AIB A CA   8  
HETATM 4321 C C    . AIB A 1 15 ? -4.818  -7.847  0.329  1.00 0.30 ?  15 AIB A C    8  
HETATM 4322 O O    . AIB A 1 15 ? -3.921  -8.693  0.416  1.00 0.30 ?  15 AIB A O    8  
HETATM 4323 C CB1  . AIB A 1 15 ? -7.157  -8.240  1.084  1.00 0.37 ?  15 AIB A CB1  8  
HETATM 4324 C CB2  . AIB A 1 15 ? -5.356  -8.323  2.738  1.00 0.37 ?  15 AIB A CB2  8  
HETATM 4325 H H    . AIB A 1 15 ? -6.902  -5.819  1.667  1.00 0.31 ?  15 AIB A H    8  
HETATM 4326 H HB11 . AIB A 1 15 ? -7.853  -8.129  1.900  1.00 1.00 ?  15 AIB A HB11 8  
HETATM 4327 H HB12 . AIB A 1 15 ? -7.024  -9.289  0.862  1.00 1.13 ?  15 AIB A HB12 8  
HETATM 4328 H HB13 . AIB A 1 15 ? -7.542  -7.735  0.211  1.00 1.02 ?  15 AIB A HB13 8  
HETATM 4329 H HB21 . AIB A 1 15 ? -5.251  -9.380  2.556  1.00 1.07 ?  15 AIB A HB21 8  
HETATM 4330 H HB22 . AIB A 1 15 ? -6.081  -8.163  3.521  1.00 1.16 ?  15 AIB A HB22 8  
HETATM 4331 H HB23 . AIB A 1 15 ? -4.404  -7.912  3.040  1.00 1.01 ?  15 AIB A HB23 8  
ATOM   4332 N N    . ALA A 1 16 ? -4.957  -7.049  -0.721 1.00 0.27 ?  16 ALA A N    8  
ATOM   4333 C CA   . ALA A 1 16 ? -4.142  -7.206  -1.915 1.00 0.26 ?  16 ALA A CA   8  
ATOM   4334 C C    . ALA A 1 16 ? -2.735  -6.685  -1.670 1.00 0.23 ?  16 ALA A C    8  
ATOM   4335 O O    . ALA A 1 16 ? -1.763  -7.191  -2.232 1.00 0.25 ?  16 ALA A O    8  
ATOM   4336 C CB   . ALA A 1 16 ? -4.783  -6.484  -3.087 1.00 0.28 ?  16 ALA A CB   8  
ATOM   4337 H H    . ALA A 1 16 ? -5.607  -6.309  -0.681 1.00 0.27 ?  16 ALA A H    8  
ATOM   4338 H HA   . ALA A 1 16 ? -4.094  -8.258  -2.150 1.00 0.29 ?  16 ALA A HA   8  
ATOM   4339 H HB1  . ALA A 1 16 ? -4.926  -5.445  -2.831 1.00 0.90 ?  16 ALA A HB1  8  
ATOM   4340 H HB2  . ALA A 1 16 ? -5.739  -6.935  -3.310 1.00 0.96 ?  16 ALA A HB2  8  
ATOM   4341 H HB3  . ALA A 1 16 ? -4.138  -6.556  -3.950 1.00 0.89 ?  16 ALA A HB3  8  
ATOM   4342 N N    . PHE A 1 17 ? -2.637  -5.676  -0.823 1.00 0.20 ?  17 PHE A N    8  
ATOM   4343 C CA   . PHE A 1 17 ? -1.356  -5.101  -0.455 1.00 0.19 ?  17 PHE A CA   8  
ATOM   4344 C C    . PHE A 1 17 ? -0.571  -6.073  0.418  1.00 0.20 ?  17 PHE A C    8  
ATOM   4345 O O    . PHE A 1 17 ? 0.604   -6.329  0.174  1.00 0.20 ?  17 PHE A O    8  
ATOM   4346 C CB   . PHE A 1 17 ? -1.592  -3.790  0.282  1.00 0.22 ?  17 PHE A CB   8  
ATOM   4347 C CG   . PHE A 1 17 ? -0.348  -3.009  0.573  1.00 0.24 ?  17 PHE A CG   8  
ATOM   4348 C CD1  . PHE A 1 17 ? 0.265   -2.280  -0.429 1.00 0.28 ?  17 PHE A CD1  8  
ATOM   4349 C CD2  . PHE A 1 17 ? 0.194   -2.983  1.846  1.00 0.28 ?  17 PHE A CD2  8  
ATOM   4350 C CE1  . PHE A 1 17 ? 1.396   -1.541  -0.170 1.00 0.33 ?  17 PHE A CE1  8  
ATOM   4351 C CE2  . PHE A 1 17 ? 1.331   -2.245  2.112  1.00 0.32 ?  17 PHE A CE2  8  
ATOM   4352 C CZ   . PHE A 1 17 ? 1.931   -1.522  1.101  1.00 0.33 ?  17 PHE A CZ   8  
ATOM   4353 H H    . PHE A 1 17 ? -3.459  -5.296  -0.435 1.00 0.21 ?  17 PHE A H    8  
ATOM   4354 H HA   . PHE A 1 17 ? -0.800  -4.906  -1.358 1.00 0.19 ?  17 PHE A HA   8  
ATOM   4355 H HB2  . PHE A 1 17 ? -2.231  -3.168  -0.322 1.00 0.22 ?  17 PHE A HB2  8  
ATOM   4356 H HB3  . PHE A 1 17 ? -2.083  -3.996  1.222  1.00 0.24 ?  17 PHE A HB3  8  
ATOM   4357 H HD1  . PHE A 1 17 ? -0.151  -2.296  -1.424 1.00 0.30 ?  17 PHE A HD1  8  
ATOM   4358 H HD2  . PHE A 1 17 ? -0.278  -3.552  2.634  1.00 0.30 ?  17 PHE A HD2  8  
ATOM   4359 H HE1  . PHE A 1 17 ? 1.863   -0.978  -0.961 1.00 0.38 ?  17 PHE A HE1  8  
ATOM   4360 H HE2  . PHE A 1 17 ? 1.748   -2.231  3.107  1.00 0.36 ?  17 PHE A HE2  8  
ATOM   4361 H HZ   . PHE A 1 17 ? 2.820   -0.944  1.302  1.00 0.37 ?  17 PHE A HZ   8  
ATOM   4362 N N    . ALA A 1 18 ? -1.241  -6.631  1.416  1.00 0.23 ?  18 ALA A N    8  
ATOM   4363 C CA   . ALA A 1 18 ? -0.623  -7.597  2.311  1.00 0.25 ?  18 ALA A CA   8  
ATOM   4364 C C    . ALA A 1 18 ? -0.337  -8.902  1.578  1.00 0.23 ?  18 ALA A C    8  
ATOM   4365 O O    . ALA A 1 18 ? 0.500   -9.698  2.005  1.00 0.23 ?  18 ALA A O    8  
ATOM   4366 C CB   . ALA A 1 18 ? -1.509  -7.842  3.519  1.00 0.30 ?  18 ALA A CB   8  
ATOM   4367 H H    . ALA A 1 18 ? -2.181  -6.382  1.555  1.00 0.25 ?  18 ALA A H    8  
ATOM   4368 H HA   . ALA A 1 18 ? 0.311   -7.178  2.658  1.00 0.27 ?  18 ALA A HA   8  
ATOM   4369 H HB1  . ALA A 1 18 ? -1.712  -6.903  4.012  1.00 1.06 ?  18 ALA A HB1  8  
ATOM   4370 H HB2  . ALA A 1 18 ? -1.007  -8.508  4.205  1.00 0.87 ?  18 ALA A HB2  8  
ATOM   4371 H HB3  . ALA A 1 18 ? -2.438  -8.289  3.198  1.00 0.99 ?  18 ALA A HB3  8  
ATOM   4372 N N    . ASN A 1 19 ? -1.057  -9.124  0.481  1.00 0.24 ?  19 ASN A N    8  
ATOM   4373 C CA   . ASN A 1 19 ? -0.767  -10.240 -0.415 1.00 0.24 ?  19 ASN A CA   8  
ATOM   4374 C C    . ASN A 1 19 ? 0.630   -10.089 -1.017 1.00 0.19 ?  19 ASN A C    8  
ATOM   4375 O O    . ASN A 1 19 ? 1.290   -11.075 -1.348 1.00 0.22 ?  19 ASN A O    8  
ATOM   4376 C CB   . ASN A 1 19 ? -1.815  -10.307 -1.533 1.00 0.31 ?  19 ASN A CB   8  
ATOM   4377 C CG   . ASN A 1 19 ? -1.606  -11.482 -2.471 1.00 0.36 ?  19 ASN A CG   8  
ATOM   4378 O OD1  . ASN A 1 19 ? -1.127  -12.542 -2.067 1.00 1.14 ?  19 ASN A OD1  8  
ATOM   4379 N ND2  . ASN A 1 19 ? -1.970  -11.307 -3.730 1.00 1.08 ?  19 ASN A ND2  8  
ATOM   4380 H H    . ASN A 1 19 ? -1.821  -8.536  0.283  1.00 0.25 ?  19 ASN A H    8  
ATOM   4381 H HA   . ASN A 1 19 ? -0.806  -11.152 0.162  1.00 0.27 ?  19 ASN A HA   8  
ATOM   4382 H HB2  . ASN A 1 19 ? -2.795  -10.397 -1.089 1.00 0.38 ?  19 ASN A HB2  8  
ATOM   4383 H HB3  . ASN A 1 19 ? -1.771  -9.396  -2.111 1.00 0.32 ?  19 ASN A HB3  8  
ATOM   4384 H HD21 . ASN A 1 19 ? -2.351  -10.440 -3.988 1.00 1.83 ?  19 ASN A HD21 8  
ATOM   4385 H HD22 . ASN A 1 19 ? -1.848  -12.053 -4.356 1.00 1.08 ?  19 ASN A HD22 8  
ATOM   4386 N N    . LEU A 1 20 ? 1.082   -8.848  -1.138 1.00 0.17 ?  20 LEU A N    8  
ATOM   4387 C CA   . LEU A 1 20 ? 2.402   -8.561  -1.676 1.00 0.17 ?  20 LEU A CA   8  
ATOM   4388 C C    . LEU A 1 20 ? 3.465   -8.849  -0.625 1.00 0.17 ?  20 LEU A C    8  
ATOM   4389 O O    . LEU A 1 20 ? 3.194   -8.772  0.574  1.00 0.18 ?  20 LEU A O    8  
ATOM   4390 C CB   . LEU A 1 20 ? 2.486   -7.100  -2.117 1.00 0.20 ?  20 LEU A CB   8  
ATOM   4391 C CG   . LEU A 1 20 ? 1.531   -6.708  -3.244 1.00 0.29 ?  20 LEU A CG   8  
ATOM   4392 C CD1  . LEU A 1 20 ? 1.510   -5.200  -3.420 1.00 0.32 ?  20 LEU A CD1  8  
ATOM   4393 C CD2  . LEU A 1 20 ? 1.941   -7.386  -4.543 1.00 0.41 ?  20 LEU A CD2  8  
ATOM   4394 H H    . LEU A 1 20 ? 0.520   -8.100  -0.834 1.00 0.19 ?  20 LEU A H    8  
ATOM   4395 H HA   . LEU A 1 20 ? 2.562   -9.201  -2.527 1.00 0.22 ?  20 LEU A HA   8  
ATOM   4396 H HB2  . LEU A 1 20 ? 2.279   -6.475  -1.261 1.00 0.19 ?  20 LEU A HB2  8  
ATOM   4397 H HB3  . LEU A 1 20 ? 3.495   -6.906  -2.448 1.00 0.24 ?  20 LEU A HB3  8  
ATOM   4398 H HG   . LEU A 1 20 ? 0.532   -7.033  -2.994 1.00 0.33 ?  20 LEU A HG   8  
ATOM   4399 H HD11 . LEU A 1 20 ? 2.502   -4.853  -3.671 1.00 1.04 ?  20 LEU A HD11 8  
ATOM   4400 H HD12 . LEU A 1 20 ? 1.188   -4.735  -2.499 1.00 1.05 ?  20 LEU A HD12 8  
ATOM   4401 H HD13 . LEU A 1 20 ? 0.826   -4.939  -4.213 1.00 1.10 ?  20 LEU A HD13 8  
ATOM   4402 H HD21 . LEU A 1 20 ? 2.957   -7.114  -4.787 1.00 1.10 ?  20 LEU A HD21 8  
ATOM   4403 H HD22 . LEU A 1 20 ? 1.283   -7.068  -5.338 1.00 0.88 ?  20 LEU A HD22 8  
ATOM   4404 H HD23 . LEU A 1 20 ? 1.873   -8.457  -4.428 1.00 1.17 ?  20 LEU A HD23 8  
ATOM   4405 N N    . PRO A 1 21 ? 4.685   -9.204  -1.054 1.00 0.23 ?  21 PRO A N    8  
ATOM   4406 C CA   . PRO A 1 21 ? 5.790   -9.479  -0.135 1.00 0.29 ?  21 PRO A CA   8  
ATOM   4407 C C    . PRO A 1 21 ? 6.186   -8.250  0.680  1.00 0.26 ?  21 PRO A C    8  
ATOM   4408 O O    . PRO A 1 21 ? 5.990   -7.120  0.223  1.00 0.22 ?  21 PRO A O    8  
ATOM   4409 C CB   . PRO A 1 21 ? 6.944   -9.900  -1.052 1.00 0.38 ?  21 PRO A CB   8  
ATOM   4410 C CG   . PRO A 1 21 ? 6.306   -10.251 -2.354 1.00 0.43 ?  21 PRO A CG   8  
ATOM   4411 C CD   . PRO A 1 21 ? 5.081   -9.386  -2.459 1.00 0.30 ?  21 PRO A CD   8  
ATOM   4412 H HA   . PRO A 1 21 ? 5.549   -10.289 0.538  1.00 0.32 ?  21 PRO A HA   8  
ATOM   4413 H HB2  . PRO A 1 21 ? 7.636   -9.076  -1.160 1.00 0.43 ?  21 PRO A HB2  8  
ATOM   4414 H HB3  . PRO A 1 21 ? 7.456   -10.748 -0.622 1.00 0.48 ?  21 PRO A HB3  8  
ATOM   4415 H HG2  . PRO A 1 21 ? 6.986   -10.038 -3.166 1.00 0.63 ?  21 PRO A HG2  8  
ATOM   4416 H HG3  . PRO A 1 21 ? 6.029   -11.297 -2.356 1.00 0.61 ?  21 PRO A HG3  8  
ATOM   4417 H HD2  . PRO A 1 21 ? 5.326   -8.440  -2.918 1.00 0.40 ?  21 PRO A HD2  8  
ATOM   4418 H HD3  . PRO A 1 21 ? 4.307   -9.889  -3.019 1.00 0.39 ?  21 PRO A HD3  8  
ATOM   4419 N N    . LEU A 1 22 ? 6.738   -8.464  1.869  1.00 0.30 ?  22 LEU A N    8  
ATOM   4420 C CA   . LEU A 1 22 ? 7.031   -7.370  2.798  1.00 0.31 ?  22 LEU A CA   8  
ATOM   4421 C C    . LEU A 1 22 ? 7.806   -6.238  2.131  1.00 0.28 ?  22 LEU A C    8  
ATOM   4422 O O    . LEU A 1 22 ? 7.460   -5.067  2.295  1.00 0.28 ?  22 LEU A O    8  
ATOM   4423 C CB   . LEU A 1 22 ? 7.812   -7.888  4.006  1.00 0.41 ?  22 LEU A CB   8  
ATOM   4424 C CG   . LEU A 1 22 ? 7.024   -8.779  4.967  1.00 1.07 ?  22 LEU A CG   8  
ATOM   4425 C CD1  . LEU A 1 22 ? 7.943   -9.340  6.039  1.00 1.64 ?  22 LEU A CD1  8  
ATOM   4426 C CD2  . LEU A 1 22 ? 5.884   -8.000  5.607  1.00 1.54 ?  22 LEU A CD2  8  
ATOM   4427 H H    . LEU A 1 22 ? 6.957   -9.384  2.132  1.00 0.34 ?  22 LEU A H    8  
ATOM   4428 H HA   . LEU A 1 22 ? 6.087   -6.975  3.142  1.00 0.30 ?  22 LEU A HA   8  
ATOM   4429 H HB2  . LEU A 1 22 ? 8.659   -8.449  3.642  1.00 1.00 ?  22 LEU A HB2  8  
ATOM   4430 H HB3  . LEU A 1 22 ? 8.179   -7.037  4.560  1.00 0.94 ?  22 LEU A HB3  8  
ATOM   4431 H HG   . LEU A 1 22 ? 6.601   -9.608  4.421  1.00 1.97 ?  22 LEU A HG   8  
ATOM   4432 H HD11 . LEU A 1 22 ? 8.420   -8.528  6.565  1.00 2.16 ?  22 LEU A HD11 8  
ATOM   4433 H HD12 . LEU A 1 22 ? 8.694   -9.963  5.578  1.00 1.77 ?  22 LEU A HD12 8  
ATOM   4434 H HD13 . LEU A 1 22 ? 7.365   -9.929  6.736  1.00 2.26 ?  22 LEU A HD13 8  
ATOM   4435 H HD21 . LEU A 1 22 ? 5.168   -7.718  4.848  1.00 2.09 ?  22 LEU A HD21 8  
ATOM   4436 H HD22 . LEU A 1 22 ? 6.276   -7.110  6.077  1.00 1.81 ?  22 LEU A HD22 8  
ATOM   4437 H HD23 . LEU A 1 22 ? 5.399   -8.615  6.349  1.00 2.05 ?  22 LEU A HD23 8  
ATOM   4438 N N    . TRP A 1 23 ? 8.834   -6.588  1.364  1.00 0.33 ?  23 TRP A N    8  
ATOM   4439 C CA   . TRP A 1 23 ? 9.658   -5.587  0.700  1.00 0.34 ?  23 TRP A CA   8  
ATOM   4440 C C    . TRP A 1 23 ? 8.835   -4.768  -0.289 1.00 0.27 ?  23 TRP A C    8  
ATOM   4441 O O    . TRP A 1 23 ? 9.077   -3.578  -0.469 1.00 0.25 ?  23 TRP A O    8  
ATOM   4442 C CB   . TRP A 1 23 ? 10.856  -6.240  -0.006 1.00 0.42 ?  23 TRP A CB   8  
ATOM   4443 C CG   . TRP A 1 23 ? 10.485  -7.203  -1.094 1.00 0.48 ?  23 TRP A CG   8  
ATOM   4444 C CD1  . TRP A 1 23 ? 10.315  -8.549  -0.970 1.00 0.56 ?  23 TRP A CD1  8  
ATOM   4445 C CD2  . TRP A 1 23 ? 10.249  -6.895  -2.474 1.00 0.51 ?  23 TRP A CD2  8  
ATOM   4446 N NE1  . TRP A 1 23 ? 9.987   -9.097  -2.186 1.00 0.62 ?  23 TRP A NE1  8  
ATOM   4447 C CE2  . TRP A 1 23 ? 9.939   -8.103  -3.125 1.00 0.60 ?  23 TRP A CE2  8  
ATOM   4448 C CE3  . TRP A 1 23 ? 10.268  -5.714  -3.221 1.00 0.49 ?  23 TRP A CE3  8  
ATOM   4449 C CZ2  . TRP A 1 23 ? 9.651   -8.163  -4.485 1.00 0.68 ?  23 TRP A CZ2  8  
ATOM   4450 C CZ3  . TRP A 1 23 ? 9.982   -5.775  -4.571 1.00 0.59 ?  23 TRP A CZ3  8  
ATOM   4451 C CH2  . TRP A 1 23 ? 9.678   -6.992  -5.191 1.00 0.68 ?  23 TRP A CH2  8  
ATOM   4452 H H    . TRP A 1 23 ? 9.045   -7.538  1.249  1.00 0.37 ?  23 TRP A H    8  
ATOM   4453 H HA   . TRP A 1 23 ? 10.030  -4.920  1.462  1.00 0.35 ?  23 TRP A HA   8  
ATOM   4454 H HB2  . TRP A 1 23 ? 11.464  -5.466  -0.448 1.00 0.42 ?  23 TRP A HB2  8  
ATOM   4455 H HB3  . TRP A 1 23 ? 11.443  -6.774  0.725  1.00 0.48 ?  23 TRP A HB3  8  
ATOM   4456 H HD1  . TRP A 1 23 ? 10.424  -9.092  -0.046 1.00 0.59 ?  23 TRP A HD1  8  
ATOM   4457 H HE1  . TRP A 1 23 ? 9.814   -10.049 -2.355 1.00 0.69 ?  23 TRP A HE1  8  
ATOM   4458 H HE3  . TRP A 1 23 ? 10.499  -4.764  -2.758 1.00 0.44 ?  23 TRP A HE3  8  
ATOM   4459 H HZ2  . TRP A 1 23 ? 9.414   -9.094  -4.977 1.00 0.76 ?  23 TRP A HZ2  8  
ATOM   4460 H HZ3  . TRP A 1 23 ? 9.991   -4.873  -5.162 1.00 0.61 ?  23 TRP A HZ3  8  
ATOM   4461 H HH2  . TRP A 1 23 ? 9.462   -6.993  -6.248 1.00 0.76 ?  23 TRP A HH2  8  
ATOM   4462 N N    . LYS A 1 24 ? 7.842   -5.401  -0.902 1.00 0.24 ?  24 LYS A N    8  
ATOM   4463 C CA   . LYS A 1 24 ? 6.996   -4.724  -1.872 1.00 0.22 ?  24 LYS A CA   8  
ATOM   4464 C C    . LYS A 1 24 ? 6.061   -3.774  -1.143 1.00 0.14 ?  24 LYS A C    8  
ATOM   4465 O O    . LYS A 1 24 ? 5.833   -2.650  -1.584 1.00 0.15 ?  24 LYS A O    8  
ATOM   4466 C CB   . LYS A 1 24 ? 6.193   -5.742  -2.686 1.00 0.26 ?  24 LYS A CB   8  
ATOM   4467 C CG   . LYS A 1 24 ? 5.348   -5.124  -3.792 1.00 0.35 ?  24 LYS A CG   8  
ATOM   4468 C CD   . LYS A 1 24 ? 6.207   -4.573  -4.919 1.00 0.97 ?  24 LYS A CD   8  
ATOM   4469 C CE   . LYS A 1 24 ? 5.352   -3.966  -6.021 1.00 0.98 ?  24 LYS A CE   8  
ATOM   4470 N NZ   . LYS A 1 24 ? 6.170   -3.511  -7.176 1.00 1.37 1  24 LYS A NZ   8  
ATOM   4471 H H    . LYS A 1 24 ? 7.658   -6.338  -0.676 1.00 0.26 ?  24 LYS A H    8  
ATOM   4472 H HA   . LYS A 1 24 ? 7.633   -4.157  -2.534 1.00 0.25 ?  24 LYS A HA   8  
ATOM   4473 H HB2  . LYS A 1 24 ? 6.879   -6.444  -3.138 1.00 0.33 ?  24 LYS A HB2  8  
ATOM   4474 H HB3  . LYS A 1 24 ? 5.534   -6.278  -2.019 1.00 0.24 ?  24 LYS A HB3  8  
ATOM   4475 H HG2  . LYS A 1 24 ? 4.689   -5.880  -4.195 1.00 0.83 ?  24 LYS A HG2  8  
ATOM   4476 H HG3  . LYS A 1 24 ? 4.763   -4.317  -3.373 1.00 0.96 ?  24 LYS A HG3  8  
ATOM   4477 H HD2  . LYS A 1 24 ? 6.860   -3.810  -4.523 1.00 1.51 ?  24 LYS A HD2  8  
ATOM   4478 H HD3  . LYS A 1 24 ? 6.798   -5.377  -5.334 1.00 1.43 ?  24 LYS A HD3  8  
ATOM   4479 H HE2  . LYS A 1 24 ? 4.646   -4.708  -6.362 1.00 1.17 ?  24 LYS A HE2  8  
ATOM   4480 H HE3  . LYS A 1 24 ? 4.816   -3.120  -5.617 1.00 1.36 ?  24 LYS A HE3  8  
ATOM   4481 H HZ1  . LYS A 1 24 ? 5.557   -3.101  -7.909 1.00 1.91 ?  24 LYS A HZ1  8  
ATOM   4482 H HZ2  . LYS A 1 24 ? 6.691   -4.309  -7.586 1.00 1.69 ?  24 LYS A HZ2  8  
ATOM   4483 H HZ3  . LYS A 1 24 ? 6.854   -2.788  -6.871 1.00 1.76 ?  24 LYS A HZ3  8  
ATOM   4484 N N    . GLN A 1 25 ? 5.536   -4.243  -0.017 1.00 0.11 ?  25 GLN A N    8  
ATOM   4485 C CA   . GLN A 1 25 ? 4.704   -3.418  0.848  1.00 0.09 ?  25 GLN A CA   8  
ATOM   4486 C C    . GLN A 1 25 ? 5.463   -2.172  1.288  1.00 0.09 ?  25 GLN A C    8  
ATOM   4487 O O    . GLN A 1 25 ? 4.995   -1.048  1.107  1.00 0.12 ?  25 GLN A O    8  
ATOM   4488 C CB   . GLN A 1 25 ? 4.276   -4.205  2.084  1.00 0.14 ?  25 GLN A CB   8  
ATOM   4489 C CG   . GLN A 1 25 ? 3.361   -5.379  1.791  1.00 0.16 ?  25 GLN A CG   8  
ATOM   4490 C CD   . GLN A 1 25 ? 2.999   -6.147  3.047  1.00 0.22 ?  25 GLN A CD   8  
ATOM   4491 O OE1  . GLN A 1 25 ? 2.958   -5.584  4.140  1.00 0.41 ?  25 GLN A OE1  8  
ATOM   4492 N NE2  . GLN A 1 25 ? 2.735   -7.432  2.901  1.00 0.24 ?  25 GLN A NE2  8  
ATOM   4493 H H    . GLN A 1 25 ? 5.710   -5.178  0.239  1.00 0.15 ?  25 GLN A H    8  
ATOM   4494 H HA   . GLN A 1 25 ? 3.827   -3.121  0.292  1.00 0.10 ?  25 GLN A HA   8  
ATOM   4495 H HB2  . GLN A 1 25 ? 5.158   -4.583  2.578  1.00 0.22 ?  25 GLN A HB2  8  
ATOM   4496 H HB3  . GLN A 1 25 ? 3.760   -3.537  2.756  1.00 0.18 ?  25 GLN A HB3  8  
ATOM   4497 H HG2  . GLN A 1 25 ? 2.453   -5.006  1.340  1.00 0.18 ?  25 GLN A HG2  8  
ATOM   4498 H HG3  . GLN A 1 25 ? 3.858   -6.047  1.106  1.00 0.21 ?  25 GLN A HG3  8  
ATOM   4499 H HE21 . GLN A 1 25 ? 2.786   -7.820  1.995  1.00 0.33 ?  25 GLN A HE21 8  
ATOM   4500 H HE22 . GLN A 1 25 ? 2.501   -7.950  3.700  1.00 0.27 ?  25 GLN A HE22 8  
ATOM   4501 N N    . GLN A 1 26 ? 6.641   -2.387  1.858  1.00 0.14 ?  26 GLN A N    8  
ATOM   4502 C CA   . GLN A 1 26 ? 7.467   -1.296  2.353  1.00 0.18 ?  26 GLN A CA   8  
ATOM   4503 C C    . GLN A 1 26 ? 7.882   -0.360  1.225  1.00 0.18 ?  26 GLN A C    8  
ATOM   4504 O O    . GLN A 1 26 ? 7.903   0.854   1.402  1.00 0.25 ?  26 GLN A O    8  
ATOM   4505 C CB   . GLN A 1 26 ? 8.700   -1.845  3.067  1.00 0.28 ?  26 GLN A CB   8  
ATOM   4506 C CG   . GLN A 1 26 ? 8.377   -2.547  4.378  1.00 0.38 ?  26 GLN A CG   8  
ATOM   4507 C CD   . GLN A 1 26 ? 9.607   -3.103  5.063  1.00 0.90 ?  26 GLN A CD   8  
ATOM   4508 O OE1  . GLN A 1 26 ? 10.713  -2.587  4.900  1.00 1.46 ?  26 GLN A OE1  8  
ATOM   4509 N NE2  . GLN A 1 26 ? 9.421   -4.152  5.845  1.00 1.59 ?  26 GLN A NE2  8  
ATOM   4510 H H    . GLN A 1 26 ? 6.961   -3.310  1.953  1.00 0.18 ?  26 GLN A H    8  
ATOM   4511 H HA   . GLN A 1 26 ? 6.877   -0.736  3.060  1.00 0.21 ?  26 GLN A HA   8  
ATOM   4512 H HB2  . GLN A 1 26 ? 9.196   -2.549  2.417  1.00 0.31 ?  26 GLN A HB2  8  
ATOM   4513 H HB3  . GLN A 1 26 ? 9.372   -1.027  3.278  1.00 0.31 ?  26 GLN A HB3  8  
ATOM   4514 H HG2  . GLN A 1 26 ? 7.904   -1.841  5.042  1.00 0.76 ?  26 GLN A HG2  8  
ATOM   4515 H HG3  . GLN A 1 26 ? 7.696   -3.361  4.176  1.00 0.60 ?  26 GLN A HG3  8  
ATOM   4516 H HE21 . GLN A 1 26 ? 8.508   -4.506  5.937  1.00 1.96 ?  26 GLN A HE21 8  
ATOM   4517 H HE22 . GLN A 1 26 ? 10.198  -4.525  6.315  1.00 1.99 ?  26 GLN A HE22 8  
ATOM   4518 N N    . ASN A 1 27 ? 8.194   -0.931  0.070  1.00 0.19 ?  27 ASN A N    8  
ATOM   4519 C CA   . ASN A 1 27 ? 8.586   -0.148  -1.098 1.00 0.26 ?  27 ASN A CA   8  
ATOM   4520 C C    . ASN A 1 27 ? 7.438   0.749   -1.562 1.00 0.22 ?  27 ASN A C    8  
ATOM   4521 O O    . ASN A 1 27 ? 7.627   1.940   -1.820 1.00 0.25 ?  27 ASN A O    8  
ATOM   4522 C CB   . ASN A 1 27 ? 9.021   -1.087  -2.228 1.00 0.38 ?  27 ASN A CB   8  
ATOM   4523 C CG   . ASN A 1 27 ? 9.518   -0.355  -3.459 1.00 0.98 ?  27 ASN A CG   8  
ATOM   4524 O OD1  . ASN A 1 27 ? 10.063  0.745   -3.372 1.00 1.81 ?  27 ASN A OD1  8  
ATOM   4525 N ND2  . ASN A 1 27 ? 9.349   -0.973  -4.617 1.00 1.18 ?  27 ASN A ND2  8  
ATOM   4526 H H    . ASN A 1 27 ? 8.175   -1.912  0.001  1.00 0.20 ?  27 ASN A H    8  
ATOM   4527 H HA   . ASN A 1 27 ? 9.421   0.473   -0.816 1.00 0.34 ?  27 ASN A HA   8  
ATOM   4528 H HB2  . ASN A 1 27 ? 9.816   -1.721  -1.869 1.00 0.77 ?  27 ASN A HB2  8  
ATOM   4529 H HB3  . ASN A 1 27 ? 8.180   -1.702  -2.511 1.00 0.92 ?  27 ASN A HB3  8  
ATOM   4530 H HD21 . ASN A 1 27 ? 8.920   -1.853  -4.616 1.00 1.16 ?  27 ASN A HD21 8  
ATOM   4531 H HD22 . ASN A 1 27 ? 9.658   -0.522  -5.432 1.00 1.75 ?  27 ASN A HD22 8  
ATOM   4532 N N    . LEU A 1 28 ? 6.244   0.176   -1.641 1.00 0.19 ?  28 LEU A N    8  
ATOM   4533 C CA   . LEU A 1 28 ? 5.062   0.919   -2.058 1.00 0.24 ?  28 LEU A CA   8  
ATOM   4534 C C    . LEU A 1 28 ? 4.694   1.984   -1.035 1.00 0.24 ?  28 LEU A C    8  
ATOM   4535 O O    . LEU A 1 28 ? 4.319   3.100   -1.394 1.00 0.29 ?  28 LEU A O    8  
ATOM   4536 C CB   . LEU A 1 28 ? 3.887   -0.034  -2.264 1.00 0.28 ?  28 LEU A CB   8  
ATOM   4537 C CG   . LEU A 1 28 ? 3.968   -0.914  -3.509 1.00 0.38 ?  28 LEU A CG   8  
ATOM   4538 C CD1  . LEU A 1 28 ? 2.837   -1.926  -3.519 1.00 0.88 ?  28 LEU A CD1  8  
ATOM   4539 C CD2  . LEU A 1 28 ? 3.918   -0.060  -4.764 1.00 0.72 ?  28 LEU A CD2  8  
ATOM   4540 H H    . LEU A 1 28 ? 6.153   -0.776  -1.413 1.00 0.18 ?  28 LEU A H    8  
ATOM   4541 H HA   . LEU A 1 28 ? 5.290   1.403   -2.994 1.00 0.30 ?  28 LEU A HA   8  
ATOM   4542 H HB2  . LEU A 1 28 ? 3.824   -0.677  -1.401 1.00 0.28 ?  28 LEU A HB2  8  
ATOM   4543 H HB3  . LEU A 1 28 ? 2.984   0.550   -2.321 1.00 0.33 ?  28 LEU A HB3  8  
ATOM   4544 H HG   . LEU A 1 28 ? 4.902   -1.453  -3.504 1.00 0.78 ?  28 LEU A HG   8  
ATOM   4545 H HD11 . LEU A 1 28 ? 1.889   -1.407  -3.501 1.00 1.30 ?  28 LEU A HD11 8  
ATOM   4546 H HD12 . LEU A 1 28 ? 2.916   -2.563  -2.649 1.00 1.54 ?  28 LEU A HD12 8  
ATOM   4547 H HD13 . LEU A 1 28 ? 2.901   -2.528  -4.413 1.00 1.23 ?  28 LEU A HD13 8  
ATOM   4548 H HD21 . LEU A 1 28 ? 4.776   0.593   -4.791 1.00 1.32 ?  28 LEU A HD21 8  
ATOM   4549 H HD22 . LEU A 1 28 ? 3.014   0.530   -4.759 1.00 1.40 ?  28 LEU A HD22 8  
ATOM   4550 H HD23 . LEU A 1 28 ? 3.926   -0.701  -5.633 1.00 1.20 ?  28 LEU A HD23 8  
ATOM   4551 N N    . LYS A 1 29 ? 4.800   1.636   0.239  1.00 0.24 ?  29 LYS A N    8  
ATOM   4552 C CA   . LYS A 1 29 ? 4.521   2.580   1.312  1.00 0.32 ?  29 LYS A CA   8  
ATOM   4553 C C    . LYS A 1 29 ? 5.563   3.695   1.315  1.00 0.34 ?  29 LYS A C    8  
ATOM   4554 O O    . LYS A 1 29 ? 5.259   4.850   1.629  1.00 0.40 ?  29 LYS A O    8  
ATOM   4555 C CB   . LYS A 1 29 ? 4.506   1.857   2.662  1.00 0.42 ?  29 LYS A CB   8  
ATOM   4556 C CG   . LYS A 1 29 ? 4.134   2.750   3.837  1.00 0.71 ?  29 LYS A CG   8  
ATOM   4557 C CD   . LYS A 1 29 ? 2.688   3.223   3.762  1.00 1.19 ?  29 LYS A CD   8  
ATOM   4558 C CE   . LYS A 1 29 ? 1.696   2.107   4.079  1.00 1.23 ?  29 LYS A CE   8  
ATOM   4559 N NZ   . LYS A 1 29 ? 1.851   1.604   5.469  1.00 1.39 1  29 LYS A NZ   8  
ATOM   4560 H H    . LYS A 1 29 ? 5.063   0.715   0.463  1.00 0.22 ?  29 LYS A H    8  
ATOM   4561 H HA   . LYS A 1 29 ? 3.550   3.009   1.129  1.00 0.36 ?  29 LYS A HA   8  
ATOM   4562 H HB2  . LYS A 1 29 ? 3.790   1.051   2.613  1.00 0.78 ?  29 LYS A HB2  8  
ATOM   4563 H HB3  . LYS A 1 29 ? 5.488   1.445   2.846  1.00 0.60 ?  29 LYS A HB3  8  
ATOM   4564 H HG2  . LYS A 1 29 ? 4.271   2.195   4.750  1.00 1.23 ?  29 LYS A HG2  8  
ATOM   4565 H HG3  . LYS A 1 29 ? 4.786   3.612   3.838  1.00 1.29 ?  29 LYS A HG3  8  
ATOM   4566 H HD2  . LYS A 1 29 ? 2.549   4.023   4.471  1.00 1.64 ?  29 LYS A HD2  8  
ATOM   4567 H HD3  . LYS A 1 29 ? 2.494   3.590   2.766  1.00 1.75 ?  29 LYS A HD3  8  
ATOM   4568 H HE2  . LYS A 1 29 ? 0.695   2.492   3.958  1.00 1.53 ?  29 LYS A HE2  8  
ATOM   4569 H HE3  . LYS A 1 29 ? 1.853   1.292   3.390  1.00 1.48 ?  29 LYS A HE3  8  
ATOM   4570 H HZ1  . LYS A 1 29 ? 1.806   2.396   6.143  1.00 2.04 ?  29 LYS A HZ1  8  
ATOM   4571 H HZ2  . LYS A 1 29 ? 2.767   1.123   5.578  1.00 1.56 ?  29 LYS A HZ2  8  
ATOM   4572 H HZ3  . LYS A 1 29 ? 1.092   0.931   5.695  1.00 1.51 ?  29 LYS A HZ3  8  
ATOM   4573 N N    . LYS A 1 30 ? 6.788   3.336   0.951  1.00 0.34 ?  30 LYS A N    8  
ATOM   4574 C CA   . LYS A 1 30 ? 7.875   4.293   0.833  1.00 0.43 ?  30 LYS A CA   8  
ATOM   4575 C C    . LYS A 1 30 ? 7.572   5.293   -0.273 1.00 0.42 ?  30 LYS A C    8  
ATOM   4576 O O    . LYS A 1 30 ? 7.767   6.503   -0.109 1.00 0.47 ?  30 LYS A O    8  
ATOM   4577 C CB   . LYS A 1 30 ? 9.189   3.564   0.534  1.00 0.54 ?  30 LYS A CB   8  
ATOM   4578 C CG   . LYS A 1 30 ? 10.391  4.485   0.416  1.00 1.28 ?  30 LYS A CG   8  
ATOM   4579 C CD   . LYS A 1 30 ? 11.640  3.718   0.010  1.00 1.67 ?  30 LYS A CD   8  
ATOM   4580 C CE   . LYS A 1 30 ? 12.854  4.631   -0.088 1.00 2.49 ?  30 LYS A CE   8  
ATOM   4581 N NZ   . LYS A 1 30 ? 14.074  3.896   -0.510 1.00 3.14 1  30 LYS A NZ   8  
ATOM   4582 H H    . LYS A 1 30 ? 6.969   2.389   0.761  1.00 0.33 ?  30 LYS A H    8  
ATOM   4583 H HA   . LYS A 1 30 ? 7.961   4.814   1.768  1.00 0.48 ?  30 LYS A HA   8  
ATOM   4584 H HB2  . LYS A 1 30 ? 9.383   2.858   1.328  1.00 0.89 ?  30 LYS A HB2  8  
ATOM   4585 H HB3  . LYS A 1 30 ? 9.084   3.025   -0.395 1.00 1.06 ?  30 LYS A HB3  8  
ATOM   4586 H HG2  . LYS A 1 30 ? 10.183  5.237   -0.331 1.00 1.89 ?  30 LYS A HG2  8  
ATOM   4587 H HG3  . LYS A 1 30 ? 10.563  4.960   1.370  1.00 1.85 ?  30 LYS A HG3  8  
ATOM   4588 H HD2  . LYS A 1 30 ? 11.837  2.953   0.748  1.00 2.02 ?  30 LYS A HD2  8  
ATOM   4589 H HD3  . LYS A 1 30 ? 11.470  3.255   -0.952 1.00 1.96 ?  30 LYS A HD3  8  
ATOM   4590 H HE2  . LYS A 1 30 ? 12.647  5.409   -0.809 1.00 2.89 ?  30 LYS A HE2  8  
ATOM   4591 H HE3  . LYS A 1 30 ? 13.031  5.079   0.880  1.00 2.91 ?  30 LYS A HE3  8  
ATOM   4592 H HZ1  . LYS A 1 30 ? 14.887  4.546   -0.554 1.00 3.57 ?  30 LYS A HZ1  8  
ATOM   4593 H HZ2  . LYS A 1 30 ? 13.933  3.479   -1.449 1.00 3.62 ?  30 LYS A HZ2  8  
ATOM   4594 H HZ3  . LYS A 1 30 ? 14.288  3.137   0.166  1.00 3.29 ?  30 LYS A HZ3  8  
ATOM   4595 N N    . GLU A 1 31 ? 7.090   4.764   -1.395 1.00 0.42 ?  31 GLU A N    8  
ATOM   4596 C CA   . GLU A 1 31 ? 6.682   5.578   -2.533 1.00 0.49 ?  31 GLU A CA   8  
ATOM   4597 C C    . GLU A 1 31 ? 5.484   6.450   -2.160 1.00 0.52 ?  31 GLU A C    8  
ATOM   4598 O O    . GLU A 1 31 ? 5.365   7.594   -2.605 1.00 0.70 ?  31 GLU A O    8  
ATOM   4599 C CB   . GLU A 1 31 ? 6.322   4.668   -3.712 1.00 0.52 ?  31 GLU A CB   8  
ATOM   4600 C CG   . GLU A 1 31 ? 6.060   5.407   -5.014 1.00 0.87 ?  31 GLU A CG   8  
ATOM   4601 C CD   . GLU A 1 31 ? 7.312   6.032   -5.590 1.00 1.47 ?  31 GLU A CD   8  
ATOM   4602 O OE1  . GLU A 1 31 ? 7.990   5.373   -6.401 1.00 1.67 ?  31 GLU A OE1  8  
ATOM   4603 O OE2  . GLU A 1 31 ? 7.626   7.188   -5.240 1.00 2.30 -1 31 GLU A OE2  8  
ATOM   4604 H H    . GLU A 1 31 ? 7.018   3.784   -1.463 1.00 0.41 ?  31 GLU A H    8  
ATOM   4605 H HA   . GLU A 1 31 ? 7.509   6.212   -2.809 1.00 0.57 ?  31 GLU A HA   8  
ATOM   4606 H HB2  . GLU A 1 31 ? 7.135   3.978   -3.877 1.00 0.87 ?  31 GLU A HB2  8  
ATOM   4607 H HB3  . GLU A 1 31 ? 5.434   4.107   -3.458 1.00 0.80 ?  31 GLU A HB3  8  
ATOM   4608 H HG2  . GLU A 1 31 ? 5.659   4.712   -5.734 1.00 1.45 ?  31 GLU A HG2  8  
ATOM   4609 H HG3  . GLU A 1 31 ? 5.337   6.187   -4.832 1.00 1.49 ?  31 GLU A HG3  8  
ATOM   4610 N N    . LYS A 1 32 ? 4.602   5.890   -1.340 1.00 0.43 ?  32 LYS A N    8  
ATOM   4611 C CA   . LYS A 1 32 ? 3.404   6.584   -0.891 1.00 0.55 ?  32 LYS A CA   8  
ATOM   4612 C C    . LYS A 1 32 ? 3.772   7.817   -0.069 1.00 0.66 ?  32 LYS A C    8  
ATOM   4613 O O    . LYS A 1 32 ? 3.531   8.949   -0.491 1.00 1.23 ?  32 LYS A O    8  
ATOM   4614 C CB   . LYS A 1 32 ? 2.529   5.626   -0.065 1.00 0.74 ?  32 LYS A CB   8  
ATOM   4615 C CG   . LYS A 1 32 ? 1.118   6.130   0.230  1.00 1.46 ?  32 LYS A CG   8  
ATOM   4616 C CD   . LYS A 1 32 ? 1.091   7.228   1.283  1.00 2.20 ?  32 LYS A CD   8  
ATOM   4617 C CE   . LYS A 1 32 ? -0.329  7.668   1.596  1.00 3.14 ?  32 LYS A CE   8  
ATOM   4618 N NZ   . LYS A 1 32 ? -0.359  8.834   2.516  1.00 3.91 1  32 LYS A NZ   8  
ATOM   4619 H H    . LYS A 1 32 ? 4.758   4.969   -1.035 1.00 0.38 ?  32 LYS A H    8  
ATOM   4620 H HA   . LYS A 1 32 ? 2.854   6.897   -1.765 1.00 0.79 ?  32 LYS A HA   8  
ATOM   4621 H HB2  . LYS A 1 32 ? 2.442   4.694   -0.602 1.00 1.02 ?  32 LYS A HB2  8  
ATOM   4622 H HB3  . LYS A 1 32 ? 3.021   5.439   0.878  1.00 1.25 ?  32 LYS A HB3  8  
ATOM   4623 H HG2  . LYS A 1 32 ? 0.693   6.517   -0.683 1.00 2.11 ?  32 LYS A HG2  8  
ATOM   4624 H HG3  . LYS A 1 32 ? 0.522   5.299   0.578  1.00 1.77 ?  32 LYS A HG3  8  
ATOM   4625 H HD2  . LYS A 1 32 ? 1.549   6.858   2.188  1.00 2.36 ?  32 LYS A HD2  8  
ATOM   4626 H HD3  . LYS A 1 32 ? 1.650   8.078   0.917  1.00 2.67 ?  32 LYS A HD3  8  
ATOM   4627 H HE2  . LYS A 1 32 ? -0.820  7.937   0.674  1.00 3.54 ?  32 LYS A HE2  8  
ATOM   4628 H HE3  . LYS A 1 32 ? -0.853  6.843   2.055  1.00 3.37 ?  32 LYS A HE3  8  
ATOM   4629 H HZ1  . LYS A 1 32 ? 0.069   9.665   2.059  1.00 3.96 ?  32 LYS A HZ1  8  
ATOM   4630 H HZ2  . LYS A 1 32 ? 0.170   8.621   3.385  1.00 4.35 ?  32 LYS A HZ2  8  
ATOM   4631 H HZ3  . LYS A 1 32 ? -1.341  9.062   2.772  1.00 4.36 ?  32 LYS A HZ3  8  
ATOM   4632 N N    . GLY A 1 33 ? 4.360   7.593   1.100  1.00 0.94 ?  33 GLY A N    8  
ATOM   4633 C CA   . GLY A 1 33 ? 4.630   8.693   2.000  1.00 1.34 ?  33 GLY A CA   8  
ATOM   4634 C C    . GLY A 1 33 ? 5.735   8.397   2.991  1.00 1.43 ?  33 GLY A C    8  
ATOM   4635 O O    . GLY A 1 33 ? 5.501   8.342   4.199  1.00 1.99 ?  33 GLY A O    8  
ATOM   4636 H H    . GLY A 1 33 ? 4.619   6.678   1.348  1.00 1.26 ?  33 GLY A H    8  
ATOM   4637 H HA2  . GLY A 1 33 ? 4.910   9.555   1.418  1.00 1.68 ?  33 GLY A HA2  8  
ATOM   4638 H HA3  . GLY A 1 33 ? 3.728   8.922   2.545  1.00 1.72 ?  33 GLY A HA3  8  
ATOM   4639 N N    . LEU A 1 34 ? 6.935   8.192   2.481  1.00 1.27 ?  34 LEU A N    8  
ATOM   4640 C CA   . LEU A 1 34 ? 8.110   8.053   3.325  1.00 1.73 ?  34 LEU A CA   8  
ATOM   4641 C C    . LEU A 1 34 ? 9.296   8.710   2.641  1.00 1.86 ?  34 LEU A C    8  
ATOM   4642 O O    . LEU A 1 34 ? 9.962   9.569   3.214  1.00 2.56 ?  34 LEU A O    8  
ATOM   4643 C CB   . LEU A 1 34 ? 8.409   6.581   3.597  1.00 1.91 ?  34 LEU A CB   8  
ATOM   4644 C CG   . LEU A 1 34 ? 9.479   6.314   4.658  1.00 2.29 ?  34 LEU A CG   8  
ATOM   4645 C CD1  . LEU A 1 34 ? 9.043   6.854   6.013  1.00 2.76 ?  34 LEU A CD1  8  
ATOM   4646 C CD2  . LEU A 1 34 ? 9.771   4.826   4.745  1.00 3.08 ?  34 LEU A CD2  8  
ATOM   4647 H H    . LEU A 1 34 ? 7.034   8.124   1.510  1.00 1.11 ?  34 LEU A H    8  
ATOM   4648 H HA   . LEU A 1 34 ? 7.915   8.560   4.256  1.00 2.15 ?  34 LEU A HA   8  
ATOM   4649 H HB2  . LEU A 1 34 ? 7.494   6.098   3.903  1.00 2.24 ?  34 LEU A HB2  8  
ATOM   4650 H HB3  . LEU A 1 34 ? 8.740   6.137   2.674  1.00 2.03 ?  34 LEU A HB3  8  
ATOM   4651 H HG   . LEU A 1 34 ? 10.392  6.819   4.376  1.00 2.45 ?  34 LEU A HG   8  
ATOM   4652 H HD11 . LEU A 1 34 ? 9.777   6.589   6.758  1.00 3.05 ?  34 LEU A HD11 8  
ATOM   4653 H HD12 . LEU A 1 34 ? 8.088   6.428   6.279  1.00 3.27 ?  34 LEU A HD12 8  
ATOM   4654 H HD13 . LEU A 1 34 ? 8.956   7.929   5.960  1.00 2.92 ?  34 LEU A HD13 8  
ATOM   4655 H HD21 . LEU A 1 34 ? 10.550  4.654   5.471  1.00 3.53 ?  34 LEU A HD21 8  
ATOM   4656 H HD22 . LEU A 1 34 ? 10.092  4.466   3.778  1.00 3.41 ?  34 LEU A HD22 8  
ATOM   4657 H HD23 . LEU A 1 34 ? 8.876   4.300   5.045  1.00 3.42 ?  34 LEU A HD23 8  
ATOM   4658 N N    . PHE A 1 35 ? 9.538   8.303   1.403  1.00 1.42 ?  35 PHE A N    8  
ATOM   4659 C CA   . PHE A 1 35 ? 10.579  8.898   0.584  1.00 1.78 ?  35 PHE A CA   8  
ATOM   4660 C C    . PHE A 1 35 ? 10.072  9.058   -0.839 1.00 2.17 ?  35 PHE A C    8  
ATOM   4661 O O    . PHE A 1 35 ? 10.407  8.275   -1.727 1.00 2.84 ?  35 PHE A O    8  
ATOM   4662 C CB   . PHE A 1 35 ? 11.853  8.044   0.596  1.00 1.55 ?  35 PHE A CB   8  
ATOM   4663 C CG   . PHE A 1 35 ? 12.584  8.045   1.912  1.00 1.48 ?  35 PHE A CG   8  
ATOM   4664 C CD1  . PHE A 1 35 ? 12.475  6.976   2.788  1.00 1.95 ?  35 PHE A CD1  8  
ATOM   4665 C CD2  . PHE A 1 35 ? 13.386  9.117   2.269  1.00 1.61 ?  35 PHE A CD2  8  
ATOM   4666 C CE1  . PHE A 1 35 ? 13.148  6.978   3.993  1.00 2.46 ?  35 PHE A CE1  8  
ATOM   4667 C CE2  . PHE A 1 35 ? 14.062  9.124   3.474  1.00 1.99 ?  35 PHE A CE2  8  
ATOM   4668 C CZ   . PHE A 1 35 ? 13.943  8.054   4.337  1.00 2.41 ?  35 PHE A CZ   8  
ATOM   4669 H H    . PHE A 1 35 ? 8.991   7.581   1.021  1.00 1.04 ?  35 PHE A H    8  
ATOM   4670 H HA   . PHE A 1 35 ? 10.803  9.874   0.987  1.00 2.31 ?  35 PHE A HA   8  
ATOM   4671 H HB2  . PHE A 1 35 ? 11.591  7.022   0.367  1.00 1.53 ?  35 PHE A HB2  8  
ATOM   4672 H HB3  . PHE A 1 35 ? 12.528  8.412   -0.161 1.00 1.88 ?  35 PHE A HB3  8  
ATOM   4673 H HD1  . PHE A 1 35 ? 11.854  6.135   2.521  1.00 2.21 ?  35 PHE A HD1  8  
ATOM   4674 H HD2  . PHE A 1 35 ? 13.481  9.954   1.595  1.00 1.82 ?  35 PHE A HD2  8  
ATOM   4675 H HE1  . PHE A 1 35 ? 13.053  6.139   4.667  1.00 3.08 ?  35 PHE A HE1  8  
ATOM   4676 H HE2  . PHE A 1 35 ? 14.683  9.967   3.740  1.00 2.26 ?  35 PHE A HE2  8  
ATOM   4677 H HZ   . PHE A 1 35 ? 14.471  8.057   5.279  1.00 2.93 ?  35 PHE A HZ   8  
HETATM 4678 N N    . NH2 A 1 36 ? 9.235   10.056  -1.045 1.00 2.32 ?  36 NH2 A N    8  
HETATM 4679 H HN1  . NH2 A 1 36 ? 9.014   10.641  -0.287 1.00 2.41 ?  36 NH2 A HN1  8  
HETATM 4680 H HN2  . NH2 A 1 36 ? 8.864   10.171  -1.945 1.00 2.69 ?  36 NH2 A HN2  8  
ATOM   4681 N N    . LEU A 1 1  ? -6.323  4.177   7.390  1.00 1.11 ?  1  LEU A N    9  
ATOM   4682 C CA   . LEU A 1 1  ? -6.632  4.179   5.942  1.00 0.77 ?  1  LEU A CA   9  
ATOM   4683 C C    . LEU A 1 1  ? -7.855  3.315   5.655  1.00 0.62 ?  1  LEU A C    9  
ATOM   4684 O O    . LEU A 1 1  ? -7.799  2.092   5.766  1.00 0.66 ?  1  LEU A O    9  
ATOM   4685 C CB   . LEU A 1 1  ? -5.437  3.650   5.132  1.00 0.91 ?  1  LEU A CB   9  
ATOM   4686 C CG   . LEU A 1 1  ? -4.344  4.665   4.755  1.00 1.01 ?  1  LEU A CG   9  
ATOM   4687 C CD1  . LEU A 1 1  ? -4.899  5.733   3.833  1.00 1.23 ?  1  LEU A CD1  9  
ATOM   4688 C CD2  . LEU A 1 1  ? -3.718  5.299   5.986  1.00 1.78 ?  1  LEU A CD2  9  
ATOM   4689 H H1   . LEU A 1 1  ? -5.516  4.798   7.588  1.00 1.40 ?  1  LEU A H1   9  
ATOM   4690 H H2   . LEU A 1 1  ? -6.089  3.215   7.702  1.00 1.62 ?  1  LEU A H2   9  
ATOM   4691 H H3   . LEU A 1 1  ? -7.146  4.514   7.931  1.00 1.61 ?  1  LEU A H3   9  
ATOM   4692 H HA   . LEU A 1 1  ? -6.843  5.192   5.640  1.00 0.75 ?  1  LEU A HA   9  
ATOM   4693 H HB2  . LEU A 1 1  ? -4.972  2.864   5.703  1.00 1.23 ?  1  LEU A HB2  9  
ATOM   4694 H HB3  . LEU A 1 1  ? -5.823  3.224   4.218  1.00 1.43 ?  1  LEU A HB3  9  
ATOM   4695 H HG   . LEU A 1 1  ? -3.562  4.146   4.217  1.00 1.75 ?  1  LEU A HG   9  
ATOM   4696 H HD11 . LEU A 1 1  ? -5.345  5.264   2.967  1.00 1.48 ?  1  LEU A HD11 9  
ATOM   4697 H HD12 . LEU A 1 1  ? -4.099  6.384   3.515  1.00 1.80 ?  1  LEU A HD12 9  
ATOM   4698 H HD13 . LEU A 1 1  ? -5.646  6.309   4.356  1.00 1.91 ?  1  LEU A HD13 9  
ATOM   4699 H HD21 . LEU A 1 1  ? -2.959  6.004   5.681  1.00 2.17 ?  1  LEU A HD21 9  
ATOM   4700 H HD22 . LEU A 1 1  ? -3.270  4.531   6.598  1.00 2.45 ?  1  LEU A HD22 9  
ATOM   4701 H HD23 . LEU A 1 1  ? -4.479  5.814   6.553  1.00 2.19 ?  1  LEU A HD23 9  
ATOM   4702 N N    . SER A 1 2  ? -8.958  3.953   5.292  1.00 0.58 ?  2  SER A N    9  
ATOM   4703 C CA   . SER A 1 2  ? -10.166 3.232   4.920  1.00 0.59 ?  2  SER A CA   9  
ATOM   4704 C C    . SER A 1 2  ? -9.936  2.532   3.585  1.00 0.53 ?  2  SER A C    9  
ATOM   4705 O O    . SER A 1 2  ? -9.338  3.111   2.690  1.00 0.45 ?  2  SER A O    9  
ATOM   4706 C CB   . SER A 1 2  ? -11.338 4.205   4.827  1.00 0.72 ?  2  SER A CB   9  
ATOM   4707 O OG   . SER A 1 2  ? -11.418 5.002   5.996  1.00 1.28 ?  2  SER A OG   9  
ATOM   4708 H H    . SER A 1 2  ? -8.957  4.937   5.262  1.00 0.63 ?  2  SER A H    9  
ATOM   4709 H HA   . SER A 1 2  ? -10.368 2.494   5.681  1.00 0.67 ?  2  SER A HA   9  
ATOM   4710 H HB2  . SER A 1 2  ? -11.204 4.851   3.969  1.00 1.39 ?  2  SER A HB2  9  
ATOM   4711 H HB3  . SER A 1 2  ? -12.256 3.649   4.721  1.00 1.05 ?  2  SER A HB3  9  
ATOM   4712 H HG   . SER A 1 2  ? -10.705 4.749   6.598  1.00 1.66 ?  2  SER A HG   9  
ATOM   4713 N N    . ASP A 1 3  ? -10.416 1.292   3.468  1.00 0.61 ?  3  ASP A N    9  
ATOM   4714 C CA   . ASP A 1 3  ? -10.010 0.379   2.387  1.00 0.60 ?  3  ASP A CA   9  
ATOM   4715 C C    . ASP A 1 3  ? -10.164 0.990   0.995  1.00 0.49 ?  3  ASP A C    9  
ATOM   4716 O O    . ASP A 1 3  ? -9.374  0.690   0.101  1.00 0.40 ?  3  ASP A O    9  
ATOM   4717 C CB   . ASP A 1 3  ? -10.788 -0.944  2.460  1.00 0.76 ?  3  ASP A CB   9  
ATOM   4718 C CG   . ASP A 1 3  ? -12.224 -0.836  1.986  1.00 1.42 ?  3  ASP A CG   9  
ATOM   4719 O OD1  . ASP A 1 3  ? -13.052 -0.256  2.720  1.00 1.93 ?  3  ASP A OD1  9  
ATOM   4720 O OD2  . ASP A 1 3  ? -12.531 -1.320  0.876  1.00 2.11 -1 3  ASP A OD2  9  
ATOM   4721 H H    . ASP A 1 3  ? -11.070 0.977   4.128  1.00 0.71 ?  3  ASP A H    9  
ATOM   4722 H HA   . ASP A 1 3  ? -8.962  0.162   2.537  1.00 0.62 ?  3  ASP A HA   9  
ATOM   4723 H HB2  . ASP A 1 3  ? -10.289 -1.672  1.842  1.00 1.30 ?  3  ASP A HB2  9  
ATOM   4724 H HB3  . ASP A 1 3  ? -10.794 -1.296  3.482  1.00 1.20 ?  3  ASP A HB3  9  
ATOM   4725 N N    . GLU A 1 4  ? -11.164 1.839   0.813  1.00 0.58 ?  4  GLU A N    9  
ATOM   4726 C CA   . GLU A 1 4  ? -11.382 2.496   -0.470 1.00 0.58 ?  4  GLU A CA   9  
ATOM   4727 C C    . GLU A 1 4  ? -10.292 3.534   -0.721 1.00 0.43 ?  4  GLU A C    9  
ATOM   4728 O O    . GLU A 1 4  ? -9.737  3.626   -1.818 1.00 0.38 ?  4  GLU A O    9  
ATOM   4729 C CB   . GLU A 1 4  ? -12.755 3.163   -0.495 1.00 0.80 ?  4  GLU A CB   9  
ATOM   4730 C CG   . GLU A 1 4  ? -13.131 3.735   -1.853 1.00 1.35 ?  4  GLU A CG   9  
ATOM   4731 C CD   . GLU A 1 4  ? -13.437 2.663   -2.881 1.00 1.81 ?  4  GLU A CD   9  
ATOM   4732 O OE1  . GLU A 1 4  ? -14.617 2.293   -3.039 1.00 2.46 ?  4  GLU A OE1  9  
ATOM   4733 O OE2  . GLU A 1 4  ? -12.489 2.173   -3.528 1.00 2.08 -1 4  GLU A OE2  9  
ATOM   4734 H H    . GLU A 1 4  ? -11.774 2.027   1.559  1.00 0.68 ?  4  GLU A H    9  
ATOM   4735 H HA   . GLU A 1 4  ? -11.337 1.746   -1.245 1.00 0.59 ?  4  GLU A HA   9  
ATOM   4736 H HB2  . GLU A 1 4  ? -13.500 2.432   -0.217 1.00 1.07 ?  4  GLU A HB2  9  
ATOM   4737 H HB3  . GLU A 1 4  ? -12.766 3.967   0.227  1.00 1.03 ?  4  GLU A HB3  9  
ATOM   4738 H HG2  . GLU A 1 4  ? -14.003 4.360   -1.736 1.00 1.90 ?  4  GLU A HG2  9  
ATOM   4739 H HG3  . GLU A 1 4  ? -12.307 4.333   -2.214 1.00 1.77 ?  4  GLU A HG3  9  
ATOM   4740 N N    . ASP A 1 5  ? -9.966  4.288   0.317  1.00 0.44 ?  5  ASP A N    9  
ATOM   4741 C CA   . ASP A 1 5  ? -8.953  5.332   0.219  1.00 0.40 ?  5  ASP A CA   9  
ATOM   4742 C C    . ASP A 1 5  ? -7.581  4.692   0.083  1.00 0.28 ?  5  ASP A C    9  
ATOM   4743 O O    . ASP A 1 5  ? -6.728  5.158   -0.670 1.00 0.29 ?  5  ASP A O    9  
ATOM   4744 C CB   . ASP A 1 5  ? -9.000  6.232   1.457  1.00 0.52 ?  5  ASP A CB   9  
ATOM   4745 C CG   . ASP A 1 5  ? -8.068  7.423   1.354  1.00 1.11 ?  5  ASP A CG   9  
ATOM   4746 O OD1  . ASP A 1 5  ? -8.331  8.319   0.523  1.00 1.17 ?  5  ASP A OD1  9  
ATOM   4747 O OD2  . ASP A 1 5  ? -7.084  7.484   2.117  1.00 1.82 -1 5  ASP A OD2  9  
ATOM   4748 H H    . ASP A 1 5  ? -10.398 4.121   1.186  1.00 0.51 ?  5  ASP A H    9  
ATOM   4749 H HA   . ASP A 1 5  ? -9.162  5.920   -0.661 1.00 0.43 ?  5  ASP A HA   9  
ATOM   4750 H HB2  . ASP A 1 5  ? -10.005 6.599   1.590  1.00 1.00 ?  5  ASP A HB2  9  
ATOM   4751 H HB3  . ASP A 1 5  ? -8.718  5.651   2.323  1.00 0.82 ?  5  ASP A HB3  9  
ATOM   4752 N N    . PHE A 1 6  ? -7.403  3.595   0.806  1.00 0.24 ?  6  PHE A N    9  
ATOM   4753 C CA   . PHE A 1 6  ? -6.193  2.796   0.745  1.00 0.18 ?  6  PHE A CA   9  
ATOM   4754 C C    . PHE A 1 6  ? -6.004  2.262   -0.665 1.00 0.13 ?  6  PHE A C    9  
ATOM   4755 O O    . PHE A 1 6  ? -4.911  2.317   -1.216 1.00 0.15 ?  6  PHE A O    9  
ATOM   4756 C CB   . PHE A 1 6  ? -6.297  1.638   1.743  1.00 0.23 ?  6  PHE A CB   9  
ATOM   4757 C CG   . PHE A 1 6  ? -5.048  0.810   1.870  1.00 0.25 ?  6  PHE A CG   9  
ATOM   4758 C CD1  . PHE A 1 6  ? -4.145  1.041   2.893  1.00 0.43 ?  6  PHE A CD1  9  
ATOM   4759 C CD2  . PHE A 1 6  ? -4.774  -0.194  0.956  1.00 0.25 ?  6  PHE A CD2  9  
ATOM   4760 C CE1  . PHE A 1 6  ? -2.995  0.287   3.004  1.00 0.50 ?  6  PHE A CE1  9  
ATOM   4761 C CE2  . PHE A 1 6  ? -3.625  -0.952  1.062  1.00 0.35 ?  6  PHE A CE2  9  
ATOM   4762 C CZ   . PHE A 1 6  ? -2.748  -0.727  2.119  1.00 0.43 ?  6  PHE A CZ   9  
ATOM   4763 H H    . PHE A 1 6  ? -8.121  3.310   1.409  1.00 0.29 ?  6  PHE A H    9  
ATOM   4764 H HA   . PHE A 1 6  ? -5.355  3.424   1.005  1.00 0.23 ?  6  PHE A HA   9  
ATOM   4765 H HB2  . PHE A 1 6  ? -6.526  2.036   2.718  1.00 0.31 ?  6  PHE A HB2  9  
ATOM   4766 H HB3  . PHE A 1 6  ? -7.098  0.983   1.435  1.00 0.27 ?  6  PHE A HB3  9  
ATOM   4767 H HD1  . PHE A 1 6  ? -4.349  1.821   3.613  1.00 0.55 ?  6  PHE A HD1  9  
ATOM   4768 H HD2  . PHE A 1 6  ? -5.470  -0.383  0.156  1.00 0.29 ?  6  PHE A HD2  9  
ATOM   4769 H HE1  . PHE A 1 6  ? -2.302  0.480   3.807  1.00 0.65 ?  6  PHE A HE1  9  
ATOM   4770 H HE2  . PHE A 1 6  ? -3.424  -1.731  0.342  1.00 0.43 ?  6  PHE A HE2  9  
ATOM   4771 H HZ   . PHE A 1 6  ? -1.853  -1.325  2.215  1.00 0.51 ?  6  PHE A HZ   9  
ATOM   4772 N N    . LYS A 1 7  ? -7.083  1.750   -1.245 1.00 0.13 ?  7  LYS A N    9  
ATOM   4773 C CA   . LYS A 1 7  ? -7.059  1.275   -2.619 1.00 0.15 ?  7  LYS A CA   9  
ATOM   4774 C C    . LYS A 1 7  ? -6.735  2.417   -3.576 1.00 0.19 ?  7  LYS A C    9  
ATOM   4775 O O    . LYS A 1 7  ? -6.014  2.236   -4.550 1.00 0.23 ?  7  LYS A O    9  
ATOM   4776 C CB   . LYS A 1 7  ? -8.402  0.647   -2.996 1.00 0.23 ?  7  LYS A CB   9  
ATOM   4777 C CG   . LYS A 1 7  ? -8.462  0.155   -4.432 1.00 0.30 ?  7  LYS A CG   9  
ATOM   4778 C CD   . LYS A 1 7  ? -9.832  -0.401  -4.772 1.00 0.44 ?  7  LYS A CD   9  
ATOM   4779 C CE   . LYS A 1 7  ? -9.950  -0.726  -6.250 1.00 1.26 ?  7  LYS A CE   9  
ATOM   4780 N NZ   . LYS A 1 7  ? -9.816  0.489   -7.097 1.00 2.06 1  7  LYS A NZ   9  
ATOM   4781 H H    . LYS A 1 7  ? -7.917  1.677   -0.728 1.00 0.18 ?  7  LYS A H    9  
ATOM   4782 H HA   . LYS A 1 7  ? -6.286  0.526   -2.696 1.00 0.15 ?  7  LYS A HA   9  
ATOM   4783 H HB2  . LYS A 1 7  ? -8.595  -0.190  -2.341 1.00 0.28 ?  7  LYS A HB2  9  
ATOM   4784 H HB3  . LYS A 1 7  ? -9.179  1.383   -2.859 1.00 0.25 ?  7  LYS A HB3  9  
ATOM   4785 H HG2  . LYS A 1 7  ? -8.244  0.980   -5.093 1.00 0.31 ?  7  LYS A HG2  9  
ATOM   4786 H HG3  . LYS A 1 7  ? -7.723  -0.622  -4.568 1.00 0.36 ?  7  LYS A HG3  9  
ATOM   4787 H HD2  . LYS A 1 7  ? -9.996  -1.302  -4.200 1.00 1.10 ?  7  LYS A HD2  9  
ATOM   4788 H HD3  . LYS A 1 7  ? -10.582 0.334   -4.511 1.00 0.92 ?  7  LYS A HD3  9  
ATOM   4789 H HE2  . LYS A 1 7  ? -9.172  -1.426  -6.516 1.00 1.83 ?  7  LYS A HE2  9  
ATOM   4790 H HE3  . LYS A 1 7  ? -10.915 -1.177  -6.432 1.00 1.84 ?  7  LYS A HE3  9  
ATOM   4791 H HZ1  . LYS A 1 7  ? -9.959  0.248   -8.097 1.00 2.69 ?  7  LYS A HZ1  9  
ATOM   4792 H HZ2  . LYS A 1 7  ? -8.870  0.902   -6.984 1.00 2.55 ?  7  LYS A HZ2  9  
ATOM   4793 H HZ3  . LYS A 1 7  ? -10.525 1.197   -6.819 1.00 2.30 ?  7  LYS A HZ3  9  
ATOM   4794 N N    . ALA A 1 8  ? -7.266  3.593   -3.284 1.00 0.22 ?  8  ALA A N    9  
ATOM   4795 C CA   . ALA A 1 8  ? -7.033  4.765   -4.117 1.00 0.30 ?  8  ALA A CA   9  
ATOM   4796 C C    . ALA A 1 8  ? -5.575  5.217   -4.045 1.00 0.35 ?  8  ALA A C    9  
ATOM   4797 O O    . ALA A 1 8  ? -5.029  5.740   -5.014 1.00 0.45 ?  8  ALA A O    9  
ATOM   4798 C CB   . ALA A 1 8  ? -7.960  5.891   -3.699 1.00 0.35 ?  8  ALA A CB   9  
ATOM   4799 H H    . ALA A 1 8  ? -7.843  3.676   -2.492 1.00 0.22 ?  8  ALA A H    9  
ATOM   4800 H HA   . ALA A 1 8  ? -7.266  4.498   -5.137 1.00 0.34 ?  8  ALA A HA   9  
ATOM   4801 H HB1  . ALA A 1 8  ? -8.986  5.587   -3.848 1.00 1.02 ?  8  ALA A HB1  9  
ATOM   4802 H HB2  . ALA A 1 8  ? -7.752  6.769   -4.291 1.00 1.02 ?  8  ALA A HB2  9  
ATOM   4803 H HB3  . ALA A 1 8  ? -7.800  6.114   -2.655 1.00 1.04 ?  8  ALA A HB3  9  
ATOM   4804 N N    . VAL A 1 9  ? -4.947  5.023   -2.894 1.00 0.31 ?  9  VAL A N    9  
ATOM   4805 C CA   . VAL A 1 9  ? -3.551  5.403   -2.712 1.00 0.39 ?  9  VAL A CA   9  
ATOM   4806 C C    . VAL A 1 9  ? -2.604  4.336   -3.257 1.00 0.38 ?  9  VAL A C    9  
ATOM   4807 O O    . VAL A 1 9  ? -1.738  4.614   -4.088 1.00 0.49 ?  9  VAL A O    9  
ATOM   4808 C CB   . VAL A 1 9  ? -3.224  5.646   -1.221 1.00 0.42 ?  9  VAL A CB   9  
ATOM   4809 C CG1  . VAL A 1 9  ? -1.749  5.964   -1.037 1.00 0.52 ?  9  VAL A CG1  9  
ATOM   4810 C CG2  . VAL A 1 9  ? -4.079  6.764   -0.653 1.00 0.50 ?  9  VAL A CG2  9  
ATOM   4811 H H    . VAL A 1 9  ? -5.440  4.627   -2.140 1.00 0.26 ?  9  VAL A H    9  
ATOM   4812 H HA   . VAL A 1 9  ? -3.385  6.325   -3.248 1.00 0.47 ?  9  VAL A HA   9  
ATOM   4813 H HB   . VAL A 1 9  ? -3.444  4.742   -0.671 1.00 0.37 ?  9  VAL A HB   9  
ATOM   4814 H HG11 . VAL A 1 9  ? -1.558  6.190   -0.001 1.00 0.97 ?  9  VAL A HG11 9  
ATOM   4815 H HG12 . VAL A 1 9  ? -1.487  6.816   -1.648 1.00 0.84 ?  9  VAL A HG12 9  
ATOM   4816 H HG13 . VAL A 1 9  ? -1.158  5.111   -1.337 1.00 1.18 ?  9  VAL A HG13 9  
ATOM   4817 H HG21 . VAL A 1 9  ? -5.122  6.503   -0.753 1.00 0.95 ?  9  VAL A HG21 9  
ATOM   4818 H HG22 . VAL A 1 9  ? -3.882  7.678   -1.193 1.00 0.76 ?  9  VAL A HG22 9  
ATOM   4819 H HG23 . VAL A 1 9  ? -3.843  6.903   0.392  1.00 0.91 ?  9  VAL A HG23 9  
ATOM   4820 N N    . PHE A 1 10 ? -2.795  3.113   -2.793 1.00 0.29 ?  10 PHE A N    9  
ATOM   4821 C CA   . PHE A 1 10 ? -1.865  2.027   -3.059 1.00 0.33 ?  10 PHE A CA   9  
ATOM   4822 C C    . PHE A 1 10 ? -2.180  1.305   -4.365 1.00 0.35 ?  10 PHE A C    9  
ATOM   4823 O O    . PHE A 1 10 ? -1.291  0.724   -4.988 1.00 0.45 ?  10 PHE A O    9  
ATOM   4824 C CB   . PHE A 1 10 ? -1.877  1.048   -1.883 1.00 0.32 ?  10 PHE A CB   9  
ATOM   4825 C CG   . PHE A 1 10 ? -1.280  1.623   -0.629 1.00 0.33 ?  10 PHE A CG   9  
ATOM   4826 C CD1  . PHE A 1 10 ? -2.044  2.412   0.204  1.00 0.39 ?  10 PHE A CD1  9  
ATOM   4827 C CD2  . PHE A 1 10 ? 0.035   1.365   -0.279 1.00 0.39 ?  10 PHE A CD2  9  
ATOM   4828 C CE1  . PHE A 1 10 ? -1.518  2.938   1.366  1.00 0.41 ?  10 PHE A CE1  9  
ATOM   4829 C CE2  . PHE A 1 10 ? 0.572   1.888   0.883  1.00 0.42 ?  10 PHE A CE2  9  
ATOM   4830 C CZ   . PHE A 1 10 ? -0.143  2.697   1.666  1.00 0.37 ?  10 PHE A CZ   9  
ATOM   4831 H H    . PHE A 1 10 ? -3.590  2.932   -2.250 1.00 0.22 ?  10 PHE A H    9  
ATOM   4832 H HA   . PHE A 1 10 ? -0.879  2.456   -3.134 1.00 0.39 ?  10 PHE A HA   9  
ATOM   4833 H HB2  . PHE A 1 10 ? -2.899  0.766   -1.666 1.00 0.30 ?  10 PHE A HB2  9  
ATOM   4834 H HB3  . PHE A 1 10 ? -1.313  0.166   -2.148 1.00 0.37 ?  10 PHE A HB3  9  
ATOM   4835 H HD1  . PHE A 1 10 ? -3.064  2.617   -0.064 1.00 0.48 ?  10 PHE A HD1  9  
ATOM   4836 H HD2  . PHE A 1 10 ? 0.645   0.751   -0.923 1.00 0.47 ?  10 PHE A HD2  9  
ATOM   4837 H HE1  . PHE A 1 10 ? -2.131  3.554   2.007  1.00 0.50 ?  10 PHE A HE1  9  
ATOM   4838 H HE2  . PHE A 1 10 ? 1.597   1.678   1.146  1.00 0.52 ?  10 PHE A HE2  9  
ATOM   4839 H HZ   . PHE A 1 10 ? 0.300   3.113   2.557  1.00 0.39 ?  10 PHE A HZ   9  
ATOM   4840 N N    . GLY A 1 11 ? -3.438  1.342   -4.778 1.00 0.28 ?  11 GLY A N    9  
ATOM   4841 C CA   . GLY A 1 11 ? -3.830  0.684   -6.009 1.00 0.31 ?  11 GLY A CA   9  
ATOM   4842 C C    . GLY A 1 11 ? -4.537  -0.634  -5.762 1.00 0.29 ?  11 GLY A C    9  
ATOM   4843 O O    . GLY A 1 11 ? -5.075  -1.242  -6.688 1.00 0.36 ?  11 GLY A O    9  
ATOM   4844 H H    . GLY A 1 11 ? -4.109  1.830   -4.252 1.00 0.24 ?  11 GLY A H    9  
ATOM   4845 H HA2  . GLY A 1 11 ? -4.493  1.338   -6.555 1.00 0.32 ?  11 GLY A HA2  9  
ATOM   4846 H HA3  . GLY A 1 11 ? -2.950  0.501   -6.604 1.00 0.35 ?  11 GLY A HA3  9  
HETATM 4847 N N    . NLE A 1 12 ? -4.540  -1.075  -4.511 1.00 0.24 ?  12 NLE A N    9  
HETATM 4848 C CA   . NLE A 1 12 ? -5.163  -2.339  -4.140 1.00 0.24 ?  12 NLE A CA   9  
HETATM 4849 C C    . NLE A 1 12 ? -5.725  -2.255  -2.729 1.00 0.21 ?  12 NLE A C    9  
HETATM 4850 O O    . NLE A 1 12 ? -5.422  -1.318  -1.990 1.00 0.22 ?  12 NLE A O    9  
HETATM 4851 C CB   . NLE A 1 12 ? -4.165  -3.508  -4.239 1.00 0.27 ?  12 NLE A CB   9  
HETATM 4852 C CG   . NLE A 1 12 ? -2.979  -3.430  -3.277 1.00 0.64 ?  12 NLE A CG   9  
HETATM 4853 C CD   . NLE A 1 12 ? -1.929  -2.413  -3.711 1.00 0.33 ?  12 NLE A CD   9  
HETATM 4854 C CE   . NLE A 1 12 ? -1.314  -2.811  -5.039 1.00 0.64 ?  12 NLE A CE   9  
HETATM 4855 H H    . NLE A 1 12 ? -4.119  -0.532  -3.813 1.00 0.26 ?  12 NLE A H    9  
HETATM 4856 H HA   . NLE A 1 12 ? -5.978  -2.517  -4.825 1.00 0.26 ?  12 NLE A HA   9  
HETATM 4857 H HB2  . NLE A 1 12 ? -3.783  -3.547  -5.245 1.00 0.51 ?  12 NLE A HB2  9  
HETATM 4858 H HB3  . NLE A 1 12 ? -4.695  -4.425  -4.036 1.00 0.31 ?  12 NLE A HB3  9  
HETATM 4859 H HG2  . NLE A 1 12 ? -2.517  -4.405  -3.219 1.00 1.24 ?  12 NLE A HG2  9  
HETATM 4860 H HG3  . NLE A 1 12 ? -3.345  -3.152  -2.300 1.00 1.24 ?  12 NLE A HG3  9  
HETATM 4861 H HD2  . NLE A 1 12 ? -1.147  -2.366  -2.967 1.00 0.70 ?  12 NLE A HD2  9  
HETATM 4862 H HD3  . NLE A 1 12 ? -2.391  -1.443  -3.820 1.00 0.43 ?  12 NLE A HD3  9  
HETATM 4863 H HE1  . NLE A 1 12 ? -2.072  -2.801  -5.808 1.00 1.10 ?  12 NLE A HE1  9  
HETATM 4864 H HE2  . NLE A 1 12 ? -0.897  -3.803  -4.960 1.00 1.19 ?  12 NLE A HE2  9  
HETATM 4865 H HE3  . NLE A 1 12 ? -0.533  -2.112  -5.297 1.00 1.26 ?  12 NLE A HE3  9  
ATOM   4866 N N    . THR A 1 13 ? -6.548  -3.229  -2.362 1.00 0.24 ?  13 THR A N    9  
ATOM   4867 C CA   . THR A 1 13 ? -7.147  -3.261  -1.038 1.00 0.27 ?  13 THR A CA   9  
ATOM   4868 C C    . THR A 1 13 ? -6.138  -3.715  0.008  1.00 0.24 ?  13 THR A C    9  
ATOM   4869 O O    . THR A 1 13 ? -5.131  -4.334  -0.335 1.00 0.23 ?  13 THR A O    9  
ATOM   4870 C CB   . THR A 1 13 ? -8.378  -4.187  -0.999 1.00 0.34 ?  13 THR A CB   9  
ATOM   4871 O OG1  . THR A 1 13 ? -8.055  -5.463  -1.571 1.00 0.36 ?  13 THR A OG1  9  
ATOM   4872 C CG2  . THR A 1 13 ? -9.543  -3.562  -1.750 1.00 0.43 ?  13 THR A CG2  9  
ATOM   4873 H H    . THR A 1 13 ? -6.751  -3.950  -2.996 1.00 0.27 ?  13 THR A H    9  
ATOM   4874 H HA   . THR A 1 13 ? -7.470  -2.261  -0.795 1.00 0.30 ?  13 THR A HA   9  
ATOM   4875 H HB   . THR A 1 13 ? -8.668  -4.331  0.031  1.00 0.34 ?  13 THR A HB   9  
ATOM   4876 H HG1  . THR A 1 13 ? -8.429  -5.519  -2.460 1.00 0.58 ?  13 THR A HG1  9  
ATOM   4877 H HG21 . THR A 1 13 ? -9.824  -2.636  -1.269 1.00 0.92 ?  13 THR A HG21 9  
ATOM   4878 H HG22 . THR A 1 13 ? -10.383 -4.241  -1.744 1.00 1.34 ?  13 THR A HG22 9  
ATOM   4879 H HG23 . THR A 1 13 ? -9.247  -3.362  -2.769 1.00 1.02 ?  13 THR A HG23 9  
ATOM   4880 N N    . ARG A 1 14 ? -6.412  -3.429  1.276  1.00 0.29 ?  14 ARG A N    9  
ATOM   4881 C CA   . ARG A 1 14 ? -5.471  -3.738  2.351  1.00 0.32 ?  14 ARG A CA   9  
ATOM   4882 C C    . ARG A 1 14 ? -5.084  -5.213  2.328  1.00 0.30 ?  14 ARG A C    9  
ATOM   4883 O O    . ARG A 1 14 ? -3.908  -5.562  2.486  1.00 0.31 ?  14 ARG A O    9  
ATOM   4884 C CB   . ARG A 1 14 ? -6.078  -3.371  3.705  1.00 0.42 ?  14 ARG A CB   9  
ATOM   4885 C CG   . ARG A 1 14 ? -6.310  -1.879  3.883  1.00 0.53 ?  14 ARG A CG   9  
ATOM   4886 C CD   . ARG A 1 14 ? -6.974  -1.570  5.214  1.00 0.77 ?  14 ARG A CD   9  
ATOM   4887 N NE   . ARG A 1 14 ? -6.167  -2.018  6.345  1.00 1.30 ?  14 ARG A NE   9  
ATOM   4888 C CZ   . ARG A 1 14 ? -6.667  -2.345  7.537  1.00 1.88 ?  14 ARG A CZ   9  
ATOM   4889 N NH1  . ARG A 1 14 ? -7.970  -2.232  7.767  1.00 2.02 1  14 ARG A NH1  9  
ATOM   4890 N NH2  . ARG A 1 14 ? -5.862  -2.771  8.501  1.00 2.82 ?  14 ARG A NH2  9  
ATOM   4891 H H    . ARG A 1 14 ? -7.274  -3.017  1.497  1.00 0.32 ?  14 ARG A H    9  
ATOM   4892 H HA   . ARG A 1 14 ? -4.582  -3.144  2.192  1.00 0.34 ?  14 ARG A HA   9  
ATOM   4893 H HB2  . ARG A 1 14 ? -7.025  -3.876  3.811  1.00 0.43 ?  14 ARG A HB2  9  
ATOM   4894 H HB3  . ARG A 1 14 ? -5.414  -3.706  4.485  1.00 0.46 ?  14 ARG A HB3  9  
ATOM   4895 H HG2  . ARG A 1 14 ? -5.358  -1.370  3.840  1.00 0.58 ?  14 ARG A HG2  9  
ATOM   4896 H HG3  . ARG A 1 14 ? -6.946  -1.527  3.083  1.00 0.53 ?  14 ARG A HG3  9  
ATOM   4897 H HD2  . ARG A 1 14 ? -7.119  -0.504  5.291  1.00 1.48 ?  14 ARG A HD2  9  
ATOM   4898 H HD3  . ARG A 1 14 ? -7.931  -2.066  5.249  1.00 1.15 ?  14 ARG A HD3  9  
ATOM   4899 H HE   . ARG A 1 14 ? -5.197  -2.085  6.205  1.00 1.80 ?  14 ARG A HE   9  
ATOM   4900 H HH11 . ARG A 1 14 ? -8.346  -2.480  8.665  1.00 2.60 ?  14 ARG A HH11 9  
ATOM   4901 H HH12 . ARG A 1 14 ? -8.584  -1.902  7.048  1.00 1.94 ?  14 ARG A HH12 9  
ATOM   4902 H HH21 . ARG A 1 14 ? -4.873  -2.850  8.338  1.00 3.23 ?  14 ARG A HH21 9  
ATOM   4903 H HH22 . ARG A 1 14 ? -6.238  -3.022  9.396  1.00 3.30 ?  14 ARG A HH22 9  
HETATM 4904 N N    . AIB A 1 15 ? -6.084  -6.060  2.096  1.00 0.31 ?  15 AIB A N    9  
HETATM 4905 C CA   . AIB A 1 15 ? -5.893  -7.512  1.994  1.00 0.33 ?  15 AIB A CA   9  
HETATM 4906 C C    . AIB A 1 15 ? -4.888  -7.826  0.876  1.00 0.30 ?  15 AIB A C    9  
HETATM 4907 O O    . AIB A 1 15 ? -3.976  -8.646  1.045  1.00 0.30 ?  15 AIB A O    9  
HETATM 4908 C CB1  . AIB A 1 15 ? -7.223  -8.163  1.682  1.00 0.37 ?  15 AIB A CB1  9  
HETATM 4909 C CB2  . AIB A 1 15 ? -5.409  -8.074  3.317  1.00 0.37 ?  15 AIB A CB2  9  
HETATM 4910 H H    . AIB A 1 15 ? -6.991  -5.696  1.991  1.00 0.31 ?  15 AIB A H    9  
HETATM 4911 H HB11 . AIB A 1 15 ? -7.926  -7.942  2.471  1.00 1.00 ?  15 AIB A HB11 9  
HETATM 4912 H HB12 . AIB A 1 15 ? -7.091  -9.231  1.606  1.00 1.13 ?  15 AIB A HB12 9  
HETATM 4913 H HB13 . AIB A 1 15 ? -7.601  -7.778  0.747  1.00 1.02 ?  15 AIB A HB13 9  
HETATM 4914 H HB21 . AIB A 1 15 ? -6.168  -7.929  4.069  1.00 1.07 ?  15 AIB A HB21 9  
HETATM 4915 H HB22 . AIB A 1 15 ? -4.506  -7.563  3.615  1.00 1.16 ?  15 AIB A HB22 9  
HETATM 4916 H HB23 . AIB A 1 15 ? -5.207  -9.129  3.206  1.00 1.01 ?  15 AIB A HB23 9  
ATOM   4917 N N    . ALA A 1 16 ? -5.043  -7.148  -0.256 1.00 0.27 ?  16 ALA A N    9  
ATOM   4918 C CA   . ALA A 1 16 ? -4.197  -7.394  -1.415 1.00 0.26 ?  16 ALA A CA   9  
ATOM   4919 C C    . ALA A 1 16 ? -2.788  -6.900  -1.143 1.00 0.23 ?  16 ALA A C    9  
ATOM   4920 O O    . ALA A 1 16 ? -1.807  -7.478  -1.612 1.00 0.25 ?  16 ALA A O    9  
ATOM   4921 C CB   . ALA A 1 16 ? -4.772  -6.712  -2.643 1.00 0.28 ?  16 ALA A CB   9  
ATOM   4922 H H    . ALA A 1 16 ? -5.725  -6.440  -0.304 1.00 0.27 ?  16 ALA A H    9  
ATOM   4923 H HA   . ALA A 1 16 ? -4.173  -8.458  -1.595 1.00 0.29 ?  16 ALA A HA   9  
ATOM   4924 H HB1  . ALA A 1 16 ? -4.825  -5.648  -2.471 1.00 0.90 ?  16 ALA A HB1  9  
ATOM   4925 H HB2  . ALA A 1 16 ? -5.762  -7.095  -2.836 1.00 0.96 ?  16 ALA A HB2  9  
ATOM   4926 H HB3  . ALA A 1 16 ? -4.138  -6.909  -3.495 1.00 0.89 ?  16 ALA A HB3  9  
ATOM   4927 N N    . PHE A 1 17 ? -2.710  -5.824  -0.370 1.00 0.20 ?  17 PHE A N    9  
ATOM   4928 C CA   . PHE A 1 17 ? -1.443  -5.257  0.055  1.00 0.19 ?  17 PHE A CA   9  
ATOM   4929 C C    . PHE A 1 17 ? -0.690  -6.242  0.938  1.00 0.20 ?  17 PHE A C    9  
ATOM   4930 O O    . PHE A 1 17 ? 0.495   -6.494  0.737  1.00 0.20 ?  17 PHE A O    9  
ATOM   4931 C CB   . PHE A 1 17 ? -1.698  -3.955  0.811  1.00 0.22 ?  17 PHE A CB   9  
ATOM   4932 C CG   . PHE A 1 17 ? -0.454  -3.234  1.236  1.00 0.24 ?  17 PHE A CG   9  
ATOM   4933 C CD1  . PHE A 1 17 ? 0.201   -2.378  0.366  1.00 0.28 ?  17 PHE A CD1  9  
ATOM   4934 C CD2  . PHE A 1 17 ? 0.066   -3.423  2.502  1.00 0.28 ?  17 PHE A CD2  9  
ATOM   4935 C CE1  . PHE A 1 17 ? 1.351   -1.720  0.756  1.00 0.33 ?  17 PHE A CE1  9  
ATOM   4936 C CE2  . PHE A 1 17 ? 1.214   -2.769  2.896  1.00 0.32 ?  17 PHE A CE2  9  
ATOM   4937 C CZ   . PHE A 1 17 ? 1.838   -1.882  2.021  1.00 0.33 ?  17 PHE A CZ   9  
ATOM   4938 H H    . PHE A 1 17 ? -3.544  -5.388  -0.083 1.00 0.21 ?  17 PHE A H    9  
ATOM   4939 H HA   . PHE A 1 17 ? -0.856  -5.046  -0.824 1.00 0.19 ?  17 PHE A HA   9  
ATOM   4940 H HB2  . PHE A 1 17 ? -2.261  -3.291  0.178  1.00 0.22 ?  17 PHE A HB2  9  
ATOM   4941 H HB3  . PHE A 1 17 ? -2.275  -4.172  1.697  1.00 0.24 ?  17 PHE A HB3  9  
ATOM   4942 H HD1  . PHE A 1 17 ? -0.199  -2.223  -0.625 1.00 0.30 ?  17 PHE A HD1  9  
ATOM   4943 H HD2  . PHE A 1 17 ? -0.436  -4.090  3.189  1.00 0.30 ?  17 PHE A HD2  9  
ATOM   4944 H HE1  . PHE A 1 17 ? 1.854   -1.055  0.071  1.00 0.38 ?  17 PHE A HE1  9  
ATOM   4945 H HE2  . PHE A 1 17 ? 1.608   -2.925  3.886  1.00 0.36 ?  17 PHE A HE2  9  
ATOM   4946 H HZ   . PHE A 1 17 ? 2.732   -1.355  2.320  1.00 0.37 ?  17 PHE A HZ   9  
ATOM   4947 N N    . ALA A 1 18 ? -1.393  -6.813  1.906  1.00 0.23 ?  18 ALA A N    9  
ATOM   4948 C CA   . ALA A 1 18 ? -0.789  -7.773  2.817  1.00 0.25 ?  18 ALA A CA   9  
ATOM   4949 C C    . ALA A 1 18 ? -0.372  -9.037  2.074  1.00 0.23 ?  18 ALA A C    9  
ATOM   4950 O O    . ALA A 1 18 ? 0.563   -9.728  2.478  1.00 0.23 ?  18 ALA A O    9  
ATOM   4951 C CB   . ALA A 1 18 ? -1.747  -8.109  3.946  1.00 0.30 ?  18 ALA A CB   9  
ATOM   4952 H H    . ALA A 1 18 ? -2.342  -6.580  2.011  1.00 0.25 ?  18 ALA A H    9  
ATOM   4953 H HA   . ALA A 1 18 ? 0.091   -7.316  3.247  1.00 0.27 ?  18 ALA A HA   9  
ATOM   4954 H HB1  . ALA A 1 18 ? -1.254  -8.756  4.657  1.00 1.06 ?  18 ALA A HB1  9  
ATOM   4955 H HB2  . ALA A 1 18 ? -2.614  -8.610  3.545  1.00 0.87 ?  18 ALA A HB2  9  
ATOM   4956 H HB3  . ALA A 1 18 ? -2.053  -7.199  4.440  1.00 0.99 ?  18 ALA A HB3  9  
ATOM   4957 N N    . ASN A 1 19 ? -1.079  -9.330  0.988  1.00 0.24 ?  19 ASN A N    9  
ATOM   4958 C CA   . ASN A 1 19 ? -0.724  -10.450 0.121  1.00 0.24 ?  19 ASN A CA   9  
ATOM   4959 C C    . ASN A 1 19 ? 0.563   -10.159 -0.656 1.00 0.19 ?  19 ASN A C    9  
ATOM   4960 O O    . ASN A 1 19 ? 1.263   -11.078 -1.087 1.00 0.22 ?  19 ASN A O    9  
ATOM   4961 C CB   . ASN A 1 19 ? -1.874  -10.755 -0.845 1.00 0.31 ?  19 ASN A CB   9  
ATOM   4962 C CG   . ASN A 1 19 ? -1.521  -11.821 -1.866 1.00 0.36 ?  19 ASN A CG   9  
ATOM   4963 O OD1  . ASN A 1 19 ? -1.067  -11.514 -2.968 1.00 1.14 ?  19 ASN A OD1  9  
ATOM   4964 N ND2  . ASN A 1 19 ? -1.725  -13.078 -1.510 1.00 1.08 ?  19 ASN A ND2  9  
ATOM   4965 H H    . ASN A 1 19 ? -1.875  -8.791  0.774  1.00 0.25 ?  19 ASN A H    9  
ATOM   4966 H HA   . ASN A 1 19 ? -0.559  -11.310 0.749  1.00 0.27 ?  19 ASN A HA   9  
ATOM   4967 H HB2  . ASN A 1 19 ? -2.728  -11.094 -0.280 1.00 0.38 ?  19 ASN A HB2  9  
ATOM   4968 H HB3  . ASN A 1 19 ? -2.136  -9.851  -1.374 1.00 0.32 ?  19 ASN A HB3  9  
ATOM   4969 H HD21 . ASN A 1 19 ? -2.089  -13.254 -0.616 1.00 1.83 ?  19 ASN A HD21 9  
ATOM   4970 H HD22 . ASN A 1 19 ? -1.505  -13.781 -2.156 1.00 1.08 ?  19 ASN A HD22 9  
ATOM   4971 N N    . LEU A 1 20 ? 0.882   -8.879  -0.815 1.00 0.17 ?  20 LEU A N    9  
ATOM   4972 C CA   . LEU A 1 20 ? 2.075   -8.474  -1.549 1.00 0.17 ?  20 LEU A CA   9  
ATOM   4973 C C    . LEU A 1 20 ? 3.333   -8.856  -0.778 1.00 0.17 ?  20 LEU A C    9  
ATOM   4974 O O    . LEU A 1 20 ? 3.301   -8.981  0.446  1.00 0.18 ?  20 LEU A O    9  
ATOM   4975 C CB   . LEU A 1 20 ? 2.073   -6.963  -1.790 1.00 0.20 ?  20 LEU A CB   9  
ATOM   4976 C CG   . LEU A 1 20 ? 0.961   -6.444  -2.697 1.00 0.29 ?  20 LEU A CG   9  
ATOM   4977 C CD1  . LEU A 1 20 ? 0.925   -4.926  -2.670 1.00 0.32 ?  20 LEU A CD1  9  
ATOM   4978 C CD2  . LEU A 1 20 ? 1.166   -6.939  -4.119 1.00 0.41 ?  20 LEU A CD2  9  
ATOM   4979 H H    . LEU A 1 20 ? 0.314   -8.187  -0.409 1.00 0.19 ?  20 LEU A H    9  
ATOM   4980 H HA   . LEU A 1 20 ? 2.072   -8.984  -2.498 1.00 0.22 ?  20 LEU A HA   9  
ATOM   4981 H HB2  . LEU A 1 20 ? 1.988   -6.468  -0.833 1.00 0.19 ?  20 LEU A HB2  9  
ATOM   4982 H HB3  . LEU A 1 20 ? 3.021   -6.692  -2.232 1.00 0.24 ?  20 LEU A HB3  9  
ATOM   4983 H HG   . LEU A 1 20 ? 0.009   -6.811  -2.344 1.00 0.33 ?  20 LEU A HG   9  
ATOM   4984 H HD11 . LEU A 1 20 ? 0.047   -4.576  -3.191 1.00 1.04 ?  20 LEU A HD11 9  
ATOM   4985 H HD12 . LEU A 1 20 ? 1.809   -4.537  -3.154 1.00 1.05 ?  20 LEU A HD12 9  
ATOM   4986 H HD13 . LEU A 1 20 ? 0.896   -4.582  -1.646 1.00 1.10 ?  20 LEU A HD13 9  
ATOM   4987 H HD21 . LEU A 1 20 ? 2.123   -6.596  -4.486 1.00 1.10 ?  20 LEU A HD21 9  
ATOM   4988 H HD22 . LEU A 1 20 ? 0.380   -6.555  -4.751 1.00 0.88 ?  20 LEU A HD22 9  
ATOM   4989 H HD23 . LEU A 1 20 ? 1.145   -8.019  -4.131 1.00 1.17 ?  20 LEU A HD23 9  
ATOM   4990 N N    . PRO A 1 21 ? 4.453   -9.058  -1.487 1.00 0.23 ?  21 PRO A N    9  
ATOM   4991 C CA   . PRO A 1 21 ? 5.737   -9.356  -0.854 1.00 0.29 ?  21 PRO A CA   9  
ATOM   4992 C C    . PRO A 1 21 ? 6.234   -8.188  -0.010 1.00 0.26 ?  21 PRO A C    9  
ATOM   4993 O O    . PRO A 1 21 ? 5.919   -7.032  -0.314 1.00 0.22 ?  21 PRO A O    9  
ATOM   4994 C CB   . PRO A 1 21 ? 6.689   -9.601  -2.033 1.00 0.38 ?  21 PRO A CB   9  
ATOM   4995 C CG   . PRO A 1 21 ? 5.805   -9.821  -3.214 1.00 0.43 ?  21 PRO A CG   9  
ATOM   4996 C CD   . PRO A 1 21 ? 4.561   -9.026  -2.952 1.00 0.30 ?  21 PRO A CD   9  
ATOM   4997 H HA   . PRO A 1 21 ? 5.679   -10.243 -0.242 1.00 0.32 ?  21 PRO A HA   9  
ATOM   4998 H HB2  . PRO A 1 21 ? 7.322   -8.736  -2.170 1.00 0.43 ?  21 PRO A HB2  9  
ATOM   4999 H HB3  . PRO A 1 21 ? 7.300   -10.469 -1.829 1.00 0.48 ?  21 PRO A HB3  9  
ATOM   5000 H HG2  . PRO A 1 21 ? 6.295   -9.467  -4.110 1.00 0.63 ?  21 PRO A HG2  9  
ATOM   5001 H HG3  . PRO A 1 21 ? 5.567   -10.873 -3.304 1.00 0.61 ?  21 PRO A HG3  9  
ATOM   5002 H HD2  . PRO A 1 21 ? 4.676   -8.012  -3.308 1.00 0.40 ?  21 PRO A HD2  9  
ATOM   5003 H HD3  . PRO A 1 21 ? 3.705   -9.494  -3.414 1.00 0.39 ?  21 PRO A HD3  9  
ATOM   5004 N N    . LEU A 1 22 ? 6.999   -8.479  1.034  1.00 0.30 ?  22 LEU A N    9  
ATOM   5005 C CA   . LEU A 1 22 ? 7.442   -7.450  1.975  1.00 0.31 ?  22 LEU A CA   9  
ATOM   5006 C C    . LEU A 1 22 ? 8.066   -6.258  1.258  1.00 0.28 ?  22 LEU A C    9  
ATOM   5007 O O    . LEU A 1 22 ? 7.750   -5.108  1.568  1.00 0.28 ?  22 LEU A O    9  
ATOM   5008 C CB   . LEU A 1 22 ? 8.442   -8.026  2.980  1.00 0.41 ?  22 LEU A CB   9  
ATOM   5009 C CG   . LEU A 1 22 ? 7.855   -8.981  4.021  1.00 1.07 ?  22 LEU A CG   9  
ATOM   5010 C CD1  . LEU A 1 22 ? 8.961   -9.565  4.884  1.00 1.64 ?  22 LEU A CD1  9  
ATOM   5011 C CD2  . LEU A 1 22 ? 6.831   -8.262  4.890  1.00 1.54 ?  22 LEU A CD2  9  
ATOM   5012 H H    . LEU A 1 22 ? 7.286   -9.408  1.172  1.00 0.34 ?  22 LEU A H    9  
ATOM   5013 H HA   . LEU A 1 22 ? 6.572   -7.105  2.511  1.00 0.30 ?  22 LEU A HA   9  
ATOM   5014 H HB2  . LEU A 1 22 ? 9.205   -8.556  2.430  1.00 1.00 ?  22 LEU A HB2  9  
ATOM   5015 H HB3  . LEU A 1 22 ? 8.907   -7.204  3.503  1.00 0.94 ?  22 LEU A HB3  9  
ATOM   5016 H HG   . LEU A 1 22 ? 7.357   -9.797  3.517  1.00 1.97 ?  22 LEU A HG   9  
ATOM   5017 H HD11 . LEU A 1 22 ? 8.532   -10.236 5.614  1.00 2.16 ?  22 LEU A HD11 9  
ATOM   5018 H HD12 . LEU A 1 22 ? 9.481   -8.766  5.392  1.00 1.77 ?  22 LEU A HD12 9  
ATOM   5019 H HD13 . LEU A 1 22 ? 9.655   -10.108 4.260  1.00 2.26 ?  22 LEU A HD13 9  
ATOM   5020 H HD21 . LEU A 1 22 ? 5.968   -8.007  4.294  1.00 2.09 ?  22 LEU A HD21 9  
ATOM   5021 H HD22 . LEU A 1 22 ? 7.270   -7.360  5.290  1.00 1.81 ?  22 LEU A HD22 9  
ATOM   5022 H HD23 . LEU A 1 22 ? 6.532   -8.908  5.701  1.00 2.05 ?  22 LEU A HD23 9  
ATOM   5023 N N    . TRP A 1 23 ? 8.924   -6.531  0.279  1.00 0.33 ?  23 TRP A N    9  
ATOM   5024 C CA   . TRP A 1 23 ? 9.610   -5.467  -0.442 1.00 0.34 ?  23 TRP A CA   9  
ATOM   5025 C C    . TRP A 1 23 ? 8.614   -4.570  -1.176 1.00 0.27 ?  23 TRP A C    9  
ATOM   5026 O O    . TRP A 1 23 ? 8.833   -3.367  -1.305 1.00 0.25 ?  23 TRP A O    9  
ATOM   5027 C CB   . TRP A 1 23 ? 10.649  -6.036  -1.421 1.00 0.42 ?  23 TRP A CB   9  
ATOM   5028 C CG   . TRP A 1 23 ? 10.070  -6.765  -2.599 1.00 0.48 ?  23 TRP A CG   9  
ATOM   5029 C CD1  . TRP A 1 23 ? 9.857   -8.107  -2.709 1.00 0.56 ?  23 TRP A CD1  9  
ATOM   5030 C CD2  . TRP A 1 23 ? 9.650   -6.189  -3.842 1.00 0.51 ?  23 TRP A CD2  9  
ATOM   5031 N NE1  . TRP A 1 23 ? 9.327   -8.399  -3.941 1.00 0.62 ?  23 TRP A NE1  9  
ATOM   5032 C CE2  . TRP A 1 23 ? 9.187   -7.238  -4.653 1.00 0.60 ?  23 TRP A CE2  9  
ATOM   5033 C CE3  . TRP A 1 23 ? 9.616   -4.884  -4.342 1.00 0.49 ?  23 TRP A CE3  9  
ATOM   5034 C CZ2  . TRP A 1 23 ? 8.699   -7.025  -5.939 1.00 0.68 ?  23 TRP A CZ2  9  
ATOM   5035 C CZ3  . TRP A 1 23 ? 9.130   -4.672  -5.616 1.00 0.59 ?  23 TRP A CZ3  9  
ATOM   5036 C CH2  . TRP A 1 23 ? 8.678   -5.738  -6.402 1.00 0.68 ?  23 TRP A CH2  9  
ATOM   5037 H H    . TRP A 1 23 ? 9.101   -7.468  0.043  1.00 0.37 ?  23 TRP A H    9  
ATOM   5038 H HA   . TRP A 1 23 ? 10.124  -4.865  0.292  1.00 0.35 ?  23 TRP A HA   9  
ATOM   5039 H HB2  . TRP A 1 23 ? 11.248  -5.226  -1.803 1.00 0.42 ?  23 TRP A HB2  9  
ATOM   5040 H HB3  . TRP A 1 23 ? 11.288  -6.724  -0.889 1.00 0.48 ?  23 TRP A HB3  9  
ATOM   5041 H HD1  . TRP A 1 23 ? 10.079  -8.822  -1.933 1.00 0.59 ?  23 TRP A HD1  9  
ATOM   5042 H HE1  . TRP A 1 23 ? 9.083   -9.299  -4.258 1.00 0.69 ?  23 TRP A HE1  9  
ATOM   5043 H HE3  . TRP A 1 23 ? 9.959   -4.048  -3.747 1.00 0.44 ?  23 TRP A HE3  9  
ATOM   5044 H HZ2  . TRP A 1 23 ? 8.344   -7.837  -6.556 1.00 0.76 ?  23 TRP A HZ2  9  
ATOM   5045 H HZ3  . TRP A 1 23 ? 9.097   -3.671  -6.018 1.00 0.61 ?  23 TRP A HZ3  9  
ATOM   5046 H HH2  . TRP A 1 23 ? 8.307   -5.526  -7.393 1.00 0.76 ?  23 TRP A HH2  9  
ATOM   5047 N N    . LYS A 1 24 ? 7.511   -5.158  -1.630 1.00 0.24 ?  24 LYS A N    9  
ATOM   5048 C CA   . LYS A 1 24 ? 6.489   -4.413  -2.351 1.00 0.22 ?  24 LYS A CA   9  
ATOM   5049 C C    . LYS A 1 24 ? 5.702   -3.556  -1.373 1.00 0.14 ?  24 LYS A C    9  
ATOM   5050 O O    . LYS A 1 24 ? 5.409   -2.394  -1.648 1.00 0.15 ?  24 LYS A O    9  
ATOM   5051 C CB   . LYS A 1 24 ? 5.552   -5.375  -3.091 1.00 0.26 ?  24 LYS A CB   9  
ATOM   5052 C CG   . LYS A 1 24 ? 4.372   -4.700  -3.780 1.00 0.35 ?  24 LYS A CG   9  
ATOM   5053 C CD   . LYS A 1 24 ? 4.784   -3.957  -5.041 1.00 0.97 ?  24 LYS A CD   9  
ATOM   5054 C CE   . LYS A 1 24 ? 3.574   -3.339  -5.731 1.00 0.98 ?  24 LYS A CE   9  
ATOM   5055 N NZ   . LYS A 1 24 ? 3.927   -2.688  -7.020 1.00 1.37 1  24 LYS A NZ   9  
ATOM   5056 H H    . LYS A 1 24 ? 7.371   -6.115  -1.453 1.00 0.26 ?  24 LYS A H    9  
ATOM   5057 H HA   . LYS A 1 24 ? 6.982   -3.771  -3.066 1.00 0.25 ?  24 LYS A HA   9  
ATOM   5058 H HB2  . LYS A 1 24 ? 6.122   -5.900  -3.843 1.00 0.33 ?  24 LYS A HB2  9  
ATOM   5059 H HB3  . LYS A 1 24 ? 5.164   -6.092  -2.382 1.00 0.24 ?  24 LYS A HB3  9  
ATOM   5060 H HG2  . LYS A 1 24 ? 3.646   -5.454  -4.046 1.00 0.83 ?  24 LYS A HG2  9  
ATOM   5061 H HG3  . LYS A 1 24 ? 3.924   -3.996  -3.091 1.00 0.96 ?  24 LYS A HG3  9  
ATOM   5062 H HD2  . LYS A 1 24 ? 5.477   -3.173  -4.776 1.00 1.51 ?  24 LYS A HD2  9  
ATOM   5063 H HD3  . LYS A 1 24 ? 5.259   -4.652  -5.717 1.00 1.43 ?  24 LYS A HD3  9  
ATOM   5064 H HE2  . LYS A 1 24 ? 2.848   -4.115  -5.920 1.00 1.17 ?  24 LYS A HE2  9  
ATOM   5065 H HE3  . LYS A 1 24 ? 3.143   -2.600  -5.073 1.00 1.36 ?  24 LYS A HE3  9  
ATOM   5066 H HZ1  . LYS A 1 24 ? 3.076   -2.290  -7.467 1.00 1.91 ?  24 LYS A HZ1  9  
ATOM   5067 H HZ2  . LYS A 1 24 ? 4.351   -3.381  -7.668 1.00 1.69 ?  24 LYS A HZ2  9  
ATOM   5068 H HZ3  . LYS A 1 24 ? 4.610   -1.921  -6.862 1.00 1.76 ?  24 LYS A HZ3  9  
ATOM   5069 N N    . GLN A 1 25 ? 5.373   -4.143  -0.227 1.00 0.11 ?  25 GLN A N    9  
ATOM   5070 C CA   . GLN A 1 25 ? 4.700   -3.417  0.844  1.00 0.09 ?  25 GLN A CA   9  
ATOM   5071 C C    . GLN A 1 25 ? 5.518   -2.199  1.257  1.00 0.09 ?  25 GLN A C    9  
ATOM   5072 O O    . GLN A 1 25 ? 5.002   -1.083  1.328  1.00 0.12 ?  25 GLN A O    9  
ATOM   5073 C CB   . GLN A 1 25 ? 4.493   -4.324  2.056  1.00 0.14 ?  25 GLN A CB   9  
ATOM   5074 C CG   . GLN A 1 25 ? 3.557   -5.493  1.804  1.00 0.16 ?  25 GLN A CG   9  
ATOM   5075 C CD   . GLN A 1 25 ? 3.396   -6.373  3.027  1.00 0.22 ?  25 GLN A CD   9  
ATOM   5076 O OE1  . GLN A 1 25 ? 3.507   -5.908  4.162  1.00 0.41 ?  25 GLN A OE1  9  
ATOM   5077 N NE2  . GLN A 1 25 ? 3.131   -7.650  2.810  1.00 0.24 ?  25 GLN A NE2  9  
ATOM   5078 H H    . GLN A 1 25 ? 5.588   -5.095  -0.100 1.00 0.15 ?  25 GLN A H    9  
ATOM   5079 H HA   . GLN A 1 25 ? 3.740   -3.088  0.476  1.00 0.10 ?  25 GLN A HA   9  
ATOM   5080 H HB2  . GLN A 1 25 ? 5.450   -4.717  2.362  1.00 0.22 ?  25 GLN A HB2  9  
ATOM   5081 H HB3  . GLN A 1 25 ? 4.085   -3.732  2.861  1.00 0.18 ?  25 GLN A HB3  9  
ATOM   5082 H HG2  . GLN A 1 25 ? 2.589   -5.106  1.527  1.00 0.18 ?  25 GLN A HG2  9  
ATOM   5083 H HG3  . GLN A 1 25 ? 3.952   -6.090  0.996  1.00 0.21 ?  25 GLN A HG3  9  
ATOM   5084 H HE21 . GLN A 1 25 ? 3.053   -7.959  1.876  1.00 0.33 ?  25 GLN A HE21 9  
ATOM   5085 H HE22 . GLN A 1 25 ? 3.021   -8.239  3.586  1.00 0.27 ?  25 GLN A HE22 9  
ATOM   5086 N N    . GLN A 1 26 ? 6.799   -2.429  1.518  1.00 0.14 ?  26 GLN A N    9  
ATOM   5087 C CA   . GLN A 1 26 ? 7.712   -1.362  1.900  1.00 0.18 ?  26 GLN A CA   9  
ATOM   5088 C C    . GLN A 1 26 ? 7.834   -0.330  0.785  1.00 0.18 ?  26 GLN A C    9  
ATOM   5089 O O    . GLN A 1 26 ? 7.804   0.871   1.039  1.00 0.25 ?  26 GLN A O    9  
ATOM   5090 C CB   . GLN A 1 26 ? 9.089   -1.933  2.234  1.00 0.28 ?  26 GLN A CB   9  
ATOM   5091 C CG   . GLN A 1 26 ? 9.095   -2.863  3.439  1.00 0.38 ?  26 GLN A CG   9  
ATOM   5092 C CD   . GLN A 1 26 ? 10.478  -3.390  3.758  1.00 0.90 ?  26 GLN A CD   9  
ATOM   5093 O OE1  . GLN A 1 26 ? 11.486  -2.723  3.513  1.00 1.46 ?  26 GLN A OE1  9  
ATOM   5094 N NE2  . GLN A 1 26 ? 10.536  -4.586  4.316  1.00 1.59 ?  26 GLN A NE2  9  
ATOM   5095 H H    . GLN A 1 26 ? 7.138   -3.351  1.461  1.00 0.18 ?  26 GLN A H    9  
ATOM   5096 H HA   . GLN A 1 26 ? 7.309   -0.879  2.776  1.00 0.21 ?  26 GLN A HA   9  
ATOM   5097 H HB2  . GLN A 1 26 ? 9.450   -2.486  1.381  1.00 0.31 ?  26 GLN A HB2  9  
ATOM   5098 H HB3  . GLN A 1 26 ? 9.764   -1.117  2.433  1.00 0.31 ?  26 GLN A HB3  9  
ATOM   5099 H HG2  . GLN A 1 26 ? 8.726   -2.325  4.297  1.00 0.76 ?  26 GLN A HG2  9  
ATOM   5100 H HG3  . GLN A 1 26 ? 8.445   -3.703  3.236  1.00 0.60 ?  26 GLN A HG3  9  
ATOM   5101 H HE21 . GLN A 1 26 ? 9.692   -5.057  4.492  1.00 1.96 ?  26 GLN A HE21 9  
ATOM   5102 H HE22 . GLN A 1 26 ? 11.418  -4.954  4.533  1.00 1.99 ?  26 GLN A HE22 9  
ATOM   5103 N N    . ASN A 1 27 ? 7.956   -0.813  -0.447 1.00 0.19 ?  27 ASN A N    9  
ATOM   5104 C CA   . ASN A 1 27 ? 8.074   0.052   -1.620 1.00 0.26 ?  27 ASN A CA   9  
ATOM   5105 C C    . ASN A 1 27 ? 6.890   1.011   -1.702 1.00 0.22 ?  27 ASN A C    9  
ATOM   5106 O O    . ASN A 1 27 ? 7.056   2.221   -1.874 1.00 0.25 ?  27 ASN A O    9  
ATOM   5107 C CB   . ASN A 1 27 ? 8.131   -0.805  -2.890 1.00 0.38 ?  27 ASN A CB   9  
ATOM   5108 C CG   . ASN A 1 27 ? 8.407   0.002   -4.143 1.00 0.98 ?  27 ASN A CG   9  
ATOM   5109 O OD1  . ASN A 1 27 ? 7.502   0.602   -4.727 1.00 1.81 ?  27 ASN A OD1  9  
ATOM   5110 N ND2  . ASN A 1 27 ? 9.649   -0.019  -4.593 1.00 1.18 ?  27 ASN A ND2  9  
ATOM   5111 H H    . ASN A 1 27 ? 7.966   -1.789  -0.576 1.00 0.20 ?  27 ASN A H    9  
ATOM   5112 H HA   . ASN A 1 27 ? 8.985   0.621   -1.531 1.00 0.34 ?  27 ASN A HA   9  
ATOM   5113 H HB2  . ASN A 1 27 ? 8.916   -1.538  -2.782 1.00 0.77 ?  27 ASN A HB2  9  
ATOM   5114 H HB3  . ASN A 1 27 ? 7.189   -1.313  -3.013 1.00 0.92 ?  27 ASN A HB3  9  
ATOM   5115 H HD21 . ASN A 1 27 ? 10.314  -0.549  -4.099 1.00 1.16 ?  27 ASN A HD21 9  
ATOM   5116 H HD22 . ASN A 1 27 ? 9.857   0.497   -5.401 1.00 1.75 ?  27 ASN A HD22 9  
ATOM   5117 N N    . LEU A 1 28 ? 5.698   0.454   -1.557 1.00 0.19 ?  28 LEU A N    9  
ATOM   5118 C CA   . LEU A 1 28 ? 4.464   1.218   -1.634 1.00 0.24 ?  28 LEU A CA   9  
ATOM   5119 C C    . LEU A 1 28 ? 4.327   2.185   -0.463 1.00 0.24 ?  28 LEU A C    9  
ATOM   5120 O O    . LEU A 1 28 ? 4.008   3.362   -0.646 1.00 0.29 ?  28 LEU A O    9  
ATOM   5121 C CB   . LEU A 1 28 ? 3.276   0.264   -1.644 1.00 0.28 ?  28 LEU A CB   9  
ATOM   5122 C CG   . LEU A 1 28 ? 3.087   -0.551  -2.923 1.00 0.38 ?  28 LEU A CG   9  
ATOM   5123 C CD1  . LEU A 1 28 ? 2.008   -1.602  -2.727 1.00 0.88 ?  28 LEU A CD1  9  
ATOM   5124 C CD2  . LEU A 1 28 ? 2.722   0.358   -4.082 1.00 0.72 ?  28 LEU A CD2  9  
ATOM   5125 H H    . LEU A 1 28 ? 5.646   -0.515  -1.394 1.00 0.18 ?  28 LEU A H    9  
ATOM   5126 H HA   . LEU A 1 28 ? 4.473   1.780   -2.553 1.00 0.30 ?  28 LEU A HA   9  
ATOM   5127 H HB2  . LEU A 1 28 ? 3.399   -0.424  -0.823 1.00 0.28 ?  28 LEU A HB2  9  
ATOM   5128 H HB3  . LEU A 1 28 ? 2.386   0.840   -1.477 1.00 0.33 ?  28 LEU A HB3  9  
ATOM   5129 H HG   . LEU A 1 28 ? 4.011   -1.054  -3.165 1.00 0.78 ?  28 LEU A HG   9  
ATOM   5130 H HD11 . LEU A 1 28 ? 1.088   -1.123  -2.431 1.00 1.30 ?  28 LEU A HD11 9  
ATOM   5131 H HD12 . LEU A 1 28 ? 2.316   -2.298  -1.959 1.00 1.54 ?  28 LEU A HD12 9  
ATOM   5132 H HD13 . LEU A 1 28 ? 1.852   -2.135  -3.653 1.00 1.23 ?  28 LEU A HD13 9  
ATOM   5133 H HD21 . LEU A 1 28 ? 2.556   -0.238  -4.966 1.00 1.32 ?  28 LEU A HD21 9  
ATOM   5134 H HD22 . LEU A 1 28 ? 3.526   1.054   -4.261 1.00 1.40 ?  28 LEU A HD22 9  
ATOM   5135 H HD23 . LEU A 1 28 ? 1.820   0.901   -3.839 1.00 1.20 ?  28 LEU A HD23 9  
ATOM   5136 N N    . LYS A 1 29 ? 4.562   1.681   0.741  1.00 0.24 ?  29 LYS A N    9  
ATOM   5137 C CA   . LYS A 1 29 ? 4.416   2.486   1.946  1.00 0.32 ?  29 LYS A CA   9  
ATOM   5138 C C    . LYS A 1 29 ? 5.405   3.648   1.944  1.00 0.34 ?  29 LYS A C    9  
ATOM   5139 O O    . LYS A 1 29 ? 5.075   4.758   2.362  1.00 0.40 ?  29 LYS A O    9  
ATOM   5140 C CB   . LYS A 1 29 ? 4.611   1.621   3.194  1.00 0.42 ?  29 LYS A CB   9  
ATOM   5141 C CG   . LYS A 1 29 ? 4.371   2.365   4.501  1.00 0.71 ?  29 LYS A CG   9  
ATOM   5142 C CD   . LYS A 1 29 ? 2.903   2.737   4.691  1.00 1.19 ?  29 LYS A CD   9  
ATOM   5143 C CE   . LYS A 1 29 ? 2.050   1.536   5.084  1.00 1.23 ?  29 LYS A CE   9  
ATOM   5144 N NZ   . LYS A 1 29 ? 2.460   0.969   6.397  1.00 1.39 1  29 LYS A NZ   9  
ATOM   5145 H H    . LYS A 1 29 ? 4.833   0.738   0.822  1.00 0.22 ?  29 LYS A H    9  
ATOM   5146 H HA   . LYS A 1 29 ? 3.415   2.887   1.952  1.00 0.36 ?  29 LYS A HA   9  
ATOM   5147 H HB2  . LYS A 1 29 ? 3.925   0.788   3.149  1.00 0.78 ?  29 LYS A HB2  9  
ATOM   5148 H HB3  . LYS A 1 29 ? 5.623   1.243   3.200  1.00 0.60 ?  29 LYS A HB3  9  
ATOM   5149 H HG2  . LYS A 1 29 ? 4.677   1.734   5.318  1.00 1.23 ?  29 LYS A HG2  9  
ATOM   5150 H HG3  . LYS A 1 29 ? 4.964   3.268   4.500  1.00 1.29 ?  29 LYS A HG3  9  
ATOM   5151 H HD2  . LYS A 1 29 ? 2.831   3.484   5.466  1.00 1.64 ?  29 LYS A HD2  9  
ATOM   5152 H HD3  . LYS A 1 29 ? 2.524   3.145   3.765  1.00 1.75 ?  29 LYS A HD3  9  
ATOM   5153 H HE2  . LYS A 1 29 ? 1.019   1.852   5.147  1.00 1.53 ?  29 LYS A HE2  9  
ATOM   5154 H HE3  . LYS A 1 29 ? 2.145   0.774   4.326  1.00 1.48 ?  29 LYS A HE3  9  
ATOM   5155 H HZ1  . LYS A 1 29 ? 3.424   0.582   6.337  1.00 2.04 ?  29 LYS A HZ1  9  
ATOM   5156 H HZ2  . LYS A 1 29 ? 1.811   0.208   6.678  1.00 1.56 ?  29 LYS A HZ2  9  
ATOM   5157 H HZ3  . LYS A 1 29 ? 2.442   1.711   7.126  1.00 1.51 ?  29 LYS A HZ3  9  
ATOM   5158 N N    . LYS A 1 30 ? 6.615   3.393   1.462  1.00 0.34 ?  30 LYS A N    9  
ATOM   5159 C CA   . LYS A 1 30 ? 7.620   4.439   1.356  1.00 0.43 ?  30 LYS A CA   9  
ATOM   5160 C C    . LYS A 1 30 ? 7.284   5.390   0.218  1.00 0.42 ?  30 LYS A C    9  
ATOM   5161 O O    . LYS A 1 30 ? 7.566   6.582   0.305  1.00 0.47 ?  30 LYS A O    9  
ATOM   5162 C CB   . LYS A 1 30 ? 9.016   3.846   1.159  1.00 0.54 ?  30 LYS A CB   9  
ATOM   5163 C CG   . LYS A 1 30 ? 9.556   3.138   2.393  1.00 1.28 ?  30 LYS A CG   9  
ATOM   5164 C CD   . LYS A 1 30 ? 9.616   4.072   3.594  1.00 1.67 ?  30 LYS A CD   9  
ATOM   5165 C CE   . LYS A 1 30 ? 10.234  3.392   4.808  1.00 2.49 ?  30 LYS A CE   9  
ATOM   5166 N NZ   . LYS A 1 30 ? 9.479   2.175   5.211  1.00 3.14 1  30 LYS A NZ   9  
ATOM   5167 H H    . LYS A 1 30 ? 6.838   2.480   1.174  1.00 0.33 ?  30 LYS A H    9  
ATOM   5168 H HA   . LYS A 1 30 ? 7.607   4.997   2.279  1.00 0.48 ?  30 LYS A HA   9  
ATOM   5169 H HB2  . LYS A 1 30 ? 8.981   3.133   0.348  1.00 0.89 ?  30 LYS A HB2  9  
ATOM   5170 H HB3  . LYS A 1 30 ? 9.699   4.640   0.899  1.00 1.06 ?  30 LYS A HB3  9  
ATOM   5171 H HG2  . LYS A 1 30 ? 8.909   2.306   2.630  1.00 1.89 ?  30 LYS A HG2  9  
ATOM   5172 H HG3  . LYS A 1 30 ? 10.551  2.774   2.180  1.00 1.85 ?  30 LYS A HG3  9  
ATOM   5173 H HD2  . LYS A 1 30 ? 10.211  4.936   3.336  1.00 2.02 ?  30 LYS A HD2  9  
ATOM   5174 H HD3  . LYS A 1 30 ? 8.612   4.386   3.841  1.00 1.96 ?  30 LYS A HD3  9  
ATOM   5175 H HE2  . LYS A 1 30 ? 11.249  3.109   4.570  1.00 2.89 ?  30 LYS A HE2  9  
ATOM   5176 H HE3  . LYS A 1 30 ? 10.241  4.089   5.633  1.00 2.91 ?  30 LYS A HE3  9  
ATOM   5177 H HZ1  . LYS A 1 30 ? 8.480   2.412   5.384  1.00 3.57 ?  30 LYS A HZ1  9  
ATOM   5178 H HZ2  . LYS A 1 30 ? 9.880   1.776   6.081  1.00 3.62 ?  30 LYS A HZ2  9  
ATOM   5179 H HZ3  . LYS A 1 30 ? 9.527   1.455   4.463  1.00 3.29 ?  30 LYS A HZ3  9  
ATOM   5180 N N    . GLU A 1 31 ? 6.675   4.856   -0.838 1.00 0.42 ?  31 GLU A N    9  
ATOM   5181 C CA   . GLU A 1 31 ? 6.200   5.673   -1.953 1.00 0.49 ?  31 GLU A CA   9  
ATOM   5182 C C    . GLU A 1 31 ? 5.195   6.700   -1.448 1.00 0.52 ?  31 GLU A C    9  
ATOM   5183 O O    . GLU A 1 31 ? 5.232   7.870   -1.826 1.00 0.70 ?  31 GLU A O    9  
ATOM   5184 C CB   . GLU A 1 31 ? 5.549   4.790   -3.020 1.00 0.52 ?  31 GLU A CB   9  
ATOM   5185 C CG   . GLU A 1 31 ? 5.212   5.527   -4.306 1.00 0.87 ?  31 GLU A CG   9  
ATOM   5186 C CD   . GLU A 1 31 ? 6.442   6.054   -5.013 1.00 1.47 ?  31 GLU A CD   9  
ATOM   5187 O OE1  . GLU A 1 31 ? 7.313   5.243   -5.392 1.00 1.67 ?  31 GLU A OE1  9  
ATOM   5188 O OE2  . GLU A 1 31 ? 6.545   7.283   -5.193 1.00 2.30 -1 31 GLU A OE2  9  
ATOM   5189 H H    . GLU A 1 31 ? 6.550   3.880   -0.876 1.00 0.41 ?  31 GLU A H    9  
ATOM   5190 H HA   . GLU A 1 31 ? 7.047   6.186   -2.379 1.00 0.57 ?  31 GLU A HA   9  
ATOM   5191 H HB2  . GLU A 1 31 ? 6.219   3.981   -3.260 1.00 0.87 ?  31 GLU A HB2  9  
ATOM   5192 H HB3  . GLU A 1 31 ? 4.635   4.379   -2.619 1.00 0.80 ?  31 GLU A HB3  9  
ATOM   5193 H HG2  . GLU A 1 31 ? 4.697   4.850   -4.969 1.00 1.45 ?  31 GLU A HG2  9  
ATOM   5194 H HG3  . GLU A 1 31 ? 4.566   6.357   -4.069 1.00 1.49 ?  31 GLU A HG3  9  
ATOM   5195 N N    . LYS A 1 32 ? 4.296   6.238   -0.590 1.00 0.43 ?  32 LYS A N    9  
ATOM   5196 C CA   . LYS A 1 32 ? 3.323   7.108   0.047  1.00 0.55 ?  32 LYS A CA   9  
ATOM   5197 C C    . LYS A 1 32 ? 4.014   8.076   0.999  1.00 0.66 ?  32 LYS A C    9  
ATOM   5198 O O    . LYS A 1 32 ? 3.724   9.272   1.005  1.00 1.23 ?  32 LYS A O    9  
ATOM   5199 C CB   . LYS A 1 32 ? 2.289   6.277   0.811  1.00 0.74 ?  32 LYS A CB   9  
ATOM   5200 C CG   . LYS A 1 32 ? 1.334   7.123   1.633  1.00 1.46 ?  32 LYS A CG   9  
ATOM   5201 C CD   . LYS A 1 32 ? 0.346   6.273   2.409  1.00 2.20 ?  32 LYS A CD   9  
ATOM   5202 C CE   . LYS A 1 32 ? -0.586  7.136   3.243  1.00 3.14 ?  32 LYS A CE   9  
ATOM   5203 N NZ   . LYS A 1 32 ? -1.274  8.169   2.422  1.00 3.91 1  32 LYS A NZ   9  
ATOM   5204 H H    . LYS A 1 32 ? 4.287   5.277   -0.380 1.00 0.38 ?  32 LYS A H    9  
ATOM   5205 H HA   . LYS A 1 32 ? 2.822   7.673   -0.725 1.00 0.79 ?  32 LYS A HA   9  
ATOM   5206 H HB2  . LYS A 1 32 ? 1.710   5.701   0.105  1.00 1.02 ?  32 LYS A HB2  9  
ATOM   5207 H HB3  . LYS A 1 32 ? 2.805   5.602   1.479  1.00 1.25 ?  32 LYS A HB3  9  
ATOM   5208 H HG2  . LYS A 1 32 ? 1.908   7.715   2.329  1.00 2.11 ?  32 LYS A HG2  9  
ATOM   5209 H HG3  . LYS A 1 32 ? 0.789   7.774   0.968  1.00 1.77 ?  32 LYS A HG3  9  
ATOM   5210 H HD2  . LYS A 1 32 ? -0.240  5.690   1.717  1.00 2.36 ?  32 LYS A HD2  9  
ATOM   5211 H HD3  . LYS A 1 32 ? 0.893   5.611   3.066  1.00 2.67 ?  32 LYS A HD3  9  
ATOM   5212 H HE2  . LYS A 1 32 ? -1.330  6.502   3.702  1.00 3.54 ?  32 LYS A HE2  9  
ATOM   5213 H HE3  . LYS A 1 32 ? -0.009  7.626   4.014  1.00 3.37 ?  32 LYS A HE3  9  
ATOM   5214 H HZ1  . LYS A 1 32 ? -0.575  8.809   1.989  1.00 3.96 ?  32 LYS A HZ1  9  
ATOM   5215 H HZ2  . LYS A 1 32 ? -1.914  8.732   3.018  1.00 4.35 ?  32 LYS A HZ2  9  
ATOM   5216 H HZ3  . LYS A 1 32 ? -1.829  7.723   1.669  1.00 4.36 ?  32 LYS A HZ3  9  
ATOM   5217 N N    . GLY A 1 33 ? 4.935   7.544   1.790  1.00 0.94 ?  33 GLY A N    9  
ATOM   5218 C CA   . GLY A 1 33 ? 5.609   8.332   2.802  1.00 1.34 ?  33 GLY A CA   9  
ATOM   5219 C C    . GLY A 1 33 ? 6.421   9.480   2.235  1.00 1.43 ?  33 GLY A C    9  
ATOM   5220 O O    . GLY A 1 33 ? 6.080   10.647  2.438  1.00 1.99 ?  33 GLY A O    9  
ATOM   5221 H H    . GLY A 1 33 ? 5.158   6.594   1.689  1.00 1.26 ?  33 GLY A H    9  
ATOM   5222 H HA2  . GLY A 1 33 ? 4.870   8.732   3.475  1.00 1.68 ?  33 GLY A HA2  9  
ATOM   5223 H HA3  . GLY A 1 33 ? 6.269   7.684   3.360  1.00 1.72 ?  33 GLY A HA3  9  
ATOM   5224 N N    . LEU A 1 34 ? 7.485   9.162   1.514  1.00 1.27 ?  34 LEU A N    9  
ATOM   5225 C CA   . LEU A 1 34 ? 8.415   10.188  1.061  1.00 1.73 ?  34 LEU A CA   9  
ATOM   5226 C C    . LEU A 1 34 ? 9.074   9.816   -0.263 1.00 1.86 ?  34 LEU A C    9  
ATOM   5227 O O    . LEU A 1 34 ? 9.353   10.682  -1.094 1.00 2.56 ?  34 LEU A O    9  
ATOM   5228 C CB   . LEU A 1 34 ? 9.495   10.402  2.124  1.00 1.91 ?  34 LEU A CB   9  
ATOM   5229 C CG   . LEU A 1 34 ? 10.454  11.564  1.862  1.00 2.29 ?  34 LEU A CG   9  
ATOM   5230 C CD1  . LEU A 1 34 ? 9.715   12.889  1.941  1.00 2.76 ?  34 LEU A CD1  9  
ATOM   5231 C CD2  . LEU A 1 34 ? 11.611  11.536  2.848  1.00 3.08 ?  34 LEU A CD2  9  
ATOM   5232 H H    . LEU A 1 34 ? 7.641   8.225   1.272  1.00 1.11 ?  34 LEU A H    9  
ATOM   5233 H HA   . LEU A 1 34 ? 7.862   11.103  0.933  1.00 2.15 ?  34 LEU A HA   9  
ATOM   5234 H HB2  . LEU A 1 34 ? 9.006   10.572  3.070  1.00 2.24 ?  34 LEU A HB2  9  
ATOM   5235 H HB3  . LEU A 1 34 ? 10.077  9.494   2.199  1.00 2.03 ?  34 LEU A HB3  9  
ATOM   5236 H HG   . LEU A 1 34 ? 10.861  11.467  0.865  1.00 2.45 ?  34 LEU A HG   9  
ATOM   5237 H HD11 . LEU A 1 34 ? 8.953   12.924  1.178  1.00 3.05 ?  34 LEU A HD11 9  
ATOM   5238 H HD12 . LEU A 1 34 ? 10.413  13.698  1.791  1.00 3.27 ?  34 LEU A HD12 9  
ATOM   5239 H HD13 . LEU A 1 34 ? 9.255   12.987  2.912  1.00 2.92 ?  34 LEU A HD13 9  
ATOM   5240 H HD21 . LEU A 1 34 ? 11.227  11.610  3.855  1.00 3.53 ?  34 LEU A HD21 9  
ATOM   5241 H HD22 . LEU A 1 34 ? 12.272  12.368  2.653  1.00 3.41 ?  34 LEU A HD22 9  
ATOM   5242 H HD23 . LEU A 1 34 ? 12.156  10.610  2.739  1.00 3.42 ?  34 LEU A HD23 9  
ATOM   5243 N N    . PHE A 1 35 ? 9.318   8.531   -0.458 1.00 1.42 ?  35 PHE A N    9  
ATOM   5244 C CA   . PHE A 1 35 ? 10.070  8.066   -1.609 1.00 1.78 ?  35 PHE A CA   9  
ATOM   5245 C C    . PHE A 1 35 ? 9.144   7.412   -2.620 1.00 2.17 ?  35 PHE A C    9  
ATOM   5246 O O    . PHE A 1 35 ? 9.217   6.209   -2.864 1.00 2.84 ?  35 PHE A O    9  
ATOM   5247 C CB   . PHE A 1 35 ? 11.142  7.065   -1.168 1.00 1.55 ?  35 PHE A CB   9  
ATOM   5248 C CG   . PHE A 1 35 ? 11.947  7.524   0.013  1.00 1.48 ?  35 PHE A CG   9  
ATOM   5249 C CD1  . PHE A 1 35 ? 11.731  6.976   1.269  1.00 1.95 ?  35 PHE A CD1  9  
ATOM   5250 C CD2  . PHE A 1 35 ? 12.915  8.503   -0.128 1.00 1.61 ?  35 PHE A CD2  9  
ATOM   5251 C CE1  . PHE A 1 35 ? 12.467  7.398   2.359  1.00 2.46 ?  35 PHE A CE1  9  
ATOM   5252 C CE2  . PHE A 1 35 ? 13.654  8.926   0.959  1.00 1.99 ?  35 PHE A CE2  9  
ATOM   5253 C CZ   . PHE A 1 35 ? 13.429  8.374   2.203  1.00 2.41 ?  35 PHE A CZ   9  
ATOM   5254 H H    . PHE A 1 35 ? 8.967   7.874   0.178  1.00 1.04 ?  35 PHE A H    9  
ATOM   5255 H HA   . PHE A 1 35 ? 10.545  8.918   -2.067 1.00 2.31 ?  35 PHE A HA   9  
ATOM   5256 H HB2  . PHE A 1 35 ? 10.665  6.135   -0.904 1.00 1.53 ?  35 PHE A HB2  9  
ATOM   5257 H HB3  . PHE A 1 35 ? 11.821  6.895   -1.989 1.00 1.88 ?  35 PHE A HB3  9  
ATOM   5258 H HD1  . PHE A 1 35 ? 10.979  6.212   1.392  1.00 2.21 ?  35 PHE A HD1  9  
ATOM   5259 H HD2  . PHE A 1 35 ? 13.092  8.937   -1.100 1.00 1.82 ?  35 PHE A HD2  9  
ATOM   5260 H HE1  . PHE A 1 35 ? 12.290  6.964   3.331  1.00 3.08 ?  35 PHE A HE1  9  
ATOM   5261 H HE2  . PHE A 1 35 ? 14.404  9.690   0.835  1.00 2.26 ?  35 PHE A HE2  9  
ATOM   5262 H HZ   . PHE A 1 35 ? 14.005  8.704   3.054  1.00 2.93 ?  35 PHE A HZ   9  
HETATM 5263 N N    . NH2 A 1 36 ? 8.274   8.207   -3.210 1.00 2.32 ?  36 NH2 A N    9  
HETATM 5264 H HN1  . NH2 A 1 36 ? 8.274   9.157   -2.963 1.00 2.41 ?  36 NH2 A HN1  9  
HETATM 5265 H HN2  . NH2 A 1 36 ? 7.660   7.816   -3.873 1.00 2.69 ?  36 NH2 A HN2  9  
ATOM   5266 N N    . LEU A 1 1  ? -6.525  4.249   7.730  1.00 1.11 ?  1  LEU A N    10 
ATOM   5267 C CA   . LEU A 1 1  ? -6.911  4.504   6.324  1.00 0.77 ?  1  LEU A CA   10 
ATOM   5268 C C    . LEU A 1 1  ? -8.160  3.715   5.963  1.00 0.62 ?  1  LEU A C    10 
ATOM   5269 O O    . LEU A 1 1  ? -8.235  2.508   6.202  1.00 0.66 ?  1  LEU A O    10 
ATOM   5270 C CB   . LEU A 1 1  ? -5.774  4.126   5.368  1.00 0.91 ?  1  LEU A CB   10 
ATOM   5271 C CG   . LEU A 1 1  ? -4.505  4.979   5.471  1.00 1.01 ?  1  LEU A CG   10 
ATOM   5272 C CD1  . LEU A 1 1  ? -3.445  4.470   4.505  1.00 1.23 ?  1  LEU A CD1  10 
ATOM   5273 C CD2  . LEU A 1 1  ? -4.814  6.442   5.190  1.00 1.78 ?  1  LEU A CD2  10 
ATOM   5274 H H1   . LEU A 1 1  ? -6.303  3.244   7.865  1.00 1.40 ?  1  LEU A H1   10 
ATOM   5275 H H2   . LEU A 1 1  ? -7.308  4.505   8.364  1.00 1.62 ?  1  LEU A H2   10 
ATOM   5276 H H3   . LEU A 1 1  ? -5.693  4.816   7.983  1.00 1.61 ?  1  LEU A H3   10 
ATOM   5277 H HA   . LEU A 1 1  ? -7.126  5.556   6.219  1.00 0.75 ?  1  LEU A HA   10 
ATOM   5278 H HB2  . LEU A 1 1  ? -5.504  3.097   5.558  1.00 1.23 ?  1  LEU A HB2  10 
ATOM   5279 H HB3  . LEU A 1 1  ? -6.146  4.199   4.357  1.00 1.43 ?  1  LEU A HB3  10 
ATOM   5280 H HG   . LEU A 1 1  ? -4.108  4.904   6.472  1.00 1.75 ?  1  LEU A HG   10 
ATOM   5281 H HD11 . LEU A 1 1  ? -3.836  4.493   3.498  1.00 1.48 ?  1  LEU A HD11 10 
ATOM   5282 H HD12 . LEU A 1 1  ? -3.177  3.458   4.765  1.00 1.80 ?  1  LEU A HD12 10 
ATOM   5283 H HD13 . LEU A 1 1  ? -2.571  5.101   4.566  1.00 1.91 ?  1  LEU A HD13 10 
ATOM   5284 H HD21 . LEU A 1 1  ? -5.270  6.533   4.216  1.00 2.17 ?  1  LEU A HD21 10 
ATOM   5285 H HD22 . LEU A 1 1  ? -3.899  7.013   5.213  1.00 2.45 ?  1  LEU A HD22 10 
ATOM   5286 H HD23 . LEU A 1 1  ? -5.491  6.818   5.940  1.00 2.19 ?  1  LEU A HD23 10 
ATOM   5287 N N    . SER A 1 2  ? -9.135  4.402   5.388  1.00 0.58 ?  2  SER A N    10 
ATOM   5288 C CA   . SER A 1 2  ? -10.370 3.772   4.956  1.00 0.59 ?  2  SER A CA   10 
ATOM   5289 C C    . SER A 1 2  ? -10.103 2.865   3.761  1.00 0.53 ?  2  SER A C    10 
ATOM   5290 O O    . SER A 1 2  ? -9.236  3.167   2.950  1.00 0.45 ?  2  SER A O    10 
ATOM   5291 C CB   . SER A 1 2  ? -11.391 4.847   4.593  1.00 0.72 ?  2  SER A CB   10 
ATOM   5292 O OG   . SER A 1 2  ? -11.512 5.800   5.637  1.00 1.28 ?  2  SER A OG   10 
ATOM   5293 H H    . SER A 1 2  ? -9.019  5.365   5.248  1.00 0.63 ?  2  SER A H    10 
ATOM   5294 H HA   . SER A 1 2  ? -10.751 3.180   5.773  1.00 0.67 ?  2  SER A HA   10 
ATOM   5295 H HB2  . SER A 1 2  ? -11.073 5.353   3.694  1.00 1.39 ?  2  SER A HB2  10 
ATOM   5296 H HB3  . SER A 1 2  ? -12.354 4.387   4.427  1.00 1.05 ?  2  SER A HB3  10 
ATOM   5297 H HG   . SER A 1 2  ? -10.916 6.540   5.469  1.00 1.66 ?  2  SER A HG   10 
ATOM   5298 N N    . ASP A 1 3  ? -10.849 1.768   3.657  1.00 0.61 ?  3  ASP A N    10 
ATOM   5299 C CA   . ASP A 1 3  ? -10.596 0.738   2.641  1.00 0.60 ?  3  ASP A CA   10 
ATOM   5300 C C    . ASP A 1 3  ? -10.421 1.337   1.250  1.00 0.49 ?  3  ASP A C    10 
ATOM   5301 O O    . ASP A 1 3  ? -9.412  1.097   0.582  1.00 0.40 ?  3  ASP A O    10 
ATOM   5302 C CB   . ASP A 1 3  ? -11.737 -0.285  2.606  1.00 0.76 ?  3  ASP A CB   10 
ATOM   5303 C CG   . ASP A 1 3  ? -11.834 -1.108  3.873  1.00 1.42 ?  3  ASP A CG   10 
ATOM   5304 O OD1  . ASP A 1 3  ? -11.101 -2.113  3.991  1.00 1.93 ?  3  ASP A OD1  10 
ATOM   5305 O OD2  . ASP A 1 3  ? -12.636 -0.751  4.763  1.00 2.11 -1 3  ASP A OD2  10 
ATOM   5306 H H    . ASP A 1 3  ? -11.597 1.645   4.278  1.00 0.71 ?  3  ASP A H    10 
ATOM   5307 H HA   . ASP A 1 3  ? -9.685  0.230   2.913  1.00 0.62 ?  3  ASP A HA   10 
ATOM   5308 H HB2  . ASP A 1 3  ? -12.673 0.234   2.470  1.00 1.30 ?  3  ASP A HB2  10 
ATOM   5309 H HB3  . ASP A 1 3  ? -11.581 -0.956  1.775  1.00 1.20 ?  3  ASP A HB3  10 
ATOM   5310 N N    . GLU A 1 4  ? -11.390 2.135   0.829  1.00 0.58 ?  4  GLU A N    10 
ATOM   5311 C CA   . GLU A 1 4  ? -11.366 2.713   -0.507 1.00 0.58 ?  4  GLU A CA   10 
ATOM   5312 C C    . GLU A 1 4  ? -10.303 3.799   -0.631 1.00 0.43 ?  4  GLU A C    10 
ATOM   5313 O O    . GLU A 1 4  ? -9.842  4.097   -1.730 1.00 0.38 ?  4  GLU A O    10 
ATOM   5314 C CB   . GLU A 1 4  ? -12.735 3.274   -0.885 1.00 0.80 ?  4  GLU A CB   10 
ATOM   5315 C CG   . GLU A 1 4  ? -13.800 2.206   -1.059 1.00 1.35 ?  4  GLU A CG   10 
ATOM   5316 C CD   . GLU A 1 4  ? -15.061 2.754   -1.685 1.00 1.81 ?  4  GLU A CD   10 
ATOM   5317 O OE1  . GLU A 1 4  ? -16.025 3.025   -0.942 1.00 2.46 ?  4  GLU A OE1  10 
ATOM   5318 O OE2  . GLU A 1 4  ? -15.097 2.920   -2.921 1.00 2.08 -1 4  GLU A OE2  10 
ATOM   5319 H H    . GLU A 1 4  ? -12.138 2.340   1.431  1.00 0.68 ?  4  GLU A H    10 
ATOM   5320 H HA   . GLU A 1 4  ? -11.121 1.918   -1.194 1.00 0.59 ?  4  GLU A HA   10 
ATOM   5321 H HB2  . GLU A 1 4  ? -13.060 3.954   -0.110 1.00 1.07 ?  4  GLU A HB2  10 
ATOM   5322 H HB3  . GLU A 1 4  ? -12.644 3.817   -1.813 1.00 1.03 ?  4  GLU A HB3  10 
ATOM   5323 H HG2  . GLU A 1 4  ? -13.408 1.426   -1.695 1.00 1.90 ?  4  GLU A HG2  10 
ATOM   5324 H HG3  . GLU A 1 4  ? -14.044 1.792   -0.092 1.00 1.77 ?  4  GLU A HG3  10 
ATOM   5325 N N    . ASP A 1 5  ? -9.903  4.378   0.492  1.00 0.44 ?  5  ASP A N    10 
ATOM   5326 C CA   . ASP A 1 5  ? -8.877  5.416   0.482  1.00 0.40 ?  5  ASP A CA   10 
ATOM   5327 C C    . ASP A 1 5  ? -7.516  4.769   0.301  1.00 0.28 ?  5  ASP A C    10 
ATOM   5328 O O    . ASP A 1 5  ? -6.699  5.217   -0.500 1.00 0.29 ?  5  ASP A O    10 
ATOM   5329 C CB   . ASP A 1 5  ? -8.920  6.229   1.777  1.00 0.52 ?  5  ASP A CB   10 
ATOM   5330 C CG   . ASP A 1 5  ? -7.856  7.309   1.830  1.00 1.11 ?  5  ASP A CG   10 
ATOM   5331 O OD1  . ASP A 1 5  ? -7.999  8.328   1.121  1.00 1.17 ?  5  ASP A OD1  10 
ATOM   5332 O OD2  . ASP A 1 5  ? -6.884  7.157   2.598  1.00 1.82 -1 5  ASP A OD2  10 
ATOM   5333 H H    . ASP A 1 5  ? -10.278 4.081   1.351  1.00 0.51 ?  5  ASP A H    10 
ATOM   5334 H HA   . ASP A 1 5  ? -9.070  6.068   -0.358 1.00 0.43 ?  5  ASP A HA   10 
ATOM   5335 H HB2  . ASP A 1 5  ? -9.887  6.699   1.867  1.00 1.00 ?  5  ASP A HB2  10 
ATOM   5336 H HB3  . ASP A 1 5  ? -8.772  5.564   2.616  1.00 0.82 ?  5  ASP A HB3  10 
ATOM   5337 N N    . PHE A 1 6  ? -7.308  3.688   1.041  1.00 0.24 ?  6  PHE A N    10 
ATOM   5338 C CA   . PHE A 1 6  ? -6.125  2.856   0.908  1.00 0.18 ?  6  PHE A CA   10 
ATOM   5339 C C    . PHE A 1 6  ? -6.019  2.349   -0.524 1.00 0.13 ?  6  PHE A C    10 
ATOM   5340 O O    . PHE A 1 6  ? -4.949  2.387   -1.137 1.00 0.15 ?  6  PHE A O    10 
ATOM   5341 C CB   . PHE A 1 6  ? -6.235  1.682   1.885  1.00 0.23 ?  6  PHE A CB   10 
ATOM   5342 C CG   . PHE A 1 6  ? -5.002  0.831   1.991  1.00 0.25 ?  6  PHE A CG   10 
ATOM   5343 C CD1  . PHE A 1 6  ? -4.118  0.990   3.043  1.00 0.43 ?  6  PHE A CD1  10 
ATOM   5344 C CD2  . PHE A 1 6  ? -4.723  -0.117  1.022  1.00 0.25 ?  6  PHE A CD2  10 
ATOM   5345 C CE1  . PHE A 1 6  ? -2.979  0.218   3.128  1.00 0.50 ?  6  PHE A CE1  10 
ATOM   5346 C CE2  . PHE A 1 6  ? -3.585  -0.893  1.102  1.00 0.35 ?  6  PHE A CE2  10 
ATOM   5347 C CZ   . PHE A 1 6  ? -2.739  -0.759  2.215  1.00 0.43 ?  6  PHE A CZ   10 
ATOM   5348 H H    . PHE A 1 6  ? -7.983  3.439   1.708  1.00 0.29 ?  6  PHE A H    10 
ATOM   5349 H HA   . PHE A 1 6  ? -5.256  3.449   1.147  1.00 0.23 ?  6  PHE A HA   10 
ATOM   5350 H HB2  . PHE A 1 6  ? -6.451  2.067   2.870  1.00 0.31 ?  6  PHE A HB2  10 
ATOM   5351 H HB3  . PHE A 1 6  ? -7.048  1.046   1.572  1.00 0.27 ?  6  PHE A HB3  10 
ATOM   5352 H HD1  . PHE A 1 6  ? -4.327  1.726   3.805  1.00 0.55 ?  6  PHE A HD1  10 
ATOM   5353 H HD2  . PHE A 1 6  ? -5.406  -0.248  0.198  1.00 0.29 ?  6  PHE A HD2  10 
ATOM   5354 H HE1  . PHE A 1 6  ? -2.298  0.353   3.953  1.00 0.65 ?  6  PHE A HE1  10 
ATOM   5355 H HE2  . PHE A 1 6  ? -3.377  -1.629  0.341  1.00 0.43 ?  6  PHE A HE2  10 
ATOM   5356 H HZ   . PHE A 1 6  ? -1.859  -1.378  2.301  1.00 0.51 ?  6  PHE A HZ   10 
ATOM   5357 N N    . LYS A 1 7  ? -7.148  1.888   -1.052 1.00 0.13 ?  7  LYS A N    10 
ATOM   5358 C CA   . LYS A 1 7  ? -7.221  1.441   -2.433 1.00 0.15 ?  7  LYS A CA   10 
ATOM   5359 C C    . LYS A 1 7  ? -6.867  2.582   -3.382 1.00 0.19 ?  7  LYS A C    10 
ATOM   5360 O O    . LYS A 1 7  ? -6.172  2.382   -4.370 1.00 0.23 ?  7  LYS A O    10 
ATOM   5361 C CB   . LYS A 1 7  ? -8.621  0.925   -2.757 1.00 0.23 ?  7  LYS A CB   10 
ATOM   5362 C CG   . LYS A 1 7  ? -8.712  0.255   -4.118 1.00 0.30 ?  7  LYS A CG   10 
ATOM   5363 C CD   . LYS A 1 7  ? -10.154 0.006   -4.532 1.00 0.44 ?  7  LYS A CD   10 
ATOM   5364 C CE   . LYS A 1 7  ? -10.878 -0.899  -3.551 1.00 1.26 ?  7  LYS A CE   10 
ATOM   5365 N NZ   . LYS A 1 7  ? -12.276 -1.169  -3.973 1.00 2.06 1  7  LYS A NZ   10 
ATOM   5366 H H    . LYS A 1 7  ? -7.952  1.830   -0.487 1.00 0.18 ?  7  LYS A H    10 
ATOM   5367 H HA   . LYS A 1 7  ? -6.507  0.640   -2.563 1.00 0.15 ?  7  LYS A HA   10 
ATOM   5368 H HB2  . LYS A 1 7  ? -8.914  0.210   -2.002 1.00 0.28 ?  7  LYS A HB2  10 
ATOM   5369 H HB3  . LYS A 1 7  ? -9.309  1.755   -2.742 1.00 0.25 ?  7  LYS A HB3  10 
ATOM   5370 H HG2  . LYS A 1 7  ? -8.243  0.893   -4.850 1.00 0.31 ?  7  LYS A HG2  10 
ATOM   5371 H HG3  . LYS A 1 7  ? -8.192  -0.691  -4.078 1.00 0.36 ?  7  LYS A HG3  10 
ATOM   5372 H HD2  . LYS A 1 7  ? -10.672 0.953   -4.581 1.00 1.10 ?  7  LYS A HD2  10 
ATOM   5373 H HD3  . LYS A 1 7  ? -10.159 -0.458  -5.507 1.00 0.92 ?  7  LYS A HD3  10 
ATOM   5374 H HE2  . LYS A 1 7  ? -10.346 -1.835  -3.484 1.00 1.83 ?  7  LYS A HE2  10 
ATOM   5375 H HE3  . LYS A 1 7  ? -10.890 -0.422  -2.582 1.00 1.84 ?  7  LYS A HE3  10 
ATOM   5376 H HZ1  . LYS A 1 7  ? -12.767 -1.732  -3.250 1.00 2.69 ?  7  LYS A HZ1  10 
ATOM   5377 H HZ2  . LYS A 1 7  ? -12.286 -1.694  -4.872 1.00 2.55 ?  7  LYS A HZ2  10 
ATOM   5378 H HZ3  . LYS A 1 7  ? -12.788 -0.275  -4.108 1.00 2.30 ?  7  LYS A HZ3  10 
ATOM   5379 N N    . ALA A 1 8  ? -7.351  3.778   -3.075 1.00 0.22 ?  8  ALA A N    10 
ATOM   5380 C CA   . ALA A 1 8  ? -7.060  4.951   -3.891 1.00 0.30 ?  8  ALA A CA   10 
ATOM   5381 C C    . ALA A 1 8  ? -5.573  5.299   -3.851 1.00 0.35 ?  8  ALA A C    10 
ATOM   5382 O O    . ALA A 1 8  ? -5.025  5.828   -4.819 1.00 0.45 ?  8  ALA A O    10 
ATOM   5383 C CB   . ALA A 1 8  ? -7.896  6.134   -3.430 1.00 0.35 ?  8  ALA A CB   10 
ATOM   5384 H H    . ALA A 1 8  ? -7.933  3.872   -2.289 1.00 0.22 ?  8  ALA A H    10 
ATOM   5385 H HA   . ALA A 1 8  ? -7.335  4.722   -4.910 1.00 0.34 ?  8  ALA A HA   10 
ATOM   5386 H HB1  . ALA A 1 8  ? -7.701  6.984   -4.069 1.00 1.02 ?  8  ALA A HB1  10 
ATOM   5387 H HB2  . ALA A 1 8  ? -7.637  6.382   -2.412 1.00 1.02 ?  8  ALA A HB2  10 
ATOM   5388 H HB3  . ALA A 1 8  ? -8.943  5.876   -3.483 1.00 1.04 ?  8  ALA A HB3  10 
ATOM   5389 N N    . VAL A 1 9  ? -4.929  5.009   -2.726 1.00 0.31 ?  9  VAL A N    10 
ATOM   5390 C CA   . VAL A 1 9  ? -3.498  5.251   -2.580 1.00 0.39 ?  9  VAL A CA   10 
ATOM   5391 C C    . VAL A 1 9  ? -2.680  4.234   -3.373 1.00 0.38 ?  9  VAL A C    10 
ATOM   5392 O O    . VAL A 1 9  ? -1.907  4.592   -4.267 1.00 0.49 ?  9  VAL A O    10 
ATOM   5393 C CB   . VAL A 1 9  ? -3.050  5.181   -1.099 1.00 0.42 ?  9  VAL A CB   10 
ATOM   5394 C CG1  . VAL A 1 9  ? -1.555  5.435   -0.977 1.00 0.52 ?  9  VAL A CG1  10 
ATOM   5395 C CG2  . VAL A 1 9  ? -3.821  6.168   -0.242 1.00 0.50 ?  9  VAL A CG2  10 
ATOM   5396 H H    . VAL A 1 9  ? -5.433  4.632   -1.968 1.00 0.26 ?  9  VAL A H    10 
ATOM   5397 H HA   . VAL A 1 9  ? -3.287  6.242   -2.952 1.00 0.47 ?  9  VAL A HA   10 
ATOM   5398 H HB   . VAL A 1 9  ? -3.252  4.185   -0.731 1.00 0.37 ?  9  VAL A HB   10 
ATOM   5399 H HG11 . VAL A 1 9  ? -1.267  5.397   0.063  1.00 0.97 ?  9  VAL A HG11 10 
ATOM   5400 H HG12 . VAL A 1 9  ? -1.321  6.408   -1.381 1.00 0.84 ?  9  VAL A HG12 10 
ATOM   5401 H HG13 . VAL A 1 9  ? -1.016  4.677   -1.527 1.00 1.18 ?  9  VAL A HG13 10 
ATOM   5402 H HG21 . VAL A 1 9  ? -4.879  5.960   -0.317 1.00 0.95 ?  9  VAL A HG21 10 
ATOM   5403 H HG22 . VAL A 1 9  ? -3.625  7.170   -0.585 1.00 0.76 ?  9  VAL A HG22 10 
ATOM   5404 H HG23 . VAL A 1 9  ? -3.508  6.070   0.788  1.00 0.91 ?  9  VAL A HG23 10 
ATOM   5405 N N    . PHE A 1 10 ? -2.870  2.965   -3.045 1.00 0.29 ?  10 PHE A N    10 
ATOM   5406 C CA   . PHE A 1 10 ? -1.993  1.910   -3.532 1.00 0.33 ?  10 PHE A CA   10 
ATOM   5407 C C    . PHE A 1 10 ? -2.502  1.262   -4.814 1.00 0.35 ?  10 PHE A C    10 
ATOM   5408 O O    . PHE A 1 10 ? -1.713  0.781   -5.626 1.00 0.45 ?  10 PHE A O    10 
ATOM   5409 C CB   . PHE A 1 10 ? -1.821  0.857   -2.442 1.00 0.32 ?  10 PHE A CB   10 
ATOM   5410 C CG   . PHE A 1 10 ? -1.145  1.393   -1.215 1.00 0.33 ?  10 PHE A CG   10 
ATOM   5411 C CD1  . PHE A 1 10 ? -1.881  1.790   -0.113 1.00 0.39 ?  10 PHE A CD1  10 
ATOM   5412 C CD2  . PHE A 1 10 ? 0.229   1.506   -1.173 1.00 0.39 ?  10 PHE A CD2  10 
ATOM   5413 C CE1  . PHE A 1 10 ? -1.254  2.289   1.012  1.00 0.41 ?  10 PHE A CE1  10 
ATOM   5414 C CE2  . PHE A 1 10 ? 0.865   2.002   -0.054 1.00 0.42 ?  10 PHE A CE2  10 
ATOM   5415 C CZ   . PHE A 1 10 ? 0.122   2.393   1.042  1.00 0.37 ?  10 PHE A CZ   10 
ATOM   5416 H H    . PHE A 1 10 ? -3.617  2.732   -2.449 1.00 0.22 ?  10 PHE A H    10 
ATOM   5417 H HA   . PHE A 1 10 ? -1.032  2.353   -3.732 1.00 0.39 ?  10 PHE A HA   10 
ATOM   5418 H HB2  . PHE A 1 10 ? -2.792  0.484   -2.152 1.00 0.30 ?  10 PHE A HB2  10 
ATOM   5419 H HB3  . PHE A 1 10 ? -1.223  0.043   -2.825 1.00 0.37 ?  10 PHE A HB3  10 
ATOM   5420 H HD1  . PHE A 1 10 ? -2.959  1.704   -0.133 1.00 0.48 ?  10 PHE A HD1  10 
ATOM   5421 H HD2  . PHE A 1 10 ? 0.808   1.201   -2.031 1.00 0.47 ?  10 PHE A HD2  10 
ATOM   5422 H HE1  . PHE A 1 10 ? -1.839  2.600   1.865  1.00 0.50 ?  10 PHE A HE1  10 
ATOM   5423 H HE2  . PHE A 1 10 ? 1.939   2.082   -0.037 1.00 0.52 ?  10 PHE A HE2  10 
ATOM   5424 H HZ   . PHE A 1 10 ? 0.616   2.780   1.919  1.00 0.39 ?  10 PHE A HZ   10 
ATOM   5425 N N    . GLY A 1 11 ? -3.808  1.256   -5.001 1.00 0.28 ?  11 GLY A N    10 
ATOM   5426 C CA   . GLY A 1 11 ? -4.384  0.627   -6.170 1.00 0.31 ?  11 GLY A CA   10 
ATOM   5427 C C    . GLY A 1 11 ? -5.035  -0.703  -5.848 1.00 0.29 ?  11 GLY A C    10 
ATOM   5428 O O    . GLY A 1 11 ? -5.601  -1.354  -6.724 1.00 0.36 ?  11 GLY A O    10 
ATOM   5429 H H    . GLY A 1 11 ? -4.394  1.698   -4.349 1.00 0.24 ?  11 GLY A H    10 
ATOM   5430 H HA2  . GLY A 1 11 ? -5.128  1.285   -6.590 1.00 0.32 ?  11 GLY A HA2  10 
ATOM   5431 H HA3  . GLY A 1 11 ? -3.605  0.467   -6.901 1.00 0.35 ?  11 GLY A HA3  10 
HETATM 5432 N N    . NLE A 1 12 ? -4.953  -1.109  -4.590 1.00 0.24 ?  12 NLE A N    10 
HETATM 5433 C CA   . NLE A 1 12 ? -5.540  -2.364  -4.147 1.00 0.24 ?  12 NLE A CA   10 
HETATM 5434 C C    . NLE A 1 12 ? -5.969  -2.253  -2.694 1.00 0.21 ?  12 NLE A C    10 
HETATM 5435 O O    . NLE A 1 12 ? -5.611  -1.296  -2.005 1.00 0.22 ?  12 NLE A O    10 
HETATM 5436 C CB   . NLE A 1 12 ? -4.559  -3.536  -4.318 1.00 0.27 ?  12 NLE A CB   10 
HETATM 5437 C CG   . NLE A 1 12 ? -3.345  -3.505  -3.391 1.00 0.64 ?  12 NLE A CG   10 
HETATM 5438 C CD   . NLE A 1 12 ? -2.318  -2.454  -3.796 1.00 0.33 ?  12 NLE A CD   10 
HETATM 5439 C CE   . NLE A 1 12 ? -1.704  -2.798  -5.138 1.00 0.64 ?  12 NLE A CE   10 
HETATM 5440 H H    . NLE A 1 12 ? -4.492  -0.546  -3.936 1.00 0.26 ?  12 NLE A H    10 
HETATM 5441 H HA   . NLE A 1 12 ? -6.416  -2.549  -4.752 1.00 0.26 ?  12 NLE A HA   10 
HETATM 5442 H HB2  . NLE A 1 12 ? -4.205  -3.541  -5.336 1.00 0.51 ?  12 NLE A HB2  10 
HETATM 5443 H HB3  . NLE A 1 12 ? -5.091  -4.455  -4.136 1.00 0.31 ?  12 NLE A HB3  10 
HETATM 5444 H HG2  . NLE A 1 12 ? -2.873  -4.477  -3.406 1.00 1.24 ?  12 NLE A HG2  10 
HETATM 5445 H HG3  . NLE A 1 12 ? -3.681  -3.286  -2.388 1.00 1.24 ?  12 NLE A HG3  10 
HETATM 5446 H HD2  . NLE A 1 12 ? -1.533  -2.418  -3.056 1.00 0.70 ?  12 NLE A HD2  10 
HETATM 5447 H HD3  . NLE A 1 12 ? -2.798  -1.492  -3.872 1.00 0.43 ?  12 NLE A HD3  10 
HETATM 5448 H HE1  . NLE A 1 12 ? -2.470  -2.799  -5.896 1.00 1.10 ?  12 NLE A HE1  10 
HETATM 5449 H HE2  . NLE A 1 12 ? -1.250  -3.777  -5.085 1.00 1.19 ?  12 NLE A HE2  10 
HETATM 5450 H HE3  . NLE A 1 12 ? -0.950  -2.066  -5.388 1.00 1.26 ?  12 NLE A HE3  10 
ATOM   5451 N N    . THR A 1 13 ? -6.740  -3.226  -2.235 1.00 0.24 ?  13 THR A N    10 
ATOM   5452 C CA   . THR A 1 13 ? -7.211  -3.241  -0.863 1.00 0.27 ?  13 THR A CA   10 
ATOM   5453 C C    . THR A 1 13 ? -6.133  -3.756  0.076  1.00 0.24 ?  13 THR A C    10 
ATOM   5454 O O    . THR A 1 13 ? -5.189  -4.415  -0.369 1.00 0.23 ?  13 THR A O    10 
ATOM   5455 C CB   . THR A 1 13 ? -8.475  -4.107  -0.709 1.00 0.34 ?  13 THR A CB   10 
ATOM   5456 O OG1  . THR A 1 13 ? -8.249  -5.411  -1.262 1.00 0.36 ?  13 THR A OG1  10 
ATOM   5457 C CG2  . THR A 1 13 ? -9.665  -3.453  -1.391 1.00 0.43 ?  13 THR A CG2  10 
ATOM   5458 H H    . THR A 1 13 ? -6.993  -3.958  -2.836 1.00 0.27 ?  13 THR A H    10 
ATOM   5459 H HA   . THR A 1 13 ? -7.459  -2.228  -0.585 1.00 0.30 ?  13 THR A HA   10 
ATOM   5460 H HB   . THR A 1 13 ? -8.692  -4.208  0.344  1.00 0.34 ?  13 THR A HB   10 
ATOM   5461 H HG1  . THR A 1 13 ? -8.402  -5.394  -2.216 1.00 0.58 ?  13 THR A HG1  10 
ATOM   5462 H HG21 . THR A 1 13 ? -9.873  -2.502  -0.921 1.00 0.92 ?  13 THR A HG21 10 
ATOM   5463 H HG22 . THR A 1 13 ? -10.530 -4.095  -1.301 1.00 1.34 ?  13 THR A HG22 10 
ATOM   5464 H HG23 . THR A 1 13 ? -9.441  -3.297  -2.435 1.00 1.02 ?  13 THR A HG23 10 
ATOM   5465 N N    . ARG A 1 14 ? -6.277  -3.473  1.363  1.00 0.29 ?  14 ARG A N    10 
ATOM   5466 C CA   . ARG A 1 14 ? -5.263  -3.839  2.348  1.00 0.32 ?  14 ARG A CA   10 
ATOM   5467 C C    . ARG A 1 14 ? -4.914  -5.321  2.265  1.00 0.30 ?  14 ARG A C    10 
ATOM   5468 O O    . ARG A 1 14 ? -3.744  -5.691  2.354  1.00 0.31 ?  14 ARG A O    10 
ATOM   5469 C CB   . ARG A 1 14 ? -5.732  -3.480  3.758  1.00 0.42 ?  14 ARG A CB   10 
ATOM   5470 C CG   . ARG A 1 14 ? -5.904  -1.987  3.968  1.00 0.53 ?  14 ARG A CG   10 
ATOM   5471 C CD   . ARG A 1 14 ? -6.276  -1.658  5.401  1.00 0.77 ?  14 ARG A CD   10 
ATOM   5472 N NE   . ARG A 1 14 ? -5.196  -1.957  6.338  1.00 1.30 ?  14 ARG A NE   10 
ATOM   5473 C CZ   . ARG A 1 14 ? -5.382  -2.191  7.635  1.00 1.88 ?  14 ARG A CZ   10 
ATOM   5474 N NH1  . ARG A 1 14 ? -6.608  -2.175  8.151  1.00 2.02 1  14 ARG A NH1  10 
ATOM   5475 N NH2  . ARG A 1 14 ? -4.341  -2.443  8.418  1.00 2.82 ?  14 ARG A NH2  10 
ATOM   5476 H H    . ARG A 1 14 ? -7.088  -3.007  1.661  1.00 0.32 ?  14 ARG A H    10 
ATOM   5477 H HA   . ARG A 1 14 ? -4.375  -3.267  2.124  1.00 0.34 ?  14 ARG A HA   10 
ATOM   5478 H HB2  . ARG A 1 14 ? -6.681  -3.961  3.943  1.00 0.43 ?  14 ARG A HB2  10 
ATOM   5479 H HB3  . ARG A 1 14 ? -5.010  -3.843  4.468  1.00 0.46 ?  14 ARG A HB3  10 
ATOM   5480 H HG2  . ARG A 1 14 ? -4.972  -1.492  3.728  1.00 0.58 ?  14 ARG A HG2  10 
ATOM   5481 H HG3  . ARG A 1 14 ? -6.683  -1.629  3.311  1.00 0.53 ?  14 ARG A HG3  10 
ATOM   5482 H HD2  . ARG A 1 14 ? -6.510  -0.606  5.465  1.00 1.48 ?  14 ARG A HD2  10 
ATOM   5483 H HD3  . ARG A 1 14 ? -7.145  -2.236  5.674  1.00 1.15 ?  14 ARG A HD3  10 
ATOM   5484 H HE   . ARG A 1 14 ? -4.280  -1.975  5.979  1.00 1.80 ?  14 ARG A HE   10 
ATOM   5485 H HH11 . ARG A 1 14 ? -6.744  -2.351  9.130  1.00 2.60 ?  14 ARG A HH11 10 
ATOM   5486 H HH12 . ARG A 1 14 ? -7.400  -1.989  7.566  1.00 1.94 ?  14 ARG A HH12 10 
ATOM   5487 H HH21 . ARG A 1 14 ? -3.411  -2.460  8.034  1.00 3.23 ?  14 ARG A HH21 10 
ATOM   5488 H HH22 . ARG A 1 14 ? -4.474  -2.620  9.396  1.00 3.30 ?  14 ARG A HH22 10 
HETATM 5489 N N    . AIB A 1 15 ? -5.935  -6.154  2.061  1.00 0.31 ?  15 AIB A N    10 
HETATM 5490 C CA   . AIB A 1 15 ? -5.754  -7.605  1.905  1.00 0.33 ?  15 AIB A CA   10 
HETATM 5491 C C    . AIB A 1 15 ? -4.769  -7.882  0.761  1.00 0.30 ?  15 AIB A C    10 
HETATM 5492 O O    . AIB A 1 15 ? -3.809  -8.645  0.916  1.00 0.30 ?  15 AIB A O    10 
HETATM 5493 C CB1  . AIB A 1 15 ? -7.087  -8.250  1.586  1.00 0.37 ?  15 AIB A CB1  10 
HETATM 5494 C CB2  . AIB A 1 15 ? -5.249  -8.217  3.200  1.00 0.37 ?  15 AIB A CB2  10 
HETATM 5495 H H    . AIB A 1 15 ? -6.841  -5.782  2.013  1.00 0.31 ?  15 AIB A H    10 
HETATM 5496 H HB11 . AIB A 1 15 ? -7.460  -7.857  0.652  1.00 1.00 ?  15 AIB A HB11 10 
HETATM 5497 H HB12 . AIB A 1 15 ? -7.790  -8.033  2.377  1.00 1.13 ?  15 AIB A HB12 10 
HETATM 5498 H HB13 . AIB A 1 15 ? -6.959  -9.319  1.501  1.00 1.02 ?  15 AIB A HB13 10 
HETATM 5499 H HB21 . AIB A 1 15 ? -5.970  -8.045  3.985  1.00 1.07 ?  15 AIB A HB21 10 
HETATM 5500 H HB22 . AIB A 1 15 ? -4.308  -7.762  3.470  1.00 1.16 ?  15 AIB A HB22 10 
HETATM 5501 H HB23 . AIB A 1 15 ? -5.111  -9.280  3.065  1.00 1.01 ?  15 AIB A HB23 10 
ATOM   5502 N N    . ALA A 1 16 ? -4.993  -7.225  -0.372 1.00 0.27 ?  16 ALA A N    10 
ATOM   5503 C CA   . ALA A 1 16 ? -4.195  -7.463  -1.565 1.00 0.26 ?  16 ALA A CA   10 
ATOM   5504 C C    . ALA A 1 16 ? -2.804  -6.871  -1.402 1.00 0.23 ?  16 ALA A C    10 
ATOM   5505 O O    . ALA A 1 16 ? -1.832  -7.370  -1.969 1.00 0.25 ?  16 ALA A O    10 
ATOM   5506 C CB   . ALA A 1 16 ? -4.886  -6.884  -2.790 1.00 0.28 ?  16 ALA A CB   10 
ATOM   5507 H H    . ALA A 1 16 ? -5.698  -6.538  -0.399 1.00 0.27 ?  16 ALA A H    10 
ATOM   5508 H HA   . ALA A 1 16 ? -4.107  -8.532  -1.699 1.00 0.29 ?  16 ALA A HA   10 
ATOM   5509 H HB1  . ALA A 1 16 ? -5.024  -5.822  -2.657 1.00 0.90 ?  16 ALA A HB1  10 
ATOM   5510 H HB2  . ALA A 1 16 ? -5.847  -7.360  -2.921 1.00 0.96 ?  16 ALA A HB2  10 
ATOM   5511 H HB3  . ALA A 1 16 ? -4.276  -7.059  -3.664 1.00 0.89 ?  16 ALA A HB3  10 
ATOM   5512 N N    . PHE A 1 17 ? -2.723  -5.806  -0.618 1.00 0.20 ?  17 PHE A N    10 
ATOM   5513 C CA   . PHE A 1 17 ? -1.456  -5.171  -0.302 1.00 0.19 ?  17 PHE A CA   10 
ATOM   5514 C C    . PHE A 1 17 ? -0.614  -6.087  0.577  1.00 0.20 ?  17 PHE A C    10 
ATOM   5515 O O    . PHE A 1 17 ? 0.556   -6.330  0.300  1.00 0.20 ?  17 PHE A O    10 
ATOM   5516 C CB   . PHE A 1 17 ? -1.711  -3.844  0.406  1.00 0.22 ?  17 PHE A CB   10 
ATOM   5517 C CG   . PHE A 1 17 ? -0.468  -3.062  0.699  1.00 0.24 ?  17 PHE A CG   10 
ATOM   5518 C CD1  . PHE A 1 17 ? 0.138   -2.299  -0.284 1.00 0.28 ?  17 PHE A CD1  10 
ATOM   5519 C CD2  . PHE A 1 17 ? 0.097   -3.097  1.959  1.00 0.28 ?  17 PHE A CD2  10 
ATOM   5520 C CE1  . PHE A 1 17 ? 1.286   -1.582  -0.011 1.00 0.33 ?  17 PHE A CE1  10 
ATOM   5521 C CE2  . PHE A 1 17 ? 1.241   -2.385  2.237  1.00 0.32 ?  17 PHE A CE2  10 
ATOM   5522 C CZ   . PHE A 1 17 ? 1.828   -1.605  1.230  1.00 0.33 ?  17 PHE A CZ   10 
ATOM   5523 H H    . PHE A 1 17 ? -3.550  -5.427  -0.245 1.00 0.21 ?  17 PHE A H    10 
ATOM   5524 H HA   . PHE A 1 17 ? -0.931  -4.985  -1.226 1.00 0.19 ?  17 PHE A HA   10 
ATOM   5525 H HB2  . PHE A 1 17 ? -2.343  -3.235  -0.217 1.00 0.22 ?  17 PHE A HB2  10 
ATOM   5526 H HB3  . PHE A 1 17 ? -2.213  -4.035  1.342  1.00 0.24 ?  17 PHE A HB3  10 
ATOM   5527 H HD1  . PHE A 1 17 ? -0.298  -2.264  -1.272 1.00 0.30 ?  17 PHE A HD1  10 
ATOM   5528 H HD2  . PHE A 1 17 ? -0.367  -3.691  2.734  1.00 0.30 ?  17 PHE A HD2  10 
ATOM   5529 H HE1  . PHE A 1 17 ? 1.752   -0.990  -0.783 1.00 0.38 ?  17 PHE A HE1  10 
ATOM   5530 H HE2  . PHE A 1 17 ? 1.670   -2.421  3.225  1.00 0.36 ?  17 PHE A HE2  10 
ATOM   5531 H HZ   . PHE A 1 17 ? 2.724   -1.039  1.432  1.00 0.37 ?  17 PHE A HZ   10 
ATOM   5532 N N    . ALA A 1 18 ? -1.228  -6.609  1.629  1.00 0.23 ?  18 ALA A N    10 
ATOM   5533 C CA   . ALA A 1 18 ? -0.551  -7.522  2.536  1.00 0.25 ?  18 ALA A CA   10 
ATOM   5534 C C    . ALA A 1 18 ? -0.192  -8.816  1.821  1.00 0.23 ?  18 ALA A C    10 
ATOM   5535 O O    . ALA A 1 18 ? 0.742   -9.517  2.210  1.00 0.23 ?  18 ALA A O    10 
ATOM   5536 C CB   . ALA A 1 18 ? -1.420  -7.806  3.748  1.00 0.30 ?  18 ALA A CB   10 
ATOM   5537 H H    . ALA A 1 18 ? -2.163  -6.366  1.804  1.00 0.25 ?  18 ALA A H    10 
ATOM   5538 H HA   . ALA A 1 18 ? 0.356   -7.043  2.874  1.00 0.27 ?  18 ALA A HA   10 
ATOM   5539 H HB1  . ALA A 1 18 ? -2.306  -8.338  3.437  1.00 1.06 ?  18 ALA A HB1  10 
ATOM   5540 H HB2  . ALA A 1 18 ? -1.703  -6.872  4.212  1.00 0.87 ?  18 ALA A HB2  10 
ATOM   5541 H HB3  . ALA A 1 18 ? -0.867  -8.407  4.455  1.00 0.99 ?  18 ALA A HB3  10 
ATOM   5542 N N    . ASN A 1 19 ? -0.956  -9.131  0.782  1.00 0.24 ?  19 ASN A N    10 
ATOM   5543 C CA   . ASN A 1 19 ? -0.670  -10.278 -0.073 1.00 0.24 ?  19 ASN A CA   10 
ATOM   5544 C C    . ASN A 1 19 ? 0.646   -10.086 -0.825 1.00 0.19 ?  19 ASN A C    10 
ATOM   5545 O O    . ASN A 1 19 ? 1.302   -11.057 -1.206 1.00 0.22 ?  19 ASN A O    10 
ATOM   5546 C CB   . ASN A 1 19 ? -1.819  -10.490 -1.064 1.00 0.31 ?  19 ASN A CB   10 
ATOM   5547 C CG   . ASN A 1 19 ? -1.559  -11.623 -2.041 1.00 0.36 ?  19 ASN A CG   10 
ATOM   5548 O OD1  . ASN A 1 19 ? -1.025  -11.405 -3.130 1.00 1.14 ?  19 ASN A OD1  10 
ATOM   5549 N ND2  . ASN A 1 19 ? -1.937  -12.834 -1.662 1.00 1.08 ?  19 ASN A ND2  10 
ATOM   5550 H H    . ASN A 1 19 ? -1.756  -8.587  0.596  1.00 0.25 ?  19 ASN A H    10 
ATOM   5551 H HA   . ASN A 1 19 ? -0.585  -11.147 0.560  1.00 0.27 ?  19 ASN A HA   10 
ATOM   5552 H HB2  . ASN A 1 19 ? -2.722  -10.711 -0.517 1.00 0.38 ?  19 ASN A HB2  10 
ATOM   5553 H HB3  . ASN A 1 19 ? -1.964  -9.580  -1.631 1.00 0.32 ?  19 ASN A HB3  10 
ATOM   5554 H HD21 . ASN A 1 19 ? -2.362  -12.937 -0.782 1.00 1.83 ?  19 ASN A HD21 10 
ATOM   5555 H HD22 . ASN A 1 19 ? -1.780  -13.582 -2.277 1.00 1.08 ?  19 ASN A HD22 10 
ATOM   5556 N N    . LEU A 1 20 ? 1.033   -8.832  -1.020 1.00 0.17 ?  20 LEU A N    10 
ATOM   5557 C CA   . LEU A 1 20 ? 2.259   -8.510  -1.737 1.00 0.17 ?  20 LEU A CA   10 
ATOM   5558 C C    . LEU A 1 20 ? 3.474   -8.844  -0.879 1.00 0.17 ?  20 LEU A C    10 
ATOM   5559 O O    . LEU A 1 20 ? 3.376   -8.882  0.350  1.00 0.18 ?  20 LEU A O    10 
ATOM   5560 C CB   . LEU A 1 20 ? 2.282   -7.024  -2.107 1.00 0.20 ?  20 LEU A CB   10 
ATOM   5561 C CG   . LEU A 1 20 ? 1.091   -6.538  -2.934 1.00 0.29 ?  20 LEU A CG   10 
ATOM   5562 C CD1  . LEU A 1 20 ? 1.155   -5.032  -3.123 1.00 0.32 ?  20 LEU A CD1  10 
ATOM   5563 C CD2  . LEU A 1 20 ? 1.056   -7.242  -4.280 1.00 0.41 ?  20 LEU A CD2  10 
ATOM   5564 H H    . LEU A 1 20 ? 0.491   -8.099  -0.654 1.00 0.19 ?  20 LEU A H    10 
ATOM   5565 H HA   . LEU A 1 20 ? 2.286   -9.103  -2.638 1.00 0.22 ?  20 LEU A HA   10 
ATOM   5566 H HB2  . LEU A 1 20 ? 2.319   -6.449  -1.193 1.00 0.19 ?  20 LEU A HB2  10 
ATOM   5567 H HB3  . LEU A 1 20 ? 3.183   -6.831  -2.669 1.00 0.24 ?  20 LEU A HB3  10 
ATOM   5568 H HG   . LEU A 1 20 ? 0.176   -6.772  -2.409 1.00 0.33 ?  20 LEU A HG   10 
ATOM   5569 H HD11 . LEU A 1 20 ? 0.296   -4.703  -3.688 1.00 1.04 ?  20 LEU A HD11 10 
ATOM   5570 H HD12 . LEU A 1 20 ? 2.056   -4.772  -3.656 1.00 1.05 ?  20 LEU A HD12 10 
ATOM   5571 H HD13 . LEU A 1 20 ? 1.157   -4.548  -2.156 1.00 1.10 ?  20 LEU A HD13 10 
ATOM   5572 H HD21 . LEU A 1 20 ? 0.933   -8.304  -4.129 1.00 1.10 ?  20 LEU A HD21 10 
ATOM   5573 H HD22 . LEU A 1 20 ? 1.982   -7.058  -4.803 1.00 0.88 ?  20 LEU A HD22 10 
ATOM   5574 H HD23 . LEU A 1 20 ? 0.230   -6.863  -4.863 1.00 1.17 ?  20 LEU A HD23 10 
ATOM   5575 N N    . PRO A 1 21 ? 4.631   -9.102  -1.509 1.00 0.23 ?  21 PRO A N    10 
ATOM   5576 C CA   . PRO A 1 21 ? 5.872   -9.389  -0.787 1.00 0.29 ?  21 PRO A CA   10 
ATOM   5577 C C    . PRO A 1 21 ? 6.293   -8.232  0.111  1.00 0.26 ?  21 PRO A C    10 
ATOM   5578 O O    . PRO A 1 21 ? 6.040   -7.069  -0.222 1.00 0.22 ?  21 PRO A O    10 
ATOM   5579 C CB   . PRO A 1 21 ? 6.910   -9.605  -1.893 1.00 0.38 ?  21 PRO A CB   10 
ATOM   5580 C CG   . PRO A 1 21 ? 6.114   -9.898  -3.120 1.00 0.43 ?  21 PRO A CG   10 
ATOM   5581 C CD   . PRO A 1 21 ? 4.824   -9.145  -2.968 1.00 0.30 ?  21 PRO A CD   10 
ATOM   5582 H HA   . PRO A 1 21 ? 5.783   -10.288 -0.194 1.00 0.32 ?  21 PRO A HA   10 
ATOM   5583 H HB2  . PRO A 1 21 ? 7.502   -8.708  -2.011 1.00 0.43 ?  21 PRO A HB2  10 
ATOM   5584 H HB3  . PRO A 1 21 ? 7.551   -10.433 -1.631 1.00 0.48 ?  21 PRO A HB3  10 
ATOM   5585 H HG2  . PRO A 1 21 ? 6.648   -9.550  -3.995 1.00 0.63 ?  21 PRO A HG2  10 
ATOM   5586 H HG3  . PRO A 1 21 ? 5.926   -10.961 -3.190 1.00 0.61 ?  21 PRO A HG3  10 
ATOM   5587 H HD2  . PRO A 1 21 ? 4.918   -8.150  -3.372 1.00 0.40 ?  21 PRO A HD2  10 
ATOM   5588 H HD3  . PRO A 1 21 ? 4.014   -9.673  -3.449 1.00 0.39 ?  21 PRO A HD3  10 
ATOM   5589 N N    . LEU A 1 22 ? 6.919   -8.545  1.237  1.00 0.30 ?  22 LEU A N    10 
ATOM   5590 C CA   . LEU A 1 22 ? 7.245   -7.546  2.248  1.00 0.31 ?  22 LEU A CA   10 
ATOM   5591 C C    . LEU A 1 22 ? 7.950   -6.330  1.643  1.00 0.28 ?  22 LEU A C    10 
ATOM   5592 O O    . LEU A 1 22 ? 7.566   -5.187  1.911  1.00 0.28 ?  22 LEU A O    10 
ATOM   5593 C CB   . LEU A 1 22 ? 8.110   -8.181  3.342  1.00 0.41 ?  22 LEU A CB   10 
ATOM   5594 C CG   . LEU A 1 22 ? 8.516   -7.253  4.487  1.00 1.07 ?  22 LEU A CG   10 
ATOM   5595 C CD1  . LEU A 1 22 ? 7.289   -6.716  5.207  1.00 1.64 ?  22 LEU A CD1  10 
ATOM   5596 C CD2  . LEU A 1 22 ? 9.424   -7.990  5.458  1.00 1.54 ?  22 LEU A CD2  10 
ATOM   5597 H H    . LEU A 1 22 ? 7.171   -9.482  1.396  1.00 0.34 ?  22 LEU A H    10 
ATOM   5598 H HA   . LEU A 1 22 ? 6.318   -7.217  2.689  1.00 0.30 ?  22 LEU A HA   10 
ATOM   5599 H HB2  . LEU A 1 22 ? 7.564   -9.014  3.761  1.00 1.00 ?  22 LEU A HB2  10 
ATOM   5600 H HB3  . LEU A 1 22 ? 9.010   -8.561  2.882  1.00 0.94 ?  22 LEU A HB3  10 
ATOM   5601 H HG   . LEU A 1 22 ? 9.064   -6.415  4.084  1.00 1.97 ?  22 LEU A HG   10 
ATOM   5602 H HD11 . LEU A 1 22 ? 6.710   -6.106  4.529  1.00 2.16 ?  22 LEU A HD11 10 
ATOM   5603 H HD12 . LEU A 1 22 ? 7.599   -6.119  6.051  1.00 1.77 ?  22 LEU A HD12 10 
ATOM   5604 H HD13 . LEU A 1 22 ? 6.686   -7.541  5.552  1.00 2.26 ?  22 LEU A HD13 10 
ATOM   5605 H HD21 . LEU A 1 22 ? 10.308  -8.328  4.938  1.00 2.09 ?  22 LEU A HD21 10 
ATOM   5606 H HD22 . LEU A 1 22 ? 8.899   -8.840  5.866  1.00 1.81 ?  22 LEU A HD22 10 
ATOM   5607 H HD23 . LEU A 1 22 ? 9.710   -7.324  6.259  1.00 2.05 ?  22 LEU A HD23 10 
ATOM   5608 N N    . TRP A 1 23 ? 8.955   -6.575  0.802  1.00 0.33 ?  23 TRP A N    10 
ATOM   5609 C CA   . TRP A 1 23 ? 9.718   -5.490  0.189  1.00 0.34 ?  23 TRP A CA   10 
ATOM   5610 C C    . TRP A 1 23 ? 8.821   -4.606  -0.672 1.00 0.27 ?  23 TRP A C    10 
ATOM   5611 O O    . TRP A 1 23 ? 9.045   -3.399  -0.777 1.00 0.25 ?  23 TRP A O    10 
ATOM   5612 C CB   . TRP A 1 23 ? 10.884  -6.035  -0.651 1.00 0.42 ?  23 TRP A CB   10 
ATOM   5613 C CG   . TRP A 1 23 ? 10.470  -6.816  -1.866 1.00 0.48 ?  23 TRP A CG   10 
ATOM   5614 C CD1  . TRP A 1 23 ? 10.305  -8.166  -1.957 1.00 0.56 ?  23 TRP A CD1  10 
ATOM   5615 C CD2  . TRP A 1 23 ? 10.186  -6.289  -3.170 1.00 0.51 ?  23 TRP A CD2  10 
ATOM   5616 N NE1  . TRP A 1 23 ? 9.929   -8.509  -3.232 1.00 0.62 ?  23 TRP A NE1  10 
ATOM   5617 C CE2  . TRP A 1 23 ? 9.849   -7.376  -3.995 1.00 0.60 ?  23 TRP A CE2  10 
ATOM   5618 C CE3  . TRP A 1 23 ? 10.179  -5.001  -3.717 1.00 0.49 ?  23 TRP A CE3  10 
ATOM   5619 C CZ2  . TRP A 1 23 ? 9.511   -7.217  -5.336 1.00 0.68 ?  23 TRP A CZ2  10 
ATOM   5620 C CZ3  . TRP A 1 23 ? 9.844   -4.844  -5.047 1.00 0.59 ?  23 TRP A CZ3  10 
ATOM   5621 C CH2  . TRP A 1 23 ? 9.513   -5.945  -5.844 1.00 0.68 ?  23 TRP A CH2  10 
ATOM   5622 H H    . TRP A 1 23 ? 9.191   -7.506  0.594  1.00 0.37 ?  23 TRP A H    10 
ATOM   5623 H HA   . TRP A 1 23 ? 10.120  -4.887  0.988  1.00 0.35 ?  23 TRP A HA   10 
ATOM   5624 H HB2  . TRP A 1 23 ? 11.488  -5.207  -0.987 1.00 0.42 ?  23 TRP A HB2  10 
ATOM   5625 H HB3  . TRP A 1 23 ? 11.488  -6.680  -0.032 1.00 0.48 ?  23 TRP A HB3  10 
ATOM   5626 H HD1  . TRP A 1 23 ? 10.449  -8.851  -1.138 1.00 0.59 ?  23 TRP A HD1  10 
ATOM   5627 H HE1  . TRP A 1 23 ? 9.746   -9.423  -3.546 1.00 0.69 ?  23 TRP A HE1  10 
ATOM   5628 H HE3  . TRP A 1 23 ? 10.428  -4.138  -3.115 1.00 0.44 ?  23 TRP A HE3  10 
ATOM   5629 H HZ2  . TRP A 1 23 ? 9.252   -8.057  -5.964 1.00 0.76 ?  23 TRP A HZ2  10 
ATOM   5630 H HZ3  . TRP A 1 23 ? 9.834   -3.858  -5.485 1.00 0.61 ?  23 TRP A HZ3  10 
ATOM   5631 H HH2  . TRP A 1 23 ? 9.259   -5.774  -6.879 1.00 0.76 ?  23 TRP A HH2  10 
ATOM   5632 N N    . LYS A 1 24 ? 7.798   -5.206  -1.267 1.00 0.24 ?  24 LYS A N    10 
ATOM   5633 C CA   . LYS A 1 24 ? 6.902   -4.485  -2.156 1.00 0.22 ?  24 LYS A CA   10 
ATOM   5634 C C    . LYS A 1 24 ? 5.957   -3.624  -1.336 1.00 0.14 ?  24 LYS A C    10 
ATOM   5635 O O    . LYS A 1 24 ? 5.678   -2.480  -1.691 1.00 0.15 ?  24 LYS A O    10 
ATOM   5636 C CB   . LYS A 1 24 ? 6.125   -5.467  -3.039 1.00 0.26 ?  24 LYS A CB   10 
ATOM   5637 C CG   . LYS A 1 24 ? 5.315   -4.804  -4.144 1.00 0.35 ?  24 LYS A CG   10 
ATOM   5638 C CD   . LYS A 1 24 ? 4.794   -5.834  -5.132 1.00 0.97 ?  24 LYS A CD   10 
ATOM   5639 C CE   . LYS A 1 24 ? 3.982   -5.190  -6.246 1.00 0.98 ?  24 LYS A CE   10 
ATOM   5640 N NZ   . LYS A 1 24 ? 3.583   -6.181  -7.281 1.00 1.37 1  24 LYS A NZ   10 
ATOM   5641 H H    . LYS A 1 24 ? 7.627   -6.158  -1.086 1.00 0.26 ?  24 LYS A H    10 
ATOM   5642 H HA   . LYS A 1 24 ? 7.504   -3.842  -2.783 1.00 0.25 ?  24 LYS A HA   10 
ATOM   5643 H HB2  . LYS A 1 24 ? 6.824   -6.150  -3.497 1.00 0.33 ?  24 LYS A HB2  10 
ATOM   5644 H HB3  . LYS A 1 24 ? 5.444   -6.029  -2.416 1.00 0.24 ?  24 LYS A HB3  10 
ATOM   5645 H HG2  . LYS A 1 24 ? 4.478   -4.283  -3.703 1.00 0.83 ?  24 LYS A HG2  10 
ATOM   5646 H HG3  . LYS A 1 24 ? 5.947   -4.100  -4.669 1.00 0.96 ?  24 LYS A HG3  10 
ATOM   5647 H HD2  . LYS A 1 24 ? 5.634   -6.353  -5.569 1.00 1.51 ?  24 LYS A HD2  10 
ATOM   5648 H HD3  . LYS A 1 24 ? 4.170   -6.540  -4.605 1.00 1.43 ?  24 LYS A HD3  10 
ATOM   5649 H HE2  . LYS A 1 24 ? 3.092   -4.752  -5.820 1.00 1.17 ?  24 LYS A HE2  10 
ATOM   5650 H HE3  . LYS A 1 24 ? 4.577   -4.418  -6.710 1.00 1.36 ?  24 LYS A HE3  10 
ATOM   5651 H HZ1  . LYS A 1 24 ? 3.069   -5.707  -8.052 1.00 1.91 ?  24 LYS A HZ1  10 
ATOM   5652 H HZ2  . LYS A 1 24 ? 2.966   -6.906  -6.866 1.00 1.69 ?  24 LYS A HZ2  10 
ATOM   5653 H HZ3  . LYS A 1 24 ? 4.426   -6.645  -7.677 1.00 1.76 ?  24 LYS A HZ3  10 
ATOM   5654 N N    . GLN A 1 25 ? 5.483   -4.181  -0.226 1.00 0.11 ?  25 GLN A N    10 
ATOM   5655 C CA   . GLN A 1 25 ? 4.674   -3.426  0.723  1.00 0.09 ?  25 GLN A CA   10 
ATOM   5656 C C    . GLN A 1 25 ? 5.442   -2.211  1.217  1.00 0.09 ?  25 GLN A C    10 
ATOM   5657 O O    . GLN A 1 25 ? 4.936   -1.089  1.195  1.00 0.12 ?  25 GLN A O    10 
ATOM   5658 C CB   . GLN A 1 25 ? 4.298   -4.284  1.926  1.00 0.14 ?  25 GLN A CB   10 
ATOM   5659 C CG   . GLN A 1 25 ? 3.412   -5.464  1.597  1.00 0.16 ?  25 GLN A CG   10 
ATOM   5660 C CD   . GLN A 1 25 ? 3.057   -6.267  2.829  1.00 0.22 ?  25 GLN A CD   10 
ATOM   5661 O OE1  . GLN A 1 25 ? 2.952   -5.727  3.934  1.00 0.41 ?  25 GLN A OE1  10 
ATOM   5662 N NE2  . GLN A 1 25 ? 2.879   -7.560  2.656  1.00 0.24 ?  25 GLN A NE2  10 
ATOM   5663 H H    . GLN A 1 25 ? 5.678   -5.130  -0.044 1.00 0.15 ?  25 GLN A H    10 
ATOM   5664 H HA   . GLN A 1 25 ? 3.776   -3.098  0.221  1.00 0.10 ?  25 GLN A HA   10 
ATOM   5665 H HB2  . GLN A 1 25 ? 5.203   -4.660  2.379  1.00 0.22 ?  25 GLN A HB2  10 
ATOM   5666 H HB3  . GLN A 1 25 ? 3.781   -3.664  2.641  1.00 0.18 ?  25 GLN A HB3  10 
ATOM   5667 H HG2  . GLN A 1 25 ? 2.502   -5.097  1.149  1.00 0.18 ?  25 GLN A HG2  10 
ATOM   5668 H HG3  . GLN A 1 25 ? 3.927   -6.107  0.899  1.00 0.21 ?  25 GLN A HG3  10 
ATOM   5669 H HE21 . GLN A 1 25 ? 2.984   -7.928  1.745  1.00 0.33 ?  25 GLN A HE21 10 
ATOM   5670 H HE22 . GLN A 1 25 ? 2.654   -8.105  3.436  1.00 0.27 ?  25 GLN A HE22 10 
ATOM   5671 N N    . GLN A 1 26 ? 6.670   -2.453  1.663  1.00 0.14 ?  26 GLN A N    10 
ATOM   5672 C CA   . GLN A 1 26 ? 7.529   -1.389  2.153  1.00 0.18 ?  26 GLN A CA   10 
ATOM   5673 C C    . GLN A 1 26 ? 7.738   -0.335  1.079  1.00 0.18 ?  26 GLN A C    10 
ATOM   5674 O O    . GLN A 1 26 ? 7.544   0.847   1.325  1.00 0.25 ?  26 GLN A O    10 
ATOM   5675 C CB   . GLN A 1 26 ? 8.880   -1.946  2.598  1.00 0.28 ?  26 GLN A CB   10 
ATOM   5676 C CG   . GLN A 1 26 ? 8.789   -2.915  3.763  1.00 0.38 ?  26 GLN A CG   10 
ATOM   5677 C CD   . GLN A 1 26 ? 10.137  -3.484  4.147  1.00 0.90 ?  26 GLN A CD   10 
ATOM   5678 O OE1  . GLN A 1 26 ? 10.841  -2.930  4.991  1.00 1.46 ?  26 GLN A OE1  10 
ATOM   5679 N NE2  . GLN A 1 26 ? 10.505  -4.594  3.532  1.00 1.59 ?  26 GLN A NE2  10 
ATOM   5680 H H    . GLN A 1 26 ? 7.004   -3.378  1.662  1.00 0.18 ?  26 GLN A H    10 
ATOM   5681 H HA   . GLN A 1 26 ? 7.040   -0.932  2.999  1.00 0.21 ?  26 GLN A HA   10 
ATOM   5682 H HB2  . GLN A 1 26 ? 9.335   -2.461  1.767  1.00 0.31 ?  26 GLN A HB2  10 
ATOM   5683 H HB3  . GLN A 1 26 ? 9.516   -1.124  2.892  1.00 0.31 ?  26 GLN A HB3  10 
ATOM   5684 H HG2  . GLN A 1 26 ? 8.379   -2.396  4.615  1.00 0.76 ?  26 GLN A HG2  10 
ATOM   5685 H HG3  . GLN A 1 26 ? 8.134   -3.730  3.490  1.00 0.60 ?  26 GLN A HG3  10 
ATOM   5686 H HE21 . GLN A 1 26 ? 9.894   -4.983  2.873  1.00 1.96 ?  26 GLN A HE21 10 
ATOM   5687 H HE22 . GLN A 1 26 ? 11.377  -4.984  3.759  1.00 1.99 ?  26 GLN A HE22 10 
ATOM   5688 N N    . ASN A 1 27 ? 8.100   -0.778  -0.118 1.00 0.19 ?  27 ASN A N    10 
ATOM   5689 C CA   . ASN A 1 27 ? 8.372   0.134   -1.222 1.00 0.26 ?  27 ASN A CA   10 
ATOM   5690 C C    . ASN A 1 27 ? 7.160   1.005   -1.524 1.00 0.22 ?  27 ASN A C    10 
ATOM   5691 O O    . ASN A 1 27 ? 7.280   2.216   -1.662 1.00 0.25 ?  27 ASN A O    10 
ATOM   5692 C CB   . ASN A 1 27 ? 8.778   -0.647  -2.474 1.00 0.38 ?  27 ASN A CB   10 
ATOM   5693 C CG   . ASN A 1 27 ? 9.180   0.257   -3.624 1.00 0.98 ?  27 ASN A CG   10 
ATOM   5694 O OD1  . ASN A 1 27 ? 9.689   1.359   -3.419 1.00 1.81 ?  27 ASN A OD1  10 
ATOM   5695 N ND2  . ASN A 1 27 ? 8.965   -0.207  -4.843 1.00 1.18 ?  27 ASN A ND2  10 
ATOM   5696 H H    . ASN A 1 27 ? 8.186   -1.746  -0.265 1.00 0.20 ?  27 ASN A H    10 
ATOM   5697 H HA   . ASN A 1 27 ? 9.190   0.771   -0.929 1.00 0.34 ?  27 ASN A HA   10 
ATOM   5698 H HB2  . ASN A 1 27 ? 9.612   -1.287  -2.236 1.00 0.77 ?  27 ASN A HB2  10 
ATOM   5699 H HB3  . ASN A 1 27 ? 7.945   -1.255  -2.793 1.00 0.92 ?  27 ASN A HB3  10 
ATOM   5700 H HD21 . ASN A 1 27 ? 8.562   -1.098  -4.936 1.00 1.16 ?  27 ASN A HD21 10 
ATOM   5701 H HD22 . ASN A 1 27 ? 9.218   0.357   -5.605 1.00 1.75 ?  27 ASN A HD22 10 
ATOM   5702 N N    . LEU A 1 28 ? 5.991   0.385   -1.599 1.00 0.19 ?  28 LEU A N    10 
ATOM   5703 C CA   . LEU A 1 28 ? 4.758   1.099   -1.901 1.00 0.24 ?  28 LEU A CA   10 
ATOM   5704 C C    . LEU A 1 28 ? 4.385   2.084   -0.793 1.00 0.24 ?  28 LEU A C    10 
ATOM   5705 O O    . LEU A 1 28 ? 4.066   3.247   -1.061 1.00 0.29 ?  28 LEU A O    10 
ATOM   5706 C CB   . LEU A 1 28 ? 3.624   0.100   -2.116 1.00 0.28 ?  28 LEU A CB   10 
ATOM   5707 C CG   . LEU A 1 28 ? 3.704   -0.716  -3.405 1.00 0.38 ?  28 LEU A CG   10 
ATOM   5708 C CD1  . LEU A 1 28 ? 2.635   -1.795  -3.421 1.00 0.88 ?  28 LEU A CD1  10 
ATOM   5709 C CD2  . LEU A 1 28 ? 3.554   0.185   -4.619 1.00 0.72 ?  28 LEU A CD2  10 
ATOM   5710 H H    . LEU A 1 28 ? 5.954   -0.587  -1.451 1.00 0.18 ?  28 LEU A H    10 
ATOM   5711 H HA   . LEU A 1 28 ? 4.913   1.650   -2.815 1.00 0.30 ?  28 LEU A HA   10 
ATOM   5712 H HB2  . LEU A 1 28 ? 3.624   -0.586  -1.283 1.00 0.28 ?  28 LEU A HB2  10 
ATOM   5713 H HB3  . LEU A 1 28 ? 2.694   0.638   -2.114 1.00 0.33 ?  28 LEU A HB3  10 
ATOM   5714 H HG   . LEU A 1 28 ? 4.668   -1.197  -3.459 1.00 0.78 ?  28 LEU A HG   10 
ATOM   5715 H HD11 . LEU A 1 28 ? 2.783   -2.462  -2.583 1.00 1.30 ?  28 LEU A HD11 10 
ATOM   5716 H HD12 . LEU A 1 28 ? 2.702   -2.354  -4.341 1.00 1.54 ?  28 LEU A HD12 10 
ATOM   5717 H HD13 . LEU A 1 28 ? 1.659   -1.337  -3.348 1.00 1.23 ?  28 LEU A HD13 10 
ATOM   5718 H HD21 . LEU A 1 28 ? 3.527   -0.419  -5.513 1.00 1.32 ?  28 LEU A HD21 10 
ATOM   5719 H HD22 . LEU A 1 28 ? 4.390   0.866   -4.670 1.00 1.40 ?  28 LEU A HD22 10 
ATOM   5720 H HD23 . LEU A 1 28 ? 2.635   0.747   -4.536 1.00 1.20 ?  28 LEU A HD23 10 
ATOM   5721 N N    . LYS A 1 29 ? 4.438   1.619   0.447  1.00 0.24 ?  29 LYS A N    10 
ATOM   5722 C CA   . LYS A 1 29 ? 4.060   2.442   1.594  1.00 0.32 ?  29 LYS A CA   10 
ATOM   5723 C C    . LYS A 1 29 ? 5.089   3.544   1.839  1.00 0.34 ?  29 LYS A C    10 
ATOM   5724 O O    . LYS A 1 29 ? 4.781   4.577   2.431  1.00 0.40 ?  29 LYS A O    10 
ATOM   5725 C CB   . LYS A 1 29 ? 3.888   1.562   2.835  1.00 0.42 ?  29 LYS A CB   10 
ATOM   5726 C CG   . LYS A 1 29 ? 3.449   2.321   4.073  1.00 0.71 ?  29 LYS A CG   10 
ATOM   5727 C CD   . LYS A 1 29 ? 3.053   1.378   5.198  1.00 1.19 ?  29 LYS A CD   10 
ATOM   5728 C CE   . LYS A 1 29 ? 4.190   0.439   5.573  1.00 1.23 ?  29 LYS A CE   10 
ATOM   5729 N NZ   . LYS A 1 29 ? 3.844   -0.412  6.741  1.00 1.39 1  29 LYS A NZ   10 
ATOM   5730 H H    . LYS A 1 29 ? 4.738   0.694   0.599  1.00 0.22 ?  29 LYS A H    10 
ATOM   5731 H HA   . LYS A 1 29 ? 3.114   2.907   1.365  1.00 0.36 ?  29 LYS A HA   10 
ATOM   5732 H HB2  . LYS A 1 29 ? 3.141   0.811   2.624  1.00 0.78 ?  29 LYS A HB2  10 
ATOM   5733 H HB3  . LYS A 1 29 ? 4.829   1.075   3.050  1.00 0.60 ?  29 LYS A HB3  10 
ATOM   5734 H HG2  . LYS A 1 29 ? 4.265   2.944   4.409  1.00 1.23 ?  29 LYS A HG2  10 
ATOM   5735 H HG3  . LYS A 1 29 ? 2.602   2.939   3.820  1.00 1.29 ?  29 LYS A HG3  10 
ATOM   5736 H HD2  . LYS A 1 29 ? 2.781   1.961   6.063  1.00 1.64 ?  29 LYS A HD2  10 
ATOM   5737 H HD3  . LYS A 1 29 ? 2.206   0.790   4.874  1.00 1.75 ?  29 LYS A HD3  10 
ATOM   5738 H HE2  . LYS A 1 29 ? 4.406   -0.198  4.728  1.00 1.53 ?  29 LYS A HE2  10 
ATOM   5739 H HE3  . LYS A 1 29 ? 5.062   1.027   5.812  1.00 1.48 ?  29 LYS A HE3  10 
ATOM   5740 H HZ1  . LYS A 1 29 ? 4.600   -1.103  6.919  1.00 2.04 ?  29 LYS A HZ1  10 
ATOM   5741 H HZ2  . LYS A 1 29 ? 2.958   -0.926  6.563  1.00 1.56 ?  29 LYS A HZ2  10 
ATOM   5742 H HZ3  . LYS A 1 29 ? 3.723   0.178   7.588  1.00 1.51 ?  29 LYS A HZ3  10 
ATOM   5743 N N    . LYS A 1 30 ? 6.305   3.322   1.380  1.00 0.34 ?  30 LYS A N    10 
ATOM   5744 C CA   . LYS A 1 30 ? 7.336   4.345   1.429  1.00 0.43 ?  30 LYS A CA   10 
ATOM   5745 C C    . LYS A 1 30 ? 7.229   5.270   0.224  1.00 0.42 ?  30 LYS A C    10 
ATOM   5746 O O    . LYS A 1 30 ? 7.639   6.426   0.286  1.00 0.47 ?  30 LYS A O    10 
ATOM   5747 C CB   . LYS A 1 30 ? 8.721   3.704   1.484  1.00 0.54 ?  30 LYS A CB   10 
ATOM   5748 C CG   . LYS A 1 30 ? 9.030   3.028   2.810  1.00 1.28 ?  30 LYS A CG   10 
ATOM   5749 C CD   . LYS A 1 30 ? 10.356  2.285   2.760  1.00 1.67 ?  30 LYS A CD   10 
ATOM   5750 C CE   . LYS A 1 30 ? 10.715  1.681   4.113  1.00 2.49 ?  30 LYS A CE   10 
ATOM   5751 N NZ   . LYS A 1 30 ? 10.959  2.728   5.139  1.00 3.14 1  30 LYS A NZ   10 
ATOM   5752 H H    . LYS A 1 30 ? 6.527   2.436   1.013  1.00 0.33 ?  30 LYS A H    10 
ATOM   5753 H HA   . LYS A 1 30 ? 7.182   4.924   2.326  1.00 0.48 ?  30 LYS A HA   10 
ATOM   5754 H HB2  . LYS A 1 30 ? 8.790   2.962   0.701  1.00 0.89 ?  30 LYS A HB2  10 
ATOM   5755 H HB3  . LYS A 1 30 ? 9.463   4.466   1.310  1.00 1.06 ?  30 LYS A HB3  10 
ATOM   5756 H HG2  . LYS A 1 30 ? 9.078   3.780   3.583  1.00 1.89 ?  30 LYS A HG2  10 
ATOM   5757 H HG3  . LYS A 1 30 ? 8.241   2.325   3.036  1.00 1.85 ?  30 LYS A HG3  10 
ATOM   5758 H HD2  . LYS A 1 30 ? 10.284  1.492   2.030  1.00 2.02 ?  30 LYS A HD2  10 
ATOM   5759 H HD3  . LYS A 1 30 ? 11.133  2.977   2.466  1.00 1.96 ?  30 LYS A HD3  10 
ATOM   5760 H HE2  . LYS A 1 30 ? 9.900   1.053   4.442  1.00 2.89 ?  30 LYS A HE2  10 
ATOM   5761 H HE3  . LYS A 1 30 ? 11.609  1.083   4.001  1.00 2.91 ?  30 LYS A HE3  10 
ATOM   5762 H HZ1  . LYS A 1 30 ? 11.741  3.347   4.839  1.00 3.57 ?  30 LYS A HZ1  10 
ATOM   5763 H HZ2  . LYS A 1 30 ? 11.211  2.290   6.048  1.00 3.62 ?  30 LYS A HZ2  10 
ATOM   5764 H HZ3  . LYS A 1 30 ? 10.106  3.307   5.271  1.00 3.29 ?  30 LYS A HZ3  10 
ATOM   5765 N N    . GLU A 1 31 ? 6.679   4.754   -0.870 1.00 0.42 ?  31 GLU A N    10 
ATOM   5766 C CA   . GLU A 1 31 ? 6.509   5.529   -2.094 1.00 0.49 ?  31 GLU A CA   10 
ATOM   5767 C C    . GLU A 1 31 ? 5.365   6.528   -1.964 1.00 0.52 ?  31 GLU A C    10 
ATOM   5768 O O    . GLU A 1 31 ? 5.433   7.631   -2.507 1.00 0.70 ?  31 GLU A O    10 
ATOM   5769 C CB   . GLU A 1 31 ? 6.245   4.598   -3.282 1.00 0.52 ?  31 GLU A CB   10 
ATOM   5770 C CG   . GLU A 1 31 ? 6.170   5.317   -4.621 1.00 0.87 ?  31 GLU A CG   10 
ATOM   5771 C CD   . GLU A 1 31 ? 5.849   4.383   -5.770 1.00 1.47 ?  31 GLU A CD   10 
ATOM   5772 O OE1  . GLU A 1 31 ? 6.789   3.916   -6.441 1.00 1.67 ?  31 GLU A OE1  10 
ATOM   5773 O OE2  . GLU A 1 31 ? 4.652   4.121   -6.013 1.00 2.30 -1 31 GLU A OE2  10 
ATOM   5774 H H    . GLU A 1 31 ? 6.406   3.809   -0.864 1.00 0.41 ?  31 GLU A H    10 
ATOM   5775 H HA   . GLU A 1 31 ? 7.424   6.072   -2.270 1.00 0.57 ?  31 GLU A HA   10 
ATOM   5776 H HB2  . GLU A 1 31 ? 7.037   3.867   -3.335 1.00 0.87 ?  31 GLU A HB2  10 
ATOM   5777 H HB3  . GLU A 1 31 ? 5.308   4.087   -3.121 1.00 0.80 ?  31 GLU A HB3  10 
ATOM   5778 H HG2  . GLU A 1 31 ? 5.401   6.071   -4.566 1.00 1.45 ?  31 GLU A HG2  10 
ATOM   5779 H HG3  . GLU A 1 31 ? 7.119   5.790   -4.814 1.00 1.49 ?  31 GLU A HG3  10 
ATOM   5780 N N    . LYS A 1 32 ? 4.318   6.133   -1.239 1.00 0.43 ?  32 LYS A N    10 
ATOM   5781 C CA   . LYS A 1 32 ? 3.125   6.970   -1.082 1.00 0.55 ?  32 LYS A CA   10 
ATOM   5782 C C    . LYS A 1 32 ? 3.471   8.352   -0.518 1.00 0.66 ?  32 LYS A C    10 
ATOM   5783 O O    . LYS A 1 32 ? 2.730   9.316   -0.722 1.00 1.23 ?  32 LYS A O    10 
ATOM   5784 C CB   . LYS A 1 32 ? 2.092   6.287   -0.179 1.00 0.74 ?  32 LYS A CB   10 
ATOM   5785 C CG   . LYS A 1 32 ? 2.494   6.231   1.286  1.00 1.46 ?  32 LYS A CG   10 
ATOM   5786 C CD   . LYS A 1 32 ? 1.380   5.673   2.152  1.00 2.20 ?  32 LYS A CD   10 
ATOM   5787 C CE   . LYS A 1 32 ? 1.790   5.604   3.615  1.00 3.14 ?  32 LYS A CE   10 
ATOM   5788 N NZ   . LYS A 1 32 ? 2.051   6.950   4.187  1.00 3.91 1  32 LYS A NZ   10 
ATOM   5789 H H    . LYS A 1 32 ? 4.340   5.243   -0.815 1.00 0.38 ?  32 LYS A H    10 
ATOM   5790 H HA   . LYS A 1 32 ? 2.692   7.101   -2.061 1.00 0.79 ?  32 LYS A HA   10 
ATOM   5791 H HB2  . LYS A 1 32 ? 1.157   6.822   -0.252 1.00 1.02 ?  32 LYS A HB2  10 
ATOM   5792 H HB3  . LYS A 1 32 ? 1.944   5.275   -0.526 1.00 1.25 ?  32 LYS A HB3  10 
ATOM   5793 H HG2  . LYS A 1 32 ? 3.361   5.595   1.386  1.00 2.11 ?  32 LYS A HG2  10 
ATOM   5794 H HG3  . LYS A 1 32 ? 2.735   7.228   1.620  1.00 1.77 ?  32 LYS A HG3  10 
ATOM   5795 H HD2  . LYS A 1 32 ? 0.514   6.312   2.063  1.00 2.36 ?  32 LYS A HD2  10 
ATOM   5796 H HD3  . LYS A 1 32 ? 1.135   4.680   1.809  1.00 2.67 ?  32 LYS A HD3  10 
ATOM   5797 H HE2  . LYS A 1 32 ? 0.998   5.132   4.176  1.00 3.54 ?  32 LYS A HE2  10 
ATOM   5798 H HE3  . LYS A 1 32 ? 2.689   5.010   3.693  1.00 3.37 ?  32 LYS A HE3  10 
ATOM   5799 H HZ1  . LYS A 1 32 ? 1.210   7.552   4.085  1.00 3.96 ?  32 LYS A HZ1  10 
ATOM   5800 H HZ2  . LYS A 1 32 ? 2.849   7.403   3.699  1.00 4.35 ?  32 LYS A HZ2  10 
ATOM   5801 H HZ3  . LYS A 1 32 ? 2.283   6.870   5.197  1.00 4.36 ?  32 LYS A HZ3  10 
ATOM   5802 N N    . GLY A 1 33 ? 4.587   8.439   0.194  1.00 0.94 ?  33 GLY A N    10 
ATOM   5803 C CA   . GLY A 1 33 ? 5.019   9.706   0.743  1.00 1.34 ?  33 GLY A CA   10 
ATOM   5804 C C    . GLY A 1 33 ? 6.409   10.099  0.281  1.00 1.43 ?  33 GLY A C    10 
ATOM   5805 O O    . GLY A 1 33 ? 6.629   11.230  -0.158 1.00 1.99 ?  33 GLY A O    10 
ATOM   5806 H H    . GLY A 1 33 ? 5.120   7.631   0.354  1.00 1.26 ?  33 GLY A H    10 
ATOM   5807 H HA2  . GLY A 1 33 ? 4.322   10.471  0.440  1.00 1.68 ?  33 GLY A HA2  10 
ATOM   5808 H HA3  . GLY A 1 33 ? 5.017   9.639   1.820  1.00 1.72 ?  33 GLY A HA3  10 
ATOM   5809 N N    . LEU A 1 34 ? 7.350   9.171   0.370  1.00 1.27 ?  34 LEU A N    10 
ATOM   5810 C CA   . LEU A 1 34 ? 8.732   9.464   0.032  1.00 1.73 ?  34 LEU A CA   10 
ATOM   5811 C C    . LEU A 1 34 ? 9.162   8.801   -1.275 1.00 1.86 ?  34 LEU A C    10 
ATOM   5812 O O    . LEU A 1 34 ? 9.042   9.390   -2.352 1.00 2.56 ?  34 LEU A O    10 
ATOM   5813 C CB   . LEU A 1 34 ? 9.659   9.020   1.165  1.00 1.91 ?  34 LEU A CB   10 
ATOM   5814 C CG   . LEU A 1 34 ? 9.439   9.719   2.506  1.00 2.29 ?  34 LEU A CG   10 
ATOM   5815 C CD1  . LEU A 1 34 ? 10.286  9.064   3.584  1.00 2.76 ?  34 LEU A CD1  10 
ATOM   5816 C CD2  . LEU A 1 34 ? 9.771   11.199  2.396  1.00 3.08 ?  34 LEU A CD2  10 
ATOM   5817 H H    . LEU A 1 34 ? 7.113   8.267   0.677  1.00 1.11 ?  34 LEU A H    10 
ATOM   5818 H HA   . LEU A 1 34 ? 8.819   10.531  -0.084 1.00 2.15 ?  34 LEU A HA   10 
ATOM   5819 H HB2  . LEU A 1 34 ? 9.525   7.958   1.313  1.00 2.24 ?  34 LEU A HB2  10 
ATOM   5820 H HB3  . LEU A 1 34 ? 10.677  9.197   0.857  1.00 2.03 ?  34 LEU A HB3  10 
ATOM   5821 H HG   . LEU A 1 34 ? 8.402   9.626   2.789  1.00 2.45 ?  34 LEU A HG   10 
ATOM   5822 H HD11 . LEU A 1 34 ? 9.996   8.031   3.691  1.00 3.05 ?  34 LEU A HD11 10 
ATOM   5823 H HD12 . LEU A 1 34 ? 10.137  9.579   4.520  1.00 3.27 ?  34 LEU A HD12 10 
ATOM   5824 H HD13 . LEU A 1 34 ? 11.327  9.119   3.305  1.00 2.92 ?  34 LEU A HD13 10 
ATOM   5825 H HD21 . LEU A 1 34 ? 10.779  11.314  2.025  1.00 3.53 ?  34 LEU A HD21 10 
ATOM   5826 H HD22 . LEU A 1 34 ? 9.693   11.657  3.372  1.00 3.41 ?  34 LEU A HD22 10 
ATOM   5827 H HD23 . LEU A 1 34 ? 9.081   11.676  1.717  1.00 3.42 ?  34 LEU A HD23 10 
ATOM   5828 N N    . PHE A 1 35 ? 9.639   7.565   -1.174 1.00 1.42 ?  35 PHE A N    10 
ATOM   5829 C CA   . PHE A 1 35 ? 10.275  6.875   -2.288 1.00 1.78 ?  35 PHE A CA   10 
ATOM   5830 C C    . PHE A 1 35 ? 10.044  5.376   -2.171 1.00 2.17 ?  35 PHE A C    10 
ATOM   5831 O O    . PHE A 1 35 ? 10.354  4.771   -1.144 1.00 2.84 ?  35 PHE A O    10 
ATOM   5832 C CB   . PHE A 1 35 ? 11.783  7.159   -2.316 1.00 1.55 ?  35 PHE A CB   10 
ATOM   5833 C CG   . PHE A 1 35 ? 12.129  8.619   -2.428 1.00 1.48 ?  35 PHE A CG   10 
ATOM   5834 C CD1  . PHE A 1 35 ? 12.098  9.259   -3.657 1.00 1.95 ?  35 PHE A CD1  10 
ATOM   5835 C CD2  . PHE A 1 35 ? 12.494  9.346   -1.309 1.00 1.61 ?  35 PHE A CD2  10 
ATOM   5836 C CE1  . PHE A 1 35 ? 12.426  10.596  -3.765 1.00 2.46 ?  35 PHE A CE1  10 
ATOM   5837 C CE2  . PHE A 1 35 ? 12.823  10.685  -1.411 1.00 1.99 ?  35 PHE A CE2  10 
ATOM   5838 C CZ   . PHE A 1 35 ? 12.745  11.321  -2.631 1.00 2.41 ?  35 PHE A CZ   10 
ATOM   5839 H H    . PHE A 1 35 ? 9.526   7.084   -0.323 1.00 1.04 ?  35 PHE A H    10 
ATOM   5840 H HA   . PHE A 1 35 ? 9.828   7.230   -3.204 1.00 2.31 ?  35 PHE A HA   10 
ATOM   5841 H HB2  . PHE A 1 35 ? 12.227  6.784   -1.406 1.00 1.53 ?  35 PHE A HB2  10 
ATOM   5842 H HB3  . PHE A 1 35 ? 12.220  6.647   -3.159 1.00 1.88 ?  35 PHE A HB3  10 
ATOM   5843 H HD1  . PHE A 1 35 ? 11.815  8.703   -4.537 1.00 2.21 ?  35 PHE A HD1  10 
ATOM   5844 H HD2  . PHE A 1 35 ? 12.523  8.859   -0.348 1.00 1.82 ?  35 PHE A HD2  10 
ATOM   5845 H HE1  . PHE A 1 35 ? 12.400  11.082  -4.729 1.00 3.08 ?  35 PHE A HE1  10 
ATOM   5846 H HE2  . PHE A 1 35 ? 13.106  11.242  -0.531 1.00 2.26 ?  35 PHE A HE2  10 
ATOM   5847 H HZ   . PHE A 1 35 ? 12.984  12.369  -2.710 1.00 2.93 ?  35 PHE A HZ   10 
HETATM 5848 N N    . NH2 A 1 36 ? 9.470   4.784   -3.201 1.00 2.32 ?  36 NH2 A N    10 
HETATM 5849 H HN1  . NH2 A 1 36 ? 9.251   5.328   -3.987 1.00 2.41 ?  36 NH2 A HN1  10 
HETATM 5850 H HN2  . NH2 A 1 36 ? 9.283   3.821   -3.139 1.00 2.69 ?  36 NH2 A HN2  10 
# 
