data_8Q6M
# 
_entry.id   8Q6M 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.383 
_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   8Q6M         pdb_00008q6m 10.2210/pdb8q6m/pdb 
WWPDB D_1292132692 ?            ?                   
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.details        . 
_pdbx_database_related.db_id          8CCX 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8Q6M 
_pdbx_database_status.recvd_initial_deposition_date   2023-08-14 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Antonyuk, S.V.' 1 0000-0002-2779-9946 
'Hossain, A.'    2 0000-0001-7765-9629 
'Agar, J.N.'     3 0000-0003-2645-1873 
'Hasnain, S.S.'  4 0000-0002-2854-4718 
# 
_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                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'Protein crosslinking as a therapeutic strategy for SOD1-related ALS' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Hossain, A.'       1  ? 
primary 'Sarin, R.'         2  ? 
primary 'Donnellya, D.P.'   3  ? 
primary 'Miller, B.C.'      4  ? 
primary 'Salisbury, J.P.'   5  ? 
primary 'Amin, J.'          6  ? 
primary 'Conway, J.B.'      7  ? 
primary 'Watson, S.S.'      8  ? 
primary 'Xu, X.'            9  ? 
primary 'Alam, N.'          10 ? 
primary 'Shahbazian, H.'    11 ? 
primary 'Sivasankar, D.'    12 ? 
primary 'Ponmudiyana, A.C.' 13 ? 
primary 'Gawde, T.'         14 ? 
primary 'Yang, W.'          15 ? 
primary 'Kannapadi, S.'     16 ? 
primary 'Plant, L.D.'       17 ? 
primary 'Auclair, J.R.'     18 ? 
primary 'Makowski, L.'      19 ? 
primary 'Ringe, D.'         20 ? 
primary 'Greenblatti, D.J.' 21 ? 
primary 'Chen, Y.'          22 ? 
primary 'Manetsch, R.'      23 ? 
primary 'Antonyuk, S.S.'    24 ? 
primary 'Hasnain, S.S.'     25 ? 
primary 'Agar, J.N.'        26 ? 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   106.280 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8Q6M 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     39.260 
_cell.length_a_esd                 ? 
_cell.length_b                     68.010 
_cell.length_b_esd                 ? 
_cell.length_c                     52.580 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8Q6M 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'Superoxide dismutase [Cu-Zn]' 15958.757 2   1.15.1.1 ? ? ? 
2 non-polymer syn 'ACETATE ION'                  59.044    1   ?        ? ? ? 
3 non-polymer syn 'ZINC ION'                     65.409    2   ?        ? ? ? 
4 non-polymer syn 'COPPER (II) ION'              63.546    2   ?        ? ? ? 
5 non-polymer syn 'SULFATE ION'                  96.063    3   ?        ? ? ? 
6 water       nat water                          18.015    333 ?        ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Superoxide dismutase 1,hSod1' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;MATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEER
HVGDLGNVTADKDGVADVSIEDSVISLSGDHCIIGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEER
HVGDLGNVTADKDGVADVSIEDSVISLSGDHCIIGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
;
_entity_poly.pdbx_strand_id                 A,B 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   ALA n 
1 3   THR n 
1 4   LYS n 
1 5   ALA n 
1 6   VAL n 
1 7   CYS n 
1 8   VAL n 
1 9   LEU n 
1 10  LYS n 
1 11  GLY n 
1 12  ASP n 
1 13  GLY n 
1 14  PRO n 
1 15  VAL n 
1 16  GLN n 
1 17  GLY n 
1 18  ILE n 
1 19  ILE n 
1 20  ASN n 
1 21  PHE n 
1 22  GLU n 
1 23  GLN n 
1 24  LYS n 
1 25  GLU n 
1 26  SER n 
1 27  ASN n 
1 28  GLY n 
1 29  PRO n 
1 30  VAL n 
1 31  LYS n 
1 32  VAL n 
1 33  TRP n 
1 34  GLY n 
1 35  SER n 
1 36  ILE n 
1 37  LYS n 
1 38  GLY n 
1 39  LEU n 
1 40  THR n 
1 41  GLU n 
1 42  GLY n 
1 43  LEU n 
1 44  HIS n 
1 45  GLY n 
1 46  PHE n 
1 47  HIS n 
1 48  VAL n 
1 49  HIS n 
1 50  GLU n 
1 51  PHE n 
1 52  GLY n 
1 53  ASP n 
1 54  ASN n 
1 55  THR n 
1 56  ALA n 
1 57  GLY n 
1 58  CYS n 
1 59  THR n 
1 60  SER n 
1 61  ALA n 
1 62  GLY n 
1 63  PRO n 
1 64  HIS n 
1 65  PHE n 
1 66  ASN n 
1 67  PRO n 
1 68  LEU n 
1 69  SER n 
1 70  ARG n 
1 71  LYS n 
1 72  HIS n 
1 73  GLY n 
1 74  GLY n 
1 75  PRO n 
1 76  LYS n 
1 77  ASP n 
1 78  GLU n 
1 79  GLU n 
1 80  ARG n 
1 81  HIS n 
1 82  VAL n 
1 83  GLY n 
1 84  ASP n 
1 85  LEU n 
1 86  GLY n 
1 87  ASN n 
1 88  VAL n 
1 89  THR n 
1 90  ALA n 
1 91  ASP n 
1 92  LYS n 
1 93  ASP n 
1 94  GLY n 
1 95  VAL n 
1 96  ALA n 
1 97  ASP n 
1 98  VAL n 
1 99  SER n 
1 100 ILE n 
1 101 GLU n 
1 102 ASP n 
1 103 SER n 
1 104 VAL n 
1 105 ILE n 
1 106 SER n 
1 107 LEU n 
1 108 SER n 
1 109 GLY n 
1 110 ASP n 
1 111 HIS n 
1 112 CYS n 
1 113 ILE n 
1 114 ILE n 
1 115 GLY n 
1 116 ARG n 
1 117 THR n 
1 118 LEU n 
1 119 VAL n 
1 120 VAL n 
1 121 HIS n 
1 122 GLU n 
1 123 LYS n 
1 124 ALA n 
1 125 ASP n 
1 126 ASP n 
1 127 LEU n 
1 128 GLY n 
1 129 LYS n 
1 130 GLY n 
1 131 GLY n 
1 132 ASN n 
1 133 GLU n 
1 134 GLU n 
1 135 SER n 
1 136 THR n 
1 137 LYS n 
1 138 THR n 
1 139 GLY n 
1 140 ASN n 
1 141 ALA n 
1 142 GLY n 
1 143 SER n 
1 144 ARG n 
1 145 LEU n 
1 146 ALA n 
1 147 CYS n 
1 148 GLY n 
1 149 VAL n 
1 150 ILE n 
1 151 GLY n 
1 152 ILE n 
1 153 ALA n 
1 154 GLN n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   154 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 SOD1 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     511693 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       pET28 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    SODC_HUMAN 
_struct_ref.pdbx_db_accession          P00441 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEER
HVGDLGNVTADKDGVADVSIEDSVISLSGDHCIIGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
;
_struct_ref.pdbx_align_begin           1 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 8Q6M A 1 ? 154 ? P00441 1 ? 154 ? 0 153 
2 1 8Q6M B 1 ? 154 ? P00441 1 ? 154 ? 0 153 
# 
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 
ACT non-polymer         . 'ACETATE ION'     ? 'C2 H3 O2 -1'    59.044  
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 
CU  non-polymer         . 'COPPER (II) ION' ? 'Cu 2'           63.546  
CYS 'L-peptide linking' y CYSTEINE          ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE         ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'   ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE           ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE         ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER             ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE        ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE           ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE            ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE        ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE     ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE           ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE            ? 'C3 H7 N O3'     105.093 
SO4 non-polymer         . 'SULFATE ION'     ? 'O4 S -2'        96.063  
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 
ZN  non-polymer         . 'ZINC ION'        ? 'Zn 2'           65.409  
# 
_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                   8Q6M 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.11 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          0.40 
_exptl_crystal.description                  plates 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              4.75 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '2.5 M Ammonium sulphate, Acetate buffer pH 4.75' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER R 4M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-01-17 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.54180 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      'ROTATING ANODE' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'RIGAKU FR-E' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.54180 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_synchrotron_site       ? 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8Q6M 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.77 
_reflns.d_resolution_low                               37.69 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     25235 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           97.3 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                3.3 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          3.9 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.184 
_reflns.pdbx_Rpim_I_all                                0.125 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.974 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.135 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_percent_possible_ellipsoidal 
_reflns_shell.pdbx_percent_possible_spherical 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous 
_reflns_shell.pdbx_percent_possible_spherical_anomalous 
_reflns_shell.pdbx_redundancy_anomalous 
_reflns_shell.pdbx_CC_half_anomalous 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous 
_reflns_shell.pdbx_percent_possible_anomalous 
9.03 37.69 ? ? ? ? ? ? 598  ? ? ? ? ? ? ? ? ? ? ? 2.9 ? ? ? 0.123 0.086 ? 1 1 0.988 ? ? ? ? 0.088 ? ? ? ? ? ? ? ? ? 
1.77 1.81  ? ? ? ? ? ? 4774 ? ? ? ? ? ? ? ? ? ? ? 3.3 ? ? ? 0.569 0.393 ? 2 1 0.649 ? ? ? ? 0.411 ? ? ? ? ? ? ? ? ? 
# 
_refine.aniso_B[1][1]                            0.994 
_refine.aniso_B[1][2]                            0.000 
_refine.aniso_B[1][3]                            -1.423 
_refine.aniso_B[2][2]                            -1.241 
_refine.aniso_B[2][3]                            -0.000 
_refine.aniso_B[3][3]                            0.921 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               19.766 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.943 
_refine.correlation_coeff_Fo_to_Fc_free          0.897 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8Q6M 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.770 
_refine.ls_d_res_low                             35.338 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     25220 
_refine.ls_number_reflns_R_free                  933 
_refine.ls_number_reflns_R_work                  24287 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    97.221 
_refine.ls_percent_reflns_R_free                 3.699 
_refine.ls_R_factor_all                          0.211 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2505 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2089 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      0.274 
_refine.ls_wR_factor_R_work                      0.230 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.164 
_refine.pdbx_overall_ESU_R_Free                  0.149 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             3.695 
_refine.overall_SU_ML                            0.118 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    0.9001 
_refine.pdbx_average_fsc_free                    0.8964 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.770 
_refine_hist.d_res_low                        35.338 
_refine_hist.number_atoms_solvent             333 
_refine_hist.number_atoms_total               2576 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        2220 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         23 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.009  0.013  2312 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  2135 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.659  1.629  3126 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 1.272  1.596  4959 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 9.904  5.000  313  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 36.885 24.528 106  ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.812 15.000 377  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.336 15.000 8    ? r_dihedral_angle_4_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.073  0.200  294  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.008  0.020  2716 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.002  0.020  464  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.181  0.200  394  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.176  0.200  1796 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.134  0.200  1030 ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.075  0.200  973  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.191  0.200  166  ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.030  0.200  2    ? r_symmetry_xyhbond_nbd_other   ? ? 
'X-RAY DIFFRACTION' ? 0.038  0.200  4    ? r_metal_ion_refined            ? ? 
'X-RAY DIFFRACTION' ? 0.259  0.200  29   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.168  0.200  56   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.208  0.200  28   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 1.522  1.912  1244 ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.518  1.911  1243 ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 2.400  2.857  1553 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 2.400  2.857  1554 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 1.923  2.182  1068 ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.886  2.155  1056 ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.067  3.169  1571 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.031  3.125  1553 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 5.173  23.954 2359 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 4.815  23.373 2294 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.770 1.816 . . 20 1846 97.0047  . . . . 0.334 . . . . . . . . . . . .     
'X-RAY DIFFRACTION' 3.953 4.562 . . 37 772  99.8765  . . . . 0.169 . . . . . . . . . . . 0.197 
'X-RAY DIFFRACTION' 5.580 7.866 . . 20 525  100.0000 . . . . 0.237 . . . . . . . . . . . 0.314 
# 
_struct.entry_id                     8Q6M 
_struct.title                        'Human SOD1 low dose data collecton' 
_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        8Q6M 
_struct_keywords.text            
'SOD1, Amyotrophic Lateral Sclerosis, ALS, pharmacological chaperone, cross-linking, stabilization, OXIDOREDUCTASE' 
_struct_keywords.pdbx_keywords   OXIDOREDUCTASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 1 ? 
C N N 2 ? 
D N N 3 ? 
E N N 4 ? 
F N N 5 ? 
G N N 5 ? 
H N N 3 ? 
I N N 4 ? 
J N N 5 ? 
K N N 6 ? 
L N N 6 ? 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 GLY A 57  ? GLY A 62  ? GLY A 56  GLY A 61  5 ? 6 
HELX_P HELX_P2 AA2 GLU A 133 ? LYS A 137 ? GLU A 132 LYS A 136 5 ? 5 
HELX_P HELX_P3 AA3 GLY B 57  ? GLY B 62  ? GLY B 56  GLY B 61  5 ? 6 
HELX_P HELX_P4 AA4 GLU B 134 ? GLY B 139 ? GLU B 133 GLY B 138 1 ? 6 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ? ? A CYS 58  SG  ? ? ? 1_555 A CYS 147 SG ? ? A CYS 57  A CYS 146 1_555 ? ? ? ? ? ? ? 2.089 ? ? 
disulf2  disulf ? ? B CYS 58  SG  ? ? ? 1_555 B CYS 147 SG ? ? B CYS 57  B CYS 146 1_555 ? ? ? ? ? ? ? 2.091 ? ? 
metalc1  metalc ? ? A HIS 47  ND1 ? ? ? 1_555 E CU  .   CU ? ? A HIS 46  A CU  203 1_555 ? ? ? ? ? ? ? 2.112 ? ? 
metalc2  metalc ? ? A HIS 49  NE2 ? ? ? 1_555 E CU  .   CU ? ? A HIS 48  A CU  203 1_555 ? ? ? ? ? ? ? 2.164 ? ? 
metalc3  metalc ? ? A HIS 64  ND1 ? ? ? 1_555 D ZN  .   ZN ? ? A HIS 63  A ZN  202 1_555 ? ? ? ? ? ? ? 2.115 ? ? 
metalc4  metalc ? ? A HIS 72  ND1 ? ? ? 1_555 D ZN  .   ZN ? ? A HIS 71  A ZN  202 1_555 ? ? ? ? ? ? ? 2.253 ? ? 
metalc5  metalc ? ? A HIS 81  ND1 ? ? ? 1_555 D ZN  .   ZN ? ? A HIS 80  A ZN  202 1_555 ? ? ? ? ? ? ? 2.002 ? ? 
metalc6  metalc ? ? A ASP 84  OD1 ? ? ? 1_555 D ZN  .   ZN ? ? A ASP 83  A ZN  202 1_555 ? ? ? ? ? ? ? 2.008 ? ? 
metalc7  metalc ? ? A HIS 121 NE2 ? ? ? 1_555 E CU  .   CU ? ? A HIS 120 A CU  203 1_555 ? ? ? ? ? ? ? 2.040 ? ? 
metalc8  metalc ? ? B HIS 47  ND1 ? ? ? 1_555 I CU  .   CU ? ? B HIS 46  B CU  202 1_555 ? ? ? ? ? ? ? 2.250 ? ? 
metalc9  metalc ? ? B HIS 49  NE2 ? ? ? 1_555 I CU  .   CU ? ? B HIS 48  B CU  202 1_555 ? ? ? ? ? ? ? 2.050 ? ? 
metalc10 metalc ? ? B HIS 64  ND1 ? ? ? 1_555 H ZN  .   ZN ? ? B HIS 63  B ZN  201 1_555 ? ? ? ? ? ? ? 2.134 ? ? 
metalc11 metalc ? ? B HIS 72  ND1 ? ? ? 1_555 H ZN  .   ZN ? ? B HIS 71  B ZN  201 1_555 ? ? ? ? ? ? ? 2.213 ? ? 
metalc12 metalc ? ? B HIS 81  ND1 ? ? ? 1_555 H ZN  .   ZN ? ? B HIS 80  B ZN  201 1_555 ? ? ? ? ? ? ? 2.053 ? ? 
metalc13 metalc ? ? B ASP 84  OD1 ? ? ? 1_555 H ZN  .   ZN ? ? B ASP 83  B ZN  201 1_555 ? ? ? ? ? ? ? 1.973 ? ? 
metalc14 metalc ? ? B HIS 121 NE2 ? ? ? 1_555 I CU  .   CU ? ? B HIS 120 B CU  202 1_555 ? ? ? ? ? ? ? 2.055 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
metalc ? ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 4 ? 
AA3 ? 5 ? 
AA4 ? 4 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA3 4 5 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA4 2 3 ? anti-parallel 
AA4 3 4 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ALA A 96  ? ASP A 102 ? ALA A 95  ASP A 101 
AA1 2 VAL A 30  ? LYS A 37  ? VAL A 29  LYS A 36  
AA1 3 GLN A 16  ? GLN A 23  ? GLN A 15  GLN A 22  
AA1 4 LYS A 4   ? LEU A 9   ? LYS A 3   LEU A 8   
AA1 5 GLY A 151 ? ILE A 152 ? GLY A 150 ILE A 151 
AA2 1 ASP A 84  ? ALA A 90  ? ASP A 83  ALA A 89  
AA2 2 GLY A 42  ? HIS A 49  ? GLY A 41  HIS A 48  
AA2 3 THR A 117 ? HIS A 121 ? THR A 116 HIS A 120 
AA2 4 ARG A 144 ? VAL A 149 ? ARG A 143 VAL A 148 
AA3 1 ALA B 96  ? ASP B 102 ? ALA B 95  ASP B 101 
AA3 2 VAL B 30  ? LYS B 37  ? VAL B 29  LYS B 36  
AA3 3 GLN B 16  ? GLU B 22  ? GLN B 15  GLU B 21  
AA3 4 LYS B 4   ? LYS B 10  ? LYS B 3   LYS B 9   
AA3 5 GLY B 151 ? ILE B 152 ? GLY B 150 ILE B 151 
AA4 1 ASP B 84  ? ALA B 90  ? ASP B 83  ALA B 89  
AA4 2 GLY B 42  ? HIS B 49  ? GLY B 41  HIS B 48  
AA4 3 THR B 117 ? HIS B 121 ? THR B 116 HIS B 120 
AA4 4 ARG B 144 ? VAL B 149 ? ARG B 143 VAL B 148 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O ILE A 100 ? O ILE A 99  N VAL A 32  ? N VAL A 31  
AA1 2 3 O TRP A 33  ? O TRP A 32  N ASN A 20  ? N ASN A 19  
AA1 3 4 O GLY A 17  ? O GLY A 16  N LEU A 9   ? N LEU A 8   
AA1 4 5 N VAL A 6   ? N VAL A 5   O GLY A 151 ? O GLY A 150 
AA2 1 2 O ALA A 90  ? O ALA A 89  N GLY A 42  ? N GLY A 41  
AA2 2 3 N HIS A 49  ? N HIS A 48  O THR A 117 ? O THR A 116 
AA2 3 4 N LEU A 118 ? N LEU A 117 O GLY A 148 ? O GLY A 147 
AA3 1 2 O ALA B 96  ? O ALA B 95  N ILE B 36  ? N ILE B 35  
AA3 2 3 O TRP B 33  ? O TRP B 32  N ASN B 20  ? N ASN B 19  
AA3 3 4 O GLY B 17  ? O GLY B 16  N LEU B 9   ? N LEU B 8   
AA3 4 5 N VAL B 6   ? N VAL B 5   O GLY B 151 ? O GLY B 150 
AA4 1 2 O ALA B 90  ? O ALA B 89  N GLY B 42  ? N GLY B 41  
AA4 2 3 N HIS B 49  ? N HIS B 48  O THR B 117 ? O THR B 116 
AA4 3 4 N VAL B 120 ? N VAL B 119 O ALA B 146 ? O ALA B 145 
# 
_atom_sites.entry_id                    8Q6M 
_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]   0.025471 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.007439 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.014704 
_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]   0.019813 
_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 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  6  6  2.310  20.844 1.020 10.208 1.589 0.569  0.865 51.651 0.216   
CU 29 29 13.344 3.583  7.171 0.247  5.619 11.397 1.674 64.813 -0.828  
H  1  1  0.493  10.511 0.323 26.126 0.140 3.142  0.041 57.800 0.003   
N  7  7  12.222 0.006  3.135 9.893  2.014 28.997 1.167 0.583  -11.538 
O  8  8  3.049  13.277 2.287 5.701  1.546 0.324  0.867 32.909 0.251   
S  16 16 6.905  1.468  5.203 22.215 1.438 0.254  1.586 56.172 1.184   
ZN 30 30 14.081 3.266  7.035 0.233  5.168 10.316 2.411 58.710 -0.308  
# 
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_site.calc_flag 
ATOM   1    N  N    A ALA A 1 2   ? 10.302  15.112  23.807  0.500 35.280 0 1   ALA A N    1 ? 
ATOM   2    C  CA   A ALA A 1 2   ? 8.862   15.145  24.228  0.500 33.918 0 1   ALA A CA   1 ? 
ATOM   3    C  C    . ALA A 1 2   ? 8.705   14.558  25.639  1.000 34.646 0 1   ALA A C    1 ? 
ATOM   4    O  O    . ALA A 1 2   ? 9.282   13.496  25.902  1.000 35.751 0 1   ALA A O    1 ? 
ATOM   5    C  CB   A ALA A 1 2   ? 8.024   14.385  23.228  0.500 34.408 0 1   ALA A CB   1 ? 
ATOM   6    H  H    . ALA A 1 2   ? 10.384  14.604  23.055  0.500 34.859 0 1   ALA A H    1 c 
ATOM   7    H  HA   . ALA A 1 2   ? 8.564   16.085  24.245  0.500 34.390 0 1   ALA A HA   1 c 
ATOM   8    H  HB1  . ALA A 1 2   ? 7.092   14.403  23.504  0.500 34.260 0 1   ALA A HB1  1 c 
ATOM   9    H  HB2  . ALA A 1 2   ? 8.109   14.797  22.352  0.500 34.260 0 1   ALA A HB2  1 c 
ATOM   10   H  HB3  . ALA A 1 2   ? 8.329   13.463  23.182  0.500 34.260 0 1   ALA A HB3  1 c 
ATOM   11   N  N    . THR A 1 3   ? 7.969   15.243  26.519  1.000 30.771 0 2   THR A N    1 ? 
ATOM   12   C  CA   . THR A 1 3   ? 7.453   14.694  27.797  1.000 25.389 0 2   THR A CA   1 ? 
ATOM   13   C  C    . THR A 1 3   ? 5.977   14.301  27.629  1.000 20.997 0 2   THR A C    1 ? 
ATOM   14   O  O    . THR A 1 3   ? 5.525   13.466  28.435  1.000 17.360 0 2   THR A O    1 ? 
ATOM   15   C  CB   . THR A 1 3   ? 7.710   15.643  28.981  1.000 30.296 0 2   THR A CB   1 ? 
ATOM   16   O  OG1  . THR A 1 3   ? 7.175   16.949  28.742  1.000 35.733 0 2   THR A OG1  1 ? 
ATOM   17   C  CG2  . THR A 1 3   ? 9.179   15.799  29.310  1.000 30.550 0 2   THR A CG2  1 ? 
ATOM   18   H  H    . THR A 1 3   ? 7.737   16.119  26.398  1.000 30.208 0 2   THR A H    1 c 
ATOM   19   H  HA   . THR A 1 3   ? 7.958   13.863  27.977  1.000 26.298 0 2   THR A HA   1 c 
ATOM   20   H  HB   . THR A 1 3   ? 7.254   15.260  29.770  1.000 30.288 0 2   THR A HB   1 c 
ATOM   21   H  HG1  . THR A 1 3   ? 7.283   17.420  29.436  0.000 36.770 0 2   THR A HG1  1 c 
ATOM   22   H  HG21 . THR A 1 3   ? 9.563   14.918  29.542  1.000 30.476 0 2   THR A HG21 1 c 
ATOM   23   H  HG22 . THR A 1 3   ? 9.282   16.414  30.078  1.000 30.476 0 2   THR A HG22 1 c 
ATOM   24   H  HG23 . THR A 1 3   ? 9.656   16.169  28.527  1.000 30.476 0 2   THR A HG23 1 c 
ATOM   25   N  N    . LYS A 1 4   ? 5.249   14.827  26.623  1.000 17.747 0 3   LYS A N    1 ? 
ATOM   26   C  CA   . LYS A 1 4   ? 3.799   14.537  26.466  1.000 18.270 0 3   LYS A CA   1 ? 
ATOM   27   C  C    . LYS A 1 4   ? 3.403   14.222  25.023  1.000 16.030 0 3   LYS A C    1 ? 
ATOM   28   O  O    . LYS A 1 4   ? 3.972   14.822  24.083  1.000 15.248 0 3   LYS A O    1 ? 
ATOM   29   C  CB   . LYS A 1 4   ? 2.963   15.703  26.991  1.000 21.399 0 3   LYS A CB   1 ? 
ATOM   30   C  CG   . LYS A 1 4   ? 3.022   15.849  28.507  1.000 21.708 0 3   LYS A CG   1 ? 
ATOM   31   C  CD   . LYS A 1 4   ? 2.033   16.833  29.084  1.000 24.109 0 3   LYS A CD   1 ? 
ATOM   32   C  CE   . LYS A 1 4   ? 2.186   16.964  30.589  1.000 25.909 0 3   LYS A CE   1 ? 
ATOM   33   N  NZ   . LYS A 1 4   ? 1.352   18.041  31.163  1.000 26.492 0 3   LYS A NZ   1 ? 
ATOM   34   H  H    . LYS A 1 4   ? 5.592   15.385  25.992  1.000 18.644 0 3   LYS A H    1 c 
ATOM   35   H  HA   . LYS A 1 4   ? 3.593   13.746  27.012  1.000 18.244 0 3   LYS A HA   1 c 
ATOM   36   H  HB2  . LYS A 1 4   ? 3.283   16.533  26.580  1.000 20.682 0 3   LYS A HB2  1 c 
ATOM   37   H  HB3  . LYS A 1 4   ? 2.030   15.571  26.722  1.000 20.674 0 3   LYS A HB3  1 c 
ATOM   38   H  HG2  . LYS A 1 4   ? 2.862   14.969  28.911  1.000 22.164 0 3   LYS A HG2  1 c 
ATOM   39   H  HG3  . LYS A 1 4   ? 3.928   16.130  28.757  1.000 22.172 0 3   LYS A HG3  1 c 
ATOM   40   H  HD2  . LYS A 1 4   ? 2.171   17.711  28.670  1.000 23.917 0 3   LYS A HD2  1 c 
ATOM   41   H  HD3  . LYS A 1 4   ? 1.121   16.537  28.877  1.000 23.920 0 3   LYS A HD3  1 c 
ATOM   42   H  HE2  . LYS A 1 4   ? 1.939   16.120  31.009  1.000 25.618 0 3   LYS A HE2  1 c 
ATOM   43   H  HE3  . LYS A 1 4   ? 3.121   17.143  30.804  1.000 25.608 0 3   LYS A HE3  1 c 
ATOM   44   H  HZ1  . LYS A 1 4   ? 1.596   18.840  30.810  1.000 26.309 0 3   LYS A HZ1  1 c 
ATOM   45   H  HZ2  . LYS A 1 4   ? 1.460   18.067  32.063  1.000 26.309 0 3   LYS A HZ2  1 c 
ATOM   46   H  HZ3  . LYS A 1 4   ? 0.478   17.886  30.973  1.000 26.309 0 3   LYS A HZ3  1 c 
ATOM   47   N  N    . ALA A 1 5   ? 2.405   13.338  24.881  1.000 13.757 0 4   ALA A N    1 ? 
ATOM   48   C  CA   . ALA A 1 5   ? 1.908   12.879  23.564  1.000 13.830 0 4   ALA A CA   1 ? 
ATOM   49   C  C    . ALA A 1 5   ? 0.401   12.633  23.623  1.000 12.612 0 4   ALA A C    1 ? 
ATOM   50   O  O    . ALA A 1 5   ? -0.138  12.525  24.728  1.000 12.000 0 4   ALA A O    1 ? 
ATOM   51   C  CB   . ALA A 1 5   ? 2.674   11.653  23.166  1.000 13.783 0 4   ALA A CB   1 ? 
ATOM   52   H  H    . ALA A 1 5   ? 1.963   12.955  25.579  1.000 14.294 0 4   ALA A H    1 c 
ATOM   53   H  HA   . ALA A 1 5   ? 2.080   13.589  22.904  1.000 13.577 0 4   ALA A HA   1 c 
ATOM   54   H  HB1  . ALA A 1 5   ? 2.345   11.329  22.310  1.000 13.797 0 4   ALA A HB1  1 c 
ATOM   55   H  HB2  . ALA A 1 5   ? 3.618   11.872  23.086  1.000 13.797 0 4   ALA A HB2  1 c 
ATOM   56   H  HB3  . ALA A 1 5   ? 2.559   10.964  23.836  1.000 13.794 0 4   ALA A HB3  1 c 
ATOM   57   N  N    . VAL A 1 6   ? -0.268  12.495  22.478  1.000 12.493 0 5   VAL A N    1 ? 
ATOM   58   C  CA   . VAL A 1 6   ? -1.758  12.356  22.414  1.000 11.944 0 5   VAL A CA   1 ? 
ATOM   59   C  C    . VAL A 1 6   ? -2.147  11.611  21.137  1.000 12.415 0 5   VAL A C    1 ? 
ATOM   60   O  O    . VAL A 1 6   ? -1.415  11.723  20.105  1.000 11.402 0 5   VAL A O    1 ? 
ATOM   61   C  CB   . VAL A 1 6   ? -2.467  13.729  22.486  1.000 13.400 0 5   VAL A CB   1 ? 
ATOM   62   C  CG1  . VAL A 1 6   ? -2.204  14.570  21.250  1.000 14.629 0 5   VAL A CG1  1 ? 
ATOM   63   C  CG2  . VAL A 1 6   ? -3.955  13.587  22.692  1.000 12.996 0 5   VAL A CG2  1 ? 
ATOM   64   H  H    . VAL A 1 6   ? 0.141   12.480  21.663  1.000 12.390 0 5   VAL A H    1 c 
ATOM   65   H  HA   . VAL A 1 6   ? -2.046  11.823  23.175  1.000 12.412 0 5   VAL A HA   1 c 
ATOM   66   H  HB   . VAL A 1 6   ? -2.099  14.212  23.265  1.000 13.254 0 5   VAL A HB   1 c 
ATOM   67   H  HG11 . VAL A 1 6   ? -1.249  14.582  21.062  1.000 14.236 0 5   VAL A HG11 1 c 
ATOM   68   H  HG12 . VAL A 1 6   ? -2.513  15.479  21.407  1.000 14.242 0 5   VAL A HG12 1 c 
ATOM   69   H  HG13 . VAL A 1 6   ? -2.680  14.194  20.489  1.000 14.235 0 5   VAL A HG13 1 c 
ATOM   70   H  HG21 . VAL A 1 6   ? -4.362  13.216  21.890  1.000 13.120 0 5   VAL A HG21 1 c 
ATOM   71   H  HG22 . VAL A 1 6   ? -4.341  14.461  22.875  1.000 13.121 0 5   VAL A HG22 1 c 
ATOM   72   H  HG23 . VAL A 1 6   ? -4.123  12.994  23.445  1.000 13.121 0 5   VAL A HG23 1 c 
ATOM   73   N  N    . CYS A 1 7   ? -3.273  10.913  21.164  1.000 13.419 0 6   CYS A N    1 ? 
ATOM   74   C  CA   . CYS A 1 7   ? -3.804  10.182  19.973  1.000 14.277 0 6   CYS A CA   1 ? 
ATOM   75   C  C    . CYS A 1 7   ? -5.331  10.249  19.957  1.000 15.275 0 6   CYS A C    1 ? 
ATOM   76   O  O    . CYS A 1 7   ? -5.948  9.895   20.974  1.000 14.871 0 6   CYS A O    1 ? 
ATOM   77   C  CB   . CYS A 1 7   ? -3.334  8.736   19.996  1.000 14.776 0 6   CYS A CB   1 ? 
ATOM   78   S  SG   . CYS A 1 7   ? -3.779  7.796   18.511  1.000 15.263 0 6   CYS A SG   1 ? 
ATOM   79   H  H    . CYS A 1 7   ? -3.800  10.820  21.905  1.000 13.370 0 6   CYS A H    1 c 
ATOM   80   H  HA   . CYS A 1 7   ? -3.455  10.618  19.157  1.000 14.381 0 6   CYS A HA   1 c 
ATOM   81   H  HB2  . CYS A 1 7   ? -2.350  8.718   20.094  1.000 14.770 0 6   CYS A HB2  1 c 
ATOM   82   H  HB3  . CYS A 1 7   ? -3.726  8.282   20.782  1.000 14.770 0 6   CYS A HB3  1 c 
ATOM   83   H  HG   . CYS A 1 7   ? -3.272  6.795   18.823  0.000 15.430 0 6   CYS A HG   1 c 
ATOM   84   N  N    . VAL A 1 8   ? -5.923  10.642  18.815  1.000 15.783 0 7   VAL A N    1 ? 
ATOM   85   C  CA   . VAL A 1 8   ? -7.388  10.581  18.531  1.000 16.003 0 7   VAL A CA   1 ? 
ATOM   86   C  C    . VAL A 1 8   ? -7.651  9.294   17.739  1.000 15.040 0 7   VAL A C    1 ? 
ATOM   87   O  O    . VAL A 1 8   ? -7.071  9.135   16.615  1.000 13.847 0 7   VAL A O    1 ? 
ATOM   88   C  CB   . VAL A 1 8   ? -7.908  11.843  17.787  1.000 15.080 0 7   VAL A CB   1 ? 
ATOM   89   C  CG1  . VAL A 1 8   ? -9.413  11.824  17.541  1.000 16.335 0 7   VAL A CG1  1 ? 
ATOM   90   C  CG2  . VAL A 1 8   ? -7.538  13.141  18.488  1.000 15.469 0 7   VAL A CG2  1 ? 
ATOM   91   H  H    . VAL A 1 8   ? -5.445  10.983  18.119  1.000 15.709 0 7   VAL A H    1 c 
ATOM   92   H  HA   . VAL A 1 8   ? -7.858  10.518  19.381  1.000 15.597 0 7   VAL A HA   1 c 
ATOM   93   H  HB   . VAL A 1 8   ? -7.467  11.854  16.901  1.000 15.563 0 7   VAL A HB   1 c 
ATOM   94   H  HG11 . VAL A 1 8   ? -9.637  11.094  16.938  1.000 15.945 0 7   VAL A HG11 1 c 
ATOM   95   H  HG12 . VAL A 1 8   ? -9.689  12.668  17.142  1.000 15.965 0 7   VAL A HG12 1 c 
ATOM   96   H  HG13 . VAL A 1 8   ? -9.879  11.700  18.386  1.000 15.946 0 7   VAL A HG13 1 c 
ATOM   97   H  HG21 . VAL A 1 8   ? -7.911  13.142  19.387  1.000 15.353 0 7   VAL A HG21 1 c 
ATOM   98   H  HG22 . VAL A 1 8   ? -7.896  13.895  17.988  1.000 15.360 0 7   VAL A HG22 1 c 
ATOM   99   H  HG23 . VAL A 1 8   ? -6.569  13.219  18.539  1.000 15.354 0 7   VAL A HG23 1 c 
ATOM   100  N  N    . LEU A 1 9   ? -8.488  8.410   18.305  1.000 15.795 0 8   LEU A N    1 ? 
ATOM   101  C  CA   . LEU A 1 9   ? -8.900  7.114   17.705  1.000 17.329 0 8   LEU A CA   1 ? 
ATOM   102  C  C    . LEU A 1 9   ? -10.214 7.316   16.940  1.000 16.408 0 8   LEU A C    1 ? 
ATOM   103  O  O    . LEU A 1 9   ? -11.214 7.774   17.559  1.000 16.713 0 8   LEU A O    1 ? 
ATOM   104  C  CB   . LEU A 1 9   ? -9.078  6.054   18.795  1.000 17.962 0 8   LEU A CB   1 ? 
ATOM   105  C  CG   . LEU A 1 9   ? -7.843  5.705   19.631  1.000 19.228 0 8   LEU A CG   1 ? 
ATOM   106  C  CD1  . LEU A 1 9   ? -8.257  4.982   20.907  1.000 20.730 0 8   LEU A CD1  1 ? 
ATOM   107  C  CD2  . LEU A 1 9   ? -6.885  4.853   18.823  1.000 19.226 0 8   LEU A CD2  1 ? 
ATOM   108  H  H    . LEU A 1 9   ? -8.868  8.560   19.119  1.000 15.969 0 8   LEU A H    1 c 
ATOM   109  H  HA   . LEU A 1 9   ? -8.201  6.824   17.074  1.000 16.965 0 8   LEU A HA   1 c 
ATOM   110  H  HB2  . LEU A 1 9   ? -9.780  6.362   19.403  1.000 18.107 0 8   LEU A HB2  1 c 
ATOM   111  H  HB3  . LEU A 1 9   ? -9.400  5.234   18.371  1.000 18.107 0 8   LEU A HB3  1 c 
ATOM   112  H  HG   . LEU A 1 9   ? -7.383  6.544   19.880  1.000 19.250 0 8   LEU A HG   1 c 
ATOM   113  H  HD11 . LEU A 1 9   ? -8.832  5.561   21.437  1.000 20.255 0 8   LEU A HD11 1 c 
ATOM   114  H  HD12 . LEU A 1 9   ? -7.464  4.754   21.423  1.000 20.259 0 8   LEU A HD12 1 c 
ATOM   115  H  HD13 . LEU A 1 9   ? -8.740  4.169   20.678  1.000 20.259 0 8   LEU A HD13 1 c 
ATOM   116  H  HD21 . LEU A 1 9   ? -7.333  4.035   18.545  1.000 19.229 0 8   LEU A HD21 1 c 
ATOM   117  H  HD22 . LEU A 1 9   ? -6.111  4.628   19.369  1.000 19.231 0 8   LEU A HD22 1 c 
ATOM   118  H  HD23 . LEU A 1 9   ? -6.594  5.346   18.037  1.000 19.226 0 8   LEU A HD23 1 c 
ATOM   119  N  N    . LYS A 1 10  ? -10.175 7.039   15.632  1.000 17.809 0 9   LYS A N    1 ? 
ATOM   120  C  CA   . LYS A 1 10  ? -11.345 6.976   14.716  1.000 20.265 0 9   LYS A CA   1 ? 
ATOM   121  C  C    . LYS A 1 10  ? -11.246 5.759   13.786  1.000 20.050 0 9   LYS A C    1 ? 
ATOM   122  O  O    . LYS A 1 10  ? -10.102 5.288   13.463  1.000 16.764 0 9   LYS A O    1 ? 
ATOM   123  C  CB   . LYS A 1 10  ? -11.429 8.239   13.849  1.000 22.022 0 9   LYS A CB   1 ? 
ATOM   124  C  CG   . LYS A 1 10  ? -11.411 9.558   14.611  1.000 25.311 0 9   LYS A CG   1 ? 
ATOM   125  C  CD   . LYS A 1 10  ? -12.465 10.553  14.142  1.000 29.045 0 9   LYS A CD   1 ? 
ATOM   126  C  CE   . LYS A 1 10  ? -12.885 11.524  15.233  1.000 30.432 0 9   LYS A CE   1 ? 
ATOM   127  N  NZ   . LYS A 1 10  ? -12.067 12.761  15.207  1.000 30.345 0 9   LYS A NZ   1 ? 
ATOM   128  H  H    . LYS A 1 10  ? -9.389  6.869   15.204  1.000 18.009 0 9   LYS A H    1 c 
ATOM   129  H  HA   . LYS A 1 10  ? -12.165 6.900   15.256  1.000 20.036 0 9   LYS A HA   1 c 
ATOM   130  H  HB2  . LYS A 1 10  ? -10.675 8.234   13.224  1.000 22.317 0 9   LYS A HB2  1 c 
ATOM   131  H  HB3  . LYS A 1 10  ? -12.253 8.194   13.320  1.000 22.343 0 9   LYS A HB3  1 c 
ATOM   132  H  HG2  . LYS A 1 10  ? -11.551 9.373   15.563  1.000 25.258 0 9   LYS A HG2  1 c 
ATOM   133  H  HG3  . LYS A 1 10  ? -10.524 9.965   14.514  1.000 25.295 0 9   LYS A HG3  1 c 
ATOM   134  H  HD2  . LYS A 1 10  ? -12.109 11.062  13.383  1.000 28.446 0 9   LYS A HD2  1 c 
ATOM   135  H  HD3  . LYS A 1 10  ? -13.257 10.063  13.833  1.000 28.402 0 9   LYS A HD3  1 c 
ATOM   136  H  HE2  . LYS A 1 10  ? -13.824 11.763  15.113  1.000 30.077 0 9   LYS A HE2  1 c 
ATOM   137  H  HE3  . LYS A 1 10  ? -12.792 11.100  16.107  1.000 30.057 0 9   LYS A HE3  1 c 
ATOM   138  H  HZ1  . LYS A 1 10  ? -11.188 12.550  15.285  1.000 30.321 0 9   LYS A HZ1  1 c 
ATOM   139  H  HZ2  . LYS A 1 10  ? -12.305 13.302  15.894  1.000 30.360 0 9   LYS A HZ2  1 c 
ATOM   140  H  HZ3  . LYS A 1 10  ? -12.198 13.200  14.424  1.000 30.357 0 9   LYS A HZ3  1 c 
ATOM   141  N  N    . GLY A 1 11  ? -12.417 5.345   13.291  1.000 21.625 0 10  GLY A N    1 ? 
ATOM   142  C  CA   . GLY A 1 11  ? -12.626 4.120   12.498  1.000 22.962 0 10  GLY A CA   1 ? 
ATOM   143  C  C    . GLY A 1 11  ? -13.770 4.293   11.520  1.000 23.769 0 10  GLY A C    1 ? 
ATOM   144  O  O    . GLY A 1 11  ? -14.329 5.402   11.450  1.000 22.876 0 10  GLY A O    1 ? 
ATOM   145  H  H    . GLY A 1 11  ? -13.183 5.820   13.426  1.000 21.542 0 10  GLY A H    1 c 
ATOM   146  H  HA2  . GLY A 1 11  ? -11.797 3.907   12.002  1.000 22.800 0 10  GLY A HA2  1 c 
ATOM   147  H  HA3  . GLY A 1 11  ? -12.827 3.372   13.109  1.000 22.796 0 10  GLY A HA3  1 c 
ATOM   148  N  N    . ASP A 1 12  ? -14.115 3.224   10.807  1.000 25.848 0 11  ASP A N    1 ? 
ATOM   149  C  CA   . ASP A 1 12  ? -15.212 3.219   9.807   1.000 29.517 0 11  ASP A CA   1 ? 
ATOM   150  C  C    . ASP A 1 12  ? -16.551 2.947   10.501  1.000 29.019 0 11  ASP A C    1 ? 
ATOM   151  O  O    . ASP A 1 12  ? -17.591 3.110   9.832   1.000 29.332 0 11  ASP A O    1 ? 
ATOM   152  C  CB   . ASP A 1 12  ? -14.874 2.246   8.675   1.000 32.287 0 11  ASP A CB   1 ? 
ATOM   153  C  CG   . ASP A 1 12  ? -13.639 2.677   7.896   1.000 35.612 0 11  ASP A CG   1 ? 
ATOM   154  O  OD1  . ASP A 1 12  ? -13.277 3.865   7.987   1.000 43.170 0 11  ASP A OD1  1 ? 
ATOM   155  O  OD2  . ASP A 1 12  ? -13.035 1.829   7.227   1.000 40.564 0 11  ASP A OD2  1 ? 
ATOM   156  H  H    . ASP A 1 12  ? -13.694 2.421   10.894  1.000 26.168 0 11  ASP A H    1 c 
ATOM   157  H  HA   . ASP A 1 12  ? -15.260 4.121   9.413   1.000 29.184 0 11  ASP A HA   1 c 
ATOM   158  H  HB2  . ASP A 1 12  ? -14.715 1.355   9.048   1.000 32.332 0 11  ASP A HB2  1 c 
ATOM   159  H  HB3  . ASP A 1 12  ? -15.631 2.192   8.057   1.000 32.345 0 11  ASP A HB3  1 c 
ATOM   160  N  N    . GLY A 1 13  ? -16.540 2.558   11.785  1.000 28.307 0 12  GLY A N    1 ? 
ATOM   161  C  CA   . GLY A 1 13  ? -17.757 2.319   12.580  1.000 25.492 0 12  GLY A CA   1 ? 
ATOM   162  C  C    . GLY A 1 13  ? -17.921 3.323   13.715  1.000 22.741 0 12  GLY A C    1 ? 
ATOM   163  O  O    . GLY A 1 13  ? -17.500 4.472   13.609  1.000 25.106 0 12  GLY A O    1 ? 
ATOM   164  H  H    . GLY A 1 13  ? -15.768 2.405   12.241  1.000 27.763 0 12  GLY A H    1 c 
ATOM   165  H  HA2  . GLY A 1 13  ? -18.547 2.367   11.986  1.000 25.443 0 12  GLY A HA2  1 c 
ATOM   166  H  HA3  . GLY A 1 13  ? -17.713 1.405   12.953  1.000 25.414 0 12  GLY A HA3  1 c 
ATOM   167  N  N    . PRO A 1 14  ? -18.549 2.899   14.834  1.000 23.760 0 13  PRO A N    1 ? 
ATOM   168  C  CA   . PRO A 1 14  ? -18.816 3.775   15.975  1.000 22.527 0 13  PRO A CA   1 ? 
ATOM   169  C  C    . PRO A 1 14  ? -17.719 3.970   17.031  1.000 21.734 0 13  PRO A C    1 ? 
ATOM   170  O  O    . PRO A 1 14  ? -17.961 4.727   17.948  1.000 22.249 0 13  PRO A O    1 ? 
ATOM   171  C  CB   . PRO A 1 14  ? -19.961 3.036   16.684  1.000 22.122 0 13  PRO A CB   1 ? 
ATOM   172  C  CG   . PRO A 1 14  ? -19.699 1.577   16.411  1.000 20.973 0 13  PRO A CG   1 ? 
ATOM   173  C  CD   . PRO A 1 14  ? -19.090 1.546   15.026  1.000 21.816 0 13  PRO A CD   1 ? 
ATOM   174  H  HA   . PRO A 1 14  ? -19.139 4.653   15.651  1.000 22.528 0 13  PRO A HA   1 c 
ATOM   175  H  HB2  . PRO A 1 14  ? -19.957 3.215   17.648  1.000 21.939 0 13  PRO A HB2  1 c 
ATOM   176  H  HB3  . PRO A 1 14  ? -20.830 3.306   16.317  1.000 21.939 0 13  PRO A HB3  1 c 
ATOM   177  H  HG2  . PRO A 1 14  ? -19.078 1.206   17.071  1.000 21.436 0 13  PRO A HG2  1 c 
ATOM   178  H  HG3  . PRO A 1 14  ? -20.531 1.063   16.436  1.000 21.436 0 13  PRO A HG3  1 c 
ATOM   179  H  HD2  . PRO A 1 14  ? -18.382 0.878   14.975  1.000 22.068 0 13  PRO A HD2  1 c 
ATOM   180  H  HD3  . PRO A 1 14  ? -19.765 1.342   14.353  1.000 22.061 0 13  PRO A HD3  1 c 
ATOM   181  N  N    . VAL A 1 15  ? -16.581 3.277   16.914  1.000 21.549 0 14  VAL A N    1 ? 
ATOM   182  C  CA   . VAL A 1 15  ? -15.516 3.271   17.959  1.000 19.403 0 14  VAL A CA   1 ? 
ATOM   183  C  C    . VAL A 1 15  ? -14.723 4.570   17.850  1.000 20.400 0 14  VAL A C    1 ? 
ATOM   184  O  O    . VAL A 1 15  ? -14.194 4.856   16.736  1.000 19.307 0 14  VAL A O    1 ? 
ATOM   185  C  CB   . VAL A 1 15  ? -14.603 2.038   17.833  1.000 19.360 0 14  VAL A CB   1 ? 
ATOM   186  C  CG1  . VAL A 1 15  ? -13.446 2.085   18.827  1.000 18.308 0 14  VAL A CG1  1 ? 
ATOM   187  C  CG2  . VAL A 1 15  ? -15.393 0.740   17.976  1.000 17.765 0 14  VAL A CG2  1 ? 
ATOM   188  H  H    . VAL A 1 15  ? -16.381 2.771   16.185  1.000 21.045 0 14  VAL A H    1 c 
ATOM   189  H  HA   . VAL A 1 15  ? -15.947 3.245   18.829  1.000 19.983 0 14  VAL A HA   1 c 
ATOM   190  H  HB   . VAL A 1 15  ? -14.216 2.052   16.923  1.000 18.857 0 14  VAL A HB   1 c 
ATOM   191  H  HG11 . VAL A 1 15  ? -12.833 2.800   18.583  1.000 18.611 0 14  VAL A HG11 1 c 
ATOM   192  H  HG12 . VAL A 1 15  ? -12.971 1.235   18.813  1.000 18.622 0 14  VAL A HG12 1 c 
ATOM   193  H  HG13 . VAL A 1 15  ? -13.793 2.246   19.722  1.000 18.622 0 14  VAL A HG13 1 c 
ATOM   194  H  HG21 . VAL A 1 15  ? -15.831 0.721   18.844  1.000 18.247 0 14  VAL A HG21 1 c 
ATOM   195  H  HG22 . VAL A 1 15  ? -14.788 -0.018  17.904  1.000 18.241 0 14  VAL A HG22 1 c 
ATOM   196  H  HG23 . VAL A 1 15  ? -16.064 0.686   17.274  1.000 18.254 0 14  VAL A HG23 1 c 
ATOM   197  N  N    . GLN A 1 16  ? -14.680 5.357   18.929  1.000 20.583 0 15  GLN A N    1 ? 
ATOM   198  C  CA   . GLN A 1 16  ? -13.842 6.582   18.957  1.000 22.187 0 15  GLN A CA   1 ? 
ATOM   199  C  C    . GLN A 1 16  ? -13.326 6.856   20.364  1.000 20.951 0 15  GLN A C    1 ? 
ATOM   200  O  O    . GLN A 1 16  ? -13.922 6.356   21.348  1.000 22.286 0 15  GLN A O    1 ? 
ATOM   201  C  CB   . GLN A 1 16  ? -14.598 7.767   18.369  1.000 25.289 0 15  GLN A CB   1 ? 
ATOM   202  C  CG   . GLN A 1 16  ? -15.722 8.330   19.221  1.000 27.822 0 15  GLN A CG   1 ? 
ATOM   203  C  CD   . GLN A 1 16  ? -16.337 9.487   18.468  1.000 31.344 0 15  GLN A CD   1 ? 
ATOM   204  O  OE1  . GLN A 1 16  ? -15.651 10.201  17.732  1.000 36.424 0 15  GLN A OE1  1 ? 
ATOM   205  N  NE2  . GLN A 1 16  ? -17.643 9.646   18.591  1.000 31.077 0 15  GLN A NE2  1 ? 
ATOM   206  H  H    . GLN A 1 16  ? -15.152 5.196   19.691  1.000 20.903 0 15  GLN A H    1 c 
ATOM   207  H  HA   . GLN A 1 16  ? -13.060 6.413   18.386  1.000 22.158 0 15  GLN A HA   1 c 
ATOM   208  H  HB2  . GLN A 1 16  ? -13.948 8.481   18.195  1.000 25.111 0 15  GLN A HB2  1 c 
ATOM   209  H  HB3  . GLN A 1 16  ? -14.968 7.492   17.505  1.000 25.091 0 15  GLN A HB3  1 c 
ATOM   210  H  HG2  . GLN A 1 16  ? -16.397 7.638   19.388  1.000 27.990 0 15  GLN A HG2  1 c 
ATOM   211  H  HG3  . GLN A 1 16  ? -15.371 8.642   20.082  1.000 27.967 0 15  GLN A HG3  1 c 
ATOM   212  H  HE21 . GLN A 1 16  ? -18.006 10.440  18.447  1.000 31.163 0 15  GLN A HE21 1 c 
ATOM   213  H  HE22 . GLN A 1 16  ? -18.154 8.960   18.814  1.000 31.128 0 15  GLN A HE22 1 c 
ATOM   214  N  N    . GLY A 1 17  ? -12.234 7.611   20.450  1.000 18.934 0 16  GLY A N    1 ? 
ATOM   215  C  CA   . GLY A 1 17  ? -11.618 7.887   21.753  1.000 18.123 0 16  GLY A CA   1 ? 
ATOM   216  C  C    . GLY A 1 17  ? -10.409 8.786   21.676  1.000 18.137 0 16  GLY A C    1 ? 
ATOM   217  O  O    . GLY A 1 17  ? -9.879  9.016   20.577  1.000 16.196 0 16  GLY A O    1 ? 
ATOM   218  H  H    . GLY A 1 17  ? -11.825 7.984   19.727  1.000 19.198 0 16  GLY A H    1 c 
ATOM   219  H  HA2  . GLY A 1 17  ? -12.295 8.308   22.340  1.000 18.314 0 16  GLY A HA2  1 c 
ATOM   220  H  HA3  . GLY A 1 17  ? -11.355 7.027   22.167  1.000 18.315 0 16  GLY A HA3  1 c 
ATOM   221  N  N    . ILE A 1 18  ? -9.961  9.217   22.849  1.000 17.194 0 17  ILE A N    1 ? 
ATOM   222  C  CA   . ILE A 1 18  ? -8.799  10.128  23.026  1.000 16.981 0 17  ILE A CA   1 ? 
ATOM   223  C  C    . ILE A 1 18  ? -7.873  9.482   24.061  1.000 16.732 0 17  ILE A C    1 ? 
ATOM   224  O  O    . ILE A 1 18  ? -8.344  9.181   25.190  1.000 17.220 0 17  ILE A O    1 ? 
ATOM   225  C  CB   . ILE A 1 18  ? -9.259  11.537  23.430  1.000 17.663 0 17  ILE A CB   1 ? 
ATOM   226  C  CG1  . ILE A 1 18  ? -10.194 12.134  22.365  1.000 16.801 0 17  ILE A CG1  1 ? 
ATOM   227  C  CG2  . ILE A 1 18  ? -8.045  12.421  23.732  1.000 18.010 0 17  ILE A CG2  1 ? 
ATOM   228  C  CD1  . ILE A 1 18  ? -10.687 13.565  22.633  1.000 17.350 0 17  ILE A CD1  1 ? 
ATOM   229  H  H    . ILE A 1 18  ? -10.352 8.978   23.637  1.000 17.360 0 17  ILE A H    1 c 
ATOM   230  H  HA   . ILE A 1 18  ? -8.323  10.192  22.179  1.000 17.090 0 17  ILE A HA   1 c 
ATOM   231  H  HB   . ILE A 1 18  ? -9.780  11.449  24.265  1.000 17.429 0 17  ILE A HB   1 c 
ATOM   232  H  HG12 . ILE A 1 18  ? -9.725  12.126  21.503  1.000 17.130 0 17  ILE A HG12 1 c 
ATOM   233  H  HG13 . ILE A 1 18  ? -10.978 11.551  22.280  1.000 17.132 0 17  ILE A HG13 1 c 
ATOM   234  H  HG21 . ILE A 1 18  ? -7.541  12.045  24.474  1.000 17.900 0 17  ILE A HG21 1 c 
ATOM   235  H  HG22 . ILE A 1 18  ? -8.343  13.316  23.970  1.000 17.899 0 17  ILE A HG22 1 c 
ATOM   236  H  HG23 . ILE A 1 18  ? -7.474  12.471  22.946  1.000 17.902 0 17  ILE A HG23 1 c 
ATOM   237  H  HD11 . ILE A 1 18  ? -11.070 13.615  23.526  1.000 17.182 0 17  ILE A HD11 1 c 
ATOM   238  H  HD12 . ILE A 1 18  ? -11.365 13.803  21.977  1.000 17.182 0 17  ILE A HD12 1 c 
ATOM   239  H  HD13 . ILE A 1 18  ? -9.941  14.186  22.566  1.000 17.184 0 17  ILE A HD13 1 c 
ATOM   240  N  N    . ILE A 1 19  ? -6.623  9.247   23.677  1.000 15.471 0 18  ILE A N    1 ? 
ATOM   241  C  CA   . ILE A 1 19  ? -5.598  8.652   24.591  1.000 15.116 0 18  ILE A CA   1 ? 
ATOM   242  C  C    . ILE A 1 19  ? -4.413  9.610   24.768  1.000 15.255 0 18  ILE A C    1 ? 
ATOM   243  O  O    . ILE A 1 19  ? -3.816  10.062  23.775  1.000 15.421 0 18  ILE A O    1 ? 
ATOM   244  C  CB   . ILE A 1 19  ? -5.160  7.270   24.080  1.000 15.207 0 18  ILE A CB   1 ? 
ATOM   245  C  CG1  . ILE A 1 19  ? -6.321  6.261   24.053  1.000 15.246 0 18  ILE A CG1  1 ? 
ATOM   246  C  CG2  . ILE A 1 19  ? -3.959  6.771   24.893  1.000 14.946 0 18  ILE A CG2  1 ? 
ATOM   247  C  CD1  . ILE A 1 19  ? -6.934  5.952   25.422  1.000 14.233 0 18  ILE A CD1  1 ? 
ATOM   248  H  H    . ILE A 1 19  ? -6.313  9.431   22.840  1.000 15.681 0 18  ILE A H    1 c 
ATOM   249  H  HA   . ILE A 1 19  ? -6.011  8.528   25.462  1.000 15.229 0 18  ILE A HA   1 c 
ATOM   250  H  HB   . ILE A 1 19  ? -4.855  7.388   23.146  1.000 15.148 0 18  ILE A HB   1 c 
ATOM   251  H  HG12 . ILE A 1 19  ? -7.025  6.610   23.466  1.000 14.994 0 18  ILE A HG12 1 c 
ATOM   252  H  HG13 . ILE A 1 19  ? -5.995  5.422   23.661  1.000 14.994 0 18  ILE A HG13 1 c 
ATOM   253  H  HG21 . ILE A 1 19  ? -3.159  7.262   24.633  1.000 15.028 0 18  ILE A HG21 1 c 
ATOM   254  H  HG22 . ILE A 1 19  ? -3.823  5.822   24.722  1.000 15.028 0 18  ILE A HG22 1 c 
ATOM   255  H  HG23 . ILE A 1 19  ? -4.129  6.907   25.842  1.000 15.028 0 18  ILE A HG23 1 c 
ATOM   256  H  HD11 . ILE A 1 19  ? -6.241  5.634   26.027  1.000 14.547 0 18  ILE A HD11 1 c 
ATOM   257  H  HD12 . ILE A 1 19  ? -7.617  5.266   25.325  1.000 14.555 0 18  ILE A HD12 1 c 
ATOM   258  H  HD13 . ILE A 1 19  ? -7.338  6.757   25.789  1.000 14.559 0 18  ILE A HD13 1 c 
ATOM   259  N  N    . ASN A 1 20  ? -4.021  9.800   26.030  1.000 14.850 0 19  ASN A N    1 ? 
ATOM   260  C  CA   . ASN A 1 20  ? -2.921  10.692  26.478  1.000 15.077 0 19  ASN A CA   1 ? 
ATOM   261  C  C    . ASN A 1 20  ? -1.716  9.843   26.930  1.000 14.384 0 19  ASN A C    1 ? 
ATOM   262  O  O    . ASN A 1 20  ? -1.958  8.689   27.384  1.000 13.324 0 19  ASN A O    1 ? 
ATOM   263  C  CB   . ASN A 1 20  ? -3.426  11.580  27.622  1.000 17.228 0 19  ASN A CB   1 ? 
ATOM   264  C  CG   . ASN A 1 20  ? -4.687  12.334  27.236  1.000 19.668 0 19  ASN A CG   1 ? 
ATOM   265  O  OD1  . ASN A 1 20  ? -4.638  13.267  26.434  1.000 21.072 0 19  ASN A OD1  1 ? 
ATOM   266  N  ND2  . ASN A 1 20  ? -5.820  11.948  27.806  1.000 21.807 0 19  ASN A ND2  1 ? 
ATOM   267  H  H    . ASN A 1 20  ? -4.425  9.371   26.725  1.000 15.004 0 19  ASN A H    1 c 
ATOM   268  H  HA   . ASN A 1 20  ? -2.650  11.272  25.728  1.000 15.279 0 19  ASN A HA   1 c 
ATOM   269  H  HB2  . ASN A 1 20  ? -3.609  11.019  28.403  1.000 17.262 0 19  ASN A HB2  1 c 
ATOM   270  H  HB3  . ASN A 1 20  ? -2.726  12.220  27.863  1.000 17.237 0 19  ASN A HB3  1 c 
ATOM   271  H  HD21 . ASN A 1 20  ? -6.564  12.404  27.663  1.000 21.118 0 19  ASN A HD21 1 c 
ATOM   272  H  HD22 . ASN A 1 20  ? -5.834  11.234  28.327  1.000 21.099 0 19  ASN A HD22 1 c 
ATOM   273  N  N    . PHE A 1 21  ? -0.499  10.371  26.735  1.000 13.145 0 20  PHE A N    1 ? 
ATOM   274  C  CA   . PHE A 1 21  ? 0.829   9.796   27.131  1.000 13.364 0 20  PHE A CA   1 ? 
ATOM   275  C  C    . PHE A 1 21  ? 1.662   10.844  27.890  1.000 15.229 0 20  PHE A C    1 ? 
ATOM   276  O  O    . PHE A 1 21  ? 1.838   11.986  27.390  1.000 14.005 0 20  PHE A O    1 ? 
ATOM   277  C  CB   . PHE A 1 21  ? 1.640   9.352   25.905  1.000 12.938 0 20  PHE A CB   1 ? 
ATOM   278  C  CG   . PHE A 1 21  ? 0.958   8.350   25.002  1.000 12.719 0 20  PHE A CG   1 ? 
ATOM   279  C  CD1  . PHE A 1 21  ? -0.006  8.743   24.076  1.000 13.142 0 20  PHE A CD1  1 ? 
ATOM   280  C  CD2  . PHE A 1 21  ? 1.280   7.009   25.084  1.000 13.922 0 20  PHE A CD2  1 ? 
ATOM   281  C  CE1  . PHE A 1 21  ? -0.648  7.797   23.280  1.000 13.561 0 20  PHE A CE1  1 ? 
ATOM   282  C  CE2  . PHE A 1 21  ? 0.624   6.063   24.308  1.000 14.218 0 20  PHE A CE2  1 ? 
ATOM   283  C  CZ   . PHE A 1 21  ? -0.332  6.462   23.399  1.000 13.104 0 20  PHE A CZ   1 ? 
ATOM   284  H  H    . PHE A 1 21  ? -0.396  11.173  26.316  1.000 13.491 0 20  PHE A H    1 c 
ATOM   285  H  HA   . PHE A 1 21  ? 0.680   9.016   27.718  1.000 13.590 0 20  PHE A HA   1 c 
ATOM   286  H  HB2  . PHE A 1 21  ? 1.856   10.148  25.382  1.000 12.995 0 20  PHE A HB2  1 c 
ATOM   287  H  HB3  . PHE A 1 21  ? 2.485   8.967   26.220  1.000 12.993 0 20  PHE A HB3  1 c 
ATOM   288  H  HD1  . PHE A 1 21  ? -0.241  9.654   24.005  1.000 13.171 0 20  PHE A HD1  1 c 
ATOM   289  H  HD2  . PHE A 1 21  ? 1.916   6.725   25.721  1.000 13.664 0 20  PHE A HD2  1 c 
ATOM   290  H  HE1  . PHE A 1 21  ? -1.302  8.073   22.658  1.000 13.363 0 20  PHE A HE1  1 c 
ATOM   291  H  HE2  . PHE A 1 21  ? 0.858   5.151   24.378  1.000 13.827 0 20  PHE A HE2  1 c 
ATOM   292  H  HZ   . PHE A 1 21  ? -0.753  5.824   22.845  1.000 13.456 0 20  PHE A HZ   1 c 
ATOM   293  N  N    . GLU A 1 22  ? 2.250   10.478  29.044  1.000 16.717 0 21  GLU A N    1 ? 
ATOM   294  C  CA   . GLU A 1 22  ? 3.210   11.348  29.789  1.000 17.879 0 21  GLU A CA   1 ? 
ATOM   295  C  C    . GLU A 1 22  ? 4.467   10.556  30.189  1.000 17.914 0 21  GLU A C    1 ? 
ATOM   296  O  O    . GLU A 1 22  ? 4.313   9.431   30.659  1.000 17.708 0 21  GLU A O    1 ? 
ATOM   297  C  CB   . GLU A 1 22  ? 2.558   11.932  31.046  1.000 18.963 0 21  GLU A CB   1 ? 
ATOM   298  C  CG   . GLU A 1 22  ? 3.419   12.978  31.735  1.000 23.653 0 21  GLU A CG   1 ? 
ATOM   299  C  CD   . GLU A 1 22  ? 2.680   13.867  32.732  1.000 25.799 0 21  GLU A CD   1 ? 
ATOM   300  O  OE1  . GLU A 1 22  ? 3.111   15.015  32.923  1.000 32.431 0 21  GLU A OE1  1 ? 
ATOM   301  O  OE2  . GLU A 1 22  ? 1.672   13.418  33.310  1.000 29.655 0 21  GLU A OE2  1 ? 
ATOM   302  H  H    . GLU A 1 22  ? 2.096   9.673   29.442  1.000 16.609 0 21  GLU A H    1 c 
ATOM   303  H  HA   . GLU A 1 22  ? 3.480   12.088  29.200  1.000 17.852 0 21  GLU A HA   1 c 
ATOM   304  H  HB2  . GLU A 1 22  ? 1.700   12.336  30.797  1.000 19.704 0 21  GLU A HB2  1 c 
ATOM   305  H  HB3  . GLU A 1 22  ? 2.377   11.202  31.675  1.000 19.701 0 21  GLU A HB3  1 c 
ATOM   306  H  HG2  . GLU A 1 22  ? 4.148   12.526  32.209  1.000 22.902 0 21  GLU A HG2  1 c 
ATOM   307  H  HG3  . GLU A 1 22  ? 3.825   13.553  31.052  1.000 22.900 0 21  GLU A HG3  1 c 
ATOM   308  N  N    . GLN A 1 23  ? 5.661   11.148  30.040  1.000 17.523 0 22  GLN A N    1 ? 
ATOM   309  C  CA   . GLN A 1 23  ? 6.971   10.569  30.466  1.000 18.974 0 22  GLN A CA   1 ? 
ATOM   310  C  C    . GLN A 1 23  ? 7.738   11.655  31.244  1.000 22.666 0 22  GLN A C    1 ? 
ATOM   311  O  O    . GLN A 1 23  ? 8.276   12.571  30.601  1.000 20.172 0 22  GLN A O    1 ? 
ATOM   312  C  CB   . GLN A 1 23  ? 7.740   10.002  29.255  1.000 18.559 0 22  GLN A CB   1 ? 
ATOM   313  C  CG   . GLN A 1 23  ? 8.954   9.150   29.646  1.000 16.951 0 22  GLN A CG   1 ? 
ATOM   314  C  CD   . GLN A 1 23  ? 9.719   8.570   28.479  1.000 18.606 0 22  GLN A CD   1 ? 
ATOM   315  O  OE1  . GLN A 1 23  ? 9.717   9.111   27.366  1.000 19.704 0 22  GLN A OE1  1 ? 
ATOM   316  N  NE2  . GLN A 1 23  ? 10.387  7.445   28.720  1.000 17.994 0 22  GLN A NE2  1 ? 
ATOM   317  H  H    . GLN A 1 23  ? 5.745   11.969  29.654  1.000 17.957 0 22  GLN A H    1 c 
ATOM   318  H  HA   . GLN A 1 23  ? 6.785   9.825   31.083  1.000 19.293 0 22  GLN A HA   1 c 
ATOM   319  H  HB2  . GLN A 1 23  ? 7.125   9.457   28.722  1.000 18.263 0 22  GLN A HB2  1 c 
ATOM   320  H  HB3  . GLN A 1 23  ? 8.040   10.750  28.697  1.000 18.268 0 22  GLN A HB3  1 c 
ATOM   321  H  HG2  . GLN A 1 23  ? 9.565   9.701   30.177  1.000 17.729 0 22  GLN A HG2  1 c 
ATOM   322  H  HG3  . GLN A 1 23  ? 8.649   8.414   30.219  1.000 17.707 0 22  GLN A HG3  1 c 
ATOM   323  H  HE21 . GLN A 1 23  ? 10.772  7.008   28.054  1.000 18.181 0 22  GLN A HE21 1 c 
ATOM   324  H  HE22 . GLN A 1 23  ? 10.449  7.133   29.545  1.000 18.175 0 22  GLN A HE22 1 c 
ATOM   325  N  N    . LYS A 1 24  ? 7.781   11.546  32.583  1.000 26.311 0 23  LYS A N    1 ? 
ATOM   326  C  CA   . LYS A 1 24  ? 8.384   12.576  33.486  1.000 31.345 0 23  LYS A CA   1 ? 
ATOM   327  C  C    . LYS A 1 24  ? 9.903   12.654  33.278  1.000 30.870 0 23  LYS A C    1 ? 
ATOM   328  O  O    . LYS A 1 24  ? 10.405  13.769  33.033  1.000 30.986 0 23  LYS A O    1 ? 
ATOM   329  C  CB   . LYS A 1 24  ? 8.035   12.322  34.956  1.000 32.627 0 23  LYS A CB   1 ? 
ATOM   330  C  CG   . LYS A 1 24  ? 6.700   12.918  35.375  1.000 38.434 0 23  LYS A CG   1 ? 
ATOM   331  C  CD   . LYS A 1 24  ? 6.330   12.674  36.826  1.000 40.318 0 23  LYS A CD   1 ? 
ATOM   332  C  CE   . LYS A 1 24  ? 4.897   13.063  37.138  1.000 44.105 0 23  LYS A CE   1 ? 
ATOM   333  N  NZ   . LYS A 1 24  ? 4.722   13.466  38.557  1.000 44.554 0 23  LYS A NZ   1 ? 
ATOM   334  H  H    . LYS A 1 24  ? 7.438   10.827  33.025  1.000 26.481 0 23  LYS A H    1 c 
ATOM   335  H  HA   . LYS A 1 24  ? 8.003   13.448  33.233  1.000 30.481 0 23  LYS A HA   1 c 
ATOM   336  H  HB2  . LYS A 1 24  ? 8.015   11.355  35.115  1.000 33.574 0 23  LYS A HB2  1 c 
ATOM   337  H  HB3  . LYS A 1 24  ? 8.741   12.706  35.519  1.000 33.586 0 23  LYS A HB3  1 c 
ATOM   338  H  HG2  . LYS A 1 24  ? 6.725   13.885  35.214  1.000 37.391 0 23  LYS A HG2  1 c 
ATOM   339  H  HG3  . LYS A 1 24  ? 5.997   12.541  34.803  1.000 37.398 0 23  LYS A HG3  1 c 
ATOM   340  H  HD2  . LYS A 1 24  ? 6.455   11.724  37.034  1.000 40.722 0 23  LYS A HD2  1 c 
ATOM   341  H  HD3  . LYS A 1 24  ? 6.933   13.192  37.402  1.000 40.729 0 23  LYS A HD3  1 c 
ATOM   342  H  HE2  . LYS A 1 24  ? 4.628   13.804  36.563  1.000 43.278 0 23  LYS A HE2  1 c 
ATOM   343  H  HE3  . LYS A 1 24  ? 4.307   12.307  36.950  1.000 43.286 0 23  LYS A HE3  1 c 
ATOM   344  H  HZ1  . LYS A 1 24  ? 4.981   12.790  39.103  1.000 44.416 0 23  LYS A HZ1  1 c 
ATOM   345  H  HZ2  . LYS A 1 24  ? 3.850   13.660  38.716  1.000 44.416 0 23  LYS A HZ2  1 c 
ATOM   346  H  HZ3  . LYS A 1 24  ? 5.226   14.200  38.732  1.000 44.409 0 23  LYS A HZ3  1 c 
ATOM   347  N  N    . GLU A 1 25  ? 10.600  11.522  33.348  1.000 33.118 0 24  GLU A N    1 ? 
ATOM   348  C  CA   . GLU A 1 25  ? 12.079  11.462  33.223  1.000 35.341 0 24  GLU A CA   1 ? 
ATOM   349  C  C    . GLU A 1 25  ? 12.426  10.754  31.911  1.000 34.190 0 24  GLU A C    1 ? 
ATOM   350  O  O    . GLU A 1 25  ? 11.673  9.845   31.503  1.000 31.617 0 24  GLU A O    1 ? 
ATOM   351  C  CB   . GLU A 1 25  ? 12.673  10.771  34.453  1.000 37.730 0 24  GLU A CB   1 ? 
ATOM   352  C  CG   . GLU A 1 25  ? 12.138  11.332  35.767  1.000 39.402 0 24  GLU A CG   1 ? 
ATOM   353  C  CD   . GLU A 1 25  ? 12.832  10.874  37.043  1.000 43.167 0 24  GLU A CD   1 ? 
ATOM   354  O  OE1  . GLU A 1 25  ? 13.736  10.011  36.961  1.000 49.465 0 24  GLU A OE1  1 ? 
ATOM   355  O  OE2  . GLU A 1 25  ? 12.465  11.380  38.129  1.000 45.185 0 24  GLU A OE2  1 ? 
ATOM   356  H  H    . GLU A 1 25  ? 10.207  10.710  33.480  1.000 33.062 0 24  GLU A H    1 c 
ATOM   357  H  HA   . GLU A 1 25  ? 12.426  12.382  33.182  1.000 35.104 0 24  GLU A HA   1 c 
ATOM   358  H  HB2  . GLU A 1 25  ? 12.467  9.815   34.406  1.000 37.539 0 24  GLU A HB2  1 c 
ATOM   359  H  HB3  . GLU A 1 25  ? 13.647  10.873  34.433  1.000 37.555 0 24  GLU A HB3  1 c 
ATOM   360  H  HG2  . GLU A 1 25  ? 12.190  12.311  35.730  1.000 39.847 0 24  GLU A HG2  1 c 
ATOM   361  H  HG3  . GLU A 1 25  ? 11.189  11.097  35.841  1.000 39.835 0 24  GLU A HG3  1 c 
ATOM   362  N  N    . SER A 1 26  ? 13.502  11.186  31.256  1.000 34.471 0 25  SER A N    1 ? 
ATOM   363  C  CA   . SER A 1 26  ? 14.110  10.487  30.092  1.000 35.873 0 25  SER A CA   1 ? 
ATOM   364  C  C    . SER A 1 26  ? 14.392  9.022   30.468  1.000 36.051 0 25  SER A C    1 ? 
ATOM   365  O  O    . SER A 1 26  ? 15.022  8.795   31.536  1.000 35.422 0 25  SER A O    1 ? 
ATOM   366  C  CB   . SER A 1 26  ? 15.363  11.192  29.658  1.000 37.815 0 25  SER A CB   1 ? 
ATOM   367  O  OG   . SER A 1 26  ? 15.095  12.561  29.401  1.000 42.447 0 25  SER A OG   1 ? 
ATOM   368  H  H    . SER A 1 26  ? 13.946  11.955  31.472  1.000 34.739 0 25  SER A H    1 c 
ATOM   369  H  HA   . SER A 1 26  ? 13.461  10.502  29.346  1.000 35.980 0 25  SER A HA   1 c 
ATOM   370  H  HB2  . SER A 1 26  ? 16.047  11.115  30.368  1.000 38.381 0 25  SER A HB2  1 c 
ATOM   371  H  HB3  . SER A 1 26  ? 15.716  10.763  28.840  1.000 38.381 0 25  SER A HB3  1 c 
ATOM   372  H  HG   . SER A 1 26  ? 15.823  12.923  29.192  0.000 42.560 0 25  SER A HG   1 c 
ATOM   373  N  N    . ASN A 1 27  ? 13.926  8.074   29.645  1.000 31.820 0 26  ASN A N    1 ? 
ATOM   374  C  CA   . ASN A 1 27  ? 14.044  6.605   29.877  1.000 32.925 0 26  ASN A CA   1 ? 
ATOM   375  C  C    . ASN A 1 27  ? 13.281  6.169   31.148  1.000 30.074 0 26  ASN A C    1 ? 
ATOM   376  O  O    . ASN A 1 27  ? 13.507  5.031   31.585  1.000 33.265 0 26  ASN A O    1 ? 
ATOM   377  C  CB   . ASN A 1 27  ? 15.509  6.148   29.960  1.000 36.406 0 26  ASN A CB   1 ? 
ATOM   378  C  CG   . ASN A 1 27  ? 16.197  6.053   28.613  1.000 39.500 0 26  ASN A CG   1 ? 
ATOM   379  O  OD1  . ASN A 1 27  ? 15.680  5.425   27.693  1.000 43.848 0 26  ASN A OD1  1 ? 
ATOM   380  N  ND2  . ASN A 1 27  ? 17.373  6.650   28.492  1.000 39.677 0 26  ASN A ND2  1 ? 
ATOM   381  H  H    . ASN A 1 27  ? 13.496  8.278   28.869  1.000 33.049 0 26  ASN A H    1 c 
ATOM   382  H  HA   . ASN A 1 27  ? 13.637  6.146   29.106  1.000 32.811 0 26  ASN A HA   1 c 
ATOM   383  H  HB2  . ASN A 1 27  ? 16.004  6.773   30.527  1.000 36.255 0 26  ASN A HB2  1 c 
ATOM   384  H  HB3  . ASN A 1 27  ? 15.541  5.269   30.388  1.000 36.228 0 26  ASN A HB3  1 c 
ATOM   385  H  HD21 . ASN A 1 27  ? 17.782  6.666   27.708  1.000 39.633 0 26  ASN A HD21 1 c 
ATOM   386  H  HD22 . ASN A 1 27  ? 17.752  7.032   29.193  1.000 39.608 0 26  ASN A HD22 1 c 
ATOM   387  N  N    . GLY A 1 28  ? 12.398  7.012   31.702  1.000 25.137 0 27  GLY A N    1 ? 
ATOM   388  C  CA   . GLY A 1 28  ? 11.488  6.675   32.820  1.000 22.108 0 27  GLY A CA   1 ? 
ATOM   389  C  C    . GLY A 1 28  ? 10.171  6.073   32.313  1.000 20.548 0 27  GLY A C    1 ? 
ATOM   390  O  O    . GLY A 1 28  ? 9.964   5.961   31.098  1.000 16.962 0 27  GLY A O    1 ? 
ATOM   391  H  H    . GLY A 1 28  ? 12.293  7.863   31.404  1.000 25.491 0 27  GLY A H    1 c 
ATOM   392  H  HA2  . GLY A 1 28  ? 11.937  6.027   33.420  1.000 22.427 0 27  GLY A HA2  1 c 
ATOM   393  H  HA3  . GLY A 1 28  ? 11.298  7.494   33.339  1.000 22.400 0 27  GLY A HA3  1 c 
ATOM   394  N  N    . PRO A 1 29  ? 9.223   5.683   33.205  1.000 18.540 0 28  PRO A N    1 ? 
ATOM   395  C  CA   . PRO A 1 29  ? 7.946   5.093   32.780  1.000 17.817 0 28  PRO A CA   1 ? 
ATOM   396  C  C    . PRO A 1 29  ? 7.010   6.050   32.026  1.000 16.415 0 28  PRO A C    1 ? 
ATOM   397  O  O    . PRO A 1 29  ? 7.015   7.256   32.298  1.000 14.349 0 28  PRO A O    1 ? 
ATOM   398  C  CB   . PRO A 1 29  ? 7.211   4.694   34.070  1.000 18.163 0 28  PRO A CB   1 ? 
ATOM   399  C  CG   . PRO A 1 29  ? 8.251   4.856   35.178  1.000 19.493 0 28  PRO A CG   1 ? 
ATOM   400  C  CD   . PRO A 1 29  ? 9.288   5.833   34.669  1.000 19.722 0 28  PRO A CD   1 ? 
ATOM   401  H  HA   . PRO A 1 29  ? 8.122   4.286   32.235  1.000 17.737 0 28  PRO A HA   1 c 
ATOM   402  H  HB2  . PRO A 1 29  ? 6.439   5.278   34.231  1.000 18.382 0 28  PRO A HB2  1 c 
ATOM   403  H  HB3  . PRO A 1 29  ? 6.898   3.765   34.021  1.000 18.386 0 28  PRO A HB3  1 c 
ATOM   404  H  HG2  . PRO A 1 29  ? 7.830   5.201   35.992  1.000 19.228 0 28  PRO A HG2  1 c 
ATOM   405  H  HG3  . PRO A 1 29  ? 8.666   3.995   35.385  1.000 19.236 0 28  PRO A HG3  1 c 
ATOM   406  H  HD2  . PRO A 1 29  ? 9.071   6.745   34.937  1.000 19.391 0 28  PRO A HD2  1 c 
ATOM   407  H  HD3  . PRO A 1 29  ? 10.175  5.606   35.004  1.000 19.391 0 28  PRO A HD3  1 c 
ATOM   408  N  N    . VAL A 1 30  ? 6.241   5.504   31.078  1.000 15.853 0 29  VAL A N    1 ? 
ATOM   409  C  CA   . VAL A 1 30  ? 5.196   6.265   30.326  1.000 15.582 0 29  VAL A CA   1 ? 
ATOM   410  C  C    . VAL A 1 30  ? 3.824   5.901   30.906  1.000 16.255 0 29  VAL A C    1 ? 
ATOM   411  O  O    . VAL A 1 30  ? 3.485   4.707   30.910  1.000 15.177 0 29  VAL A O    1 ? 
ATOM   412  C  CB   . VAL A 1 30  ? 5.242   5.976   28.812  1.000 15.167 0 29  VAL A CB   1 ? 
ATOM   413  C  CG1  . VAL A 1 30  ? 4.347   6.925   28.022  1.000 14.796 0 29  VAL A CG1  1 ? 
ATOM   414  C  CG2  . VAL A 1 30  ? 6.660   5.991   28.278  1.000 15.917 0 29  VAL A CG2  1 ? 
ATOM   415  H  H    . VAL A 1 30  ? 6.306   4.630   30.830  1.000 15.929 0 29  VAL A H    1 c 
ATOM   416  H  HA   . VAL A 1 30  ? 5.349   7.214   30.462  1.000 15.688 0 29  VAL A HA   1 c 
ATOM   417  H  HB   . VAL A 1 30  ? 4.889   5.061   28.681  1.000 15.314 0 29  VAL A HB   1 c 
ATOM   418  H  HG11 . VAL A 1 30  ? 3.419   6.788   28.279  1.000 14.911 0 29  VAL A HG11 1 c 
ATOM   419  H  HG12 . VAL A 1 30  ? 4.448   6.751   27.070  1.000 14.910 0 29  VAL A HG12 1 c 
ATOM   420  H  HG13 . VAL A 1 30  ? 4.602   7.845   28.212  1.000 14.909 0 29  VAL A HG13 1 c 
ATOM   421  H  HG21 . VAL A 1 30  ? 7.086   6.834   28.511  1.000 15.680 0 29  VAL A HG21 1 c 
ATOM   422  H  HG22 . VAL A 1 30  ? 6.643   5.894   27.310  1.000 15.679 0 29  VAL A HG22 1 c 
ATOM   423  H  HG23 . VAL A 1 30  ? 7.163   5.255   28.668  1.000 15.680 0 29  VAL A HG23 1 c 
ATOM   424  N  N    . LYS A 1 31  ? 3.041   6.901   31.310  1.000 16.883 0 30  LYS A N    1 ? 
ATOM   425  C  CA   . LYS A 1 31  ? 1.629   6.760   31.726  1.000 19.856 0 30  LYS A CA   1 ? 
ATOM   426  C  C    . LYS A 1 31  ? 0.728   6.922   30.498  1.000 19.041 0 30  LYS A C    1 ? 
ATOM   427  O  O    . LYS A 1 31  ? 0.980   7.829   29.694  1.000 18.915 0 30  LYS A O    1 ? 
ATOM   428  C  CB   . LYS A 1 31  ? 1.282   7.809   32.782  1.000 22.384 0 30  LYS A CB   1 ? 
ATOM   429  C  CG   . LYS A 1 31  ? 2.165   7.773   34.022  1.000 25.308 0 30  LYS A CG   1 ? 
ATOM   430  C  CD   . LYS A 1 31  ? 1.791   8.799   35.059  1.000 26.812 0 30  LYS A CD   1 ? 
ATOM   431  C  CE   . LYS A 1 31  ? 0.441   8.555   35.695  1.000 27.224 0 30  LYS A CE   1 ? 
ATOM   432  N  NZ   . LYS A 1 31  ? 0.473   8.704   37.172  1.000 28.878 0 30  LYS A NZ   1 ? 
ATOM   433  H  H    . LYS A 1 31  ? 3.340   7.761   31.352  1.000 17.386 0 30  LYS A H    1 c 
ATOM   434  H  HA   . LYS A 1 31  ? 1.499   5.862   32.107  1.000 19.522 0 30  LYS A HA   1 c 
ATOM   435  H  HB2  . LYS A 1 31  ? 1.352   8.697   32.374  1.000 22.400 0 30  LYS A HB2  1 c 
ATOM   436  H  HB3  . LYS A 1 31  ? 0.351   7.677   33.056  1.000 22.407 0 30  LYS A HB3  1 c 
ATOM   437  H  HG2  . LYS A 1 31  ? 2.109   6.879   34.423  1.000 24.924 0 30  LYS A HG2  1 c 
ATOM   438  H  HG3  . LYS A 1 31  ? 3.096   7.921   33.751  1.000 24.904 0 30  LYS A HG3  1 c 
ATOM   439  H  HD2  . LYS A 1 31  ? 2.475   8.804   35.762  1.000 26.553 0 30  LYS A HD2  1 c 
ATOM   440  H  HD3  . LYS A 1 31  ? 1.786   9.686   34.640  1.000 26.546 0 30  LYS A HD3  1 c 
ATOM   441  H  HE2  . LYS A 1 31  ? -0.208  9.186   35.330  1.000 27.502 0 30  LYS A HE2  1 c 
ATOM   442  H  HE3  . LYS A 1 31  ? 0.136   7.653   35.477  1.000 27.492 0 30  LYS A HE3  1 c 
ATOM   443  H  HZ1  . LYS A 1 31  ? 1.032   8.086   37.531  1.000 28.351 0 30  LYS A HZ1  1 c 
ATOM   444  H  HZ2  . LYS A 1 31  ? -0.360  8.584   37.511  1.000 28.355 0 30  LYS A HZ2  1 c 
ATOM   445  H  HZ3  . LYS A 1 31  ? 0.767   9.533   37.391  1.000 28.355 0 30  LYS A HZ3  1 c 
ATOM   446  N  N    . VAL A 1 32  ? -0.255  6.044   30.348  1.000 20.048 0 31  VAL A N    1 ? 
ATOM   447  C  CA   . VAL A 1 32  ? -1.229  6.055   29.216  1.000 21.571 0 31  VAL A CA   1 ? 
ATOM   448  C  C    . VAL A 1 32  ? -2.637  6.118   29.833  1.000 22.239 0 31  VAL A C    1 ? 
ATOM   449  O  O    . VAL A 1 32  ? -2.934  5.274   30.708  1.000 24.239 0 31  VAL A O    1 ? 
ATOM   450  C  CB   . VAL A 1 32  ? -1.009  4.833   28.296  1.000 22.522 0 31  VAL A CB   1 ? 
ATOM   451  C  CG1  . VAL A 1 32  ? -1.831  4.907   27.020  1.000 22.975 0 31  VAL A CG1  1 ? 
ATOM   452  C  CG2  . VAL A 1 32  ? 0.464   4.621   27.951  1.000 21.443 0 31  VAL A CG2  1 ? 
ATOM   453  H  H    . VAL A 1 32  ? -0.398  5.366   30.940  1.000 20.152 0 31  VAL A H    1 c 
ATOM   454  H  HA   . VAL A 1 32  ? -1.085  6.861   28.695  1.000 21.536 0 31  VAL A HA   1 c 
ATOM   455  H  HB   . VAL A 1 32  ? -1.312  4.037   28.795  1.000 22.212 0 31  VAL A HB   1 c 
ATOM   456  H  HG11 . VAL A 1 32  ? -2.778  4.920   27.242  1.000 22.833 0 31  VAL A HG11 1 c 
ATOM   457  H  HG12 . VAL A 1 32  ? -1.640  4.131   26.464  1.000 22.832 0 31  VAL A HG12 1 c 
ATOM   458  H  HG13 . VAL A 1 32  ? -1.602  5.717   26.532  1.000 22.834 0 31  VAL A HG13 1 c 
ATOM   459  H  HG21 . VAL A 1 32  ? 0.828   5.436   27.563  1.000 21.769 0 31  VAL A HG21 1 c 
ATOM   460  H  HG22 . VAL A 1 32  ? 0.547   3.894   27.310  1.000 21.771 0 31  VAL A HG22 1 c 
ATOM   461  H  HG23 . VAL A 1 32  ? 0.960   4.397   28.758  1.000 21.766 0 31  VAL A HG23 1 c 
ATOM   462  N  N    . TRP A 1 33  ? -3.458  7.107   29.463  1.000 20.608 0 32  TRP A N    1 ? 
ATOM   463  C  CA   . TRP A 1 33  ? -4.830  7.260   30.021  1.000 20.267 0 32  TRP A CA   1 ? 
ATOM   464  C  C    . TRP A 1 33  ? -5.758  7.999   29.056  1.000 19.094 0 32  TRP A C    1 ? 
ATOM   465  O  O    . TRP A 1 33  ? -5.282  8.872   28.285  1.000 16.450 0 32  TRP A O    1 ? 
ATOM   466  C  CB   . TRP A 1 33  ? -4.802  7.950   31.388  1.000 22.599 0 32  TRP A CB   1 ? 
ATOM   467  C  CG   . TRP A 1 33  ? -4.618  9.438   31.351  1.000 24.222 0 32  TRP A CG   1 ? 
ATOM   468  C  CD1  . TRP A 1 33  ? -5.587  10.385  31.523  1.000 24.760 0 32  TRP A CD1  1 ? 
ATOM   469  C  CD2  . TRP A 1 33  ? -3.388  10.163  31.159  1.000 23.839 0 32  TRP A CD2  1 ? 
ATOM   470  N  NE1  . TRP A 1 33  ? -5.058  11.642  31.424  1.000 24.383 0 32  TRP A NE1  1 ? 
ATOM   471  C  CE2  . TRP A 1 33  ? -3.713  11.538  31.203  1.000 24.414 0 32  TRP A CE2  1 ? 
ATOM   472  C  CE3  . TRP A 1 33  ? -2.059  9.792   30.931  1.000 25.739 0 32  TRP A CE3  1 ? 
ATOM   473  C  CZ2  . TRP A 1 33  ? -2.748  12.535  31.076  1.000 27.134 0 32  TRP A CZ2  1 ? 
ATOM   474  C  CZ3  . TRP A 1 33  ? -1.108  10.778  30.774  1.000 25.712 0 32  TRP A CZ3  1 ? 
ATOM   475  C  CH2  . TRP A 1 33  ? -1.453  12.130  30.838  1.000 26.425 0 32  TRP A CH2  1 ? 
ATOM   476  H  H    . TRP A 1 33  ? -3.232  7.746   28.853  1.000 20.894 0 32  TRP A H    1 c 
ATOM   477  H  HA   . TRP A 1 33  ? -5.189  6.355   30.156  1.000 20.522 0 32  TRP A HA   1 c 
ATOM   478  H  HB2  . TRP A 1 33  ? -5.642  7.747   31.846  1.000 22.426 0 32  TRP A HB2  1 c 
ATOM   479  H  HB3  . TRP A 1 33  ? -4.076  7.555   31.914  1.000 22.396 0 32  TRP A HB3  1 c 
ATOM   480  H  HD1  . TRP A 1 33  ? -6.503  10.203  31.670  1.000 24.627 0 32  TRP A HD1  1 c 
ATOM   481  H  HE1  . TRP A 1 33  ? -5.506  12.390  31.511  1.000 24.568 0 32  TRP A HE1  1 c 
ATOM   482  H  HE3  . TRP A 1 33  ? -1.817  8.880   30.891  1.000 25.249 0 32  TRP A HE3  1 c 
ATOM   483  H  HZ2  . TRP A 1 33  ? -2.983  13.447  31.097  1.000 26.124 0 32  TRP A HZ2  1 c 
ATOM   484  H  HZ3  . TRP A 1 33  ? -0.207  10.536  30.630  1.000 25.759 0 32  TRP A HZ3  1 c 
ATOM   485  H  HH2  . TRP A 1 33  ? -0.782  12.782  30.732  1.000 26.213 0 32  TRP A HH2  1 c 
ATOM   486  N  N    . GLY A 1 34  ? -7.051  7.671   29.159  1.000 17.457 0 33  GLY A N    1 ? 
ATOM   487  C  CA   . GLY A 1 34  ? -8.140  8.213   28.322  1.000 18.546 0 33  GLY A CA   1 ? 
ATOM   488  C  C    . GLY A 1 34  ? -9.336  7.281   28.309  1.000 19.844 0 33  GLY A C    1 ? 
ATOM   489  O  O    . GLY A 1 34  ? -9.396  6.396   29.177  1.000 21.944 0 33  GLY A O    1 ? 
ATOM   490  H  H    . GLY A 1 34  ? -7.340  7.071   29.782  1.000 18.102 0 33  GLY A H    1 c 
ATOM   491  H  HA2  . GLY A 1 34  ? -8.412  9.096   28.677  1.000 18.577 0 33  GLY A HA2  1 c 
ATOM   492  H  HA3  . GLY A 1 34  ? -7.807  8.337   27.401  1.000 18.565 0 33  GLY A HA3  1 c 
ATOM   493  N  N    . SER A 1 35  ? -10.245 7.464   27.345  1.000 20.271 0 34  SER A N    1 ? 
ATOM   494  C  CA   . SER A 1 35  ? -11.573 6.808   27.262  1.000 20.802 0 34  SER A CA   1 ? 
ATOM   495  C  C    . SER A 1 35  ? -11.840 6.434   25.797  1.000 22.190 0 34  SER A C    1 ? 
ATOM   496  O  O    . SER A 1 35  ? -11.472 7.249   24.899  1.000 21.059 0 34  SER A O    1 ? 
ATOM   497  C  CB   . SER A 1 35  ? -12.621 7.739   27.857  1.000 24.203 0 34  SER A CB   1 ? 
ATOM   498  O  OG   . SER A 1 35  ? -13.953 7.327   27.577  1.000 25.390 0 34  SER A OG   1 ? 
ATOM   499  H  H    . SER A 1 35  ? -10.101 8.028   26.640  1.000 20.295 0 34  SER A H    1 c 
ATOM   500  H  HA   . SER A 1 35  ? -11.543 5.979   27.800  1.000 21.562 0 34  SER A HA   1 c 
ATOM   501  H  HB2  . SER A 1 35  ? -12.494 7.781   28.837  1.000 23.621 0 34  SER A HB2  1 c 
ATOM   502  H  HB3  . SER A 1 35  ? -12.483 8.650   27.497  1.000 23.621 0 34  SER A HB3  1 c 
ATOM   503  H  HG   . SER A 1 35  ? -14.455 7.937   27.935  0.000 25.550 0 34  SER A HG   1 c 
ATOM   504  N  N    . ILE A 1 36  ? -12.393 5.239   25.563  1.000 20.125 0 35  ILE A N    1 ? 
ATOM   505  C  CA   . ILE A 1 36  ? -12.803 4.725   24.217  1.000 18.894 0 35  ILE A CA   1 ? 
ATOM   506  C  C    . ILE A 1 36  ? -14.267 4.279   24.312  1.000 20.686 0 35  ILE A C    1 ? 
ATOM   507  O  O    . ILE A 1 36  ? -14.598 3.508   25.241  1.000 18.911 0 35  ILE A O    1 ? 
ATOM   508  C  CB   . ILE A 1 36  ? -11.892 3.570   23.741  1.000 18.355 0 35  ILE A CB   1 ? 
ATOM   509  C  CG1  . ILE A 1 36  ? -10.408 3.874   23.959  1.000 17.928 0 35  ILE A CG1  1 ? 
ATOM   510  C  CG2  . ILE A 1 36  ? -12.190 3.202   22.288  1.000 17.024 0 35  ILE A CG2  1 ? 
ATOM   511  C  CD1  . ILE A 1 36  ? -9.466  2.733   23.623  1.000 19.296 0 35  ILE A CD1  1 ? 
ATOM   512  H  H    . ILE A 1 36  ? -12.559 4.644   26.233  1.000 20.296 0 35  ILE A H    1 c 
ATOM   513  H  HA   . ILE A 1 36  ? -12.740 5.453   23.574  1.000 19.367 0 35  ILE A HA   1 c 
ATOM   514  H  HB   . ILE A 1 36  ? -12.111 2.780   24.295  1.000 18.118 0 35  ILE A HB   1 c 
ATOM   515  H  HG12 . ILE A 1 36  ? -10.165 4.651   23.411  1.000 18.345 0 35  ILE A HG12 1 c 
ATOM   516  H  HG13 . ILE A 1 36  ? -10.273 4.118   24.899  1.000 18.352 0 35  ILE A HG13 1 c 
ATOM   517  H  HG21 . ILE A 1 36  ? -13.132 2.982   22.192  1.000 17.433 0 35  ILE A HG21 1 c 
ATOM   518  H  HG22 . ILE A 1 36  ? -11.653 2.434   22.027  1.000 17.434 0 35  ILE A HG22 1 c 
ATOM   519  H  HG23 . ILE A 1 36  ? -11.975 3.955   21.711  1.000 17.429 0 35  ILE A HG23 1 c 
ATOM   520  H  HD11 . ILE A 1 36  ? -9.780  1.916   24.048  1.000 18.865 0 35  ILE A HD11 1 c 
ATOM   521  H  HD12 . ILE A 1 36  ? -8.573  2.943   23.947  1.000 18.865 0 35  ILE A HD12 1 c 
ATOM   522  H  HD13 . ILE A 1 36  ? -9.438  2.606   22.658  1.000 18.859 0 35  ILE A HD13 1 c 
ATOM   523  N  N    . LYS A 1 37  ? -15.116 4.705   23.366  1.000 20.529 0 36  LYS A N    1 ? 
ATOM   524  C  CA   . LYS A 1 37  ? -16.562 4.372   23.369  1.000 20.698 0 36  LYS A CA   1 ? 
ATOM   525  C  C    . LYS A 1 37  ? -16.927 3.681   22.053  1.000 19.201 0 36  LYS A C    1 ? 
ATOM   526  O  O    . LYS A 1 37  ? -16.104 3.727   21.104  1.000 18.743 0 36  LYS A O    1 ? 
ATOM   527  C  CB   . LYS A 1 37  ? -17.408 5.619   23.648  1.000 22.203 0 36  LYS A CB   1 ? 
ATOM   528  C  CG   . LYS A 1 37  ? -17.596 6.573   22.475  1.000 23.664 0 36  LYS A CG   1 ? 
ATOM   529  C  CD   . LYS A 1 37  ? -17.983 7.963   22.926  1.000 26.204 0 36  LYS A CD   1 ? 
ATOM   530  C  CE   . LYS A 1 37  ? -18.223 8.906   21.771  1.000 28.075 0 36  LYS A CE   1 ? 
ATOM   531  N  NZ   . LYS A 1 37  ? -19.062 10.054  22.174  1.000 27.613 0 36  LYS A NZ   1 ? 
ATOM   532  H  H    . LYS A 1 37  ? -14.856 5.225   22.665  1.000 20.602 0 36  LYS A H    1 c 
ATOM   533  H  HA   . LYS A 1 37  ? -16.720 3.732   24.097  1.000 20.648 0 36  LYS A HA   1 c 
ATOM   534  H  HB2  . LYS A 1 37  ? -18.294 5.327   23.951  1.000 22.177 0 36  LYS A HB2  1 c 
ATOM   535  H  HB3  . LYS A 1 37  ? -16.994 6.113   24.385  1.000 22.205 0 36  LYS A HB3  1 c 
ATOM   536  H  HG2  . LYS A 1 37  ? -16.759 6.620   21.965  1.000 23.875 0 36  LYS A HG2  1 c 
ATOM   537  H  HG3  . LYS A 1 37  ? -18.294 6.219   21.883  1.000 23.878 0 36  LYS A HG3  1 c 
ATOM   538  H  HD2  . LYS A 1 37  ? -18.800 7.909   23.467  1.000 26.005 0 36  LYS A HD2  1 c 
ATOM   539  H  HD3  . LYS A 1 37  ? -17.269 8.328   23.492  1.000 26.002 0 36  LYS A HD3  1 c 
ATOM   540  H  HE2  . LYS A 1 37  ? -17.368 9.238   21.437  1.000 27.513 0 36  LYS A HE2  1 c 
ATOM   541  H  HE3  . LYS A 1 37  ? -18.666 8.428   21.045  1.000 27.507 0 36  LYS A HE3  1 c 
ATOM   542  H  HZ1  . LYS A 1 37  ? -19.890 9.764   22.405  1.000 27.749 0 36  LYS A HZ1  1 c 
ATOM   543  H  HZ2  . LYS A 1 37  ? -19.133 10.640  21.486  1.000 27.752 0 36  LYS A HZ2  1 c 
ATOM   544  H  HZ3  . LYS A 1 37  ? -18.686 10.475  22.885  1.000 27.752 0 36  LYS A HZ3  1 c 
ATOM   545  N  N    . GLY A 1 38  ? -18.087 3.022   22.043  1.000 17.571 0 37  GLY A N    1 ? 
ATOM   546  C  CA   . GLY A 1 38  ? -18.664 2.304   20.887  1.000 17.957 0 37  GLY A CA   1 ? 
ATOM   547  C  C    . GLY A 1 38  ? -18.167 0.879   20.773  1.000 18.817 0 37  GLY A C    1 ? 
ATOM   548  O  O    . GLY A 1 38  ? -18.269 0.303   19.663  1.000 19.986 0 37  GLY A O    1 ? 
ATOM   549  H  H    . GLY A 1 38  ? -18.612 2.977   22.787  1.000 18.041 0 37  GLY A H    1 c 
ATOM   550  H  HA2  . GLY A 1 38  ? -19.650 2.299   20.974  1.000 18.069 0 37  GLY A HA2  1 c 
ATOM   551  H  HA3  . GLY A 1 38  ? -18.435 2.796   20.059  1.000 18.066 0 37  GLY A HA3  1 c 
ATOM   552  N  N    . LEU A 1 39  ? -17.652 0.311   21.873  1.000 18.346 0 38  LEU A N    1 ? 
ATOM   553  C  CA   . LEU A 1 39  ? -17.064 -1.051  21.924  1.000 19.471 0 38  LEU A CA   1 ? 
ATOM   554  C  C    . LEU A 1 39  ? -18.103 -2.082  22.397  1.000 20.347 0 38  LEU A C    1 ? 
ATOM   555  O  O    . LEU A 1 39  ? -19.022 -1.705  23.178  1.000 19.706 0 38  LEU A O    1 ? 
ATOM   556  C  CB   . LEU A 1 39  ? -15.848 -1.024  22.858  1.000 18.005 0 38  LEU A CB   1 ? 
ATOM   557  C  CG   . LEU A 1 39  ? -14.642 -0.246  22.331  1.000 18.131 0 38  LEU A CG   1 ? 
ATOM   558  C  CD1  . LEU A 1 39  ? -13.719 0.158   23.479  1.000 18.392 0 38  LEU A CD1  1 ? 
ATOM   559  C  CD2  . LEU A 1 39  ? -13.879 -1.049  21.276  1.000 18.133 0 38  LEU A CD2  1 ? 
ATOM   560  H  H    . LEU A 1 39  ? -17.646 0.734   22.680  1.000 18.710 0 38  LEU A H    1 c 
ATOM   561  H  HA   . LEU A 1 39  ? -16.770 -1.296  21.016  1.000 19.130 0 38  LEU A HA   1 c 
ATOM   562  H  HB2  . LEU A 1 39  ? -16.122 -0.634  23.712  1.000 18.374 0 38  LEU A HB2  1 c 
ATOM   563  H  HB3  . LEU A 1 39  ? -15.571 -1.946  23.031  1.000 18.376 0 38  LEU A HB3  1 c 
ATOM   564  H  HG   . LEU A 1 39  ? -14.975 0.581   21.902  1.000 18.160 0 38  LEU A HG   1 c 
ATOM   565  H  HD11 . LEU A 1 39  ? -14.195 0.752   24.085  1.000 18.316 0 38  LEU A HD11 1 c 
ATOM   566  H  HD12 . LEU A 1 39  ? -12.938 0.616   23.123  1.000 18.314 0 38  LEU A HD12 1 c 
ATOM   567  H  HD13 . LEU A 1 39  ? -13.435 -0.637  23.962  1.000 18.316 0 38  LEU A HD13 1 c 
ATOM   568  H  HD21 . LEU A 1 39  ? -13.572 -1.887  21.665  1.000 18.138 0 38  LEU A HD21 1 c 
ATOM   569  H  HD22 . LEU A 1 39  ? -13.111 -0.535  20.969  1.000 18.138 0 38  LEU A HD22 1 c 
ATOM   570  H  HD23 . LEU A 1 39  ? -14.465 -1.237  20.523  1.000 18.140 0 38  LEU A HD23 1 c 
ATOM   571  N  N    . THR A 1 40  ? -17.944 -3.339  21.966  1.000 20.355 0 39  THR A N    1 ? 
ATOM   572  C  CA   . THR A 1 40  ? -18.631 -4.511  22.573  1.000 20.774 0 39  THR A CA   1 ? 
ATOM   573  C  C    . THR A 1 40  ? -18.041 -4.754  23.964  1.000 19.498 0 39  THR A C    1 ? 
ATOM   574  O  O    . THR A 1 40  ? -16.816 -4.621  24.126  1.000 21.105 0 39  THR A O    1 ? 
ATOM   575  C  CB   . THR A 1 40  ? -18.516 -5.793  21.742  1.000 21.333 0 39  THR A CB   1 ? 
ATOM   576  O  OG1  . THR A 1 40  ? -17.142 -6.133  21.557  1.000 21.462 0 39  THR A OG1  1 ? 
ATOM   577  C  CG2  . THR A 1 40  ? -19.218 -5.673  20.407  1.000 21.211 0 39  THR A CG2  1 ? 
ATOM   578  H  H    . THR A 1 40  ? -17.401 -3.568  21.267  1.000 20.450 0 39  THR A H    1 c 
ATOM   579  H  HA   . THR A 1 40  ? -19.588 -4.285  22.672  1.000 20.542 0 39  THR A HA   1 c 
ATOM   580  H  HB   . THR A 1 40  ? -18.949 -6.520  22.252  1.000 21.223 0 39  THR A HB   1 c 
ATOM   581  H  HG1  . THR A 1 40  ? -17.082 -6.828  21.095  0.000 21.070 0 39  THR A HG1  1 c 
ATOM   582  H  HG21 . THR A 1 40  ? -20.180 -5.496  20.554  1.000 21.249 0 39  THR A HG21 1 c 
ATOM   583  H  HG22 . THR A 1 40  ? -19.113 -6.515  19.900  1.000 21.249 0 39  THR A HG22 1 c 
ATOM   584  H  HG23 . THR A 1 40  ? -18.823 -4.927  19.891  1.000 21.249 0 39  THR A HG23 1 c 
ATOM   585  N  N    . GLU A 1 41  ? -18.894 -5.057  24.942  1.000 19.371 0 40  GLU A N    1 ? 
ATOM   586  C  CA   . GLU A 1 41  ? -18.449 -5.317  26.340  1.000 18.402 0 40  GLU A CA   1 ? 
ATOM   587  C  C    . GLU A 1 41  ? -17.343 -6.400  26.317  1.000 15.300 0 40  GLU A C    1 ? 
ATOM   588  O  O    . GLU A 1 41  ? -17.475 -7.420  25.575  1.000 16.854 0 40  GLU A O    1 ? 
ATOM   589  C  CB   . GLU A 1 41  ? -19.686 -5.645  27.185  1.000 20.544 0 40  GLU A CB   1 ? 
ATOM   590  C  CG   . GLU A 1 41  ? -19.378 -6.149  28.587  1.000 22.281 0 40  GLU A CG   1 ? 
ATOM   591  C  CD   . GLU A 1 41  ? -20.590 -6.644  29.368  1.000 24.900 0 40  GLU A CD   1 ? 
ATOM   592  O  OE1  . GLU A 1 41  ? -21.427 -7.347  28.760  1.000 26.928 0 40  GLU A OE1  1 ? 
ATOM   593  O  OE2  . GLU A 1 41  ? -20.707 -6.322  30.575  1.000 23.445 0 40  GLU A OE2  1 ? 
ATOM   594  H  H    . GLU A 1 41  ? -19.794 -5.120  24.813  1.000 19.183 0 40  GLU A H    1 c 
ATOM   595  H  HA   . GLU A 1 41  ? -18.054 -4.485  26.687  1.000 18.306 0 40  GLU A HA   1 c 
ATOM   596  H  HB2  . GLU A 1 41  ? -20.237 -4.837  27.253  1.000 20.406 0 40  GLU A HB2  1 c 
ATOM   597  H  HB3  . GLU A 1 41  ? -20.211 -6.325  26.713  1.000 20.413 0 40  GLU A HB3  1 c 
ATOM   598  H  HG2  . GLU A 1 41  ? -18.732 -6.882  28.526  1.000 22.423 0 40  GLU A HG2  1 c 
ATOM   599  H  HG3  . GLU A 1 41  ? -18.956 -5.425  29.098  1.000 22.438 0 40  GLU A HG3  1 c 
ATOM   600  N  N    . GLY A 1 42  ? -16.260 -6.195  27.088  1.000 13.645 0 41  GLY A N    1 ? 
ATOM   601  C  CA   . GLY A 1 42  ? -15.130 -7.125  27.210  1.000 12.855 0 41  GLY A CA   1 ? 
ATOM   602  C  C    . GLY A 1 42  ? -13.811 -6.551  26.715  1.000 12.829 0 41  GLY A C    1 ? 
ATOM   603  O  O    . GLY A 1 42  ? -13.712 -5.337  26.519  1.000 11.152 0 41  GLY A O    1 ? 
ATOM   604  H  H    . GLY A 1 42  ? -16.168 -5.443  27.594  1.000 13.835 0 41  GLY A H    1 c 
ATOM   605  H  HA2  . GLY A 1 42  ? -15.033 -7.381  28.162  1.000 13.034 0 41  GLY A HA2  1 c 
ATOM   606  H  HA3  . GLY A 1 42  ? -15.335 -7.948  26.700  1.000 13.043 0 41  GLY A HA3  1 c 
ATOM   607  N  N    . LEU A 1 43  ? -12.823 -7.418  26.524  1.000 13.068 0 42  LEU A N    1 ? 
ATOM   608  C  CA   . LEU A 1 43  ? -11.407 -7.047  26.277  1.000 13.390 0 42  LEU A CA   1 ? 
ATOM   609  C  C    . LEU A 1 43  ? -11.177 -6.814  24.785  1.000 13.923 0 42  LEU A C    1 ? 
ATOM   610  O  O    . LEU A 1 43  ? -11.648 -7.646  23.982  1.000 16.586 0 42  LEU A O    1 ? 
ATOM   611  C  CB   . LEU A 1 43  ? -10.453 -8.139  26.760  1.000 12.697 0 42  LEU A CB   1 ? 
ATOM   612  C  CG   . LEU A 1 43  ? -10.045 -8.035  28.225  1.000 13.229 0 42  LEU A CG   1 ? 
ATOM   613  C  CD1  . LEU A 1 43  ? -11.264 -8.237  29.105  1.000 13.542 0 42  LEU A CD1  1 ? 
ATOM   614  C  CD2  . LEU A 1 43  ? -8.953  -9.045  28.528  1.000 12.766 0 42  LEU A CD2  1 ? 
ATOM   615  H  H    . LEU A 1 43  ? -12.961 -8.315  26.547  1.000 13.084 0 42  LEU A H    1 c 
ATOM   616  H  HA   . LEU A 1 43  ? -11.219 -6.214  26.762  1.000 13.298 0 42  LEU A HA   1 c 
ATOM   617  H  HB2  . LEU A 1 43  ? -10.876 -9.009  26.616  1.000 12.984 0 42  LEU A HB2  1 c 
ATOM   618  H  HB3  . LEU A 1 43  ? -9.644  -8.110  26.211  1.000 12.984 0 42  LEU A HB3  1 c 
ATOM   619  H  HG   . LEU A 1 43  ? -9.687  -7.127  28.387  1.000 13.097 0 42  LEU A HG   1 c 
ATOM   620  H  HD11 . LEU A 1 43  ? -11.871 -7.483  29.000  1.000 13.445 0 42  LEU A HD11 1 c 
ATOM   621  H  HD12 . LEU A 1 43  ? -10.984 -8.299  30.036  1.000 13.446 0 42  LEU A HD12 1 c 
ATOM   622  H  HD13 . LEU A 1 43  ? -11.718 -9.058  28.848  1.000 13.446 0 42  LEU A HD13 1 c 
ATOM   623  H  HD21 . LEU A 1 43  ? -9.288  -9.944  28.367  1.000 12.909 0 42  LEU A HD21 1 c 
ATOM   624  H  HD22 . LEU A 1 43  ? -8.683  -8.962  29.459  1.000 12.909 0 42  LEU A HD22 1 c 
ATOM   625  H  HD23 . LEU A 1 43  ? -8.187  -8.877  27.952  1.000 12.910 0 42  LEU A HD23 1 c 
ATOM   626  N  N    . HIS A 1 44  ? -10.366 -5.806  24.478  1.000 14.591 0 43  HIS A N    1 ? 
ATOM   627  C  CA   . HIS A 1 44  ? -9.970  -5.412  23.095  1.000 14.932 0 43  HIS A CA   1 ? 
ATOM   628  C  C    . HIS A 1 44  ? -8.452  -5.216  23.040  1.000 15.406 0 43  HIS A C    1 ? 
ATOM   629  O  O    . HIS A 1 44  ? -7.941  -4.428  23.832  1.000 16.892 0 43  HIS A O    1 ? 
ATOM   630  C  CB   . HIS A 1 44  ? -10.733 -4.159  22.649  1.000 15.271 0 43  HIS A CB   1 ? 
ATOM   631  C  CG   . HIS A 1 44  ? -12.205 -4.381  22.543  1.000 15.995 0 43  HIS A CG   1 ? 
ATOM   632  N  ND1  . HIS A 1 44  ? -12.813 -4.625  21.319  1.000 17.859 0 43  HIS A ND1  1 ? 
ATOM   633  C  CD2  . HIS A 1 44  ? -13.196 -4.348  23.471  1.000 15.224 0 43  HIS A CD2  1 ? 
ATOM   634  C  CE1  . HIS A 1 44  ? -14.109 -4.805  21.507  1.000 16.548 0 43  HIS A CE1  1 ? 
ATOM   635  N  NE2  . HIS A 1 44  ? -14.374 -4.651  22.828  1.000 15.772 0 43  HIS A NE2  1 ? 
ATOM   636  H  H    . HIS A 1 44  ? -9.987  -5.269  25.109  1.000 14.504 0 43  HIS A H    1 c 
ATOM   637  H  HA   . HIS A 1 44  ? -10.206 -6.152  22.488  1.000 15.017 0 43  HIS A HA   1 c 
ATOM   638  H  HB2  . HIS A 1 44  ? -10.564 -3.436  23.293  1.000 15.356 0 43  HIS A HB2  1 c 
ATOM   639  H  HB3  . HIS A 1 44  ? -10.388 -3.869  21.775  1.000 15.356 0 43  HIS A HB3  1 c 
ATOM   640  H  HD1  . HIS A 1 44  ? -12.406 -4.659  20.533  0.000 16.990 0 43  HIS A HD1  1 c 
ATOM   641  H  HD2  . HIS A 1 44  ? -13.090 -4.212  24.393  1.000 15.558 0 43  HIS A HD2  1 c 
ATOM   642  H  HE1  . HIS A 1 44  ? -14.741 -4.994  20.836  1.000 16.614 0 43  HIS A HE1  1 c 
ATOM   643  H  HE2  . HIS A 1 44  ? -15.154 -4.728  23.208  0.000 15.150 0 43  HIS A HE2  1 c 
ATOM   644  N  N    . GLY A 1 45  ? -7.785  -5.876  22.094  1.000 14.647 0 44  GLY A N    1 ? 
ATOM   645  C  CA   . GLY A 1 45  ? -6.356  -5.686  21.793  1.000 14.324 0 44  GLY A CA   1 ? 
ATOM   646  C  C    . GLY A 1 45  ? -5.994  -4.223  21.541  1.000 14.145 0 44  GLY A C    1 ? 
ATOM   647  O  O    . GLY A 1 45  ? -6.788  -3.484  20.901  1.000 11.698 0 44  GLY A O    1 ? 
ATOM   648  H  H    . GLY A 1 45  ? -8.189  -6.500  21.567  1.000 14.745 0 44  GLY A H    1 c 
ATOM   649  H  HA2  . GLY A 1 45  ? -5.823  -6.029  22.552  1.000 14.363 0 44  GLY A HA2  1 c 
ATOM   650  H  HA3  . GLY A 1 45  ? -6.125  -6.220  20.992  1.000 14.357 0 44  GLY A HA3  1 c 
ATOM   651  N  N    . PHE A 1 46  ? -4.833  -3.814  22.062  1.000 14.895 0 45  PHE A N    1 ? 
ATOM   652  C  CA   . PHE A 1 46  ? -4.379  -2.406  22.220  1.000 15.248 0 45  PHE A CA   1 ? 
ATOM   653  C  C    . PHE A 1 46  ? -2.860  -2.364  21.963  1.000 16.890 0 45  PHE A C    1 ? 
ATOM   654  O  O    . PHE A 1 46  ? -2.112  -2.855  22.799  1.000 16.042 0 45  PHE A O    1 ? 
ATOM   655  C  CB   . PHE A 1 46  ? -4.841  -1.934  23.606  1.000 14.303 0 45  PHE A CB   1 ? 
ATOM   656  C  CG   . PHE A 1 46  ? -4.745  -0.452  23.852  1.000 15.413 0 45  PHE A CG   1 ? 
ATOM   657  C  CD1  . PHE A 1 46  ? -5.416  0.457   23.038  1.000 14.791 0 45  PHE A CD1  1 ? 
ATOM   658  C  CD2  . PHE A 1 46  ? -4.006  0.044   24.922  1.000 14.867 0 45  PHE A CD2  1 ? 
ATOM   659  C  CE1  . PHE A 1 46  ? -5.332  1.817   23.282  1.000 15.396 0 45  PHE A CE1  1 ? 
ATOM   660  C  CE2  . PHE A 1 46  ? -3.936  1.407   25.166  1.000 15.393 0 45  PHE A CE2  1 ? 
ATOM   661  C  CZ   . PHE A 1 46  ? -4.594  2.289   24.342  1.000 14.914 0 45  PHE A CZ   1 ? 
ATOM   662  H  H    . PHE A 1 46  ? -4.211  -4.404  22.371  1.000 14.798 0 45  PHE A H    1 c 
ATOM   663  H  HA   . PHE A 1 46  ? -4.827  -1.853  21.534  1.000 15.282 0 45  PHE A HA   1 c 
ATOM   664  H  HB2  . PHE A 1 46  ? -5.774  -2.210  23.727  1.000 14.779 0 45  PHE A HB2  1 c 
ATOM   665  H  HB3  . PHE A 1 46  ? -4.306  -2.400  24.282  1.000 14.781 0 45  PHE A HB3  1 c 
ATOM   666  H  HD1  . PHE A 1 46  ? -5.925  0.142   22.308  1.000 15.071 0 45  PHE A HD1  1 c 
ATOM   667  H  HD2  . PHE A 1 46  ? -3.553  -0.556  25.492  1.000 15.106 0 45  PHE A HD2  1 c 
ATOM   668  H  HE1  . PHE A 1 46  ? -5.786  2.423   22.718  1.000 15.131 0 45  PHE A HE1  1 c 
ATOM   669  H  HE2  . PHE A 1 46  ? -3.424  1.730   25.890  1.000 15.145 0 45  PHE A HE2  1 c 
ATOM   670  H  HZ   . PHE A 1 46  ? -4.540  3.217   24.504  1.000 15.126 0 45  PHE A HZ   1 c 
ATOM   671  N  N    . HIS A 1 47  ? -2.428  -1.888  20.780  1.000 16.763 0 46  HIS A N    1 ? 
ATOM   672  C  CA   . HIS A 1 47  ? -1.023  -1.980  20.298  1.000 18.231 0 46  HIS A CA   1 ? 
ATOM   673  C  C    . HIS A 1 47  ? -0.600  -0.718  19.532  1.000 16.138 0 46  HIS A C    1 ? 
ATOM   674  O  O    . HIS A 1 47  ? -1.455  -0.049  18.927  1.000 13.060 0 46  HIS A O    1 ? 
ATOM   675  C  CB   . HIS A 1 47  ? -0.776  -3.168  19.339  1.000 21.248 0 46  HIS A CB   1 ? 
ATOM   676  C  CG   . HIS A 1 47  ? -1.522  -4.424  19.647  1.000 22.404 0 46  HIS A CG   1 ? 
ATOM   677  N  ND1  . HIS A 1 47  ? -2.482  -4.920  18.790  1.000 22.633 0 46  HIS A ND1  1 ? 
ATOM   678  C  CD2  . HIS A 1 47  ? -1.455  -5.285  20.690  1.000 21.726 0 46  HIS A CD2  1 ? 
ATOM   679  C  CE1  . HIS A 1 47  ? -2.970  -6.032  19.287  1.000 22.274 0 46  HIS A CE1  1 ? 
ATOM   680  N  NE2  . HIS A 1 47  ? -2.362  -6.271  20.449  1.000 19.888 0 46  HIS A NE2  1 ? 
ATOM   681  H  H    . HIS A 1 47  ? -2.975  -1.471  20.182  1.000 17.121 0 46  HIS A H    1 c 
ATOM   682  H  HA   . HIS A 1 47  ? -0.437  -2.077  21.082  1.000 18.022 0 46  HIS A HA   1 c 
ATOM   683  H  HB2  . HIS A 1 47  ? -1.012  -2.885  18.428  1.000 20.740 0 46  HIS A HB2  1 c 
ATOM   684  H  HB3  . HIS A 1 47  ? 0.186   -3.371  19.341  1.000 20.749 0 46  HIS A HB3  1 c 
ATOM   685  H  HD1  . HIS A 1 47  ? -2.703  -4.563  18.013  0.000 22.400 0 46  HIS A HD1  1 c 
ATOM   686  H  HD2  . HIS A 1 47  ? -0.892  -5.220  21.438  1.000 21.455 0 46  HIS A HD2  1 c 
ATOM   687  H  HE1  . HIS A 1 47  ? -3.645  -6.561  18.897  1.000 21.782 0 46  HIS A HE1  1 c 
ATOM   688  H  HE2  . HIS A 1 47  ? -2.488  -6.968  20.955  0.000 19.520 0 46  HIS A HE2  1 c 
ATOM   689  N  N    . VAL A 1 48  ? 0.708   -0.463  19.554  1.000 14.066 0 47  VAL A N    1 ? 
ATOM   690  C  CA   . VAL A 1 48  ? 1.408   0.503   18.672  1.000 13.143 0 47  VAL A CA   1 ? 
ATOM   691  C  C    . VAL A 1 48  ? 1.882   -0.293  17.473  1.000 12.525 0 47  VAL A C    1 ? 
ATOM   692  O  O    . VAL A 1 48  ? 2.613   -1.301  17.645  1.000 12.396 0 47  VAL A O    1 ? 
ATOM   693  C  CB   . VAL A 1 48  ? 2.550   1.265   19.369  1.000 13.285 0 47  VAL A CB   1 ? 
ATOM   694  C  CG1  . VAL A 1 48  ? 3.240   2.216   18.406  1.000 13.595 0 47  VAL A CG1  1 ? 
ATOM   695  C  CG2  . VAL A 1 48  ? 2.048   1.981   20.616  1.000 13.686 0 47  VAL A CG2  1 ? 
ATOM   696  H  H    . VAL A 1 48  ? 1.272   -0.881  20.134  1.000 14.317 0 47  VAL A H    1 c 
ATOM   697  H  HA   . VAL A 1 48  ? 0.756   1.156   18.367  1.000 13.217 0 47  VAL A HA   1 c 
ATOM   698  H  HB   . VAL A 1 48  ? 3.218   0.594   19.657  1.000 13.392 0 47  VAL A HB   1 c 
ATOM   699  H  HG11 . VAL A 1 48  ? 3.710   1.707   17.723  1.000 13.497 0 47  VAL A HG11 1 c 
ATOM   700  H  HG12 . VAL A 1 48  ? 3.877   2.766   18.895  1.000 13.499 0 47  VAL A HG12 1 c 
ATOM   701  H  HG13 . VAL A 1 48  ? 2.576   2.789   17.984  1.000 13.499 0 47  VAL A HG13 1 c 
ATOM   702  H  HG21 . VAL A 1 48  ? 1.329   2.590   20.374  1.000 13.562 0 47  VAL A HG21 1 c 
ATOM   703  H  HG22 . VAL A 1 48  ? 2.777   2.484   21.017  1.000 13.562 0 47  VAL A HG22 1 c 
ATOM   704  H  HG23 . VAL A 1 48  ? 1.716   1.327   21.256  1.000 13.563 0 47  VAL A HG23 1 c 
ATOM   705  N  N    . HIS A 1 49  ? 1.417   0.110   16.301  1.000 11.609 0 48  HIS A N    1 ? 
ATOM   706  C  CA   . HIS A 1 49  ? 1.899   -0.453  15.012  1.000 11.259 0 48  HIS A CA   1 ? 
ATOM   707  C  C    . HIS A 1 49  ? 3.036   0.425   14.489  1.000 12.209 0 48  HIS A C    1 ? 
ATOM   708  O  O    . HIS A 1 49  ? 3.156   1.623   14.936  1.000 11.295 0 48  HIS A O    1 ? 
ATOM   709  C  CB   . HIS A 1 49  ? 0.714   -0.675  14.043  1.000 10.951 0 48  HIS A CB   1 ? 
ATOM   710  C  CG   . HIS A 1 49  ? -0.184  -1.800  14.417  1.000 11.348 0 48  HIS A CG   1 ? 
ATOM   711  N  ND1  . HIS A 1 49  ? -0.416  -2.892  13.590  1.000 10.410 0 48  HIS A ND1  1 ? 
ATOM   712  C  CD2  . HIS A 1 49  ? -0.867  -2.034  15.566  1.000 10.290 0 48  HIS A CD2  1 ? 
ATOM   713  C  CE1  . HIS A 1 49  ? -1.216  -3.740  14.198  1.000 11.580 0 48  HIS A CE1  1 ? 
ATOM   714  N  NE2  . HIS A 1 49  ? -1.554  -3.208  15.387  1.000 10.864 0 48  HIS A NE2  1 ? 
ATOM   715  H  H    . HIS A 1 49  ? 0.778   0.750   16.195  1.000 11.737 0 48  HIS A H    1 c 
ATOM   716  H  HA   . HIS A 1 49  ? 2.283   -1.339  15.207  1.000 11.450 0 48  HIS A HA   1 c 
ATOM   717  H  HB2  . HIS A 1 49  ? 0.182   0.151   14.001  1.000 11.117 0 48  HIS A HB2  1 c 
ATOM   718  H  HB3  . HIS A 1 49  ? 1.071   -0.843  13.143  1.000 11.116 0 48  HIS A HB3  1 c 
ATOM   719  H  HD1  . HIS A 1 49  ? -0.065  -2.989  12.775  0.000 9.910  0 48  HIS A HD1  1 c 
ATOM   720  H  HD2  . HIS A 1 49  ? -0.927  -1.464  16.310  1.000 10.678 0 48  HIS A HD2  1 c 
ATOM   721  H  HE1  . HIS A 1 49  ? -1.546  -4.542  13.835  1.000 11.133 0 48  HIS A HE1  1 c 
ATOM   722  H  HE2  . HIS A 1 49  ? -2.060  -3.594  15.974  0.000 10.370 0 48  HIS A HE2  1 c 
ATOM   723  N  N    . GLU A 1 50  ? 3.814   -0.136  13.555  1.000 12.522 0 49  GLU A N    1 ? 
ATOM   724  C  CA   . GLU A 1 50  ? 5.116   0.421   13.084  1.000 13.312 0 49  GLU A CA   1 ? 
ATOM   725  C  C    . GLU A 1 50  ? 4.958   1.772   12.362  1.000 12.622 0 49  GLU A C    1 ? 
ATOM   726  O  O    . GLU A 1 50  ? 5.800   2.653   12.603  1.000 12.903 0 49  GLU A O    1 ? 
ATOM   727  C  CB   . GLU A 1 50  ? 5.794   -0.548  12.126  1.000 14.524 0 49  GLU A CB   1 ? 
ATOM   728  C  CG   . GLU A 1 50  ? 7.137   -0.047  11.646  1.000 15.733 0 49  GLU A CG   1 ? 
ATOM   729  C  CD   . GLU A 1 50  ? 7.944   -1.051  10.841  1.000 17.450 0 49  GLU A CD   1 ? 
ATOM   730  O  OE1  . GLU A 1 50  ? 7.354   -2.048  10.375  1.000 19.602 0 49  GLU A OE1  1 ? 
ATOM   731  O  OE2  . GLU A 1 50  ? 9.175   -0.829  10.696  1.000 20.875 0 49  GLU A OE2  1 ? 
ATOM   732  H  H    . GLU A 1 50  ? 3.584   -0.914  13.140  1.000 12.630 0 49  GLU A H    1 c 
ATOM   733  H  HA   . GLU A 1 50  ? 5.698   0.550   13.868  1.000 13.244 0 49  GLU A HA   1 c 
ATOM   734  H  HB2  . GLU A 1 50  ? 5.914   -1.408  12.580  1.000 14.510 0 49  GLU A HB2  1 c 
ATOM   735  H  HB3  . GLU A 1 50  ? 5.208   -0.691  11.354  1.000 14.508 0 49  GLU A HB3  1 c 
ATOM   736  H  HG2  . GLU A 1 50  ? 7.000   0.749   11.091  1.000 15.824 0 49  GLU A HG2  1 c 
ATOM   737  H  HG3  . GLU A 1 50  ? 7.670   0.224   12.423  1.000 15.824 0 49  GLU A HG3  1 c 
ATOM   738  N  N    . PHE A 1 51  ? 4.002   1.917   11.443  1.000 13.725 0 50  PHE A N    1 ? 
ATOM   739  C  CA   . PHE A 1 51  ? 3.890   3.119   10.582  1.000 14.178 0 50  PHE A CA   1 ? 
ATOM   740  C  C    . PHE A 1 51  ? 2.757   4.047   11.026  1.000 13.067 0 50  PHE A C    1 ? 
ATOM   741  O  O    . PHE A 1 51  ? 1.626   3.608   11.256  1.000 13.525 0 50  PHE A O    1 ? 
ATOM   742  C  CB   . PHE A 1 51  ? 3.758   2.749   9.099   1.000 14.998 0 50  PHE A CB   1 ? 
ATOM   743  C  CG   . PHE A 1 51  ? 4.823   1.784   8.653   1.000 16.663 0 50  PHE A CG   1 ? 
ATOM   744  C  CD1  . PHE A 1 51  ? 6.158   2.147   8.704   1.000 18.354 0 50  PHE A CD1  1 ? 
ATOM   745  C  CD2  . PHE A 1 51  ? 4.504   0.493   8.256   1.000 19.617 0 50  PHE A CD2  1 ? 
ATOM   746  C  CE1  . PHE A 1 51  ? 7.154   1.262   8.315   1.000 20.327 0 50  PHE A CE1  1 ? 
ATOM   747  C  CE2  . PHE A 1 51  ? 5.508   -0.394  7.886   1.000 18.857 0 50  PHE A CE2  1 ? 
ATOM   748  C  CZ   . PHE A 1 51  ? 6.827   -0.011  7.908   1.000 19.417 0 50  PHE A CZ   1 ? 
ATOM   749  H  H    . PHE A 1 51  ? 3.356   1.297   11.277  1.000 13.559 0 50  PHE A H    1 c 
ATOM   750  H  HA   . PHE A 1 51  ? 4.734   3.628   10.678  1.000 14.018 0 50  PHE A HA   1 c 
ATOM   751  H  HB2  . PHE A 1 51  ? 2.875   2.350   8.949   1.000 15.188 0 50  PHE A HB2  1 c 
ATOM   752  H  HB3  . PHE A 1 51  ? 3.817   3.567   8.562   1.000 15.176 0 50  PHE A HB3  1 c 
ATOM   753  H  HD1  . PHE A 1 51  ? 6.391   3.019   8.978   1.000 18.398 0 50  PHE A HD1  1 c 
ATOM   754  H  HD2  . PHE A 1 51  ? 3.601   0.219   8.234   1.000 18.685 0 50  PHE A HD2  1 c 
ATOM   755  H  HE1  . PHE A 1 51  ? 8.056   1.530   8.341   1.000 19.522 0 50  PHE A HE1  1 c 
ATOM   756  H  HE2  . PHE A 1 51  ? 5.278   -1.263  7.598   1.000 19.087 0 50  PHE A HE2  1 c 
ATOM   757  H  HZ   . PHE A 1 51  ? 7.503   -0.617  7.648   1.000 19.378 0 50  PHE A HZ   1 c 
ATOM   758  N  N    . GLY A 1 52  ? 3.071   5.344   11.068  1.000 13.046 0 51  GLY A N    1 ? 
ATOM   759  C  CA   . GLY A 1 52  ? 2.069   6.414   11.240  1.000 12.647 0 51  GLY A CA   1 ? 
ATOM   760  C  C    . GLY A 1 52  ? 1.361   6.749   9.936   1.000 14.095 0 51  GLY A C    1 ? 
ATOM   761  O  O    . GLY A 1 52  ? 1.202   7.952   9.662   1.000 13.190 0 51  GLY A O    1 ? 
ATOM   762  H  H    . GLY A 1 52  ? 3.929   5.642   10.993  1.000 12.961 0 51  GLY A H    1 c 
ATOM   763  H  HA2  . GLY A 1 52  ? 1.402   6.127   11.911  1.000 13.072 0 51  GLY A HA2  1 c 
ATOM   764  H  HA3  . GLY A 1 52  ? 2.518   7.222   11.584  1.000 13.063 0 51  GLY A HA3  1 c 
ATOM   765  N  N    . ASP A 1 53  ? 0.934   5.715   9.195   1.000 16.072 0 52  ASP A N    1 ? 
ATOM   766  C  CA   . ASP A 1 53  ? 0.309   5.833   7.842   1.000 16.327 0 52  ASP A CA   1 ? 
ATOM   767  C  C    . ASP A 1 53  ? -1.138  5.331   7.906   1.000 17.437 0 52  ASP A C    1 ? 
ATOM   768  O  O    . ASP A 1 53  ? -1.339  4.116   8.151   1.000 16.360 0 52  ASP A O    1 ? 
ATOM   769  C  CB   . ASP A 1 53  ? 1.182   5.098   6.822   1.000 14.979 0 52  ASP A CB   1 ? 
ATOM   770  C  CG   . ASP A 1 53  ? 0.679   5.199   5.392   1.000 15.566 0 52  ASP A CG   1 ? 
ATOM   771  O  OD1  . ASP A 1 53  ? -0.514  5.447   5.223   1.000 15.312 0 52  ASP A OD1  1 ? 
ATOM   772  O  OD2  . ASP A 1 53  ? 1.497   4.999   4.466   1.000 15.716 0 52  ASP A OD2  1 ? 
ATOM   773  H  H    . ASP A 1 53  ? 0.979   4.857   9.489   1.000 15.619 0 52  ASP A H    1 c 
ATOM   774  H  HA   . ASP A 1 53  ? 0.296   6.785   7.593   1.000 16.199 0 52  ASP A HA   1 c 
ATOM   775  H  HB2  . ASP A 1 53  ? 2.089   5.465   6.856   1.000 15.425 0 52  ASP A HB2  1 c 
ATOM   776  H  HB3  . ASP A 1 53  ? 1.227   4.151   7.066   1.000 15.425 0 52  ASP A HB3  1 c 
ATOM   777  N  N    . ASN A 1 54  ? -2.104  6.232   7.715   1.000 18.127 0 53  ASN A N    1 ? 
ATOM   778  C  CA   . ASN A 1 54  ? -3.565  5.939   7.710   1.000 20.589 0 53  ASN A CA   1 ? 
ATOM   779  C  C    . ASN A 1 54  ? -4.175  6.157   6.318   1.000 18.605 0 53  ASN A C    1 ? 
ATOM   780  O  O    . ASN A 1 54  ? -5.400  6.319   6.214   1.000 16.432 0 53  ASN A O    1 ? 
ATOM   781  C  CB   . ASN A 1 54  ? -4.322  6.825   8.695   1.000 25.468 0 53  ASN A CB   1 ? 
ATOM   782  C  CG   . ASN A 1 54  ? -5.709  6.298   9.004   1.000 31.847 0 53  ASN A CG   1 ? 
ATOM   783  O  OD1  . ASN A 1 54  ? -6.706  6.805   8.483   1.000 38.003 0 53  ASN A OD1  1 ? 
ATOM   784  N  ND2  . ASN A 1 54  ? -5.783  5.289   9.856   1.000 36.131 0 53  ASN A ND2  1 ? 
ATOM   785  H  H    . ASN A 1 54  ? -1.920  7.113   7.572   1.000 18.496 0 53  ASN A H    1 c 
ATOM   786  H  HA   . ASN A 1 54  ? -3.701  5.000   7.976   1.000 20.517 0 53  ASN A HA   1 c 
ATOM   787  H  HB2  . ASN A 1 54  ? -3.809  6.893   9.523   1.000 25.501 0 53  ASN A HB2  1 c 
ATOM   788  H  HB3  . ASN A 1 54  ? -4.401  7.724   8.316   1.000 25.491 0 53  ASN A HB3  1 c 
ATOM   789  H  HD21 . ASN A 1 54  ? -6.571  4.948   10.070  1.000 34.755 0 53  ASN A HD21 1 c 
ATOM   790  H  HD22 . ASN A 1 54  ? -5.047  4.955   10.213  1.000 34.726 0 53  ASN A HD22 1 c 
ATOM   791  N  N    . THR A 1 55  ? -3.376  6.140   5.258   1.000 17.800 0 54  THR A N    1 ? 
ATOM   792  C  CA   . THR A 1 55  ? -3.854  6.526   3.904   1.000 17.698 0 54  THR A CA   1 ? 
ATOM   793  C  C    . THR A 1 55  ? -5.100  5.715   3.493   1.000 19.559 0 54  THR A C    1 ? 
ATOM   794  O  O    . THR A 1 55  ? -6.002  6.303   2.801   1.000 18.118 0 54  THR A O    1 ? 
ATOM   795  C  CB   . THR A 1 55  ? -2.702  6.439   2.896   1.000 16.763 0 54  THR A CB   1 ? 
ATOM   796  O  OG1  . THR A 1 55  ? -2.078  5.163   3.017   1.000 16.259 0 54  THR A OG1  1 ? 
ATOM   797  C  CG2  . THR A 1 55  ? -1.677  7.534   3.094   1.000 17.746 0 54  THR A CG2  1 ? 
ATOM   798  H  H    . THR A 1 55  ? -2.500  5.883   5.275   1.000 17.958 0 54  THR A H    1 c 
ATOM   799  H  HA   . THR A 1 55  ? -4.126  7.476   3.958   1.000 17.873 0 54  THR A HA   1 c 
ATOM   800  H  HB   . THR A 1 55  ? -3.082  6.522   1.987   1.000 17.030 0 54  THR A HB   1 c 
ATOM   801  H  HG1  . THR A 1 55  ? -1.439  5.111   2.516   0.000 15.880 0 54  THR A HG1  1 c 
ATOM   802  H  HG21 . THR A 1 55  ? -2.102  8.415   2.948   1.000 17.439 0 54  THR A HG21 1 c 
ATOM   803  H  HG22 . THR A 1 55  ? -0.938  7.415   2.448   1.000 17.436 0 54  THR A HG22 1 c 
ATOM   804  H  HG23 . THR A 1 55  ? -1.319  7.492   4.015   1.000 17.433 0 54  THR A HG23 1 c 
ATOM   805  N  N    . ALA A 1 56  ? -5.153  4.429   3.850   1.000 18.609 0 55  ALA A N    1 ? 
ATOM   806  C  CA   . ALA A 1 56  ? -6.254  3.494   3.514   1.000 18.753 0 55  ALA A CA   1 ? 
ATOM   807  C  C    . ALA A 1 56  ? -6.899  2.969   4.802   1.000 18.775 0 55  ALA A C    1 ? 
ATOM   808  O  O    . ALA A 1 56  ? -7.390  1.803   4.810   1.000 20.362 0 55  ALA A O    1 ? 
ATOM   809  C  CB   . ALA A 1 56  ? -5.739  2.371   2.660   1.000 18.192 0 55  ALA A CB   1 ? 
ATOM   810  H  H    . ALA A 1 56  ? -4.496  4.022   4.331   1.000 18.860 0 55  ALA A H    1 c 
ATOM   811  H  HA   . ALA A 1 56  ? -6.939  3.987   3.005   1.000 18.624 0 55  ALA A HA   1 c 
ATOM   812  H  HB1  . ALA A 1 56  ? -6.485  1.834   2.344   1.000 18.367 0 55  ALA A HB1  1 c 
ATOM   813  H  HB2  . ALA A 1 56  ? -5.259  2.736   1.898   1.000 18.364 0 55  ALA A HB2  1 c 
ATOM   814  H  HB3  . ALA A 1 56  ? -5.139  1.813   3.183   1.000 18.358 0 55  ALA A HB3  1 c 
ATOM   815  N  N    . GLY A 1 57  ? -6.938  3.813   5.828   1.000 18.076 0 56  GLY A N    1 ? 
ATOM   816  C  CA   . GLY A 1 57  ? -7.469  3.460   7.151   1.000 16.460 0 56  GLY A CA   1 ? 
ATOM   817  C  C    . GLY A 1 57  ? -6.429  2.679   7.932   1.000 15.380 0 56  GLY A C    1 ? 
ATOM   818  O  O    . GLY A 1 57  ? -5.226  2.801   7.602   1.000 13.545 0 56  GLY A O    1 ? 
ATOM   819  H  H    . GLY A 1 57  ? -6.644  4.673   5.764   1.000 17.849 0 56  GLY A H    1 c 
ATOM   820  H  HA2  . GLY A 1 57  ? -7.704  4.287   7.641   1.000 16.562 0 56  GLY A HA2  1 c 
ATOM   821  H  HA3  . GLY A 1 57  ? -8.287  2.913   7.042   1.000 16.571 0 56  GLY A HA3  1 c 
ATOM   822  N  N    . CYS A 1 58  ? -6.866  1.895   8.920   1.000 14.133 0 57  CYS A N    1 ? 
ATOM   823  C  CA   . CYS A 1 58  ? -5.967  1.285   9.943   1.000 14.413 0 57  CYS A CA   1 ? 
ATOM   824  C  C    . CYS A 1 58  ? -5.023  0.232   9.319   1.000 13.894 0 57  CYS A C    1 ? 
ATOM   825  O  O    . CYS A 1 58  ? -3.862  0.044   9.826   1.000 12.499 0 57  CYS A O    1 ? 
ATOM   826  C  CB   . CYS A 1 58  ? -6.785  0.778   11.131  1.000 15.157 0 57  CYS A CB   1 ? 
ATOM   827  S  SG   . CYS A 1 58  ? -7.785  2.059   11.943  1.000 16.526 0 57  CYS A SG   1 ? 
ATOM   828  H  H    . CYS A 1 58  ? -7.744  1.673   9.041   1.000 14.486 0 57  CYS A H    1 c 
ATOM   829  H  HA   . CYS A 1 58  ? -5.394  2.017   10.281  1.000 14.402 0 57  CYS A HA   1 c 
ATOM   830  H  HB2  . CYS A 1 58  ? -7.389  0.057   10.823  1.000 15.290 0 57  CYS A HB2  1 c 
ATOM   831  H  HB3  . CYS A 1 58  ? -6.170  0.390   11.802  1.000 15.288 0 57  CYS A HB3  1 c 
ATOM   832  N  N    . THR A 1 59  ? -5.393  -0.416  8.213   1.000 13.537 0 58  THR A N    1 ? 
ATOM   833  C  CA   . THR A 1 59  ? -4.542  -1.486  7.606   1.000 15.009 0 58  THR A CA   1 ? 
ATOM   834  C  C    . THR A 1 59  ? -3.160  -0.928  7.178   1.000 14.306 0 58  THR A C    1 ? 
ATOM   835  O  O    . THR A 1 59  ? -2.153  -1.655  7.333   1.000 13.152 0 58  THR A O    1 ? 
ATOM   836  C  CB   . THR A 1 59  ? -5.280  -2.223  6.476   1.000 16.394 0 58  THR A CB   1 ? 
ATOM   837  O  OG1  . THR A 1 59  ? -4.472  -3.357  6.141   1.000 17.533 0 58  THR A OG1  1 ? 
ATOM   838  C  CG2  . THR A 1 59  ? -5.512  -1.358  5.262   1.000 16.803 0 58  THR A CG2  1 ? 
ATOM   839  H  H    . THR A 1 59  ? -6.177  -0.274  7.766   1.000 13.975 0 58  THR A H    1 c 
ATOM   840  H  HA   . THR A 1 59  ? -4.375  -2.148  8.321   1.000 14.826 0 58  THR A HA   1 c 
ATOM   841  H  HB   . THR A 1 59  ? -6.152  -2.537  6.822   1.000 16.441 0 58  THR A HB   1 c 
ATOM   842  H  HG1  . THR A 1 59  ? -4.881  -3.796  5.527   0.000 17.760 0 58  THR A HG1  1 c 
ATOM   843  H  HG21 . THR A 1 59  ? -6.031  -0.556  5.520   1.000 16.667 0 58  THR A HG21 1 c 
ATOM   844  H  HG22 . THR A 1 59  ? -6.018  -1.871  4.584   1.000 16.673 0 58  THR A HG22 1 c 
ATOM   845  H  HG23 . THR A 1 59  ? -4.644  -1.079  4.880   1.000 16.670 0 58  THR A HG23 1 c 
ATOM   846  N  N    . SER A 1 60  ? -3.072  0.352   6.801   1.000 14.008 0 59  SER A N    1 ? 
ATOM   847  C  CA   . SER A 1 60  ? -1.823  1.010   6.312   1.000 14.065 0 59  SER A CA   1 ? 
ATOM   848  C  C    . SER A 1 60  ? -0.760  1.133   7.412   1.000 13.345 0 59  SER A C    1 ? 
ATOM   849  O  O    . SER A 1 60  ? 0.400   1.359   7.050   1.000 14.583 0 59  SER A O    1 ? 
ATOM   850  C  CB   . SER A 1 60  ? -2.137  2.375   5.725   1.000 14.043 0 59  SER A CB   1 ? 
ATOM   851  O  OG   . SER A 1 60  ? -3.206  2.248   4.809   1.000 14.808 0 59  SER A OG   1 ? 
ATOM   852  H  H    . SER A 1 60  ? -3.784  0.925   6.807   1.000 14.090 0 59  SER A H    1 c 
ATOM   853  H  HA   . SER A 1 60  ? -1.449  0.445   5.592   1.000 13.911 0 59  SER A HA   1 c 
ATOM   854  H  HB2  . SER A 1 60  ? -2.390  3.000   6.448   1.000 14.232 0 59  SER A HB2  1 c 
ATOM   855  H  HB3  . SER A 1 60  ? -1.338  2.733   5.264   1.000 14.228 0 59  SER A HB3  1 c 
ATOM   856  H  HG   . SER A 1 60  ? -3.374  2.998   4.504   0.000 15.390 0 59  SER A HG   1 c 
ATOM   857  N  N    . ALA A 1 61  ? -1.142  0.996   8.690   1.000 11.290 0 60  ALA A N    1 ? 
ATOM   858  C  CA   . ALA A 1 61  ? -0.222  1.107   9.844   1.000 11.258 0 60  ALA A CA   1 ? 
ATOM   859  C  C    . ALA A 1 61  ? 0.757   -0.074  9.900   1.000 11.915 0 60  ALA A C    1 ? 
ATOM   860  O  O    . ALA A 1 61  ? 1.822   0.028   10.574  1.000 11.658 0 60  ALA A O    1 ? 
ATOM   861  C  CB   . ALA A 1 61  ? -1.030  1.191   11.117  1.000 10.934 0 60  ALA A CB   1 ? 
ATOM   862  H  H    . ALA A 1 61  ? -2.002  0.839   8.945   1.000 11.742 0 60  ALA A H    1 c 
ATOM   863  H  HA   . ALA A 1 61  ? 0.299   1.937   9.745   1.000 11.327 0 60  ALA A HA   1 c 
ATOM   864  H  HB1  . ALA A 1 61  ? -0.430  1.285   11.876  1.000 11.042 0 60  ALA A HB1  1 c 
ATOM   865  H  HB2  . ALA A 1 61  ? -1.621  1.961   11.076  1.000 11.036 0 60  ALA A HB2  1 c 
ATOM   866  H  HB3  . ALA A 1 61  ? -1.559  0.382   11.221  1.000 11.040 0 60  ALA A HB3  1 c 
ATOM   867  N  N    . GLY A 1 62  ? 0.440   -1.189  9.245   1.000 11.361 0 61  GLY A N    1 ? 
ATOM   868  C  CA   . GLY A 1 62  ? 1.377   -2.321  9.155   1.000 11.611 0 61  GLY A CA   1 ? 
ATOM   869  C  C    . GLY A 1 62  ? 1.397   -3.156  10.421  1.000 12.513 0 61  GLY A C    1 ? 
ATOM   870  O  O    . GLY A 1 62  ? 0.405   -3.215  11.175  1.000 12.063 0 61  GLY A O    1 ? 
ATOM   871  H  H    . GLY A 1 62  ? -0.363  -1.317  8.836   1.000 11.551 0 61  GLY A H    1 c 
ATOM   872  H  HA2  . GLY A 1 62  ? 1.115   -2.893  8.391   1.000 11.759 0 61  GLY A HA2  1 c 
ATOM   873  H  HA3  . GLY A 1 62  ? 2.282   -1.969  8.974   1.000 11.765 0 61  GLY A HA3  1 c 
ATOM   874  N  N    . PRO A 1 63  ? 2.550   -3.816  10.671  1.000 12.479 0 62  PRO A N    1 ? 
ATOM   875  C  CA   . PRO A 1 63  ? 2.682   -4.775  11.755  1.000 13.521 0 62  PRO A CA   1 ? 
ATOM   876  C  C    . PRO A 1 63  ? 2.920   -4.090  13.104  1.000 14.890 0 62  PRO A C    1 ? 
ATOM   877  O  O    . PRO A 1 63  ? 3.011   -2.855  13.143  1.000 14.966 0 62  PRO A O    1 ? 
ATOM   878  C  CB   . PRO A 1 63  ? 3.883   -5.623  11.291  1.000 13.579 0 62  PRO A CB   1 ? 
ATOM   879  C  CG   . PRO A 1 63  ? 4.758   -4.657  10.504  1.000 12.699 0 62  PRO A CG   1 ? 
ATOM   880  C  CD   . PRO A 1 63  ? 3.788   -3.684  9.886   1.000 12.838 0 62  PRO A CD   1 ? 
ATOM   881  H  HA   . PRO A 1 63  ? 1.872   -5.342  11.796  1.000 13.569 0 62  PRO A HA   1 c 
ATOM   882  H  HB2  . PRO A 1 63  ? 4.370   -5.988  12.059  1.000 13.360 0 62  PRO A HB2  1 c 
ATOM   883  H  HB3  . PRO A 1 63  ? 3.588   -6.366  10.723  1.000 13.355 0 62  PRO A HB3  1 c 
ATOM   884  H  HG2  . PRO A 1 63  ? 5.386   -4.194  11.095  1.000 12.935 0 62  PRO A HG2  1 c 
ATOM   885  H  HG3  . PRO A 1 63  ? 5.265   -5.130  9.812   1.000 12.935 0 62  PRO A HG3  1 c 
ATOM   886  H  HD2  . PRO A 1 63  ? 4.133   -2.774  9.937   1.000 12.716 0 62  PRO A HD2  1 c 
ATOM   887  H  HD3  . PRO A 1 63  ? 3.628   -3.905  8.950   1.000 12.715 0 62  PRO A HD3  1 c 
ATOM   888  N  N    . HIS A 1 64  ? 3.024   -4.879  14.180  1.000 15.387 0 63  HIS A N    1 ? 
ATOM   889  C  CA   . HIS A 1 64  ? 3.370   -4.370  15.532  1.000 15.421 0 63  HIS A CA   1 ? 
ATOM   890  C  C    . HIS A 1 64  ? 4.763   -3.729  15.498  1.000 14.368 0 63  HIS A C    1 ? 
ATOM   891  O  O    . HIS A 1 64  ? 5.634   -4.139  14.701  1.000 14.331 0 63  HIS A O    1 ? 
ATOM   892  C  CB   . HIS A 1 64  ? 3.275   -5.460  16.609  1.000 15.939 0 63  HIS A CB   1 ? 
ATOM   893  C  CG   . HIS A 1 64  ? 1.895   -5.974  16.825  1.000 17.403 0 63  HIS A CG   1 ? 
ATOM   894  N  ND1  . HIS A 1 64  ? 1.537   -6.775  17.912  1.000 17.132 0 63  HIS A ND1  1 ? 
ATOM   895  C  CD2  . HIS A 1 64  ? 0.767   -5.792  16.105  1.000 17.540 0 63  HIS A CD2  1 ? 
ATOM   896  C  CE1  . HIS A 1 64  ? 0.256   -7.062  17.824  1.000 18.725 0 63  HIS A CE1  1 ? 
ATOM   897  N  NE2  . HIS A 1 64  ? -0.227  -6.488  16.714  1.000 17.309 0 63  HIS A NE2  1 ? 
ATOM   898  H  H    . HIS A 1 64  ? 2.898   -5.782  14.159  1.000 15.286 0 63  HIS A H    1 c 
ATOM   899  H  HA   . HIS A 1 64  ? 2.720   -3.664  15.757  1.000 15.299 0 63  HIS A HA   1 c 
ATOM   900  H  HB2  . HIS A 1 64  ? 3.856   -6.211  16.352  1.000 16.148 0 63  HIS A HB2  1 c 
ATOM   901  H  HB3  . HIS A 1 64  ? 3.615   -5.098  17.458  1.000 16.146 0 63  HIS A HB3  1 c 
ATOM   902  H  HD1  . HIS A 1 64  ? 2.082   -6.995  18.576  0.000 17.540 0 63  HIS A HD1  1 c 
ATOM   903  H  HD2  . HIS A 1 64  ? 0.689   -5.308  15.306  1.000 17.431 0 63  HIS A HD2  1 c 
ATOM   904  H  HE1  . HIS A 1 64  ? -0.232  -7.594  18.429  1.000 17.964 0 63  HIS A HE1  1 c 
ATOM   905  H  HE2  . HIS A 1 64  ? -1.041  -6.568  16.427  0.000 17.850 0 63  HIS A HE2  1 c 
ATOM   906  N  N    . PHE A 1 65  ? 4.935   -2.657  16.255  1.000 14.229 0 64  PHE A N    1 ? 
ATOM   907  C  CA   . PHE A 1 65  ? 6.226   -1.930  16.388  1.000 13.390 0 64  PHE A CA   1 ? 
ATOM   908  C  C    . PHE A 1 65  ? 7.198   -2.876  17.114  1.000 13.699 0 64  PHE A C    1 ? 
ATOM   909  O  O    . PHE A 1 65  ? 6.899   -3.191  18.267  1.000 12.652 0 64  PHE A O    1 ? 
ATOM   910  C  CB   . PHE A 1 65  ? 6.004   -0.583  17.074  1.000 12.890 0 64  PHE A CB   1 ? 
ATOM   911  C  CG   . PHE A 1 65  ? 7.258   0.212   17.356  1.000 12.650 0 64  PHE A CG   1 ? 
ATOM   912  C  CD1  . PHE A 1 65  ? 8.215   0.420   16.369  1.000 12.658 0 64  PHE A CD1  1 ? 
ATOM   913  C  CD2  . PHE A 1 65  ? 7.474   0.774   18.601  1.000 11.979 0 64  PHE A CD2  1 ? 
ATOM   914  C  CE1  . PHE A 1 65  ? 9.381   1.125   16.646  1.000 12.431 0 64  PHE A CE1  1 ? 
ATOM   915  C  CE2  . PHE A 1 65  ? 8.622   1.513   18.863  1.000 12.574 0 64  PHE A CE2  1 ? 
ATOM   916  C  CZ   . PHE A 1 65  ? 9.581   1.684   17.888  1.000 12.330 0 64  PHE A CZ   1 ? 
ATOM   917  H  H    . PHE A 1 65  ? 4.270   -2.286  16.755  1.000 14.059 0 64  PHE A H    1 c 
ATOM   918  H  HA   . PHE A 1 65  ? 6.581   -1.761  15.478  1.000 13.507 0 64  PHE A HA   1 c 
ATOM   919  H  HB2  . PHE A 1 65  ? 5.412   -0.044  16.508  1.000 12.948 0 64  PHE A HB2  1 c 
ATOM   920  H  HB3  . PHE A 1 65  ? 5.537   -0.743  17.921  1.000 12.947 0 64  PHE A HB3  1 c 
ATOM   921  H  HD1  . PHE A 1 65  ? 8.092   0.036   15.517  1.000 12.601 0 64  PHE A HD1  1 c 
ATOM   922  H  HD2  . PHE A 1 65  ? 6.830   0.658   19.281  1.000 12.294 0 64  PHE A HD2  1 c 
ATOM   923  H  HE1  . PHE A 1 65  ? 10.021  1.257   15.966  1.000 12.474 0 64  PHE A HE1  1 c 
ATOM   924  H  HE2  . PHE A 1 65  ? 8.757   1.879   19.722  1.000 12.388 0 64  PHE A HE2  1 c 
ATOM   925  H  HZ   . PHE A 1 65  ? 10.361  2.184   18.068  1.000 12.417 0 64  PHE A HZ   1 c 
ATOM   926  N  N    . ASN A 1 66  ? 8.241   -3.360  16.434  1.000 14.129 0 65  ASN A N    1 ? 
ATOM   927  C  CA   . ASN A 1 66  ? 9.090   -4.495  16.914  1.000 14.941 0 65  ASN A CA   1 ? 
ATOM   928  C  C    . ASN A 1 66  ? 10.553  -4.246  16.531  1.000 15.107 0 65  ASN A C    1 ? 
ATOM   929  O  O    . ASN A 1 66  ? 11.171  -5.052  15.826  1.000 14.855 0 65  ASN A O    1 ? 
ATOM   930  C  CB   . ASN A 1 66  ? 8.544   -5.845  16.419  1.000 15.409 0 65  ASN A CB   1 ? 
ATOM   931  C  CG   . ASN A 1 66  ? 9.300   -7.059  16.934  1.000 15.594 0 65  ASN A CG   1 ? 
ATOM   932  O  OD1  . ASN A 1 66  ? 9.929   -7.033  17.999  1.000 17.363 0 65  ASN A OD1  1 ? 
ATOM   933  N  ND2  . ASN A 1 66  ? 9.273   -8.139  16.176  1.000 17.303 0 65  ASN A ND2  1 ? 
ATOM   934  H  H    . ASN A 1 66  ? 8.485   -3.039  15.620  1.000 14.219 0 65  ASN A H    1 c 
ATOM   935  H  HA   . ASN A 1 66  ? 9.035   -4.510  17.896  1.000 14.886 0 65  ASN A HA   1 c 
ATOM   936  H  HB2  . ASN A 1 66  ? 7.607   -5.920  16.692  1.000 15.341 0 65  ASN A HB2  1 c 
ATOM   937  H  HB3  . ASN A 1 66  ? 8.571   -5.850  15.440  1.000 15.344 0 65  ASN A HB3  1 c 
ATOM   938  H  HD21 . ASN A 1 66  ? 9.753   -8.848  16.399  1.000 16.757 0 65  ASN A HD21 1 c 
ATOM   939  H  HD22 . ASN A 1 66  ? 8.775   -8.157  15.445  1.000 16.750 0 65  ASN A HD22 1 c 
ATOM   940  N  N    . PRO A 1 67  ? 11.185  -3.154  17.031  1.000 16.506 0 66  PRO A N    1 ? 
ATOM   941  C  CA   . PRO A 1 67  ? 12.550  -2.801  16.624  1.000 16.954 0 66  PRO A CA   1 ? 
ATOM   942  C  C    . PRO A 1 67  ? 13.619  -3.816  17.076  1.000 18.570 0 66  PRO A C    1 ? 
ATOM   943  O  O    . PRO A 1 67  ? 14.627  -3.935  16.429  1.000 20.680 0 66  PRO A O    1 ? 
ATOM   944  C  CB   . PRO A 1 67  ? 12.790  -1.443  17.297  1.000 16.126 0 66  PRO A CB   1 ? 
ATOM   945  C  CG   . PRO A 1 67  ? 11.896  -1.497  18.511  1.000 15.170 0 66  PRO A CG   1 ? 
ATOM   946  C  CD   . PRO A 1 67  ? 10.652  -2.237  18.054  1.000 16.192 0 66  PRO A CD   1 ? 
ATOM   947  H  HA   . PRO A 1 67  ? 12.583  -2.693  15.641  1.000 16.994 0 66  PRO A HA   1 c 
ATOM   948  H  HB2  . PRO A 1 67  ? 13.730  -1.336  17.556  1.000 16.088 0 66  PRO A HB2  1 c 
ATOM   949  H  HB3  . PRO A 1 67  ? 12.535  -0.704  16.704  1.000 16.082 0 66  PRO A HB3  1 c 
ATOM   950  H  HG2  . PRO A 1 67  ? 12.334  -1.976  19.243  1.000 15.640 0 66  PRO A HG2  1 c 
ATOM   951  H  HG3  . PRO A 1 67  ? 11.669  -0.595  18.815  1.000 15.630 0 66  PRO A HG3  1 c 
ATOM   952  H  HD2  . PRO A 1 67  ? 10.240  -2.724  18.791  1.000 15.989 0 66  PRO A HD2  1 c 
ATOM   953  H  HD3  . PRO A 1 67  ? 9.997   -1.624  17.671  1.000 16.010 0 66  PRO A HD3  1 c 
ATOM   954  N  N    . LEU A 1 68  ? 13.356  -4.548  18.151  1.000 19.499 0 67  LEU A N    1 ? 
ATOM   955  C  CA   . LEU A 1 68  ? 14.310  -5.520  18.759  1.000 19.817 0 67  LEU A CA   1 ? 
ATOM   956  C  C    . LEU A 1 68  ? 14.115  -6.948  18.218  1.000 21.074 0 67  LEU A C    1 ? 
ATOM   957  O  O    . LEU A 1 68  ? 14.839  -7.852  18.707  1.000 20.166 0 67  LEU A O    1 ? 
ATOM   958  C  CB   . LEU A 1 68  ? 14.166  -5.446  20.284  1.000 20.678 0 67  LEU A CB   1 ? 
ATOM   959  C  CG   . LEU A 1 68  ? 14.336  -4.050  20.898  1.000 22.174 0 67  LEU A CG   1 ? 
ATOM   960  C  CD1  . LEU A 1 68  ? 14.255  -4.099  22.419  1.000 21.599 0 67  LEU A CD1  1 ? 
ATOM   961  C  CD2  . LEU A 1 68  ? 15.655  -3.425  20.467  1.000 23.297 0 67  LEU A CD2  1 ? 
ATOM   962  H  H    . LEU A 1 68  ? 12.562  -4.496  18.595  1.000 19.336 0 67  LEU A H    1 c 
ATOM   963  H  HA   . LEU A 1 68  ? 15.221  -5.233  18.518  1.000 20.162 0 67  LEU A HA   1 c 
ATOM   964  H  HB2  . LEU A 1 68  ? 13.281  -5.785  20.526  1.000 20.813 0 67  LEU A HB2  1 c 
ATOM   965  H  HB3  . LEU A 1 68  ? 14.829  -6.043  20.685  1.000 20.812 0 67  LEU A HB3  1 c 
ATOM   966  H  HG   . LEU A 1 68  ? 13.601  -3.477  20.570  1.000 21.957 0 67  LEU A HG   1 c 
ATOM   967  H  HD11 . LEU A 1 68  ? 13.387  -4.447  22.687  1.000 21.775 0 67  LEU A HD11 1 c 
ATOM   968  H  HD12 . LEU A 1 68  ? 14.370  -3.203  22.780  1.000 21.778 0 67  LEU A HD12 1 c 
ATOM   969  H  HD13 . LEU A 1 68  ? 14.956  -4.679  22.764  1.000 21.776 0 67  LEU A HD13 1 c 
ATOM   970  H  HD21 . LEU A 1 68  ? 16.379  -4.060  20.612  1.000 22.943 0 67  LEU A HD21 1 c 
ATOM   971  H  HD22 . LEU A 1 68  ? 15.820  -2.621  20.992  1.000 22.940 0 67  LEU A HD22 1 c 
ATOM   972  H  HD23 . LEU A 1 68  ? 15.613  -3.191  19.523  1.000 22.932 0 67  LEU A HD23 1 c 
ATOM   973  N  N    . SER A 1 69  ? 13.219  -7.175  17.246  1.000 22.617 0 68  SER A N    1 ? 
ATOM   974  C  CA   . SER A 1 69  ? 13.036  -8.484  16.547  1.000 24.652 0 68  SER A CA   1 ? 
ATOM   975  C  C    . SER A 1 69  ? 12.665  -9.614  17.528  1.000 25.075 0 68  SER A C    1 ? 
ATOM   976  O  O    . SER A 1 69  ? 13.310  -10.692 17.453  1.000 24.260 0 68  SER A O    1 ? 
ATOM   977  C  CB   . SER A 1 69  ? 14.280  -8.852  15.764  1.000 25.100 0 68  SER A CB   1 ? 
ATOM   978  O  OG   . SER A 1 69  ? 14.544  -7.887  14.756  1.000 27.189 0 68  SER A OG   1 ? 
ATOM   979  H  H    . SER A 1 69  ? 12.643  -6.537  16.936  1.000 22.683 0 68  SER A H    1 c 
ATOM   980  H  HA   . SER A 1 69  ? 12.288  -8.382  15.908  1.000 24.413 0 68  SER A HA   1 c 
ATOM   981  H  HB2  . SER A 1 69  ? 15.054  -8.911  16.378  1.000 25.446 0 68  SER A HB2  1 c 
ATOM   982  H  HB3  . SER A 1 69  ? 14.153  -9.738  15.342  1.000 25.461 0 68  SER A HB3  1 c 
ATOM   983  H  HG   . SER A 1 69  ? 15.262  -8.123  14.351  0.000 26.900 0 68  SER A HG   1 c 
ATOM   984  N  N    . ARG A 1 70  ? 11.693  -9.379  18.419  1.000 23.951 0 69  ARG A N    1 ? 
ATOM   985  C  CA   . ARG A 1 70  ? 11.189  -10.354 19.423  1.000 24.075 0 69  ARG A CA   1 ? 
ATOM   986  C  C    . ARG A 1 70  ? 9.851   -10.961 18.967  1.000 22.452 0 69  ARG A C    1 ? 
ATOM   987  O  O    . ARG A 1 70  ? 9.243   -10.452 18.012  1.000 20.461 0 69  ARG A O    1 ? 
ATOM   988  C  CB   . ARG A 1 70  ? 10.995  -9.666  20.772  1.000 25.776 0 69  ARG A CB   1 ? 
ATOM   989  C  CG   . ARG A 1 70  ? 12.203  -8.865  21.232  1.000 31.245 0 69  ARG A CG   1 ? 
ATOM   990  C  CD   . ARG A 1 70  ? 13.417  -9.750  21.428  1.000 33.923 0 69  ARG A CD   1 ? 
ATOM   991  N  NE   . ARG A 1 70  ? 13.213  -10.698 22.516  1.000 37.710 0 69  ARG A NE   1 ? 
ATOM   992  C  CZ   . ARG A 1 70  ? 13.336  -10.419 23.820  1.000 41.985 0 69  ARG A CZ   1 ? 
ATOM   993  N  NH1  . ARG A 1 70  ? 13.671  -9.204  24.225  1.000 41.708 0 69  ARG A NH1  1 ? 
ATOM   994  N  NH2  . ARG A 1 70  ? 13.124  -11.366 24.720  1.000 42.136 0 69  ARG A NH2  1 ? 
ATOM   995  H  H    . ARG A 1 70  ? 11.267  -8.572  18.463  1.000 24.221 0 69  ARG A H    1 c 
ATOM   996  H  HA   . ARG A 1 70  ? 11.851  -11.081 19.521  1.000 24.080 0 69  ARG A HA   1 c 
ATOM   997  H  HB2  . ARG A 1 70  ? 10.215  -9.061  20.708  1.000 26.503 0 69  ARG A HB2  1 c 
ATOM   998  H  HB3  . ARG A 1 70  ? 10.789  -10.356 21.451  1.000 26.551 0 69  ARG A HB3  1 c 
ATOM   999  H  HG2  . ARG A 1 70  ? 12.413  -8.169  20.561  1.000 30.427 0 69  ARG A HG2  1 c 
ATOM   1000 H  HG3  . ARG A 1 70  ? 11.991  -8.413  22.086  1.000 30.457 0 69  ARG A HG3  1 c 
ATOM   1001 H  HD2  . ARG A 1 70  ? 13.603  -10.246 20.593  1.000 34.063 0 69  ARG A HD2  1 c 
ATOM   1002 H  HD3  . ARG A 1 70  ? 14.205  -9.186  21.626  1.000 34.133 0 69  ARG A HD3  1 c 
ATOM   1003 H  HE   . ARG A 1 70  ? 12.987  -11.539 22.294  1.000 37.940 0 69  ARG A HE   1 c 
ATOM   1004 H  HH11 . ARG A 1 70  ? 13.815  -8.549  23.627  1.000 41.514 0 69  ARG A HH11 1 c 
ATOM   1005 H  HH12 . ARG A 1 70  ? 13.748  -9.033  25.104  1.000 41.563 0 69  ARG A HH12 1 c 
ATOM   1006 H  HH21 . ARG A 1 70  ? 12.902  -12.196 24.456  1.000 41.804 0 69  ARG A HH21 1 c 
ATOM   1007 H  HH22 . ARG A 1 70  ? 13.209  -11.180 25.595  1.000 41.830 0 69  ARG A HH22 1 c 
ATOM   1008 N  N    . LYS A 1 71  ? 9.391   -11.998 19.669  1.000 22.286 0 70  LYS A N    1 ? 
ATOM   1009 C  CA   . LYS A 1 71  ? 8.038   -12.598 19.498  1.000 22.560 0 70  LYS A CA   1 ? 
ATOM   1010 C  C    . LYS A 1 71  ? 7.001   -11.701 20.203  1.000 19.522 0 70  LYS A C    1 ? 
ATOM   1011 O  O    . LYS A 1 71  ? 7.402   -10.898 21.066  1.000 18.240 0 70  LYS A O    1 ? 
ATOM   1012 C  CB   . LYS A 1 71  ? 8.040   -14.041 20.018  1.000 25.696 0 70  LYS A CB   1 ? 
ATOM   1013 C  CG   . LYS A 1 71  ? 8.663   -15.075 19.089  1.000 29.255 0 70  LYS A CG   1 ? 
ATOM   1014 C  CD   . LYS A 1 71  ? 8.464   -16.513 19.561  1.000 34.003 0 70  LYS A CD   1 ? 
ATOM   1015 C  CE   . LYS A 1 71  ? 9.032   -17.539 18.594  1.000 38.377 0 70  LYS A CE   1 ? 
ATOM   1016 N  NZ   . LYS A 1 71  ? 8.932   -18.921 19.125  1.000 41.213 0 70  LYS A NZ   1 ? 
ATOM   1017 H  H    . LYS A 1 71  ? 9.891   -12.405 20.312  1.000 22.410 0 70  LYS A H    1 c 
ATOM   1018 H  HA   . LYS A 1 71  ? 7.830   -12.614 18.535  1.000 22.441 0 70  LYS A HA   1 c 
ATOM   1019 H  HB2  . LYS A 1 71  ? 8.520   -14.061 20.872  1.000 25.681 0 70  LYS A HB2  1 c 
ATOM   1020 H  HB3  . LYS A 1 71  ? 7.112   -14.305 20.195  1.000 25.677 0 70  LYS A HB3  1 c 
ATOM   1021 H  HG2  . LYS A 1 71  ? 8.269   -14.975 18.196  1.000 29.398 0 70  LYS A HG2  1 c 
ATOM   1022 H  HG3  . LYS A 1 71  ? 9.624   -14.893 19.015  1.000 29.398 0 70  LYS A HG3  1 c 
ATOM   1023 H  HD2  . LYS A 1 71  ? 8.897   -16.626 20.434  1.000 33.767 0 70  LYS A HD2  1 c 
ATOM   1024 H  HD3  . LYS A 1 71  ? 7.505   -16.682 19.676  1.000 33.767 0 70  LYS A HD3  1 c 
ATOM   1025 H  HE2  . LYS A 1 71  ? 8.549   -17.491 17.747  1.000 37.929 0 70  LYS A HE2  1 c 
ATOM   1026 H  HE3  . LYS A 1 71  ? 9.970   -17.336 18.417  1.000 37.929 0 70  LYS A HE3  1 c 
ATOM   1027 H  HZ1  . LYS A 1 71  ? 9.401   -18.987 19.899  1.000 40.319 0 70  LYS A HZ1  1 c 
ATOM   1028 H  HZ2  . LYS A 1 71  ? 9.271   -19.507 18.521  1.000 40.319 0 70  LYS A HZ2  1 c 
ATOM   1029 H  HZ3  . LYS A 1 71  ? 8.064   -19.127 19.285  1.000 40.319 0 70  LYS A HZ3  1 c 
ATOM   1030 N  N    . HIS A 1 72  ? 5.737   -11.762 19.770  1.000 17.517 0 71  HIS A N    1 ? 
ATOM   1031 C  CA   . HIS A 1 72  ? 4.571   -11.072 20.384  1.000 17.114 0 71  HIS A CA   1 ? 
ATOM   1032 C  C    . HIS A 1 72  ? 4.353   -11.619 21.805  1.000 16.940 0 71  HIS A C    1 ? 
ATOM   1033 O  O    . HIS A 1 72  ? 4.369   -12.869 21.987  1.000 17.495 0 71  HIS A O    1 ? 
ATOM   1034 C  CB   . HIS A 1 72  ? 3.297   -11.253 19.524  1.000 17.135 0 71  HIS A CB   1 ? 
ATOM   1035 C  CG   . HIS A 1 72  ? 2.059   -10.714 20.154  1.000 16.334 0 71  HIS A CG   1 ? 
ATOM   1036 N  ND1  . HIS A 1 72  ? 1.724   -9.358  20.115  1.000 16.016 0 71  HIS A ND1  1 ? 
ATOM   1037 C  CD2  . HIS A 1 72  ? 1.077   -11.316 20.854  1.000 15.429 0 71  HIS A CD2  1 ? 
ATOM   1038 C  CE1  . HIS A 1 72  ? 0.618   -9.167  20.783  1.000 14.594 0 71  HIS A CE1  1 ? 
ATOM   1039 N  NE2  . HIS A 1 72  ? 0.190   -10.334 21.204  1.000 15.432 0 71  HIS A NE2  1 ? 
ATOM   1040 H  H    . HIS A 1 72  ? 5.498   -12.251 19.039  1.000 17.867 0 71  HIS A H    1 c 
ATOM   1041 H  HA   . HIS A 1 72  ? 4.781   -10.111 20.447  1.000 17.151 0 71  HIS A HA   1 c 
ATOM   1042 H  HB2  . HIS A 1 72  ? 3.429   -10.813 18.658  1.000 16.942 0 71  HIS A HB2  1 c 
ATOM   1043 H  HB3  . HIS A 1 72  ? 3.168   -12.212 19.354  1.000 16.957 0 71  HIS A HB3  1 c 
ATOM   1044 H  HD1  . HIS A 1 72  ? 2.204   -8.706  19.746  0.000 16.840 0 71  HIS A HD1  1 c 
ATOM   1045 H  HD2  . HIS A 1 72  ? 1.003   -12.231 21.053  1.000 15.657 0 71  HIS A HD2  1 c 
ATOM   1046 H  HE1  . HIS A 1 72  ? 0.172   -8.343  20.886  1.000 15.163 0 71  HIS A HE1  1 c 
ATOM   1047 H  HE2  . HIS A 1 72  ? -0.541  -10.432 21.690  0.000 16.140 0 71  HIS A HE2  1 c 
ATOM   1048 N  N    . GLY A 1 73  ? 4.071   -10.734 22.757  1.000 16.996 0 72  GLY A N    1 ? 
ATOM   1049 C  CA   . GLY A 1 73  ? 3.750   -11.124 24.137  1.000 16.018 0 72  GLY A CA   1 ? 
ATOM   1050 C  C    . GLY A 1 73  ? 2.739   -10.188 24.747  1.000 16.402 0 72  GLY A C    1 ? 
ATOM   1051 O  O    . GLY A 1 73  ? 2.181   -9.334  24.009  1.000 16.517 0 72  GLY A O    1 ? 
ATOM   1052 H  H    . GLY A 1 73  ? 4.063   -9.836  22.604  1.000 16.750 0 72  GLY A H    1 c 
ATOM   1053 H  HA2  . GLY A 1 73  ? 3.388   -12.046 24.141  1.000 16.337 0 72  GLY A HA2  1 c 
ATOM   1054 H  HA3  . GLY A 1 73  ? 4.577   -11.113 24.678  1.000 16.332 0 72  GLY A HA3  1 c 
ATOM   1055 N  N    . GLY A 1 74  ? 2.490   -10.321 26.058  1.000 16.022 0 73  GLY A N    1 ? 
ATOM   1056 C  CA   . GLY A 1 74  ? 1.746   -9.310  26.820  1.000 16.164 0 73  GLY A CA   1 ? 
ATOM   1057 C  C    . GLY A 1 74  ? 2.688   -8.272  27.422  1.000 18.081 0 73  GLY A C    1 ? 
ATOM   1058 O  O    . GLY A 1 74  ? 3.885   -8.503  27.493  1.000 19.929 0 73  GLY A O    1 ? 
ATOM   1059 H  H    . GLY A 1 74  ? 2.765   -11.043 26.540  1.000 16.159 0 73  GLY A H    1 c 
ATOM   1060 H  HA2  . GLY A 1 74  ? 1.097   -8.863  26.222  1.000 16.578 0 73  GLY A HA2  1 c 
ATOM   1061 H  HA3  . GLY A 1 74  ? 1.242   -9.759  27.544  1.000 16.579 0 73  GLY A HA3  1 c 
ATOM   1062 N  N    . PRO A 1 75  ? 2.179   -7.116  27.896  1.000 22.500 0 74  PRO A N    1 ? 
ATOM   1063 C  CA   . PRO A 1 75  ? 3.039   -6.038  28.400  1.000 23.175 0 74  PRO A CA   1 ? 
ATOM   1064 C  C    . PRO A 1 75  ? 3.935   -6.474  29.577  1.000 27.205 0 74  PRO A C    1 ? 
ATOM   1065 O  O    . PRO A 1 75  ? 4.986   -5.884  29.754  1.000 27.988 0 74  PRO A O    1 ? 
ATOM   1066 C  CB   . PRO A 1 75  ? 2.054   -4.943  28.841  1.000 22.551 0 74  PRO A CB   1 ? 
ATOM   1067 C  CG   . PRO A 1 75  ? 0.717   -5.665  28.996  1.000 22.224 0 74  PRO A CG   1 ? 
ATOM   1068 C  CD   . PRO A 1 75  ? 0.743   -6.803  28.000  1.000 23.189 0 74  PRO A CD   1 ? 
ATOM   1069 H  HA   . PRO A 1 75  ? 3.599   -5.695  27.659  1.000 23.636 0 74  PRO A HA   1 c 
ATOM   1070 H  HB2  . PRO A 1 75  ? 2.333   -4.540  29.691  1.000 22.627 0 74  PRO A HB2  1 c 
ATOM   1071 H  HB3  . PRO A 1 75  ? 1.991   -4.236  28.163  1.000 22.620 0 74  PRO A HB3  1 c 
ATOM   1072 H  HG2  . PRO A 1 75  ? 0.615   -6.008  29.907  1.000 22.525 0 74  PRO A HG2  1 c 
ATOM   1073 H  HG3  . PRO A 1 75  ? -0.027  -5.058  28.805  1.000 22.525 0 74  PRO A HG3  1 c 
ATOM   1074 H  HD2  . PRO A 1 75  ? 0.236   -7.569  28.326  1.000 22.783 0 74  PRO A HD2  1 c 
ATOM   1075 H  HD3  . PRO A 1 75  ? 0.382   -6.525  27.138  1.000 22.780 0 74  PRO A HD3  1 c 
ATOM   1076 N  N    . LYS A 1 76  ? 3.508   -7.489  30.339  1.000 25.959 0 75  LYS A N    1 ? 
ATOM   1077 C  CA   . LYS A 1 76  ? 4.202   -7.959  31.569  1.000 28.241 0 75  LYS A CA   1 ? 
ATOM   1078 C  C    . LYS A 1 76  ? 5.305   -8.973  31.243  1.000 26.605 0 75  LYS A C    1 ? 
ATOM   1079 O  O    . LYS A 1 76  ? 6.052   -9.312  32.172  1.000 26.529 0 75  LYS A O    1 ? 
ATOM   1080 C  CB   . LYS A 1 76  ? 3.186   -8.541  32.554  1.000 31.129 0 75  LYS A CB   1 ? 
ATOM   1081 C  CG   . LYS A 1 76  ? 2.435   -7.509  33.378  1.000 33.312 0 75  LYS A CG   1 ? 
ATOM   1082 C  CD   . LYS A 1 76  ? 1.574   -8.137  34.457  1.000 35.444 0 75  LYS A CD   1 ? 
ATOM   1083 C  CE   . LYS A 1 76  ? 0.440   -8.978  33.907  1.000 36.535 0 75  LYS A CE   1 ? 
ATOM   1084 N  NZ   . LYS A 1 76  ? -0.373  -9.582  34.993  1.000 38.767 0 75  LYS A NZ   1 ? 
ATOM   1085 H  H    . LYS A 1 76  ? 2.747   -7.952  30.154  1.000 26.761 0 75  LYS A H    1 c 
ATOM   1086 H  HA   . LYS A 1 76  ? 4.625   -7.176  31.992  1.000 28.001 0 75  LYS A HA   1 c 
ATOM   1087 H  HB2  . LYS A 1 76  ? 2.537   -9.074  32.051  1.000 30.907 0 75  LYS A HB2  1 c 
ATOM   1088 H  HB3  . LYS A 1 76  ? 3.656   -9.144  33.167  1.000 30.894 0 75  LYS A HB3  1 c 
ATOM   1089 H  HG2  . LYS A 1 76  ? 3.083   -6.902  33.796  1.000 33.253 0 75  LYS A HG2  1 c 
ATOM   1090 H  HG3  . LYS A 1 76  ? 1.865   -6.978  32.781  1.000 33.264 0 75  LYS A HG3  1 c 
ATOM   1091 H  HD2  . LYS A 1 76  ? 2.139   -8.702  35.026  1.000 35.179 0 75  LYS A HD2  1 c 
ATOM   1092 H  HD3  . LYS A 1 76  ? 1.197   -7.426  35.018  1.000 35.179 0 75  LYS A HD3  1 c 
ATOM   1093 H  HE2  . LYS A 1 76  ? -0.138  -8.423  33.350  1.000 36.777 0 75  LYS A HE2  1 c 
ATOM   1094 H  HE3  . LYS A 1 76  ? 0.801   -9.693  33.350  1.000 36.755 0 75  LYS A HE3  1 c 
ATOM   1095 H  HZ1  . LYS A 1 76  ? 0.149   -10.118 35.505  1.000 38.061 0 75  LYS A HZ1  1 c 
ATOM   1096 H  HZ2  . LYS A 1 76  ? -1.045  -10.075 34.636  1.000 38.061 0 75  LYS A HZ2  1 c 
ATOM   1097 H  HZ3  . LYS A 1 76  ? -0.727  -8.928  35.512  1.000 38.061 0 75  LYS A HZ3  1 c 
ATOM   1098 N  N    . ASP A 1 77  ? 5.431   -9.419  29.989  1.000 24.149 0 76  ASP A N    1 ? 
ATOM   1099 C  CA   . ASP A 1 77  ? 6.408   -10.458 29.563  1.000 25.718 0 76  ASP A CA   1 ? 
ATOM   1100 C  C    . ASP A 1 77  ? 7.721   -9.799  29.121  1.000 25.684 0 76  ASP A C    1 ? 
ATOM   1101 O  O    . ASP A 1 77  ? 7.652   -8.680  28.543  1.000 22.886 0 76  ASP A O    1 ? 
ATOM   1102 C  CB   . ASP A 1 77  ? 5.873   -11.297 28.398  1.000 25.131 0 76  ASP A CB   1 ? 
ATOM   1103 C  CG   . ASP A 1 77  ? 4.514   -11.923 28.646  1.000 25.861 0 76  ASP A CG   1 ? 
ATOM   1104 O  OD1  . ASP A 1 77  ? 4.079   -11.976 29.824  1.000 25.555 0 76  ASP A OD1  1 ? 
ATOM   1105 O  OD2  . ASP A 1 77  ? 3.884   -12.322 27.654  1.000 23.937 0 76  ASP A OD2  1 ? 
ATOM   1106 H  H    . ASP A 1 77  ? 4.916   -9.109  29.306  1.000 25.082 0 76  ASP A H    1 c 
ATOM   1107 H  HA   . ASP A 1 77  ? 6.589   -11.055 30.327  1.000 25.296 0 76  ASP A HA   1 c 
ATOM   1108 H  HB2  . ASP A 1 77  ? 5.806   -10.729 27.603  1.000 25.439 0 76  ASP A HB2  1 c 
ATOM   1109 H  HB3  . ASP A 1 77  ? 6.510   -12.015 28.207  1.000 25.438 0 76  ASP A HB3  1 c 
ATOM   1110 N  N    . GLU A 1 78  ? 8.862   -10.471 29.353  1.000 23.888 0 77  GLU A N    1 ? 
ATOM   1111 C  CA   . GLU A 1 78  ? 10.170  -10.030 28.807  1.000 24.361 0 77  GLU A CA   1 ? 
ATOM   1112 C  C    . GLU A 1 78  ? 10.093  -10.232 27.284  1.000 23.281 0 77  GLU A C    1 ? 
ATOM   1113 O  O    . GLU A 1 78  ? 10.463  -9.294  26.534  1.000 23.659 0 77  GLU A O    1 ? 
ATOM   1114 C  CB   . GLU A 1 78  ? 11.350  -10.763 29.466  1.000 24.957 0 77  GLU A CB   1 ? 
ATOM   1115 C  CG   . GLU A 1 78  ? 12.714  -10.113 29.206  1.000 27.095 0 77  GLU A CG   1 ? 
ATOM   1116 C  CD   . GLU A 1 78  ? 13.916  -10.705 29.939  1.000 30.172 0 77  GLU A CD   1 ? 
ATOM   1117 O  OE1  . GLU A 1 78  ? 13.889  -11.915 30.251  1.000 29.804 0 77  GLU A OE1  1 ? 
ATOM   1118 O  OE2  . GLU A 1 78  ? 14.900  -9.950  30.195  1.000 35.703 0 77  GLU A OE2  1 ? 
ATOM   1119 H  H    . GLU A 1 78  ? 8.899   -11.231 29.853  1.000 24.414 0 77  GLU A H    1 c 
ATOM   1120 H  HA   . GLU A 1 78  ? 10.265  -9.066  28.987  1.000 24.170 0 77  GLU A HA   1 c 
ATOM   1121 H  HB2  . GLU A 1 78  ? 11.194  -10.796 30.434  1.000 25.301 0 77  GLU A HB2  1 c 
ATOM   1122 H  HB3  . GLU A 1 78  ? 11.370  -11.684 29.134  1.000 25.301 0 77  GLU A HB3  1 c 
ATOM   1123 H  HG2  . GLU A 1 78  ? 12.897  -10.153 28.244  1.000 27.259 0 77  GLU A HG2  1 c 
ATOM   1124 H  HG3  . GLU A 1 78  ? 12.653  -9.165  29.448  1.000 27.259 0 77  GLU A HG3  1 c 
ATOM   1125 N  N    . GLU A 1 79  ? 9.505   -11.343 26.830  1.000 22.383 0 78  GLU A N    1 ? 
ATOM   1126 C  CA   . GLU A 1 79  ? 9.420   -11.654 25.375  1.000 21.741 0 78  GLU A CA   1 ? 
ATOM   1127 C  C    . GLU A 1 79  ? 8.168   -10.965 24.825  1.000 17.908 0 78  GLU A C    1 ? 
ATOM   1128 O  O    . GLU A 1 79  ? 7.072   -11.525 24.954  1.000 15.055 0 78  GLU A O    1 ? 
ATOM   1129 C  CB   . GLU A 1 79  ? 9.429   -13.166 25.120  1.000 23.896 0 78  GLU A CB   1 ? 
ATOM   1130 C  CG   . GLU A 1 79  ? 9.569   -13.543 23.650  1.000 26.092 0 78  GLU A CG   1 ? 
ATOM   1131 C  CD   . GLU A 1 79  ? 10.938  -13.318 23.034  1.000 29.428 0 78  GLU A CD   1 ? 
ATOM   1132 O  OE1  . GLU A 1 79  ? 11.925  -13.399 23.791  1.000 33.492 0 78  GLU A OE1  1 ? 
ATOM   1133 O  OE2  . GLU A 1 79  ? 11.026  -13.050 21.799  1.000 27.452 0 78  GLU A OE2  1 ? 
ATOM   1134 H  H    . GLU A 1 79  ? 9.133   -11.972 27.374  1.000 22.444 0 78  GLU A H    1 c 
ATOM   1135 H  HA   . GLU A 1 79  ? 10.209  -11.263 24.933  1.000 21.436 0 78  GLU A HA   1 c 
ATOM   1136 H  HB2  . GLU A 1 79  ? 10.170  -13.563 25.623  1.000 23.871 0 78  GLU A HB2  1 c 
ATOM   1137 H  HB3  . GLU A 1 79  ? 8.595   -13.546 25.466  1.000 23.839 0 78  GLU A HB3  1 c 
ATOM   1138 H  HG2  . GLU A 1 79  ? 9.342   -14.491 23.548  1.000 26.288 0 78  GLU A HG2  1 c 
ATOM   1139 H  HG3  . GLU A 1 79  ? 8.914   -13.030 23.130  1.000 26.274 0 78  GLU A HG3  1 c 
ATOM   1140 N  N    . ARG A 1 80  ? 8.339   -9.753  24.295  1.000 15.405 0 79  ARG A N    1 ? 
ATOM   1141 C  CA   . ARG A 1 80  ? 7.248   -8.919  23.712  1.000 14.853 0 79  ARG A CA   1 ? 
ATOM   1142 C  C    . ARG A 1 80  ? 7.813   -8.017  22.604  1.000 14.698 0 79  ARG A C    1 ? 
ATOM   1143 O  O    . ARG A 1 80  ? 9.055   -7.775  22.570  1.000 14.892 0 79  ARG A O    1 ? 
ATOM   1144 C  CB   . ARG A 1 80  ? 6.568   -8.072  24.802  1.000 13.680 0 79  ARG A CB   1 ? 
ATOM   1145 C  CG   . ARG A 1 80  ? 7.491   -7.103  25.544  1.000 14.217 0 79  ARG A CG   1 ? 
ATOM   1146 C  CD   . ARG A 1 80  ? 6.737   -6.132  26.453  1.000 13.751 0 79  ARG A CD   1 ? 
ATOM   1147 N  NE   . ARG A 1 80  ? 6.292   -4.907  25.753  1.000 13.969 0 79  ARG A NE   1 ? 
ATOM   1148 C  CZ   . ARG A 1 80  ? 5.782   -3.822  26.320  1.000 15.860 0 79  ARG A CZ   1 ? 
ATOM   1149 N  NH1  . ARG A 1 80  ? 5.577   -3.778  27.632  1.000 14.463 0 79  ARG A NH1  1 ? 
ATOM   1150 N  NH2  . ARG A 1 80  ? 5.472   -2.775  25.561  1.000 16.315 0 79  ARG A NH2  1 ? 
ATOM   1151 H  H    . ARG A 1 80  ? 9.159   -9.351  24.261  1.000 15.850 0 79  ARG A H    1 c 
ATOM   1152 H  HA   . ARG A 1 80  ? 6.574   -9.523  23.313  1.000 14.702 0 79  ARG A HA   1 c 
ATOM   1153 H  HB2  . ARG A 1 80  ? 5.838   -7.553  24.384  1.000 14.077 0 79  ARG A HB2  1 c 
ATOM   1154 H  HB3  . ARG A 1 80  ? 6.160   -8.686  25.462  1.000 14.077 0 79  ARG A HB3  1 c 
ATOM   1155 H  HG2  . ARG A 1 80  ? 8.130   -7.622  26.093  1.000 13.994 0 79  ARG A HG2  1 c 
ATOM   1156 H  HG3  . ARG A 1 80  ? 8.014   -6.582  24.886  1.000 13.985 0 79  ARG A HG3  1 c 
ATOM   1157 H  HD2  . ARG A 1 80  ? 5.946   -6.592  26.830  1.000 13.912 0 79  ARG A HD2  1 c 
ATOM   1158 H  HD3  . ARG A 1 80  ? 7.324   -5.878  27.207  1.000 13.915 0 79  ARG A HD3  1 c 
ATOM   1159 H  HE   . ARG A 1 80  ? 6.426   -4.876  24.865  1.000 14.403 0 79  ARG A HE   1 c 
ATOM   1160 H  HH11 . ARG A 1 80  ? 5.796   -4.481  28.148  1.000 14.890 0 79  ARG A HH11 1 c 
ATOM   1161 H  HH12 . ARG A 1 80  ? 5.221   -3.042  28.005  1.000 14.899 0 79  ARG A HH12 1 c 
ATOM   1162 H  HH21 . ARG A 1 80  ? 5.600   -2.811  24.672  1.000 16.023 0 79  ARG A HH21 1 c 
ATOM   1163 H  HH22 . ARG A 1 80  ? 5.104   -2.044  25.934  1.000 16.026 0 79  ARG A HH22 1 c 
ATOM   1164 N  N    . HIS A 1 81  ? 6.925   -7.489  21.751  1.000 15.834 0 80  HIS A N    1 ? 
ATOM   1165 C  CA   . HIS A 1 81  ? 7.172   -6.267  20.937  1.000 14.944 0 80  HIS A CA   1 ? 
ATOM   1166 C  C    . HIS A 1 81  ? 7.152   -4.998  21.830  1.000 14.447 0 80  HIS A C    1 ? 
ATOM   1167 O  O    . HIS A 1 81  ? 6.439   -4.965  22.879  1.000 12.293 0 80  HIS A O    1 ? 
ATOM   1168 C  CB   . HIS A 1 81  ? 6.157   -6.188  19.791  1.000 15.148 0 80  HIS A CB   1 ? 
ATOM   1169 C  CG   . HIS A 1 81  ? 6.038   -7.421  18.954  1.000 15.671 0 80  HIS A CG   1 ? 
ATOM   1170 N  ND1  . HIS A 1 81  ? 4.801   -7.911  18.486  1.000 15.897 0 80  HIS A ND1  1 ? 
ATOM   1171 C  CD2  . HIS A 1 81  ? 6.967   -8.283  18.495  1.000 14.546 0 80  HIS A CD2  1 ? 
ATOM   1172 C  CE1  . HIS A 1 81  ? 5.017   -8.984  17.760  1.000 14.467 0 80  HIS A CE1  1 ? 
ATOM   1173 N  NE2  . HIS A 1 81  ? 6.310   -9.235  17.750  1.000 15.378 0 80  HIS A NE2  1 ? 
ATOM   1174 H  H    . HIS A 1 81  ? 6.092   -7.834  21.623  1.000 15.347 0 80  HIS A H    1 c 
ATOM   1175 H  HA   . HIS A 1 81  ? 8.073   -6.346  20.544  1.000 15.049 0 80  HIS A HA   1 c 
ATOM   1176 H  HB2  . HIS A 1 81  ? 5.274   -5.980  20.168  1.000 15.212 0 80  HIS A HB2  1 c 
ATOM   1177 H  HB3  . HIS A 1 81  ? 6.408   -5.441  19.205  1.000 15.212 0 80  HIS A HB3  1 c 
ATOM   1178 H  HD1  . HIS A 1 81  ? 4.012   -7.529  18.620  0.000 15.450 0 80  HIS A HD1  1 c 
ATOM   1179 H  HD2  . HIS A 1 81  ? 7.891   -8.239  18.643  1.000 15.019 0 80  HIS A HD2  1 c 
ATOM   1180 H  HE1  . HIS A 1 81  ? 4.356   -9.496  17.332  1.000 15.033 0 80  HIS A HE1  1 c 
ATOM   1181 H  HE2  . HIS A 1 81  ? 6.680   -9.903  17.335  0.000 14.750 0 80  HIS A HE2  1 c 
ATOM   1182 N  N    . VAL A 1 82  ? 7.884   -3.956  21.426  1.000 14.125 0 81  VAL A N    1 ? 
ATOM   1183 C  CA   . VAL A 1 82  ? 7.853   -2.637  22.123  1.000 14.152 0 81  VAL A CA   1 ? 
ATOM   1184 C  C    . VAL A 1 82  ? 6.384   -2.181  22.105  1.000 14.287 0 81  VAL A C    1 ? 
ATOM   1185 O  O    . VAL A 1 82  ? 5.916   -1.767  23.159  1.000 14.325 0 81  VAL A O    1 ? 
ATOM   1186 C  CB   . VAL A 1 82  ? 8.856   -1.609  21.544  1.000 14.481 0 81  VAL A CB   1 ? 
ATOM   1187 C  CG1  . VAL A 1 82  ? 8.639   -0.218  22.093  1.000 14.260 0 81  VAL A CG1  1 ? 
ATOM   1188 C  CG2  . VAL A 1 82  ? 10.319  -2.037  21.744  1.000 14.926 0 81  VAL A CG2  1 ? 
ATOM   1189 H  H    . VAL A 1 82  ? 8.440   -3.985  20.705  1.000 14.211 0 81  VAL A H    1 c 
ATOM   1190 H  HA   . VAL A 1 82  ? 8.099   -2.795  23.050  1.000 14.234 0 81  VAL A HA   1 c 
ATOM   1191 H  HB   . VAL A 1 82  ? 8.694   -1.568  20.569  1.000 14.459 0 81  VAL A HB   1 c 
ATOM   1192 H  HG11 . VAL A 1 82  ? 7.798   0.139   21.755  1.000 14.329 0 81  VAL A HG11 1 c 
ATOM   1193 H  HG12 . VAL A 1 82  ? 9.370   0.360   21.812  1.000 14.330 0 81  VAL A HG12 1 c 
ATOM   1194 H  HG13 . VAL A 1 82  ? 8.609   -0.252  23.065  1.000 14.329 0 81  VAL A HG13 1 c 
ATOM   1195 H  HG21 . VAL A 1 82  ? 10.520  -2.073  22.696  1.000 14.784 0 81  VAL A HG21 1 c 
ATOM   1196 H  HG22 . VAL A 1 82  ? 10.908  -1.394  21.313  1.000 14.783 0 81  VAL A HG22 1 c 
ATOM   1197 H  HG23 . VAL A 1 82  ? 10.458  -2.916  21.353  1.000 14.770 0 81  VAL A HG23 1 c 
ATOM   1198 N  N    . GLY A 1 83  ? 5.642   -2.417  21.007  1.000 14.371 0 82  GLY A N    1 ? 
ATOM   1199 C  CA   . GLY A 1 83  ? 4.227   -1.979  20.877  1.000 15.250 0 82  GLY A CA   1 ? 
ATOM   1200 C  C    . GLY A 1 83  ? 3.150   -2.858  21.552  1.000 14.999 0 82  GLY A C    1 ? 
ATOM   1201 O  O    . GLY A 1 83  ? 1.951   -2.492  21.429  1.000 14.974 0 82  GLY A O    1 ? 
ATOM   1202 H  H    . GLY A 1 83  ? 5.971   -2.850  20.276  1.000 14.552 0 82  GLY A H    1 c 
ATOM   1203 H  HA2  . GLY A 1 83  ? 4.156   -1.062  21.246  1.000 14.978 0 82  GLY A HA2  1 c 
ATOM   1204 H  HA3  . GLY A 1 83  ? 4.015   -1.914  19.912  1.000 14.980 0 82  GLY A HA3  1 c 
ATOM   1205 N  N    . ASP A 1 84  ? 3.495   -3.929  22.291  1.000 14.394 0 83  ASP A N    1 ? 
ATOM   1206 C  CA   . ASP A 1 84  ? 2.533   -4.856  22.957  1.000 14.617 0 83  ASP A CA   1 ? 
ATOM   1207 C  C    . ASP A 1 84  ? 2.026   -4.253  24.294  1.000 15.319 0 83  ASP A C    1 ? 
ATOM   1208 O  O    . ASP A 1 84  ? 2.649   -4.515  25.358  1.000 17.044 0 83  ASP A O    1 ? 
ATOM   1209 C  CB   . ASP A 1 84  ? 3.133   -6.284  23.101  1.000 13.976 0 83  ASP A CB   1 ? 
ATOM   1210 C  CG   . ASP A 1 84  ? 3.277   -7.002  21.760  1.000 14.156 0 83  ASP A CG   1 ? 
ATOM   1211 O  OD1  . ASP A 1 84  ? 2.570   -6.615  20.845  1.000 13.119 0 83  ASP A OD1  1 ? 
ATOM   1212 O  OD2  . ASP A 1 84  ? 4.107   -7.891  21.629  1.000 12.998 0 83  ASP A OD2  1 ? 
ATOM   1213 H  H    . ASP A 1 84  ? 4.365   -4.158  22.432  1.000 14.584 0 83  ASP A H    1 c 
ATOM   1214 H  HA   . ASP A 1 84  ? 1.752   -4.937  22.361  1.000 14.580 0 83  ASP A HA   1 c 
ATOM   1215 H  HB2  . ASP A 1 84  ? 4.016   -6.224  23.520  1.000 14.169 0 83  ASP A HB2  1 c 
ATOM   1216 H  HB3  . ASP A 1 84  ? 2.553   -6.817  23.681  1.000 14.173 0 83  ASP A HB3  1 c 
ATOM   1217 N  N    . LEU A 1 85  ? 0.885   -3.548  24.277  1.000 15.668 0 84  LEU A N    1 ? 
ATOM   1218 C  CA   . LEU A 1 85  ? 0.251   -2.878  25.461  1.000 14.920 0 84  LEU A CA   1 ? 
ATOM   1219 C  C    . LEU A 1 85  ? -0.965  -3.688  25.975  1.000 16.287 0 84  LEU A C    1 ? 
ATOM   1220 O  O    . LEU A 1 85  ? -1.664  -3.170  26.894  1.000 15.843 0 84  LEU A O    1 ? 
ATOM   1221 C  CB   . LEU A 1 85  ? -0.146  -1.427  25.114  1.000 15.026 0 84  LEU A CB   1 ? 
ATOM   1222 C  CG   . LEU A 1 85  ? 0.975   -0.423  24.793  1.000 14.887 0 84  LEU A CG   1 ? 
ATOM   1223 C  CD1  . LEU A 1 85  ? 0.406   0.980   24.579  1.000 14.614 0 84  LEU A CD1  1 ? 
ATOM   1224 C  CD2  . LEU A 1 85  ? 2.046   -0.392  25.880  1.000 14.934 0 84  LEU A CD2  1 ? 
ATOM   1225 H  H    . LEU A 1 85  ? 0.411   -3.426  23.508  1.000 15.406 0 84  LEU A H    1 c 
ATOM   1226 H  HA   . LEU A 1 85  ? 0.920   -2.856  26.182  1.000 15.336 0 84  LEU A HA   1 c 
ATOM   1227 H  HB2  . LEU A 1 85  ? -0.751  -1.457  24.347  1.000 14.972 0 84  LEU A HB2  1 c 
ATOM   1228 H  HB3  . LEU A 1 85  ? -0.658  -1.070  25.867  1.000 14.973 0 84  LEU A HB3  1 c 
ATOM   1229 H  HG   . LEU A 1 85  ? 1.405   -0.708  23.949  1.000 14.870 0 84  LEU A HG   1 c 
ATOM   1230 H  HD11 . LEU A 1 85  ? -0.229  0.964   23.842  1.000 14.698 0 84  LEU A HD11 1 c 
ATOM   1231 H  HD12 . LEU A 1 85  ? 1.130   1.595   24.370  1.000 14.698 0 84  LEU A HD12 1 c 
ATOM   1232 H  HD13 . LEU A 1 85  ? -0.045  1.274   25.389  1.000 14.698 0 84  LEU A HD13 1 c 
ATOM   1233 H  HD21 . LEU A 1 85  ? 1.626   -0.250  26.747  1.000 14.920 0 84  LEU A HD21 1 c 
ATOM   1234 H  HD22 . LEU A 1 85  ? 2.670   0.333   25.700  1.000 14.920 0 84  LEU A HD22 1 c 
ATOM   1235 H  HD23 . LEU A 1 85  ? 2.528   -1.238  25.888  1.000 14.921 0 84  LEU A HD23 1 c 
ATOM   1236 N  N    . GLY A 1 86  ? -1.240  -4.864  25.375  1.000 15.824 0 85  GLY A N    1 ? 
ATOM   1237 C  CA   . GLY A 1 86  ? -2.149  -5.928  25.863  1.000 15.773 0 85  GLY A CA   1 ? 
ATOM   1238 C  C    . GLY A 1 86  ? -3.605  -5.728  25.462  1.000 16.791 0 85  GLY A C    1 ? 
ATOM   1239 O  O    . GLY A 1 86  ? -3.858  -5.705  24.241  1.000 16.887 0 85  GLY A O    1 ? 
ATOM   1240 H  H    . GLY A 1 86  ? -0.860  -5.082  24.578  1.000 15.917 0 85  GLY A H    1 c 
ATOM   1241 H  HA2  . GLY A 1 86  ? -1.837  -6.798  25.513  1.000 16.017 0 85  GLY A HA2  1 c 
ATOM   1242 H  HA3  . GLY A 1 86  ? -2.089  -5.966  26.850  1.000 16.021 0 85  GLY A HA3  1 c 
ATOM   1243 N  N    . ASN A 1 87  ? -4.514  -5.550  26.443  1.000 16.123 0 86  ASN A N    1 ? 
ATOM   1244 C  CA   . ASN A 1 87  ? -5.991  -5.394  26.269  1.000 17.192 0 86  ASN A CA   1 ? 
ATOM   1245 C  C    . ASN A 1 87  ? -6.529  -4.220  27.089  1.000 17.163 0 86  ASN A C    1 ? 
ATOM   1246 O  O    . ASN A 1 87  ? -5.995  -3.971  28.185  1.000 17.170 0 86  ASN A O    1 ? 
ATOM   1247 C  CB   . ASN A 1 87  ? -6.770  -6.653  26.676  1.000 17.377 0 86  ASN A CB   1 ? 
ATOM   1248 C  CG   . ASN A 1 87  ? -6.532  -7.811  25.737  1.000 17.929 0 86  ASN A CG   1 ? 
ATOM   1249 O  OD1  . ASN A 1 87  ? -7.022  -7.811  24.605  1.000 19.529 0 86  ASN A OD1  1 ? 
ATOM   1250 N  ND2  . ASN A 1 87  ? -5.759  -8.791  26.178  1.000 17.138 0 86  ASN A ND2  1 ? 
ATOM   1251 H  H    . ASN A 1 87  ? -4.264  -5.513  27.318  1.000 16.525 0 86  ASN A H    1 c 
ATOM   1252 H  HA   . ASN A 1 87  ? -6.172  -5.224  25.318  1.000 17.014 0 86  ASN A HA   1 c 
ATOM   1253 H  HB2  . ASN A 1 87  ? -6.504  -6.912  27.581  1.000 17.465 0 86  ASN A HB2  1 c 
ATOM   1254 H  HB3  . ASN A 1 87  ? -7.726  -6.444  26.689  1.000 17.461 0 86  ASN A HB3  1 c 
ATOM   1255 H  HD21 . ASN A 1 87  ? -5.656  -9.524  25.694  1.000 17.384 0 86  ASN A HD21 1 c 
ATOM   1256 H  HD22 . ASN A 1 87  ? -5.345  -8.715  26.956  1.000 17.379 0 86  ASN A HD22 1 c 
ATOM   1257 N  N    . VAL A 1 88  ? -7.537  -3.507  26.568  1.000 17.905 0 87  VAL A N    1 ? 
ATOM   1258 C  CA   . VAL A 1 88  ? -8.415  -2.589  27.368  1.000 17.333 0 87  VAL A CA   1 ? 
ATOM   1259 C  C    . VAL A 1 88  ? -9.825  -3.218  27.514  1.000 17.582 0 87  VAL A C    1 ? 
ATOM   1260 O  O    . VAL A 1 88  ? -10.200 -4.036  26.666  1.000 15.952 0 87  VAL A O    1 ? 
ATOM   1261 C  CB   . VAL A 1 88  ? -8.448  -1.159  26.791  1.000 17.583 0 87  VAL A CB   1 ? 
ATOM   1262 C  CG1  . VAL A 1 88  ? -7.057  -0.520  26.758  1.000 17.318 0 87  VAL A CG1  1 ? 
ATOM   1263 C  CG2  . VAL A 1 88  ? -9.097  -1.111  25.425  1.000 18.041 0 87  VAL A CG2  1 ? 
ATOM   1264 H  H    . VAL A 1 88  ? -7.759  -3.548  25.687  1.000 17.593 0 87  VAL A H    1 c 
ATOM   1265 H  HA   . VAL A 1 88  ? -8.033  -2.529  28.262  1.000 17.535 0 87  VAL A HA   1 c 
ATOM   1266 H  HB   . VAL A 1 88  ? -9.006  -0.616  27.401  1.000 17.571 0 87  VAL A HB   1 c 
ATOM   1267 H  HG11 . VAL A 1 88  ? -6.690  -0.492  27.659  1.000 17.400 0 87  VAL A HG11 1 c 
ATOM   1268 H  HG12 . VAL A 1 88  ? -7.123  0.385   26.407  1.000 17.400 0 87  VAL A HG12 1 c 
ATOM   1269 H  HG13 . VAL A 1 88  ? -6.471  -1.046  26.186  1.000 17.401 0 87  VAL A HG13 1 c 
ATOM   1270 H  HG21 . VAL A 1 88  ? -8.614  -1.692  24.814  1.000 17.898 0 87  VAL A HG21 1 c 
ATOM   1271 H  HG22 . VAL A 1 88  ? -9.074  -0.198  25.088  1.000 17.899 0 87  VAL A HG22 1 c 
ATOM   1272 H  HG23 . VAL A 1 88  ? -10.022 -1.406  25.491  1.000 17.898 0 87  VAL A HG23 1 c 
ATOM   1273 N  N    . THR A 1 89  ? -10.569 -2.909  28.589  1.000 16.945 0 88  THR A N    1 ? 
ATOM   1274 C  CA   . THR A 1 89  ? -11.881 -3.556  28.895  1.000 16.793 0 88  THR A CA   1 ? 
ATOM   1275 C  C    . THR A 1 89  ? -13.037 -2.535  28.804  1.000 16.005 0 88  THR A C    1 ? 
ATOM   1276 O  O    . THR A 1 89  ? -13.049 -1.556  29.556  1.000 14.532 0 88  THR A O    1 ? 
ATOM   1277 C  CB   . THR A 1 89  ? -11.885 -4.256  30.263  1.000 18.007 0 88  THR A CB   1 ? 
ATOM   1278 O  OG1  . THR A 1 89  ? -10.801 -5.180  30.242  1.000 18.319 0 88  THR A OG1  1 ? 
ATOM   1279 C  CG2  . THR A 1 89  ? -13.183 -4.988  30.564  1.000 18.448 0 88  THR A CG2  1 ? 
ATOM   1280 H  H    . THR A 1 89  ? -10.329 -2.280  29.207  1.000 17.056 0 88  THR A H    1 c 
ATOM   1281 H  HA   . THR A 1 89  ? -12.035 -4.249  28.206  1.000 16.873 0 88  THR A HA   1 c 
ATOM   1282 H  HB   . THR A 1 89  ? -11.723 -3.579  30.965  1.000 17.909 0 88  THR A HB   1 c 
ATOM   1283 H  HG1  . THR A 1 89  ? -10.756 -5.573  30.983  0.000 18.530 0 88  THR A HG1  1 c 
ATOM   1284 H  HG21 . THR A 1 89  ? -13.934 -4.344  30.575  1.000 18.306 0 88  THR A HG21 1 c 
ATOM   1285 H  HG22 . THR A 1 89  ? -13.116 -5.426  31.449  1.000 18.309 0 88  THR A HG22 1 c 
ATOM   1286 H  HG23 . THR A 1 89  ? -13.347 -5.673  29.870  1.000 18.309 0 88  THR A HG23 1 c 
ATOM   1287 N  N    . ALA A 1 90  ? -14.006 -2.806  27.925  1.000 15.741 0 89  ALA A N    1 ? 
ATOM   1288 C  CA   . ALA A 1 90  ? -15.264 -2.031  27.770  1.000 16.344 0 89  ALA A CA   1 ? 
ATOM   1289 C  C    . ALA A 1 90  ? -16.341 -2.590  28.707  1.000 16.829 0 89  ALA A C    1 ? 
ATOM   1290 O  O    . ALA A 1 90  ? -16.488 -3.823  28.760  1.000 18.296 0 89  ALA A O    1 ? 
ATOM   1291 C  CB   . ALA A 1 90  ? -15.727 -2.072  26.336  1.000 15.149 0 89  ALA A CB   1 ? 
ATOM   1292 H  H    . ALA A 1 90  ? -13.962 -3.506  27.343  1.000 15.945 0 89  ALA A H    1 c 
ATOM   1293 H  HA   . ALA A 1 90  ? -15.087 -1.095  28.019  1.000 16.098 0 89  ALA A HA   1 c 
ATOM   1294 H  HB1  . ALA A 1 90  ? -16.539 -1.546  26.242  1.000 15.511 0 89  ALA A HB1  1 c 
ATOM   1295 H  HB2  . ALA A 1 90  ? -15.036 -1.703  25.761  1.000 15.511 0 89  ALA A HB2  1 c 
ATOM   1296 H  HB3  . ALA A 1 90  ? -15.906 -2.991  26.078  1.000 15.518 0 89  ALA A HB3  1 c 
ATOM   1297 N  N    . ASP A 1 91  ? -17.090 -1.704  29.374  1.000 18.630 0 90  ASP A N    1 ? 
ATOM   1298 C  CA   . ASP A 1 91  ? -18.287 -2.044  30.193  1.000 20.233 0 90  ASP A CA   1 ? 
ATOM   1299 C  C    . ASP A 1 91  ? -19.515 -2.249  29.285  1.000 20.371 0 90  ASP A C    1 ? 
ATOM   1300 O  O    . ASP A 1 91  ? -19.373 -2.211  28.022  1.000 17.494 0 90  ASP A O    1 ? 
ATOM   1301 C  CB   . ASP A 1 91  ? -18.560 -0.981  31.276  1.000 22.414 0 90  ASP A CB   1 ? 
ATOM   1302 C  CG   . ASP A 1 91  ? -18.946 0.439   30.839  1.000 26.353 0 90  ASP A CG   1 ? 
ATOM   1303 O  OD1  . ASP A 1 91  ? -19.338 0.664   29.649  1.000 26.185 0 90  ASP A OD1  1 ? 
ATOM   1304 O  OD2  . ASP A 1 91  ? -18.854 1.344   31.711  1.000 27.408 0 90  ASP A OD2  1 ? 
ATOM   1305 H  H    . ASP A 1 91  ? -16.904 -0.813  29.365  1.000 18.556 0 90  ASP A H    1 c 
ATOM   1306 H  HA   . ASP A 1 91  ? -18.103 -2.896  30.654  1.000 20.327 0 90  ASP A HA   1 c 
ATOM   1307 H  HB2  . ASP A 1 91  ? -19.271 -1.311  31.860  1.000 22.722 0 90  ASP A HB2  1 c 
ATOM   1308 H  HB3  . ASP A 1 91  ? -17.749 -0.900  31.819  1.000 22.731 0 90  ASP A HB3  1 c 
ATOM   1309 N  N    . LYS A 1 92  ? -20.686 -2.414  29.911  1.000 19.857 0 91  LYS A N    1 ? 
ATOM   1310 C  CA   . LYS A 1 92  ? -21.978 -2.735  29.234  1.000 23.972 0 91  LYS A CA   1 ? 
ATOM   1311 C  C    . LYS A 1 92  ? -22.455 -1.582  28.350  1.000 24.538 0 91  LYS A C    1 ? 
ATOM   1312 O  O    . LYS A 1 92  ? -23.274 -1.858  27.449  1.000 22.351 0 91  LYS A O    1 ? 
ATOM   1313 C  CB   . LYS A 1 92  ? -23.107 -2.986  30.245  1.000 26.298 0 91  LYS A CB   1 ? 
ATOM   1314 C  CG   . LYS A 1 92  ? -23.613 -4.417  30.335  1.000 28.098 0 91  LYS A CG   1 ? 
ATOM   1315 C  CD   . LYS A 1 92  ? -24.069 -5.037  29.034  1.000 29.508 0 91  LYS A CD   1 ? 
ATOM   1316 C  CE   . LYS A 1 92  ? -24.958 -6.240  29.271  1.000 30.732 0 91  LYS A CE   1 ? 
ATOM   1317 N  NZ   . LYS A 1 92  ? -25.653 -6.665  28.038  1.000 33.385 0 91  LYS A NZ   1 ? 
ATOM   1318 H  H    . LYS A 1 92  ? -20.763 -2.354  30.814  1.000 20.922 0 91  LYS A H    1 c 
ATOM   1319 H  HA   . LYS A 1 92  ? -21.852 -3.536  28.678  1.000 23.671 0 91  LYS A HA   1 c 
ATOM   1320 H  HB2  . LYS A 1 92  ? -22.794 -2.715  31.132  1.000 26.100 0 91  LYS A HB2  1 c 
ATOM   1321 H  HB3  . LYS A 1 92  ? -23.864 -2.409  30.012  1.000 26.118 0 91  LYS A HB3  1 c 
ATOM   1322 H  HG2  . LYS A 1 92  ? -22.900 -4.974  30.714  1.000 27.978 0 91  LYS A HG2  1 c 
ATOM   1323 H  HG3  . LYS A 1 92  ? -24.362 -4.433  30.966  1.000 27.996 0 91  LYS A HG3  1 c 
ATOM   1324 H  HD2  . LYS A 1 92  ? -24.562 -4.369  28.512  1.000 29.455 0 91  LYS A HD2  1 c 
ATOM   1325 H  HD3  . LYS A 1 92  ? -23.285 -5.316  28.515  1.000 29.437 0 91  LYS A HD3  1 c 
ATOM   1326 H  HE2  . LYS A 1 92  ? -24.420 -6.984  29.603  1.000 31.039 0 91  LYS A HE2  1 c 
ATOM   1327 H  HE3  . LYS A 1 92  ? -25.625 -6.025  29.950  1.000 31.033 0 91  LYS A HE3  1 c 
ATOM   1328 H  HZ1  . LYS A 1 92  ? -26.094 -5.960  27.675  1.000 32.541 0 91  LYS A HZ1  1 c 
ATOM   1329 H  HZ2  . LYS A 1 92  ? -26.250 -7.319  28.230  1.000 32.548 0 91  LYS A HZ2  1 c 
ATOM   1330 H  HZ3  . LYS A 1 92  ? -25.050 -6.980  27.437  1.000 32.548 0 91  LYS A HZ3  1 c 
ATOM   1331 N  N    . ASP A 1 93  ? -22.030 -0.348  28.651  1.000 24.648 0 92  ASP A N    1 ? 
ATOM   1332 C  CA   . ASP A 1 93  ? -22.348 0.875   27.860  1.000 24.757 0 92  ASP A CA   1 ? 
ATOM   1333 C  C    . ASP A 1 93  ? -21.375 1.017   26.679  1.000 22.323 0 92  ASP A C    1 ? 
ATOM   1334 O  O    . ASP A 1 93  ? -21.635 1.871   25.815  1.000 21.417 0 92  ASP A O    1 ? 
ATOM   1335 C  CB   . ASP A 1 93  ? -22.306 2.114   28.754  1.000 25.950 0 92  ASP A CB   1 ? 
ATOM   1336 C  CG   . ASP A 1 93  ? -23.294 2.044   29.910  1.000 26.373 0 92  ASP A CG   1 ? 
ATOM   1337 O  OD1  . ASP A 1 93  ? -24.310 1.328   29.784  1.000 29.822 0 92  ASP A OD1  1 ? 
ATOM   1338 O  OD2  . ASP A 1 93  ? -23.053 2.719   30.921  1.000 27.945 0 92  ASP A OD2  1 ? 
ATOM   1339 H  H    . ASP A 1 93  ? -21.513 -0.178  29.381  1.000 24.631 0 92  ASP A H    1 c 
ATOM   1340 H  HA   . ASP A 1 93  ? -23.261 0.783   27.501  1.000 24.476 0 92  ASP A HA   1 c 
ATOM   1341 H  HB2  . ASP A 1 93  ? -21.404 2.217   29.118  1.000 25.769 0 92  ASP A HB2  1 c 
ATOM   1342 H  HB3  . ASP A 1 93  ? -22.511 2.906   28.216  1.000 25.763 0 92  ASP A HB3  1 c 
ATOM   1343 N  N    . GLY A 1 94  ? -20.296 0.225   26.642  1.000 20.282 0 93  GLY A N    1 ? 
ATOM   1344 C  CA   . GLY A 1 94  ? -19.346 0.184   25.514  1.000 20.905 0 93  GLY A CA   1 ? 
ATOM   1345 C  C    . GLY A 1 94  ? -18.198 1.165   25.700  1.000 21.063 0 93  GLY A C    1 ? 
ATOM   1346 O  O    . GLY A 1 94  ? -17.552 1.482   24.691  1.000 22.873 0 93  GLY A O    1 ? 
ATOM   1347 H  H    . GLY A 1 94  ? -20.078 -0.333  27.325  1.000 20.907 0 93  GLY A H    1 c 
ATOM   1348 H  HA2  . GLY A 1 94  ? -18.981 -0.732  25.438  1.000 20.791 0 93  GLY A HA2  1 c 
ATOM   1349 H  HA3  . GLY A 1 94  ? -19.827 0.395   24.675  1.000 20.795 0 93  GLY A HA3  1 c 
ATOM   1350 N  N    . VAL A 1 95  ? -17.917 1.577   26.940  1.000 20.366 0 94  VAL A N    1 ? 
ATOM   1351 C  CA   . VAL A 1 95  ? -16.854 2.575   27.290  1.000 21.615 0 94  VAL A CA   1 ? 
ATOM   1352 C  C    . VAL A 1 95  ? -15.702 1.839   27.991  1.000 21.873 0 94  VAL A C    1 ? 
ATOM   1353 O  O    . VAL A 1 95  ? -15.973 1.121   28.985  1.000 19.711 0 94  VAL A O    1 ? 
ATOM   1354 C  CB   . VAL A 1 95  ? -17.386 3.730   28.169  1.000 20.519 0 94  VAL A CB   1 ? 
ATOM   1355 C  CG1  . VAL A 1 95  ? -16.288 4.718   28.553  1.000 20.604 0 94  VAL A CG1  1 ? 
ATOM   1356 C  CG2  . VAL A 1 95  ? -18.525 4.477   27.498  1.000 21.924 0 94  VAL A CG2  1 ? 
ATOM   1357 H  H    . VAL A 1 95  ? -18.362 1.264   27.670  1.000 20.815 0 94  VAL A H    1 c 
ATOM   1358 H  HA   . VAL A 1 95  ? -16.515 2.956   26.464  1.000 21.198 0 94  VAL A HA   1 c 
ATOM   1359 H  HB   . VAL A 1 95  ? -17.737 3.330   29.003  1.000 21.002 0 94  VAL A HB   1 c 
ATOM   1360 H  HG11 . VAL A 1 95  ? -15.686 4.303   29.197  1.000 20.580 0 94  VAL A HG11 1 c 
ATOM   1361 H  HG12 . VAL A 1 95  ? -16.687 5.511   28.950  1.000 20.581 0 94  VAL A HG12 1 c 
ATOM   1362 H  HG13 . VAL A 1 95  ? -15.787 4.972   27.758  1.000 20.578 0 94  VAL A HG13 1 c 
ATOM   1363 H  HG21 . VAL A 1 95  ? -18.215 4.853   26.656  1.000 21.479 0 94  VAL A HG21 1 c 
ATOM   1364 H  HG22 . VAL A 1 95  ? -18.831 5.195   28.080  1.000 21.477 0 94  VAL A HG22 1 c 
ATOM   1365 H  HG23 . VAL A 1 95  ? -19.261 3.864   27.328  1.000 21.478 0 94  VAL A HG23 1 c 
ATOM   1366 N  N    . ALA A 1 96  ? -14.464 2.022   27.514  1.000 19.119 0 95  ALA A N    1 ? 
ATOM   1367 C  CA   . ALA A 1 96  ? -13.250 1.559   28.232  1.000 19.607 0 95  ALA A CA   1 ? 
ATOM   1368 C  C    . ALA A 1 96  ? -12.531 2.770   28.825  1.000 21.545 0 95  ALA A C    1 ? 
ATOM   1369 O  O    . ALA A 1 96  ? -12.175 3.707   28.067  1.000 19.845 0 95  ALA A O    1 ? 
ATOM   1370 C  CB   . ALA A 1 96  ? -12.351 0.757   27.317  1.000 19.392 0 95  ALA A CB   1 ? 
ATOM   1371 H  H    . ALA A 1 96  ? -14.275 2.437   26.726  1.000 19.856 0 95  ALA A H    1 c 
ATOM   1372 H  HA   . ALA A 1 96  ? -13.533 0.977   28.975  1.000 19.833 0 95  ALA A HA   1 c 
ATOM   1373 H  HB1  . ALA A 1 96  ? -11.568 0.459   27.810  1.000 19.458 0 95  ALA A HB1  1 c 
ATOM   1374 H  HB2  . ALA A 1 96  ? -12.835 -0.016  26.982  1.000 19.458 0 95  ALA A HB2  1 c 
ATOM   1375 H  HB3  . ALA A 1 96  ? -12.071 1.311   26.570  1.000 19.458 0 95  ALA A HB3  1 c 
ATOM   1376 N  N    . ASP A 1 97  ? -12.349 2.780   30.151  1.000 23.510 0 96  ASP A N    1 ? 
ATOM   1377 C  CA   . ASP A 1 97  ? -11.487 3.767   30.852  1.000 24.616 0 96  ASP A CA   1 ? 
ATOM   1378 C  C    . ASP A 1 97  ? -10.065 3.194   30.894  1.000 24.547 0 96  ASP A C    1 ? 
ATOM   1379 O  O    . ASP A 1 97  ? -9.853  2.146   31.524  1.000 23.182 0 96  ASP A O    1 ? 
ATOM   1380 C  CB   . ASP A 1 97  ? -12.048 4.120   32.228  1.000 27.864 0 96  ASP A CB   1 ? 
ATOM   1381 C  CG   . ASP A 1 97  ? -13.203 5.093   32.150  1.000 30.474 0 96  ASP A CG   1 ? 
ATOM   1382 O  OD1  . ASP A 1 97  ? -13.952 5.185   33.144  1.000 36.730 0 96  ASP A OD1  1 ? 
ATOM   1383 O  OD2  . ASP A 1 97  ? -13.358 5.733   31.081  1.000 35.051 0 96  ASP A OD2  1 ? 
ATOM   1384 H  H    . ASP A 1 97  ? -12.745 2.176   30.707  1.000 23.288 0 96  ASP A H    1 c 
ATOM   1385 H  HA   . ASP A 1 97  ? -11.468 4.591   30.313  1.000 24.973 0 96  ASP A HA   1 c 
ATOM   1386 H  HB2  . ASP A 1 97  ? -12.351 3.305   32.678  1.000 27.629 0 96  ASP A HB2  1 c 
ATOM   1387 H  HB3  . ASP A 1 97  ? -11.340 4.524   32.768  1.000 27.651 0 96  ASP A HB3  1 c 
ATOM   1388 N  N    . VAL A 1 98  ? -9.149  3.800   30.137  1.000 23.165 0 97  VAL A N    1 ? 
ATOM   1389 C  CA   . VAL A 1 98  ? -7.766  3.278   29.940  1.000 21.481 0 97  VAL A CA   1 ? 
ATOM   1390 C  C    . VAL A 1 98  ? -6.851  3.890   31.007  1.000 21.045 0 97  VAL A C    1 ? 
ATOM   1391 O  O    . VAL A 1 98  ? -6.911  5.098   31.177  1.000 21.422 0 97  VAL A O    1 ? 
ATOM   1392 C  CB   . VAL A 1 98  ? -7.252  3.577   28.522  1.000 19.931 0 97  VAL A CB   1 ? 
ATOM   1393 C  CG1  . VAL A 1 98  ? -5.917  2.890   28.269  1.000 19.978 0 97  VAL A CG1  1 ? 
ATOM   1394 C  CG2  . VAL A 1 98  ? -8.280  3.183   27.460  1.000 19.655 0 97  VAL A CG2  1 ? 
ATOM   1395 H  H    . VAL A 1 98  ? -9.309  4.583   29.700  1.000 23.054 0 97  VAL A H    1 c 
ATOM   1396 H  HA   . VAL A 1 98  ? -7.782  2.312   30.063  1.000 21.412 0 97  VAL A HA   1 c 
ATOM   1397 H  HB   . VAL A 1 98  ? -7.108  4.554   28.457  1.000 20.176 0 97  VAL A HB   1 c 
ATOM   1398 H  HG11 . VAL A 1 98  ? -5.238  3.269   28.854  1.000 19.967 0 97  VAL A HG11 1 c 
ATOM   1399 H  HG12 . VAL A 1 98  ? -5.654  3.022   27.342  1.000 19.965 0 97  VAL A HG12 1 c 
ATOM   1400 H  HG13 . VAL A 1 98  ? -6.003  1.937   28.448  1.000 19.965 0 97  VAL A HG13 1 c 
ATOM   1401 H  HG21 . VAL A 1 98  ? -8.564  2.264   27.607  1.000 19.742 0 97  VAL A HG21 1 c 
ATOM   1402 H  HG22 . VAL A 1 98  ? -7.880  3.260   26.576  1.000 19.731 0 97  VAL A HG22 1 c 
ATOM   1403 H  HG23 . VAL A 1 98  ? -9.052  3.774   27.516  1.000 19.753 0 97  VAL A HG23 1 c 
ATOM   1404 N  N    . SER A 1 99  ? -6.021  3.070   31.668  1.000 23.518 0 98  SER A N    1 ? 
ATOM   1405 C  CA   . SER A 1 99  ? -5.021  3.485   32.696  1.000 22.380 0 98  SER A CA   1 ? 
ATOM   1406 C  C    . SER A 1 99  ? -3.862  2.466   32.729  1.000 23.816 0 98  SER A C    1 ? 
ATOM   1407 O  O    . SER A 1 99  ? -4.079  1.331   33.250  1.000 24.737 0 98  SER A O    1 ? 
ATOM   1408 C  CB   . SER A 1 99  ? -5.714  3.638   34.024  1.000 23.482 0 98  SER A CB   1 ? 
ATOM   1409 O  OG   . SER A 1 99  ? -4.807  4.024   35.052  1.000 23.511 0 98  SER A OG   1 ? 
ATOM   1410 H  H    . SER A 1 99  ? -6.014  2.166   31.532  1.000 22.645 0 98  SER A H    1 c 
ATOM   1411 H  HA   . SER A 1 99  ? -4.655  4.364   32.430  1.000 23.069 0 98  SER A HA   1 c 
ATOM   1412 H  HB2  . SER A 1 99  ? -6.426  4.319   33.943  1.000 23.225 0 98  SER A HB2  1 c 
ATOM   1413 H  HB3  . SER A 1 99  ? -6.139  2.779   34.269  1.000 23.227 0 98  SER A HB3  1 c 
ATOM   1414 H  HG   . SER A 1 99  ? -5.231  4.101   35.751  0.000 23.490 0 98  SER A HG   1 c 
ATOM   1415 N  N    . ILE A 1 100 ? -2.702  2.813   32.140  1.000 21.454 0 99  ILE A N    1 ? 
ATOM   1416 C  CA   . ILE A 1 100 ? -1.550  1.891   31.880  1.000 22.281 0 99  ILE A CA   1 ? 
ATOM   1417 C  C    . ILE A 1 100 ? -0.239  2.635   32.261  1.000 21.145 0 99  ILE A C    1 ? 
ATOM   1418 O  O    . ILE A 1 100 ? -0.139  3.850   31.959  1.000 18.074 0 99  ILE A O    1 ? 
ATOM   1419 C  CB   . ILE A 1 100 ? -1.605  1.409   30.401  1.000 21.167 0 99  ILE A CB   1 ? 
ATOM   1420 C  CG1  . ILE A 1 100 ? -2.831  0.527   30.116  1.000 21.900 0 99  ILE A CG1  1 ? 
ATOM   1421 C  CG2  . ILE A 1 100 ? -0.319  0.724   29.974  1.000 21.985 0 99  ILE A CG2  1 ? 
ATOM   1422 C  CD1  . ILE A 1 100 ? -2.980  0.107   28.669  1.000 21.459 0 99  ILE A CD1  1 ? 
ATOM   1423 H  H    . ILE A 1 100 ? -2.546  3.662   31.849  1.000 22.184 0 99  ILE A H    1 c 
ATOM   1424 H  HA   . ILE A 1 100 ? -1.641  1.114   32.459  1.000 21.697 0 99  ILE A HA   1 c 
ATOM   1425 H  HB   . ILE A 1 100 ? -1.701  2.217   29.842  1.000 21.672 0 99  ILE A HB   1 c 
ATOM   1426 H  HG12 . ILE A 1 100 ? -2.773  -0.279  30.671  1.000 21.623 0 99  ILE A HG12 1 c 
ATOM   1427 H  HG13 . ILE A 1 100 ? -3.638  1.016   30.381  1.000 21.625 0 99  ILE A HG13 1 c 
ATOM   1428 H  HG21 . ILE A 1 100 ? 0.428   1.341   30.066  1.000 21.729 0 99  ILE A HG21 1 c 
ATOM   1429 H  HG22 . ILE A 1 100 ? -0.388  0.444   29.045  1.000 21.729 0 99  ILE A HG22 1 c 
ATOM   1430 H  HG23 . ILE A 1 100 ? -0.163  -0.055  30.535  1.000 21.728 0 99  ILE A HG23 1 c 
ATOM   1431 H  HD11 . ILE A 1 100 ? -2.865  0.882   28.091  1.000 21.594 0 99  ILE A HD11 1 c 
ATOM   1432 H  HD12 . ILE A 1 100 ? -3.866  -0.271  28.530  1.000 21.595 0 99  ILE A HD12 1 c 
ATOM   1433 H  HD13 . ILE A 1 100 ? -2.307  -0.562  28.451  1.000 21.591 0 99  ILE A HD13 1 c 
ATOM   1434 N  N    . GLU A 1 101 ? 0.715   1.981   32.949  1.000 21.505 0 100 GLU A N    1 ? 
ATOM   1435 C  CA   . GLU A 1 101 ? 2.139   2.444   33.057  1.000 20.851 0 100 GLU A CA   1 ? 
ATOM   1436 C  C    . GLU A 1 101 ? 3.027   1.394   32.374  1.000 18.620 0 100 GLU A C    1 ? 
ATOM   1437 O  O    . GLU A 1 101 ? 2.866   0.168   32.689  1.000 16.419 0 100 GLU A O    1 ? 
ATOM   1438 C  CB   . GLU A 1 101 ? 2.630   2.637   34.500  1.000 23.441 0 100 GLU A CB   1 ? 
ATOM   1439 C  CG   . GLU A 1 101 ? 1.939   3.751   35.264  1.000 27.178 0 100 GLU A CG   1 ? 
ATOM   1440 C  CD   . GLU A 1 101 ? 2.779   4.439   36.337  1.000 32.165 0 100 GLU A CD   1 ? 
ATOM   1441 O  OE1  . GLU A 1 101 ? 3.956   4.034   36.526  1.000 32.184 0 100 GLU A OE1  1 ? 
ATOM   1442 O  OE2  . GLU A 1 101 ? 2.265   5.405   36.972  1.000 34.301 0 100 GLU A OE2  1 ? 
ATOM   1443 H  H    . GLU A 1 101 ? 0.549   1.205   33.398  1.000 21.268 0 100 GLU A H    1 c 
ATOM   1444 H  HA   . GLU A 1 101 ? 2.227   3.296   32.576  1.000 20.954 0 100 GLU A HA   1 c 
ATOM   1445 H  HB2  . GLU A 1 101 ? 2.502   1.795   34.985  1.000 23.619 0 100 GLU A HB2  1 c 
ATOM   1446 H  HB3  . GLU A 1 101 ? 3.592   2.821   34.473  1.000 23.635 0 100 GLU A HB3  1 c 
ATOM   1447 H  HG2  . GLU A 1 101 ? 1.641   4.433   34.625  1.000 27.299 0 100 GLU A HG2  1 c 
ATOM   1448 H  HG3  . GLU A 1 101 ? 1.137   3.384   35.695  1.000 27.311 0 100 GLU A HG3  1 c 
ATOM   1449 N  N    . ASP A 1 102 ? 3.874   1.817   31.436  1.000 16.827 0 101 ASP A N    1 ? 
ATOM   1450 C  CA   . ASP A 1 102 ? 4.735   0.903   30.647  1.000 18.603 0 101 ASP A CA   1 ? 
ATOM   1451 C  C    . ASP A 1 102 ? 6.153   1.464   30.566  1.000 17.919 0 101 ASP A C    1 ? 
ATOM   1452 O  O    . ASP A 1 102 ? 6.305   2.665   30.321  1.000 18.563 0 101 ASP A O    1 ? 
ATOM   1453 C  CB   . ASP A 1 102 ? 4.168   0.665   29.241  1.000 18.154 0 101 ASP A CB   1 ? 
ATOM   1454 C  CG   . ASP A 1 102 ? 4.819   -0.514  28.543  1.000 18.893 0 101 ASP A CG   1 ? 
ATOM   1455 O  OD1  . ASP A 1 102 ? 4.414   -1.670  28.846  1.000 18.478 0 101 ASP A OD1  1 ? 
ATOM   1456 O  OD2  . ASP A 1 102 ? 5.760   -0.288  27.741  1.000 17.919 0 101 ASP A OD2  1 ? 
ATOM   1457 H  H    . ASP A 1 102 ? 3.974   2.697   31.223  1.000 17.655 0 101 ASP A H    1 c 
ATOM   1458 H  HA   . ASP A 1 102 ? 4.773   0.035   31.112  1.000 18.036 0 101 ASP A HA   1 c 
ATOM   1459 H  HB2  . ASP A 1 102 ? 3.206   0.496   29.307  1.000 18.429 0 101 ASP A HB2  1 c 
ATOM   1460 H  HB3  . ASP A 1 102 ? 4.302   1.468   28.700  1.000 18.418 0 101 ASP A HB3  1 c 
ATOM   1461 N  N    . SER A 1 103 ? 7.179   0.623   30.741  1.000 17.657 0 102 SER A N    1 ? 
ATOM   1462 C  CA   . SER A 1 103 ? 8.578   1.110   30.779  1.000 17.193 0 102 SER A CA   1 ? 
ATOM   1463 C  C    . SER A 1 103 ? 9.342   0.625   29.557  1.000 15.542 0 102 SER A C    1 ? 
ATOM   1464 O  O    . SER A 1 103 ? 10.528  0.933   29.520  1.000 15.600 0 102 SER A O    1 ? 
ATOM   1465 C  CB   . SER A 1 103 ? 9.272   0.757   32.057  1.000 18.780 0 102 SER A CB   1 ? 
ATOM   1466 O  OG   . SER A 1 103 ? 8.716   1.511   33.121  1.000 19.663 0 102 SER A OG   1 ? 
ATOM   1467 H  H    . SER A 1 103 ? 7.103   -0.281  30.854  1.000 17.601 0 102 SER A H    1 c 
ATOM   1468 H  HA   . SER A 1 103 ? 8.547   2.097   30.727  1.000 17.243 0 102 SER A HA   1 c 
ATOM   1469 H  HB2  . SER A 1 103 ? 9.166   -0.209  32.239  1.000 18.593 0 102 SER A HB2  1 c 
ATOM   1470 H  HB3  . SER A 1 103 ? 10.238  0.957   31.979  1.000 18.582 0 102 SER A HB3  1 c 
ATOM   1471 H  HG   . SER A 1 103 ? 9.090   1.299   33.843  0.000 20.560 0 102 SER A HG   1 c 
ATOM   1472 N  N    . VAL A 1 104 ? 8.662   -0.012  28.580  1.000 14.956 0 103 VAL A N    1 ? 
ATOM   1473 C  CA   . VAL A 1 104 ? 9.289   -0.503  27.309  1.000 14.359 0 103 VAL A CA   1 ? 
ATOM   1474 C  C    . VAL A 1 104 ? 9.068   0.559   26.219  1.000 14.469 0 103 VAL A C    1 ? 
ATOM   1475 O  O    . VAL A 1 104 ? 10.024  0.894   25.486  1.000 16.184 0 103 VAL A O    1 ? 
ATOM   1476 C  CB   . VAL A 1 104 ? 8.724   -1.883  26.901  1.000 13.758 0 103 VAL A CB   1 ? 
ATOM   1477 C  CG1  . VAL A 1 104 ? 9.290   -2.411  25.584  1.000 13.912 0 103 VAL A CG1  1 ? 
ATOM   1478 C  CG2  . VAL A 1 104 ? 8.971   -2.902  27.992  1.000 15.043 0 103 VAL A CG2  1 ? 
ATOM   1479 H  H    . VAL A 1 104 ? 7.769   -0.182  28.630  1.000 14.965 0 103 VAL A H    1 c 
ATOM   1480 H  HA   . VAL A 1 104 ? 10.247  -0.595  27.456  1.000 14.380 0 103 VAL A HA   1 c 
ATOM   1481 H  HB   . VAL A 1 104 ? 7.747   -1.784  26.794  1.000 14.149 0 103 VAL A HB   1 c 
ATOM   1482 H  HG11 . VAL A 1 104 ? 9.052   -1.806  24.861  1.000 13.870 0 103 VAL A HG11 1 c 
ATOM   1483 H  HG12 . VAL A 1 104 ? 8.920   -3.293  25.402  1.000 13.869 0 103 VAL A HG12 1 c 
ATOM   1484 H  HG13 . VAL A 1 104 ? 10.259  -2.473  25.648  1.000 13.868 0 103 VAL A HG13 1 c 
ATOM   1485 H  HG21 . VAL A 1 104 ? 9.925   -2.959  28.174  1.000 14.637 0 103 VAL A HG21 1 c 
ATOM   1486 H  HG22 . VAL A 1 104 ? 8.644   -3.772  27.703  1.000 14.636 0 103 VAL A HG22 1 c 
ATOM   1487 H  HG23 . VAL A 1 104 ? 8.502   -2.634  28.801  1.000 14.638 0 103 VAL A HG23 1 c 
ATOM   1488 N  N    . ILE A 1 105 ? 7.852   1.079   26.106  1.000 15.982 0 104 ILE A N    1 ? 
ATOM   1489 C  CA   . ILE A 1 105 ? 7.572   2.259   25.225  1.000 15.735 0 104 ILE A CA   1 ? 
ATOM   1490 C  C    . ILE A 1 105 ? 8.323   3.490   25.771  1.000 15.908 0 104 ILE A C    1 ? 
ATOM   1491 O  O    . ILE A 1 105 ? 8.537   3.591   27.022  1.000 14.993 0 104 ILE A O    1 ? 
ATOM   1492 C  CB   . ILE A 1 105 ? 6.059   2.517   25.033  1.000 15.314 0 104 ILE A CB   1 ? 
ATOM   1493 C  CG1  . ILE A 1 105 ? 5.309   2.786   26.343  1.000 15.849 0 104 ILE A CG1  1 ? 
ATOM   1494 C  CG2  . ILE A 1 105 ? 5.449   1.344   24.276  1.000 15.446 0 104 ILE A CG2  1 ? 
ATOM   1495 C  CD1  . ILE A 1 105 ? 4.022   3.529   26.156  1.000 16.268 0 104 ILE A CD1  1 ? 
ATOM   1496 H  H    . ILE A 1 105 ? 7.124   0.751   26.544  1.000 15.553 0 104 ILE A H    1 c 
ATOM   1497 H  HA   . ILE A 1 105 ? 7.943   2.058   24.347  1.000 15.729 0 104 ILE A HA   1 c 
ATOM   1498 H  HB   . ILE A 1 105 ? 5.965   3.322   24.466  1.000 15.520 0 104 ILE A HB   1 c 
ATOM   1499 H  HG12 . ILE A 1 105 ? 5.115   1.928   26.773  1.000 15.826 0 104 ILE A HG12 1 c 
ATOM   1500 H  HG13 . ILE A 1 105 ? 5.887   3.301   26.943  1.000 15.817 0 104 ILE A HG13 1 c 
ATOM   1501 H  HG21 . ILE A 1 105 ? 5.902   1.236   23.421  1.000 15.404 0 104 ILE A HG21 1 c 
ATOM   1502 H  HG22 . ILE A 1 105 ? 4.503   1.513   24.120  1.000 15.405 0 104 ILE A HG22 1 c 
ATOM   1503 H  HG23 . ILE A 1 105 ? 5.548   0.530   24.799  1.000 15.405 0 104 ILE A HG23 1 c 
ATOM   1504 H  HD11 . ILE A 1 105 ? 4.203   4.394   25.749  1.000 16.135 0 104 ILE A HD11 1 c 
ATOM   1505 H  HD12 . ILE A 1 105 ? 3.594   3.661   27.019  1.000 16.135 0 104 ILE A HD12 1 c 
ATOM   1506 H  HD13 . ILE A 1 105 ? 3.431   3.017   25.577  1.000 16.133 0 104 ILE A HD13 1 c 
ATOM   1507 N  N    . SER A 1 106 ? 8.721   4.380   24.863  1.000 14.863 0 105 SER A N    1 ? 
ATOM   1508 C  CA   . SER A 1 106 ? 9.362   5.686   25.179  1.000 14.360 0 105 SER A CA   1 ? 
ATOM   1509 C  C    . SER A 1 106 ? 8.813   6.793   24.282  1.000 15.892 0 105 SER A C    1 ? 
ATOM   1510 O  O    . SER A 1 106 ? 8.363   6.464   23.154  1.000 15.500 0 105 SER A O    1 ? 
ATOM   1511 C  CB   . SER A 1 106 ? 10.848  5.601   25.092  1.000 14.313 0 105 SER A CB   1 ? 
ATOM   1512 O  OG   . SER A 1 106 ? 11.420  6.730   25.729  1.000 14.118 0 105 SER A OG   1 ? 
ATOM   1513 H  H    . SER A 1 106 ? 8.629   4.249   23.963  1.000 14.986 0 105 SER A H    1 c 
ATOM   1514 H  HA   . SER A 1 106 ? 9.126   5.914   26.112  1.000 14.732 0 105 SER A HA   1 c 
ATOM   1515 H  HB2  . SER A 1 106 ? 11.161  4.774   25.534  1.000 14.310 0 105 SER A HB2  1 c 
ATOM   1516 H  HB3  . SER A 1 106 ? 11.125  5.573   24.143  1.000 14.300 0 105 SER A HB3  1 c 
ATOM   1517 H  HG   . SER A 1 106 ? 12.258  6.698   25.671  0.000 13.460 0 105 SER A HG   1 c 
ATOM   1518 N  N    . LEU A 1 107 ? 8.890   8.042   24.759  1.000 16.185 0 106 LEU A N    1 ? 
ATOM   1519 C  CA   . LEU A 1 107 ? 8.586   9.255   23.955  1.000 17.050 0 106 LEU A CA   1 ? 
ATOM   1520 C  C    . LEU A 1 107 ? 9.888   9.870   23.416  1.000 17.973 0 106 LEU A C    1 ? 
ATOM   1521 O  O    . LEU A 1 107 ? 9.806   10.944  22.836  1.000 19.221 0 106 LEU A O    1 ? 
ATOM   1522 C  CB   . LEU A 1 107 ? 7.757   10.257  24.762  1.000 16.926 0 106 LEU A CB   1 ? 
ATOM   1523 C  CG   . LEU A 1 107 ? 6.449   9.743   25.357  1.000 16.248 0 106 LEU A CG   1 ? 
ATOM   1524 C  CD1  . LEU A 1 107 ? 5.678   10.863  26.029  1.000 16.720 0 106 LEU A CD1  1 ? 
ATOM   1525 C  CD2  . LEU A 1 107 ? 5.569   9.040   24.314  1.000 16.375 0 106 LEU A CD2  1 ? 
ATOM   1526 H  H    . LEU A 1 107 ? 9.137   8.224   25.617  1.000 16.309 0 106 LEU A H    1 c 
ATOM   1527 H  HA   . LEU A 1 107 ? 8.053   8.968   23.178  1.000 17.021 0 106 LEU A HA   1 c 
ATOM   1528 H  HB2  . LEU A 1 107 ? 8.315   10.593  25.492  1.000 16.795 0 106 LEU A HB2  1 c 
ATOM   1529 H  HB3  . LEU A 1 107 ? 7.550   11.017  24.182  1.000 16.798 0 106 LEU A HB3  1 c 
ATOM   1530 H  HG   . LEU A 1 107 ? 6.678   9.079   26.052  1.000 16.491 0 106 LEU A HG   1 c 
ATOM   1531 H  HD11 . LEU A 1 107 ? 6.218   11.247  26.742  1.000 16.578 0 106 LEU A HD11 1 c 
ATOM   1532 H  HD12 . LEU A 1 107 ? 4.852   10.509  26.404  1.000 16.577 0 106 LEU A HD12 1 c 
ATOM   1533 H  HD13 . LEU A 1 107 ? 5.467   11.551  25.375  1.000 16.578 0 106 LEU A HD13 1 c 
ATOM   1534 H  HD21 . LEU A 1 107 ? 5.441   9.627   23.549  1.000 16.340 0 106 LEU A HD21 1 c 
ATOM   1535 H  HD22 . LEU A 1 107 ? 4.705   8.829   24.709  1.000 16.341 0 106 LEU A HD22 1 c 
ATOM   1536 H  HD23 . LEU A 1 107 ? 6.001   8.218   24.024  1.000 16.343 0 106 LEU A HD23 1 c 
ATOM   1537 N  N    . SER A 1 108 ? 11.024  9.172   23.512  1.000 19.509 0 107 SER A N    1 ? 
ATOM   1538 C  CA   . SER A 1 108 ? 12.276  9.502   22.770  1.000 22.412 0 107 SER A CA   1 ? 
ATOM   1539 C  C    . SER A 1 108 ? 13.113  8.236   22.516  1.000 23.095 0 107 SER A C    1 ? 
ATOM   1540 O  O    . SER A 1 108 ? 12.809  7.183   23.129  1.000 23.249 0 107 SER A O    1 ? 
ATOM   1541 C  CB   . SER A 1 108 ? 13.077  10.528  23.509  1.000 24.935 0 107 SER A CB   1 ? 
ATOM   1542 O  OG   . SER A 1 108 ? 13.711  9.929   24.632  1.000 27.769 0 107 SER A OG   1 ? 
ATOM   1543 H  H    . SER A 1 108 ? 11.124  8.443   24.054  1.000 19.761 0 107 SER A H    1 c 
ATOM   1544 H  HA   . SER A 1 108 ? 12.020  9.880   21.893  1.000 22.387 0 107 SER A HA   1 c 
ATOM   1545 H  HB2  . SER A 1 108 ? 13.760  10.913  22.906  1.000 24.942 0 107 SER A HB2  1 c 
ATOM   1546 H  HB3  . SER A 1 108 ? 12.482  11.258  23.812  1.000 24.942 0 107 SER A HB3  1 c 
ATOM   1547 H  HG   . SER A 1 108 ? 14.154  10.463  25.030  0.000 28.000 0 107 SER A HG   1 c 
ATOM   1548 N  N    . GLY A 1 109 ? 14.105  8.325   21.614  1.000 24.172 0 108 GLY A N    1 ? 
ATOM   1549 C  CA   . GLY A 1 109 ? 15.106  7.270   21.338  1.000 24.316 0 108 GLY A CA   1 ? 
ATOM   1550 C  C    . GLY A 1 109 ? 14.577  6.168   20.429  1.000 24.161 0 108 GLY A C    1 ? 
ATOM   1551 O  O    . GLY A 1 109 ? 13.635  6.447   19.648  1.000 24.375 0 108 GLY A O    1 ? 
ATOM   1552 H  H    . GLY A 1 109 ? 14.218  9.071   21.104  1.000 23.944 0 108 GLY A H    1 c 
ATOM   1553 H  HA2  . GLY A 1 109 ? 15.899  7.686   20.917  1.000 24.247 0 108 GLY A HA2  1 c 
ATOM   1554 H  HA3  . GLY A 1 109 ? 15.394  6.872   22.198  1.000 24.247 0 108 GLY A HA3  1 c 
ATOM   1555 N  N    . ASP A 1 110 ? 15.168  4.965   20.495  1.000 24.412 0 109 ASP A N    1 ? 
ATOM   1556 C  CA   . ASP A 1 110 ? 14.895  3.853   19.531  1.000 24.900 0 109 ASP A CA   1 ? 
ATOM   1557 C  C    . ASP A 1 110 ? 13.567  3.142   19.870  1.000 22.978 0 109 ASP A C    1 ? 
ATOM   1558 O  O    . ASP A 1 110 ? 13.008  2.463   18.972  1.000 20.062 0 109 ASP A O    1 ? 
ATOM   1559 C  CB   . ASP A 1 110 ? 16.087  2.888   19.404  1.000 28.457 0 109 ASP A CB   1 ? 
ATOM   1560 C  CG   . ASP A 1 110 ? 16.399  2.048   20.628  1.000 31.159 0 109 ASP A CG   1 ? 
ATOM   1561 O  OD1  . ASP A 1 110 ? 16.662  2.635   21.684  1.000 38.134 0 109 ASP A OD1  1 ? 
ATOM   1562 O  OD2  . ASP A 1 110 ? 16.385  0.808   20.513  1.000 37.683 0 109 ASP A OD2  1 ? 
ATOM   1563 H  H    . ASP A 1 110 ? 15.777  4.755   21.138  1.000 24.488 0 109 ASP A H    1 c 
ATOM   1564 H  HA   . ASP A 1 110 ? 14.781  4.268   18.644  1.000 25.059 0 109 ASP A HA   1 c 
ATOM   1565 H  HB2  . ASP A 1 110 ? 15.915  2.278   18.658  1.000 28.192 0 109 ASP A HB2  1 c 
ATOM   1566 H  HB3  . ASP A 1 110 ? 16.887  3.409   19.188  1.000 28.177 0 109 ASP A HB3  1 c 
ATOM   1567 N  N    . HIS A 1 111 ? 13.070  3.282   21.103  1.000 20.327 0 110 HIS A N    1 ? 
ATOM   1568 C  CA   . HIS A 1 111 ? 11.740  2.779   21.543  1.000 21.612 0 110 HIS A CA   1 ? 
ATOM   1569 C  C    . HIS A 1 111 ? 10.660  3.858   21.332  1.000 18.019 0 110 HIS A C    1 ? 
ATOM   1570 O  O    . HIS A 1 111 ? 9.548   3.688   21.883  1.000 16.549 0 110 HIS A O    1 ? 
ATOM   1571 C  CB   . HIS A 1 111 ? 11.793  2.313   23.014  1.000 23.561 0 110 HIS A CB   1 ? 
ATOM   1572 C  CG   . HIS A 1 111 ? 12.778  1.210   23.286  1.000 27.515 0 110 HIS A CG   1 ? 
ATOM   1573 N  ND1  . HIS A 1 111 ? 14.031  1.162   22.693  1.000 29.796 0 110 HIS A ND1  1 ? 
ATOM   1574 C  CD2  . HIS A 1 111 ? 12.713  0.126   24.098  1.000 31.103 0 110 HIS A CD2  1 ? 
ATOM   1575 C  CE1  . HIS A 1 111 ? 14.688  0.099   23.117  1.000 32.646 0 110 HIS A CE1  1 ? 
ATOM   1576 N  NE2  . HIS A 1 111 ? 13.902  -0.556  23.983  1.000 32.894 0 110 HIS A NE2  1 ? 
ATOM   1577 H  H    . HIS A 1 111 ? 13.522  3.696   21.776  1.000 21.257 0 110 HIS A H    1 c 
ATOM   1578 H  HA   . HIS A 1 111 ? 11.508  2.002   20.982  1.000 20.978 0 110 HIS A HA   1 c 
ATOM   1579 H  HB2  . HIS A 1 111 ? 12.021  3.083   23.580  1.000 23.943 0 110 HIS A HB2  1 c 
ATOM   1580 H  HB3  . HIS A 1 111 ? 10.898  2.005   23.279  1.000 23.913 0 110 HIS A HB3  1 c 
ATOM   1581 H  HD1  . HIS A 1 111 ? 14.369  1.745   22.138  0.000 31.130 0 110 HIS A HD1  1 c 
ATOM   1582 H  HD2  . HIS A 1 111 ? 11.988  -0.122  24.640  1.000 30.505 0 110 HIS A HD2  1 c 
ATOM   1583 H  HE1  . HIS A 1 111 ? 15.557  -0.154  22.856  1.000 31.843 0 110 HIS A HE1  1 c 
ATOM   1584 H  HE2  . HIS A 1 111 ? 14.097  -1.303  24.408  0.000 34.080 0 110 HIS A HE2  1 c 
ATOM   1585 N  N    . CYS A 1 112 ? 10.955  4.942   20.597  1.000 16.754 0 111 CYS A N    1 ? 
ATOM   1586 C  CA   . CYS A 1 112 ? 10.054  6.118   20.507  1.000 16.625 0 111 CYS A CA   1 ? 
ATOM   1587 C  C    . CYS A 1 112 ? 8.820   5.750   19.671  1.000 16.468 0 111 CYS A C    1 ? 
ATOM   1588 O  O    . CYS A 1 112 ? 9.025   5.171   18.557  1.000 18.080 0 111 CYS A O    1 ? 
ATOM   1589 C  CB   . CYS A 1 112 ? 10.740  7.371   19.973  1.000 16.785 0 111 CYS A CB   1 ? 
ATOM   1590 S  SG   . CYS A 1 112 ? 9.642   8.813   19.972  1.000 17.328 0 111 CYS A SG   1 ? 
ATOM   1591 H  H    . CYS A 1 112 ? 11.716  5.039   20.100  1.000 17.032 0 111 CYS A H    1 c 
ATOM   1592 H  HA   . CYS A 1 112 ? 9.750   6.318   21.426  1.000 16.641 0 111 CYS A HA   1 c 
ATOM   1593 H  HB2  . CYS A 1 112 ? 11.530  7.574   20.531  1.000 16.897 0 111 CYS A HB2  1 c 
ATOM   1594 H  HB3  . CYS A 1 112 ? 11.050  7.206   19.049  1.000 16.879 0 111 CYS A HB3  1 c 
ATOM   1595 H  HG   . CYS A 1 112 ? 10.410  9.596   19.543  0.000 17.580 0 111 CYS A HG   1 c 
ATOM   1596 N  N    . ILE A 1 113 ? 7.618   6.040   20.209  1.000 14.674 0 112 ILE A N    1 ? 
ATOM   1597 C  CA   . ILE A 1 113 ? 6.285   5.704   19.601  1.000 13.185 0 112 ILE A CA   1 ? 
ATOM   1598 C  C    . ILE A 1 113 ? 5.675   6.938   18.931  1.000 13.550 0 112 ILE A C    1 ? 
ATOM   1599 O  O    . ILE A 1 113 ? 4.571   6.834   18.347  1.000 11.942 0 112 ILE A O    1 ? 
ATOM   1600 C  CB   . ILE A 1 113 ? 5.335   5.048   20.628  1.000 13.734 0 112 ILE A CB   1 ? 
ATOM   1601 C  CG1  . ILE A 1 113 ? 4.928   6.020   21.745  1.000 13.893 0 112 ILE A CG1  1 ? 
ATOM   1602 C  CG2  . ILE A 1 113 ? 5.981   3.766   21.153  1.000 13.628 0 112 ILE A CG2  1 ? 
ATOM   1603 C  CD1  . ILE A 1 113 ? 3.856   5.527   22.670  1.000 13.440 0 112 ILE A CD1  1 ? 
ATOM   1604 H  H    . ILE A 1 113 ? 7.542   6.482   21.001  1.000 14.703 0 112 ILE A H    1 c 
ATOM   1605 H  HA   . ILE A 1 113 ? 6.445   5.046   18.901  1.000 13.644 0 112 ILE A HA   1 c 
ATOM   1606 H  HB   . ILE A 1 113 ? 4.511   4.791   20.145  1.000 13.638 0 112 ILE A HB   1 c 
ATOM   1607 H  HG12 . ILE A 1 113 ? 5.724   6.228   22.280  1.000 13.752 0 112 ILE A HG12 1 c 
ATOM   1608 H  HG13 . ILE A 1 113 ? 4.620   6.856   21.335  1.000 13.749 0 112 ILE A HG13 1 c 
ATOM   1609 H  HG21 . ILE A 1 113 ? 6.232   3.198   20.404  1.000 13.661 0 112 ILE A HG21 1 c 
ATOM   1610 H  HG22 . ILE A 1 113 ? 5.349   3.291   21.720  1.000 13.660 0 112 ILE A HG22 1 c 
ATOM   1611 H  HG23 . ILE A 1 113 ? 6.775   3.988   21.669  1.000 13.662 0 112 ILE A HG23 1 c 
ATOM   1612 H  HD11 . ILE A 1 113 ? 3.065   5.292   22.155  1.000 13.581 0 112 ILE A HD11 1 c 
ATOM   1613 H  HD12 . ILE A 1 113 ? 3.630   6.226   23.308  1.000 13.581 0 112 ILE A HD12 1 c 
ATOM   1614 H  HD13 . ILE A 1 113 ? 4.174   4.743   23.150  1.000 13.581 0 112 ILE A HD13 1 c 
ATOM   1615 N  N    . ILE A 1 114 ? 6.336   8.091   19.000  1.000 12.841 0 113 ILE A N    1 ? 
ATOM   1616 C  CA   . ILE A 1 114 ? 5.765   9.319   18.388  1.000 13.223 0 113 ILE A CA   1 ? 
ATOM   1617 C  C    . ILE A 1 114 ? 5.864   9.141   16.868  1.000 12.262 0 113 ILE A C    1 ? 
ATOM   1618 O  O    . ILE A 1 114 ? 6.878   8.591   16.394  1.000 11.225 0 113 ILE A O    1 ? 
ATOM   1619 C  CB   . ILE A 1 114 ? 6.439   10.594  18.912  1.000 15.386 0 113 ILE A CB   1 ? 
ATOM   1620 C  CG1  . ILE A 1 114 ? 5.973   10.880  20.349  1.000 16.906 0 113 ILE A CG1  1 ? 
ATOM   1621 C  CG2  . ILE A 1 114 ? 6.162   11.760  17.963  1.000 14.938 0 113 ILE A CG2  1 ? 
ATOM   1622 C  CD1  . ILE A 1 114 ? 6.652   12.050  20.993  1.000 18.260 0 113 ILE A CD1  1 ? 
ATOM   1623 H  H    . ILE A 1 114 ? 7.145   8.199   19.404  1.000 13.114 0 113 ILE A H    1 c 
ATOM   1624 H  HA   . ILE A 1 114 ? 4.822   9.363   18.626  1.000 13.336 0 113 ILE A HA   1 c 
ATOM   1625 H  HB   . ILE A 1 114 ? 7.416   10.439  18.932  1.000 15.131 0 113 ILE A HB   1 c 
ATOM   1626 H  HG12 . ILE A 1 114 ? 5.006   11.045  20.338  1.000 16.836 0 113 ILE A HG12 1 c 
ATOM   1627 H  HG13 . ILE A 1 114 ? 6.135   10.082  20.896  1.000 16.837 0 113 ILE A HG13 1 c 
ATOM   1628 H  HG21 . ILE A 1 114 ? 6.571   11.584  17.098  1.000 15.072 0 113 ILE A HG21 1 c 
ATOM   1629 H  HG22 . ILE A 1 114 ? 6.537   12.578  18.332  1.000 15.087 0 113 ILE A HG22 1 c 
ATOM   1630 H  HG23 . ILE A 1 114 ? 5.202   11.868  17.850  1.000 15.077 0 113 ILE A HG23 1 c 
ATOM   1631 H  HD11 . ILE A 1 114 ? 7.617   11.956  20.906  1.000 17.824 0 113 ILE A HD11 1 c 
ATOM   1632 H  HD12 . ILE A 1 114 ? 6.414   12.084  21.937  1.000 17.824 0 113 ILE A HD12 1 c 
ATOM   1633 H  HD13 . ILE A 1 114 ? 6.366   12.871  20.560  1.000 17.805 0 113 ILE A HD13 1 c 
ATOM   1634 N  N    . GLY A 1 115 ? 4.803   9.491   16.136  1.000 11.048 0 114 GLY A N    1 ? 
ATOM   1635 C  CA   . GLY A 1 115 ? 4.771   9.267   14.672  1.000 10.972 0 114 GLY A CA   1 ? 
ATOM   1636 C  C    . GLY A 1 115 ? 4.363   7.834   14.272  1.000 11.036 0 114 GLY A C    1 ? 
ATOM   1637 O  O    . GLY A 1 115 ? 4.398   7.533   13.047  1.000 10.672 0 114 GLY A O    1 ? 
ATOM   1638 H  H    . GLY A 1 115 ? 4.059   9.880   16.491  1.000 11.310 0 114 GLY A H    1 c 
ATOM   1639 H  HA2  . GLY A 1 115 ? 4.133   9.907   14.268  1.000 11.008 0 114 GLY A HA2  1 c 
ATOM   1640 H  HA3  . GLY A 1 115 ? 5.666   9.463   14.299  1.000 11.018 0 114 GLY A HA3  1 c 
ATOM   1641 N  N    . ARG A 1 116 ? 3.981   6.965   15.209  1.000 11.646 0 115 ARG A N    1 ? 
ATOM   1642 C  CA   . ARG A 1 116 ? 3.487   5.586   14.910  1.000 11.782 0 115 ARG A CA   1 ? 
ATOM   1643 C  C    . ARG A 1 116 ? 1.972   5.566   15.182  1.000 10.691 0 115 ARG A C    1 ? 
ATOM   1644 O  O    . ARG A 1 116 ? 1.425   6.648   15.469  1.000 11.320 0 115 ARG A O    1 ? 
ATOM   1645 C  CB   . ARG A 1 116 ? 4.322   4.539   15.675  1.000 12.533 0 115 ARG A CB   1 ? 
ATOM   1646 C  CG   . ARG A 1 116 ? 5.815   4.845   15.741  1.000 13.604 0 115 ARG A CG   1 ? 
ATOM   1647 C  CD   . ARG A 1 116 ? 6.714   3.660   16.040  1.000 13.908 0 115 ARG A CD   1 ? 
ATOM   1648 N  NE   . ARG A 1 116 ? 8.145   3.899   15.849  1.000 13.887 0 115 ARG A NE   1 ? 
ATOM   1649 C  CZ   . ARG A 1 116 ? 8.860   3.643   14.749  1.000 15.399 0 115 ARG A CZ   1 ? 
ATOM   1650 N  NH1  . ARG A 1 116 ? 8.292   3.175   13.649  1.000 15.287 0 115 ARG A NH1  1 ? 
ATOM   1651 N  NH2  . ARG A 1 116 ? 10.163  3.892   14.745  1.000 15.916 0 115 ARG A NH2  1 ? 
ATOM   1652 H  H    . ARG A 1 116 ? 3.994   7.162   16.101  1.000 11.531 0 115 ARG A H    1 c 
ATOM   1653 H  HA   . ARG A 1 116 ? 3.617   5.424   13.943  1.000 11.674 0 115 ARG A HA   1 c 
ATOM   1654 H  HB2  . ARG A 1 116 ? 3.970   4.468   16.596  1.000 12.593 0 115 ARG A HB2  1 c 
ATOM   1655 H  HB3  . ARG A 1 116 ? 4.201   3.662   15.235  1.000 12.592 0 115 ARG A HB3  1 c 
ATOM   1656 H  HG2  . ARG A 1 116 ? 6.096   5.238   14.878  1.000 13.409 0 115 ARG A HG2  1 c 
ATOM   1657 H  HG3  . ARG A 1 116 ? 5.965   5.531   16.438  1.000 13.407 0 115 ARG A HG3  1 c 
ATOM   1658 H  HD2  . ARG A 1 116 ? 6.566   3.386   16.979  1.000 13.833 0 115 ARG A HD2  1 c 
ATOM   1659 H  HD3  . ARG A 1 116 ? 6.438   2.902   15.469  1.000 13.838 0 115 ARG A HD3  1 c 
ATOM   1660 H  HE   . ARG A 1 116 ? 8.600   4.210   16.560  1.000 14.310 0 115 ARG A HE   1 c 
ATOM   1661 H  HH11 . ARG A 1 116 ? 7.412   2.995   13.633  1.000 15.281 0 115 ARG A HH11 1 c 
ATOM   1662 H  HH12 . ARG A 1 116 ? 8.794   3.020   12.919  1.000 15.285 0 115 ARG A HH12 1 c 
ATOM   1663 H  HH21 . ARG A 1 116 ? 10.559  4.223   15.481  1.000 15.667 0 115 ARG A HH21 1 c 
ATOM   1664 H  HH22 . ARG A 1 116 ? 10.647  3.741   14.002  1.000 15.667 0 115 ARG A HH22 1 c 
ATOM   1665 N  N    . THR A 1 117 ? 1.279   4.439   14.993  1.000 12.104 0 116 THR A N    1 ? 
ATOM   1666 C  CA   . THR A 1 117 ? -0.207  4.367   15.064  1.000 13.004 0 116 THR A CA   1 ? 
ATOM   1667 C  C    . THR A 1 117 ? -0.642  3.521   16.265  1.000 12.513 0 116 THR A C    1 ? 
ATOM   1668 O  O    . THR A 1 117 ? -0.188  2.332   16.383  1.000 13.335 0 116 THR A O    1 ? 
ATOM   1669 C  CB   . THR A 1 117 ? -0.810  3.773   13.779  1.000 14.743 0 116 THR A CB   1 ? 
ATOM   1670 O  OG1  . THR A 1 117 ? -0.492  4.634   12.679  1.000 15.244 0 116 THR A OG1  1 ? 
ATOM   1671 C  CG2  . THR A 1 117 ? -2.306  3.571   13.884  1.000 14.931 0 116 THR A CG2  1 ? 
ATOM   1672 H  H    . THR A 1 117 ? 1.665   3.632   14.807  1.000 11.955 0 116 THR A H    1 c 
ATOM   1673 H  HA   . THR A 1 117 ? -0.555  5.286   15.179  1.000 13.032 0 116 THR A HA   1 c 
ATOM   1674 H  HB   . THR A 1 117 ? -0.385  2.894   13.622  1.000 14.512 0 116 THR A HB   1 c 
ATOM   1675 H  HG1  . THR A 1 117 ? -0.868  4.365   11.972  0.000 15.310 0 116 THR A HG1  1 c 
ATOM   1676 H  HG21 . THR A 1 117 ? -2.506  2.913   14.594  1.000 14.866 0 116 THR A HG21 1 c 
ATOM   1677 H  HG22 . THR A 1 117 ? -2.655  3.237   13.021  1.000 14.870 0 116 THR A HG22 1 c 
ATOM   1678 H  HG23 . THR A 1 117 ? -2.740  4.433   14.102  1.000 14.868 0 116 THR A HG23 1 c 
ATOM   1679 N  N    . LEU A 1 118 ? -1.513  4.071   17.111  1.000 12.639 0 117 LEU A N    1 ? 
ATOM   1680 C  CA   . LEU A 1 118 ? -2.182  3.300   18.186  1.000 12.350 0 117 LEU A CA   1 ? 
ATOM   1681 C  C    . LEU A 1 118 ? -3.453  2.665   17.592  1.000 12.355 0 117 LEU A C    1 ? 
ATOM   1682 O  O    . LEU A 1 118 ? -4.179  3.405   16.913  1.000 13.835 0 117 LEU A O    1 ? 
ATOM   1683 C  CB   . LEU A 1 118 ? -2.542  4.261   19.320  1.000 12.947 0 117 LEU A CB   1 ? 
ATOM   1684 C  CG   . LEU A 1 118 ? -3.110  3.596   20.563  1.000 12.975 0 117 LEU A CG   1 ? 
ATOM   1685 C  CD1  . LEU A 1 118 ? -2.076  2.643   21.178  1.000 13.423 0 117 LEU A CD1  1 ? 
ATOM   1686 C  CD2  . LEU A 1 118 ? -3.558  4.651   21.556  1.000 13.341 0 117 LEU A CD2  1 ? 
ATOM   1687 H  H    . LEU A 1 118 ? -1.749  4.951   17.078  1.000 12.545 0 117 LEU A H    1 c 
ATOM   1688 H  HA   . LEU A 1 118 ? -1.576  2.595   18.508  1.000 12.523 0 117 LEU A HA   1 c 
ATOM   1689 H  HB2  . LEU A 1 118 ? -1.738  4.757   19.571  1.000 12.812 0 117 LEU A HB2  1 c 
ATOM   1690 H  HB3  . LEU A 1 118 ? -3.196  4.905   18.984  1.000 12.813 0 117 LEU A HB3  1 c 
ATOM   1691 H  HG   . LEU A 1 118 ? -3.901  3.065   20.299  1.000 13.122 0 117 LEU A HG   1 c 
ATOM   1692 H  HD11 . LEU A 1 118 ? -1.956  1.873   20.597  1.000 13.280 0 117 LEU A HD11 1 c 
ATOM   1693 H  HD12 . LEU A 1 118 ? -2.389  2.345   22.050  1.000 13.284 0 117 LEU A HD12 1 c 
ATOM   1694 H  HD13 . LEU A 1 118 ? -1.227  3.108   21.281  1.000 13.284 0 117 LEU A HD13 1 c 
ATOM   1695 H  HD21 . LEU A 1 118 ? -2.799  5.206   21.806  1.000 13.230 0 117 LEU A HD21 1 c 
ATOM   1696 H  HD22 . LEU A 1 118 ? -3.919  4.219   22.350  1.000 13.231 0 117 LEU A HD22 1 c 
ATOM   1697 H  HD23 . LEU A 1 118 ? -4.245  5.208   21.151  1.000 13.229 0 117 LEU A HD23 1 c 
ATOM   1698 N  N    . VAL A 1 119 ? -3.709  1.383   17.865  1.000 11.820 0 118 VAL A N    1 ? 
ATOM   1699 C  CA   . VAL A 1 119 ? -4.857  0.609   17.302  1.000 11.757 0 118 VAL A CA   1 ? 
ATOM   1700 C  C    . VAL A 1 119 ? -5.661  -0.074  18.426  1.000 13.353 0 118 VAL A C    1 ? 
ATOM   1701 O  O    . VAL A 1 119 ? -5.019  -0.705  19.300  1.000 13.720 0 118 VAL A O    1 ? 
ATOM   1702 C  CB   . VAL A 1 119 ? -4.362  -0.437  16.276  1.000 11.711 0 118 VAL A CB   1 ? 
ATOM   1703 C  CG1  . VAL A 1 119 ? -5.535  -1.254  15.732  1.000 10.447 0 118 VAL A CG1  1 ? 
ATOM   1704 C  CG2  . VAL A 1 119 ? -3.578  0.176   15.114  1.000 11.533 0 118 VAL A CG2  1 ? 
ATOM   1705 H  H    . VAL A 1 119 ? -3.186  0.890   18.425  1.000 11.931 0 118 VAL A H    1 c 
ATOM   1706 H  HA   . VAL A 1 119 ? -5.447  1.232   16.841  1.000 12.056 0 118 VAL A HA   1 c 
ATOM   1707 H  HB   . VAL A 1 119 ? -3.758  -1.058  16.754  1.000 11.433 0 118 VAL A HB   1 c 
ATOM   1708 H  HG11 . VAL A 1 119 ? -5.896  -1.820  16.437  1.000 10.828 0 118 VAL A HG11 1 c 
ATOM   1709 H  HG12 . VAL A 1 119 ? -5.228  -1.813  14.996  1.000 10.835 0 118 VAL A HG12 1 c 
ATOM   1710 H  HG13 . VAL A 1 119 ? -6.230  -0.652  15.411  1.000 10.824 0 118 VAL A HG13 1 c 
ATOM   1711 H  HG21 . VAL A 1 119 ? -4.136  0.826   14.653  1.000 11.591 0 118 VAL A HG21 1 c 
ATOM   1712 H  HG22 . VAL A 1 119 ? -3.317  -0.526  14.492  1.000 11.585 0 118 VAL A HG22 1 c 
ATOM   1713 H  HG23 . VAL A 1 119 ? -2.781  0.618   15.455  1.000 11.586 0 118 VAL A HG23 1 c 
ATOM   1714 N  N    . VAL A 1 120 ? -7.011  0.001   18.378  1.000 13.513 0 119 VAL A N    1 ? 
ATOM   1715 C  CA   . VAL A 1 120 ? -7.914  -0.817  19.243  1.000 14.541 0 119 VAL A CA   1 ? 
ATOM   1716 C  C    . VAL A 1 120 ? -8.636  -1.821  18.331  1.000 14.503 0 119 VAL A C    1 ? 
ATOM   1717 O  O    . VAL A 1 120 ? -9.075  -1.413  17.229  1.000 14.413 0 119 VAL A O    1 ? 
ATOM   1718 C  CB   . VAL A 1 120 ? -8.858  0.047   20.111  1.000 14.591 0 119 VAL A CB   1 ? 
ATOM   1719 C  CG1  . VAL A 1 120 ? -9.773  0.960   19.296  1.000 14.140 0 119 VAL A CG1  1 ? 
ATOM   1720 C  CG2  . VAL A 1 120 ? -9.683  -0.787  21.073  1.000 16.379 0 119 VAL A CG2  1 ? 
ATOM   1721 H  H    . VAL A 1 120 ? -7.454  0.551   17.803  1.000 13.707 0 119 VAL A H    1 c 
ATOM   1722 H  HA   . VAL A 1 120 ? -7.351  -1.326  19.850  1.000 14.337 0 119 VAL A HA   1 c 
ATOM   1723 H  HB   . VAL A 1 120 ? -8.280  0.633   20.660  1.000 14.818 0 119 VAL A HB   1 c 
ATOM   1724 H  HG11 . VAL A 1 120 ? -9.234  1.569   18.762  1.000 14.277 0 119 VAL A HG11 1 c 
ATOM   1725 H  HG12 . VAL A 1 120 ? -10.339 1.473   19.899  1.000 14.279 0 119 VAL A HG12 1 c 
ATOM   1726 H  HG13 . VAL A 1 120 ? -10.331 0.422   18.709  1.000 14.279 0 119 VAL A HG13 1 c 
ATOM   1727 H  HG21 . VAL A 1 120 ? -10.283 -1.366  20.572  1.000 15.804 0 119 VAL A HG21 1 c 
ATOM   1728 H  HG22 . VAL A 1 120 ? -10.205 -0.200  21.647  1.000 15.805 0 119 VAL A HG22 1 c 
ATOM   1729 H  HG23 . VAL A 1 120 ? -9.091  -1.332  21.621  1.000 15.806 0 119 VAL A HG23 1 c 
ATOM   1730 N  N    . HIS A 1 121 ? -8.614  -3.098  18.735  1.000 15.415 0 120 HIS A N    1 ? 
ATOM   1731 C  CA   . HIS A 1 121 ? -8.998  -4.274  17.903  1.000 15.226 0 120 HIS A CA   1 ? 
ATOM   1732 C  C    . HIS A 1 121 ? -10.375 -4.840  18.242  1.000 16.338 0 120 HIS A C    1 ? 
ATOM   1733 O  O    . HIS A 1 121 ? -10.963 -4.555  19.318  1.000 15.706 0 120 HIS A O    1 ? 
ATOM   1734 C  CB   . HIS A 1 121 ? -7.947  -5.380  18.031  1.000 15.381 0 120 HIS A CB   1 ? 
ATOM   1735 C  CG   . HIS A 1 121 ? -6.695  -5.121  17.271  1.000 14.240 0 120 HIS A CG   1 ? 
ATOM   1736 N  ND1  . HIS A 1 121 ? -6.559  -5.521  15.957  1.000 15.961 0 120 HIS A ND1  1 ? 
ATOM   1737 C  CD2  . HIS A 1 121 ? -5.542  -4.499  17.613  1.000 14.204 0 120 HIS A CD2  1 ? 
ATOM   1738 C  CE1  . HIS A 1 121 ? -5.366  -5.200  15.522  1.000 14.867 0 120 HIS A CE1  1 ? 
ATOM   1739 N  NE2  . HIS A 1 121 ? -4.722  -4.536  16.518  1.000 15.530 0 120 HIS A NE2  1 ? 
ATOM   1740 H  H    . HIS A 1 121 ? -8.362  -3.342  19.576  1.000 15.148 0 120 HIS A H    1 c 
ATOM   1741 H  HA   . HIS A 1 121 ? -9.017  -3.979  16.963  1.000 15.503 0 120 HIS A HA   1 c 
ATOM   1742 H  HB2  . HIS A 1 121 ? -7.722  -5.495  18.981  1.000 15.071 0 120 HIS A HB2  1 c 
ATOM   1743 H  HB3  . HIS A 1 121 ? -8.336  -6.225  17.715  1.000 15.084 0 120 HIS A HB3  1 c 
ATOM   1744 H  HD1  . HIS A 1 121 ? -7.142  -5.940  15.477  0.000 15.390 0 120 HIS A HD1  1 c 
ATOM   1745 H  HD2  . HIS A 1 121 ? -5.340  -4.109  18.444  1.000 14.548 0 120 HIS A HD2  1 c 
ATOM   1746 H  HE1  . HIS A 1 121 ? -5.034  -5.357  14.655  1.000 15.244 0 120 HIS A HE1  1 c 
ATOM   1747 H  HE2  . HIS A 1 121 ? -3.910  -4.173  16.496  0.000 14.980 0 120 HIS A HE2  1 c 
ATOM   1748 N  N    . GLU A 1 122 ? -10.857 -5.664  17.317  1.000 16.926 0 121 GLU A N    1 ? 
ATOM   1749 C  CA   . GLU A 1 122 ? -12.173 -6.336  17.387  1.000 17.664 0 121 GLU A CA   1 ? 
ATOM   1750 C  C    . GLU A 1 122 ? -12.216 -7.341  18.558  1.000 17.737 0 121 GLU A C    1 ? 
ATOM   1751 O  O    . GLU A 1 122 ? -13.197 -7.298  19.343  1.000 16.602 0 121 GLU A O    1 ? 
ATOM   1752 C  CB   . GLU A 1 122 ? -12.426 -6.965  16.024  1.000 19.864 0 121 GLU A CB   1 ? 
ATOM   1753 C  CG   . GLU A 1 122 ? -13.665 -7.823  15.993  1.000 21.971 0 121 GLU A CG   1 ? 
ATOM   1754 C  CD   . GLU A 1 122 ? -13.727 -8.799  14.829  1.000 27.173 0 121 GLU A CD   1 ? 
ATOM   1755 O  OE1  . GLU A 1 122 ? -14.838 -9.354  14.639  1.000 28.553 0 121 GLU A OE1  1 ? 
ATOM   1756 O  OE2  . GLU A 1 122 ? -12.669 -9.027  14.118  1.000 25.135 0 121 GLU A OE2  1 ? 
ATOM   1757 H  H    . GLU A 1 122 ? -10.388 -5.866  16.563  1.000 16.953 0 121 GLU A H    1 c 
ATOM   1758 H  HA   . GLU A 1 122 ? -12.858 -5.649  17.545  1.000 17.929 0 121 GLU A HA   1 c 
ATOM   1759 H  HB2  . GLU A 1 122 ? -12.514 -6.251  15.361  1.000 19.803 0 121 GLU A HB2  1 c 
ATOM   1760 H  HB3  . GLU A 1 122 ? -11.650 -7.513  15.781  1.000 19.802 0 121 GLU A HB3  1 c 
ATOM   1761 H  HG2  . GLU A 1 122 ? -13.724 -8.335  16.826  1.000 22.537 0 121 GLU A HG2  1 c 
ATOM   1762 H  HG3  . GLU A 1 122 ? -14.453 -7.240  15.950  1.000 22.555 0 121 GLU A HG3  1 c 
ATOM   1763 N  N    . LYS A 1 123 ? -11.192 -8.190  18.679  1.000 19.207 0 122 LYS A N    1 ? 
ATOM   1764 C  CA   . LYS A 1 123 ? -11.136 -9.365  19.588  1.000 20.419 0 122 LYS A CA   1 ? 
ATOM   1765 C  C    . LYS A 1 123 ? -10.101 -9.118  20.698  1.000 19.226 0 122 LYS A C    1 ? 
ATOM   1766 O  O    . LYS A 1 123 ? -9.350  -8.125  20.610  1.000 18.412 0 122 LYS A O    1 ? 
ATOM   1767 C  CB   . LYS A 1 123 ? -10.785 -10.624 18.789  1.000 21.821 0 122 LYS A CB   1 ? 
ATOM   1768 C  CG   . LYS A 1 123 ? -11.700 -10.884 17.606  1.000 22.980 0 122 LYS A CG   1 ? 
ATOM   1769 C  CD   . LYS A 1 123 ? -11.330 -12.089 16.804  1.000 26.909 0 122 LYS A CD   1 ? 
ATOM   1770 C  CE   . LYS A 1 123 ? -12.137 -12.200 15.527  1.000 30.228 0 122 LYS A CE   1 ? 
ATOM   1771 N  NZ   . LYS A 1 123 ? -11.672 -13.321 14.678  1.000 31.228 0 122 LYS A NZ   1 ? 
ATOM   1772 H  H    . LYS A 1 123 ? -10.433 -8.095  18.185  1.000 19.118 0 122 LYS A H    1 c 
ATOM   1773 H  HA   . LYS A 1 123 ? -12.022 -9.486  20.001  1.000 20.194 0 122 LYS A HA   1 c 
ATOM   1774 H  HB2  . LYS A 1 123 ? -9.865  -10.545 18.466  1.000 21.727 0 122 LYS A HB2  1 c 
ATOM   1775 H  HB3  . LYS A 1 123 ? -10.826 -11.396 19.391  1.000 21.742 0 122 LYS A HB3  1 c 
ATOM   1776 H  HG2  . LYS A 1 123 ? -12.617 -10.992 17.937  1.000 23.563 0 122 LYS A HG2  1 c 
ATOM   1777 H  HG3  . LYS A 1 123 ? -11.686 -10.099 17.019  1.000 23.565 0 122 LYS A HG3  1 c 
ATOM   1778 H  HD2  . LYS A 1 123 ? -10.377 -12.046 16.577  1.000 26.647 0 122 LYS A HD2  1 c 
ATOM   1779 H  HD3  . LYS A 1 123 ? -11.478 -12.894 17.345  1.000 26.647 0 122 LYS A HD3  1 c 
ATOM   1780 H  HE2  . LYS A 1 123 ? -13.079 -12.337 15.746  1.000 29.634 0 122 LYS A HE2  1 c 
ATOM   1781 H  HE3  . LYS A 1 123 ? -12.063 -11.369 15.022  1.000 29.613 0 122 LYS A HE3  1 c 
ATOM   1782 H  HZ1  . LYS A 1 123 ? -10.803 -13.193 14.449  1.000 30.919 0 122 LYS A HZ1  1 c 
ATOM   1783 H  HZ2  . LYS A 1 123 ? -12.174 -13.365 13.924  1.000 30.919 0 122 LYS A HZ2  1 c 
ATOM   1784 H  HZ3  . LYS A 1 123 ? -11.748 -14.102 15.131  1.000 30.919 0 122 LYS A HZ3  1 c 
ATOM   1785 N  N    . ALA A 1 124 ? -10.066 -9.990  21.702  1.000 19.645 0 123 ALA A N    1 ? 
ATOM   1786 C  CA   . ALA A 1 124 ? -9.044  -9.938  22.779  1.000 20.649 0 123 ALA A CA   1 ? 
ATOM   1787 C  C    . ALA A 1 124 ? -7.683  -10.390 22.218  1.000 19.481 0 123 ALA A C    1 ? 
ATOM   1788 O  O    . ALA A 1 124 ? -7.626  -11.305 21.351  1.000 18.523 0 123 ALA A O    1 ? 
ATOM   1789 C  CB   . ALA A 1 124 ? -9.482  -10.768 23.965  1.000 21.876 0 123 ALA A CB   1 ? 
ATOM   1790 H  H    . ALA A 1 124 ? -10.656 -10.677 21.803  1.000 19.786 0 123 ALA A H    1 c 
ATOM   1791 H  HA   . ALA A 1 124 ? -8.958  -9.001  23.072  1.000 20.441 0 123 ALA A HA   1 c 
ATOM   1792 H  HB1  . ALA A 1 124 ? -8.805  -10.722 24.662  1.000 21.489 0 123 ALA A HB1  1 c 
ATOM   1793 H  HB2  . ALA A 1 124 ? -10.323 -10.425 24.310  1.000 21.489 0 123 ALA A HB2  1 c 
ATOM   1794 H  HB3  . ALA A 1 124 ? -9.599  -11.693 23.690  1.000 21.486 0 123 ALA A HB3  1 c 
ATOM   1795 N  N    . ASP A 1 125 ? -6.605  -9.773  22.709  1.000 18.867 0 124 ASP A N    1 ? 
ATOM   1796 C  CA   . ASP A 1 125 ? -5.211  -10.227 22.476  1.000 17.789 0 124 ASP A CA   1 ? 
ATOM   1797 C  C    . ASP A 1 125 ? -4.955  -11.426 23.404  1.000 17.346 0 124 ASP A C    1 ? 
ATOM   1798 O  O    . ASP A 1 125 ? -5.180  -11.281 24.612  1.000 17.438 0 124 ASP A O    1 ? 
ATOM   1799 C  CB   . ASP A 1 125 ? -4.268  -9.038  22.664  1.000 17.589 0 124 ASP A CB   1 ? 
ATOM   1800 C  CG   . ASP A 1 125 ? -2.782  -9.288  22.437  1.000 16.807 0 124 ASP A CG   1 ? 
ATOM   1801 O  OD1  . ASP A 1 125 ? -2.362  -10.470 22.259  1.000 15.502 0 124 ASP A OD1  1 ? 
ATOM   1802 O  OD2  . ASP A 1 125 ? -2.046  -8.281  22.452  1.000 18.737 0 124 ASP A OD2  1 ? 
ATOM   1803 H  H    . ASP A 1 125 ? -6.665  -9.023  23.221  1.000 18.748 0 124 ASP A H    1 c 
ATOM   1804 H  HA   . ASP A 1 125 ? -5.138  -10.532 21.541  1.000 17.866 0 124 ASP A HA   1 c 
ATOM   1805 H  HB2  . ASP A 1 125 ? -4.546  -8.326  22.052  1.000 17.450 0 124 ASP A HB2  1 c 
ATOM   1806 H  HB3  . ASP A 1 125 ? -4.374  -8.704  23.578  1.000 17.452 0 124 ASP A HB3  1 c 
ATOM   1807 N  N    . ASP A 1 126 ? -4.556  -12.572 22.842  1.000 17.264 0 125 ASP A N    1 ? 
ATOM   1808 C  CA   . ASP A 1 126 ? -4.205  -13.818 23.596  1.000 17.041 0 125 ASP A CA   1 ? 
ATOM   1809 C  C    . ASP A 1 126 ? -2.761  -13.790 24.138  1.000 18.051 0 125 ASP A C    1 ? 
ATOM   1810 O  O    . ASP A 1 126 ? -2.368  -14.810 24.735  1.000 17.571 0 125 ASP A O    1 ? 
ATOM   1811 C  CB   . ASP A 1 126 ? -4.450  -15.078 22.756  1.000 18.921 0 125 ASP A CB   1 ? 
ATOM   1812 C  CG   . ASP A 1 126 ? -3.468  -15.307 21.609  1.000 18.755 0 125 ASP A CG   1 ? 
ATOM   1813 O  OD1  . ASP A 1 126 ? -2.336  -14.733 21.659  1.000 16.381 0 125 ASP A OD1  1 ? 
ATOM   1814 O  OD2  . ASP A 1 126 ? -3.837  -16.081 20.670  1.000 22.571 0 125 ASP A OD2  1 ? 
ATOM   1815 H  H    . ASP A 1 126 ? -4.470  -12.663 21.940  1.000 17.240 0 125 ASP A H    1 c 
ATOM   1816 H  HA   . ASP A 1 126 ? -4.811  -13.869 24.372  1.000 17.620 0 125 ASP A HA   1 c 
ATOM   1817 H  HB2  . ASP A 1 126 ? -4.413  -15.859 23.345  1.000 18.429 0 125 ASP A HB2  1 c 
ATOM   1818 H  HB3  . ASP A 1 126 ? -5.351  -15.029 22.377  1.000 18.449 0 125 ASP A HB3  1 c 
ATOM   1819 N  N    . LEU A 1 127 ? -2.005  -12.692 23.978  1.000 18.375 0 126 LEU A N    1 ? 
ATOM   1820 C  CA   . LEU A 1 127 ? -0.676  -12.443 24.633  1.000 18.509 0 126 LEU A CA   1 ? 
ATOM   1821 C  C    . LEU A 1 127 ? 0.355   -13.539 24.302  1.000 21.325 0 126 LEU A C    1 ? 
ATOM   1822 O  O    . LEU A 1 127 ? 1.317   -13.705 25.081  1.000 19.746 0 126 LEU A O    1 ? 
ATOM   1823 C  CB   . LEU A 1 127 ? -0.872  -12.300 26.157  1.000 17.934 0 126 LEU A CB   1 ? 
ATOM   1824 C  CG   . LEU A 1 127 ? -2.039  -11.419 26.606  1.000 17.657 0 126 LEU A CG   1 ? 
ATOM   1825 C  CD1  . LEU A 1 127 ? -2.146  -11.378 28.128  1.000 17.443 0 126 LEU A CD1  1 ? 
ATOM   1826 C  CD2  . LEU A 1 127 ? -1.947  -9.990  26.080  1.000 18.344 0 126 LEU A CD2  1 ? 
ATOM   1827 H  H    . LEU A 1 127 ? -2.256  -12.011 23.430  1.000 18.324 0 126 LEU A H    1 c 
ATOM   1828 H  HA   . LEU A 1 127 ? -0.330  -11.590 24.282  1.000 18.876 0 126 LEU A HA   1 c 
ATOM   1829 H  HB2  . LEU A 1 127 ? -0.998  -13.193 26.535  1.000 18.039 0 126 LEU A HB2  1 c 
ATOM   1830 H  HB3  . LEU A 1 127 ? -0.049  -11.934 26.537  1.000 18.038 0 126 LEU A HB3  1 c 
ATOM   1831 H  HG   . LEU A 1 127 ? -2.874  -11.817 26.256  1.000 17.798 0 126 LEU A HG   1 c 
ATOM   1832 H  HD11 . LEU A 1 127 ? -2.221  -12.285 28.471  1.000 17.508 0 126 LEU A HD11 1 c 
ATOM   1833 H  HD12 . LEU A 1 127 ? -2.934  -10.868 28.385  1.000 17.512 0 126 LEU A HD12 1 c 
ATOM   1834 H  HD13 . LEU A 1 127 ? -1.352  -10.956 28.498  1.000 17.508 0 126 LEU A HD13 1 c 
ATOM   1835 H  HD21 . LEU A 1 127 ? -1.124  -9.580  26.398  1.000 18.124 0 126 LEU A HD21 1 c 
ATOM   1836 H  HD22 . LEU A 1 127 ? -2.709  -9.477  26.399  1.000 18.127 0 126 LEU A HD22 1 c 
ATOM   1837 H  HD23 . LEU A 1 127 ? -1.948  -10.001 25.108  1.000 18.126 0 126 LEU A HD23 1 c 
ATOM   1838 N  N    . GLY A 1 128 ? 0.239   -14.198 23.146  1.000 21.887 0 127 GLY A N    1 ? 
ATOM   1839 C  CA   . GLY A 1 128 ? 1.185   -15.254 22.734  1.000 22.927 0 127 GLY A CA   1 ? 
ATOM   1840 C  C    . GLY A 1 128 ? 0.927   -16.594 23.417  1.000 24.767 0 127 GLY A C    1 ? 
ATOM   1841 O  O    . GLY A 1 128 ? 1.841   -17.422 23.377  1.000 23.235 0 127 GLY A O    1 ? 
ATOM   1842 H  H    . GLY A 1 128 ? -0.421  -14.024 22.543  1.000 21.974 0 127 GLY A H    1 c 
ATOM   1843 H  HA2  . GLY A 1 128 ? 1.127   -15.372 21.757  1.000 23.097 0 127 GLY A HA2  1 c 
ATOM   1844 H  HA3  . GLY A 1 128 ? 2.106   -14.957 22.944  1.000 23.084 0 127 GLY A HA3  1 c 
ATOM   1845 N  N    . LYS A 1 129 ? -0.279  -16.821 23.972  1.000 27.384 0 128 LYS A N    1 ? 
ATOM   1846 C  CA   . LYS A 1 129 ? -0.632  -18.019 24.794  1.000 29.429 0 128 LYS A CA   1 ? 
ATOM   1847 C  C    . LYS A 1 129 ? -1.644  -18.935 24.084  1.000 29.735 0 128 LYS A C    1 ? 
ATOM   1848 O  O    . LYS A 1 129 ? -2.029  -19.963 24.698  1.000 29.102 0 128 LYS A O    1 ? 
ATOM   1849 C  CB   . LYS A 1 129 ? -1.219  -17.578 26.140  1.000 30.172 0 128 LYS A CB   1 ? 
ATOM   1850 C  CG   . LYS A 1 129 ? -0.218  -17.024 27.140  1.000 30.612 0 128 LYS A CG   1 ? 
ATOM   1851 C  CD   . LYS A 1 129 ? -0.733  -17.056 28.567  1.000 31.526 0 128 LYS A CD   1 ? 
ATOM   1852 C  CE   . LYS A 1 129 ? -1.265  -15.722 29.041  1.000 34.090 0 128 LYS A CE   1 ? 
ATOM   1853 N  NZ   . LYS A 1 129 ? -0.165  -14.804 29.426  1.000 32.064 0 128 LYS A NZ   1 ? 
ATOM   1854 H  H    . LYS A 1 129 ? -0.975  -16.243 23.870  1.000 27.202 0 128 LYS A H    1 c 
ATOM   1855 H  HA   . LYS A 1 129 ? 0.191   -18.533 24.962  1.000 29.206 0 128 LYS A HA   1 c 
ATOM   1856 H  HB2  . LYS A 1 129 ? -1.899  -16.895 25.972  1.000 30.057 0 128 LYS A HB2  1 c 
ATOM   1857 H  HB3  . LYS A 1 129 ? -1.667  -18.348 26.547  1.000 30.096 0 128 LYS A HB3  1 c 
ATOM   1858 H  HG2  . LYS A 1 129 ? 0.609   -17.549 27.086  1.000 30.722 0 128 LYS A HG2  1 c 
ATOM   1859 H  HG3  . LYS A 1 129 ? -0.005  -16.099 26.895  1.000 30.734 0 128 LYS A HG3  1 c 
ATOM   1860 H  HD2  . LYS A 1 129 ? -1.447  -17.723 28.638  1.000 31.886 0 128 LYS A HD2  1 c 
ATOM   1861 H  HD3  . LYS A 1 129 ? -0.004  -17.334 29.162  1.000 31.894 0 128 LYS A HD3  1 c 
ATOM   1862 H  HE2  . LYS A 1 129 ? -1.791  -15.308 28.332  1.000 32.994 0 128 LYS A HE2  1 c 
ATOM   1863 H  HE3  . LYS A 1 129 ? -1.847  -15.858 29.811  1.000 32.994 0 128 LYS A HE3  1 c 
ATOM   1864 H  HZ1  . LYS A 1 129 ? 0.335   -15.180 30.083  1.000 32.682 0 128 LYS A HZ1  1 c 
ATOM   1865 H  HZ2  . LYS A 1 129 ? -0.510  -14.021 29.727  1.000 32.684 0 128 LYS A HZ2  1 c 
ATOM   1866 H  HZ3  . LYS A 1 129 ? 0.364   -14.639 28.708  1.000 32.697 0 128 LYS A HZ3  1 c 
ATOM   1867 N  N    . GLY A 1 130 ? -2.045  -18.622 22.845  1.000 29.959 0 129 GLY A N    1 ? 
ATOM   1868 C  CA   . GLY A 1 130 ? -3.134  -19.322 22.126  1.000 30.196 0 129 GLY A CA   1 ? 
ATOM   1869 C  C    . GLY A 1 130 ? -2.670  -20.545 21.332  1.000 30.714 0 129 GLY A C    1 ? 
ATOM   1870 O  O    . GLY A 1 130 ? -3.515  -21.158 20.653  1.000 31.497 0 129 GLY A O    1 ? 
ATOM   1871 H  H    . GLY A 1 130 ? -1.658  -17.953 22.365  1.000 29.946 0 129 GLY A H    1 c 
ATOM   1872 H  HA2  . GLY A 1 130 ? -3.816  -19.603 22.783  1.000 30.258 0 129 GLY A HA2  1 c 
ATOM   1873 H  HA3  . GLY A 1 130 ? -3.564  -18.681 21.506  1.000 30.260 0 129 GLY A HA3  1 c 
ATOM   1874 N  N    . GLY A 1 131 ? -1.386  -20.903 21.387  1.000 33.395 0 130 GLY A N    1 ? 
ATOM   1875 C  CA   . GLY A 1 131 ? -0.875  -22.158 20.791  1.000 37.915 0 130 GLY A CA   1 ? 
ATOM   1876 C  C    . GLY A 1 131 ? -1.300  -22.349 19.338  1.000 38.509 0 130 GLY A C    1 ? 
ATOM   1877 O  O    . GLY A 1 131 ? -1.688  -23.492 18.982  1.000 42.070 0 130 GLY A O    1 ? 
ATOM   1878 H  H    . GLY A 1 131 ? -0.750  -20.391 21.787  1.000 33.718 0 130 GLY A H    1 c 
ATOM   1879 H  HA2  . GLY A 1 131 ? 0.114   -22.155 20.842  1.000 36.930 0 130 GLY A HA2  1 c 
ATOM   1880 H  HA3  . GLY A 1 131 ? -1.202  -22.922 21.328  1.000 36.941 0 130 GLY A HA3  1 c 
ATOM   1881 N  N    . ASN A 1 132 ? -1.285  -21.272 18.539  1.000 38.721 0 131 ASN A N    1 ? 
ATOM   1882 C  CA   . ASN A 1 132 ? -1.216  -21.331 17.052  1.000 36.008 0 131 ASN A CA   1 ? 
ATOM   1883 C  C    . ASN A 1 132 ? -0.062  -20.417 16.617  1.000 34.085 0 131 ASN A C    1 ? 
ATOM   1884 O  O    . ASN A 1 132 ? 0.494   -19.714 17.487  1.000 29.969 0 131 ASN A O    1 ? 
ATOM   1885 C  CB   . ASN A 1 132 ? -2.568  -21.033 16.393  1.000 36.745 0 131 ASN A CB   1 ? 
ATOM   1886 C  CG   . ASN A 1 132 ? -3.166  -19.696 16.779  1.000 34.145 0 131 ASN A CG   1 ? 
ATOM   1887 O  OD1  . ASN A 1 132 ? -2.532  -18.888 17.439  1.000 35.010 0 131 ASN A OD1  1 ? 
ATOM   1888 N  ND2  . ASN A 1 132 ? -4.392  -19.453 16.358  1.000 35.398 0 131 ASN A ND2  1 ? 
ATOM   1889 H  H    . ASN A 1 132 ? -1.311  -20.423 18.866  1.000 37.970 0 131 ASN A H    1 c 
ATOM   1890 H  HA   . ASN A 1 132 ? -0.977  -22.252 16.804  1.000 36.283 0 131 ASN A HA   1 c 
ATOM   1891 H  HB2  . ASN A 1 132 ? -2.453  -21.058 15.421  1.000 35.946 0 131 ASN A HB2  1 c 
ATOM   1892 H  HB3  . ASN A 1 132 ? -3.197  -21.742 16.638  1.000 35.958 0 131 ASN A HB3  1 c 
ATOM   1893 H  HD21 . ASN A 1 132 ? -4.776  -18.677 16.538  1.000 35.010 0 131 ASN A HD21 1 c 
ATOM   1894 H  HD22 . ASN A 1 132 ? -4.831  -20.064 15.894  1.000 35.014 0 131 ASN A HD22 1 c 
ATOM   1895 N  N    . GLU A 1 133 ? 0.349   -20.462 15.345  1.000 34.586 0 132 GLU A N    1 ? 
ATOM   1896 C  CA   . GLU A 1 133 ? 1.555   -19.707 14.901  1.000 33.640 0 132 GLU A CA   1 ? 
ATOM   1897 C  C    . GLU A 1 133 ? 1.206   -18.214 14.969  1.000 29.705 0 132 GLU A C    1 ? 
ATOM   1898 O  O    . GLU A 1 133 ? 2.103   -17.433 15.308  1.000 26.848 0 132 GLU A O    1 ? 
ATOM   1899 C  CB   . GLU A 1 133 ? 2.092   -20.184 13.540  1.000 35.284 0 132 GLU A CB   1 ? 
ATOM   1900 C  CG   . GLU A 1 133 ? 1.159   -19.986 12.358  1.000 39.291 0 132 GLU A CG   1 ? 
ATOM   1901 C  CD   . GLU A 1 133 ? 1.311   -18.719 11.521  1.000 41.379 0 132 GLU A CD   1 ? 
ATOM   1902 O  OE1  . GLU A 1 133 ? 2.044   -17.780 11.931  1.000 44.214 0 132 GLU A OE1  1 ? 
ATOM   1903 O  OE2  . GLU A 1 133 ? 0.670   -18.667 10.451  1.000 39.861 0 132 GLU A OE2  1 ? 
ATOM   1904 H  H    . GLU A 1 133 ? -0.066  -20.949 14.697  1.000 34.268 0 132 GLU A H    1 c 
ATOM   1905 H  HA   . GLU A 1 133 ? 2.260   -19.873 15.567  1.000 33.307 0 132 GLU A HA   1 c 
ATOM   1906 H  HB2  . GLU A 1 133 ? 2.931   -19.712 13.360  1.000 35.811 0 132 GLU A HB2  1 c 
ATOM   1907 H  HB3  . GLU A 1 133 ? 2.302   -21.139 13.614  1.000 35.792 0 132 GLU A HB3  1 c 
ATOM   1908 H  HG2  . GLU A 1 133 ? 1.264   -20.753 11.755  1.000 38.754 0 132 GLU A HG2  1 c 
ATOM   1909 H  HG3  . GLU A 1 133 ? 0.239   -20.011 12.688  1.000 38.644 0 132 GLU A HG3  1 c 
ATOM   1910 N  N    . GLU A 1 134 ? -0.064  -17.868 14.731  1.000 27.631 0 133 GLU A N    1 ? 
ATOM   1911 C  CA   A GLU A 1 134 ? -0.553  -16.462 14.728  0.500 27.837 0 133 GLU A CA   1 ? 
ATOM   1912 C  CA   B GLU A 1 134 ? -0.590  -16.474 14.739  0.500 28.651 0 133 GLU A CA   1 ? 
ATOM   1913 C  C    . GLU A 1 134 ? -0.398  -15.843 16.124  1.000 27.687 0 133 GLU A C    1 ? 
ATOM   1914 O  O    . GLU A 1 134 ? -0.108  -14.624 16.192  1.000 25.586 0 133 GLU A O    1 ? 
ATOM   1915 C  CB   A GLU A 1 134 ? -2.015  -16.377 14.286  0.500 28.338 0 133 GLU A CB   1 ? 
ATOM   1916 C  CB   B GLU A 1 134 ? -2.082  -16.443 14.395  0.500 30.348 0 133 GLU A CB   1 ? 
ATOM   1917 C  CG   A GLU A 1 134 ? -2.221  -16.632 12.809  0.500 27.838 0 133 GLU A CG   1 ? 
ATOM   1918 C  CG   B GLU A 1 134 ? -2.423  -17.080 13.064  0.500 30.953 0 133 GLU A CG   1 ? 
ATOM   1919 C  CD   A GLU A 1 134 ? -2.406  -18.091 12.426  0.500 27.799 0 133 GLU A CD   1 ? 
ATOM   1920 C  CD   B GLU A 1 134 ? -1.394  -16.808 11.984  0.500 30.992 0 133 GLU A CD   1 ? 
ATOM   1921 O  OE1  A GLU A 1 134 ? -2.066  -18.988 13.258  0.500 24.476 0 133 GLU A OE1  1 ? 
ATOM   1922 O  OE1  B GLU A 1 134 ? -0.384  -16.141 12.295  0.500 30.980 0 133 GLU A OE1  1 ? 
ATOM   1923 O  OE2  A GLU A 1 134 ? -2.884  -18.329 11.287  0.500 26.226 0 133 GLU A OE2  1 ? 
ATOM   1924 O  OE2  B GLU A 1 134 ? -1.607  -17.255 10.840  0.500 31.133 0 133 GLU A OE2  1 ? 
ATOM   1925 H  H    . GLU A 1 134 ? -0.718  -18.474 14.553  1.000 28.284 0 133 GLU A H    1 c 
ATOM   1926 H  HA   A GLU A 1 134 ? -0.003  -15.946 14.095  0.500 27.865 0 133 GLU A HA   1 c 
ATOM   1927 H  HA   B GLU A 1 134 ? -0.094  -15.944 14.073  0.500 28.582 0 133 GLU A HA   1 c 
ATOM   1928 H  HB2  A GLU A 1 134 ? -2.536  -17.031 14.798  0.500 28.105 0 133 GLU A HB2  1 c 
ATOM   1929 H  HB2  B GLU A 1 134 ? -2.574  -16.908 15.104  0.500 30.064 0 133 GLU A HB2  1 c 
ATOM   1930 H  HB3  A GLU A 1 134 ? -2.357  -15.485 14.504  0.500 28.104 0 133 GLU A HB3  1 c 
ATOM   1931 H  HB3  B GLU A 1 134 ? -2.381  -15.510 14.386  0.500 30.078 0 133 GLU A HB3  1 c 
ATOM   1932 H  HG2  A GLU A 1 134 ? -3.011  -16.133 12.509  0.500 27.950 0 133 GLU A HG2  1 c 
ATOM   1933 H  HG2  B GLU A 1 134 ? -2.505  -18.050 13.182  0.500 30.815 0 133 GLU A HG2  1 c 
ATOM   1934 H  HG3  A GLU A 1 134 ? -1.448  -16.281 12.317  0.500 27.950 0 133 GLU A HG3  1 c 
ATOM   1935 H  HG3  B GLU A 1 134 ? -3.292  -16.742 12.760  0.500 30.820 0 133 GLU A HG3  1 c 
ATOM   1936 N  N    . SER A 1 135 ? -0.575  -16.630 17.192  1.000 27.117 0 134 SER A N    1 ? 
ATOM   1937 C  CA   . SER A 1 135 ? -0.546  -16.104 18.588  1.000 25.836 0 134 SER A CA   1 ? 
ATOM   1938 C  C    . SER A 1 135 ? 0.745   -15.315 18.867  1.000 25.129 0 134 SER A C    1 ? 
ATOM   1939 O  O    . SER A 1 135 ? 0.680   -14.331 19.592  1.000 23.630 0 134 SER A O    1 ? 
ATOM   1940 C  CB   . SER A 1 135 ? -0.716  -17.191 19.605  1.000 26.121 0 134 SER A CB   1 ? 
ATOM   1941 O  OG   . SER A 1 135 ? -0.728  -16.639 20.909  1.000 23.327 0 134 SER A OG   1 ? 
ATOM   1942 H  H    . SER A 1 135 ? -0.730  -17.530 17.151  1.000 26.943 0 134 SER A H    1 c 
ATOM   1943 H  HA   . SER A 1 135 ? -1.306  -15.478 18.683  1.000 25.989 0 134 SER A HA   1 c 
ATOM   1944 H  HB2  . SER A 1 135 ? -1.566  -17.668 19.440  1.000 25.391 0 134 SER A HB2  1 c 
ATOM   1945 H  HB3  . SER A 1 135 ? 0.026   -17.840 19.524  1.000 25.389 0 134 SER A HB3  1 c 
ATOM   1946 H  HG   . SER A 1 135 ? -0.853  -17.239 21.468  0.000 24.260 0 134 SER A HG   1 c 
ATOM   1947 N  N    . THR A 1 136 ? 1.895   -15.757 18.365  1.000 26.919 0 135 THR A N    1 ? 
ATOM   1948 C  CA   . THR A 1 136 ? 3.208   -15.148 18.711  1.000 26.395 0 135 THR A CA   1 ? 
ATOM   1949 C  C    . THR A 1 136 ? 3.633   -14.163 17.601  1.000 27.407 0 135 THR A C    1 ? 
ATOM   1950 O  O    . THR A 1 136 ? 4.836   -13.803 17.536  1.000 25.842 0 135 THR A O    1 ? 
ATOM   1951 C  CB   . THR A 1 136 ? 4.185   -16.274 19.071  1.000 27.031 0 135 THR A CB   1 ? 
ATOM   1952 O  OG1  . THR A 1 136 ? 4.277   -17.173 17.966  1.000 28.980 0 135 THR A OG1  1 ? 
ATOM   1953 C  CG2  . THR A 1 136 ? 3.741   -17.022 20.306  1.000 25.379 0 135 THR A CG2  1 ? 
ATOM   1954 H  H    . THR A 1 136 ? 1.966   -16.457 17.782  1.000 26.370 0 135 THR A H    1 c 
ATOM   1955 H  HA   . THR A 1 136 ? 3.070   -14.615 19.532  1.000 26.796 0 135 THR A HA   1 c 
ATOM   1956 H  HB   . THR A 1 136 ? 5.074   -15.875 19.239  1.000 26.941 0 135 THR A HB   1 c 
ATOM   1957 H  HG1  . THR A 1 136 ? 4.781   -17.782 18.135  0.000 28.980 0 135 THR A HG1  1 c 
ATOM   1958 H  HG21 . THR A 1 136 ? 3.673   -16.394 21.067  1.000 25.878 0 135 THR A HG21 1 c 
ATOM   1959 H  HG22 . THR A 1 136 ? 4.401   -17.727 20.521  1.000 25.878 0 135 THR A HG22 1 c 
ATOM   1960 H  HG23 . THR A 1 136 ? 2.858   -17.438 20.144  1.000 25.880 0 135 THR A HG23 1 c 
ATOM   1961 N  N    . LYS A 1 137 ? 2.664   -13.707 16.794  1.000 29.169 0 136 LYS A N    1 ? 
ATOM   1962 C  CA   . LYS A 1 137 ? 2.816   -12.639 15.771  1.000 29.017 0 136 LYS A CA   1 ? 
ATOM   1963 C  C    . LYS A 1 137 ? 1.838   -11.490 16.074  1.000 24.025 0 136 LYS A C    1 ? 
ATOM   1964 O  O    . LYS A 1 137 ? 2.326   -10.362 16.266  1.000 24.045 0 136 LYS A O    1 ? 
ATOM   1965 C  CB   . LYS A 1 137 ? 2.639   -13.227 14.369  1.000 32.429 0 136 LYS A CB   1 ? 
ATOM   1966 C  CG   . LYS A 1 137 ? 3.905   -13.870 13.819  1.000 37.395 0 136 LYS A CG   1 ? 
ATOM   1967 C  CD   . LYS A 1 137 ? 3.682   -15.077 12.946  1.000 42.638 0 136 LYS A CD   1 ? 
ATOM   1968 C  CE   . LYS A 1 137 ? 4.883   -15.999 12.928  1.000 45.575 0 136 LYS A CE   1 ? 
ATOM   1969 N  NZ   . LYS A 1 137 ? 6.085   -15.319 12.387  1.000 49.105 0 136 LYS A NZ   1 ? 
ATOM   1970 H  H    . LYS A 1 137 ? 1.822   -14.046 16.817  1.000 28.642 0 136 LYS A H    1 c 
ATOM   1971 H  HA   . LYS A 1 137 ? 3.731   -12.283 15.840  1.000 28.629 0 136 LYS A HA   1 c 
ATOM   1972 H  HB2  . LYS A 1 137 ? 1.927   -13.900 14.398  1.000 32.704 0 136 LYS A HB2  1 c 
ATOM   1973 H  HB3  . LYS A 1 137 ? 2.357   -12.513 13.760  1.000 32.656 0 136 LYS A HB3  1 c 
ATOM   1974 H  HG2  . LYS A 1 137 ? 4.394   -13.196 13.301  1.000 37.294 0 136 LYS A HG2  1 c 
ATOM   1975 H  HG3  . LYS A 1 137 ? 4.475   -14.130 14.575  1.000 37.286 0 136 LYS A HG3  1 c 
ATOM   1976 H  HD2  . LYS A 1 137 ? 2.903   -15.574 13.275  1.000 41.957 0 136 LYS A HD2  1 c 
ATOM   1977 H  HD3  . LYS A 1 137 ? 3.491   -14.782 12.031  1.000 41.988 0 136 LYS A HD3  1 c 
ATOM   1978 H  HE2  . LYS A 1 137 ? 5.073   -16.306 13.835  1.000 45.643 0 136 LYS A HE2  1 c 
ATOM   1979 H  HE3  . LYS A 1 137 ? 4.686   -16.781 12.379  1.000 45.661 0 136 LYS A HE3  1 c 
ATOM   1980 H  HZ1  . LYS A 1 137 ? 5.880   -14.906 11.605  1.000 47.986 0 136 LYS A HZ1  1 c 
ATOM   1981 H  HZ2  . LYS A 1 137 ? 6.741   -15.929 12.237  1.000 47.990 0 136 LYS A HZ2  1 c 
ATOM   1982 H  HZ3  . LYS A 1 137 ? 6.386   -14.702 12.981  1.000 47.973 0 136 LYS A HZ3  1 c 
ATOM   1983 N  N    . THR A 1 138 ? 0.528   -11.758 16.160  1.000 20.726 0 137 THR A N    1 ? 
ATOM   1984 C  CA   . THR A 1 138 ? -0.533  -10.727 16.360  1.000 19.689 0 137 THR A CA   1 ? 
ATOM   1985 C  C    . THR A 1 138 ? -1.361  -10.957 17.629  1.000 17.068 0 137 THR A C    1 ? 
ATOM   1986 O  O    . THR A 1 138 ? -2.126  -10.056 17.951  1.000 16.317 0 137 THR A O    1 ? 
ATOM   1987 C  CB   . THR A 1 138 ? -1.518  -10.637 15.187  1.000 19.341 0 137 THR A CB   1 ? 
ATOM   1988 O  OG1  . THR A 1 138 ? -2.255  -11.859 15.146  1.000 21.550 0 137 THR A OG1  1 ? 
ATOM   1989 C  CG2  . THR A 1 138 ? -0.859  -10.338 13.852  1.000 19.682 0 137 THR A CG2  1 ? 
ATOM   1990 H  H    . THR A 1 138 ? 0.185   -12.601 16.075  1.000 21.197 0 137 THR A H    1 c 
ATOM   1991 H  HA   . THR A 1 138 ? -0.083  -9.850  16.446  1.000 19.299 0 137 THR A HA   1 c 
ATOM   1992 H  HB   . THR A 1 138 ? -2.151  -9.903  15.385  1.000 19.880 0 137 THR A HB   1 c 
ATOM   1993 H  HG1  . THR A 1 138 ? -2.793  -11.820 14.517  0.000 21.790 0 137 THR A HG1  1 c 
ATOM   1994 H  HG21 . THR A 1 138 ? -0.378  -9.475  13.907  1.000 19.592 0 137 THR A HG21 1 c 
ATOM   1995 H  HG22 . THR A 1 138 ? -1.551  -10.283 13.147  1.000 19.581 0 137 THR A HG22 1 c 
ATOM   1996 H  HG23 . THR A 1 138 ? -0.219  -11.057 13.629  1.000 19.583 0 137 THR A HG23 1 c 
ATOM   1997 N  N    . GLY A 1 139 ? -1.265  -12.108 18.297  1.000 17.156 0 138 GLY A N    1 ? 
ATOM   1998 C  CA   . GLY A 1 139 ? -2.178  -12.425 19.433  1.000 17.095 0 138 GLY A CA   1 ? 
ATOM   1999 C  C    . GLY A 1 139 ? -3.645  -12.664 19.047  1.000 16.442 0 138 GLY A C    1 ? 
ATOM   2000 O  O    . GLY A 1 139 ? -4.515  -12.711 19.974  1.000 14.307 0 138 GLY A O    1 ? 
ATOM   2001 H  H    . GLY A 1 139 ? -0.648  -12.749 18.107  1.000 17.141 0 138 GLY A H    1 c 
ATOM   2002 H  HA2  . GLY A 1 139 ? -1.834  -13.230 19.889  1.000 16.951 0 138 GLY A HA2  1 c 
ATOM   2003 H  HA3  . GLY A 1 139 ? -2.137  -11.681 20.081  1.000 16.948 0 138 GLY A HA3  1 c 
ATOM   2004 N  N    . ASN A 1 140 ? -3.953  -12.808 17.756  1.000 18.569 0 139 ASN A N    1 ? 
ATOM   2005 C  CA   . ASN A 1 140 ? -5.305  -13.177 17.247  1.000 20.335 0 139 ASN A CA   1 ? 
ATOM   2006 C  C    . ASN A 1 140 ? -6.374  -12.138 17.672  1.000 19.997 0 139 ASN A C    1 ? 
ATOM   2007 O  O    . ASN A 1 140 ? -7.522  -12.549 17.925  1.000 20.575 0 139 ASN A O    1 ? 
ATOM   2008 C  CB   . ASN A 1 140 ? -5.684  -14.604 17.676  1.000 21.432 0 139 ASN A CB   1 ? 
ATOM   2009 C  CG   . ASN A 1 140 ? -4.813  -15.683 17.055  1.000 22.974 0 139 ASN A CG   1 ? 
ATOM   2010 O  OD1  . ASN A 1 140 ? -4.945  -16.003 15.874  1.000 24.099 0 139 ASN A OD1  1 ? 
ATOM   2011 N  ND2  . ASN A 1 140 ? -3.920  -16.269 17.840  1.000 25.901 0 139 ASN A ND2  1 ? 
ATOM   2012 H  H    . ASN A 1 140 ? -3.341  -12.698 17.093  1.000 18.427 0 139 ASN A H    1 c 
ATOM   2013 H  HA   . ASN A 1 140 ? -5.259  -13.178 16.263  1.000 20.156 0 139 ASN A HA   1 c 
ATOM   2014 H  HB2  . ASN A 1 140 ? -5.624  -14.668 18.651  1.000 21.507 0 139 ASN A HB2  1 c 
ATOM   2015 H  HB3  . ASN A 1 140 ? -6.615  -14.772 17.423  1.000 21.513 0 139 ASN A HB3  1 c 
ATOM   2016 H  HD21 . ASN A 1 140 ? -3.364  -16.869 17.506  1.000 24.970 0 139 ASN A HD21 1 c 
ATOM   2017 H  HD22 . ASN A 1 140 ? -3.878  -16.060 18.698  1.000 24.943 0 139 ASN A HD22 1 c 
ATOM   2018 N  N    . ALA A 1 141 ? -6.044  -10.831 17.729  1.000 20.536 0 140 ALA A N    1 ? 
ATOM   2019 C  CA   . ALA A 1 141 ? -6.989  -9.760  18.151  1.000 19.025 0 140 ALA A CA   1 ? 
ATOM   2020 C  C    . ALA A 1 141 ? -7.930  -9.353  17.009  1.000 19.410 0 140 ALA A C    1 ? 
ATOM   2021 O  O    . ALA A 1 141 ? -8.811  -8.556  17.269  1.000 17.958 0 140 ALA A O    1 ? 
ATOM   2022 C  CB   . ALA A 1 141 ? -6.239  -8.546  18.683  1.000 18.738 0 140 ALA A CB   1 ? 
ATOM   2023 H  H    . ALA A 1 141 ? -5.222  -10.507 17.509  1.000 20.036 0 140 ALA A H    1 c 
ATOM   2024 H  HA   . ALA A 1 141 ? -7.543  -10.119 18.882  1.000 19.330 0 140 ALA A HA   1 c 
ATOM   2025 H  HB1  . ALA A 1 141 ? -6.876  -7.875  18.982  1.000 18.818 0 140 ALA A HB1  1 c 
ATOM   2026 H  HB2  . ALA A 1 141 ? -5.677  -8.813  19.429  1.000 18.824 0 140 ALA A HB2  1 c 
ATOM   2027 H  HB3  . ALA A 1 141 ? -5.684  -8.172  17.978  1.000 18.824 0 140 ALA A HB3  1 c 
ATOM   2028 N  N    . GLY A 1 142 ? -7.726  -9.854  15.783  1.000 20.493 0 141 GLY A N    1 ? 
ATOM   2029 C  CA   . GLY A 1 142 ? -8.660  -9.655  14.656  1.000 19.261 0 141 GLY A CA   1 ? 
ATOM   2030 C  C    . GLY A 1 142 ? -8.592  -8.250  14.076  1.000 18.816 0 141 GLY A C    1 ? 
ATOM   2031 O  O    . GLY A 1 142 ? -7.498  -7.670  14.037  1.000 17.161 0 141 GLY A O    1 ? 
ATOM   2032 H  H    . GLY A 1 142 ? -6.986  -10.338 15.570  1.000 19.940 0 141 GLY A H    1 c 
ATOM   2033 H  HA2  . GLY A 1 142 ? -8.449  -10.312 13.946  1.000 19.437 0 141 GLY A HA2  1 c 
ATOM   2034 H  HA3  . GLY A 1 142 ? -9.582  -9.834  14.971  1.000 19.440 0 141 GLY A HA3  1 c 
ATOM   2035 N  N    . SER A 1 143 ? -9.716  -7.731  13.575  1.000 21.825 0 142 SER A N    1 ? 
ATOM   2036 C  CA   . SER A 1 143 ? -9.755  -6.497  12.757  1.000 21.955 0 142 SER A CA   1 ? 
ATOM   2037 C  C    . SER A 1 143 ? -9.476  -5.262  13.622  1.000 20.726 0 142 SER A C    1 ? 
ATOM   2038 O  O    . SER A 1 143 ? -9.623  -5.324  14.885  1.000 20.365 0 142 SER A O    1 ? 
ATOM   2039 C  CB   . SER A 1 143 ? -11.070 -6.350  12.014  1.000 24.541 0 142 SER A CB   1 ? 
ATOM   2040 O  OG   . SER A 1 143 ? -12.128 -6.084  12.927  1.000 28.225 0 142 SER A OG   1 ? 
ATOM   2041 H  H    . SER A 1 143 ? -10.544 -8.098  13.701  1.000 21.108 0 142 SER A H    1 c 
ATOM   2042 H  HA   . SER A 1 143 ? -9.031  -6.563  12.086  1.000 22.170 0 142 SER A HA   1 c 
ATOM   2043 H  HB2  . SER A 1 143 ? -11.000 -5.610  11.361  1.000 24.706 0 142 SER A HB2  1 c 
ATOM   2044 H  HB3  . SER A 1 143 ? -11.262 -7.183  11.517  1.000 24.706 0 142 SER A HB3  1 c 
ATOM   2045 H  HG   . SER A 1 143 ? -12.819 -5.954  12.452  0.000 28.920 0 142 SER A HG   1 c 
ATOM   2046 N  N    . ARG A 1 144 ? -9.156  -4.171  12.936  1.000 17.434 0 143 ARG A N    1 ? 
ATOM   2047 C  CA   . ARG A 1 144 ? -8.788  -2.859  13.517  1.000 16.183 0 143 ARG A CA   1 ? 
ATOM   2048 C  C    . ARG A 1 144 ? -10.035 -1.964  13.518  1.000 14.600 0 143 ARG A C    1 ? 
ATOM   2049 O  O    . ARG A 1 144 ? -10.487 -1.560  12.430  1.000 14.757 0 143 ARG A O    1 ? 
ATOM   2050 C  CB   . ARG A 1 144 ? -7.610  -2.289  12.713  1.000 16.206 0 143 ARG A CB   1 ? 
ATOM   2051 C  CG   . ARG A 1 144 ? -6.430  -3.241  12.576  1.000 16.588 0 143 ARG A CG   1 ? 
ATOM   2052 C  CD   . ARG A 1 144 ? -5.332  -2.774  11.628  1.000 15.844 0 143 ARG A CD   1 ? 
ATOM   2053 N  NE   . ARG A 1 144 ? -4.346  -3.838  11.542  1.000 15.595 0 143 ARG A NE   1 ? 
ATOM   2054 C  CZ   . ARG A 1 144 ? -3.087  -3.719  11.117  1.000 14.751 0 143 ARG A CZ   1 ? 
ATOM   2055 N  NH1  . ARG A 1 144 ? -2.589  -2.542  10.770  1.000 13.999 0 143 ARG A NH1  1 ? 
ATOM   2056 N  NH2  . ARG A 1 144 ? -2.304  -4.785  11.121  1.000 14.740 0 143 ARG A NH2  1 ? 
ATOM   2057 H  H    . ARG A 1 144 ? -9.147  -4.167  12.022  1.000 17.853 0 143 ARG A H    1 c 
ATOM   2058 H  HA   . ARG A 1 144 ? -8.497  -3.001  14.451  1.000 16.110 0 143 ARG A HA   1 c 
ATOM   2059 H  HB2  . ARG A 1 144 ? -7.932  -2.049  11.809  1.000 16.312 0 143 ARG A HB2  1 c 
ATOM   2060 H  HB3  . ARG A 1 144 ? -7.301  -1.459  13.154  1.000 16.294 0 143 ARG A HB3  1 c 
ATOM   2061 H  HG2  . ARG A 1 144 ? -6.031  -3.383  13.469  1.000 16.301 0 143 ARG A HG2  1 c 
ATOM   2062 H  HG3  . ARG A 1 144 ? -6.762  -4.117  12.258  1.000 16.317 0 143 ARG A HG3  1 c 
ATOM   2063 H  HD2  . ARG A 1 144 ? -5.710  -2.587  10.733  1.000 15.955 0 143 ARG A HD2  1 c 
ATOM   2064 H  HD3  . ARG A 1 144 ? -4.914  -1.948  11.977  1.000 15.948 0 143 ARG A HD3  1 c 
ATOM   2065 H  HE   . ARG A 1 144 ? -4.615  -4.663  11.779  1.000 15.394 0 143 ARG A HE   1 c 
ATOM   2066 H  HH11 . ARG A 1 144 ? -3.109  -1.810  10.774  1.000 14.303 0 143 ARG A HH11 1 c 
ATOM   2067 H  HH12 . ARG A 1 144 ? -1.734  -2.483  10.496  1.000 14.299 0 143 ARG A HH12 1 c 
ATOM   2068 H  HH21 . ARG A 1 144 ? -2.634  -5.584  11.367  1.000 14.755 0 143 ARG A HH21 1 c 
ATOM   2069 H  HH22 . ARG A 1 144 ? -1.451  -4.715  10.845  1.000 14.755 0 143 ARG A HH22 1 c 
ATOM   2070 N  N    . LEU A 1 145 ? -10.654 -1.744  14.679  1.000 14.637 0 144 LEU A N    1 ? 
ATOM   2071 C  CA   . LEU A 1 145 ? -11.935 -0.982  14.775  1.000 15.275 0 144 LEU A CA   1 ? 
ATOM   2072 C  C    . LEU A 1 145 ? -11.665 0.525   14.673  1.000 13.429 0 144 LEU A C    1 ? 
ATOM   2073 O  O    . LEU A 1 145 ? -12.514 1.243   14.112  1.000 14.437 0 144 LEU A O    1 ? 
ATOM   2074 C  CB   . LEU A 1 145 ? -12.673 -1.275  16.090  1.000 15.831 0 144 LEU A CB   1 ? 
ATOM   2075 C  CG   . LEU A 1 145 ? -13.021 -2.734  16.392  1.000 17.054 0 144 LEU A CG   1 ? 
ATOM   2076 C  CD1  . LEU A 1 145 ? -13.623 -2.851  17.795  1.000 19.027 0 144 LEU A CD1  1 ? 
ATOM   2077 C  CD2  . LEU A 1 145 ? -13.972 -3.318  15.342  1.000 18.745 0 144 LEU A CD2  1 ? 
ATOM   2078 H  H    . LEU A 1 145 ? -10.333 -2.043  15.477  1.000 14.784 0 144 LEU A H    1 c 
ATOM   2079 H  HA   . LEU A 1 145 ? -12.507 -1.247  14.019  1.000 14.896 0 144 LEU A HA   1 c 
ATOM   2080 H  HB2  . LEU A 1 145 ? -12.125 -0.935  16.825  1.000 15.972 0 144 LEU A HB2  1 c 
ATOM   2081 H  HB3  . LEU A 1 145 ? -13.504 -0.759  16.088  1.000 15.979 0 144 LEU A HB3  1 c 
ATOM   2082 H  HG   . LEU A 1 145 ? -12.184 -3.259  16.374  1.000 17.475 0 144 LEU A HG   1 c 
ATOM   2083 H  HD11 . LEU A 1 145 ? -12.970 -2.558  18.454  1.000 18.396 0 144 LEU A HD11 1 c 
ATOM   2084 H  HD12 . LEU A 1 145 ? -13.866 -3.776  17.969  1.000 18.395 0 144 LEU A HD12 1 c 
ATOM   2085 H  HD13 . LEU A 1 145 ? -14.417 -2.293  17.855  1.000 18.395 0 144 LEU A HD13 1 c 
ATOM   2086 H  HD21 . LEU A 1 145 ? -14.771 -2.765  15.283  1.000 18.205 0 144 LEU A HD21 1 c 
ATOM   2087 H  HD22 . LEU A 1 145 ? -14.223 -4.222  15.599  1.000 18.205 0 144 LEU A HD22 1 c 
ATOM   2088 H  HD23 . LEU A 1 145 ? -13.528 -3.339  14.477  1.000 18.194 0 144 LEU A HD23 1 c 
ATOM   2089 N  N    . ALA A 1 146 ? -10.572 1.016   15.263  1.000 13.071 0 145 ALA A N    1 ? 
ATOM   2090 C  CA   . ALA A 1 146 ? -10.241 2.462   15.277  1.000 12.131 0 145 ALA A CA   1 ? 
ATOM   2091 C  C    . ALA A 1 146 ? -8.731  2.634   15.527  1.000 12.940 0 145 ALA A C    1 ? 
ATOM   2092 O  O    . ALA A 1 146 ? -8.091  1.704   16.108  1.000 11.786 0 145 ALA A O    1 ? 
ATOM   2093 C  CB   . ALA A 1 146 ? -11.117 3.189   16.268  1.000 12.390 0 145 ALA A CB   1 ? 
ATOM   2094 H  H    . ALA A 1 146 ? -9.959  0.506   15.704  1.000 12.930 0 145 ALA A H    1 c 
ATOM   2095 H  HA   . ALA A 1 146 ? -10.436 2.821   14.381  1.000 12.520 0 145 ALA A HA   1 c 
ATOM   2096 H  HB1  . ALA A 1 146 ? -10.889 4.134   16.271  1.000 12.315 0 145 ALA A HB1  1 c 
ATOM   2097 H  HB2  . ALA A 1 146 ? -12.050 3.082   16.019  1.000 12.320 0 145 ALA A HB2  1 c 
ATOM   2098 H  HB3  . ALA A 1 146 ? -10.976 2.820   17.157  1.000 12.324 0 145 ALA A HB3  1 c 
ATOM   2099 N  N    . CYS A 1 147 ? -8.166  3.744   15.047  1.000 13.602 0 146 CYS A N    1 ? 
ATOM   2100 C  CA   . CYS A 1 147 ? -6.713  4.048   15.142  1.000 13.571 0 146 CYS A CA   1 ? 
ATOM   2101 C  C    . CYS A 1 147 ? -6.427  5.544   14.989  1.000 12.707 0 146 CYS A C    1 ? 
ATOM   2102 O  O    . CYS A 1 147 ? -7.303  6.281   14.531  1.000 11.134 0 146 CYS A O    1 ? 
ATOM   2103 C  CB   . CYS A 1 147 ? -5.891  3.314   14.085  1.000 14.470 0 146 CYS A CB   1 ? 
ATOM   2104 S  SG   . CYS A 1 147 ? -6.438  3.596   12.375  1.000 17.823 0 146 CYS A SG   1 ? 
ATOM   2105 H  H    . CYS A 1 147 ? -8.634  4.401   14.617  1.000 13.435 0 146 CYS A H    1 c 
ATOM   2106 H  HA   . CYS A 1 147 ? -6.403  3.759   16.036  1.000 13.569 0 146 CYS A HA   1 c 
ATOM   2107 H  HB2  . CYS A 1 147 ? -4.946  3.595   14.160  1.000 14.962 0 146 CYS A HB2  1 c 
ATOM   2108 H  HB3  . CYS A 1 147 ? -5.930  2.342   14.266  1.000 14.963 0 146 CYS A HB3  1 c 
ATOM   2109 N  N    . GLY A 1 148 ? -5.201  5.943   15.316  1.000 12.986 0 147 GLY A N    1 ? 
ATOM   2110 C  CA   . GLY A 1 148 ? -4.673  7.267   14.942  1.000 13.348 0 147 GLY A CA   1 ? 
ATOM   2111 C  C    . GLY A 1 148 ? -3.181  7.374   15.127  1.000 14.834 0 147 GLY A C    1 ? 
ATOM   2112 O  O    . GLY A 1 148 ? -2.529  6.461   15.789  1.000 13.532 0 147 GLY A O    1 ? 
ATOM   2113 H  H    . GLY A 1 148 ? -4.624  5.419   15.788  1.000 13.009 0 147 GLY A H    1 c 
ATOM   2114 H  HA2  . GLY A 1 148 ? -4.897  7.445   13.997  1.000 13.614 0 147 GLY A HA2  1 c 
ATOM   2115 H  HA3  . GLY A 1 148 ? -5.118  7.956   15.495  1.000 13.599 0 147 GLY A HA3  1 c 
ATOM   2116 N  N    . VAL A 1 149 ? -2.626  8.448   14.577  1.000 13.537 0 148 VAL A N    1 ? 
ATOM   2117 C  CA   . VAL A 1 149 ? -1.169  8.722   14.687  1.000 13.626 0 148 VAL A CA   1 ? 
ATOM   2118 C  C    . VAL A 1 149 ? -0.914  9.332   16.055  1.000 14.451 0 148 VAL A C    1 ? 
ATOM   2119 O  O    . VAL A 1 149 ? -1.711  10.177  16.477  1.000 12.795 0 148 VAL A O    1 ? 
ATOM   2120 C  CB   . VAL A 1 149 ? -0.625  9.592   13.538  1.000 13.570 0 148 VAL A CB   1 ? 
ATOM   2121 C  CG1  . VAL A 1 149 ? 0.900   9.694   13.598  1.000 12.947 0 148 VAL A CG1  1 ? 
ATOM   2122 C  CG2  . VAL A 1 149 ? -1.065  9.052   12.187  1.000 12.932 0 148 VAL A CG2  1 ? 
ATOM   2123 H  H    . VAL A 1 149 ? -3.097  9.080   14.120  1.000 13.846 0 148 VAL A H    1 c 
ATOM   2124 H  HA   . VAL A 1 149 ? -0.706  7.867   14.652  1.000 13.750 0 148 VAL A HA   1 c 
ATOM   2125 H  HB   . VAL A 1 149 ? -1.000  10.500  13.645  1.000 13.334 0 148 VAL A HB   1 c 
ATOM   2126 H  HG11 . VAL A 1 149 ? 1.164   10.173  14.403  1.000 13.139 0 148 VAL A HG11 1 c 
ATOM   2127 H  HG12 . VAL A 1 149 ? 1.225   10.173  12.816  1.000 13.136 0 148 VAL A HG12 1 c 
ATOM   2128 H  HG13 . VAL A 1 149 ? 1.285   8.800   13.613  1.000 13.136 0 148 VAL A HG13 1 c 
ATOM   2129 H  HG21 . VAL A 1 149 ? -0.826  8.111   12.120  1.000 13.125 0 148 VAL A HG21 1 c 
ATOM   2130 H  HG22 . VAL A 1 149 ? -0.620  9.549   11.478  1.000 13.125 0 148 VAL A HG22 1 c 
ATOM   2131 H  HG23 . VAL A 1 149 ? -2.028  9.148   12.093  1.000 13.127 0 148 VAL A HG23 1 c 
ATOM   2132 N  N    . ILE A 1 150 ? 0.205   8.946   16.677  1.000 14.370 0 149 ILE A N    1 ? 
ATOM   2133 C  CA   . ILE A 1 150 ? 0.636   9.474   17.997  1.000 14.280 0 149 ILE A CA   1 ? 
ATOM   2134 C  C    . ILE A 1 150 ? 1.446   10.761  17.765  1.000 12.664 0 149 ILE A C    1 ? 
ATOM   2135 O  O    . ILE A 1 150 ? 2.496   10.733  17.079  1.000 11.872 0 149 ILE A O    1 ? 
ATOM   2136 C  CB   . ILE A 1 150 ? 1.407   8.418   18.812  1.000 14.383 0 149 ILE A CB   1 ? 
ATOM   2137 C  CG1  . ILE A 1 150 ? 0.588   7.124   18.957  1.000 14.704 0 149 ILE A CG1  1 ? 
ATOM   2138 C  CG2  . ILE A 1 150 ? 1.829   9.002   20.163  1.000 15.307 0 149 ILE A CG2  1 ? 
ATOM   2139 C  CD1  . ILE A 1 150 ? 1.408   5.911   19.391  1.000 13.805 0 149 ILE A CD1  1 ? 
ATOM   2140 H  H    . ILE A 1 150 ? 0.782   8.336   16.322  1.000 14.364 0 149 ILE A H    1 c 
ATOM   2141 H  HA   . ILE A 1 150 ? -0.165  9.707   18.500  1.000 13.991 0 149 ILE A HA   1 c 
ATOM   2142 H  HB   . ILE A 1 150 ? 2.229   8.196   18.310  1.000 14.590 0 149 ILE A HB   1 c 
ATOM   2143 H  HG12 . ILE A 1 150 ? -0.122  7.274   19.616  1.000 14.412 0 149 ILE A HG12 1 c 
ATOM   2144 H  HG13 . ILE A 1 150 ? 0.162   6.921   18.098  1.000 14.411 0 149 ILE A HG13 1 c 
ATOM   2145 H  HG21 . ILE A 1 150 ? 2.471   9.720   20.024  1.000 15.009 0 149 ILE A HG21 1 c 
ATOM   2146 H  HG22 . ILE A 1 150 ? 2.238   8.307   20.706  1.000 15.009 0 149 ILE A HG22 1 c 
ATOM   2147 H  HG23 . ILE A 1 150 ? 1.047   9.354   20.624  1.000 15.013 0 149 ILE A HG23 1 c 
ATOM   2148 H  HD11 . ILE A 1 150 ? 2.136   5.767   18.762  1.000 14.071 0 149 ILE A HD11 1 c 
ATOM   2149 H  HD12 . ILE A 1 150 ? 0.838   5.123   19.411  1.000 14.074 0 149 ILE A HD12 1 c 
ATOM   2150 H  HD13 . ILE A 1 150 ? 1.775   6.066   20.279  1.000 14.076 0 149 ILE A HD13 1 c 
ATOM   2151 N  N    . GLY A 1 151 ? 0.940   11.862  18.324  1.000 14.447 0 150 GLY A N    1 ? 
ATOM   2152 C  CA   . GLY A 1 151 ? 1.487   13.220  18.122  1.000 13.281 0 150 GLY A CA   1 ? 
ATOM   2153 C  C    . GLY A 1 151 ? 2.106   13.791  19.395  1.000 13.933 0 150 GLY A C    1 ? 
ATOM   2154 O  O    . GLY A 1 151 ? 1.615   13.452  20.512  1.000 14.971 0 150 GLY A O    1 ? 
ATOM   2155 H  H    . GLY A 1 151 ? 0.216   11.836  18.875  1.000 13.734 0 150 GLY A H    1 c 
ATOM   2156 H  HA2  . GLY A 1 151 ? 2.173   13.190  17.410  1.000 13.695 0 150 GLY A HA2  1 c 
ATOM   2157 H  HA3  . GLY A 1 151 ? 0.762   13.813  17.818  1.000 13.699 0 150 GLY A HA3  1 c 
ATOM   2158 N  N    . ILE A 1 152 ? 3.049   14.709  19.223  1.000 13.558 0 151 ILE A N    1 ? 
ATOM   2159 C  CA   . ILE A 1 152 ? 3.637   15.540  20.329  1.000 13.727 0 151 ILE A CA   1 ? 
ATOM   2160 C  C    . ILE A 1 152 ? 2.544   16.453  20.901  1.000 13.400 0 151 ILE A C    1 ? 
ATOM   2161 O  O    . ILE A 1 152 ? 1.858   17.140  20.134  1.000 14.414 0 151 ILE A O    1 ? 
ATOM   2162 C  CB   . ILE A 1 152 ? 4.877   16.322  19.825  1.000 15.176 0 151 ILE A CB   1 ? 
ATOM   2163 C  CG1  . ILE A 1 152 ? 5.988   15.376  19.357  1.000 15.447 0 151 ILE A CG1  1 ? 
ATOM   2164 C  CG2  . ILE A 1 152 ? 5.386   17.304  20.878  1.000 16.306 0 151 ILE A CG2  1 ? 
ATOM   2165 C  CD1  . ILE A 1 152 ? 6.983   15.990  18.389  1.000 16.140 0 151 ILE A CD1  1 ? 
ATOM   2166 H  H    . ILE A 1 152 ? 3.392   14.905  18.402  1.000 13.701 0 151 ILE A H    1 c 
ATOM   2167 H  HA   . ILE A 1 152 ? 3.930   14.937  21.035  1.000 13.896 0 151 ILE A HA   1 c 
ATOM   2168 H  HB   . ILE A 1 152 ? 4.591   16.851  19.040  1.000 15.142 0 151 ILE A HB   1 c 
ATOM   2169 H  HG12 . ILE A 1 152 ? 6.477   15.059  20.145  1.000 15.547 0 151 ILE A HG12 1 c 
ATOM   2170 H  HG13 . ILE A 1 152 ? 5.577   14.596  18.928  1.000 15.531 0 151 ILE A HG13 1 c 
ATOM   2171 H  HG21 . ILE A 1 152 ? 4.733   18.014  21.010  1.000 15.946 0 151 ILE A HG21 1 c 
ATOM   2172 H  HG22 . ILE A 1 152 ? 6.227   17.693  20.581  1.000 15.950 0 151 ILE A HG22 1 c 
ATOM   2173 H  HG23 . ILE A 1 152 ? 5.527   16.836  21.720  1.000 15.950 0 151 ILE A HG23 1 c 
ATOM   2174 H  HD11 . ILE A 1 152 ? 6.510   16.345  17.616  1.000 15.921 0 151 ILE A HD11 1 c 
ATOM   2175 H  HD12 . ILE A 1 152 ? 7.615   15.311  18.096  1.000 15.925 0 151 ILE A HD12 1 c 
ATOM   2176 H  HD13 . ILE A 1 152 ? 7.465   16.710  18.831  1.000 15.925 0 151 ILE A HD13 1 c 
ATOM   2177 N  N    . ALA A 1 153 ? 2.350   16.435  22.227  1.000 13.750 0 152 ALA A N    1 ? 
ATOM   2178 C  CA   . ALA A 1 153 ? 1.354   17.268  22.932  1.000 13.836 0 152 ALA A CA   1 ? 
ATOM   2179 C  C    . ALA A 1 153 ? 2.050   18.377  23.742  1.000 14.471 0 152 ALA A C    1 ? 
ATOM   2180 O  O    . ALA A 1 153 ? 3.249   18.259  24.044  1.000 13.027 0 152 ALA A O    1 ? 
ATOM   2181 C  CB   . ALA A 1 153 ? 0.470   16.404  23.807  1.000 14.536 0 152 ALA A CB   1 ? 
ATOM   2182 H  H    . ALA A 1 153 ? 2.823   15.905  22.795  1.000 13.693 0 152 ALA A H    1 c 
ATOM   2183 H  HA   . ALA A 1 153 ? 0.784   17.701  22.255  1.000 14.076 0 152 ALA A HA   1 c 
ATOM   2184 H  HB1  . ALA A 1 153 ? -0.182  16.962  24.263  1.000 14.318 0 152 ALA A HB1  1 c 
ATOM   2185 H  HB2  . ALA A 1 153 ? 0.006   15.750  23.257  1.000 14.318 0 152 ALA A HB2  1 c 
ATOM   2186 H  HB3  . ALA A 1 153 ? 1.016   15.942  24.466  1.000 14.318 0 152 ALA A HB3  1 c 
ATOM   2187 N  N    . GLN A 1 154 ? 1.269   19.414  24.040  1.000 17.588 0 153 GLN A N    1 ? 
ATOM   2188 C  CA   . GLN A 1 154 ? 1.582   20.614  24.861  1.000 18.941 0 153 GLN A CA   1 ? 
ATOM   2189 C  C    . GLN A 1 154 ? 1.886   20.194  26.306  1.000 20.517 0 153 GLN A C    1 ? 
ATOM   2190 O  O    . GLN A 1 154 ? 1.222   19.299  26.852  1.000 22.293 0 153 GLN A O    1 ? 
ATOM   2191 C  CB   . GLN A 1 154 ? 0.327   21.495  24.816  1.000 20.492 0 153 GLN A CB   1 ? 
ATOM   2192 C  CG   . GLN A 1 154 ? 0.517   22.885  25.373  1.000 22.976 0 153 GLN A CG   1 ? 
ATOM   2193 C  CD   . GLN A 1 154 ? -0.733  23.689  25.119  1.000 23.087 0 153 GLN A CD   1 ? 
ATOM   2194 O  OE1  . GLN A 1 154 ? -1.203  23.792  23.988  1.000 21.708 0 153 GLN A OE1  1 ? 
ATOM   2195 N  NE2  . GLN A 1 154 ? -1.308  24.207  26.186  1.000 26.195 0 153 GLN A NE2  1 ? 
ATOM   2196 O  OXT  . GLN A 1 154 ? 2.775   20.749  26.967  1.000 22.422 0 153 GLN A OXT  1 ? 
ATOM   2197 H  H    . GLN A 1 154 ? 0.412   19.440  23.730  1.000 17.102 0 153 GLN A H    1 c 
ATOM   2198 H  HA   . GLN A 1 154 ? 2.351   21.093  24.476  1.000 19.249 0 153 GLN A HA   1 c 
ATOM   2199 H  HB2  . GLN A 1 154 ? 0.033   21.565  23.884  1.000 20.644 0 153 GLN A HB2  1 c 
ATOM   2200 H  HB3  . GLN A 1 154 ? -0.385  21.046  25.319  1.000 20.653 0 153 GLN A HB3  1 c 
ATOM   2201 H  HG2  . GLN A 1 154 ? 0.693   22.836  26.337  1.000 22.403 0 153 GLN A HG2  1 c 
ATOM   2202 H  HG3  . GLN A 1 154 ? 1.283   23.316  24.938  1.000 22.394 0 153 GLN A HG3  1 c 
ATOM   2203 H  HE21 . GLN A 1 154 ? -2.055  24.673  26.103  1.000 25.183 0 153 GLN A HE21 1 c 
ATOM   2204 H  HE22 . GLN A 1 154 ? -0.950  24.092  26.986  1.000 25.178 0 153 GLN A HE22 1 c 
ATOM   2205 N  N    . ALA B 1 2   ? 14.171  8.029   10.407  1.000 47.375 0 1   ALA B N    1 ? 
ATOM   2206 C  CA   . ALA B 1 2   ? 13.153  7.923   9.301   1.000 43.598 0 1   ALA B CA   1 ? 
ATOM   2207 C  C    . ALA B 1 2   ? 13.677  8.618   8.035   1.000 39.397 0 1   ALA B C    1 ? 
ATOM   2208 O  O    . ALA B 1 2   ? 14.181  9.752   8.128   1.000 36.980 0 1   ALA B O    1 ? 
ATOM   2209 C  CB   . ALA B 1 2   ? 11.828  8.504   9.749   1.000 44.960 0 1   ALA B CB   1 ? 
ATOM   2210 H  H    . ALA B 1 2   ? 13.818  8.487   11.111  1.000 46.170 0 1   ALA B H    1 c 
ATOM   2211 H  HA   . ALA B 1 2   ? 13.021  6.967   9.097   1.000 43.657 0 1   ALA B HA   1 c 
ATOM   2212 H  HB1  . ALA B 1 2   ? 11.179  8.426   9.030   1.000 44.539 0 1   ALA B HB1  1 c 
ATOM   2213 H  HB2  . ALA B 1 2   ? 11.507  8.019   10.528  1.000 44.539 0 1   ALA B HB2  1 c 
ATOM   2214 H  HB3  . ALA B 1 2   ? 11.944  9.441   9.978   1.000 44.542 0 1   ALA B HB3  1 c 
ATOM   2215 N  N    . THR B 1 3   ? 13.611  7.930   6.894   1.000 34.807 0 2   THR B N    1 ? 
ATOM   2216 C  CA   . THR B 1 3   ? 13.878  8.522   5.565   1.000 29.830 0 2   THR B CA   1 ? 
ATOM   2217 C  C    . THR B 1 3   ? 12.521  8.858   4.926   1.000 24.050 0 2   THR B C    1 ? 
ATOM   2218 O  O    . THR B 1 3   ? 12.532  9.684   4.041   1.000 21.248 0 2   THR B O    1 ? 
ATOM   2219 C  CB   . THR B 1 3   ? 14.851  7.677   4.721   1.000 31.329 0 2   THR B CB   1 ? 
ATOM   2220 O  OG1  . THR B 1 3   ? 14.230  6.512   4.177   1.000 36.051 0 2   THR B OG1  1 ? 
ATOM   2221 C  CG2  . THR B 1 3   ? 16.061  7.207   5.499   1.000 34.353 0 2   THR B CG2  1 ? 
ATOM   2222 H  H    . THR B 1 3   ? 13.410  7.040   6.851   1.000 34.536 0 2   THR B H    1 c 
ATOM   2223 H  HA   . THR B 1 3   ? 14.333  9.385   5.730   1.000 29.787 0 2   THR B HA   1 c 
ATOM   2224 H  HB   . THR B 1 3   ? 15.164  8.242   3.973   1.000 32.421 0 2   THR B HB   1 c 
ATOM   2225 H  HG1  . THR B 1 3   ? 14.837  6.070   3.727   0.000 36.240 0 2   THR B HG1  1 c 
ATOM   2226 H  HG21 . THR B 1 3   ? 16.547  7.990   5.858   1.000 33.399 0 2   THR B HG21 1 c 
ATOM   2227 H  HG22 . THR B 1 3   ? 16.660  6.695   4.901   1.000 33.399 0 2   THR B HG22 1 c 
ATOM   2228 H  HG23 . THR B 1 3   ? 15.772  6.629   6.246   1.000 33.401 0 2   THR B HG23 1 c 
ATOM   2229 N  N    . LYS B 1 4   ? 11.393  8.297   5.394   1.000 22.220 0 3   LYS B N    1 ? 
ATOM   2230 C  CA   . LYS B 1 4   ? 10.058  8.566   4.769   1.000 20.194 0 3   LYS B CA   1 ? 
ATOM   2231 C  C    . LYS B 1 4   ? 8.962   8.853   5.813   1.000 18.067 0 3   LYS B C    1 ? 
ATOM   2232 O  O    . LYS B 1 4   ? 8.977   8.271   6.898   1.000 18.244 0 3   LYS B O    1 ? 
ATOM   2233 C  CB   . LYS B 1 4   ? 9.685   7.408   3.834   1.000 22.365 0 3   LYS B CB   1 ? 
ATOM   2234 C  CG   . LYS B 1 4   ? 10.620  7.216   2.646   1.000 23.733 0 3   LYS B CG   1 ? 
ATOM   2235 C  CD   . LYS B 1 4   ? 10.122  6.217   1.626   1.000 25.999 0 3   LYS B CD   1 ? 
ATOM   2236 C  CE   . LYS B 1 4   ? 11.237  5.501   0.882   1.000 27.431 0 3   LYS B CE   1 ? 
ATOM   2237 N  NZ   . LYS B 1 4   ? 10.725  4.829   -0.340  1.000 29.923 0 3   LYS B NZ   1 ? 
ATOM   2238 H  H    . LYS B 1 4   ? 11.369  7.726   6.102   1.000 22.193 0 3   LYS B H    1 c 
ATOM   2239 H  HA   . LYS B 1 4   ? 10.153  9.373   4.216   1.000 20.498 0 3   LYS B HA   1 c 
ATOM   2240 H  HB2  . LYS B 1 4   ? 9.670   6.579   4.357   1.000 22.141 0 3   LYS B HB2  1 c 
ATOM   2241 H  HB3  . LYS B 1 4   ? 8.778   7.563   3.495   1.000 22.141 0 3   LYS B HB3  1 c 
ATOM   2242 H  HG2  . LYS B 1 4   ? 10.748  8.083   2.204   1.000 23.914 0 3   LYS B HG2  1 c 
ATOM   2243 H  HG3  . LYS B 1 4   ? 11.494  6.920   2.979   1.000 23.920 0 3   LYS B HG3  1 c 
ATOM   2244 H  HD2  . LYS B 1 4   ? 9.566   5.549   2.079   1.000 25.765 0 3   LYS B HD2  1 c 
ATOM   2245 H  HD3  . LYS B 1 4   ? 9.557   6.684   0.973   1.000 25.779 0 3   LYS B HD3  1 c 
ATOM   2246 H  HE2  . LYS B 1 4   ? 11.926  6.143   0.627   1.000 27.651 0 3   LYS B HE2  1 c 
ATOM   2247 H  HE3  . LYS B 1 4   ? 11.645  4.833   1.466   1.000 27.651 0 3   LYS B HE3  1 c 
ATOM   2248 H  HZ1  . LYS B 1 4   ? 10.079  4.233   -0.115  1.000 29.136 0 3   LYS B HZ1  1 c 
ATOM   2249 H  HZ2  . LYS B 1 4   ? 11.401  4.391   -0.756  1.000 29.136 0 3   LYS B HZ2  1 c 
ATOM   2250 H  HZ3  . LYS B 1 4   ? 10.376  5.445   -0.907  1.000 29.129 0 3   LYS B HZ3  1 c 
ATOM   2251 N  N    . ALA B 1 5   ? 8.010   9.720   5.449   1.000 15.284 0 4   ALA B N    1 ? 
ATOM   2252 C  CA   . ALA B 1 5   ? 6.898   10.175  6.307   1.000 14.889 0 4   ALA B CA   1 ? 
ATOM   2253 C  C    . ALA B 1 5   ? 5.649   10.461  5.454   1.000 13.751 0 4   ALA B C    1 ? 
ATOM   2254 O  O    . ALA B 1 5   ? 5.769   10.656  4.224   1.000 13.251 0 4   ALA B O    1 ? 
ATOM   2255 C  CB   . ALA B 1 5   ? 7.371   11.382  7.055   1.000 14.306 0 4   ALA B CB   1 ? 
ATOM   2256 H  H    . ALA B 1 5   ? 7.982   10.102  4.622   1.000 15.816 0 4   ALA B H    1 c 
ATOM   2257 H  HA   . ALA B 1 5   ? 6.684   9.461   6.950   1.000 14.634 0 4   ALA B HA   1 c 
ATOM   2258 H  HB1  . ALA B 1 5   ? 6.658   11.710  7.628   1.000 14.482 0 4   ALA B HB1  1 c 
ATOM   2259 H  HB2  . ALA B 1 5   ? 8.140   11.146  7.601   1.000 14.482 0 4   ALA B HB2  1 c 
ATOM   2260 H  HB3  . ALA B 1 5   ? 7.624   12.077  6.428   1.000 14.478 0 4   ALA B HB3  1 c 
ATOM   2261 N  N    . VAL B 1 6   ? 4.474   10.506  6.071   1.000 13.460 0 5   VAL B N    1 ? 
ATOM   2262 C  CA   . VAL B 1 6   ? 3.193   10.700  5.317   1.000 11.705 0 5   VAL B CA   1 ? 
ATOM   2263 C  C    . VAL B 1 6   ? 2.167   11.423  6.188   1.000 12.377 0 5   VAL B C    1 ? 
ATOM   2264 O  O    . VAL B 1 6   ? 2.274   11.373  7.416   1.000 11.493 0 5   VAL B O    1 ? 
ATOM   2265 C  CB   . VAL B 1 6   ? 2.690   9.340   4.793   1.000 11.551 0 5   VAL B CB   1 ? 
ATOM   2266 C  CG1  . VAL B 1 6   ? 2.294   8.395   5.914   1.000 12.283 0 5   VAL B CG1  1 ? 
ATOM   2267 C  CG2  . VAL B 1 6   ? 1.569   9.463   3.784   1.000 11.678 0 5   VAL B CG2  1 ? 
ATOM   2268 H  H    . VAL B 1 6   ? 4.374   10.419  6.973   1.000 13.088 0 5   VAL B H    1 c 
ATOM   2269 H  HA   . VAL B 1 6   ? 3.382   11.266  4.549   1.000 12.127 0 5   VAL B HA   1 c 
ATOM   2270 H  HB   . VAL B 1 6   ? 3.452   8.921   4.322   1.000 11.759 0 5   VAL B HB   1 c 
ATOM   2271 H  HG11 . VAL B 1 6   ? 3.025   8.322   6.552   1.000 12.058 0 5   VAL B HG11 1 c 
ATOM   2272 H  HG12 . VAL B 1 6   ? 2.099   7.518   5.543   1.000 12.064 0 5   VAL B HG12 1 c 
ATOM   2273 H  HG13 . VAL B 1 6   ? 1.502   8.738   6.365   1.000 12.057 0 5   VAL B HG13 1 c 
ATOM   2274 H  HG21 . VAL B 1 6   ? 0.779   9.829   4.218   1.000 11.645 0 5   VAL B HG21 1 c 
ATOM   2275 H  HG22 . VAL B 1 6   ? 1.360   8.584   3.422   1.000 11.641 0 5   VAL B HG22 1 c 
ATOM   2276 H  HG23 . VAL B 1 6   ? 1.845   10.054  3.062   1.000 11.641 0 5   VAL B HG23 1 c 
ATOM   2277 N  N    . CYS B 1 7   ? 1.205   12.110  5.573   1.000 12.550 0 6   CYS B N    1 ? 
ATOM   2278 C  CA   . CYS B 1 7   ? 0.166   12.907  6.274   1.000 13.328 0 6   CYS B CA   1 ? 
ATOM   2279 C  C    . CYS B 1 7   ? -1.154  12.812  5.485   1.000 14.481 0 6   CYS B C    1 ? 
ATOM   2280 O  O    . CYS B 1 7   ? -1.114  12.999  4.258   1.000 13.907 0 6   CYS B O    1 ? 
ATOM   2281 C  CB   . CYS B 1 7   ? 0.592   14.357  6.451   1.000 14.960 0 6   CYS B CB   1 ? 
ATOM   2282 S  SG   . CYS B 1 7   ? -0.573  15.287  7.478   1.000 16.324 0 6   CYS B SG   1 ? 
ATOM   2283 H  H    . CYS B 1 7   ? 1.120   12.148  4.664   1.000 12.687 0 6   CYS B H    1 c 
ATOM   2284 H  HA   . CYS B 1 7   ? 0.028   12.511  7.170   1.000 13.679 0 6   CYS B HA   1 c 
ATOM   2285 H  HB2  . CYS B 1 7   ? 1.486   14.388  6.874   1.000 14.861 0 6   CYS B HB2  1 c 
ATOM   2286 H  HB3  . CYS B 1 7   ? 0.654   14.792  5.565   1.000 14.861 0 6   CYS B HB3  1 c 
ATOM   2287 H  HG   . CYS B 1 7   ? -0.015  16.319  7.432   0.000 16.260 0 6   CYS B HG   1 c 
ATOM   2288 N  N    . VAL B 1 8   ? -2.232  12.409  6.160   1.000 14.205 0 7   VAL B N    1 ? 
ATOM   2289 C  CA   . VAL B 1 8   ? -3.627  12.436  5.641   1.000 14.382 0 7   VAL B CA   1 ? 
ATOM   2290 C  C    . VAL B 1 8   ? -4.276  13.715  6.179   1.000 15.395 0 7   VAL B C    1 ? 
ATOM   2291 O  O    . VAL B 1 8   ? -4.491  13.828  7.417   1.000 16.239 0 7   VAL B O    1 ? 
ATOM   2292 C  CB   . VAL B 1 8   ? -4.453  11.173  5.979   1.000 14.066 0 7   VAL B CB   1 ? 
ATOM   2293 C  CG1  . VAL B 1 8   ? -5.832  11.204  5.340   1.000 15.145 0 7   VAL B CG1  1 ? 
ATOM   2294 C  CG2  . VAL B 1 8   ? -3.735  9.868   5.637   1.000 14.402 0 7   VAL B CG2  1 ? 
ATOM   2295 H  H    . VAL B 1 8   ? -2.177  12.081  7.009   1.000 14.305 0 7   VAL B H    1 c 
ATOM   2296 H  HA   . VAL B 1 8   ? -3.580  12.508  4.671   1.000 14.485 0 7   VAL B HA   1 c 
ATOM   2297 H  HB   . VAL B 1 8   ? -4.589  11.179  6.958   1.000 14.393 0 7   VAL B HB   1 c 
ATOM   2298 H  HG11 . VAL B 1 8   ? -6.350  11.938  5.716   1.000 14.804 0 7   VAL B HG11 1 c 
ATOM   2299 H  HG12 . VAL B 1 8   ? -6.290  10.364  5.515   1.000 14.802 0 7   VAL B HG12 1 c 
ATOM   2300 H  HG13 . VAL B 1 8   ? -5.743  11.330  4.380   1.000 14.803 0 7   VAL B HG13 1 c 
ATOM   2301 H  HG21 . VAL B 1 8   ? -3.519  9.854   4.689   1.000 14.296 0 7   VAL B HG21 1 c 
ATOM   2302 H  HG22 . VAL B 1 8   ? -4.312  9.114   5.849   1.000 14.297 0 7   VAL B HG22 1 c 
ATOM   2303 H  HG23 . VAL B 1 8   ? -2.914  9.803   6.156   1.000 14.296 0 7   VAL B HG23 1 c 
ATOM   2304 N  N    . LEU B 1 9   ? -4.599  14.631  5.261   1.000 17.823 0 8   LEU B N    1 ? 
ATOM   2305 C  CA   . LEU B 1 9   ? -5.305  15.921  5.485   1.000 18.378 0 8   LEU B CA   1 ? 
ATOM   2306 C  C    . LEU B 1 9   ? -6.829  15.737  5.421   1.000 19.754 0 8   LEU B C    1 ? 
ATOM   2307 O  O    . LEU B 1 9   ? -7.304  15.220  4.406   1.000 17.324 0 8   LEU B O    1 ? 
ATOM   2308 C  CB   . LEU B 1 9   ? -4.854  16.924  4.417   1.000 19.688 0 8   LEU B CB   1 ? 
ATOM   2309 C  CG   . LEU B 1 9   ? -3.368  17.273  4.401   1.000 20.329 0 8   LEU B CG   1 ? 
ATOM   2310 C  CD1  . LEU B 1 9   ? -2.973  17.973  3.101   1.000 20.557 0 8   LEU B CD1  1 ? 
ATOM   2311 C  CD2  . LEU B 1 9   ? -3.014  18.137  5.588   1.000 19.617 0 8   LEU B CD2  1 ? 
ATOM   2312 H  H    . LEU B 1 9   ? -4.390  14.507  4.383   1.000 17.336 0 8   LEU B H    1 c 
ATOM   2313 H  HA   . LEU B 1 9   ? -5.062  16.259  6.376   1.000 18.756 0 8   LEU B HA   1 c 
ATOM   2314 H  HB2  . LEU B 1 9   ? -5.095  16.566  3.540   1.000 19.514 0 8   LEU B HB2  1 c 
ATOM   2315 H  HB3  . LEU B 1 9   ? -5.361  17.751  4.544   1.000 19.517 0 8   LEU B HB3  1 c 
ATOM   2316 H  HG   . LEU B 1 9   ? -2.851  16.433  4.467   1.000 20.106 0 8   LEU B HG   1 c 
ATOM   2317 H  HD11 . LEU B 1 9   ? -3.183  17.397  2.346   1.000 20.486 0 8   LEU B HD11 1 c 
ATOM   2318 H  HD12 . LEU B 1 9   ? -2.019  18.161  3.110   1.000 20.486 0 8   LEU B HD12 1 c 
ATOM   2319 H  HD13 . LEU B 1 9   ? -3.467  18.807  3.019   1.000 20.486 0 8   LEU B HD13 1 c 
ATOM   2320 H  HD21 . LEU B 1 9   ? -3.558  18.944  5.577   1.000 19.829 0 8   LEU B HD21 1 c 
ATOM   2321 H  HD22 . LEU B 1 9   ? -2.073  18.382  5.542   1.000 19.822 0 8   LEU B HD22 1 c 
ATOM   2322 H  HD23 . LEU B 1 9   ? -3.180  17.645  6.410   1.000 19.825 0 8   LEU B HD23 1 c 
ATOM   2323 N  N    . LYS B 1 10  ? -7.544  16.107  6.493   1.000 19.488 0 9   LYS B N    1 ? 
ATOM   2324 C  CA   . LYS B 1 10  ? -9.035  16.064  6.609   1.000 24.733 0 9   LYS B CA   1 ? 
ATOM   2325 C  C    . LYS B 1 10  ? -9.543  17.339  7.290   1.000 24.269 0 9   LYS B C    1 ? 
ATOM   2326 O  O    . LYS B 1 10  ? -8.852  17.796  8.250   1.000 23.554 0 9   LYS B O    1 ? 
ATOM   2327 C  CB   . LYS B 1 10  ? -9.490  14.865  7.444   1.000 26.304 0 9   LYS B CB   1 ? 
ATOM   2328 C  CG   . LYS B 1 10  ? -9.378  13.532  6.719   1.000 29.930 0 9   LYS B CG   1 ? 
ATOM   2329 C  CD   . LYS B 1 10  ? -10.236 12.443  7.311   1.000 31.933 0 9   LYS B CD   1 ? 
ATOM   2330 C  CE   . LYS B 1 10  ? -10.786 11.531  6.237   1.000 35.143 0 9   LYS B CE   1 ? 
ATOM   2331 N  NZ   . LYS B 1 10  ? -9.712  10.988  5.366   1.000 36.375 0 9   LYS B NZ   1 ? 
ATOM   2332 H  H    . LYS B 1 10  ? -7.143  16.418  7.250   1.000 20.678 0 9   LYS B H    1 c 
ATOM   2333 H  HA   . LYS B 1 10  ? -9.422  15.999  5.706   1.000 23.815 0 9   LYS B HA   1 c 
ATOM   2334 H  HB2  . LYS B 1 10  ? -8.948  14.827  8.260   1.000 26.731 0 9   LYS B HB2  1 c 
ATOM   2335 H  HB3  . LYS B 1 10  ? -10.424 15.003  7.707   1.000 26.744 0 9   LYS B HB3  1 c 
ATOM   2336 H  HG2  . LYS B 1 10  ? -9.632  13.665  5.781   1.000 29.503 0 9   LYS B HG2  1 c 
ATOM   2337 H  HG3  . LYS B 1 10  ? -8.440  13.243  6.737   1.000 29.485 0 9   LYS B HG3  1 c 
ATOM   2338 H  HD2  . LYS B 1 10  ? -9.701  11.913  7.941   1.000 32.165 0 9   LYS B HD2  1 c 
ATOM   2339 H  HD3  . LYS B 1 10  ? -10.982 12.845  7.805   1.000 32.141 0 9   LYS B HD3  1 c 
ATOM   2340 H  HE2  . LYS B 1 10  ? -11.263 10.790  6.653   1.000 34.678 0 9   LYS B HE2  1 c 
ATOM   2341 H  HE3  . LYS B 1 10  ? -11.419 12.026  5.686   1.000 34.655 0 9   LYS B HE3  1 c 
ATOM   2342 H  HZ1  . LYS B 1 10  ? -9.459  11.613  4.758   1.000 35.961 0 9   LYS B HZ1  1 c 
ATOM   2343 H  HZ2  . LYS B 1 10  ? -10.017 10.255  4.925   1.000 35.985 0 9   LYS B HZ2  1 c 
ATOM   2344 H  HZ3  . LYS B 1 10  ? -8.994  10.753  5.871   1.000 35.979 0 9   LYS B HZ3  1 c 
ATOM   2345 N  N    A GLY B 1 11  ? -10.759 17.819  7.000   0.400 26.334 0 10  GLY B N    1 ? 
ATOM   2346 N  N    B GLY B 1 11  ? -10.569 17.918  6.632   0.600 24.501 0 10  GLY B N    1 ? 
ATOM   2347 C  CA   A GLY B 1 11  ? -11.285 19.055  7.631   0.400 26.904 0 10  GLY B CA   1 ? 
ATOM   2348 C  CA   B GLY B 1 11  ? -11.455 19.022  7.063   0.600 24.476 0 10  GLY B CA   1 ? 
ATOM   2349 C  C    A GLY B 1 11  ? -12.733 18.972  8.092   0.400 26.634 0 10  GLY B C    1 ? 
ATOM   2350 C  C    B GLY B 1 11  ? -12.644 19.221  6.119   0.600 23.506 0 10  GLY B C    1 ? 
ATOM   2351 O  O    A GLY B 1 11  ? -13.341 17.894  7.969   0.400 25.879 0 10  GLY B O    1 ? 
ATOM   2352 O  O    B GLY B 1 11  ? -12.723 18.513  5.074   0.600 22.041 0 10  GLY B O    1 ? 
ATOM   2353 H  H    A GLY B 1 11  ? -11.322 17.416  6.408   0.400 25.963 0 10  GLY B H    1 c 
ATOM   2354 H  H    B GLY B 1 11  ? -10.792 17.631  5.797   0.600 24.436 0 10  GLY B H    1 c 
ATOM   2355 H  HA2  A GLY B 1 11  ? -10.716 19.282  8.409   0.400 26.684 0 10  GLY B HA2  1 c 
ATOM   2356 H  HA2  B GLY B 1 11  ? -11.791 18.825  7.973   0.600 24.242 0 10  GLY B HA2  1 c 
ATOM   2357 H  HA3  A GLY B 1 11  ? -11.203 19.792  6.982   0.400 26.658 0 10  GLY B HA3  1 c 
ATOM   2358 H  HA3  B GLY B 1 11  ? -10.929 19.854  7.108   0.600 24.211 0 10  GLY B HA3  1 c 
ATOM   2359 N  N    A ASP B 1 12  ? -13.264 20.092  8.605   0.400 28.501 0 11  ASP B N    1 ? 
ATOM   2360 N  N    B ASP B 1 12  ? -13.542 20.152  6.466   0.600 23.666 0 11  ASP B N    1 ? 
ATOM   2361 C  CA   A ASP B 1 12  ? -14.718 20.302  8.866   0.400 29.519 0 11  ASP B CA   1 ? 
ATOM   2362 C  CA   B ASP B 1 12  ? -14.846 20.411  5.786   0.600 24.278 0 11  ASP B CA   1 ? 
ATOM   2363 C  C    A ASP B 1 12  ? -15.454 20.570  7.546   0.400 28.695 0 11  ASP B C    1 ? 
ATOM   2364 C  C    B ASP B 1 12  ? -14.643 20.976  4.377   0.600 25.898 0 11  ASP B C    1 ? 
ATOM   2365 O  O    A ASP B 1 12  ? -16.595 21.073  7.605   0.400 28.224 0 11  ASP B O    1 ? 
ATOM   2366 O  O    B ASP B 1 12  ? -13.634 21.663  4.151   0.600 26.042 0 11  ASP B O    1 ? 
ATOM   2367 C  CB   A ASP B 1 12  ? -14.993 21.499  9.785   0.400 31.923 0 11  ASP B CB   1 ? 
ATOM   2368 C  CB   B ASP B 1 12  ? -15.711 21.405  6.566   0.600 24.341 0 11  ASP B CB   1 ? 
ATOM   2369 C  CG   A ASP B 1 12  ? -14.246 21.488  11.105  0.400 34.350 0 11  ASP B CG   1 ? 
ATOM   2370 C  CG   B ASP B 1 12  ? -16.152 20.886  7.920   0.600 26.165 0 11  ASP B CG   1 ? 
ATOM   2371 O  OD1  A ASP B 1 12  ? -13.016 21.310  11.079  0.400 38.064 0 11  ASP B OD1  1 ? 
ATOM   2372 O  OD1  B ASP B 1 12  ? -16.538 19.704  7.988   0.600 25.541 0 11  ASP B OD1  1 ? 
ATOM   2373 O  OD2  A ASP B 1 12  ? -14.903 21.666  12.150  0.400 35.592 0 11  ASP B OD2  1 ? 
ATOM   2374 O  OD2  B ASP B 1 12  ? -16.078 21.657  8.902   0.600 28.513 0 11  ASP B OD2  1 ? 
ATOM   2375 H  H    A ASP B 1 12  ? -12.751 20.810  8.830   0.400 28.283 0 11  ASP B H    1 c 
ATOM   2376 H  H    B ASP B 1 12  ? -13.397 20.711  7.171   0.600 23.775 0 11  ASP B H    1 c 
ATOM   2377 H  HA   A ASP B 1 12  ? -15.087 19.488  9.282   0.400 29.604 0 11  ASP B HA   1 c 
ATOM   2378 H  HA   B ASP B 1 12  ? -15.335 19.558  5.715   0.600 24.471 0 11  ASP B HA   1 c 
ATOM   2379 H  HB2  A ASP B 1 12  ? -14.755 22.321  9.308   0.400 31.887 0 11  ASP B HB2  1 c 
ATOM   2380 H  HB2  B ASP B 1 12  ? -15.204 22.232  6.701   0.600 24.749 0 11  ASP B HB2  1 c 
ATOM   2381 H  HB3  A ASP B 1 12  ? -15.952 21.530  9.980   0.400 31.887 0 11  ASP B HB3  1 c 
ATOM   2382 H  HB3  B ASP B 1 12  ? -16.510 21.617  6.042   0.600 24.747 0 11  ASP B HB3  1 c 
ATOM   2383 N  N    A GLY B 1 13  ? -14.829 20.273  6.403   0.400 26.729 0 12  GLY B N    1 ? 
ATOM   2384 N  N    B GLY B 1 13  ? -15.673 20.801  3.544   0.600 26.982 0 12  GLY B N    1 ? 
ATOM   2385 C  CA   A GLY B 1 13  ? -15.373 20.608  5.072   0.400 25.982 0 12  GLY B CA   1 ? 
ATOM   2386 C  CA   B GLY B 1 13  ? -15.669 20.825  2.067   0.600 27.557 0 12  GLY B CA   1 ? 
ATOM   2387 C  C    A GLY B 1 13  ? -15.020 19.548  4.037   0.400 25.027 0 12  GLY B C    1 ? 
ATOM   2388 C  C    B GLY B 1 13  ? -16.293 19.500  1.650   0.600 28.636 0 12  GLY B C    1 ? 
ATOM   2389 O  O    A GLY B 1 13  ? -14.645 18.437  4.395   0.400 24.162 0 12  GLY B O    1 ? 
ATOM   2390 O  O    B GLY B 1 13  ? -17.517 19.399  1.576   0.600 30.364 0 12  GLY B O    1 ? 
ATOM   2391 H  H    A GLY B 1 13  ? -14.026 19.844  6.384   0.400 27.001 0 12  GLY B H    1 c 
ATOM   2392 H  H    B GLY B 1 13  ? -16.509 20.648  3.875   0.600 26.842 0 12  GLY B H    1 c 
ATOM   2393 H  HA2  A GLY B 1 13  ? -16.357 20.690  5.137   0.400 25.930 0 12  GLY B HA2  1 c 
ATOM   2394 H  HA2  B GLY B 1 13  ? -16.210 21.583  1.735   0.600 27.660 0 12  GLY B HA2  1 c 
ATOM   2395 H  HA3  A GLY B 1 13  ? -15.007 21.482  4.785   0.400 25.930 0 12  GLY B HA3  1 c 
ATOM   2396 H  HA3  B GLY B 1 13  ? -14.741 20.894  1.729   0.600 27.659 0 12  GLY B HA3  1 c 
ATOM   2397 N  N    A PRO B 1 14  ? -15.103 19.856  2.724   0.400 25.924 0 13  PRO B N    1 ? 
ATOM   2398 N  N    B PRO B 1 14  ? -15.480 18.549  1.149   0.600 27.278 0 13  PRO B N    1 ? 
ATOM   2399 C  CA   A PRO B 1 14  ? -14.768 18.879  1.691   0.400 25.579 0 13  PRO B CA   1 ? 
ATOM   2400 C  CA   B PRO B 1 14  ? -14.495 17.865  1.979   0.600 26.472 0 13  PRO B CA   1 ? 
ATOM   2401 C  C    A PRO B 1 14  ? -13.289 18.903  1.268   0.400 25.186 0 13  PRO B C    1 ? 
ATOM   2402 C  C    B PRO B 1 14  ? -13.145 18.374  1.442   0.600 25.650 0 13  PRO B C    1 ? 
ATOM   2403 O  O    A PRO B 1 14  ? -13.034 18.749  0.091   0.400 23.381 0 13  PRO B O    1 ? 
ATOM   2404 O  O    B PRO B 1 14  ? -12.879 18.083  0.309   0.600 24.809 0 13  PRO B O    1 ? 
ATOM   2405 C  CB   A PRO B 1 14  ? -15.652 19.366  0.534   0.400 26.435 0 13  PRO B CB   1 ? 
ATOM   2406 C  CB   B PRO B 1 14  ? -14.731 16.372  1.698   0.600 26.337 0 13  PRO B CB   1 ? 
ATOM   2407 C  CG   A PRO B 1 14  ? -15.601 20.880  0.660   0.400 26.452 0 13  PRO B CG   1 ? 
ATOM   2408 C  CG   B PRO B 1 14  ? -15.762 16.354  0.558   0.600 27.754 0 13  PRO B CG   1 ? 
ATOM   2409 C  CD   A PRO B 1 14  ? -15.515 21.151  2.152   0.400 25.760 0 13  PRO B CD   1 ? 
ATOM   2410 C  CD   B PRO B 1 14  ? -15.749 17.746  -0.050  0.600 28.062 0 13  PRO B CD   1 ? 
ATOM   2411 H  HA   A PRO B 1 14  ? -15.042 17.971  1.975   0.400 25.733 0 13  PRO B HA   1 c 
ATOM   2412 H  HA   B PRO B 1 14  ? -14.622 18.080  2.937   0.600 26.439 0 13  PRO B HA   1 c 
ATOM   2413 H  HB2  A PRO B 1 14  ? -15.295 19.073  -0.332  0.400 26.240 0 13  PRO B HB2  1 c 
ATOM   2414 H  HB2  B PRO B 1 14  ? -13.899 15.930  1.423   0.600 26.686 0 13  PRO B HB2  1 c 
ATOM   2415 H  HB3  A PRO B 1 14  ? -16.571 19.036  0.628   0.400 26.240 0 13  PRO B HB3  1 c 
ATOM   2416 H  HB3  B PRO B 1 14  ? -15.082 15.918  2.493   0.600 26.691 0 13  PRO B HB3  1 c 
ATOM   2417 H  HG2  A PRO B 1 14  ? -14.818 21.241  0.195   0.400 26.289 0 13  PRO B HG2  1 c 
ATOM   2418 H  HG2  B PRO B 1 14  ? -15.521 15.684  -0.113  0.600 27.481 0 13  PRO B HG2  1 c 
ATOM   2419 H  HG3  A PRO B 1 14  ? -16.408 21.285  0.281   0.400 26.289 0 13  PRO B HG3  1 c 
ATOM   2420 H  HG3  B PRO B 1 14  ? -16.652 16.140  0.906   0.600 27.481 0 13  PRO B HG3  1 c 
ATOM   2421 H  HD2  A PRO B 1 14  ? -14.855 21.842  2.344   0.400 25.966 0 13  PRO B HD2  1 c 
ATOM   2422 H  HD2  B PRO B 1 14  ? -15.045 17.842  -0.717  0.600 27.788 0 13  PRO B HD2  1 c 
ATOM   2423 H  HD3  A PRO B 1 14  ? -16.379 21.430  2.508   0.400 25.966 0 13  PRO B HD3  1 c 
ATOM   2424 H  HD3  B PRO B 1 14  ? -16.610 17.972  -0.448  0.600 27.802 0 13  PRO B HD3  1 c 
ATOM   2425 N  N    . VAL B 1 15  ? -12.365 19.154  2.203   1.000 24.347 0 14  VAL B N    1 ? 
ATOM   2426 C  CA   . VAL B 1 15  ? -10.930 19.400  1.849   1.000 24.071 0 14  VAL B CA   1 ? 
ATOM   2427 C  C    . VAL B 1 15  ? -10.144 18.177  2.330   1.000 22.239 0 14  VAL B C    1 ? 
ATOM   2428 O  O    . VAL B 1 15  ? -10.281 17.826  3.538   1.000 19.718 0 14  VAL B O    1 ? 
ATOM   2429 C  CB   . VAL B 1 15  ? -10.377 20.721  2.428   1.000 24.434 0 14  VAL B CB   1 ? 
ATOM   2430 C  CG1  . VAL B 1 15  ? -8.909  20.930  2.087   1.000 25.859 0 14  VAL B CG1  1 ? 
ATOM   2431 C  CG2  . VAL B 1 15  ? -11.185 21.930  1.971   1.000 25.447 0 14  VAL B CG2  1 ? 
ATOM   2432 H  H    . VAL B 1 15  ? -12.596 19.379  3.047   1.000 24.701 0 14  VAL B H    1 c 
ATOM   2433 H  HA   . VAL B 1 15  ? -10.857 19.446  0.882   1.000 23.813 0 14  VAL B HA   1 c 
ATOM   2434 H  HB   . VAL B 1 15  ? -10.451 20.664  3.413   1.000 24.821 0 14  VAL B HB   1 c 
ATOM   2435 H  HG11 . VAL B 1 15  ? -8.369  20.257  2.539   1.000 25.407 0 14  VAL B HG11 1 c 
ATOM   2436 H  HG12 . VAL B 1 15  ? -8.631  21.816  2.378   1.000 25.412 0 14  VAL B HG12 1 c 
ATOM   2437 H  HG13 . VAL B 1 15  ? -8.784  20.852  1.125   1.000 25.412 0 14  VAL B HG13 1 c 
ATOM   2438 H  HG21 . VAL B 1 15  ? -11.055 22.065  1.016   1.000 25.117 0 14  VAL B HG21 1 c 
ATOM   2439 H  HG22 . VAL B 1 15  ? -10.887 22.722  2.453   1.000 25.124 0 14  VAL B HG22 1 c 
ATOM   2440 H  HG23 . VAL B 1 15  ? -12.129 21.779  2.150   1.000 25.128 0 14  VAL B HG23 1 c 
ATOM   2441 N  N    . GLN B 1 16  ? -9.434  17.503  1.423   1.000 20.834 0 15  GLN B N    1 ? 
ATOM   2442 C  CA   . GLN B 1 16  ? -8.749  16.228  1.758   1.000 22.288 0 15  GLN B CA   1 ? 
ATOM   2443 C  C    . GLN B 1 16  ? -7.589  15.927  0.799   1.000 20.162 0 15  GLN B C    1 ? 
ATOM   2444 O  O    . GLN B 1 16  ? -7.653  16.221  -0.423  1.000 18.015 0 15  GLN B O    1 ? 
ATOM   2445 C  CB   . GLN B 1 16  ? -9.811  15.135  1.869   1.000 27.393 0 15  GLN B CB   1 ? 
ATOM   2446 C  CG   . GLN B 1 16  ? -10.155 14.406  0.587   1.000 29.477 0 15  GLN B CG   1 ? 
ATOM   2447 C  CD   . GLN B 1 16  ? -11.295 13.464  0.884   1.000 32.373 0 15  GLN B CD   1 ? 
ATOM   2448 O  OE1  . GLN B 1 16  ? -11.660 13.241  2.042   1.000 37.643 0 15  GLN B OE1  1 ? 
ATOM   2449 N  NE2  . GLN B 1 16  ? -11.881 12.917  -0.159  1.000 35.110 0 15  GLN B NE2  1 ? 
ATOM   2450 H  H    . GLN B 1 16  ? -9.329  17.778  0.561   1.000 21.499 0 15  GLN B H    1 c 
ATOM   2451 H  HA   . GLN B 1 16  ? -8.359  16.345  2.651   1.000 22.411 0 15  GLN B HA   1 c 
ATOM   2452 H  HB2  . GLN B 1 16  ? -9.498  14.479  2.527   1.000 26.572 0 15  GLN B HB2  1 c 
ATOM   2453 H  HB3  . GLN B 1 16  ? -10.628 15.541  2.227   1.000 26.542 0 15  GLN B HB3  1 c 
ATOM   2454 H  HG2  . GLN B 1 16  ? -10.421 15.047  -0.106  1.000 29.624 0 15  GLN B HG2  1 c 
ATOM   2455 H  HG3  . GLN B 1 16  ? -9.379  13.899  0.267   1.000 29.600 0 15  GLN B HG3  1 c 
ATOM   2456 H  HE21 . GLN B 1 16  ? -12.344 12.167  -0.065  1.000 34.240 0 15  GLN B HE21 1 c 
ATOM   2457 H  HE22 . GLN B 1 16  ? -11.816 13.304  -0.950  1.000 34.198 0 15  GLN B HE22 1 c 
ATOM   2458 N  N    . GLY B 1 17  ? -6.528  15.338  1.337   1.000 16.738 0 16  GLY B N    1 ? 
ATOM   2459 C  CA   . GLY B 1 17  ? -5.347  15.027  0.526   1.000 16.935 0 16  GLY B CA   1 ? 
ATOM   2460 C  C    . GLY B 1 17  ? -4.374  14.138  1.256   1.000 16.029 0 16  GLY B C    1 ? 
ATOM   2461 O  O    . GLY B 1 17  ? -4.482  14.019  2.495   1.000 15.036 0 16  GLY B O    1 ? 
ATOM   2462 H  H    . GLY B 1 17  ? -6.478  15.102  2.216   1.000 17.556 0 16  GLY B H    1 c 
ATOM   2463 H  HA2  . GLY B 1 17  ? -5.636  14.578  -0.307  1.000 16.679 0 16  GLY B HA2  1 c 
ATOM   2464 H  HA3  . GLY B 1 17  ? -4.896  15.872  0.279   1.000 16.677 0 16  GLY B HA3  1 c 
ATOM   2465 N  N    . ILE B 1 18  ? -3.459  13.546  0.500   1.000 15.734 0 17  ILE B N    1 ? 
ATOM   2466 C  CA   . ILE B 1 18  ? -2.322  12.762  1.061   1.000 16.274 0 17  ILE B CA   1 ? 
ATOM   2467 C  C    . ILE B 1 18  ? -1.014  13.489  0.700   1.000 16.152 0 17  ILE B C    1 ? 
ATOM   2468 O  O    . ILE B 1 18  ? -0.774  13.706  -0.541  1.000 14.109 0 17  ILE B O    1 ? 
ATOM   2469 C  CB   . ILE B 1 18  ? -2.416  11.310  0.552   1.000 17.564 0 17  ILE B CB   1 ? 
ATOM   2470 C  CG1  . ILE B 1 18  ? -3.736  10.664  0.988   1.000 18.655 0 17  ILE B CG1  1 ? 
ATOM   2471 C  CG2  . ILE B 1 18  ? -1.204  10.494  0.977   1.000 17.819 0 17  ILE B CG2  1 ? 
ATOM   2472 C  CD1  . ILE B 1 18  ? -3.924  9.228   0.510   1.000 18.908 0 17  ILE B CD1  1 ? 
ATOM   2473 H  H    . ILE B 1 18  ? -3.469  13.582  -0.411  1.000 15.933 0 17  ILE B H    1 c 
ATOM   2474 H  HA   . ILE B 1 18  ? -2.407  12.747  2.030   1.000 16.365 0 17  ILE B HA   1 c 
ATOM   2475 H  HB   . ILE B 1 18  ? -2.419  11.345  -0.436  1.000 17.557 0 17  ILE B HB   1 c 
ATOM   2476 H  HG12 . ILE B 1 18  ? -3.782  10.676  1.968   1.000 18.448 0 17  ILE B HG12 1 c 
ATOM   2477 H  HG13 . ILE B 1 18  ? -4.479  11.206  0.648   1.000 18.443 0 17  ILE B HG13 1 c 
ATOM   2478 H  HG21 . ILE B 1 18  ? -0.392  10.917  0.648   1.000 17.737 0 17  ILE B HG21 1 c 
ATOM   2479 H  HG22 . ILE B 1 18  ? -1.268  9.596   0.608   1.000 17.744 0 17  ILE B HG22 1 c 
ATOM   2480 H  HG23 . ILE B 1 18  ? -1.170  10.442  1.947   1.000 17.740 0 17  ILE B HG23 1 c 
ATOM   2481 H  HD11 . ILE B 1 18  ? -3.777  9.183   -0.451  1.000 18.824 0 17  ILE B HD11 1 c 
ATOM   2482 H  HD12 . ILE B 1 18  ? -4.830  8.935   0.712   1.000 18.824 0 17  ILE B HD12 1 c 
ATOM   2483 H  HD13 . ILE B 1 18  ? -3.289  8.646   0.962   1.000 18.815 0 17  ILE B HD13 1 c 
ATOM   2484 N  N    . ILE B 1 19  ? -0.206  13.858  1.719   1.000 14.331 0 18  ILE B N    1 ? 
ATOM   2485 C  CA   . ILE B 1 19  ? 1.139   14.478  1.501   1.000 14.629 0 18  ILE B CA   1 ? 
ATOM   2486 C  C    . ILE B 1 19  ? 2.257   13.512  1.949   1.000 14.412 0 18  ILE B C    1 ? 
ATOM   2487 O  O    . ILE B 1 19  ? 2.206   13.033  3.098   1.000 13.906 0 18  ILE B O    1 ? 
ATOM   2488 C  CB   . ILE B 1 19  ? 1.259   15.860  2.170   1.000 14.892 0 18  ILE B CB   1 ? 
ATOM   2489 C  CG1  . ILE B 1 19  ? 0.179   16.828  1.672   1.000 15.391 0 18  ILE B CG1  1 ? 
ATOM   2490 C  CG2  . ILE B 1 19  ? 2.657   16.445  1.949   1.000 14.730 0 18  ILE B CG2  1 ? 
ATOM   2491 C  CD1  . ILE B 1 19  ? 0.257   17.115  0.190   1.000 15.676 0 18  ILE B CD1  1 ? 
ATOM   2492 H  H    . ILE B 1 19  ? -0.428  13.754  2.596   1.000 14.816 0 18  ILE B H    1 c 
ATOM   2493 H  HA   . ILE B 1 19  ? 1.243   14.614  0.544   1.000 14.581 0 18  ILE B HA   1 c 
ATOM   2494 H  HB   . ILE B 1 19  ? 1.129   15.737  3.142   1.000 14.904 0 18  ILE B HB   1 c 
ATOM   2495 H  HG12 . ILE B 1 19  ? -0.703  16.450  1.875   1.000 15.336 0 18  ILE B HG12 1 c 
ATOM   2496 H  HG13 . ILE B 1 19  ? 0.264   17.674  2.161   1.000 15.338 0 18  ILE B HG13 1 c 
ATOM   2497 H  HG21 . ILE B 1 19  ? 3.299   15.982  2.516   1.000 14.780 0 18  ILE B HG21 1 c 
ATOM   2498 H  HG22 . ILE B 1 19  ? 2.653   17.392  2.175   1.000 14.781 0 18  ILE B HG22 1 c 
ATOM   2499 H  HG23 . ILE B 1 19  ? 2.913   16.337  1.016   1.000 14.783 0 18  ILE B HG23 1 c 
ATOM   2500 H  HD11 . ILE B 1 19  ? 1.141   17.453  -0.033  1.000 15.583 0 18  ILE B HD11 1 c 
ATOM   2501 H  HD12 . ILE B 1 19  ? -0.411  17.782  -0.046  1.000 15.586 0 18  ILE B HD12 1 c 
ATOM   2502 H  HD13 . ILE B 1 19  ? 0.086   16.299  -0.312  1.000 15.582 0 18  ILE B HD13 1 c 
ATOM   2503 N  N    . ASN B 1 20  ? 3.225   13.298  1.051   1.000 13.281 0 19  ASN B N    1 ? 
ATOM   2504 C  CA   . ASN B 1 20  ? 4.425   12.419  1.210   1.000 14.609 0 19  ASN B CA   1 ? 
ATOM   2505 C  C    . ASN B 1 20  ? 5.679   13.243  1.517   1.000 14.297 0 19  ASN B C    1 ? 
ATOM   2506 O  O    . ASN B 1 20  ? 5.782   14.370  1.007   1.000 13.211 0 19  ASN B O    1 ? 
ATOM   2507 C  CB   . ASN B 1 20  ? 4.647   11.596  -0.063  1.000 15.462 0 19  ASN B CB   1 ? 
ATOM   2508 C  CG   . ASN B 1 20  ? 3.457   10.712  -0.371  1.000 18.970 0 19  ASN B CG   1 ? 
ATOM   2509 O  OD1  . ASN B 1 20  ? 3.270   9.692   0.285   1.000 21.142 0 19  ASN B OD1  1 ? 
ATOM   2510 N  ND2  . ASN B 1 20  ? 2.630   11.124  -1.327  1.000 20.105 0 19  ASN B ND2  1 ? 
ATOM   2511 H  H    . ASN B 1 20  ? 3.211   13.707  0.237   1.000 13.854 0 19  ASN B H    1 c 
ATOM   2512 H  HA   . ASN B 1 20  ? 4.262   11.793  1.954   1.000 14.441 0 19  ASN B HA   1 c 
ATOM   2513 H  HB2  . ASN B 1 20  ? 4.802   12.205  -0.813  1.000 16.045 0 19  ASN B HB2  1 c 
ATOM   2514 H  HB3  . ASN B 1 20  ? 5.443   11.038  0.050   1.000 16.018 0 19  ASN B HB3  1 c 
ATOM   2515 H  HD21 . ASN B 1 20  ? 1.957   10.610  -1.580  1.000 19.746 0 19  ASN B HD21 1 c 
ATOM   2516 H  HD22 . ASN B 1 20  ? 2.751   11.912  -1.710  1.000 19.723 0 19  ASN B HD22 1 c 
ATOM   2517 N  N    . PHE B 1 21  ? 6.577   12.703  2.354   1.000 14.070 0 20  PHE B N    1 ? 
ATOM   2518 C  CA   . PHE B 1 21  ? 7.905   13.285  2.704   1.000 14.365 0 20  PHE B CA   1 ? 
ATOM   2519 C  C    . PHE B 1 21  ? 8.992   12.231  2.501   1.000 14.753 0 20  PHE B C    1 ? 
ATOM   2520 O  O    . PHE B 1 21  ? 8.766   11.079  2.911   1.000 14.746 0 20  PHE B O    1 ? 
ATOM   2521 C  CB   . PHE B 1 21  ? 7.974   13.755  4.163   1.000 13.533 0 20  PHE B CB   1 ? 
ATOM   2522 C  CG   . PHE B 1 21  ? 6.919   14.755  4.554   1.000 13.174 0 20  PHE B CG   1 ? 
ATOM   2523 C  CD1  . PHE B 1 21  ? 5.618   14.355  4.829   1.000 13.342 0 20  PHE B CD1  1 ? 
ATOM   2524 C  CD2  . PHE B 1 21  ? 7.227   16.105  4.646   1.000 13.313 0 20  PHE B CD2  1 ? 
ATOM   2525 C  CE1  . PHE B 1 21  ? 4.659   15.283  5.228   1.000 13.771 0 20  PHE B CE1  1 ? 
ATOM   2526 C  CE2  . PHE B 1 21  ? 6.264   17.037  5.000   1.000 13.231 0 20  PHE B CE2  1 ? 
ATOM   2527 C  CZ   . PHE B 1 21  ? 4.985   16.621  5.303   1.000 14.520 0 20  PHE B CZ   1 ? 
ATOM   2528 H  H    . PHE B 1 21  ? 6.430   11.913  2.782   1.000 14.196 0 20  PHE B H    1 c 
ATOM   2529 H  HA   . PHE B 1 21  ? 8.087   14.052  2.110   1.000 14.231 0 20  PHE B HA   1 c 
ATOM   2530 H  HB2  . PHE B 1 21  ? 7.894   12.971  4.740   1.000 13.645 0 20  PHE B HB2  1 c 
ATOM   2531 H  HB3  . PHE B 1 21  ? 8.857   14.150  4.318   1.000 13.641 0 20  PHE B HB3  1 c 
ATOM   2532 H  HD1  . PHE B 1 21  ? 5.395   13.439  4.792   1.000 13.422 0 20  PHE B HD1  1 c 
ATOM   2533 H  HD2  . PHE B 1 21  ? 8.103   16.394  4.449   1.000 13.313 0 20  PHE B HD2  1 c 
ATOM   2534 H  HE1  . PHE B 1 21  ? 3.777   15.000  5.412   1.000 13.809 0 20  PHE B HE1  1 c 
ATOM   2535 H  HE2  . PHE B 1 21  ? 6.492   17.950  5.065   1.000 13.544 0 20  PHE B HE2  1 c 
ATOM   2536 H  HZ   . PHE B 1 21  ? 4.329   17.254  5.547   1.000 13.982 0 20  PHE B HZ   1 c 
ATOM   2537 N  N    . GLU B 1 22  ? 10.148  12.638  1.936   1.000 17.193 0 21  GLU B N    1 ? 
ATOM   2538 C  CA   . GLU B 1 22  ? 11.359  11.795  1.715   1.000 18.860 0 21  GLU B CA   1 ? 
ATOM   2539 C  C    . GLU B 1 22  ? 12.617  12.617  2.007   1.000 18.850 0 21  GLU B C    1 ? 
ATOM   2540 O  O    . GLU B 1 22  ? 12.659  13.800  1.608   1.000 18.044 0 21  GLU B O    1 ? 
ATOM   2541 C  CB   . GLU B 1 22  ? 11.444  11.248  0.278   1.000 20.450 0 21  GLU B CB   1 ? 
ATOM   2542 C  CG   . GLU B 1 22  ? 12.550  10.205  0.095   1.000 25.405 0 21  GLU B CG   1 ? 
ATOM   2543 C  CD   . GLU B 1 22  ? 12.398  9.193   -1.039  1.000 28.863 0 21  GLU B CD   1 ? 
ATOM   2544 O  OE1  . GLU B 1 22  ? 13.169  8.192   -1.054  1.000 32.121 0 21  GLU B OE1  1 ? 
ATOM   2545 O  OE2  . GLU B 1 22  ? 11.496  9.372   -1.884  1.000 28.519 0 21  GLU B OE2  1 ? 
ATOM   2546 H  H    . GLU B 1 22  ? 10.258  13.494  1.642   1.000 16.938 0 21  GLU B H    1 c 
ATOM   2547 H  HA   . GLU B 1 22  ? 11.324  11.037  2.339   1.000 18.819 0 21  GLU B HA   1 c 
ATOM   2548 H  HB2  . GLU B 1 22  ? 10.582  10.845  0.045   1.000 21.133 0 21  GLU B HB2  1 c 
ATOM   2549 H  HB3  . GLU B 1 22  ? 11.604  11.995  -0.335  1.000 21.117 0 21  GLU B HB3  1 c 
ATOM   2550 H  HG2  . GLU B 1 22  ? 13.398  10.680  -0.041  1.000 24.856 0 21  GLU B HG2  1 c 
ATOM   2551 H  HG3  . GLU B 1 22  ? 12.638  9.702   0.933   1.000 24.840 0 21  GLU B HG3  1 c 
ATOM   2552 N  N    . GLN B 1 23  ? 13.585  12.013  2.705   1.000 19.091 0 22  GLN B N    1 ? 
ATOM   2553 C  CA   . GLN B 1 23  ? 14.921  12.588  3.039   1.000 20.799 0 22  GLN B CA   1 ? 
ATOM   2554 C  C    . GLN B 1 23  ? 15.933  11.444  2.859   1.000 23.192 0 22  GLN B C    1 ? 
ATOM   2555 O  O    . GLN B 1 23  ? 15.884  10.492  3.659   1.000 21.695 0 22  GLN B O    1 ? 
ATOM   2556 C  CB   . GLN B 1 23  ? 14.890  13.184  4.457   1.000 20.237 0 22  GLN B CB   1 ? 
ATOM   2557 C  CG   . GLN B 1 23  ? 16.115  14.008  4.851   1.000 18.387 0 22  GLN B CG   1 ? 
ATOM   2558 C  CD   . GLN B 1 23  ? 16.029  14.606  6.245   1.000 19.004 0 22  GLN B CD   1 ? 
ATOM   2559 O  OE1  . GLN B 1 23  ? 15.388  14.069  7.148   1.000 18.761 0 22  GLN B OE1  1 ? 
ATOM   2560 N  NE2  . GLN B 1 23  ? 16.687  15.740  6.458   1.000 18.064 0 22  GLN B NE2  1 ? 
ATOM   2561 H  H    . GLN B 1 23  ? 13.475  11.171  3.038   1.000 19.427 0 22  GLN B H    1 c 
ATOM   2562 H  HA   . GLN B 1 23  ? 15.126  13.302  2.396   1.000 20.817 0 22  GLN B HA   1 c 
ATOM   2563 H  HB2  . GLN B 1 23  ? 14.094  13.750  4.532   1.000 19.912 0 22  GLN B HB2  1 c 
ATOM   2564 H  HB3  . GLN B 1 23  ? 14.789  12.447  5.095   1.000 19.913 0 22  GLN B HB3  1 c 
ATOM   2565 H  HG2  . GLN B 1 23  ? 16.907  13.436  4.803   1.000 18.975 0 22  GLN B HG2  1 c 
ATOM   2566 H  HG3  . GLN B 1 23  ? 16.233  14.733  4.202   1.000 18.958 0 22  GLN B HG3  1 c 
ATOM   2567 H  HE21 . GLN B 1 23  ? 16.611  16.157  7.234   1.000 18.347 0 22  GLN B HE21 1 c 
ATOM   2568 H  HE22 . GLN B 1 23  ? 17.204  16.078  5.825   1.000 18.348 0 22  GLN B HE22 1 c 
ATOM   2569 N  N    . LYS B 1 24  ? 16.733  11.504  1.786   1.000 27.733 0 23  LYS B N    1 ? 
ATOM   2570 C  CA   . LYS B 1 24  ? 17.716  10.470  1.350   1.000 33.805 0 23  LYS B CA   1 ? 
ATOM   2571 C  C    . LYS B 1 24  ? 18.871  10.381  2.359   1.000 34.909 0 23  LYS B C    1 ? 
ATOM   2572 O  O    . LYS B 1 24  ? 19.354  9.257   2.616   1.000 33.769 0 23  LYS B O    1 ? 
ATOM   2573 C  CB   . LYS B 1 24  ? 18.238  10.800  -0.056  1.000 36.116 0 23  LYS B CB   1 ? 
ATOM   2574 C  CG   . LYS B 1 24  ? 17.168  10.966  -1.131  1.000 39.575 0 23  LYS B CG   1 ? 
ATOM   2575 C  CD   . LYS B 1 24  ? 17.699  11.014  -2.564  1.000 42.839 0 23  LYS B CD   1 ? 
ATOM   2576 C  CE   . LYS B 1 24  ? 17.509  9.710   -3.324  1.000 47.735 0 23  LYS B CE   1 ? 
ATOM   2577 N  NZ   . LYS B 1 24  ? 18.100  9.752   -4.690  1.000 49.083 0 23  LYS B NZ   1 ? 
ATOM   2578 H  H    . LYS B 1 24  ? 16.732  12.234  1.242   1.000 27.883 0 23  LYS B H    1 c 
ATOM   2579 H  HA   . LYS B 1 24  ? 17.257  9.599   1.321   1.000 33.164 0 23  LYS B HA   1 c 
ATOM   2580 H  HB2  . LYS B 1 24  ? 18.757  11.630  -0.004  1.000 36.333 0 23  LYS B HB2  1 c 
ATOM   2581 H  HB3  . LYS B 1 24  ? 18.848  10.085  -0.334  1.000 36.333 0 23  LYS B HB3  1 c 
ATOM   2582 H  HG2  . LYS B 1 24  ? 16.534  10.222  -1.055  1.000 39.468 0 23  LYS B HG2  1 c 
ATOM   2583 H  HG3  . LYS B 1 24  ? 16.674  11.793  -0.954  1.000 39.409 0 23  LYS B HG3  1 c 
ATOM   2584 H  HD2  . LYS B 1 24  ? 17.239  11.731  -3.050  1.000 43.134 0 23  LYS B HD2  1 c 
ATOM   2585 H  HD3  . LYS B 1 24  ? 18.655  11.230  -2.543  1.000 43.121 0 23  LYS B HD3  1 c 
ATOM   2586 H  HE2  . LYS B 1 24  ? 17.924  8.981   -2.825  1.000 46.844 0 23  LYS B HE2  1 c 
ATOM   2587 H  HE3  . LYS B 1 24  ? 16.556  9.516   -3.401  1.000 46.844 0 23  LYS B HE3  1 c 
ATOM   2588 H  HZ1  . LYS B 1 24  ? 17.723  10.425  -5.167  1.000 48.669 0 23  LYS B HZ1  1 c 
ATOM   2589 H  HZ2  . LYS B 1 24  ? 17.949  8.965   -5.115  1.000 48.669 0 23  LYS B HZ2  1 c 
ATOM   2590 H  HZ3  . LYS B 1 24  ? 18.994  9.892   -4.634  1.000 48.669 0 23  LYS B HZ3  1 c 
ATOM   2591 N  N    . GLU B 1 25  ? 19.289  11.533  2.894   1.000 35.345 0 24  GLU B N    1 ? 
ATOM   2592 C  CA   . GLU B 1 25  ? 20.405  11.689  3.861   1.000 37.138 0 24  GLU B CA   1 ? 
ATOM   2593 C  C    . GLU B 1 25  ? 19.933  12.559  5.021   1.000 35.152 0 24  GLU B C    1 ? 
ATOM   2594 O  O    . GLU B 1 25  ? 19.223  13.559  4.771   1.000 29.224 0 24  GLU B O    1 ? 
ATOM   2595 C  CB   . GLU B 1 25  ? 21.603  12.365  3.185   1.000 40.831 0 24  GLU B CB   1 ? 
ATOM   2596 C  CG   . GLU B 1 25  ? 22.244  11.542  2.076   1.000 43.460 0 24  GLU B CG   1 ? 
ATOM   2597 C  CD   . GLU B 1 25  ? 22.624  12.319  0.825   1.000 45.817 0 24  GLU B CD   1 ? 
ATOM   2598 O  OE1  . GLU B 1 25  ? 23.436  13.267  0.930   1.000 51.683 0 24  GLU B OE1  1 ? 
ATOM   2599 O  OE2  . GLU B 1 25  ? 22.090  11.987  -0.254  1.000 48.236 0 24  GLU B OE2  1 ? 
ATOM   2600 H  H    . GLU B 1 25  ? 18.900  12.328  2.680   1.000 35.626 0 24  GLU B H    1 c 
ATOM   2601 H  HA   . GLU B 1 25  ? 20.671  10.803  4.199   1.000 37.060 0 24  GLU B HA   1 c 
ATOM   2602 H  HB2  . GLU B 1 25  ? 21.306  13.222  2.812   1.000 40.528 0 24  GLU B HB2  1 c 
ATOM   2603 H  HB3  . GLU B 1 25  ? 22.279  12.555  3.868   1.000 40.511 0 24  GLU B HB3  1 c 
ATOM   2604 H  HG2  . GLU B 1 25  ? 23.055  11.117  2.430   1.000 43.354 0 24  GLU B HG2  1 c 
ATOM   2605 H  HG3  . GLU B 1 25  ? 21.628  10.825  1.817   1.000 43.326 0 24  GLU B HG3  1 c 
ATOM   2606 N  N    . SER B 1 26  ? 20.336  12.224  6.246   1.000 37.278 0 25  SER B N    1 ? 
ATOM   2607 C  CA   . SER B 1 26  ? 20.344  13.195  7.367   1.000 40.372 0 25  SER B CA   1 ? 
ATOM   2608 C  C    . SER B 1 26  ? 21.208  14.378  6.910   1.000 41.637 0 25  SER B C    1 ? 
ATOM   2609 O  O    . SER B 1 26  ? 22.210  14.132  6.207   1.000 42.728 0 25  SER B O    1 ? 
ATOM   2610 C  CB   . SER B 1 26  ? 20.833  12.558  8.648   1.000 41.998 0 25  SER B CB   1 ? 
ATOM   2611 O  OG   . SER B 1 26  ? 21.446  11.302  8.387   1.000 43.471 0 25  SER B OG   1 ? 
ATOM   2612 H  H    . SER B 1 26  ? 20.627  11.392  6.486   1.000 37.471 0 25  SER B H    1 c 
ATOM   2613 H  HA   . SER B 1 26  ? 19.419  13.517  7.505   1.000 40.303 0 25  SER B HA   1 c 
ATOM   2614 H  HB2  . SER B 1 26  ? 21.484  13.158  9.088   1.000 41.945 0 25  SER B HB2  1 c 
ATOM   2615 H  HB3  . SER B 1 26  ? 20.069  12.430  9.262   1.000 41.946 0 25  SER B HB3  1 c 
ATOM   2616 H  HG   . SER B 1 26  ? 21.740  10.962  9.088   0.000 43.500 0 25  SER B HG   1 c 
ATOM   2617 N  N    . ASN B 1 27  ? 20.805  15.616  7.196   1.000 42.995 0 26  ASN B N    1 ? 
ATOM   2618 C  CA   . ASN B 1 27  ? 21.548  16.829  6.740   1.000 45.418 0 26  ASN B CA   1 ? 
ATOM   2619 C  C    . ASN B 1 27  ? 21.317  17.058  5.230   1.000 40.108 0 26  ASN B C    1 ? 
ATOM   2620 O  O    . ASN B 1 27  ? 21.987  17.944  4.645   1.000 38.947 0 26  ASN B O    1 ? 
ATOM   2621 C  CB   . ASN B 1 27  ? 23.055  16.742  7.046   1.000 48.495 0 26  ASN B CB   1 ? 
ATOM   2622 C  CG   . ASN B 1 27  ? 23.405  16.092  8.378   1.000 51.786 0 26  ASN B CG   1 ? 
ATOM   2623 O  OD1  . ASN B 1 27  ? 22.742  16.300  9.403   1.000 47.479 0 26  ASN B OD1  1 ? 
ATOM   2624 N  ND2  . ASN B 1 27  ? 24.471  15.304  8.376   1.000 53.398 0 26  ASN B ND2  1 ? 
ATOM   2625 H  H    . ASN B 1 27  ? 20.056  15.795  7.684   1.000 43.215 0 26  ASN B H    1 c 
ATOM   2626 H  HA   . ASN B 1 27  ? 21.191  17.606  7.230   1.000 44.444 0 26  ASN B HA   1 c 
ATOM   2627 H  HB2  . ASN B 1 27  ? 23.488  16.238  6.327   1.000 48.486 0 26  ASN B HB2  1 c 
ATOM   2628 H  HB3  . ASN B 1 27  ? 23.425  17.646  7.034   1.000 48.494 0 26  ASN B HB3  1 c 
ATOM   2629 H  HD21 . ASN B 1 27  ? 24.661  14.816  9.088   1.000 52.874 0 26  ASN B HD21 1 c 
ATOM   2630 H  HD22 . ASN B 1 27  ? 24.994  15.266  7.664   1.000 52.865 0 26  ASN B HD22 1 c 
ATOM   2631 N  N    . GLY B 1 28  ? 20.409  16.294  4.612   1.000 31.610 0 27  GLY B N    1 ? 
ATOM   2632 C  CA   . GLY B 1 28  ? 19.958  16.489  3.224   1.000 30.705 0 27  GLY B CA   1 ? 
ATOM   2633 C  C    . GLY B 1 28  ? 18.611  17.210  3.183   1.000 28.304 0 27  GLY B C    1 ? 
ATOM   2634 O  O    . GLY B 1 28  ? 17.945  17.383  4.209   1.000 28.198 0 27  GLY B O    1 ? 
ATOM   2635 H  H    . GLY B 1 28  ? 19.996  15.600  5.028   1.000 33.254 0 27  GLY B H    1 c 
ATOM   2636 H  HA2  . GLY B 1 28  ? 20.634  17.019  2.733   1.000 30.355 0 27  GLY B HA2  1 c 
ATOM   2637 H  HA3  . GLY B 1 28  ? 19.874  15.607  2.783   1.000 30.333 0 27  GLY B HA3  1 c 
ATOM   2638 N  N    . PRO B 1 29  ? 18.170  17.652  1.987   1.000 27.338 0 28  PRO B N    1 ? 
ATOM   2639 C  CA   . PRO B 1 29  ? 16.868  18.300  1.845   1.000 26.816 0 28  PRO B CA   1 ? 
ATOM   2640 C  C    . PRO B 1 29  ? 15.724  17.293  2.053   1.000 23.593 0 28  PRO B C    1 ? 
ATOM   2641 O  O    . PRO B 1 29  ? 15.959  16.099  1.923   1.000 21.129 0 28  PRO B O    1 ? 
ATOM   2642 C  CB   . PRO B 1 29  ? 16.880  18.858  0.408   1.000 27.709 0 28  PRO B CB   1 ? 
ATOM   2643 C  CG   . PRO B 1 29  ? 17.926  18.034  -0.326  1.000 27.992 0 28  PRO B CG   1 ? 
ATOM   2644 C  CD   . PRO B 1 29  ? 18.920  17.577  0.720   1.000 27.049 0 28  PRO B CD   1 ? 
ATOM   2645 H  HA   . PRO B 1 29  ? 16.794  19.045  2.493   1.000 26.433 0 28  PRO B HA   1 c 
ATOM   2646 H  HB2  . PRO B 1 29  ? 16.001  18.756  -0.014  1.000 27.554 0 28  PRO B HB2  1 c 
ATOM   2647 H  HB3  . PRO B 1 29  ? 17.123  19.808  0.405   1.000 27.561 0 28  PRO B HB3  1 c 
ATOM   2648 H  HG2  . PRO B 1 29  ? 17.512  17.264  -0.766  1.000 27.708 0 28  PRO B HG2  1 c 
ATOM   2649 H  HG3  . PRO B 1 29  ? 18.374  18.578  -1.006  1.000 27.736 0 28  PRO B HG3  1 c 
ATOM   2650 H  HD2  . PRO B 1 29  ? 19.214  16.664  0.544   1.000 27.342 0 28  PRO B HD2  1 c 
ATOM   2651 H  HD3  . PRO B 1 29  ? 19.700  18.161  0.741   1.000 27.337 0 28  PRO B HD3  1 c 
ATOM   2652 N  N    . VAL B 1 30  ? 14.534  17.795  2.421   1.000 21.495 0 29  VAL B N    1 ? 
ATOM   2653 C  CA   . VAL B 1 30  ? 13.276  16.996  2.462   1.000 19.227 0 29  VAL B CA   1 ? 
ATOM   2654 C  C    . VAL B 1 30  ? 12.437  17.364  1.239   1.000 18.939 0 29  VAL B C    1 ? 
ATOM   2655 O  O    . VAL B 1 30  ? 12.143  18.564  1.084   1.000 16.716 0 29  VAL B O    1 ? 
ATOM   2656 C  CB   . VAL B 1 30  ? 12.462  17.221  3.748   1.000 17.945 0 29  VAL B CB   1 ? 
ATOM   2657 C  CG1  . VAL B 1 30  ? 11.238  16.320  3.776   1.000 17.536 0 29  VAL B CG1  1 ? 
ATOM   2658 C  CG2  . VAL B 1 30  ? 13.315  17.028  4.989   1.000 17.172 0 29  VAL B CG2  1 ? 
ATOM   2659 H  H    . VAL B 1 30  ? 14.423  18.664  2.670   1.000 21.402 0 29  VAL B H    1 c 
ATOM   2660 H  HA   . VAL B 1 30  ? 13.509  16.053  2.406   1.000 19.336 0 29  VAL B HA   1 c 
ATOM   2661 H  HB   . VAL B 1 30  ? 12.148  18.159  3.740   1.000 17.951 0 29  VAL B HB   1 c 
ATOM   2662 H  HG11 . VAL B 1 30  ? 10.608  16.603  3.090   1.000 17.663 0 29  VAL B HG11 1 c 
ATOM   2663 H  HG12 . VAL B 1 30  ? 10.812  16.380  4.650   1.000 17.661 0 29  VAL B HG12 1 c 
ATOM   2664 H  HG13 . VAL B 1 30  ? 11.508  15.400  3.610   1.000 17.661 0 29  VAL B HG13 1 c 
ATOM   2665 H  HG21 . VAL B 1 30  ? 13.704  16.136  4.980   1.000 17.408 0 29  VAL B HG21 1 c 
ATOM   2666 H  HG22 . VAL B 1 30  ? 12.762  17.132  5.782   1.000 17.408 0 29  VAL B HG22 1 c 
ATOM   2667 H  HG23 . VAL B 1 30  ? 14.027  17.691  5.002   1.000 17.414 0 29  VAL B HG23 1 c 
ATOM   2668 N  N    . LYS B 1 31  ? 12.073  16.360  0.439   1.000 19.229 0 30  LYS B N    1 ? 
ATOM   2669 C  CA   . LYS B 1 31  ? 11.081  16.498  -0.657  1.000 20.397 0 30  LYS B CA   1 ? 
ATOM   2670 C  C    . LYS B 1 31  ? 9.685   16.262  -0.076  1.000 18.957 0 30  LYS B C    1 ? 
ATOM   2671 O  O    . LYS B 1 31  ? 9.499   15.263  0.660   1.000 17.866 0 30  LYS B O    1 ? 
ATOM   2672 C  CB   . LYS B 1 31  ? 11.390  15.537  -1.809  1.000 24.852 0 30  LYS B CB   1 ? 
ATOM   2673 C  CG   . LYS B 1 31  ? 12.814  15.640  -2.343  1.000 29.294 0 30  LYS B CG   1 ? 
ATOM   2674 C  CD   . LYS B 1 31  ? 13.034  14.931  -3.666  1.000 34.681 0 30  LYS B CD   1 ? 
ATOM   2675 C  CE   . LYS B 1 31  ? 12.442  15.663  -4.856  1.000 38.667 0 30  LYS B CE   1 ? 
ATOM   2676 N  NZ   . LYS B 1 31  ? 13.149  15.329  -6.121  1.000 39.600 0 30  LYS B NZ   1 ? 
ATOM   2677 H  H    . LYS B 1 31  ? 12.416  15.520  0.519   1.000 19.454 0 30  LYS B H    1 c 
ATOM   2678 H  HA   . LYS B 1 31  ? 11.128  17.420  -0.999  1.000 20.633 0 30  LYS B HA   1 c 
ATOM   2679 H  HB2  . LYS B 1 31  ? 11.236  14.619  -1.501  1.000 24.660 0 30  LYS B HB2  1 c 
ATOM   2680 H  HB3  . LYS B 1 31  ? 10.765  15.717  -2.542  1.000 24.676 0 30  LYS B HB3  1 c 
ATOM   2681 H  HG2  . LYS B 1 31  ? 13.040  16.586  -2.450  1.000 29.349 0 30  LYS B HG2  1 c 
ATOM   2682 H  HG3  . LYS B 1 31  ? 13.426  15.261  -1.676  1.000 29.309 0 30  LYS B HG3  1 c 
ATOM   2683 H  HD2  . LYS B 1 31  ? 13.997  14.820  -3.811  1.000 34.206 0 30  LYS B HD2  1 c 
ATOM   2684 H  HD3  . LYS B 1 31  ? 12.634  14.036  -3.617  1.000 34.197 0 30  LYS B HD3  1 c 
ATOM   2685 H  HE2  . LYS B 1 31  ? 11.500  15.424  -4.949  1.000 37.894 0 30  LYS B HE2  1 c 
ATOM   2686 H  HE3  . LYS B 1 31  ? 12.494  16.624  -4.706  1.000 37.852 0 30  LYS B HE3  1 c 
ATOM   2687 H  HZ1  . LYS B 1 31  ? 14.023  15.564  -6.056  1.000 39.301 0 30  LYS B HZ1  1 c 
ATOM   2688 H  HZ2  . LYS B 1 31  ? 12.772  15.780  -6.812  1.000 39.311 0 30  LYS B HZ2  1 c 
ATOM   2689 H  HZ3  . LYS B 1 31  ? 13.092  14.438  -6.280  1.000 39.311 0 30  LYS B HZ3  1 c 
ATOM   2690 N  N    . VAL B 1 32  ? 8.763   17.175  -0.386  1.000 18.699 0 31  VAL B N    1 ? 
ATOM   2691 C  CA   . VAL B 1 32  ? 7.334   17.148  0.032   1.000 18.913 0 31  VAL B CA   1 ? 
ATOM   2692 C  C    . VAL B 1 32  ? 6.485   17.134  -1.241  1.000 19.148 0 31  VAL B C    1 ? 
ATOM   2693 O  O    . VAL B 1 32  ? 6.684   18.062  -2.075  1.000 20.109 0 31  VAL B O    1 ? 
ATOM   2694 C  CB   . VAL B 1 32  ? 7.015   18.379  0.899   1.000 18.440 0 31  VAL B CB   1 ? 
ATOM   2695 C  CG1  . VAL B 1 32  ? 5.587   18.353  1.433   1.000 17.881 0 31  VAL B CG1  1 ? 
ATOM   2696 C  CG2  . VAL B 1 32  ? 8.041   18.537  2.030   1.000 19.333 0 31  VAL B CG2  1 ? 
ATOM   2697 H  H    . VAL B 1 32  ? 8.962   17.903  -0.896  1.000 18.819 0 31  VAL B H    1 c 
ATOM   2698 H  HA   . VAL B 1 32  ? 7.165   16.340  0.544   1.000 18.808 0 31  VAL B HA   1 c 
ATOM   2699 H  HB   . VAL B 1 32  ? 7.096   19.171  0.316   1.000 18.595 0 31  VAL B HB   1 c 
ATOM   2700 H  HG11 . VAL B 1 32  ? 4.959   18.413  0.692   1.000 18.054 0 31  VAL B HG11 1 c 
ATOM   2701 H  HG12 . VAL B 1 32  ? 5.450   19.107  2.032   1.000 18.053 0 31  VAL B HG12 1 c 
ATOM   2702 H  HG13 . VAL B 1 32  ? 5.436   17.523  1.918   1.000 18.052 0 31  VAL B HG13 1 c 
ATOM   2703 H  HG21 . VAL B 1 32  ? 8.131   17.694  2.507   1.000 19.023 0 31  VAL B HG21 1 c 
ATOM   2704 H  HG22 . VAL B 1 32  ? 7.740   19.227  2.647   1.000 19.045 0 31  VAL B HG22 1 c 
ATOM   2705 H  HG23 . VAL B 1 32  ? 8.902   18.792  1.656   1.000 19.046 0 31  VAL B HG23 1 c 
ATOM   2706 N  N    . TRP B 1 33  ? 5.580   16.166  -1.384  1.000 17.769 0 32  TRP B N    1 ? 
ATOM   2707 C  CA   . TRP B 1 33  ? 4.725   16.022  -2.601  1.000 19.295 0 32  TRP B CA   1 ? 
ATOM   2708 C  C    . TRP B 1 33  ? 3.411   15.265  -2.352  1.000 18.308 0 32  TRP B C    1 ? 
ATOM   2709 O  O    . TRP B 1 33  ? 3.339   14.371  -1.489  1.000 18.193 0 32  TRP B O    1 ? 
ATOM   2710 C  CB   . TRP B 1 33  ? 5.528   15.368  -3.729  1.000 21.603 0 32  TRP B CB   1 ? 
ATOM   2711 C  CG   . TRP B 1 33  ? 5.645   13.877  -3.670  1.000 20.674 0 32  TRP B CG   1 ? 
ATOM   2712 C  CD1  . TRP B 1 33  ? 4.926   12.952  -4.380  1.000 21.343 0 32  TRP B CD1  1 ? 
ATOM   2713 C  CD2  . TRP B 1 33  ? 6.569   13.127  -2.860  1.000 21.200 0 32  TRP B CD2  1 ? 
ATOM   2714 N  NE1  . TRP B 1 33  ? 5.327   11.682  -4.052  1.000 21.793 0 32  TRP B NE1  1 ? 
ATOM   2715 C  CE2  . TRP B 1 33  ? 6.349   11.762  -3.136  1.000 20.766 0 32  TRP B CE2  1 ? 
ATOM   2716 C  CE3  . TRP B 1 33  ? 7.567   13.482  -1.941  1.000 21.159 0 32  TRP B CE3  1 ? 
ATOM   2717 C  CZ2  . TRP B 1 33  ? 7.100   10.752  -2.530  1.000 22.317 0 32  TRP B CZ2  1 ? 
ATOM   2718 C  CZ3  . TRP B 1 33  ? 8.291   12.484  -1.328  1.000 21.671 0 32  TRP B CZ3  1 ? 
ATOM   2719 C  CH2  . TRP B 1 33  ? 8.051   11.136  -1.614  1.000 22.831 0 32  TRP B CH2  1 ? 
ATOM   2720 H  H    . TRP B 1 33  ? 5.426   15.530  -0.750  1.000 18.439 0 32  TRP B H    1 c 
ATOM   2721 H  HA   . TRP B 1 33  ? 4.496   16.931  -2.898  1.000 19.212 0 32  TRP B HA   1 c 
ATOM   2722 H  HB2  . TRP B 1 33  ? 5.111   15.616  -4.578  1.000 20.820 0 32  TRP B HB2  1 c 
ATOM   2723 H  HB3  . TRP B 1 33  ? 6.428   15.752  -3.721  1.000 20.817 0 32  TRP B HB3  1 c 
ATOM   2724 H  HD1  . TRP B 1 33  ? 4.236   13.153  -4.994  1.000 21.336 0 32  TRP B HD1  1 c 
ATOM   2725 H  HE1  . TRP B 1 33  ? 5.006   10.943  -4.398  1.000 21.471 0 32  TRP B HE1  1 c 
ATOM   2726 H  HE3  . TRP B 1 33  ? 7.738   14.390  -1.746  1.000 21.335 0 32  TRP B HE3  1 c 
ATOM   2727 H  HZ2  . TRP B 1 33  ? 6.924   9.843   -2.705  1.000 21.994 0 32  TRP B HZ2  1 c 
ATOM   2728 H  HZ3  . TRP B 1 33  ? 8.966   12.712  -0.709  1.000 21.783 0 32  TRP B HZ3  1 c 
ATOM   2729 H  HH2  . TRP B 1 33  ? 8.564   10.475  -1.182  1.000 22.308 0 32  TRP B HH2  1 c 
ATOM   2730 N  N    . GLY B 1 34  ? 2.401   15.557  -3.178  1.000 17.820 0 33  GLY B N    1 ? 
ATOM   2731 C  CA   . GLY B 1 34  ? 1.078   14.926  -3.103  1.000 17.153 0 33  GLY B CA   1 ? 
ATOM   2732 C  C    . GLY B 1 34  ? 0.019   15.793  -3.763  1.000 18.361 0 33  GLY B C    1 ? 
ATOM   2733 O  O    . GLY B 1 34  ? 0.383   16.614  -4.635  1.000 17.298 0 33  GLY B O    1 ? 
ATOM   2734 H  H    . GLY B 1 34  ? 2.485   16.173  -3.845  1.000 17.783 0 33  GLY B H    1 c 
ATOM   2735 H  HA2  . GLY B 1 34  ? 1.114   14.046  -3.555  1.000 17.591 0 33  GLY B HA2  1 c 
ATOM   2736 H  HA3  . GLY B 1 34  ? 0.841   14.781  -2.155  1.000 17.585 0 33  GLY B HA3  1 c 
ATOM   2737 N  N    . SER B 1 35  ? -1.235  15.652  -3.346  1.000 18.500 0 34  SER B N    1 ? 
ATOM   2738 C  CA   . SER B 1 35  ? -2.423  16.264  -4.003  1.000 17.667 0 34  SER B CA   1 ? 
ATOM   2739 C  C    . SER B 1 35  ? -3.457  16.615  -2.935  1.000 19.497 0 34  SER B C    1 ? 
ATOM   2740 O  O    . SER B 1 35  ? -3.548  15.835  -1.965  1.000 18.928 0 34  SER B O    1 ? 
ATOM   2741 C  CB   . SER B 1 35  ? -2.997  15.320  -5.028  1.000 20.554 0 34  SER B CB   1 ? 
ATOM   2742 O  OG   . SER B 1 35  ? -3.983  15.976  -5.815  1.000 22.534 0 34  SER B OG   1 ? 
ATOM   2743 H  H    . SER B 1 35  ? -1.461  15.156  -2.612  1.000 18.267 0 34  SER B H    1 c 
ATOM   2744 H  HA   . SER B 1 35  ? -2.139  17.096  -4.456  1.000 18.685 0 34  SER B HA   1 c 
ATOM   2745 H  HB2  . SER B 1 35  ? -2.272  14.990  -5.614  1.000 20.269 0 34  SER B HB2  1 c 
ATOM   2746 H  HB3  . SER B 1 35  ? -3.402  14.543  -4.569  1.000 20.268 0 34  SER B HB3  1 c 
ATOM   2747 H  HG   . SER B 1 35  ? -4.314  15.439  -6.359  0.000 23.850 0 34  SER B HG   1 c 
ATOM   2748 N  N    . ILE B 1 36  ? -4.149  17.757  -3.079  1.000 16.447 0 35  ILE B N    1 ? 
ATOM   2749 C  CA   . ILE B 1 36  ? -5.200  18.250  -2.125  1.000 16.338 0 35  ILE B CA   1 ? 
ATOM   2750 C  C    . ILE B 1 36  ? -6.405  18.724  -2.950  1.000 17.718 0 35  ILE B C    1 ? 
ATOM   2751 O  O    . ILE B 1 36  ? -6.188  19.561  -3.883  1.000 17.364 0 35  ILE B O    1 ? 
ATOM   2752 C  CB   . ILE B 1 36  ? -4.658  19.368  -1.212  1.000 15.392 0 35  ILE B CB   1 ? 
ATOM   2753 C  CG1  . ILE B 1 36  ? -3.316  18.980  -0.574  1.000 16.059 0 35  ILE B CG1  1 ? 
ATOM   2754 C  CG2  . ILE B 1 36  ? -5.719  19.756  -0.168  1.000 16.739 0 35  ILE B CG2  1 ? 
ATOM   2755 C  CD1  . ILE B 1 36  ? -2.562  20.121  0.090   1.000 16.938 0 35  ILE B CD1  1 ? 
ATOM   2756 H  H    . ILE B 1 36  ? -4.016  18.318  -3.784  1.000 17.100 0 35  ILE B H    1 c 
ATOM   2757 H  HA   . ILE B 1 36  ? -5.482  17.506  -1.564  1.000 16.443 0 35  ILE B HA   1 c 
ATOM   2758 H  HB   . ILE B 1 36  ? -4.496  20.161  -1.781  1.000 15.947 0 35  ILE B HB   1 c 
ATOM   2759 H  HG12 . ILE B 1 36  ? -3.481  18.284  0.098   1.000 16.101 0 35  ILE B HG12 1 c 
ATOM   2760 H  HG13 . ILE B 1 36  ? -2.740  18.595  -1.265  1.000 16.106 0 35  ILE B HG13 1 c 
ATOM   2761 H  HG21 . ILE B 1 36  ? -6.504  20.116  -0.616  1.000 16.315 0 35  ILE B HG21 1 c 
ATOM   2762 H  HG22 . ILE B 1 36  ? -5.355  20.429  0.433   1.000 16.315 0 35  ILE B HG22 1 c 
ATOM   2763 H  HG23 . ILE B 1 36  ? -5.974  18.969  0.345   1.000 16.313 0 35  ILE B HG23 1 c 
ATOM   2764 H  HD11 . ILE B 1 36  ? -2.418  20.835  -0.555  1.000 16.660 0 35  ILE B HD11 1 c 
ATOM   2765 H  HD12 . ILE B 1 36  ? -1.702  19.799  0.412   1.000 16.660 0 35  ILE B HD12 1 c 
ATOM   2766 H  HD13 . ILE B 1 36  ? -3.079  20.463  0.840   1.000 16.659 0 35  ILE B HD13 1 c 
ATOM   2767 N  N    . LYS B 1 37  ? -7.611  18.206  -2.646  1.000 17.822 0 36  LYS B N    1 ? 
ATOM   2768 C  CA   . LYS B 1 37  ? -8.847  18.504  -3.430  1.000 19.080 0 36  LYS B CA   1 ? 
ATOM   2769 C  C    . LYS B 1 37  ? -9.824  19.292  -2.543  1.000 19.486 0 36  LYS B C    1 ? 
ATOM   2770 O  O    . LYS B 1 37  ? -9.620  19.320  -1.305  1.000 18.431 0 36  LYS B O    1 ? 
ATOM   2771 C  CB   . LYS B 1 37  ? -9.455  17.199  -3.968  1.000 20.947 0 36  LYS B CB   1 ? 
ATOM   2772 C  CG   . LYS B 1 37  ? -10.174 16.322  -2.947  1.000 23.919 0 36  LYS B CG   1 ? 
ATOM   2773 C  CD   . LYS B 1 37  ? -11.048 15.237  -3.564  1.000 27.748 0 36  LYS B CD   1 ? 
ATOM   2774 C  CE   . LYS B 1 37  ? -10.363 13.893  -3.719  1.000 29.696 0 36  LYS B CE   1 ? 
ATOM   2775 N  NZ   . LYS B 1 37  ? -11.301 12.759  -3.505  1.000 32.261 0 36  LYS B NZ   1 ? 
ATOM   2776 H  H    . LYS B 1 37  ? -7.744  17.643  -1.943  1.000 18.080 0 36  LYS B H    1 c 
ATOM   2777 H  HA   . LYS B 1 37  ? -8.599  19.070  -4.196  1.000 19.241 0 36  LYS B HA   1 c 
ATOM   2778 H  HB2  . LYS B 1 37  ? -10.089 17.429  -4.678  1.000 21.155 0 36  LYS B HB2  1 c 
ATOM   2779 H  HB3  . LYS B 1 37  ? -8.735  16.672  -4.374  1.000 21.145 0 36  LYS B HB3  1 c 
ATOM   2780 H  HG2  . LYS B 1 37  ? -9.503  15.901  -2.369  1.000 24.017 0 36  LYS B HG2  1 c 
ATOM   2781 H  HG3  . LYS B 1 37  ? -10.736 16.892  -2.382  1.000 24.000 0 36  LYS B HG3  1 c 
ATOM   2782 H  HD2  . LYS B 1 37  ? -11.846 15.122  -3.005  1.000 27.245 0 36  LYS B HD2  1 c 
ATOM   2783 H  HD3  . LYS B 1 37  ? -11.347 15.538  -4.448  1.000 27.235 0 36  LYS B HD3  1 c 
ATOM   2784 H  HE2  . LYS B 1 37  ? -9.982  13.823  -4.615  1.000 29.794 0 36  LYS B HE2  1 c 
ATOM   2785 H  HE3  . LYS B 1 37  ? -9.632  13.822  -3.076  1.000 29.769 0 36  LYS B HE3  1 c 
ATOM   2786 H  HZ1  . LYS B 1 37  ? -11.908 12.970  -2.868  1.000 31.443 0 36  LYS B HZ1  1 c 
ATOM   2787 H  HZ2  . LYS B 1 37  ? -10.837 12.022  -3.243  1.000 31.446 0 36  LYS B HZ2  1 c 
ATOM   2788 H  HZ3  . LYS B 1 37  ? -11.739 12.574  -4.279  1.000 31.446 0 36  LYS B HZ3  1 c 
ATOM   2789 N  N    . GLY B 1 38  ? -10.831 19.932  -3.150  1.000 18.945 0 37  GLY B N    1 ? 
ATOM   2790 C  CA   . GLY B 1 38  ? -11.916 20.640  -2.438  1.000 17.767 0 37  GLY B CA   1 ? 
ATOM   2791 C  C    . GLY B 1 38  ? -11.529 22.056  -2.045  1.000 18.536 0 37  GLY B C    1 ? 
ATOM   2792 O  O    . GLY B 1 38  ? -12.276 22.666  -1.232  1.000 19.198 0 37  GLY B O    1 ? 
ATOM   2793 H  H    . GLY B 1 38  ? -10.902 19.966  -4.057  1.000 18.785 0 37  GLY B H    1 c 
ATOM   2794 H  HA2  . GLY B 1 38  ? -12.715 20.671  -3.022  1.000 18.221 0 37  GLY B HA2  1 c 
ATOM   2795 H  HA3  . GLY B 1 38  ? -12.151 20.131  -1.627  1.000 18.232 0 37  GLY B HA3  1 c 
ATOM   2796 N  N    . LEU B 1 39  ? -10.446 22.599  -2.630  1.000 19.043 0 38  LEU B N    1 ? 
ATOM   2797 C  CA   . LEU B 1 39  ? -9.970  23.981  -2.344  1.000 17.684 0 38  LEU B CA   1 ? 
ATOM   2798 C  C    . LEU B 1 39  ? -10.553 25.026  -3.311  1.000 19.150 0 38  LEU B C    1 ? 
ATOM   2799 O  O    . LEU B 1 39  ? -10.845 24.684  -4.477  1.000 19.069 0 38  LEU B O    1 ? 
ATOM   2800 C  CB   . LEU B 1 39  ? -8.441  24.021  -2.395  1.000 17.809 0 38  LEU B CB   1 ? 
ATOM   2801 C  CG   . LEU B 1 39  ? -7.719  23.294  -1.258  1.000 18.531 0 38  LEU B CG   1 ? 
ATOM   2802 C  CD1  . LEU B 1 39  ? -6.295  22.978  -1.697  1.000 17.429 0 38  LEU B CD1  1 ? 
ATOM   2803 C  CD2  . LEU B 1 39  ? -7.767  24.101  0.050   1.000 19.207 0 38  LEU B CD2  1 ? 
ATOM   2804 H  H    . LEU B 1 39  ? -9.943  22.156  -3.246  1.000 18.592 0 38  LEU B H    1 c 
ATOM   2805 H  HA   . LEU B 1 39  ? -10.260 24.215  -1.433  1.000 18.241 0 38  LEU B HA   1 c 
ATOM   2806 H  HB2  . LEU B 1 39  ? -8.152  23.633  -3.245  1.000 17.946 0 38  LEU B HB2  1 c 
ATOM   2807 H  HB3  . LEU B 1 39  ? -8.158  24.958  -2.390  1.000 17.947 0 38  LEU B HB3  1 c 
ATOM   2808 H  HG   . LEU B 1 39  ? -8.185  22.436  -1.102  1.000 18.303 0 38  LEU B HG   1 c 
ATOM   2809 H  HD11 . LEU B 1 39  ? -6.316  22.400  -2.479  1.000 17.761 0 38  LEU B HD11 1 c 
ATOM   2810 H  HD12 . LEU B 1 39  ? -5.824  22.528  -0.975  1.000 17.759 0 38  LEU B HD12 1 c 
ATOM   2811 H  HD13 . LEU B 1 39  ? -5.833  23.806  -1.919  1.000 17.760 0 38  LEU B HD13 1 c 
ATOM   2812 H  HD21 . LEU B 1 39  ? -7.359  24.973  -0.091  1.000 18.994 0 38  LEU B HD21 1 c 
ATOM   2813 H  HD22 . LEU B 1 39  ? -7.279  23.624  0.744   1.000 18.994 0 38  LEU B HD22 1 c 
ATOM   2814 H  HD23 . LEU B 1 39  ? -8.692  24.217  0.327   1.000 18.993 0 38  LEU B HD23 1 c 
ATOM   2815 N  N    . THR B 1 40  ? -10.647 26.275  -2.842  1.000 17.696 0 39  THR B N    1 ? 
ATOM   2816 C  CA   . THR B 1 40  ? -10.944 27.475  -3.674  1.000 17.187 0 39  THR B CA   1 ? 
ATOM   2817 C  C    . THR B 1 40  ? -9.731  27.784  -4.564  1.000 17.965 0 39  THR B C    1 ? 
ATOM   2818 O  O    . THR B 1 40  ? -8.569  27.715  -4.055  1.000 18.868 0 39  THR B O    1 ? 
ATOM   2819 C  CB   . THR B 1 40  ? -11.341 28.711  -2.857  1.000 16.918 0 39  THR B CB   1 ? 
ATOM   2820 O  OG1  . THR B 1 40  ? -10.306 29.114  -1.958  1.000 16.534 0 39  THR B OG1  1 ? 
ATOM   2821 C  CG2  . THR B 1 40  ? -12.618 28.498  -2.079  1.000 15.579 0 39  THR B CG2  1 ? 
ATOM   2822 H  H    . THR B 1 40  ? -10.531 26.483  -1.959  1.000 17.895 0 39  THR B H    1 c 
ATOM   2823 H  HA   . THR B 1 40  ? -11.703 27.243  -4.264  1.000 17.377 0 39  THR B HA   1 c 
ATOM   2824 H  HB   . THR B 1 40  ? -11.494 29.450  -3.497  1.000 16.633 0 39  THR B HB   1 c 
ATOM   2825 H  HG1  . THR B 1 40  ? -10.579 29.813  -1.536  0.000 17.000 0 39  THR B HG1  1 c 
ATOM   2826 H  HG21 . THR B 1 40  ? -13.357 28.301  -2.706  1.000 16.041 0 39  THR B HG21 1 c 
ATOM   2827 H  HG22 . THR B 1 40  ? -12.834 29.314  -1.564  1.000 16.061 0 39  THR B HG22 1 c 
ATOM   2828 H  HG23 . THR B 1 40  ? -12.503 27.738  -1.458  1.000 16.022 0 39  THR B HG23 1 c 
ATOM   2829 N  N    . GLU B 1 41  ? -9.977  28.140  -5.838  1.000 16.484 0 40  GLU B N    1 ? 
ATOM   2830 C  CA   . GLU B 1 41  ? -8.899  28.410  -6.840  1.000 15.314 0 40  GLU B CA   1 ? 
ATOM   2831 C  C    . GLU B 1 41  ? -7.945  29.486  -6.272  1.000 15.726 0 40  GLU B C    1 ? 
ATOM   2832 O  O    . GLU B 1 41  ? -8.444  30.498  -5.742  1.000 17.729 0 40  GLU B O    1 ? 
ATOM   2833 C  CB   . GLU B 1 41  ? -9.565  28.809  -8.162  1.000 14.474 0 40  GLU B CB   1 ? 
ATOM   2834 C  CG   . GLU B 1 41  ? -8.606  28.968  -9.317  1.000 13.876 0 40  GLU B CG   1 ? 
ATOM   2835 C  CD   . GLU B 1 41  ? -9.253  29.463  -10.600 1.000 14.663 0 40  GLU B CD   1 ? 
ATOM   2836 O  OE1  . GLU B 1 41  ? -10.316 30.097  -10.500 1.000 15.490 0 40  GLU B OE1  1 ? 
ATOM   2837 O  OE2  . GLU B 1 41  ? -8.683  29.214  -11.684 1.000 13.607 0 40  GLU B OE2  1 ? 
ATOM   2838 H  H    . GLU B 1 41  ? -10.822 28.240  -6.165  1.000 16.523 0 40  GLU B H    1 c 
ATOM   2839 H  HA   . GLU B 1 41  ? -8.390  27.578  -6.979  1.000 15.441 0 40  GLU B HA   1 c 
ATOM   2840 H  HB2  . GLU B 1 41  ? -10.229 28.126  -8.394  1.000 14.528 0 40  GLU B HB2  1 c 
ATOM   2841 H  HB3  . GLU B 1 41  ? -10.040 29.655  -8.024  1.000 14.526 0 40  GLU B HB3  1 c 
ATOM   2842 H  HG2  . GLU B 1 41  ? -7.901  29.600  -9.063  1.000 14.203 0 40  GLU B HG2  1 c 
ATOM   2843 H  HG3  . GLU B 1 41  ? -8.179  28.106  -9.497  1.000 14.208 0 40  GLU B HG3  1 c 
ATOM   2844 N  N    . GLY B 1 42  ? -6.620  29.259  -6.279  1.000 14.515 0 41  GLY B N    1 ? 
ATOM   2845 C  CA   . GLY B 1 42  ? -5.628  30.229  -5.779  1.000 13.997 0 41  GLY B CA   1 ? 
ATOM   2846 C  C    . GLY B 1 42  ? -4.740  29.651  -4.682  1.000 13.035 0 41  GLY B C    1 ? 
ATOM   2847 O  O    . GLY B 1 42  ? -4.762  28.434  -4.498  1.000 10.619 0 41  GLY B O    1 ? 
ATOM   2848 H  H    . GLY B 1 42  ? -6.260  28.485  -6.598  1.000 14.667 0 41  GLY B H    1 c 
ATOM   2849 H  HA2  . GLY B 1 42  ? -5.061  30.523  -6.535  1.000 13.884 0 41  GLY B HA2  1 c 
ATOM   2850 H  HA3  . GLY B 1 42  ? -6.101  31.025  -5.429  1.000 13.893 0 41  GLY B HA3  1 c 
ATOM   2851 N  N    . LEU B 1 43  ? -3.963  30.519  -4.014  1.000 12.997 0 42  LEU B N    1 ? 
ATOM   2852 C  CA   . LEU B 1 43  ? -2.892  30.156  -3.040  1.000 12.486 0 42  LEU B CA   1 ? 
ATOM   2853 C  C    . LEU B 1 43  ? -3.528  29.957  -1.659  1.000 13.626 0 42  LEU B C    1 ? 
ATOM   2854 O  O    . LEU B 1 43  ? -4.371  30.816  -1.247  1.000 14.977 0 42  LEU B O    1 ? 
ATOM   2855 C  CB   . LEU B 1 43  ? -1.802  31.233  -2.957  1.000 11.705 0 42  LEU B CB   1 ? 
ATOM   2856 C  CG   . LEU B 1 43  ? -0.714  31.243  -4.044  1.000 11.681 0 42  LEU B CG   1 ? 
ATOM   2857 C  CD1  . LEU B 1 43  ? -1.291  31.547  -5.409  1.000 10.919 0 42  LEU B CD1  1 ? 
ATOM   2858 C  CD2  . LEU B 1 43  ? 0.353   32.280  -3.728  1.000 10.917 0 42  LEU B CD2  1 ? 
ATOM   2859 H  H    . LEU B 1 43  ? -4.047  31.417  -4.129  1.000 12.881 0 42  LEU B H    1 c 
ATOM   2860 H  HA   . LEU B 1 43  ? -2.490  29.308  -3.330  1.000 12.640 0 42  LEU B HA   1 c 
ATOM   2861 H  HB2  . LEU B 1 43  ? -2.242  32.106  -2.963  1.000 11.883 0 42  LEU B HB2  1 c 
ATOM   2862 H  HB3  . LEU B 1 43  ? -1.358  31.143  -2.090  1.000 11.884 0 42  LEU B HB3  1 c 
ATOM   2863 H  HG   . LEU B 1 43  ? -0.288  30.351  -4.073  1.000 11.390 0 42  LEU B HG   1 c 
ATOM   2864 H  HD11 . LEU B 1 43  ? -1.900  30.835  -5.671  1.000 11.156 0 42  LEU B HD11 1 c 
ATOM   2865 H  HD12 . LEU B 1 43  ? -0.570  31.612  -6.059  1.000 11.152 0 42  LEU B HD12 1 c 
ATOM   2866 H  HD13 . LEU B 1 43  ? -1.774  32.391  -5.377  1.000 11.152 0 42  LEU B HD13 1 c 
ATOM   2867 H  HD21 . LEU B 1 43  ? -0.051  33.165  -3.705  1.000 11.150 0 42  LEU B HD21 1 c 
ATOM   2868 H  HD22 . LEU B 1 43  ? 1.043   32.256  -4.414  1.000 11.150 0 42  LEU B HD22 1 c 
ATOM   2869 H  HD23 . LEU B 1 43  ? 0.751   32.083  -2.862  1.000 11.150 0 42  LEU B HD23 1 c 
ATOM   2870 N  N    . HIS B 1 44  ? -3.034  28.934  -0.950  1.000 13.303 0 43  HIS B N    1 ? 
ATOM   2871 C  CA   . HIS B 1 44  ? -3.451  28.573  0.425   1.000 13.730 0 43  HIS B CA   1 ? 
ATOM   2872 C  C    . HIS B 1 44  ? -2.171  28.392  1.251   1.000 13.898 0 43  HIS B C    1 ? 
ATOM   2873 O  O    . HIS B 1 44  ? -1.316  27.603  0.821   1.000 13.787 0 43  HIS B O    1 ? 
ATOM   2874 C  CB   . HIS B 1 44  ? -4.340  27.332  0.393   1.000 13.392 0 43  HIS B CB   1 ? 
ATOM   2875 C  CG   . HIS B 1 44  ? -5.644  27.512  -0.327  1.000 14.107 0 43  HIS B CG   1 ? 
ATOM   2876 N  ND1  . HIS B 1 44  ? -6.818  27.772  0.342   1.000 13.360 0 43  HIS B ND1  1 ? 
ATOM   2877 C  CD2  . HIS B 1 44  ? -5.968  27.393  -1.633  1.000 12.954 0 43  HIS B CD2  1 ? 
ATOM   2878 C  CE1  . HIS B 1 44  ? -7.811  27.858  -0.535  1.000 15.713 0 43  HIS B CE1  1 ? 
ATOM   2879 N  NE2  . HIS B 1 44  ? -7.301  27.667  -1.758  1.000 13.811 0 43  HIS B NE2  1 ? 
ATOM   2880 H  H    . HIS B 1 44  ? -2.394  28.372  -1.275  1.000 13.475 0 43  HIS B H    1 c 
ATOM   2881 H  HA   . HIS B 1 44  ? -3.964  29.325  0.802   1.000 13.617 0 43  HIS B HA   1 c 
ATOM   2882 H  HB2  . HIS B 1 44  ? -3.843  26.602  -0.039  1.000 13.638 0 43  HIS B HB2  1 c 
ATOM   2883 H  HB3  . HIS B 1 44  ? -4.526  27.055  1.317   1.000 13.641 0 43  HIS B HB3  1 c 
ATOM   2884 H  HD1  . HIS B 1 44  ? -6.894  27.887  1.185   0.000 13.810 0 43  HIS B HD1  1 c 
ATOM   2885 H  HD2  . HIS B 1 44  ? -5.371  27.232  -2.339  1.000 13.445 0 43  HIS B HD2  1 c 
ATOM   2886 H  HE1  . HIS B 1 44  ? -8.708  28.052  -0.332  1.000 14.656 0 43  HIS B HE1  1 c 
ATOM   2887 H  HE2  . HIS B 1 44  ? -7.719  27.655  -2.535  0.000 14.230 0 43  HIS B HE2  1 c 
ATOM   2888 N  N    . GLY B 1 45  ? -2.075  29.085  2.387   1.000 13.375 0 44  GLY B N    1 ? 
ATOM   2889 C  CA   . GLY B 1 45  ? -0.996  28.908  3.370   1.000 13.484 0 44  GLY B CA   1 ? 
ATOM   2890 C  C    . GLY B 1 45  ? -0.833  27.439  3.714   1.000 13.926 0 44  GLY B C    1 ? 
ATOM   2891 O  O    . GLY B 1 45  ? -1.867  26.694  3.787   1.000 12.560 0 44  GLY B O    1 ? 
ATOM   2892 H  H    . GLY B 1 45  ? -2.686  29.720  2.619   1.000 13.523 0 44  GLY B H    1 c 
ATOM   2893 H  HA2  . GLY B 1 45  ? -0.150  29.258  2.994   1.000 13.564 0 44  GLY B HA2  1 c 
ATOM   2894 H  HA3  . GLY B 1 45  ? -1.212  29.420  4.190   1.000 13.562 0 44  GLY B HA3  1 c 
ATOM   2895 N  N    . PHE B 1 46  ? 0.418   27.019  3.970   1.000 14.290 0 45  PHE B N    1 ? 
ATOM   2896 C  CA   . PHE B 1 46  ? 0.866   25.601  4.093   1.000 14.892 0 45  PHE B CA   1 ? 
ATOM   2897 C  C    . PHE B 1 46  ? 1.976   25.531  5.152   1.000 16.058 0 45  PHE B C    1 ? 
ATOM   2898 O  O    . PHE B 1 46  ? 3.050   26.052  4.902   1.000 14.336 0 45  PHE B O    1 ? 
ATOM   2899 C  CB   . PHE B 1 46  ? 1.315   25.116  2.703   1.000 16.151 0 45  PHE B CB   1 ? 
ATOM   2900 C  CG   . PHE B 1 46  ? 1.482   23.623  2.545   1.000 16.559 0 45  PHE B CG   1 ? 
ATOM   2901 C  CD1  . PHE B 1 46  ? 0.419   22.750  2.784   1.000 16.426 0 45  PHE B CD1  1 ? 
ATOM   2902 C  CD2  . PHE B 1 46  ? 2.688   23.081  2.106   1.000 16.612 0 45  PHE B CD2  1 ? 
ATOM   2903 C  CE1  . PHE B 1 46  ? 0.568   21.381  2.594   1.000 16.886 0 45  PHE B CE1  1 ? 
ATOM   2904 C  CE2  . PHE B 1 46  ? 2.844   21.709  1.954   1.000 16.510 0 45  PHE B CE2  1 ? 
ATOM   2905 C  CZ   . PHE B 1 46  ? 1.787   20.857  2.206   1.000 16.909 0 45  PHE B CZ   1 ? 
ATOM   2906 H  H    . PHE B 1 46  ? 1.108   27.603  4.088   1.000 14.344 0 45  PHE B H    1 c 
ATOM   2907 H  HA   . PHE B 1 46  ? 0.102   25.049  4.395   1.000 15.219 0 45  PHE B HA   1 c 
ATOM   2908 H  HB2  . PHE B 1 46  ? 0.657   25.425  2.047   1.000 15.940 0 45  PHE B HB2  1 c 
ATOM   2909 H  HB3  . PHE B 1 46  ? 2.168   25.550  2.490   1.000 15.940 0 45  PHE B HB3  1 c 
ATOM   2910 H  HD1  . PHE B 1 46  ? -0.415  23.096  3.058   1.000 16.569 0 45  PHE B HD1  1 c 
ATOM   2911 H  HD2  . PHE B 1 46  ? 3.421   23.653  1.945   1.000 16.579 0 45  PHE B HD2  1 c 
ATOM   2912 H  HE1  . PHE B 1 46  ? -0.154  20.802  2.780   1.000 16.764 0 45  PHE B HE1  1 c 
ATOM   2913 H  HE2  . PHE B 1 46  ? 3.673   21.359  1.670   1.000 16.630 0 45  PHE B HE2  1 c 
ATOM   2914 H  HZ   . PHE B 1 46  ? 1.888   19.926  2.086   1.000 16.787 0 45  PHE B HZ   1 c 
ATOM   2915 N  N    . HIS B 1 47  ? 1.688   24.995  6.348   1.000 16.767 0 46  HIS B N    1 ? 
ATOM   2916 C  CA   . HIS B 1 47  ? 2.629   25.094  7.506   1.000 16.809 0 46  HIS B CA   1 ? 
ATOM   2917 C  C    . HIS B 1 47  ? 2.664   23.810  8.341   1.000 15.329 0 46  HIS B C    1 ? 
ATOM   2918 O  O    . HIS B 1 47  ? 1.659   23.132  8.436   1.000 12.468 0 46  HIS B O    1 ? 
ATOM   2919 C  CB   . HIS B 1 47  ? 2.273   26.246  8.453   1.000 18.476 0 46  HIS B CB   1 ? 
ATOM   2920 C  CG   . HIS B 1 47  ? 1.928   27.515  7.768   1.000 19.444 0 46  HIS B CG   1 ? 
ATOM   2921 N  ND1  . HIS B 1 47  ? 0.660   28.049  7.845   1.000 20.066 0 46  HIS B ND1  1 ? 
ATOM   2922 C  CD2  . HIS B 1 47  ? 2.663   28.346  6.996   1.000 19.376 0 46  HIS B CD2  1 ? 
ATOM   2923 C  CE1  . HIS B 1 47  ? 0.618   29.157  7.133   1.000 20.111 0 46  HIS B CE1  1 ? 
ATOM   2924 N  NE2  . HIS B 1 47  ? 1.817   29.329  6.578   1.000 19.563 0 46  HIS B NE2  1 ? 
ATOM   2925 H  H    . HIS B 1 47  ? 0.921   24.544  6.541   1.000 16.601 0 46  HIS B H    1 c 
ATOM   2926 H  HA   . HIS B 1 47  ? 3.533   25.251  7.151   1.000 16.797 0 46  HIS B HA   1 c 
ATOM   2927 H  HB2  . HIS B 1 47  ? 1.512   25.973  9.012   1.000 18.302 0 46  HIS B HB2  1 c 
ATOM   2928 H  HB3  . HIS B 1 47  ? 3.036   26.408  9.051   1.000 18.291 0 46  HIS B HB3  1 c 
ATOM   2929 H  HD1  . HIS B 1 47  ? 0.014   27.646  8.302   0.000 19.730 0 46  HIS B HD1  1 c 
ATOM   2930 H  HD2  . HIS B 1 47  ? 3.559   28.234  6.738   1.000 19.443 0 46  HIS B HD2  1 c 
ATOM   2931 H  HE1  . HIS B 1 47  ? -0.134  29.713  7.018   1.000 19.936 0 46  HIS B HE1  1 c 
ATOM   2932 H  HE2  . HIS B 1 47  ? 1.991   30.037  6.098   0.000 18.980 0 46  HIS B HE2  1 c 
ATOM   2933 N  N    . VAL B 1 48  ? 3.798   23.548  8.999   1.000 15.693 0 47  VAL B N    1 ? 
ATOM   2934 C  CA   . VAL B 1 48  ? 3.867   22.556  10.112  1.000 13.852 0 47  VAL B CA   1 ? 
ATOM   2935 C  C    . VAL B 1 48  ? 3.590   23.342  11.396  1.000 12.385 0 47  VAL B C    1 ? 
ATOM   2936 O  O    . VAL B 1 48  ? 4.332   24.338  11.675  1.000 11.400 0 47  VAL B O    1 ? 
ATOM   2937 C  CB   . VAL B 1 48  ? 5.212   21.797  10.172  1.000 14.310 0 47  VAL B CB   1 ? 
ATOM   2938 C  CG1  . VAL B 1 48  ? 5.197   20.708  11.244  1.000 14.641 0 47  VAL B CG1  1 ? 
ATOM   2939 C  CG2  . VAL B 1 48  ? 5.610   21.210  8.810   1.000 13.549 0 47  VAL B CG2  1 ? 
ATOM   2940 H  H    . VAL B 1 48  ? 4.592   23.954  8.810   1.000 15.158 0 47  VAL B H    1 c 
ATOM   2941 H  HA   . VAL B 1 48  ? 3.156   21.906  9.986   1.000 13.961 0 47  VAL B HA   1 c 
ATOM   2942 H  HB   . VAL B 1 48  ? 5.906   22.454  10.426  1.000 14.135 0 47  VAL B HB   1 c 
ATOM   2943 H  HG11 . VAL B 1 48  ? 5.115   21.117  12.123  1.000 14.533 0 47  VAL B HG11 1 c 
ATOM   2944 H  HG12 . VAL B 1 48  ? 6.024   20.198  11.201  1.000 14.536 0 47  VAL B HG12 1 c 
ATOM   2945 H  HG13 . VAL B 1 48  ? 4.442   20.113  11.092  1.000 14.536 0 47  VAL B HG13 1 c 
ATOM   2946 H  HG21 . VAL B 1 48  ? 4.907   20.616  8.494   1.000 13.780 0 47  VAL B HG21 1 c 
ATOM   2947 H  HG22 . VAL B 1 48  ? 6.440   20.709  8.902   1.000 13.780 0 47  VAL B HG22 1 c 
ATOM   2948 H  HG23 . VAL B 1 48  ? 5.738   21.930  8.169   1.000 13.782 0 47  VAL B HG23 1 c 
ATOM   2949 N  N    . HIS B 1 49  ? 2.616   22.885  12.157  1.000 12.706 0 48  HIS B N    1 ? 
ATOM   2950 C  CA   . HIS B 1 49  ? 2.203   23.452  13.468  1.000 12.885 0 48  HIS B CA   1 ? 
ATOM   2951 C  C    . HIS B 1 49  ? 2.868   22.618  14.565  1.000 13.895 0 48  HIS B C    1 ? 
ATOM   2952 O  O    . HIS B 1 49  ? 3.210   21.427  14.303  1.000 13.389 0 48  HIS B O    1 ? 
ATOM   2953 C  CB   . HIS B 1 49  ? 0.679   23.623  13.566  1.000 13.613 0 48  HIS B CB   1 ? 
ATOM   2954 C  CG   . HIS B 1 49  ? 0.143   24.801  12.810  1.000 13.538 0 48  HIS B CG   1 ? 
ATOM   2955 N  ND1  . HIS B 1 49  ? -0.530  25.817  13.424  1.000 13.862 0 48  HIS B ND1  1 ? 
ATOM   2956 C  CD2  . HIS B 1 49  ? 0.226   25.136  11.502  1.000 14.228 0 48  HIS B CD2  1 ? 
ATOM   2957 C  CE1  . HIS B 1 49  ? -0.886  26.717  12.521  1.000 15.424 0 48  HIS B CE1  1 ? 
ATOM   2958 N  NE2  . HIS B 1 49  ? -0.400  26.338  11.348  1.000 13.983 0 48  HIS B NE2  1 ? 
ATOM   2959 H  H    . HIS B 1 49  ? 2.109   22.165  11.923  1.000 12.679 0 48  HIS B H    1 c 
ATOM   2960 H  HA   . HIS B 1 49  ? 2.593   24.356  13.523  1.000 13.171 0 48  HIS B HA   1 c 
ATOM   2961 H  HB2  . HIS B 1 49  ? 0.248   22.807  13.228  1.000 13.418 0 48  HIS B HB2  1 c 
ATOM   2962 H  HB3  . HIS B 1 49  ? 0.433   23.717  14.513  1.000 13.419 0 48  HIS B HB3  1 c 
ATOM   2963 H  HD1  . HIS B 1 49  ? -0.722  25.866  14.270  0.000 13.020 0 48  HIS B HD1  1 c 
ATOM   2964 H  HD2  . HIS B 1 49  ? 0.650   24.642  10.825  1.000 14.019 0 48  HIS B HD2  1 c 
ATOM   2965 H  HE1  . HIS B 1 49  ? -1.357  27.514  12.693  1.000 14.666 0 48  HIS B HE1  1 c 
ATOM   2966 H  HE2  . HIS B 1 49  ? -0.493  26.737  10.571  0.000 13.380 0 48  HIS B HE2  1 c 
ATOM   2967 N  N    . GLU B 1 50  ? 3.122   23.263  15.712  1.000 14.708 0 49  GLU B N    1 ? 
ATOM   2968 C  CA   . GLU B 1 50  ? 3.952   22.699  16.802  1.000 17.525 0 49  GLU B CA   1 ? 
ATOM   2969 C  C    . GLU B 1 50  ? 3.410   21.355  17.298  1.000 17.779 0 49  GLU B C    1 ? 
ATOM   2970 O  O    . GLU B 1 50  ? 4.273   20.493  17.637  1.000 17.214 0 49  GLU B O    1 ? 
ATOM   2971 C  CB   . GLU B 1 50  ? 4.027   23.668  17.975  1.000 19.091 0 49  GLU B CB   1 ? 
ATOM   2972 C  CG   . GLU B 1 50  ? 4.874   23.130  19.117  1.000 21.670 0 49  GLU B CG   1 ? 
ATOM   2973 C  CD   . GLU B 1 50  ? 5.014   24.115  20.262  1.000 24.537 0 49  GLU B CD   1 ? 
ATOM   2974 O  OE1  . GLU B 1 50  ? 4.250   25.110  20.266  1.000 27.893 0 49  GLU B OE1  1 ? 
ATOM   2975 O  OE2  . GLU B 1 50  ? 5.895   23.901  21.131  1.000 24.164 0 49  GLU B OE2  1 ? 
ATOM   2976 H  H    . GLU B 1 50  ? 2.792   24.093  15.891  1.000 15.124 0 49  GLU B H    1 c 
ATOM   2977 H  HA   . GLU B 1 50  ? 4.862   22.559  16.452  1.000 17.274 0 49  GLU B HA   1 c 
ATOM   2978 H  HB2  . GLU B 1 50  ? 4.407   24.515  17.662  1.000 19.294 0 49  GLU B HB2  1 c 
ATOM   2979 H  HB3  . GLU B 1 50  ? 3.119   23.842  18.300  1.000 19.295 0 49  GLU B HB3  1 c 
ATOM   2980 H  HG2  . GLU B 1 50  ? 4.472   22.308  19.462  1.000 21.630 0 49  GLU B HG2  1 c 
ATOM   2981 H  HG3  . GLU B 1 50  ? 5.768   22.909  18.780  1.000 21.654 0 49  GLU B HG3  1 c 
ATOM   2982 N  N    . PHE B 1 51  ? 2.095   21.199  17.503  1.000 15.580 0 50  PHE B N    1 ? 
ATOM   2983 C  CA   . PHE B 1 51  ? 1.575   19.996  18.205  1.000 15.146 0 50  PHE B CA   1 ? 
ATOM   2984 C  C    . PHE B 1 51  ? 0.845   19.054  17.245  1.000 14.097 0 50  PHE B C    1 ? 
ATOM   2985 O  O    . PHE B 1 51  ? 0.010   19.506  16.428  1.000 14.116 0 50  PHE B O    1 ? 
ATOM   2986 C  CB   . PHE B 1 51  ? 0.691   20.348  19.405  1.000 15.989 0 50  PHE B CB   1 ? 
ATOM   2987 C  CG   . PHE B 1 51  ? 1.319   21.325  20.356  1.000 17.891 0 50  PHE B CG   1 ? 
ATOM   2988 C  CD1  . PHE B 1 51  ? 2.498   21.024  21.019  1.000 18.345 0 50  PHE B CD1  1 ? 
ATOM   2989 C  CD2  . PHE B 1 51  ? 0.761   22.574  20.538  1.000 18.855 0 50  PHE B CD2  1 ? 
ATOM   2990 C  CE1  . PHE B 1 51  ? 3.074   21.947  21.880  1.000 18.925 0 50  PHE B CE1  1 ? 
ATOM   2991 C  CE2  . PHE B 1 51  ? 1.348   23.502  21.381  1.000 18.847 0 50  PHE B CE2  1 ? 
ATOM   2992 C  CZ   . PHE B 1 51  ? 2.493   23.178  22.067  1.000 18.737 0 50  PHE B CZ   1 ? 
ATOM   2993 H  H    . PHE B 1 51  ? 1.449   21.787  17.246  1.000 15.963 0 50  PHE B H    1 c 
ATOM   2994 H  HA   . PHE B 1 51  ? 2.356   19.501  18.558  1.000 15.176 0 50  PHE B HA   1 c 
ATOM   2995 H  HB2  . PHE B 1 51  ? -0.152  20.722  19.071  1.000 16.220 0 50  PHE B HB2  1 c 
ATOM   2996 H  HB3  . PHE B 1 51  ? 0.482   19.522  19.889  1.000 16.212 0 50  PHE B HB3  1 c 
ATOM   2997 H  HD1  . PHE B 1 51  ? 2.895   20.175  20.905  1.000 18.372 0 50  PHE B HD1  1 c 
ATOM   2998 H  HD2  . PHE B 1 51  ? -0.031  22.800  20.076  1.000 18.590 0 50  PHE B HD2  1 c 
ATOM   2999 H  HE1  . PHE B 1 51  ? 3.867   21.726  22.342  1.000 18.702 0 50  PHE B HE1  1 c 
ATOM   3000 H  HE2  . PHE B 1 51  ? 0.942   24.344  21.510  1.000 18.771 0 50  PHE B HE2  1 c 
ATOM   3001 H  HZ   . PHE B 1 51  ? 2.893   23.808  22.645  1.000 18.756 0 50  PHE B HZ   1 c 
ATOM   3002 N  N    . GLY B 1 52  ? 1.073   17.753  17.440  1.000 12.654 0 51  GLY B N    1 ? 
ATOM   3003 C  CA   . GLY B 1 52  ? 0.339   16.648  16.769  1.000 13.064 0 51  GLY B CA   1 ? 
ATOM   3004 C  C    . GLY B 1 52  ? -0.931  16.271  17.526  1.000 13.423 0 51  GLY B C    1 ? 
ATOM   3005 O  O    . GLY B 1 52  ? -1.131  15.060  17.782  1.000 13.515 0 51  GLY B O    1 ? 
ATOM   3006 H  H    . GLY B 1 52  ? 1.714   17.461  18.017  1.000 13.089 0 51  GLY B H    1 c 
ATOM   3007 H  HA2  . GLY B 1 52  ? 0.104   16.926  15.850  1.000 13.051 0 51  GLY B HA2  1 c 
ATOM   3008 H  HA3  . GLY B 1 52  ? 0.929   15.858  16.710  1.000 13.044 0 51  GLY B HA3  1 c 
ATOM   3009 N  N    . ASP B 1 53  ? -1.749  17.283  17.852  1.000 14.333 0 52  ASP B N    1 ? 
ATOM   3010 C  CA   . ASP B 1 53  ? -2.965  17.224  18.704  1.000 15.835 0 52  ASP B CA   1 ? 
ATOM   3011 C  C    . ASP B 1 53  ? -4.147  17.731  17.876  1.000 15.432 0 52  ASP B C    1 ? 
ATOM   3012 O  O    . ASP B 1 53  ? -4.173  18.968  17.544  1.000 15.752 0 52  ASP B O    1 ? 
ATOM   3013 C  CB   . ASP B 1 53  ? -2.750  18.040  19.979  1.000 15.574 0 52  ASP B CB   1 ? 
ATOM   3014 C  CG   . ASP B 1 53  ? -3.863  17.861  20.994  1.000 16.488 0 52  ASP B CG   1 ? 
ATOM   3015 O  OD1  . ASP B 1 53  ? -5.000  17.542  20.579  1.000 16.098 0 52  ASP B OD1  1 ? 
ATOM   3016 O  OD2  . ASP B 1 53  ? -3.559  18.027  22.197  1.000 17.344 0 52  ASP B OD2  1 ? 
ATOM   3017 H  H    . ASP B 1 53  ? -1.602  18.123  17.535  1.000 14.443 0 52  ASP B H    1 c 
ATOM   3018 H  HA   . ASP B 1 53  ? -3.127  16.286  18.955  1.000 15.412 0 52  ASP B HA   1 c 
ATOM   3019 H  HB2  . ASP B 1 53  ? -1.905  17.770  20.394  1.000 15.851 0 52  ASP B HB2  1 c 
ATOM   3020 H  HB3  . ASP B 1 53  ? -2.688  18.989  19.748  1.000 15.848 0 52  ASP B HB3  1 c 
ATOM   3021 N  N    . ASN B 1 54  ? -5.043  16.805  17.528  1.000 18.211 0 53  ASN B N    1 ? 
ATOM   3022 C  CA   . ASN B 1 54  ? -6.307  17.071  16.790  1.000 19.352 0 53  ASN B CA   1 ? 
ATOM   3023 C  C    . ASN B 1 54  ? -7.536  16.788  17.670  1.000 20.202 0 53  ASN B C    1 ? 
ATOM   3024 O  O    . ASN B 1 54  ? -8.613  16.496  17.108  1.000 20.852 0 53  ASN B O    1 ? 
ATOM   3025 C  CB   . ASN B 1 54  ? -6.359  16.206  15.534  1.000 23.073 0 53  ASN B CB   1 ? 
ATOM   3026 C  CG   . ASN B 1 54  ? -7.512  16.560  14.619  1.000 25.990 0 53  ASN B CG   1 ? 
ATOM   3027 O  OD1  . ASN B 1 54  ? -7.641  17.711  14.195  1.000 28.495 0 53  ASN B OD1  1 ? 
ATOM   3028 N  ND2  . ASN B 1 54  ? -8.343  15.575  14.295  1.000 27.734 0 53  ASN B ND2  1 ? 
ATOM   3029 H  H    . ASN B 1 54  ? -4.927  15.923  17.726  1.000 17.753 0 53  ASN B H    1 c 
ATOM   3030 H  HA   . ASN B 1 54  ? -6.321  18.016  16.513  1.000 19.929 0 53  ASN B HA   1 c 
ATOM   3031 H  HB2  . ASN B 1 54  ? -5.520  16.312  15.044  1.000 22.789 0 53  ASN B HB2  1 c 
ATOM   3032 H  HB3  . ASN B 1 54  ? -6.436  15.268  15.801  1.000 22.784 0 53  ASN B HB3  1 c 
ATOM   3033 H  HD21 . ASN B 1 54  ? -9.041  15.739  13.777  1.000 27.183 0 53  ASN B HD21 1 c 
ATOM   3034 H  HD22 . ASN B 1 54  ? -8.201  14.756  14.595  1.000 27.159 0 53  ASN B HD22 1 c 
ATOM   3035 N  N    . THR B 1 55  ? -7.420  16.868  18.997  1.000 19.678 0 54  THR B N    1 ? 
ATOM   3036 C  CA   . THR B 1 55  ? -8.525  16.485  19.915  1.000 21.997 0 54  THR B CA   1 ? 
ATOM   3037 C  C    . THR B 1 55  ? -9.766  17.361  19.646  1.000 22.636 0 54  THR B C    1 ? 
ATOM   3038 O  O    . THR B 1 55  ? -10.876 16.773  19.651  1.000 25.929 0 54  THR B O    1 ? 
ATOM   3039 C  CB   . THR B 1 55  ? -8.103  16.490  21.387  1.000 21.927 0 54  THR B CB   1 ? 
ATOM   3040 O  OG1  . THR B 1 55  ? -7.527  17.750  21.699  1.000 21.643 0 54  THR B OG1  1 ? 
ATOM   3041 C  CG2  . THR B 1 55  ? -7.115  15.393  21.723  1.000 22.132 0 54  THR B CG2  1 ? 
ATOM   3042 H  H    . THR B 1 55  ? -6.672  17.163  19.433  1.000 20.323 0 54  THR B H    1 c 
ATOM   3043 H  HA   . THR B 1 55  ? -8.770  15.555  19.687  1.000 21.646 0 54  THR B HA   1 c 
ATOM   3044 H  HB   . THR B 1 55  ? -8.914  16.366  21.940  1.000 21.924 0 54  THR B HB   1 c 
ATOM   3045 H  HG1  . THR B 1 55  ? -7.339  17.755  22.534  0.000 20.690 0 54  THR B HG1  1 c 
ATOM   3046 H  HG21 . THR B 1 55  ? -7.527  14.512  21.544  1.000 22.062 0 54  THR B HG21 1 c 
ATOM   3047 H  HG22 . THR B 1 55  ? -6.868  15.451  22.679  1.000 22.062 0 54  THR B HG22 1 c 
ATOM   3048 H  HG23 . THR B 1 55  ? -6.304  15.494  21.167  1.000 22.050 0 54  THR B HG23 1 c 
ATOM   3049 N  N    . ALA B 1 56  ? -9.613  18.672  19.394  1.000 20.652 0 55  ALA B N    1 ? 
ATOM   3050 C  CA   . ALA B 1 56  ? -10.723 19.595  19.024  1.000 19.840 0 55  ALA B CA   1 ? 
ATOM   3051 C  C    . ALA B 1 56  ? -10.537 20.144  17.598  1.000 18.687 0 55  ALA B C    1 ? 
ATOM   3052 O  O    . ALA B 1 56  ? -10.874 21.314  17.359  1.000 20.223 0 55  ALA B O    1 ? 
ATOM   3053 C  CB   . ALA B 1 56  ? -10.810 20.722  20.009  1.000 20.607 0 55  ALA B CB   1 ? 
ATOM   3054 H  H    . ALA B 1 56  ? -8.809  19.097  19.436  1.000 20.902 0 55  ALA B H    1 c 
ATOM   3055 H  HA   . ALA B 1 56  ? -11.568 19.092  19.050  1.000 19.924 0 55  ALA B HA   1 c 
ATOM   3056 H  HB1  . ALA B 1 56  ? -11.625 21.228  19.853  1.000 20.364 0 55  ALA B HB1  1 c 
ATOM   3057 H  HB2  . ALA B 1 56  ? -10.821 20.363  20.913  1.000 20.365 0 55  ALA B HB2  1 c 
ATOM   3058 H  HB3  . ALA B 1 56  ? -10.041 21.307  19.904  1.000 20.356 0 55  ALA B HB3  1 c 
ATOM   3059 N  N    . GLY B 1 57  ? -10.054 19.318  16.683  1.000 17.630 0 56  GLY B N    1 ? 
ATOM   3060 C  CA   . GLY B 1 57  ? -9.752  19.706  15.295  1.000 17.666 0 56  GLY B CA   1 ? 
ATOM   3061 C  C    . GLY B 1 57  ? -8.435  20.440  15.161  1.000 17.054 0 56  GLY B C    1 ? 
ATOM   3062 O  O    . GLY B 1 57  ? -7.577  20.298  16.064  1.000 15.041 0 56  GLY B O    1 ? 
ATOM   3063 H  H    . GLY B 1 57  ? -9.884  18.442  16.864  1.000 17.891 0 56  GLY B H    1 c 
ATOM   3064 H  HA2  . GLY B 1 57  ? -9.732  18.892  14.733  1.000 17.530 0 56  GLY B HA2  1 c 
ATOM   3065 H  HA3  . GLY B 1 57  ? -10.482 20.285  14.959  1.000 17.520 0 56  GLY B HA3  1 c 
ATOM   3066 N  N    . CYS B 1 58  ? -8.250  21.155  14.044  1.000 15.600 0 57  CYS B N    1 ? 
ATOM   3067 C  CA   . CYS B 1 58  ? -6.967  21.785  13.652  1.000 16.758 0 57  CYS B CA   1 ? 
ATOM   3068 C  C    . CYS B 1 58  ? -6.550  22.846  14.673  1.000 15.688 0 57  CYS B C    1 ? 
ATOM   3069 O  O    . CYS B 1 58  ? -5.334  23.025  14.821  1.000 14.401 0 57  CYS B O    1 ? 
ATOM   3070 C  CB   . CYS B 1 58  ? -7.029  22.293  12.207  1.000 15.524 0 57  CYS B CB   1 ? 
ATOM   3071 S  SG   . CYS B 1 58  ? -7.582  20.984  11.077  1.000 17.116 0 57  CYS B SG   1 ? 
ATOM   3072 H  H    . CYS B 1 58  ? -8.915  21.311  13.436  1.000 16.201 0 57  CYS B H    1 c 
ATOM   3073 H  HA   . CYS B 1 58  ? -6.282  21.071  13.681  1.000 16.084 0 57  CYS B HA   1 c 
ATOM   3074 H  HB2  . CYS B 1 58  ? -7.657  23.055  12.151  1.000 16.170 0 57  CYS B HB2  1 c 
ATOM   3075 H  HB3  . CYS B 1 58  ? -6.134  22.604  11.926  1.000 16.172 0 57  CYS B HB3  1 c 
ATOM   3076 N  N    . THR B 1 59  ? -7.473  23.452  15.435  1.000 16.731 0 58  THR B N    1 ? 
ATOM   3077 C  CA   . THR B 1 59  ? -7.148  24.527  16.424  1.000 16.865 0 58  THR B CA   1 ? 
ATOM   3078 C  C    . THR B 1 59  ? -6.209  24.014  17.526  1.000 16.289 0 58  THR B C    1 ? 
ATOM   3079 O  O    . THR B 1 59  ? -5.462  24.825  18.036  1.000 15.801 0 58  THR B O    1 ? 
ATOM   3080 C  CB   . THR B 1 59  ? -8.389  25.160  17.075  1.000 18.423 0 58  THR B CB   1 ? 
ATOM   3081 O  OG1  . THR B 1 59  ? -7.966  26.392  17.684  1.000 19.953 0 58  THR B OG1  1 ? 
ATOM   3082 C  CG2  . THR B 1 59  ? -9.056  24.251  18.083  1.000 19.732 0 58  THR B CG2  1 ? 
ATOM   3083 H  H    . THR B 1 59  ? -8.366  23.265  15.398  1.000 16.514 0 58  THR B H    1 c 
ATOM   3084 H  HA   . THR B 1 59  ? -6.671  25.240  15.931  1.000 17.016 0 58  THR B HA   1 c 
ATOM   3085 H  HB   . THR B 1 59  ? -9.039  25.367  16.360  1.000 18.635 0 58  THR B HB   1 c 
ATOM   3086 H  HG1  . THR B 1 59  ? -8.585  26.787  18.039  0.000 19.880 0 58  THR B HG1  1 c 
ATOM   3087 H  HG21 . THR B 1 59  ? -9.304  23.399  17.647  1.000 19.318 0 58  THR B HG21 1 c 
ATOM   3088 H  HG22 . THR B 1 59  ? -9.870  24.690  18.434  1.000 19.317 0 58  THR B HG22 1 c 
ATOM   3089 H  HG23 . THR B 1 59  ? -8.435  24.069  18.831  1.000 19.307 0 58  THR B HG23 1 c 
ATOM   3090 N  N    . SER B 1 60  ? -6.267  22.727  17.858  1.000 16.078 0 59  SER B N    1 ? 
ATOM   3091 C  CA   . SER B 1 60  ? -5.448  22.067  18.919  1.000 15.126 0 59  SER B CA   1 ? 
ATOM   3092 C  C    . SER B 1 60  ? -3.970  21.949  18.489  1.000 14.017 0 59  SER B C    1 ? 
ATOM   3093 O  O    . SER B 1 60  ? -3.083  21.765  19.378  1.000 12.622 0 59  SER B O    1 ? 
ATOM   3094 C  CB   . SER B 1 60  ? -6.071  20.724  19.261  1.000 15.548 0 59  SER B CB   1 ? 
ATOM   3095 O  OG   . SER B 1 60  ? -7.464  20.894  19.494  1.000 16.944 0 59  SER B OG   1 ? 
ATOM   3096 H  H    . SER B 1 60  ? -6.838  22.138  17.454  1.000 15.899 0 59  SER B H    1 c 
ATOM   3097 H  HA   . SER B 1 60  ? -5.485  22.638  19.726  1.000 15.162 0 59  SER B HA   1 c 
ATOM   3098 H  HB2  . SER B 1 60  ? -5.934  20.092  18.513  1.000 15.765 0 59  SER B HB2  1 c 
ATOM   3099 H  HB3  . SER B 1 60  ? -5.639  20.352  20.069  1.000 15.765 0 59  SER B HB3  1 c 
ATOM   3100 H  HG   . SER B 1 60  ? -7.769  20.104  19.660  0.000 18.110 0 59  SER B HG   1 c 
ATOM   3101 N  N    . ALA B 1 61  ? -3.664  22.111  17.195  1.000 12.302 0 60  ALA B N    1 ? 
ATOM   3102 C  CA   . ALA B 1 61  ? -2.267  22.053  16.713  1.000 12.538 0 60  ALA B CA   1 ? 
ATOM   3103 C  C    . ALA B 1 61  ? -1.428  23.223  17.260  1.000 11.910 0 60  ALA B C    1 ? 
ATOM   3104 O  O    . ALA B 1 61  ? -0.199  23.100  17.194  1.000 12.101 0 60  ALA B O    1 ? 
ATOM   3105 C  CB   . ALA B 1 61  ? -2.211  21.960  15.203  1.000 12.214 0 60  ALA B CB   1 ? 
ATOM   3106 H  H    . ALA B 1 61  ? -4.269  22.250  16.529  1.000 12.755 0 60  ALA B H    1 c 
ATOM   3107 H  HA   . ALA B 1 61  ? -1.873  21.224  17.072  1.000 12.315 0 60  ALA B HA   1 c 
ATOM   3108 H  HB1  . ALA B 1 61  ? -1.284  21.934  14.913  1.000 12.312 0 60  ALA B HB1  1 c 
ATOM   3109 H  HB2  . ALA B 1 61  ? -2.664  21.152  14.910  1.000 12.312 0 60  ALA B HB2  1 c 
ATOM   3110 H  HB3  . ALA B 1 61  ? -2.649  22.735  14.813  1.000 12.315 0 60  ALA B HB3  1 c 
ATOM   3111 N  N    . GLY B 1 62  ? -2.031  24.291  17.798  1.000 11.965 0 61  GLY B N    1 ? 
ATOM   3112 C  CA   . GLY B 1 62  ? -1.313  25.489  18.297  1.000 11.518 0 61  GLY B CA   1 ? 
ATOM   3113 C  C    . GLY B 1 62  ? -0.620  26.304  17.205  1.000 11.970 0 61  GLY B C    1 ? 
ATOM   3114 O  O    . GLY B 1 62  ? -1.086  26.378  16.068  1.000 11.095 0 61  GLY B O    1 ? 
ATOM   3115 H  H    . GLY B 1 62  ? -2.935  24.351  17.875  1.000 11.851 0 61  GLY B H    1 c 
ATOM   3116 H  HA2  . GLY B 1 62  ? -1.959  26.070  18.770  1.000 11.739 0 61  GLY B HA2  1 c 
ATOM   3117 H  HA3  . GLY B 1 62  ? -0.640  25.194  18.958  1.000 11.737 0 61  GLY B HA3  1 c 
ATOM   3118 N  N    . PRO B 1 63  ? 0.491   26.996  17.525  1.000 12.207 0 62  PRO B N    1 ? 
ATOM   3119 C  CA   . PRO B 1 63  ? 1.154   27.886  16.576  1.000 13.657 0 62  PRO B CA   1 ? 
ATOM   3120 C  C    . PRO B 1 63  ? 2.058   27.155  15.573  1.000 13.817 0 62  PRO B C    1 ? 
ATOM   3121 O  O    . PRO B 1 63  ? 2.202   25.934  15.649  1.000 12.514 0 62  PRO B O    1 ? 
ATOM   3122 C  CB   . PRO B 1 63  ? 1.954   28.813  17.515  1.000 15.307 0 62  PRO B CB   1 ? 
ATOM   3123 C  CG   . PRO B 1 63  ? 2.331   27.890  18.664  1.000 13.686 0 62  PRO B CG   1 ? 
ATOM   3124 C  CD   . PRO B 1 63  ? 1.149   26.975  18.844  1.000 13.517 0 62  PRO B CD   1 ? 
ATOM   3125 H  HA   . PRO B 1 63  ? 0.473   28.418  16.094  1.000 13.684 0 62  PRO B HA   1 c 
ATOM   3126 H  HB2  . PRO B 1 63  ? 2.754   29.167  17.071  1.000 14.512 0 62  PRO B HB2  1 c 
ATOM   3127 H  HB3  . PRO B 1 63  ? 1.403   29.561  17.830  1.000 14.514 0 62  PRO B HB3  1 c 
ATOM   3128 H  HG2  . PRO B 1 63  ? 3.135   27.376  18.446  1.000 14.011 0 62  PRO B HG2  1 c 
ATOM   3129 H  HG3  . PRO B 1 63  ? 2.497   28.403  19.480  1.000 14.011 0 62  PRO B HG3  1 c 
ATOM   3130 H  HD2  . PRO B 1 63  ? 1.438   26.073  19.075  1.000 13.230 0 62  PRO B HD2  1 c 
ATOM   3131 H  HD3  . PRO B 1 63  ? 0.552   27.305  19.540  1.000 13.231 0 62  PRO B HD3  1 c 
ATOM   3132 N  N    . HIS B 1 64  ? 2.682   27.912  14.661  1.000 14.098 0 63  HIS B N    1 ? 
ATOM   3133 C  CA   . HIS B 1 64  ? 3.700   27.369  13.721  1.000 13.660 0 63  HIS B CA   1 ? 
ATOM   3134 C  C    . HIS B 1 64  ? 4.838   26.747  14.541  1.000 13.305 0 63  HIS B C    1 ? 
ATOM   3135 O  O    . HIS B 1 64  ? 5.175   27.314  15.579  1.000 13.152 0 63  HIS B O    1 ? 
ATOM   3136 C  CB   . HIS B 1 64  ? 4.215   28.465  12.783  1.000 14.324 0 63  HIS B CB   1 ? 
ATOM   3137 C  CG   . HIS B 1 64  ? 3.128   28.986  11.907  1.000 15.599 0 63  HIS B CG   1 ? 
ATOM   3138 N  ND1  . HIS B 1 64  ? 3.362   29.893  10.892  1.000 17.397 0 63  HIS B ND1  1 ? 
ATOM   3139 C  CD2  . HIS B 1 64  ? 1.810   28.730  11.892  1.000 16.068 0 63  HIS B CD2  1 ? 
ATOM   3140 C  CE1  . HIS B 1 64  ? 2.215   30.186  10.312  1.000 18.593 0 63  HIS B CE1  1 ? 
ATOM   3141 N  NE2  . HIS B 1 64  ? 1.255   29.475  10.900  1.000 17.389 0 63  HIS B NE2  1 ? 
ATOM   3142 H  H    . HIS B 1 64  ? 2.547   28.808  14.567  1.000 13.936 0 63  HIS B H    1 c 
ATOM   3143 H  HA   . HIS B 1 64  ? 3.277   26.659  13.183  1.000 13.801 0 63  HIS B HA   1 c 
ATOM   3144 H  HB2  . HIS B 1 64  ? 4.583   29.203  13.317  1.000 14.452 0 63  HIS B HB2  1 c 
ATOM   3145 H  HB3  . HIS B 1 64  ? 4.937   28.102  12.224  1.000 14.452 0 63  HIS B HB3  1 c 
ATOM   3146 H  HD1  . HIS B 1 64  ? 4.168   30.219  10.684  0.000 17.140 0 63  HIS B HD1  1 c 
ATOM   3147 H  HD2  . HIS B 1 64  ? 1.350   28.150  12.467  1.000 16.273 0 63  HIS B HD2  1 c 
ATOM   3148 H  HE1  . HIS B 1 64  ? 2.101   30.774  9.585   1.000 17.908 0 63  HIS B HE1  1 c 
ATOM   3149 H  HE2  . HIS B 1 64  ? 0.430   29.491  10.673  0.000 17.380 0 63  HIS B HE2  1 c 
ATOM   3150 N  N    . PHE B 1 65  ? 5.369   25.605  14.110  1.000 14.115 0 64  PHE B N    1 ? 
ATOM   3151 C  CA   . PHE B 1 65  ? 6.584   24.960  14.682  1.000 13.224 0 64  PHE B CA   1 ? 
ATOM   3152 C  C    . PHE B 1 65  ? 7.778   25.925  14.549  1.000 12.973 0 64  PHE B C    1 ? 
ATOM   3153 O  O    . PHE B 1 65  ? 8.232   26.239  13.422  1.000 11.155 0 64  PHE B O    1 ? 
ATOM   3154 C  CB   . PHE B 1 65  ? 6.815   23.609  13.997  1.000 14.682 0 64  PHE B CB   1 ? 
ATOM   3155 C  CG   . PHE B 1 65  ? 8.051   22.856  14.424  1.000 15.512 0 64  PHE B CG   1 ? 
ATOM   3156 C  CD1  . PHE B 1 65  ? 8.351   22.662  15.766  1.000 16.161 0 64  PHE B CD1  1 ? 
ATOM   3157 C  CD2  . PHE B 1 65  ? 8.905   22.318  13.474  1.000 15.028 0 64  PHE B CD2  1 ? 
ATOM   3158 C  CE1  . PHE B 1 65  ? 9.512   21.987  16.139  1.000 16.515 0 64  PHE B CE1  1 ? 
ATOM   3159 C  CE2  . PHE B 1 65  ? 10.053  21.639  13.848  1.000 15.294 0 64  PHE B CE2  1 ? 
ATOM   3160 C  CZ   . PHE B 1 65  ? 10.347  21.462  15.174  1.000 16.580 0 64  PHE B CZ   1 ? 
ATOM   3161 H  H    . PHE B 1 65  ? 5.016   25.128  13.418  1.000 13.713 0 64  PHE B H    1 c 
ATOM   3162 H  HA   . PHE B 1 65  ? 6.422   24.796  15.646  1.000 13.613 0 64  PHE B HA   1 c 
ATOM   3163 H  HB2  . PHE B 1 65  ? 6.033   23.044  14.167  1.000 14.511 0 64  PHE B HB2  1 c 
ATOM   3164 H  HB3  . PHE B 1 65  ? 6.863   23.763  13.030  1.000 14.512 0 64  PHE B HB3  1 c 
ATOM   3165 H  HD1  . PHE B 1 65  ? 7.787   23.026  16.429  1.000 16.037 0 64  PHE B HD1  1 c 
ATOM   3166 H  HD2  . PHE B 1 65  ? 8.713   22.439  12.557  1.000 15.263 0 64  PHE B HD2  1 c 
ATOM   3167 H  HE1  . PHE B 1 65  ? 9.710   21.862  17.053  1.000 16.363 0 64  PHE B HE1  1 c 
ATOM   3168 H  HE2  . PHE B 1 65  ? 10.624  21.282  13.186  1.000 15.547 0 64  PHE B HE2  1 c 
ATOM   3169 H  HZ   . PHE B 1 65  ? 11.126  20.992  15.427  1.000 16.196 0 64  PHE B HZ   1 c 
ATOM   3170 N  N    . ASN B 1 66  ? 8.324   26.339  15.696  1.000 12.351 0 65  ASN B N    1 ? 
ATOM   3171 C  CA   . ASN B 1 66  ? 9.251   27.499  15.806  1.000 13.713 0 65  ASN B CA   1 ? 
ATOM   3172 C  C    . ASN B 1 66  ? 10.251  27.238  16.925  1.000 13.627 0 65  ASN B C    1 ? 
ATOM   3173 O  O    . ASN B 1 66  ? 10.274  27.980  17.912  1.000 14.099 0 65  ASN B O    1 ? 
ATOM   3174 C  CB   . ASN B 1 66  ? 8.483   28.810  16.021  1.000 14.367 0 65  ASN B CB   1 ? 
ATOM   3175 C  CG   . ASN B 1 66  ? 9.368   30.036  15.944  1.000 14.638 0 65  ASN B CG   1 ? 
ATOM   3176 O  OD1  . ASN B 1 66  ? 10.428  30.029  15.301  1.000 16.246 0 65  ASN B OD1  1 ? 
ATOM   3177 N  ND2  . ASN B 1 66  ? 8.915   31.118  16.560  1.000 13.953 0 65  ASN B ND2  1 ? 
ATOM   3178 H  H    . ASN B 1 66  ? 8.157   25.929  16.492  1.000 12.811 0 65  ASN B H    1 c 
ATOM   3179 H  HA   . ASN B 1 66  ? 9.744   27.580  14.958  1.000 13.555 0 65  ASN B HA   1 c 
ATOM   3180 H  HB2  . ASN B 1 66  ? 7.783   28.880  15.340  1.000 14.273 0 65  ASN B HB2  1 c 
ATOM   3181 H  HB3  . ASN B 1 66  ? 8.048   28.783  16.898  1.000 14.272 0 65  ASN B HB3  1 c 
ATOM   3182 H  HD21 . ASN B 1 66  ? 9.413   31.847  16.595  1.000 14.177 0 65  ASN B HD21 1 c 
ATOM   3183 H  HD22 . ASN B 1 66  ? 8.115   31.112  16.936  1.000 14.165 0 65  ASN B HD22 1 c 
ATOM   3184 N  N    . PRO B 1 67  ? 11.085  26.179  16.794  1.000 15.738 0 66  PRO B N    1 ? 
ATOM   3185 C  CA   . PRO B 1 67  ? 12.037  25.793  17.849  1.000 16.064 0 66  PRO B CA   1 ? 
ATOM   3186 C  C    . PRO B 1 67  ? 13.140  26.820  18.167  1.000 18.150 0 66  PRO B C    1 ? 
ATOM   3187 O  O    . PRO B 1 67  ? 13.559  26.837  19.334  1.000 18.634 0 66  PRO B O    1 ? 
ATOM   3188 C  CB   . PRO B 1 67  ? 12.639  24.482  17.344  1.000 15.897 0 66  PRO B CB   1 ? 
ATOM   3189 C  CG   . PRO B 1 67  ? 12.472  24.541  15.845  1.000 15.730 0 66  PRO B CG   1 ? 
ATOM   3190 C  CD   . PRO B 1 67  ? 11.161  25.281  15.629  1.000 16.126 0 66  PRO B CD   1 ? 
ATOM   3191 H  HA   . PRO B 1 67  ? 11.526  25.605  18.675  1.000 16.352 0 66  PRO B HA   1 c 
ATOM   3192 H  HB2  . PRO B 1 67  ? 13.587  24.413  17.587  1.000 15.904 0 66  PRO B HB2  1 c 
ATOM   3193 H  HB3  . PRO B 1 67  ? 12.160  23.711  17.717  1.000 15.901 0 66  PRO B HB3  1 c 
ATOM   3194 H  HG2  . PRO B 1 67  ? 13.216  25.024  15.431  1.000 15.865 0 66  PRO B HG2  1 c 
ATOM   3195 H  HG3  . PRO B 1 67  ? 12.429  23.640  15.464  1.000 15.865 0 66  PRO B HG3  1 c 
ATOM   3196 H  HD2  . PRO B 1 67  ? 11.176  25.784  14.795  1.000 15.928 0 66  PRO B HD2  1 c 
ATOM   3197 H  HD3  . PRO B 1 67  ? 10.408  24.662  15.614  1.000 15.935 0 66  PRO B HD3  1 c 
ATOM   3198 N  N    . LEU B 1 68  ? 13.502  27.686  17.205  1.000 18.190 0 67  LEU B N    1 ? 
ATOM   3199 C  CA   . LEU B 1 68  ? 14.490  28.793  17.341  1.000 19.556 0 67  LEU B CA   1 ? 
ATOM   3200 C  C    . LEU B 1 68  ? 13.872  30.148  17.734  1.000 21.476 0 67  LEU B C    1 ? 
ATOM   3201 O  O    . LEU B 1 68  ? 14.650  31.128  17.829  1.000 22.174 0 67  LEU B O    1 ? 
ATOM   3202 C  CB   . LEU B 1 68  ? 15.250  28.909  16.014  1.000 21.369 0 67  LEU B CB   1 ? 
ATOM   3203 C  CG   . LEU B 1 68  ? 16.055  27.675  15.618  1.000 24.205 0 67  LEU B CG   1 ? 
ATOM   3204 C  CD1  . LEU B 1 68  ? 16.852  27.922  14.347  1.000 25.241 0 67  LEU B CD1  1 ? 
ATOM   3205 C  CD2  . LEU B 1 68  ? 16.989  27.246  16.746  1.000 26.216 0 67  LEU B CD2  1 ? 
ATOM   3206 H  H    . LEU B 1 68  ? 13.144  27.642  16.369  1.000 18.503 0 67  LEU B H    1 c 
ATOM   3207 H  HA   . LEU B 1 68  ? 15.125  28.540  18.049  1.000 19.988 0 67  LEU B HA   1 c 
ATOM   3208 H  HB2  . LEU B 1 68  ? 14.605  29.101  15.304  1.000 21.545 0 67  LEU B HB2  1 c 
ATOM   3209 H  HB3  . LEU B 1 68  ? 15.861  29.671  16.072  1.000 21.552 0 67  LEU B HB3  1 c 
ATOM   3210 H  HG   . LEU B 1 68  ? 15.421  26.936  15.445  1.000 24.180 0 67  LEU B HG   1 c 
ATOM   3211 H  HD11 . LEU B 1 68  ? 16.243  28.132  13.617  1.000 24.906 0 67  LEU B HD11 1 c 
ATOM   3212 H  HD12 . LEU B 1 68  ? 17.362  27.124  14.122  1.000 24.918 0 67  LEU B HD12 1 c 
ATOM   3213 H  HD13 . LEU B 1 68  ? 17.461  28.668  14.484  1.000 24.916 0 67  LEU B HD13 1 c 
ATOM   3214 H  HD21 . LEU B 1 68  ? 17.464  28.024  17.088  1.000 25.574 0 67  LEU B HD21 1 c 
ATOM   3215 H  HD22 . LEU B 1 68  ? 17.631  26.598  16.407  1.000 25.573 0 67  LEU B HD22 1 c 
ATOM   3216 H  HD23 . LEU B 1 68  ? 16.470  26.841  17.463  1.000 25.551 0 67  LEU B HD23 1 c 
ATOM   3217 N  N    . SER B 1 69  ? 12.561  30.237  17.986  1.000 19.829 0 68  SER B N    1 ? 
ATOM   3218 C  CA   . SER B 1 69  ? 11.875  31.478  18.439  1.000 21.178 0 68  SER B CA   1 ? 
ATOM   3219 C  C    . SER B 1 69  ? 12.094  32.651  17.461  1.000 21.481 0 68  SER B C    1 ? 
ATOM   3220 O  O    . SER B 1 69  ? 12.118  33.795  17.923  1.000 18.481 0 68  SER B O    1 ? 
ATOM   3221 C  CB   . SER B 1 69  ? 12.325  31.839  19.833  1.000 23.525 0 68  SER B CB   1 ? 
ATOM   3222 O  OG   . SER B 1 69  ? 12.422  30.659  20.627  1.000 26.731 0 68  SER B OG   1 ? 
ATOM   3223 H  H    . SER B 1 69  ? 11.984  29.534  17.899  1.000 20.515 0 68  SER B H    1 c 
ATOM   3224 H  HA   . SER B 1 69  ? 10.904  31.288  18.470  1.000 21.397 0 68  SER B HA   1 c 
ATOM   3225 H  HB2  . SER B 1 69  ? 13.206  32.286  19.793  1.000 23.633 0 68  SER B HB2  1 c 
ATOM   3226 H  HB3  . SER B 1 69  ? 11.676  32.463  20.240  1.000 23.639 0 68  SER B HB3  1 c 
ATOM   3227 H  HG   . SER B 1 69  ? 12.697  30.893  21.395  0.000 26.690 0 68  SER B HG   1 c 
ATOM   3228 N  N    . ARG B 1 70  ? 12.113  32.393  16.141  1.000 20.390 0 69  ARG B N    1 ? 
ATOM   3229 C  CA   . ARG B 1 70  ? 12.258  33.434  15.080  1.000 23.576 0 69  ARG B CA   1 ? 
ATOM   3230 C  C    . ARG B 1 70  ? 10.878  34.003  14.687  1.000 21.921 0 69  ARG B C    1 ? 
ATOM   3231 O  O    . ARG B 1 70  ? 9.863   33.478  15.173  1.000 20.582 0 69  ARG B O    1 ? 
ATOM   3232 C  CB   . ARG B 1 70  ? 12.941  32.822  13.854  1.000 24.929 0 69  ARG B CB   1 ? 
ATOM   3233 C  CG   . ARG B 1 70  ? 14.092  31.887  14.203  1.000 29.665 0 69  ARG B CG   1 ? 
ATOM   3234 C  CD   . ARG B 1 70  ? 15.428  32.579  14.298  1.000 31.442 0 69  ARG B CD   1 ? 
ATOM   3235 N  NE   . ARG B 1 70  ? 16.061  32.538  12.989  1.000 34.170 0 69  ARG B NE   1 ? 
ATOM   3236 C  CZ   . ARG B 1 70  ? 17.201  31.911  12.690  1.000 34.064 0 69  ARG B CZ   1 ? 
ATOM   3237 N  NH1  . ARG B 1 70  ? 17.901  31.281  13.614  1.000 35.287 0 69  ARG B NH1  1 ? 
ATOM   3238 N  NH2  . ARG B 1 70  ? 17.650  31.935  11.451  1.000 34.518 0 69  ARG B NH2  1 ? 
ATOM   3239 H  H    . ARG B 1 70  ? 11.985  31.551  15.811  1.000 21.404 0 69  ARG B H    1 c 
ATOM   3240 H  HA   . ARG B 1 70  ? 12.820  34.169  15.431  1.000 22.847 0 69  ARG B HA   1 c 
ATOM   3241 H  HB2  . ARG B 1 70  ? 12.266  32.320  13.334  1.000 25.609 0 69  ARG B HB2  1 c 
ATOM   3242 H  HB3  . ARG B 1 70  ? 13.283  33.554  13.283  1.000 25.644 0 69  ARG B HB3  1 c 
ATOM   3243 H  HG2  . ARG B 1 70  ? 13.906  31.439  15.064  1.000 28.798 0 69  ARG B HG2  1 c 
ATOM   3244 H  HG3  . ARG B 1 70  ? 14.151  31.185  13.509  1.000 28.833 0 69  ARG B HG3  1 c 
ATOM   3245 H  HD2  . ARG B 1 70  ? 15.300  33.518  14.581  1.000 31.612 0 69  ARG B HD2  1 c 
ATOM   3246 H  HD3  . ARG B 1 70  ? 15.992  32.123  14.970  1.000 31.648 0 69  ARG B HD3  1 c 
ATOM   3247 H  HE   . ARG B 1 70  ? 15.629  32.943  12.313  1.000 33.557 0 69  ARG B HE   1 c 
ATOM   3248 H  HH11 . ARG B 1 70  ? 17.611  31.247  14.464  1.000 34.802 0 69  ARG B HH11 1 c 
ATOM   3249 H  HH12 . ARG B 1 70  ? 18.670  30.873  13.389  1.000 34.812 0 69  ARG B HH12 1 c 
ATOM   3250 H  HH21 . ARG B 1 70  ? 17.188  32.371  10.815  1.000 34.353 0 69  ARG B HH21 1 c 
ATOM   3251 H  HH22 . ARG B 1 70  ? 18.426  31.530  11.246  1.000 34.353 0 69  ARG B HH22 1 c 
ATOM   3252 N  N    . LYS B 1 71  ? 10.855  35.043  13.846  1.000 20.591 0 70  LYS B N    1 ? 
ATOM   3253 C  CA   A LYS B 1 71  ? 9.623   35.638  13.250  0.500 20.654 0 70  LYS B CA   1 ? 
ATOM   3254 C  CA   B LYS B 1 71  ? 9.610   35.624  13.268  0.500 20.528 0 70  LYS B CA   1 ? 
ATOM   3255 C  C    . LYS B 1 71  ? 9.179   34.786  12.051  1.000 19.961 0 70  LYS B C    1 ? 
ATOM   3256 O  O    . LYS B 1 71  ? 10.041  34.058  11.485  1.000 17.681 0 70  LYS B O    1 ? 
ATOM   3257 C  CB   A LYS B 1 71  ? 9.872   37.085  12.798  0.500 21.940 0 70  LYS B CB   1 ? 
ATOM   3258 C  CB   B LYS B 1 71  ? 9.828   37.098  12.902  0.500 21.609 0 70  LYS B CB   1 ? 
ATOM   3259 C  CG   A LYS B 1 71  ? 9.913   38.136  13.902  0.500 23.452 0 70  LYS B CG   1 ? 
ATOM   3260 C  CG   B LYS B 1 71  ? 10.148  38.033  14.067  0.500 23.083 0 70  LYS B CG   1 ? 
ATOM   3261 C  CD   A LYS B 1 71  ? 10.467  39.478  13.455  0.500 24.295 0 70  LYS B CD   1 ? 
ATOM   3262 C  CD   B LYS B 1 71  ? 8.987   38.239  15.032  0.500 23.278 0 70  LYS B CD   1 ? 
ATOM   3263 C  CE   A LYS B 1 71  ? 10.643  40.466  14.589  0.500 24.701 0 70  LYS B CE   1 ? 
ATOM   3264 C  CE   B LYS B 1 71  ? 9.342   39.041  16.272  0.500 24.138 0 70  LYS B CE   1 ? 
ATOM   3265 N  NZ   A LYS B 1 71  ? 11.869  41.283  14.416  0.500 24.852 0 70  LYS B NZ   1 ? 
ATOM   3266 N  NZ   B LYS B 1 71  ? 9.321   40.507  16.041  0.500 24.007 0 70  LYS B NZ   1 ? 
ATOM   3267 H  H    . LYS B 1 71  ? 11.610  35.470  13.565  1.000 20.846 0 70  LYS B H    1 c 
ATOM   3268 H  HA   A LYS B 1 71  ? 8.910   35.631  13.929  0.500 20.741 0 70  LYS B HA   1 c 
ATOM   3269 H  HA   B LYS B 1 71  ? 8.900   35.571  13.950  0.500 20.630 0 70  LYS B HA   1 c 
ATOM   3270 H  HB2  A LYS B 1 71  ? 10.724  37.114  12.314  0.500 21.967 0 70  LYS B HB2  1 c 
ATOM   3271 H  HB2  B LYS B 1 71  ? 10.563  37.148  12.255  0.500 21.680 0 70  LYS B HB2  1 c 
ATOM   3272 H  HB3  A LYS B 1 71  ? 9.166   37.334  12.166  0.500 21.966 0 70  LYS B HB3  1 c 
ATOM   3273 H  HB3  B LYS B 1 71  ? 9.019   37.426  12.456  0.500 21.682 0 70  LYS B HB3  1 c 
ATOM   3274 H  HG2  A LYS B 1 71  ? 9.003   38.267  14.245  0.500 23.278 0 70  LYS B HG2  1 c 
ATOM   3275 H  HG2  B LYS B 1 71  ? 10.912  37.668  14.562  0.500 22.766 0 70  LYS B HG2  1 c 
ATOM   3276 H  HG3  A LYS B 1 71  ? 10.464  37.796  14.640  0.500 23.278 0 70  LYS B HG3  1 c 
ATOM   3277 H  HG3  B LYS B 1 71  ? 10.416  38.904  13.705  0.500 22.770 0 70  LYS B HG3  1 c 
ATOM   3278 H  HD2  A LYS B 1 71  ? 11.335  39.336  13.022  0.500 24.186 0 70  LYS B HD2  1 c 
ATOM   3279 H  HD2  B LYS B 1 71  ? 8.267   38.701  14.556  0.500 23.450 0 70  LYS B HD2  1 c 
ATOM   3280 H  HD3  A LYS B 1 71  ? 9.860   39.867  12.790  0.500 24.186 0 70  LYS B HD3  1 c 
ATOM   3281 H  HD3  B LYS B 1 71  ? 8.645   37.362  15.307  0.500 23.434 0 70  LYS B HD3  1 c 
ATOM   3282 H  HE2  A LYS B 1 71  ? 9.869   41.059  14.630  0.500 24.638 0 70  LYS B HE2  1 c 
ATOM   3283 H  HE2  B LYS B 1 71  ? 8.712   38.829  16.986  0.500 23.901 0 70  LYS B HE2  1 c 
ATOM   3284 H  HE3  A LYS B 1 71  ? 10.700  39.984  15.436  0.500 24.638 0 70  LYS B HE3  1 c 
ATOM   3285 H  HE3  B LYS B 1 71  ? 10.234  38.786  16.572  0.500 23.901 0 70  LYS B HE3  1 c 
ATOM   3286 H  HZ1  A LYS B 1 71  ? 12.585  40.741  14.294  0.500 24.802 0 70  LYS B HZ1  1 c 
ATOM   3287 H  HZ1  B LYS B 1 71  ? 9.892   40.721  15.369  0.500 24.046 0 70  LYS B HZ1  1 c 
ATOM   3288 H  HZ2  A LYS B 1 71  ? 12.004  41.792  15.152  0.500 24.802 0 70  LYS B HZ2  1 c 
ATOM   3289 H  HZ2  B LYS B 1 71  ? 9.576   40.941  16.796  0.500 24.046 0 70  LYS B HZ2  1 c 
ATOM   3290 H  HZ3  A LYS B 1 71  ? 11.778  41.824  13.693  0.500 24.802 0 70  LYS B HZ3  1 c 
ATOM   3291 H  HZ3  B LYS B 1 71  ? 8.483   40.771  15.815  0.500 24.046 0 70  LYS B HZ3  1 c 
ATOM   3292 N  N    . HIS B 1 72  ? 7.887   34.879  11.695  1.000 19.460 0 71  HIS B N    1 ? 
ATOM   3293 C  CA   . HIS B 1 72  ? 7.250   34.255  10.504  1.000 18.243 0 71  HIS B CA   1 ? 
ATOM   3294 C  C    . HIS B 1 72  ? 7.872   34.840  9.231   1.000 18.586 0 71  HIS B C    1 ? 
ATOM   3295 O  O    . HIS B 1 72  ? 8.004   36.076  9.150   1.000 20.262 0 71  HIS B O    1 ? 
ATOM   3296 C  CB   . HIS B 1 72  ? 5.743   34.507  10.476  1.000 17.134 0 71  HIS B CB   1 ? 
ATOM   3297 C  CG   . HIS B 1 72  ? 5.044   33.885  9.309   1.000 16.676 0 71  HIS B CG   1 ? 
ATOM   3298 N  ND1  . HIS B 1 72  ? 4.785   32.545  9.239   1.000 14.602 0 71  HIS B ND1  1 ? 
ATOM   3299 C  CD2  . HIS B 1 72  ? 4.462   34.427  8.218   1.000 14.970 0 71  HIS B CD2  1 ? 
ATOM   3300 C  CE1  . HIS B 1 72  ? 4.161   32.262  8.123   1.000 16.057 0 71  HIS B CE1  1 ? 
ATOM   3301 N  NE2  . HIS B 1 72  ? 3.934   33.400  7.491   1.000 15.605 0 71  HIS B NE2  1 ? 
ATOM   3302 H  H    . HIS B 1 72  ? 7.286   35.355  12.187  1.000 19.289 0 71  HIS B H    1 c 
ATOM   3303 H  HA   . HIS B 1 72  ? 7.421   33.285  10.527  1.000 18.305 0 71  HIS B HA   1 c 
ATOM   3304 H  HB2  . HIS B 1 72  ? 5.345   34.164  11.305  1.000 17.295 0 71  HIS B HB2  1 c 
ATOM   3305 H  HB3  . HIS B 1 72  ? 5.588   35.475  10.451  1.000 17.321 0 71  HIS B HB3  1 c 
ATOM   3306 H  HD1  . HIS B 1 72  ? 5.011   31.954  9.856   0.000 15.470 0 71  HIS B HD1  1 c 
ATOM   3307 H  HD2  . HIS B 1 72  ? 4.457   35.334  7.978   1.000 15.535 0 71  HIS B HD2  1 c 
ATOM   3308 H  HE1  . HIS B 1 72  ? 3.882   31.406  7.846   1.000 15.619 0 71  HIS B HE1  1 c 
ATOM   3309 H  HE2  . HIS B 1 72  ? 3.541   33.431  6.708   0.000 16.260 0 71  HIS B HE2  1 c 
ATOM   3310 N  N    . GLY B 1 73  ? 8.149   33.979  8.260   1.000 16.647 0 72  GLY B N    1 ? 
ATOM   3311 C  CA   . GLY B 1 73  ? 8.792   34.352  7.007   1.000 16.877 0 72  GLY B CA   1 ? 
ATOM   3312 C  C    . GLY B 1 73  ? 8.272   33.469  5.907   1.000 16.274 0 72  GLY B C    1 ? 
ATOM   3313 O  O    . GLY B 1 73  ? 7.412   32.584  6.186   1.000 16.151 0 72  GLY B O    1 ? 
ATOM   3314 H  H    . GLY B 1 73  ? 7.949   33.092  8.328   1.000 17.143 0 72  GLY B H    1 c 
ATOM   3315 H  HA2  . GLY B 1 73  ? 8.594   35.299  6.799   1.000 16.691 0 72  GLY B HA2  1 c 
ATOM   3316 H  HA3  . GLY B 1 73  ? 9.772   34.240  7.092   1.000 16.689 0 72  GLY B HA3  1 c 
ATOM   3317 N  N    . GLY B 1 74  ? 8.817   33.654  4.709   1.000 17.344 0 73  GLY B N    1 ? 
ATOM   3318 C  CA   . GLY B 1 74  ? 8.616   32.695  3.610   1.000 16.112 0 73  GLY B CA   1 ? 
ATOM   3319 C  C    . GLY B 1 74  ? 9.673   31.601  3.676   1.000 17.808 0 73  GLY B C    1 ? 
ATOM   3320 O  O    . GLY B 1 74  ? 10.680  31.756  4.356   1.000 14.877 0 73  GLY B O    1 ? 
ATOM   3321 H  H    . GLY B 1 74  ? 9.330   34.377  4.505   1.000 16.811 0 73  GLY B H    1 c 
ATOM   3322 H  HA2  . GLY B 1 74  ? 7.714   32.295  3.683   1.000 16.790 0 73  GLY B HA2  1 c 
ATOM   3323 H  HA3  . GLY B 1 74  ? 8.683   33.171  2.744   1.000 16.787 0 73  GLY B HA3  1 c 
ATOM   3324 N  N    . PRO B 1 75  ? 9.480   30.470  2.970   1.000 18.182 0 74  PRO B N    1 ? 
ATOM   3325 C  CA   . PRO B 1 75  ? 10.449  29.367  3.018   1.000 19.984 0 74  PRO B CA   1 ? 
ATOM   3326 C  C    . PRO B 1 75  ? 11.876  29.793  2.595   1.000 22.213 0 74  PRO B C    1 ? 
ATOM   3327 O  O    . PRO B 1 75  ? 12.838  29.252  3.109   1.000 18.809 0 74  PRO B O    1 ? 
ATOM   3328 C  CB   . PRO B 1 75  ? 9.823   28.300  2.089   1.000 19.324 0 74  PRO B CB   1 ? 
ATOM   3329 C  CG   . PRO B 1 75  ? 8.845   29.076  1.205   1.000 19.210 0 74  PRO B CG   1 ? 
ATOM   3330 C  CD   . PRO B 1 75  ? 8.341   30.210  2.075   1.000 19.993 0 74  PRO B CD   1 ? 
ATOM   3331 H  HA   . PRO B 1 75  ? 10.475  29.008  3.941   1.000 19.901 0 74  PRO B HA   1 c 
ATOM   3332 H  HB2  . PRO B 1 75  ? 10.512  27.862  1.544   1.000 19.473 0 74  PRO B HB2  1 c 
ATOM   3333 H  HB3  . PRO B 1 75  ? 9.352   27.615  2.610   1.000 19.456 0 74  PRO B HB3  1 c 
ATOM   3334 H  HG2  . PRO B 1 75  ? 9.297   29.425  0.410   1.000 19.421 0 74  PRO B HG2  1 c 
ATOM   3335 H  HG3  . PRO B 1 75  ? 8.104   28.503  0.920   1.000 19.421 0 74  PRO B HG3  1 c 
ATOM   3336 H  HD2  . PRO B 1 75  ? 8.124   30.995  1.540   1.000 19.360 0 74  PRO B HD2  1 c 
ATOM   3337 H  HD3  . PRO B 1 75  ? 7.552   29.942  2.582   1.000 19.362 0 74  PRO B HD3  1 c 
ATOM   3338 N  N    . LYS B 1 76  ? 12.007  30.770  1.693   1.000 24.366 0 75  LYS B N    1 ? 
ATOM   3339 C  CA   . LYS B 1 76  ? 13.334  31.180  1.148   1.000 25.294 0 75  LYS B CA   1 ? 
ATOM   3340 C  C    . LYS B 1 76  ? 14.049  32.114  2.130   1.000 25.424 0 75  LYS B C    1 ? 
ATOM   3341 O  O    . LYS B 1 76  ? 15.274  32.291  1.968   1.000 24.839 0 75  LYS B O    1 ? 
ATOM   3342 C  CB   . LYS B 1 76  ? 13.166  31.793  -0.241  1.000 28.284 0 75  LYS B CB   1 ? 
ATOM   3343 C  CG   . LYS B 1 76  ? 12.838  30.769  -1.315  1.000 29.756 0 75  LYS B CG   1 ? 
ATOM   3344 C  CD   . LYS B 1 76  ? 12.835  31.322  -2.715  1.000 33.396 0 75  LYS B CD   1 ? 
ATOM   3345 C  CE   . LYS B 1 76  ? 11.755  32.359  -2.924  1.000 34.396 0 75  LYS B CE   1 ? 
ATOM   3346 N  NZ   . LYS B 1 76  ? 11.063  32.183  -4.226  1.000 37.934 0 75  LYS B NZ   1 ? 
ATOM   3347 H  H    . LYS B 1 76  ? 11.301  31.235  1.355   1.000 24.042 0 75  LYS B H    1 c 
ATOM   3348 H  HA   . LYS B 1 76  ? 13.881  30.367  1.055   1.000 25.667 0 75  LYS B HA   1 c 
ATOM   3349 H  HB2  . LYS B 1 76  ? 12.450  32.461  -0.208  1.000 27.878 0 75  LYS B HB2  1 c 
ATOM   3350 H  HB3  . LYS B 1 76  ? 13.997  32.252  -0.486  1.000 27.874 0 75  LYS B HB3  1 c 
ATOM   3351 H  HG2  . LYS B 1 76  ? 13.496  30.044  -1.265  1.000 30.203 0 75  LYS B HG2  1 c 
ATOM   3352 H  HG3  . LYS B 1 76  ? 11.955  30.385  -1.123  1.000 30.220 0 75  LYS B HG3  1 c 
ATOM   3353 H  HD2  . LYS B 1 76  ? 13.708  31.729  -2.902  1.000 32.728 0 75  LYS B HD2  1 c 
ATOM   3354 H  HD3  . LYS B 1 76  ? 12.700  30.587  -3.351  1.000 32.744 0 75  LYS B HD3  1 c 
ATOM   3355 H  HE2  . LYS B 1 76  ? 11.097  32.296  -2.206  1.000 34.924 0 75  LYS B HE2  1 c 
ATOM   3356 H  HE3  . LYS B 1 76  ? 12.149  33.251  -2.893  1.000 34.947 0 75  LYS B HE3  1 c 
ATOM   3357 H  HZ1  . LYS B 1 76  ? 11.667  32.221  -4.902  1.000 36.801 0 75  LYS B HZ1  1 c 
ATOM   3358 H  HZ2  . LYS B 1 76  ? 10.449  32.841  -4.339  1.000 36.801 0 75  LYS B HZ2  1 c 
ATOM   3359 H  HZ3  . LYS B 1 76  ? 10.644  31.379  -4.246  1.000 36.793 0 75  LYS B HZ3  1 c 
ATOM   3360 N  N    . ASP B 1 77  ? 13.330  32.663  3.119   1.000 25.582 0 76  ASP B N    1 ? 
ATOM   3361 C  CA   . ASP B 1 77  ? 13.884  33.646  4.090   1.000 26.949 0 76  ASP B CA   1 ? 
ATOM   3362 C  C    . ASP B 1 77  ? 14.749  32.945  5.136   1.000 28.744 0 76  ASP B C    1 ? 
ATOM   3363 O  O    . ASP B 1 77  ? 14.396  31.826  5.566   1.000 26.854 0 76  ASP B O    1 ? 
ATOM   3364 C  CB   . ASP B 1 77  ? 12.785  34.447  4.797   1.000 26.978 0 76  ASP B CB   1 ? 
ATOM   3365 C  CG   . ASP B 1 77  ? 11.894  35.171  3.805   1.000 27.692 0 76  ASP B CG   1 ? 
ATOM   3366 O  OD1  . ASP B 1 77  ? 12.271  35.226  2.611   1.000 30.405 0 76  ASP B OD1  1 ? 
ATOM   3367 O  OD2  . ASP B 1 77  ? 10.817  35.619  4.214   1.000 29.333 0 76  ASP B OD2  1 ? 
ATOM   3368 H  H    . ASP B 1 77  ? 12.453  32.467  3.258   1.000 25.837 0 76  ASP B H    1 c 
ATOM   3369 H  HA   . ASP B 1 77  ? 14.452  34.280  3.592   1.000 27.029 0 76  ASP B HA   1 c 
ATOM   3370 H  HB2  . ASP B 1 77  ? 12.234  33.842  5.335   1.000 27.139 0 76  ASP B HB2  1 c 
ATOM   3371 H  HB3  . ASP B 1 77  ? 13.196  35.106  5.393   1.000 27.139 0 76  ASP B HB3  1 c 
ATOM   3372 N  N    . GLU B 1 78  ? 15.820  33.623  5.549   1.000 29.294 0 77  GLU B N    1 ? 
ATOM   3373 C  CA   . GLU B 1 78  ? 16.701  33.178  6.648   1.000 31.412 0 77  GLU B CA   1 ? 
ATOM   3374 C  C    . GLU B 1 78  ? 15.924  33.364  7.953   1.000 28.606 0 77  GLU B C    1 ? 
ATOM   3375 O  O    . GLU B 1 78  ? 15.987  32.455  8.796   1.000 30.806 0 77  GLU B O    1 ? 
ATOM   3376 C  CB   . GLU B 1 78  ? 18.019  33.956  6.653   1.000 36.122 0 77  GLU B CB   1 ? 
ATOM   3377 C  CG   . GLU B 1 78  ? 19.152  33.169  7.290   1.000 41.668 0 77  GLU B CG   1 ? 
ATOM   3378 C  CD   . GLU B 1 78  ? 20.431  33.951  7.551   1.000 46.485 0 77  GLU B CD   1 ? 
ATOM   3379 O  OE1  . GLU B 1 78  ? 20.852  34.718  6.654   1.000 49.368 0 77  GLU B OE1  1 ? 
ATOM   3380 O  OE2  . GLU B 1 78  ? 21.002  33.791  8.656   1.000 48.664 0 77  GLU B OE2  1 ? 
ATOM   3381 H  H    . GLU B 1 78  ? 16.070  34.416  5.177   1.000 29.666 0 77  GLU B H    1 c 
ATOM   3382 H  HA   . GLU B 1 78  ? 16.894  32.220  6.526   1.000 31.282 0 77  GLU B HA   1 c 
ATOM   3383 H  HB2  . GLU B 1 78  ? 18.262  34.176  5.729   1.000 36.130 0 77  GLU B HB2  1 c 
ATOM   3384 H  HB3  . GLU B 1 78  ? 17.892  34.794  7.144   1.000 36.131 0 77  GLU B HB3  1 c 
ATOM   3385 H  HG2  . GLU B 1 78  ? 18.838  32.802  8.144   1.000 41.359 0 77  GLU B HG2  1 c 
ATOM   3386 H  HG3  . GLU B 1 78  ? 19.372  32.409  6.710   1.000 41.347 0 77  GLU B HG3  1 c 
ATOM   3387 N  N    . GLU B 1 79  ? 15.194  34.478  8.095   1.000 24.444 0 78  GLU B N    1 ? 
ATOM   3388 C  CA   . GLU B 1 79  ? 14.297  34.703  9.261   1.000 24.610 0 78  GLU B CA   1 ? 
ATOM   3389 C  C    . GLU B 1 79  ? 12.934  34.073  8.944   1.000 23.992 0 78  GLU B C    1 ? 
ATOM   3390 O  O    . GLU B 1 79  ? 12.125  34.703  8.226   1.000 21.615 0 78  GLU B O    1 ? 
ATOM   3391 C  CB   . GLU B 1 79  ? 14.162  36.175  9.639   1.000 26.565 0 78  GLU B CB   1 ? 
ATOM   3392 C  CG   . GLU B 1 79  ? 13.394  36.373  10.943  1.000 28.833 0 78  GLU B CG   1 ? 
ATOM   3393 C  CD   . GLU B 1 79  ? 14.182  36.294  12.250  1.000 32.195 0 78  GLU B CD   1 ? 
ATOM   3394 O  OE1  . GLU B 1 79  ? 15.437  36.129  12.190  1.000 33.883 0 78  GLU B OE1  1 ? 
ATOM   3395 O  OE2  . GLU B 1 79  ? 13.536  36.410  13.345  1.000 30.871 0 78  GLU B OE2  1 ? 
ATOM   3396 H  H    . GLU B 1 79  ? 15.209  35.164  7.495   1.000 25.419 0 78  GLU B H    1 c 
ATOM   3397 H  HA   . GLU B 1 79  ? 14.682  34.227  10.033  1.000 24.813 0 78  GLU B HA   1 c 
ATOM   3398 H  HB2  . GLU B 1 79  ? 15.057  36.563  9.728   1.000 26.611 0 78  GLU B HB2  1 c 
ATOM   3399 H  HB3  . GLU B 1 79  ? 13.697  36.646  8.917   1.000 26.592 0 78  GLU B HB3  1 c 
ATOM   3400 H  HG2  . GLU B 1 79  ? 12.960  37.250  10.911  1.000 29.013 0 78  GLU B HG2  1 c 
ATOM   3401 H  HG3  . GLU B 1 79  ? 12.678  35.704  10.987  1.000 29.005 0 78  GLU B HG3  1 c 
ATOM   3402 N  N    . ARG B 1 80  ? 12.725  32.842  9.422   1.000 19.460 0 79  ARG B N    1 ? 
ATOM   3403 C  CA   . ARG B 1 80  ? 11.461  32.081  9.293   1.000 19.320 0 79  ARG B CA   1 ? 
ATOM   3404 C  C    . ARG B 1 80  ? 11.321  31.152  10.499  1.000 17.964 0 79  ARG B C    1 ? 
ATOM   3405 O  O    . ARG B 1 80  ? 12.335  30.876  11.183  1.000 17.321 0 79  ARG B O    1 ? 
ATOM   3406 C  CB   . ARG B 1 80  ? 11.422  31.230  8.011   1.000 17.895 0 79  ARG B CB   1 ? 
ATOM   3407 C  CG   . ARG B 1 80  ? 12.658  30.362  7.789   1.000 18.194 0 79  ARG B CG   1 ? 
ATOM   3408 C  CD   . ARG B 1 80  ? 12.562  29.356  6.644   1.000 16.931 0 79  ARG B CD   1 ? 
ATOM   3409 N  NE   . ARG B 1 80  ? 11.834  28.113  6.979   1.000 17.362 0 79  ARG B NE   1 ? 
ATOM   3410 C  CZ   . ARG B 1 80  ? 11.719  27.045  6.173   1.000 17.141 0 79  ARG B CZ   1 ? 
ATOM   3411 N  NH1  . ARG B 1 80  ? 12.235  27.068  4.949   1.000 15.771 0 79  ARG B NH1  1 ? 
ATOM   3412 N  NH2  . ARG B 1 80  ? 11.041  25.971  6.579   1.000 17.283 0 79  ARG B NH2  1 ? 
ATOM   3413 H  H    . ARG B 1 80  ? 13.376  32.380  9.866   1.000 20.427 0 79  ARG B H    1 c 
ATOM   3414 H  HA   . ARG B 1 80  ? 10.705  32.718  9.285   1.000 18.816 0 79  ARG B HA   1 c 
ATOM   3415 H  HB2  . ARG B 1 80  ? 10.625  30.646  8.045   1.000 18.291 0 79  ARG B HB2  1 c 
ATOM   3416 H  HB3  . ARG B 1 80  ? 11.317  31.836  7.236   1.000 18.293 0 79  ARG B HB3  1 c 
ATOM   3417 H  HG2  . ARG B 1 80  ? 13.433  30.953  7.622   1.000 17.840 0 79  ARG B HG2  1 c 
ATOM   3418 H  HG3  . ARG B 1 80  ? 12.846  29.863  8.622   1.000 17.824 0 79  ARG B HG3  1 c 
ATOM   3419 H  HD2  . ARG B 1 80  ? 12.112  29.789  5.877   1.000 17.323 0 79  ARG B HD2  1 c 
ATOM   3420 H  HD3  . ARG B 1 80  ? 13.477  29.118  6.354   1.000 17.321 0 79  ARG B HD3  1 c 
ATOM   3421 H  HE   . ARG B 1 80  ? 11.468  28.054  7.797   1.000 17.176 0 79  ARG B HE   1 c 
ATOM   3422 H  HH11 . ARG B 1 80  ? 12.691  27.788  4.664   1.000 16.262 0 79  ARG B HH11 1 c 
ATOM   3423 H  HH12 . ARG B 1 80  ? 12.144  26.353  4.412   1.000 16.266 0 79  ARG B HH12 1 c 
ATOM   3424 H  HH21 . ARG B 1 80  ? 10.679  25.954  7.402   1.000 17.190 0 79  ARG B HH21 1 c 
ATOM   3425 H  HH22 . ARG B 1 80  ? 10.952  25.263  6.033   1.000 17.196 0 79  ARG B HH22 1 c 
ATOM   3426 N  N    . HIS B 1 81  ? 10.120  30.627  10.695  1.000 17.388 0 80  HIS B N    1 ? 
ATOM   3427 C  CA   . HIS B 1 81  ? 9.871   29.391  11.482  1.000 15.546 0 80  HIS B CA   1 ? 
ATOM   3428 C  C    . HIS B 1 81  ? 10.354  28.161  10.686  1.000 15.664 0 80  HIS B C    1 ? 
ATOM   3429 O  O    . HIS B 1 81  ? 10.294  28.155  9.432   1.000 14.505 0 80  HIS B O    1 ? 
ATOM   3430 C  CB   . HIS B 1 81  ? 8.394   29.305  11.900  1.000 14.918 0 80  HIS B CB   1 ? 
ATOM   3431 C  CG   . HIS B 1 81  ? 7.811   30.552  12.473  1.000 16.902 0 80  HIS B CG   1 ? 
ATOM   3432 N  ND1  . HIS B 1 81  ? 6.536   30.979  12.153  1.000 15.457 0 80  HIS B ND1  1 ? 
ATOM   3433 C  CD2  . HIS B 1 81  ? 8.290   31.461  13.348  1.000 15.227 0 80  HIS B CD2  1 ? 
ATOM   3434 C  CE1  . HIS B 1 81  ? 6.263   32.090  12.810  1.000 16.582 0 80  HIS B CE1  1 ? 
ATOM   3435 N  NE2  . HIS B 1 81  ? 7.309   32.405  13.551  1.000 15.434 0 80  HIS B NE2  1 ? 
ATOM   3436 H  H    . HIS B 1 81  ? 9.358   30.981  10.343  1.000 17.064 0 80  HIS B H    1 c 
ATOM   3437 H  HA   . HIS B 1 81  ? 10.414  29.448  12.303  1.000 15.787 0 80  HIS B HA   1 c 
ATOM   3438 H  HB2  . HIS B 1 81  ? 7.863   29.046  11.115  1.000 15.511 0 80  HIS B HB2  1 c 
ATOM   3439 H  HB3  . HIS B 1 81  ? 8.301   28.588  12.564  1.000 15.502 0 80  HIS B HB3  1 c 
ATOM   3440 H  HD1  . HIS B 1 81  ? 5.975   30.592  11.597  0.000 14.720 0 80  HIS B HD1  1 c 
ATOM   3441 H  HD2  . HIS B 1 81  ? 9.137   31.453  13.750  1.000 15.666 0 80  HIS B HD2  1 c 
ATOM   3442 H  HE1  . HIS B 1 81  ? 5.459   32.572  12.761  1.000 16.044 0 80  HIS B HE1  1 c 
ATOM   3443 H  HE2  . HIS B 1 81  ? 7.353   33.102  14.091  0.000 14.370 0 80  HIS B HE2  1 c 
ATOM   3444 N  N    . VAL B 1 82  ? 10.822  27.115  11.373  1.000 16.380 0 81  VAL B N    1 ? 
ATOM   3445 C  CA   . VAL B 1 82  ? 11.099  25.814  10.702  1.000 15.686 0 81  VAL B CA   1 ? 
ATOM   3446 C  C    . VAL B 1 82  ? 9.815   25.415  9.959   1.000 15.963 0 81  VAL B C    1 ? 
ATOM   3447 O  O    . VAL B 1 82  ? 9.940   25.054  8.798   1.000 14.882 0 81  VAL B O    1 ? 
ATOM   3448 C  CB   . VAL B 1 82  ? 11.637  24.743  11.680  1.000 15.703 0 81  VAL B CB   1 ? 
ATOM   3449 C  CG1  . VAL B 1 82  ? 11.761  23.375  11.027  1.000 15.382 0 81  VAL B CG1  1 ? 
ATOM   3450 C  CG2  . VAL B 1 82  ? 12.985  25.182  12.251  1.000 15.749 0 81  VAL B CG2  1 ? 
ATOM   3451 H  H    . VAL B 1 82  ? 10.983  27.129  12.269  1.000 16.041 0 81  VAL B H    1 c 
ATOM   3452 H  HA   . VAL B 1 82  ? 11.787  25.973  10.033  1.000 15.874 0 81  VAL B HA   1 c 
ATOM   3453 H  HB   . VAL B 1 82  ? 10.996  24.669  12.430  1.000 15.648 0 81  VAL B HB   1 c 
ATOM   3454 H  HG11 . VAL B 1 82  ? 10.873  23.019  10.845  1.000 15.485 0 81  VAL B HG11 1 c 
ATOM   3455 H  HG12 . VAL B 1 82  ? 12.233  22.771  11.626  1.000 15.487 0 81  VAL B HG12 1 c 
ATOM   3456 H  HG13 . VAL B 1 82  ? 12.255  23.455  10.194  1.000 15.489 0 81  VAL B HG13 1 c 
ATOM   3457 H  HG21 . VAL B 1 82  ? 13.614  25.325  11.523  1.000 15.740 0 81  VAL B HG21 1 c 
ATOM   3458 H  HG22 . VAL B 1 82  ? 13.328  24.490  12.843  1.000 15.737 0 81  VAL B HG22 1 c 
ATOM   3459 H  HG23 . VAL B 1 82  ? 12.875  26.008  12.751  1.000 15.737 0 81  VAL B HG23 1 c 
ATOM   3460 N  N    . GLY B 1 83  ? 8.629   25.660  10.539  1.000 15.825 0 82  GLY B N    1 ? 
ATOM   3461 C  CA   . GLY B 1 83  ? 7.324   25.225  9.968   1.000 15.732 0 82  GLY B CA   1 ? 
ATOM   3462 C  C    . GLY B 1 83  ? 6.841   25.971  8.714   1.000 16.106 0 82  GLY B C    1 ? 
ATOM   3463 O  O    . GLY B 1 83  ? 5.796   25.542  8.175   1.000 16.180 0 82  GLY B O    1 ? 
ATOM   3464 H  H    . GLY B 1 83  ? 8.557   26.098  11.334  1.000 15.836 0 82  GLY B H    1 c 
ATOM   3465 H  HA2  . GLY B 1 83  ? 7.388   24.261  9.754   1.000 15.839 0 82  GLY B HA2  1 c 
ATOM   3466 H  HA3  . GLY B 1 83  ? 6.634   25.318  10.673  1.000 15.832 0 82  GLY B HA3  1 c 
ATOM   3467 N  N    . ASP B 1 84  ? 7.532   27.026  8.259   1.000 14.962 0 83  ASP B N    1 ? 
ATOM   3468 C  CA   . ASP B 1 84  ? 7.042   27.981  7.220   1.000 15.928 0 83  ASP B CA   1 ? 
ATOM   3469 C  C    . ASP B 1 84  ? 7.300   27.361  5.841   1.000 15.912 0 83  ASP B C    1 ? 
ATOM   3470 O  O    . ASP B 1 84  ? 8.397   27.514  5.335   1.000 15.653 0 83  ASP B O    1 ? 
ATOM   3471 C  CB   . ASP B 1 84  ? 7.689   29.372  7.385   1.000 16.438 0 83  ASP B CB   1 ? 
ATOM   3472 C  CG   . ASP B 1 84  ? 7.201   30.199  8.569   1.000 16.125 0 83  ASP B CG   1 ? 
ATOM   3473 O  OD1  . ASP B 1 84  ? 6.120   29.915  9.044   1.000 15.280 0 83  ASP B OD1  1 ? 
ATOM   3474 O  OD2  . ASP B 1 84  ? 7.923   31.161  9.007   1.000 18.098 0 83  ASP B OD2  1 ? 
ATOM   3475 H  H    . ASP B 1 84  ? 8.365   27.228  8.564   1.000 15.456 0 83  ASP B H    1 c 
ATOM   3476 H  HA   . ASP B 1 84  ? 6.068   28.082  7.334   1.000 15.829 0 83  ASP B HA   1 c 
ATOM   3477 H  HB2  . ASP B 1 84  ? 8.657   29.257  7.479   1.000 16.239 0 83  ASP B HB2  1 c 
ATOM   3478 H  HB3  . ASP B 1 84  ? 7.526   29.890  6.571   1.000 16.238 0 83  ASP B HB3  1 c 
ATOM   3479 N  N    . LEU B 1 85  ? 6.290   26.740  5.220   1.000 14.836 0 84  LEU B N    1 ? 
ATOM   3480 C  CA   . LEU B 1 85  ? 6.460   26.104  3.898   1.000 15.381 0 84  LEU B CA   1 ? 
ATOM   3481 C  C    . LEU B 1 85  ? 5.785   26.979  2.818   1.000 15.134 0 84  LEU B C    1 ? 
ATOM   3482 O  O    . LEU B 1 85  ? 5.708   26.504  1.656   1.000 16.182 0 84  LEU B O    1 ? 
ATOM   3483 C  CB   . LEU B 1 85  ? 5.932   24.666  3.962   1.000 15.067 0 84  LEU B CB   1 ? 
ATOM   3484 C  CG   . LEU B 1 85  ? 6.761   23.681  4.804   1.000 15.677 0 84  LEU B CG   1 ? 
ATOM   3485 C  CD1  . LEU B 1 85  ? 6.211   22.261  4.689   1.000 15.015 0 84  LEU B CD1  1 ? 
ATOM   3486 C  CD2  . LEU B 1 85  ? 8.234   23.710  4.414   1.000 15.671 0 84  LEU B CD2  1 ? 
ATOM   3487 H  H    . LEU B 1 85  ? 5.452   26.673  5.570   1.000 15.214 0 84  LEU B H    1 c 
ATOM   3488 H  HA   . LEU B 1 85  ? 7.422   26.076  3.698   1.000 15.174 0 84  LEU B HA   1 c 
ATOM   3489 H  HB2  . LEU B 1 85  ? 5.024   24.688  4.321   1.000 15.282 0 84  LEU B HB2  1 c 
ATOM   3490 H  HB3  . LEU B 1 85  ? 5.878   24.319  3.049   1.000 15.285 0 84  LEU B HB3  1 c 
ATOM   3491 H  HG   . LEU B 1 85  ? 6.692   23.958  5.751   1.000 15.432 0 84  LEU B HG   1 c 
ATOM   3492 H  HD11 . LEU B 1 85  ? 5.285   22.246  4.990   1.000 15.219 0 84  LEU B HD11 1 c 
ATOM   3493 H  HD12 . LEU B 1 85  ? 6.741   21.661  5.242   1.000 15.219 0 84  LEU B HD12 1 c 
ATOM   3494 H  HD13 . LEU B 1 85  ? 6.254   21.970  3.762   1.000 15.219 0 84  LEU B HD13 1 c 
ATOM   3495 H  HD21 . LEU B 1 85  ? 8.314   23.673  3.444   1.000 15.674 0 84  LEU B HD21 1 c 
ATOM   3496 H  HD22 . LEU B 1 85  ? 8.689   22.944  4.806   1.000 15.673 0 84  LEU B HD22 1 c 
ATOM   3497 H  HD23 . LEU B 1 85  ? 8.642   24.531  4.742   1.000 15.672 0 84  LEU B HD23 1 c 
ATOM   3498 N  N    . GLY B 1 86  ? 5.387   28.217  3.161   1.000 13.889 0 85  GLY B N    1 ? 
ATOM   3499 C  CA   . GLY B 1 86  ? 4.826   29.195  2.189   1.000 15.711 0 85  GLY B CA   1 ? 
ATOM   3500 C  C    . GLY B 1 86  ? 3.409   28.832  1.754   1.000 14.183 0 85  GLY B C    1 ? 
ATOM   3501 O  O    . GLY B 1 86  ? 2.558   28.704  2.650   1.000 13.957 0 85  GLY B O    1 ? 
ATOM   3502 H  H    . GLY B 1 86  ? 5.435   28.529  4.014   1.000 14.593 0 85  GLY B H    1 c 
ATOM   3503 H  HA2  . GLY B 1 86  ? 4.820   30.093  2.603   1.000 14.898 0 85  GLY B HA2  1 c 
ATOM   3504 H  HA3  . GLY B 1 86  ? 5.414   29.230  1.393   1.000 14.897 0 85  GLY B HA3  1 c 
ATOM   3505 N  N    . ASN B 1 87  ? 3.134   28.703  0.434   1.000 13.809 0 86  ASN B N    1 ? 
ATOM   3506 C  CA   . ASN B 1 87  ? 1.770   28.501  -0.138  1.000 14.581 0 86  ASN B CA   1 ? 
ATOM   3507 C  C    . ASN B 1 87  ? 1.743   27.316  -1.103  1.000 14.054 0 86  ASN B C    1 ? 
ATOM   3508 O  O    . ASN B 1 87  ? 2.750   27.046  -1.749  1.000 13.605 0 86  ASN B O    1 ? 
ATOM   3509 C  CB   . ASN B 1 87  ? 1.270   29.724  -0.927  1.000 15.502 0 86  ASN B CB   1 ? 
ATOM   3510 C  CG   . ASN B 1 87  ? 0.954   30.899  -0.038  1.000 15.489 0 86  ASN B CG   1 ? 
ATOM   3511 O  OD1  . ASN B 1 87  ? -0.068  30.900  0.638   1.000 15.220 0 86  ASN B OD1  1 ? 
ATOM   3512 N  ND2  . ASN B 1 87  ? 1.863   31.866  0.054   1.000 16.576 0 86  ASN B ND2  1 ? 
ATOM   3513 H  H    . ASN B 1 87  ? 3.787   28.733  -0.200  1.000 14.078 0 86  ASN B H    1 c 
ATOM   3514 H  HA   . ASN B 1 87  ? 1.138   28.331  0.597   1.000 14.496 0 86  ASN B HA   1 c 
ATOM   3515 H  HB2  . ASN B 1 87  ? 1.956   29.985  -1.575  1.000 15.283 0 86  ASN B HB2  1 c 
ATOM   3516 H  HB3  . ASN B 1 87  ? 0.464   29.474  -1.423  1.000 15.277 0 86  ASN B HB3  1 c 
ATOM   3517 H  HD21 . ASN B 1 87  ? 1.683   32.601  0.511   1.000 16.232 0 86  ASN B HD21 1 c 
ATOM   3518 H  HD22 . ASN B 1 87  ? 2.649   31.776  -0.342  1.000 16.230 0 86  ASN B HD22 1 c 
ATOM   3519 N  N    . VAL B 1 88  ? 0.594   26.665  -1.231  1.000 15.357 0 87  VAL B N    1 ? 
ATOM   3520 C  CA   . VAL B 1 88  ? 0.292   25.753  -2.381  1.000 14.089 0 87  VAL B CA   1 ? 
ATOM   3521 C  C    . VAL B 1 88  ? -0.833  26.406  -3.203  1.000 15.019 0 87  VAL B C    1 ? 
ATOM   3522 O  O    . VAL B 1 88  ? -1.560  27.245  -2.661  1.000 13.965 0 87  VAL B O    1 ? 
ATOM   3523 C  CB   . VAL B 1 88  ? -0.060  24.322  -1.937  1.000 14.596 0 87  VAL B CB   1 ? 
ATOM   3524 C  CG1  . VAL B 1 88  ? 1.106   23.640  -1.234  1.000 14.281 0 87  VAL B CG1  1 ? 
ATOM   3525 C  CG2  . VAL B 1 88  ? -1.302  24.261  -1.073  1.000 15.088 0 87  VAL B CG2  1 ? 
ATOM   3526 H  H    . VAL B 1 88  ? -0.087  26.742  -0.632  1.000 14.739 0 87  VAL B H    1 c 
ATOM   3527 H  HA   . VAL B 1 88  ? 1.085   25.706  -2.945  1.000 14.607 0 87  VAL B HA   1 c 
ATOM   3528 H  HB   . VAL B 1 88  ? -0.249  23.805  -2.758  1.000 14.530 0 87  VAL B HB   1 c 
ATOM   3529 H  HG11 . VAL B 1 88  ? 1.873   23.610  -1.832  1.000 14.379 0 87  VAL B HG11 1 c 
ATOM   3530 H  HG12 . VAL B 1 88  ? 0.852   22.734  -0.987  1.000 14.379 0 87  VAL B HG12 1 c 
ATOM   3531 H  HG13 . VAL B 1 88  ? 1.340   24.140  -0.433  1.000 14.380 0 87  VAL B HG13 1 c 
ATOM   3532 H  HG21 . VAL B 1 88  ? -1.176  24.812  -0.281  1.000 14.936 0 87  VAL B HG21 1 c 
ATOM   3533 H  HG22 . VAL B 1 88  ? -1.462  23.340  -0.802  1.000 14.935 0 87  VAL B HG22 1 c 
ATOM   3534 H  HG23 . VAL B 1 88  ? -2.067  24.586  -1.576  1.000 14.936 0 87  VAL B HG23 1 c 
ATOM   3535 N  N    . THR B 1 89  ? -0.924  26.069  -4.488  1.000 14.464 0 88  THR B N    1 ? 
ATOM   3536 C  CA   . THR B 1 89  ? -1.875  26.706  -5.444  1.000 13.432 0 88  THR B CA   1 ? 
ATOM   3537 C  C    . THR B 1 89  ? -2.901  25.674  -5.954  1.000 13.666 0 88  THR B C    1 ? 
ATOM   3538 O  O    . THR B 1 89  ? -2.484  24.637  -6.515  1.000 12.591 0 88  THR B O    1 ? 
ATOM   3539 C  CB   . THR B 1 89  ? -1.115  27.360  -6.604  1.000 14.687 0 88  THR B CB   1 ? 
ATOM   3540 O  OG1  . THR B 1 89  ? -0.237  28.356  -6.071  1.000 14.879 0 88  THR B OG1  1 ? 
ATOM   3541 C  CG2  . THR B 1 89  ? -2.044  27.977  -7.632  1.000 13.682 0 88  THR B CG2  1 ? 
ATOM   3542 H  H    . THR B 1 89  ? -0.418  25.413  -4.875  1.000 14.342 0 88  THR B H    1 c 
ATOM   3543 H  HA   . THR B 1 89  ? -2.364  27.415  -4.959  1.000 13.898 0 88  THR B HA   1 c 
ATOM   3544 H  HB   . THR B 1 89  ? -0.572  26.662  -7.047  1.000 14.282 0 88  THR B HB   1 c 
ATOM   3545 H  HG1  . THR B 1 89  ? 0.208   28.704  -6.686  0.000 14.950 0 88  THR B HG1  1 c 
ATOM   3546 H  HG21 . THR B 1 89  ? -2.605  27.272  -8.040  1.000 13.985 0 88  THR B HG21 1 c 
ATOM   3547 H  HG22 . THR B 1 89  ? -1.508  28.418  -8.336  1.000 13.986 0 88  THR B HG22 1 c 
ATOM   3548 H  HG23 . THR B 1 89  ? -2.625  28.647  -7.193  1.000 13.986 0 88  THR B HG23 1 c 
ATOM   3549 N  N    . ALA B 1 90  ? -4.195  25.937  -5.735  1.000 13.644 0 89  ALA B N    1 ? 
ATOM   3550 C  CA   . ALA B 1 90  ? -5.336  25.124  -6.240  1.000 14.694 0 89  ALA B CA   1 ? 
ATOM   3551 C  C    . ALA B 1 90  ? -5.779  25.665  -7.603  1.000 15.162 0 89  ALA B C    1 ? 
ATOM   3552 O  O    . ALA B 1 90  ? -5.806  26.888  -7.786  1.000 15.013 0 89  ALA B O    1 ? 
ATOM   3553 C  CB   . ALA B 1 90  ? -6.471  25.119  -5.236  1.000 15.188 0 89  ALA B CB   1 ? 
ATOM   3554 H  H    . ALA B 1 90  ? -4.476  26.655  -5.250  1.000 13.897 0 89  ALA B H    1 c 
ATOM   3555 H  HA   . ALA B 1 90  ? -5.024  24.199  -6.362  1.000 14.683 0 89  ALA B HA   1 c 
ATOM   3556 H  HB1  . ALA B 1 90  ? -7.201  24.574  -5.573  1.000 15.036 0 89  ALA B HB1  1 c 
ATOM   3557 H  HB2  . ALA B 1 90  ? -6.157  24.752  -4.392  1.000 15.036 0 89  ALA B HB2  1 c 
ATOM   3558 H  HB3  . ALA B 1 90  ? -6.784  26.028  -5.095  1.000 15.039 0 89  ALA B HB3  1 c 
ATOM   3559 N  N    . ASP B 1 91  ? -6.118  24.770  -8.528  1.000 17.288 0 90  ASP B N    1 ? 
ATOM   3560 C  CA   . ASP B 1 91  ? -6.539  25.166  -9.896  1.000 20.037 0 90  ASP B CA   1 ? 
ATOM   3561 C  C    . ASP B 1 91  ? -8.055  25.413  -9.912  1.000 19.613 0 90  ASP B C    1 ? 
ATOM   3562 O  O    . ASP B 1 91  ? -8.744  25.365  -8.840  1.000 18.815 0 90  ASP B O    1 ? 
ATOM   3563 C  CB   . ASP B 1 91  ? -6.065  24.147  -10.938 1.000 21.701 0 90  ASP B CB   1 ? 
ATOM   3564 C  CG   . ASP B 1 91  ? -6.710  22.767  -10.872 1.000 23.829 0 90  ASP B CG   1 ? 
ATOM   3565 O  OD1  . ASP B 1 91  ? -7.694  22.577  -10.089 1.000 25.298 0 90  ASP B OD1  1 ? 
ATOM   3566 O  OD2  . ASP B 1 91  ? -6.199  21.872  -11.574 1.000 25.159 0 90  ASP B OD2  1 ? 
ATOM   3567 H  H    . ASP B 1 91  ? -6.114  23.872  -8.377  1.000 17.362 0 90  ASP B H    1 c 
ATOM   3568 H  HA   . ASP B 1 91  ? -6.096  26.021  -10.108 1.000 19.678 0 90  ASP B HA   1 c 
ATOM   3569 H  HB2  . ASP B 1 91  ? -6.221  24.512  -11.832 1.000 21.760 0 90  ASP B HB2  1 c 
ATOM   3570 H  HB3  . ASP B 1 91  ? -5.101  24.026  -10.827 1.000 21.770 0 90  ASP B HB3  1 c 
ATOM   3571 N  N    . LYS B 1 92  ? -8.578  25.716  -11.100 1.000 18.410 0 91  LYS B N    1 ? 
ATOM   3572 C  CA   . LYS B 1 92  ? -10.020 25.932  -11.315 1.000 20.547 0 91  LYS B CA   1 ? 
ATOM   3573 C  C    . LYS B 1 92  ? -10.850 24.772  -10.754 1.000 20.031 0 91  LYS B C    1 ? 
ATOM   3574 O  O    . LYS B 1 92  ? -11.996 25.067  -10.332 1.000 18.682 0 91  LYS B O    1 ? 
ATOM   3575 C  CB   . LYS B 1 92  ? -10.270 26.123  -12.814 1.000 21.741 0 91  LYS B CB   1 ? 
ATOM   3576 C  CG   . LYS B 1 92  ? -11.679 26.541  -13.186 1.000 22.634 0 91  LYS B CG   1 ? 
ATOM   3577 C  CD   . LYS B 1 92  ? -12.114 27.839  -12.580 1.000 23.722 0 91  LYS B CD   1 ? 
ATOM   3578 C  CE   . LYS B 1 92  ? -13.382 28.331  -13.227 1.000 24.825 0 91  LYS B CE   1 ? 
ATOM   3579 N  NZ   . LYS B 1 92  ? -13.786 29.661  -12.722 1.000 26.121 0 91  LYS B NZ   1 ? 
ATOM   3580 H  H    . LYS B 1 92  ? -8.071  25.818  -11.850 1.000 19.204 0 91  LYS B H    1 c 
ATOM   3581 H  HA   . LYS B 1 92  ? -10.279 26.756  -10.844 1.000 20.241 0 91  LYS B HA   1 c 
ATOM   3582 H  HB2  . LYS B 1 92  ? -9.649  26.804  -13.146 1.000 21.654 0 91  LYS B HB2  1 c 
ATOM   3583 H  HB3  . LYS B 1 92  ? -10.062 25.284  -13.270 1.000 21.666 0 91  LYS B HB3  1 c 
ATOM   3584 H  HG2  . LYS B 1 92  ? -11.732 26.617  -14.161 1.000 22.678 0 91  LYS B HG2  1 c 
ATOM   3585 H  HG3  . LYS B 1 92  ? -12.302 25.836  -12.908 1.000 22.660 0 91  LYS B HG3  1 c 
ATOM   3586 H  HD2  . LYS B 1 92  ? -12.268 27.717  -11.619 1.000 23.702 0 91  LYS B HD2  1 c 
ATOM   3587 H  HD3  . LYS B 1 92  ? -11.407 28.509  -12.698 1.000 23.713 0 91  LYS B HD3  1 c 
ATOM   3588 H  HE2  . LYS B 1 92  ? -13.255 28.386  -14.194 1.000 24.854 0 91  LYS B HE2  1 c 
ATOM   3589 H  HE3  . LYS B 1 92  ? -14.102 27.697  -13.052 1.000 24.858 0 91  LYS B HE3  1 c 
ATOM   3590 H  HZ1  . LYS B 1 92  ? -13.994 29.604  -11.840 1.000 25.720 0 91  LYS B HZ1  1 c 
ATOM   3591 H  HZ2  . LYS B 1 92  ? -14.512 29.956  -13.179 1.000 25.720 0 91  LYS B HZ2  1 c 
ATOM   3592 H  HZ3  . LYS B 1 92  ? -13.106 30.251  -12.830 1.000 25.720 0 91  LYS B HZ3  1 c 
ATOM   3593 N  N    . ASP B 1 93  ? -10.351 23.517  -10.782 1.000 21.687 0 92  ASP B N    1 ? 
ATOM   3594 C  CA   . ASP B 1 93  ? -11.124 22.339  -10.279 1.000 22.575 0 92  ASP B CA   1 ? 
ATOM   3595 C  C    . ASP B 1 93  ? -10.974 22.209  -8.755  1.000 21.048 0 92  ASP B C    1 ? 
ATOM   3596 O  O    . ASP B 1 93  ? -11.602 21.308  -8.200  1.000 18.995 0 92  ASP B O    1 ? 
ATOM   3597 C  CB   . ASP B 1 93  ? -10.717 20.950  -10.797 1.000 25.143 0 92  ASP B CB   1 ? 
ATOM   3598 C  CG   . ASP B 1 93  ? -9.726  20.842  -11.937 1.000 30.383 0 92  ASP B CG   1 ? 
ATOM   3599 O  OD1  . ASP B 1 93  ? -10.086 21.227  -13.055 1.000 33.519 0 92  ASP B OD1  1 ? 
ATOM   3600 O  OD2  . ASP B 1 93  ? -8.620  20.281  -11.702 1.000 38.245 0 92  ASP B OD2  1 ? 
ATOM   3601 H  H    . ASP B 1 93  ? -9.526  23.317  -11.107 1.000 21.499 0 92  ASP B H    1 c 
ATOM   3602 H  HA   . ASP B 1 93  ? -12.077 22.481  -10.490 1.000 22.570 0 92  ASP B HA   1 c 
ATOM   3603 H  HB2  . ASP B 1 93  ? -10.342 20.439  -10.051 1.000 25.630 0 92  ASP B HB2  1 c 
ATOM   3604 H  HB3  . ASP B 1 93  ? -11.533 20.492  -11.084 1.000 25.635 0 92  ASP B HB3  1 c 
ATOM   3605 N  N    . GLY B 1 94  ? -10.180 23.068  -8.113  1.000 21.041 0 93  GLY B N    1 ? 
ATOM   3606 C  CA   . GLY B 1 94  ? -10.021 23.092  -6.643  1.000 19.989 0 93  GLY B CA   1 ? 
ATOM   3607 C  C    . GLY B 1 94  ? -8.998  22.075  -6.174  1.000 20.411 0 93  GLY B C    1 ? 
ATOM   3608 O  O    . GLY B 1 94  ? -9.071  21.662  -4.992  1.000 19.823 0 93  GLY B O    1 ? 
ATOM   3609 H  H    . GLY B 1 94  ? -9.676  23.684  -8.547  1.000 20.789 0 93  GLY B H    1 c 
ATOM   3610 H  HA2  . GLY B 1 94  ? -9.732  23.997  -6.369  1.000 20.328 0 93  GLY B HA2  1 c 
ATOM   3611 H  HA3  . GLY B 1 94  ? -10.895 22.901  -6.220  1.000 20.327 0 93  GLY B HA3  1 c 
ATOM   3612 N  N    . VAL B 1 95  ? -8.091  21.681  -7.068  1.000 18.104 0 94  VAL B N    1 ? 
ATOM   3613 C  CA   . VAL B 1 95  ? -7.016  20.674  -6.813  1.000 18.311 0 94  VAL B CA   1 ? 
ATOM   3614 C  C    . VAL B 1 95  ? -5.660  21.393  -6.780  1.000 19.362 0 94  VAL B C    1 ? 
ATOM   3615 O  O    . VAL B 1 95  ? -5.326  22.092  -7.780  1.000 17.773 0 94  VAL B O    1 ? 
ATOM   3616 C  CB   . VAL B 1 95  ? -7.030  19.579  -7.894  1.000 19.222 0 94  VAL B CB   1 ? 
ATOM   3617 C  CG1  . VAL B 1 95  ? -5.837  18.641  -7.771  1.000 19.766 0 94  VAL B CG1  1 ? 
ATOM   3618 C  CG2  . VAL B 1 95  ? -8.365  18.828  -7.859  1.000 18.648 0 94  VAL B CG2  1 ? 
ATOM   3619 H  H    . VAL B 1 95  ? -8.064  22.018  -7.913  1.000 18.682 0 94  VAL B H    1 c 
ATOM   3620 H  HA   . VAL B 1 95  ? -7.175  20.261  -5.949  1.000 18.636 0 94  VAL B HA   1 c 
ATOM   3621 H  HB   . VAL B 1 95  ? -6.965  20.032  -8.771  1.000 19.037 0 94  VAL B HB   1 c 
ATOM   3622 H  HG11 . VAL B 1 95  ? -5.024  19.109  -8.031  1.000 19.596 0 94  VAL B HG11 1 c 
ATOM   3623 H  HG12 . VAL B 1 95  ? -5.968  17.873  -8.355  1.000 19.596 0 94  VAL B HG12 1 c 
ATOM   3624 H  HG13 . VAL B 1 95  ? -5.756  18.337  -6.850  1.000 19.597 0 94  VAL B HG13 1 c 
ATOM   3625 H  HG21 . VAL B 1 95  ? -8.507  18.460  -6.969  1.000 18.823 0 94  VAL B HG21 1 c 
ATOM   3626 H  HG22 . VAL B 1 95  ? -8.347  18.104  -8.509  1.000 18.824 0 94  VAL B HG22 1 c 
ATOM   3627 H  HG23 . VAL B 1 95  ? -9.089  19.439  -8.076  1.000 18.822 0 94  VAL B HG23 1 c 
ATOM   3628 N  N    . ALA B 1 96  ? -4.875  21.179  -5.717  1.000 17.085 0 95  ALA B N    1 ? 
ATOM   3629 C  CA   . ALA B 1 96  ? -3.478  21.662  -5.612  1.000 17.078 0 95  ALA B CA   1 ? 
ATOM   3630 C  C    . ALA B 1 96  ? -2.536  20.473  -5.803  1.000 18.843 0 95  ALA B C    1 ? 
ATOM   3631 O  O    . ALA B 1 96  ? -2.735  19.430  -5.131  1.000 18.021 0 95  ALA B O    1 ? 
ATOM   3632 C  CB   . ALA B 1 96  ? -3.242  22.361  -4.279  1.000 17.374 0 95  ALA B CB   1 ? 
ATOM   3633 H  H    . ALA B 1 96  ? -5.142  20.720  -4.976  1.000 17.598 0 95  ALA B H    1 c 
ATOM   3634 H  HA   . ALA B 1 96  ? -3.316  22.306  -6.339  1.000 17.466 0 95  ALA B HA   1 c 
ATOM   3635 H  HB1  . ALA B 1 96  ? -2.319  22.662  -4.229  1.000 17.284 0 95  ALA B HB1  1 c 
ATOM   3636 H  HB2  . ALA B 1 96  ? -3.836  23.127  -4.204  1.000 17.284 0 95  ALA B HB2  1 c 
ATOM   3637 H  HB3  . ALA B 1 96  ? -3.420  21.742  -3.551  1.000 17.284 0 95  ALA B HB3  1 c 
ATOM   3638 N  N    . ASP B 1 97  ? -1.581  20.588  -6.727  1.000 20.456 0 96  ASP B N    1 ? 
ATOM   3639 C  CA   . ASP B 1 97  ? -0.517  19.569  -6.941  1.000 23.288 0 96  ASP B CA   1 ? 
ATOM   3640 C  C    . ASP B 1 97  ? 0.735   20.055  -6.208  1.000 21.857 0 96  ASP B C    1 ? 
ATOM   3641 O  O    . ASP B 1 97  ? 1.249   21.114  -6.586  1.000 23.818 0 96  ASP B O    1 ? 
ATOM   3642 C  CB   . ASP B 1 97  ? -0.283  19.327  -8.435  1.000 24.604 0 96  ASP B CB   1 ? 
ATOM   3643 C  CG   . ASP B 1 97  ? -1.140  18.209  -9.023  1.000 28.514 0 96  ASP B CG   1 ? 
ATOM   3644 O  OD1  . ASP B 1 97  ? -1.123  18.071  -10.265 1.000 32.486 0 96  ASP B OD1  1 ? 
ATOM   3645 O  OD2  . ASP B 1 97  ? -1.815  17.470  -8.240  1.000 30.376 0 96  ASP B OD2  1 ? 
ATOM   3646 H  H    . ASP B 1 97  ? -1.520  21.307  -7.284  1.000 20.685 0 96  ASP B H    1 c 
ATOM   3647 H  HA   . ASP B 1 97  ? -0.809  18.723  -6.530  1.000 22.680 0 96  ASP B HA   1 c 
ATOM   3648 H  HB2  . ASP B 1 97  ? -0.472  20.151  -8.928  1.000 25.139 0 96  ASP B HB2  1 c 
ATOM   3649 H  HB3  . ASP B 1 97  ? 0.657   19.097  -8.576  1.000 25.158 0 96  ASP B HB3  1 c 
ATOM   3650 N  N    . VAL B 1 98  ? 1.148   19.372  -5.138  1.000 20.279 0 97  VAL B N    1 ? 
ATOM   3651 C  CA   . VAL B 1 98  ? 2.214   19.869  -4.209  1.000 19.852 0 97  VAL B CA   1 ? 
ATOM   3652 C  C    . VAL B 1 98  ? 3.554   19.265  -4.610  1.000 19.559 0 97  VAL B C    1 ? 
ATOM   3653 O  O    . VAL B 1 98  ? 3.612   18.044  -4.818  1.000 18.413 0 97  VAL B O    1 ? 
ATOM   3654 C  CB   . VAL B 1 98  ? 1.888   19.559  -2.740  1.000 19.104 0 97  VAL B CB   1 ? 
ATOM   3655 C  CG1  . VAL B 1 98  ? 2.899   20.202  -1.785  1.000 18.865 0 97  VAL B CG1  1 ? 
ATOM   3656 C  CG2  . VAL B 1 98  ? 0.482   20.010  -2.410  1.000 19.697 0 97  VAL B CG2  1 ? 
ATOM   3657 H  H    . VAL B 1 98  ? 0.807   18.560  -4.906  1.000 20.541 0 97  VAL B H    1 c 
ATOM   3658 H  HA   . VAL B 1 98  ? 2.273   20.836  -4.307  1.000 19.745 0 97  VAL B HA   1 c 
ATOM   3659 H  HB   . VAL B 1 98  ? 1.932   18.578  -2.621  1.000 19.309 0 97  VAL B HB   1 c 
ATOM   3660 H  HG11 . VAL B 1 98  ? 3.775   19.798  -1.915  1.000 18.938 0 97  VAL B HG11 1 c 
ATOM   3661 H  HG12 . VAL B 1 98  ? 2.612   20.062  -0.866  1.000 18.938 0 97  VAL B HG12 1 c 
ATOM   3662 H  HG13 . VAL B 1 98  ? 2.953   21.157  -1.965  1.000 18.937 0 97  VAL B HG13 1 c 
ATOM   3663 H  HG21 . VAL B 1 98  ? 0.372   20.944  -2.663  1.000 19.511 0 97  VAL B HG21 1 c 
ATOM   3664 H  HG22 . VAL B 1 98  ? 0.325   19.913  -1.455  1.000 19.511 0 97  VAL B HG22 1 c 
ATOM   3665 H  HG23 . VAL B 1 98  ? -0.159  19.465  -2.899  1.000 19.514 0 97  VAL B HG23 1 c 
ATOM   3666 N  N    . SER B 1 99  ? 4.575   20.120  -4.754  1.000 20.500 0 98  SER B N    1 ? 
ATOM   3667 C  CA   . SER B 1 99  ? 5.974   19.751  -5.110  1.000 19.864 0 98  SER B CA   1 ? 
ATOM   3668 C  C    . SER B 1 99  ? 6.912   20.772  -4.469  1.000 20.890 0 98  SER B C    1 ? 
ATOM   3669 O  O    . SER B 1 99  ? 6.997   21.915  -5.018  1.000 19.113 0 98  SER B O    1 ? 
ATOM   3670 C  CB   . SER B 1 99  ? 6.158   19.694  -6.614  1.000 19.819 0 98  SER B CB   1 ? 
ATOM   3671 O  OG   . SER B 1 99  ? 7.416   19.104  -6.954  1.000 20.071 0 98  SER B OG   1 ? 
ATOM   3672 H  H    . SER B 1 99  ? 4.479   21.022  -4.644  1.000 20.126 0 98  SER B H    1 c 
ATOM   3673 H  HA   . SER B 1 99  ? 6.169   18.859  -4.730  1.000 20.165 0 98  SER B HA   1 c 
ATOM   3674 H  HB2  . SER B 1 99  ? 5.426   19.162  -7.012  1.000 19.892 0 98  SER B HB2  1 c 
ATOM   3675 H  HB3  . SER B 1 99  ? 6.110   20.609  -6.987  1.000 19.891 0 98  SER B HB3  1 c 
ATOM   3676 H  HG   . SER B 1 99  ? 7.429   19.150  -7.841  0.000 20.850 0 98  SER B HG   1 c 
ATOM   3677 N  N    . ILE B 1 100 ? 7.536   20.419  -3.334  1.000 20.213 0 99  ILE B N    1 ? 
ATOM   3678 C  CA   . ILE B 1 100 ? 8.355   21.342  -2.487  1.000 19.543 0 99  ILE B CA   1 ? 
ATOM   3679 C  C    . ILE B 1 100 ? 9.687   20.640  -2.168  1.000 20.745 0 99  ILE B C    1 ? 
ATOM   3680 O  O    . ILE B 1 100 ? 9.666   19.412  -1.959  1.000 19.634 0 99  ILE B O    1 ? 
ATOM   3681 C  CB   . ILE B 1 100 ? 7.564   21.755  -1.214  1.000 19.779 0 99  ILE B CB   1 ? 
ATOM   3682 C  CG1  . ILE B 1 100 ? 6.411   22.714  -1.540  1.000 19.446 0 99  ILE B CG1  1 ? 
ATOM   3683 C  CG2  . ILE B 1 100 ? 8.475   22.324  -0.131  1.000 21.259 0 99  ILE B CG2  1 ? 
ATOM   3684 C  CD1  . ILE B 1 100 ? 5.467   22.968  -0.398  1.000 18.804 0 99  ILE B CD1  1 ? 
ATOM   3685 H  H    . ILE B 1 100 ? 7.495   19.572  -3.000  1.000 20.211 0 99  ILE B H    1 c 
ATOM   3686 H  HA   . ILE B 1 100 ? 8.545   22.146  -3.002  1.000 19.944 0 99  ILE B HA   1 c 
ATOM   3687 H  HB   . ILE B 1 100 ? 7.157   20.933  -0.850  1.000 19.938 0 99  ILE B HB   1 c 
ATOM   3688 H  HG12 . ILE B 1 100 ? 6.791   23.571  -1.829  1.000 19.371 0 99  ILE B HG12 1 c 
ATOM   3689 H  HG13 . ILE B 1 100 ? 5.900   22.345  -2.291  1.000 19.374 0 99  ILE B HG13 1 c 
ATOM   3690 H  HG21 . ILE B 1 100 ? 9.094   21.637  0.170   1.000 20.788 0 99  ILE B HG21 1 c 
ATOM   3691 H  HG22 . ILE B 1 100 ? 7.940   22.624  0.623   1.000 20.781 0 99  ILE B HG22 1 c 
ATOM   3692 H  HG23 . ILE B 1 100 ? 8.977   23.076  -0.490  1.000 20.788 0 99  ILE B HG23 1 c 
ATOM   3693 H  HD11 . ILE B 1 100 ? 5.173   22.119  -0.023  1.000 18.995 0 99  ILE B HD11 1 c 
ATOM   3694 H  HD12 . ILE B 1 100 ? 4.694   23.464  -0.720  1.000 19.000 0 99  ILE B HD12 1 c 
ATOM   3695 H  HD13 . ILE B 1 100 ? 5.918   23.487  0.291   1.000 19.006 0 99  ILE B HD13 1 c 
ATOM   3696 N  N    . GLU B 1 101 ? 10.803  21.378  -2.169  1.000 22.217 0 100 GLU B N    1 ? 
ATOM   3697 C  CA   . GLU B 1 101 ? 12.087  20.938  -1.544  1.000 23.963 0 100 GLU B CA   1 ? 
ATOM   3698 C  C    . GLU B 1 101 ? 12.481  21.955  -0.472  1.000 21.969 0 100 GLU B C    1 ? 
ATOM   3699 O  O    . GLU B 1 101 ? 12.502  23.156  -0.777  1.000 18.680 0 100 GLU B O    1 ? 
ATOM   3700 C  CB   . GLU B 1 101 ? 13.181  20.715  -2.583  1.000 27.233 0 100 GLU B CB   1 ? 
ATOM   3701 C  CG   . GLU B 1 101 ? 13.295  19.267  -2.991  1.000 31.306 0 100 GLU B CG   1 ? 
ATOM   3702 C  CD   . GLU B 1 101 ? 14.492  18.908  -3.855  1.000 36.418 0 100 GLU B CD   1 ? 
ATOM   3703 O  OE1  . GLU B 1 101 ? 15.639  19.239  -3.464  1.000 35.079 0 100 GLU B OE1  1 ? 
ATOM   3704 O  OE2  . GLU B 1 101 ? 14.268  18.285  -4.923  1.000 40.933 0 100 GLU B OE2  1 ? 
ATOM   3705 H  H    . GLU B 1 101 ? 10.846  22.201  -2.556  1.000 22.247 0 100 GLU B H    1 c 
ATOM   3706 H  HA   . GLU B 1 101 ? 11.919  20.079  -1.093  1.000 23.781 0 100 GLU B HA   1 c 
ATOM   3707 H  HB2  . GLU B 1 101 ? 12.983  21.259  -3.374  1.000 27.295 0 100 GLU B HB2  1 c 
ATOM   3708 H  HB3  . GLU B 1 101 ? 14.038  21.015  -2.213  1.000 27.305 0 100 GLU B HB3  1 c 
ATOM   3709 H  HG2  . GLU B 1 101 ? 13.333  18.718  -2.179  1.000 31.370 0 100 GLU B HG2  1 c 
ATOM   3710 H  HG3  . GLU B 1 101 ? 12.480  19.013  -3.475  1.000 31.408 0 100 GLU B HG3  1 c 
ATOM   3711 N  N    . ASP B 1 102 ? 12.719  21.501  0.765   1.000 18.223 0 101 ASP B N    1 ? 
ATOM   3712 C  CA   . ASP B 1 102 ? 13.001  22.416  1.901   1.000 18.774 0 101 ASP B CA   1 ? 
ATOM   3713 C  C    . ASP B 1 102 ? 14.249  21.902  2.620   1.000 18.784 0 101 ASP B C    1 ? 
ATOM   3714 O  O    . ASP B 1 102 ? 14.366  20.674  2.783   1.000 18.968 0 101 ASP B O    1 ? 
ATOM   3715 C  CB   . ASP B 1 102 ? 11.785  22.554  2.829   1.000 18.219 0 101 ASP B CB   1 ? 
ATOM   3716 C  CG   . ASP B 1 102 ? 11.898  23.753  3.749   1.000 20.603 0 101 ASP B CG   1 ? 
ATOM   3717 O  OD1  . ASP B 1 102 ? 11.744  24.909  3.236   1.000 19.775 0 101 ASP B OD1  1 ? 
ATOM   3718 O  OD2  . ASP B 1 102 ? 12.184  23.535  4.951   1.000 20.057 0 101 ASP B OD2  1 ? 
ATOM   3719 H  H    . ASP B 1 102 ? 12.721  20.616  0.981   1.000 19.190 0 101 ASP B H    1 c 
ATOM   3720 H  HA   . ASP B 1 102 ? 13.203  23.308  1.534   1.000 18.579 0 101 ASP B HA   1 c 
ATOM   3721 H  HB2  . ASP B 1 102 ? 10.975  22.651  2.288   1.000 18.887 0 101 ASP B HB2  1 c 
ATOM   3722 H  HB3  . ASP B 1 102 ? 11.698  21.744  3.369   1.000 18.883 0 101 ASP B HB3  1 c 
ATOM   3723 N  N    . SER B 1 103 ? 15.130  22.819  3.031   1.000 19.757 0 102 SER B N    1 ? 
ATOM   3724 C  CA   . SER B 1 103 ? 16.454  22.515  3.639   1.000 20.346 0 102 SER B CA   1 ? 
ATOM   3725 C  C    . SER B 1 103 ? 16.389  22.732  5.151   1.000 20.455 0 102 SER B C    1 ? 
ATOM   3726 O  O    . SER B 1 103 ? 17.399  22.450  5.830   1.000 20.017 0 102 SER B O    1 ? 
ATOM   3727 C  CB   . SER B 1 103 ? 17.544  23.355  3.007   1.000 23.028 0 102 SER B CB   1 ? 
ATOM   3728 O  OG   . SER B 1 103 ? 17.881  22.871  1.702   1.000 24.167 0 102 SER B OG   1 ? 
ATOM   3729 H  H    . SER B 1 103 ? 14.979  23.718  2.965   1.000 19.665 0 102 SER B H    1 c 
ATOM   3730 H  HA   . SER B 1 103 ? 16.659  21.561  3.472   1.000 20.728 0 102 SER B HA   1 c 
ATOM   3731 H  HB2  . SER B 1 103 ? 17.237  24.293  2.941   1.000 22.609 0 102 SER B HB2  1 c 
ATOM   3732 H  HB3  . SER B 1 103 ? 18.349  23.336  3.581   1.000 22.607 0 102 SER B HB3  1 c 
ATOM   3733 H  HG   . SER B 1 103 ? 18.509  23.338  1.392   0.000 23.030 0 102 SER B HG   1 c 
ATOM   3734 N  N    . VAL B 1 104 ? 15.253  23.207  5.671   1.000 18.137 0 103 VAL B N    1 ? 
ATOM   3735 C  CA   . VAL B 1 104 ? 15.155  23.635  7.100   1.000 17.903 0 103 VAL B CA   1 ? 
ATOM   3736 C  C    . VAL B 1 104 ? 14.384  22.578  7.888   1.000 17.995 0 103 VAL B C    1 ? 
ATOM   3737 O  O    . VAL B 1 104 ? 14.829  22.243  9.000   1.000 17.572 0 103 VAL B O    1 ? 
ATOM   3738 C  CB   . VAL B 1 104 ? 14.497  25.019  7.235   1.000 17.577 0 103 VAL B CB   1 ? 
ATOM   3739 C  CG1  . VAL B 1 104 ? 14.213  25.386  8.687   1.000 17.887 0 103 VAL B CG1  1 ? 
ATOM   3740 C  CG2  . VAL B 1 104 ? 15.327  26.086  6.556   1.000 18.159 0 103 VAL B CG2  1 ? 
ATOM   3741 H  H    . VAL B 1 104 ? 14.480  23.298  5.201   1.000 18.601 0 103 VAL B H    1 c 
ATOM   3742 H  HA   . VAL B 1 104 ? 16.056  23.690  7.466   1.000 17.911 0 103 VAL B HA   1 c 
ATOM   3743 H  HB   . VAL B 1 104 ? 13.629  24.974  6.764   1.000 17.810 0 103 VAL B HB   1 c 
ATOM   3744 H  HG11 . VAL B 1 104 ? 13.510  24.813  9.037   1.000 17.782 0 103 VAL B HG11 1 c 
ATOM   3745 H  HG12 . VAL B 1 104 ? 13.926  26.315  8.736   1.000 17.792 0 103 VAL B HG12 1 c 
ATOM   3746 H  HG13 . VAL B 1 104 ? 15.021  25.269  9.216   1.000 17.791 0 103 VAL B HG13 1 c 
ATOM   3747 H  HG21 . VAL B 1 104 ? 16.217  26.106  6.950   1.000 17.982 0 103 VAL B HG21 1 c 
ATOM   3748 H  HG22 . VAL B 1 104 ? 14.902  26.953  6.673   1.000 17.982 0 103 VAL B HG22 1 c 
ATOM   3749 H  HG23 . VAL B 1 104 ? 15.399  25.888  5.606   1.000 17.982 0 103 VAL B HG23 1 c 
ATOM   3750 N  N    . ILE B 1 105 ? 13.274  22.083  7.345   1.000 17.197 0 104 ILE B N    1 ? 
ATOM   3751 C  CA   . ILE B 1 105 ? 12.573  20.922  7.965   1.000 17.040 0 104 ILE B CA   1 ? 
ATOM   3752 C  C    . ILE B 1 105 ? 13.499  19.706  7.872   1.000 16.789 0 104 ILE B C    1 ? 
ATOM   3753 O  O    . ILE B 1 105 ? 14.375  19.647  6.936   1.000 17.345 0 104 ILE B O    1 ? 
ATOM   3754 C  CB   . ILE B 1 105 ? 11.183  20.664  7.341   1.000 17.446 0 104 ILE B CB   1 ? 
ATOM   3755 C  CG1  . ILE B 1 105 ? 11.292  20.335  5.853   1.000 17.468 0 104 ILE B CG1  1 ? 
ATOM   3756 C  CG2  . ILE B 1 105 ? 10.245  21.848  7.606   1.000 16.656 0 104 ILE B CG2  1 ? 
ATOM   3757 C  CD1  . ILE B 1 105 ? 10.017  19.779  5.262   1.000 16.650 0 104 ILE B CD1  1 ? 
ATOM   3758 H  H    . ILE B 1 105 ? 12.878  22.421  6.599   1.000 17.348 0 104 ILE B H    1 c 
ATOM   3759 H  HA   . ILE B 1 105 ? 12.439  21.125  8.909   1.000 17.098 0 104 ILE B HA   1 c 
ATOM   3760 H  HB   . ILE B 1 105 ? 10.799  19.872  7.792   1.000 17.219 0 104 ILE B HB   1 c 
ATOM   3761 H  HG12 . ILE B 1 105 ? 11.534  21.149  5.368   1.000 17.276 0 104 ILE B HG12 1 c 
ATOM   3762 H  HG13 . ILE B 1 105 ? 12.010  19.680  5.722   1.000 17.267 0 104 ILE B HG13 1 c 
ATOM   3763 H  HG21 . ILE B 1 105 ? 10.215  22.032  8.561   1.000 16.894 0 104 ILE B HG21 1 c 
ATOM   3764 H  HG22 . ILE B 1 105 ? 9.350   21.632  7.293   1.000 16.894 0 104 ILE B HG22 1 c 
ATOM   3765 H  HG23 . ILE B 1 105 ? 10.571  22.635  7.136   1.000 16.895 0 104 ILE B HG23 1 c 
ATOM   3766 H  HD11 . ILE B 1 105 ? 9.728   19.007  5.779   1.000 16.896 0 104 ILE B HD11 1 c 
ATOM   3767 H  HD12 . ILE B 1 105 ? 10.177  19.508  4.341   1.000 16.896 0 104 ILE B HD12 1 c 
ATOM   3768 H  HD13 . ILE B 1 105 ? 9.324   20.460  5.282   1.000 16.896 0 104 ILE B HD13 1 c 
ATOM   3769 N  N    . SER B 1 106 ? 13.297  18.756  8.781   1.000 15.510 0 105 SER B N    1 ? 
ATOM   3770 C  CA   . SER B 1 106 ? 14.007  17.450  8.801   1.000 15.755 0 105 SER B CA   1 ? 
ATOM   3771 C  C    . SER B 1 106 ? 13.062  16.354  9.311   1.000 16.740 0 105 SER B C    1 ? 
ATOM   3772 O  O    . SER B 1 106 ? 12.056  16.691  10.038  1.000 16.949 0 105 SER B O    1 ? 
ATOM   3773 C  CB   . SER B 1 106 ? 15.280  17.525  9.605   1.000 15.204 0 105 SER B CB   1 ? 
ATOM   3774 O  OG   . SER B 1 106 ? 16.032  16.331  9.462   1.000 15.238 0 105 SER B OG   1 ? 
ATOM   3775 H  H    . SER B 1 106 ? 12.705  18.841  9.473   1.000 15.869 0 105 SER B H    1 c 
ATOM   3776 H  HA   . SER B 1 106 ? 14.249  17.227  7.868   1.000 15.792 0 105 SER B HA   1 c 
ATOM   3777 H  HB2  . SER B 1 106 ? 15.820  18.294  9.297   1.000 15.344 0 105 SER B HB2  1 c 
ATOM   3778 H  HB3  . SER B 1 106 ? 15.059  17.664  10.559  1.000 15.357 0 105 SER B HB3  1 c 
ATOM   3779 H  HG   . SER B 1 106 ? 16.743  16.372  9.893   0.000 14.990 0 105 SER B HG   1 c 
ATOM   3780 N  N    . LEU B 1 107 ? 13.376  15.106  8.950   1.000 17.335 0 106 LEU B N    1 ? 
ATOM   3781 C  CA   . LEU B 1 107 ? 12.684  13.896  9.450   1.000 18.738 0 106 LEU B CA   1 ? 
ATOM   3782 C  C    . LEU B 1 107 ? 13.494  13.248  10.586  1.000 19.810 0 106 LEU B C    1 ? 
ATOM   3783 O  O    . LEU B 1 107 ? 12.997  12.246  11.112  1.000 18.702 0 106 LEU B O    1 ? 
ATOM   3784 C  CB   . LEU B 1 107 ? 12.446  12.920  8.291   1.000 19.165 0 106 LEU B CB   1 ? 
ATOM   3785 C  CG   . LEU B 1 107 ? 11.659  13.485  7.106   1.000 19.428 0 106 LEU B CG   1 ? 
ATOM   3786 C  CD1  . LEU B 1 107 ? 11.432  12.410  6.053   1.000 18.682 0 106 LEU B CD1  1 ? 
ATOM   3787 C  CD2  . LEU B 1 107 ? 10.321  14.078  7.539   1.000 19.125 0 106 LEU B CD2  1 ? 
ATOM   3788 H  H    . LEU B 1 107 ? 14.050  14.923  8.364   1.000 17.508 0 106 LEU B H    1 c 
ATOM   3789 H  HA   . LEU B 1 107 ? 11.814  14.173  9.818   1.000 18.734 0 106 LEU B HA   1 c 
ATOM   3790 H  HB2  . LEU B 1 107 ? 13.314  12.610  7.966   1.000 19.126 0 106 LEU B HB2  1 c 
ATOM   3791 H  HB3  . LEU B 1 107 ? 11.966  12.142  8.638   1.000 19.126 0 106 LEU B HB3  1 c 
ATOM   3792 H  HG   . LEU B 1 107 ? 12.196  14.207  6.696   1.000 19.175 0 106 LEU B HG   1 c 
ATOM   3793 H  HD11 . LEU B 1 107 ? 12.291  12.075  5.742   1.000 18.914 0 106 LEU B HD11 1 c 
ATOM   3794 H  HD12 . LEU B 1 107 ? 10.941  12.789  5.303   1.000 18.914 0 106 LEU B HD12 1 c 
ATOM   3795 H  HD13 . LEU B 1 107 ? 10.920  11.679  6.440   1.000 18.914 0 106 LEU B HD13 1 c 
ATOM   3796 H  HD21 . LEU B 1 107 ? 9.829   13.423  8.064   1.000 19.215 0 106 LEU B HD21 1 c 
ATOM   3797 H  HD22 . LEU B 1 107 ? 9.802   14.316  6.750   1.000 19.220 0 106 LEU B HD22 1 c 
ATOM   3798 H  HD23 . LEU B 1 107 ? 10.475  14.875  8.076   1.000 19.218 0 106 LEU B HD23 1 c 
ATOM   3799 N  N    . SER B 1 108 ? 14.639  13.824  11.002  1.000 21.609 0 107 SER B N    1 ? 
ATOM   3800 C  CA   . SER B 1 108 ? 15.318  13.490  12.293  1.000 25.357 0 107 SER B CA   1 ? 
ATOM   3801 C  C    . SER B 1 108 ? 15.982  14.744  12.877  1.000 27.043 0 107 SER B C    1 ? 
ATOM   3802 O  O    . SER B 1 108 ? 16.026  15.748  12.179  1.000 26.185 0 107 SER B O    1 ? 
ATOM   3803 C  CB   . SER B 1 108 ? 16.297  12.336  12.186  1.000 26.265 0 107 SER B CB   1 ? 
ATOM   3804 O  OG   . SER B 1 108 ? 16.947  12.275  10.927  1.000 24.846 0 107 SER B OG   1 ? 
ATOM   3805 H  H    . SER B 1 108 ? 15.095  14.452  10.519  1.000 21.982 0 107 SER B H    1 c 
ATOM   3806 H  HA   . SER B 1 108 ? 14.611  13.216  12.928  1.000 25.040 0 107 SER B HA   1 c 
ATOM   3807 H  HB2  . SER B 1 108 ? 16.979  12.423  12.897  1.000 25.718 0 107 SER B HB2  1 c 
ATOM   3808 H  HB3  . SER B 1 108 ? 15.811  11.489  12.339  1.000 25.711 0 107 SER B HB3  1 c 
ATOM   3809 H  HG   . SER B 1 108 ? 17.505  11.658  10.932  0.000 25.010 0 107 SER B HG   1 c 
ATOM   3810 N  N    . GLY B 1 109 ? 16.422  14.696  14.141  1.000 29.292 0 108 GLY B N    1 ? 
ATOM   3811 C  CA   . GLY B 1 109 ? 17.246  15.761  14.760  1.000 30.803 0 108 GLY B CA   1 ? 
ATOM   3812 C  C    . GLY B 1 109 ? 16.416  16.895  15.343  1.000 32.844 0 108 GLY B C    1 ? 
ATOM   3813 O  O    . GLY B 1 109 ? 15.233  16.673  15.623  1.000 35.952 0 108 GLY B O    1 ? 
ATOM   3814 H  H    . GLY B 1 109 ? 16.234  13.997  14.694  1.000 29.089 0 108 GLY B H    1 c 
ATOM   3815 H  HA2  . GLY B 1 109 ? 17.796  15.360  15.479  1.000 30.903 0 108 GLY B HA2  1 c 
ATOM   3816 H  HA3  . GLY B 1 109 ? 17.862  16.127  14.077  1.000 30.896 0 108 GLY B HA3  1 c 
ATOM   3817 N  N    A ASP B 1 110 ? 17.020  18.077  15.522  1.000 34.577 0 109 ASP B N    1 ? 
ATOM   3818 C  CA   A ASP B 1 110 ? 16.435  19.241  16.260  1.000 38.018 0 109 ASP B CA   1 ? 
ATOM   3819 C  C    A ASP B 1 110 ? 15.245  19.849  15.485  1.000 32.913 0 109 ASP B C    1 ? 
ATOM   3820 O  O    A ASP B 1 110 ? 14.342  20.457  16.126  1.000 36.698 0 109 ASP B O    1 ? 
ATOM   3821 C  CB   A ASP B 1 110 ? 17.508  20.300  16.571  1.000 43.237 0 109 ASP B CB   1 ? 
ATOM   3822 C  CG   A ASP B 1 110 ? 18.652  20.396  15.562  1.000 50.044 0 109 ASP B CG   1 ? 
ATOM   3823 O  OD1  A ASP B 1 110 ? 19.300  19.344  15.290  1.000 50.415 0 109 ASP B OD1  1 ? 
ATOM   3824 O  OD2  A ASP B 1 110 ? 18.900  21.522  15.055  1.000 52.244 0 109 ASP B OD2  1 ? 
ATOM   3825 H  H    . ASP B 1 110 ? 17.850  18.239  15.190  1.000 34.967 0 109 ASP B H    1 c 
ATOM   3826 H  HA   . ASP B 1 110 ? 16.094  18.904  17.122  1.000 37.230 0 109 ASP B HA   1 c 
ATOM   3827 H  HB2  . ASP B 1 110 ? 17.079  21.178  16.628  1.000 43.400 0 109 ASP B HB2  1 c 
ATOM   3828 H  HB3  . ASP B 1 110 ? 17.900  20.098  17.445  1.000 43.405 0 109 ASP B HB3  1 c 
ATOM   3829 N  N    . HIS B 1 111 ? 15.223  19.698  14.163  1.000 26.212 0 110 HIS B N    1 ? 
ATOM   3830 C  CA   . HIS B 1 111 ? 14.175  20.285  13.277  1.000 23.830 0 110 HIS B CA   1 ? 
ATOM   3831 C  C    . HIS B 1 111 ? 13.160  19.219  12.849  1.000 19.710 0 110 HIS B C    1 ? 
ATOM   3832 O  O    . HIS B 1 111 ? 12.395  19.480  11.913  1.000 16.124 0 110 HIS B O    1 ? 
ATOM   3833 C  CB   . HIS B 1 111 ? 14.844  21.031  12.113  1.000 25.367 0 110 HIS B CB   1 ? 
ATOM   3834 C  CG   . HIS B 1 111 ? 15.631  22.202  12.604  1.000 27.554 0 110 HIS B CG   1 ? 
ATOM   3835 N  ND1  . HIS B 1 111 ? 15.556  22.622  13.926  1.000 29.754 0 110 HIS B ND1  1 ? 
ATOM   3836 C  CD2  . HIS B 1 111 ? 16.466  23.057  11.974  1.000 30.147 0 110 HIS B CD2  1 ? 
ATOM   3837 C  CE1  . HIS B 1 111 ? 16.342  23.669  14.096  1.000 30.959 0 110 HIS B CE1  1 ? 
ATOM   3838 N  NE2  . HIS B 1 111 ? 16.907  23.959  12.905  1.000 30.398 0 110 HIS B NE2  1 ? 
ATOM   3839 H  H    . HIS B 1 111 ? 15.851  19.231  13.698  1.000 27.017 0 110 HIS B H    1 c 
ATOM   3840 H  HA   . HIS B 1 111 ? 13.683  20.953  13.809  1.000 23.735 0 110 HIS B HA   1 c 
ATOM   3841 H  HB2  . HIS B 1 111 ? 15.440  20.417  11.630  1.000 25.468 0 110 HIS B HB2  1 c 
ATOM   3842 H  HB3  . HIS B 1 111 ? 14.154  21.344  11.487  1.000 25.456 0 110 HIS B HB3  1 c 
ATOM   3843 H  HD1  . HIS B 1 111 ? 15.051  22.261  14.571  0.000 28.670 0 110 HIS B HD1  1 c 
ATOM   3844 H  HD2  . HIS B 1 111 ? 16.714  23.032  11.069  1.000 29.549 0 110 HIS B HD2  1 c 
ATOM   3845 H  HE1  . HIS B 1 111 ? 16.470  24.139  14.902  1.000 30.431 0 110 HIS B HE1  1 c 
ATOM   3846 H  HE2  . HIS B 1 111 ? 17.515  24.604  12.826  0.000 28.890 0 110 HIS B HE2  1 c 
ATOM   3847 N  N    . CYS B 1 112 ? 13.083  18.092  13.561  1.000 18.138 0 111 CYS B N    1 ? 
ATOM   3848 C  CA   . CYS B 1 112 ? 12.192  16.973  13.177  1.000 17.700 0 111 CYS B CA   1 ? 
ATOM   3849 C  C    . CYS B 1 112 ? 10.703  17.390  13.233  1.000 15.823 0 111 CYS B C    1 ? 
ATOM   3850 O  O    . CYS B 1 112 ? 10.267  17.995  14.271  1.000 15.193 0 111 CYS B O    1 ? 
ATOM   3851 C  CB   . CYS B 1 112 ? 12.452  15.766  14.071  1.000 18.085 0 111 CYS B CB   1 ? 
ATOM   3852 S  SG   . CYS B 1 112 ? 11.703  14.281  13.381  1.000 20.230 0 111 CYS B SG   1 ? 
ATOM   3853 H  H    . CYS B 1 112 ? 13.549  17.933  14.330  1.000 18.429 0 111 CYS B H    1 c 
ATOM   3854 H  HA   . CYS B 1 112 ? 12.413  16.719  12.247  1.000 17.471 0 111 CYS B HA   1 c 
ATOM   3855 H  HB2  . CYS B 1 112 ? 13.426  15.622  14.160  1.000 18.501 0 111 CYS B HB2  1 c 
ATOM   3856 H  HB3  . CYS B 1 112 ? 12.076  15.930  14.971  1.000 18.480 0 111 CYS B HB3  1 c 
ATOM   3857 H  HG   . CYS B 1 112 ? 12.059  13.542  14.212  0.000 20.270 0 111 CYS B HG   1 c 
ATOM   3858 N  N    . ILE B 1 113 ? 9.931   17.048  12.187  1.000 15.674 0 112 ILE B N    1 ? 
ATOM   3859 C  CA   . ILE B 1 113 ? 8.473   17.360  12.047  1.000 14.542 0 112 ILE B CA   1 ? 
ATOM   3860 C  C    . ILE B 1 113 ? 7.633   16.078  12.249  1.000 13.659 0 112 ILE B C    1 ? 
ATOM   3861 O  O    . ILE B 1 113 ? 6.392   16.155  12.155  1.000 12.980 0 112 ILE B O    1 ? 
ATOM   3862 C  CB   . ILE B 1 113 ? 8.185   18.057  10.692  1.000 14.695 0 112 ILE B CB   1 ? 
ATOM   3863 C  CG1  . ILE B 1 113 ? 8.608   17.175  9.512   1.000 14.456 0 112 ILE B CG1  1 ? 
ATOM   3864 C  CG2  . ILE B 1 113 ? 8.861   19.425  10.627  1.000 15.563 0 112 ILE B CG2  1 ? 
ATOM   3865 C  CD1  . ILE B 1 113 ? 8.005   17.543  8.199   1.000 14.496 0 112 ILE B CD1  1 ? 
ATOM   3866 H  H    . ILE B 1 113 ? 10.261  16.576  11.483  1.000 15.435 0 112 ILE B H    1 c 
ATOM   3867 H  HA   . ILE B 1 113 ? 8.234   17.985  12.754  1.000 14.608 0 112 ILE B HA   1 c 
ATOM   3868 H  HB   . ILE B 1 113 ? 7.208   18.198  10.627  1.000 14.777 0 112 ILE B HB   1 c 
ATOM   3869 H  HG12 . ILE B 1 113 ? 9.583   17.220  9.426   1.000 14.527 0 112 ILE B HG12 1 c 
ATOM   3870 H  HG13 . ILE B 1 113 ? 8.369   16.246  9.713   1.000 14.521 0 112 ILE B HG13 1 c 
ATOM   3871 H  HG21 . ILE B 1 113 ? 8.563   19.972  11.374  1.000 15.288 0 112 ILE B HG21 1 c 
ATOM   3872 H  HG22 . ILE B 1 113 ? 8.627   19.866  9.792   1.000 15.285 0 112 ILE B HG22 1 c 
ATOM   3873 H  HG23 . ILE B 1 113 ? 9.827   19.314  10.673  1.000 15.288 0 112 ILE B HG23 1 c 
ATOM   3874 H  HD11 . ILE B 1 113 ? 7.036   17.541  8.274   1.000 14.481 0 112 ILE B HD11 1 c 
ATOM   3875 H  HD12 . ILE B 1 113 ? 8.278   16.898  7.524   1.000 14.483 0 112 ILE B HD12 1 c 
ATOM   3876 H  HD13 . ILE B 1 113 ? 8.307   18.430  7.939   1.000 14.485 0 112 ILE B HD13 1 c 
ATOM   3877 N  N    . ILE B 1 114 ? 8.253   14.927  12.555  1.000 14.208 0 113 ILE B N    1 ? 
ATOM   3878 C  CA   . ILE B 1 114 ? 7.497   13.662  12.795  1.000 14.092 0 113 ILE B CA   1 ? 
ATOM   3879 C  C    . ILE B 1 114 ? 6.694   13.922  14.078  1.000 13.668 0 113 ILE B C    1 ? 
ATOM   3880 O  O    . ILE B 1 114 ? 7.316   14.410  15.050  1.000 13.788 0 113 ILE B O    1 ? 
ATOM   3881 C  CB   . ILE B 1 114 ? 8.408   12.411  12.923  1.000 15.351 0 113 ILE B CB   1 ? 
ATOM   3882 C  CG1  . ILE B 1 114 ? 9.296   12.150  11.695  1.000 16.445 0 113 ILE B CG1  1 ? 
ATOM   3883 C  CG2  . ILE B 1 114 ? 7.603   11.174  13.308  1.000 14.357 0 113 ILE B CG2  1 ? 
ATOM   3884 C  CD1  . ILE B 1 114 ? 8.604   12.140  10.374  1.000 16.994 0 113 ILE B CD1  1 ? 
ATOM   3885 H  H    . ILE B 1 114 ? 9.156   14.845  12.640  1.000 14.071 0 113 ILE B H    1 c 
ATOM   3886 H  HA   . ILE B 1 114 ? 6.876   13.524  12.057  1.000 14.266 0 113 ILE B HA   1 c 
ATOM   3887 H  HB   . ILE B 1 114 ? 9.023   12.592  13.677  1.000 15.109 0 113 ILE B HB   1 c 
ATOM   3888 H  HG12 . ILE B 1 114 ? 9.993   12.838  11.669  1.000 16.306 0 113 ILE B HG12 1 c 
ATOM   3889 H  HG13 . ILE B 1 114 ? 9.741   11.284  11.816  1.000 16.303 0 113 ILE B HG13 1 c 
ATOM   3890 H  HG21 . ILE B 1 114 ? 7.230   11.288  14.199  1.000 14.651 0 113 ILE B HG21 1 c 
ATOM   3891 H  HG22 . ILE B 1 114 ? 8.184   10.393  13.301  1.000 14.661 0 113 ILE B HG22 1 c 
ATOM   3892 H  HG23 . ILE B 1 114 ? 6.881   11.044  12.669  1.000 14.656 0 113 ILE B HG23 1 c 
ATOM   3893 H  HD11 . ILE B 1 114 ? 7.861   11.511  10.400  1.000 16.822 0 113 ILE B HD11 1 c 
ATOM   3894 H  HD12 . ILE B 1 114 ? 9.231   11.869  9.681   1.000 16.827 0 113 ILE B HD12 1 c 
ATOM   3895 H  HD13 . ILE B 1 114 ? 8.267   13.031  10.174  1.000 16.813 0 113 ILE B HD13 1 c 
ATOM   3896 N  N    . GLY B 1 115 ? 5.394   13.595  14.093  1.000 12.494 0 114 GLY B N    1 ? 
ATOM   3897 C  CA   . GLY B 1 115 ? 4.544   13.796  15.297  1.000 11.279 0 114 GLY B CA   1 ? 
ATOM   3898 C  C    . GLY B 1 115 ? 4.000   15.226  15.424  1.000 10.631 0 114 GLY B C    1 ? 
ATOM   3899 O  O    . GLY B 1 115 ? 3.342   15.526  16.444  1.000 9.601  0 114 GLY B O    1 ? 
ATOM   3900 H  H    . GLY B 1 115 ? 4.966   13.236  13.373  1.000 12.463 0 114 GLY B H    1 c 
ATOM   3901 H  HA2  . GLY B 1 115 ? 3.784   13.163  15.259  1.000 11.399 0 114 GLY B HA2  1 c 
ATOM   3902 H  HA3  . GLY B 1 115 ? 5.076   13.580  16.103  1.000 11.409 0 114 GLY B HA3  1 c 
ATOM   3903 N  N    . ARG B 1 116 ? 4.199   16.092  14.438  1.000 11.454 0 115 ARG B N    1 ? 
ATOM   3904 C  CA   . ARG B 1 116 ? 3.604   17.459  14.433  1.000 11.555 0 115 ARG B CA   1 ? 
ATOM   3905 C  C    . ARG B 1 116 ? 2.418   17.495  13.451  1.000 10.815 0 115 ARG B C    1 ? 
ATOM   3906 O  O    . ARG B 1 116 ? 2.098   16.439  12.906  1.000 10.465 0 115 ARG B O    1 ? 
ATOM   3907 C  CB   . ARG B 1 116 ? 4.720   18.495  14.210  1.000 12.101 0 115 ARG B CB   1 ? 
ATOM   3908 C  CG   . ARG B 1 116 ? 5.960   18.205  15.048  1.000 14.097 0 115 ARG B CG   1 ? 
ATOM   3909 C  CD   . ARG B 1 116 ? 6.823   19.431  15.286  1.000 14.144 0 115 ARG B CD   1 ? 
ATOM   3910 N  NE   . ARG B 1 116 ? 7.960   19.224  16.177  1.000 14.453 0 115 ARG B NE   1 ? 
ATOM   3911 C  CZ   . ARG B 1 116 ? 7.957   19.394  17.493  1.000 15.854 0 115 ARG B CZ   1 ? 
ATOM   3912 N  NH1  . ARG B 1 116 ? 6.866   19.786  18.137  1.000 15.914 0 115 ARG B NH1  1 ? 
ATOM   3913 N  NH2  . ARG B 1 116 ? 9.078   19.194  18.172  1.000 16.377 0 115 ARG B NH2  1 ? 
ATOM   3914 H  H    . ARG B 1 116 ? 4.709   15.905  13.703  1.000 11.287 0 115 ARG B H    1 c 
ATOM   3915 H  HA   . ARG B 1 116 ? 3.235   17.621  15.336  1.000 11.487 0 115 ARG B HA   1 c 
ATOM   3916 H  HB2  . ARG B 1 116 ? 4.968   18.499  13.252  1.000 12.411 0 115 ARG B HB2  1 c 
ATOM   3917 H  HB3  . ARG B 1 116 ? 4.375   19.392  14.443  1.000 12.419 0 115 ARG B HB3  1 c 
ATOM   3918 H  HG2  . ARG B 1 116 ? 5.682   17.835  15.922  1.000 13.605 0 115 ARG B HG2  1 c 
ATOM   3919 H  HG3  . ARG B 1 116 ? 6.505   17.518  14.590  1.000 13.605 0 115 ARG B HG3  1 c 
ATOM   3920 H  HD2  . ARG B 1 116 ? 7.165   19.747  14.414  1.000 14.206 0 115 ARG B HD2  1 c 
ATOM   3921 H  HD3  . ARG B 1 116 ? 6.255   20.152  15.655  1.000 14.211 0 115 ARG B HD3  1 c 
ATOM   3922 H  HE   . ARG B 1 116 ? 8.735   18.970  15.799  1.000 14.774 0 115 ARG B HE   1 c 
ATOM   3923 H  HH11 . ARG B 1 116 ? 6.101   19.933  17.688  1.000 15.841 0 115 ARG B HH11 1 c 
ATOM   3924 H  HH12 . ARG B 1 116 ? 6.889   19.894  19.029  1.000 15.846 0 115 ARG B HH12 1 c 
ATOM   3925 H  HH21 . ARG B 1 116 ? 9.822   18.927  17.742  1.000 16.126 0 115 ARG B HH21 1 c 
ATOM   3926 H  HH22 . ARG B 1 116 ? 9.087   19.300  19.064  1.000 16.126 0 115 ARG B HH22 1 c 
ATOM   3927 N  N    . THR B 1 117 ? 1.729   18.632  13.319  1.000 10.966 0 116 THR B N    1 ? 
ATOM   3928 C  CA   . THR B 1 117 ? 0.516   18.773  12.436  1.000 11.930 0 116 THR B CA   1 ? 
ATOM   3929 C  C    . THR B 1 117 ? 0.899   19.556  11.175  1.000 12.474 0 116 THR B C    1 ? 
ATOM   3930 O  O    . THR B 1 117 ? 1.403   20.684  11.320  1.000 12.028 0 116 THR B O    1 ? 
ATOM   3931 C  CB   . THR B 1 117 ? -0.664  19.409  13.181  1.000 12.414 0 116 THR B CB   1 ? 
ATOM   3932 O  OG1  . THR B 1 117 ? -1.028  18.541  14.260  1.000 12.330 0 116 THR B OG1  1 ? 
ATOM   3933 C  CG2  . THR B 1 117 ? -1.905  19.629  12.330  1.000 12.058 0 116 THR B CG2  1 ? 
ATOM   3934 H  H    . THR B 1 117 ? 1.945   19.408  13.752  1.000 11.150 0 116 THR B H    1 c 
ATOM   3935 H  HA   . THR B 1 117 ? 0.244   17.864  12.159  1.000 11.930 0 116 THR B HA   1 c 
ATOM   3936 H  HB   . THR B 1 117 ? -0.370  20.277  13.551  1.000 12.237 0 116 THR B HB   1 c 
ATOM   3937 H  HG1  . THR B 1 117 ? -1.676  18.854  14.672  0.000 12.280 0 116 THR B HG1  1 c 
ATOM   3938 H  HG21 . THR B 1 117 ? -1.695  20.248  11.588  1.000 12.174 0 116 THR B HG21 1 c 
ATOM   3939 H  HG22 . THR B 1 117 ? -2.624  20.016  12.887  1.000 12.170 0 116 THR B HG22 1 c 
ATOM   3940 H  HG23 . THR B 1 117 ? -2.208  18.763  11.959  1.000 12.176 0 116 THR B HG23 1 c 
ATOM   3941 N  N    . LEU B 1 118 ? 0.580   19.007  9.986   1.000 11.907 0 117 LEU B N    1 ? 
ATOM   3942 C  CA   . LEU B 1 118 ? 0.521   19.779  8.704   1.000 12.685 0 117 LEU B CA   1 ? 
ATOM   3943 C  C    . LEU B 1 118 ? -0.888  20.386  8.528   1.000 11.926 0 117 LEU B C    1 ? 
ATOM   3944 O  O    . LEU B 1 118 ? -1.886  19.674  8.712   1.000 13.431 0 117 LEU B O    1 ? 
ATOM   3945 C  CB   . LEU B 1 118 ? 0.939   18.851  7.555   1.000 12.031 0 117 LEU B CB   1 ? 
ATOM   3946 C  CG   . LEU B 1 118 ? 1.124   19.505  6.187   1.000 13.226 0 117 LEU B CG   1 ? 
ATOM   3947 C  CD1  . LEU B 1 118 ? 2.388   20.333  6.125   1.000 13.721 0 117 LEU B CD1  1 ? 
ATOM   3948 C  CD2  . LEU B 1 118 ? 1.114   18.487  5.054   1.000 13.572 0 117 LEU B CD2  1 ? 
ATOM   3949 H  H    . LEU B 1 118 ? 0.380   18.123  9.893   1.000 12.217 0 117 LEU B H    1 c 
ATOM   3950 H  HA   . LEU B 1 118 ? 1.168   20.518  8.766   1.000 12.265 0 117 LEU B HA   1 c 
ATOM   3951 H  HB2  . LEU B 1 118 ? 1.781   18.419  7.804   1.000 12.457 0 117 LEU B HB2  1 c 
ATOM   3952 H  HB3  . LEU B 1 118 ? 0.264   18.148  7.471   1.000 12.463 0 117 LEU B HB3  1 c 
ATOM   3953 H  HG   . LEU B 1 118 ? 0.360   20.116  6.043   1.000 13.142 0 117 LEU B HG   1 c 
ATOM   3954 H  HD11 . LEU B 1 118 ? 2.341   21.048  6.783   1.000 13.562 0 117 LEU B HD11 1 c 
ATOM   3955 H  HD12 . LEU B 1 118 ? 2.482   20.717  5.236   1.000 13.564 0 117 LEU B HD12 1 c 
ATOM   3956 H  HD13 . LEU B 1 118 ? 3.157   19.768  6.316   1.000 13.564 0 117 LEU B HD13 1 c 
ATOM   3957 H  HD21 . LEU B 1 118 ? 1.841   17.853  5.180   1.000 13.467 0 117 LEU B HD21 1 c 
ATOM   3958 H  HD22 . LEU B 1 118 ? 1.228   18.946  4.204   1.000 13.471 0 117 LEU B HD22 1 c 
ATOM   3959 H  HD23 . LEU B 1 118 ? 0.265   18.011  5.052   1.000 13.472 0 117 LEU B HD23 1 c 
ATOM   3960 N  N    . VAL B 1 119 ? -0.957  21.685  8.215   1.000 12.319 0 118 VAL B N    1 ? 
ATOM   3961 C  CA   . VAL B 1 119 ? -2.225  22.459  8.034   1.000 12.630 0 118 VAL B CA   1 ? 
ATOM   3962 C  C    . VAL B 1 119 ? -2.223  23.143  6.656   1.000 13.346 0 118 VAL B C    1 ? 
ATOM   3963 O  O    . VAL B 1 119 ? -1.165  23.698  6.245   1.000 12.892 0 118 VAL B O    1 ? 
ATOM   3964 C  CB   . VAL B 1 119 ? -2.415  23.483  9.171   1.000 13.720 0 118 VAL B CB   1 ? 
ATOM   3965 C  CG1  . VAL B 1 119 ? -3.694  24.295  8.980   1.000 12.766 0 118 VAL B CG1  1 ? 
ATOM   3966 C  CG2  . VAL B 1 119 ? -2.407  22.836  10.549  1.000 13.310 0 118 VAL B CG2  1 ? 
ATOM   3967 H  H    . VAL B 1 119 ? -0.212  22.193  8.088   1.000 12.300 0 118 VAL B H    1 c 
ATOM   3968 H  HA   . VAL B 1 119 ? -2.969  21.832  8.061   1.000 12.904 0 118 VAL B HA   1 c 
ATOM   3969 H  HB   . VAL B 1 119 ? -1.652  24.111  9.130   1.000 13.243 0 118 VAL B HB   1 c 
ATOM   3970 H  HG11 . VAL B 1 119 ? -3.603  24.870  8.200   1.000 13.052 0 118 VAL B HG11 1 c 
ATOM   3971 H  HG12 . VAL B 1 119 ? -3.850  24.844  9.768   1.000 13.055 0 118 VAL B HG12 1 c 
ATOM   3972 H  HG13 . VAL B 1 119 ? -4.446  23.691  8.852   1.000 13.051 0 118 VAL B HG13 1 c 
ATOM   3973 H  HG21 . VAL B 1 119 ? -3.093  22.147  10.590  1.000 13.433 0 118 VAL B HG21 1 c 
ATOM   3974 H  HG22 . VAL B 1 119 ? -2.586  23.511  11.227  1.000 13.430 0 118 VAL B HG22 1 c 
ATOM   3975 H  HG23 . VAL B 1 119 ? -1.536  22.436  10.716  1.000 13.427 0 118 VAL B HG23 1 c 
ATOM   3976 N  N    . VAL B 1 120 ? -3.380  23.107  5.963   1.000 13.176 0 119 VAL B N    1 ? 
ATOM   3977 C  CA   . VAL B 1 120 ? -3.674  23.957  4.761   1.000 15.266 0 119 VAL B CA   1 ? 
ATOM   3978 C  C    . VAL B 1 120 ? -4.772  24.953  5.147   1.000 14.513 0 119 VAL B C    1 ? 
ATOM   3979 O  O    . VAL B 1 120 ? -5.766  24.560  5.786   1.000 15.423 0 119 VAL B O    1 ? 
ATOM   3980 C  CB   . VAL B 1 120 ? -4.046  23.128  3.510   1.000 14.381 0 119 VAL B CB   1 ? 
ATOM   3981 C  CG1  . VAL B 1 120 ? -5.192  22.158  3.759   1.000 14.185 0 119 VAL B CG1  1 ? 
ATOM   3982 C  CG2  . VAL B 1 120 ? -4.322  24.004  2.299   1.000 14.783 0 119 VAL B CG2  1 ? 
ATOM   3983 H  H    . VAL B 1 120 ? -4.071  22.566  6.201   1.000 13.683 0 119 VAL B H    1 c 
ATOM   3984 H  HA   . VAL B 1 120 ? -2.870  24.464  4.552   1.000 14.528 0 119 VAL B HA   1 c 
ATOM   3985 H  HB   . VAL B 1 120 ? -3.251  22.581  3.291   1.000 14.584 0 119 VAL B HB   1 c 
ATOM   3986 H  HG11 . VAL B 1 120 ? -4.935  21.518  4.445   1.000 14.241 0 119 VAL B HG11 1 c 
ATOM   3987 H  HG12 . VAL B 1 120 ? -5.397  21.682  2.936   1.000 14.244 0 119 VAL B HG12 1 c 
ATOM   3988 H  HG13 . VAL B 1 120 ? -5.979  22.649  4.052   1.000 14.246 0 119 VAL B HG13 1 c 
ATOM   3989 H  HG21 . VAL B 1 120 ? -5.126  24.531  2.453   1.000 14.657 0 119 VAL B HG21 1 c 
ATOM   3990 H  HG22 . VAL B 1 120 ? -4.450  23.442  1.515   1.000 14.658 0 119 VAL B HG22 1 c 
ATOM   3991 H  HG23 . VAL B 1 120 ? -3.567  24.600  2.150   1.000 14.658 0 119 VAL B HG23 1 c 
ATOM   3992 N  N    . HIS B 1 121 ? -4.569  26.216  4.772   1.000 15.533 0 120 HIS B N    1 ? 
ATOM   3993 C  CA   . HIS B 1 121 ? -5.270  27.409  5.318   1.000 14.459 0 120 HIS B CA   1 ? 
ATOM   3994 C  C    . HIS B 1 121 ? -6.279  27.959  4.303   1.000 14.807 0 120 HIS B C    1 ? 
ATOM   3995 O  O    . HIS B 1 121 ? -6.205  27.605  3.116   1.000 15.178 0 120 HIS B O    1 ? 
ATOM   3996 C  CB   . HIS B 1 121 ? -4.241  28.461  5.725   1.000 13.389 0 120 HIS B CB   1 ? 
ATOM   3997 C  CG   . HIS B 1 121 ? -3.652  28.248  7.076   1.000 13.323 0 120 HIS B CG   1 ? 
ATOM   3998 N  ND1  . HIS B 1 121 ? -4.286  28.717  8.226   1.000 14.163 0 120 HIS B ND1  1 ? 
ATOM   3999 C  CD2  . HIS B 1 121 ? -2.523  27.627  7.488   1.000 13.982 0 120 HIS B CD2  1 ? 
ATOM   4000 C  CE1  . HIS B 1 121 ? -3.572  28.398  9.281   1.000 14.635 0 120 HIS B CE1  1 ? 
ATOM   4001 N  NE2  . HIS B 1 121 ? -2.495  27.696  8.855   1.000 13.811 0 120 HIS B NE2  1 ? 
ATOM   4002 H  H    . HIS B 1 121 ? -3.970  26.441  4.123   1.000 15.023 0 120 HIS B H    1 c 
ATOM   4003 H  HA   . HIS B 1 121 ? -5.765  27.129  6.122   1.000 14.513 0 120 HIS B HA   1 c 
ATOM   4004 H  HB2  . HIS B 1 121 ? -3.515  28.467  5.062   1.000 13.628 0 120 HIS B HB2  1 c 
ATOM   4005 H  HB3  . HIS B 1 121 ? -4.668  29.345  5.704   1.000 13.637 0 120 HIS B HB3  1 c 
ATOM   4006 H  HD1  . HIS B 1 121 ? -5.022  29.190  8.236   0.000 14.740 0 120 HIS B HD1  1 c 
ATOM   4007 H  HD2  . HIS B 1 121 ? -1.894  27.192  6.944   1.000 13.800 0 120 HIS B HD2  1 c 
ATOM   4008 H  HE1  . HIS B 1 121 ? -3.789  28.597  10.176  1.000 14.298 0 120 HIS B HE1  1 c 
ATOM   4009 H  HE2  . HIS B 1 121 ? -1.867  27.365  9.367   0.000 14.550 0 120 HIS B HE2  1 c 
ATOM   4010 N  N    . GLU B 1 122 ? -7.168  28.822  4.784   1.000 15.704 0 121 GLU B N    1 ? 
ATOM   4011 C  CA   . GLU B 1 122 ? -8.296  29.433  4.022   1.000 17.522 0 121 GLU B CA   1 ? 
ATOM   4012 C  C    . GLU B 1 122 ? -7.762  30.424  2.967   1.000 18.659 0 121 GLU B C    1 ? 
ATOM   4013 O  O    . GLU B 1 122 ? -8.223  30.372  1.779   1.000 19.804 0 121 GLU B O    1 ? 
ATOM   4014 C  CB   . GLU B 1 122 ? -9.238  30.113  5.014   1.000 18.668 0 121 GLU B CB   1 ? 
ATOM   4015 C  CG   . GLU B 1 122 ? -10.246 31.051  4.379   1.000 20.457 0 121 GLU B CG   1 ? 
ATOM   4016 C  CD   . GLU B 1 122 ? -10.949 31.948  5.382   1.000 24.684 0 121 GLU B CD   1 ? 
ATOM   4017 O  OE1  . GLU B 1 122 ? -12.088 32.394  5.044   1.000 26.510 0 121 GLU B OE1  1 ? 
ATOM   4018 O  OE2  . GLU B 1 122 ? -10.365 32.208  6.488   1.000 23.406 0 121 GLU B OE2  1 ? 
ATOM   4019 H  H    . GLU B 1 122 ? -7.135  29.101  5.651   1.000 15.906 0 121 GLU B H    1 c 
ATOM   4020 H  HA   . GLU B 1 122 ? -8.784  28.715  3.561   1.000 17.580 0 121 GLU B HA   1 c 
ATOM   4021 H  HB2  . GLU B 1 122 ? -9.720  29.419  5.509   1.000 18.805 0 121 GLU B HB2  1 c 
ATOM   4022 H  HB3  . GLU B 1 122 ? -8.698  30.618  5.656   1.000 18.807 0 121 GLU B HB3  1 c 
ATOM   4023 H  HG2  . GLU B 1 122 ? -9.795  31.617  3.720   1.000 20.929 0 121 GLU B HG2  1 c 
ATOM   4024 H  HG3  . GLU B 1 122 ? -10.923 30.522  3.905   1.000 20.931 0 121 GLU B HG3  1 c 
ATOM   4025 N  N    . LYS B 1 123 ? -6.834  31.282  3.384   1.000 19.682 0 122 LYS B N    1 ? 
ATOM   4026 C  CA   . LYS B 1 123 ? -6.257  32.435  2.638   1.000 20.345 0 122 LYS B CA   1 ? 
ATOM   4027 C  C    . LYS B 1 123 ? -4.770  32.169  2.346   1.000 19.769 0 122 LYS B C    1 ? 
ATOM   4028 O  O    . LYS B 1 123 ? -4.180  31.195  2.882   1.000 19.159 0 122 LYS B O    1 ? 
ATOM   4029 C  CB   . LYS B 1 123 ? -6.423  33.742  3.430   1.000 20.747 0 122 LYS B CB   1 ? 
ATOM   4030 C  CG   . LYS B 1 123 ? -7.831  34.017  3.927   1.000 22.052 0 122 LYS B CG   1 ? 
ATOM   4031 C  CD   . LYS B 1 123 ? -7.913  35.107  4.968   1.000 24.050 0 122 LYS B CD   1 ? 
ATOM   4032 C  CE   . LYS B 1 123 ? -9.348  35.416  5.359   1.000 25.630 0 122 LYS B CE   1 ? 
ATOM   4033 N  NZ   . LYS B 1 123 ? -9.431  36.020  6.710   1.000 27.848 0 122 LYS B NZ   1 ? 
ATOM   4034 H  H    . LYS B 1 123 ? -6.473  31.209  4.217   1.000 19.574 0 122 LYS B H    1 c 
ATOM   4035 H  HA   . LYS B 1 123 ? -6.736  32.521  1.781   1.000 20.180 0 122 LYS B HA   1 c 
ATOM   4036 H  HB2  . LYS B 1 123 ? -5.820  33.716  4.201   1.000 20.951 0 122 LYS B HB2  1 c 
ATOM   4037 H  HB3  . LYS B 1 123 ? -6.144  34.488  2.858   1.000 20.950 0 122 LYS B HB3  1 c 
ATOM   4038 H  HG2  . LYS B 1 123 ? -8.392  34.267  3.162   1.000 22.188 0 122 LYS B HG2  1 c 
ATOM   4039 H  HG3  . LYS B 1 123 ? -8.197  33.191  4.308   1.000 22.181 0 122 LYS B HG3  1 c 
ATOM   4040 H  HD2  . LYS B 1 123 ? -7.416  34.829  5.767   1.000 23.930 0 122 LYS B HD2  1 c 
ATOM   4041 H  HD3  . LYS B 1 123 ? -7.495  35.921  4.616   1.000 23.924 0 122 LYS B HD3  1 c 
ATOM   4042 H  HE2  . LYS B 1 123 ? -9.737  36.033  4.711   1.000 25.747 0 122 LYS B HE2  1 c 
ATOM   4043 H  HE3  . LYS B 1 123 ? -9.874  34.595  5.347   1.000 25.736 0 122 LYS B HE3  1 c 
ATOM   4044 H  HZ1  . LYS B 1 123 ? -9.096  35.444  7.326   1.000 27.141 0 122 LYS B HZ1  1 c 
ATOM   4045 H  HZ2  . LYS B 1 123 ? -10.296 36.202  6.913   1.000 27.147 0 122 LYS B HZ2  1 c 
ATOM   4046 H  HZ3  . LYS B 1 123 ? -8.952  36.790  6.732   1.000 27.147 0 122 LYS B HZ3  1 c 
ATOM   4047 N  N    . ALA B 1 124 ? -4.193  32.987  1.475   1.000 19.716 0 123 ALA B N    1 ? 
ATOM   4048 C  CA   . ALA B 1 124 ? -2.753  32.996  1.151   1.000 18.578 0 123 ALA B CA   1 ? 
ATOM   4049 C  C    . ALA B 1 124 ? -1.956  33.490  2.364   1.000 17.369 0 123 ALA B C    1 ? 
ATOM   4050 O  O    . ALA B 1 124 ? -2.363  34.433  3.066   1.000 17.593 0 123 ALA B O    1 ? 
ATOM   4051 C  CB   . ALA B 1 124 ? -2.493  33.850  -0.077  1.000 18.992 0 123 ALA B CB   1 ? 
ATOM   4052 H  H    . ALA B 1 124 ? -4.656  33.617  1.007   1.000 19.456 0 123 ALA B H    1 c 
ATOM   4053 H  HA   . ALA B 1 124 ? -2.477  32.071  0.953   1.000 18.614 0 123 ALA B HA   1 c 
ATOM   4054 H  HB1  . ALA B 1 124 ? -1.544  33.834  -0.289  1.000 18.867 0 123 ALA B HB1  1 c 
ATOM   4055 H  HB2  . ALA B 1 124 ? -2.997  33.500  -0.830  1.000 18.867 0 123 ALA B HB2  1 c 
ATOM   4056 H  HB3  . ALA B 1 124 ? -2.769  34.766  0.099   1.000 18.868 0 123 ALA B HB3  1 c 
ATOM   4057 N  N    . ASP B 1 125 ? -0.815  32.863  2.580   1.000 16.260 0 124 ASP B N    1 ? 
ATOM   4058 C  CA   . ASP B 1 125 ? 0.233   33.346  3.510   1.000 16.702 0 124 ASP B CA   1 ? 
ATOM   4059 C  C    . ASP B 1 125 ? 0.927   34.566  2.874   1.000 17.008 0 124 ASP B C    1 ? 
ATOM   4060 O  O    . ASP B 1 125 ? 1.378   34.437  1.711   1.000 15.477 0 124 ASP B O    1 ? 
ATOM   4061 C  CB   . ASP B 1 125 ? 1.146   32.153  3.812   1.000 15.512 0 124 ASP B CB   1 ? 
ATOM   4062 C  CG   . ASP B 1 125 ? 2.240   32.416  4.825   1.000 17.097 0 124 ASP B CG   1 ? 
ATOM   4063 O  OD1  . ASP B 1 125 ? 2.568   33.610  5.090   1.000 18.144 0 124 ASP B OD1  1 ? 
ATOM   4064 O  OD2  . ASP B 1 125 ? 2.750   31.409  5.357   1.000 17.555 0 124 ASP B OD2  1 ? 
ATOM   4065 H  H    . ASP B 1 125 ? -0.601  32.083  2.161   1.000 16.625 0 124 ASP B H    1 c 
ATOM   4066 H  HA   . ASP B 1 125 ? -0.200  33.629  4.349   1.000 16.448 0 124 ASP B HA   1 c 
ATOM   4067 H  HB2  . ASP B 1 125 ? 0.596   31.414  4.143   1.000 16.154 0 124 ASP B HB2  1 c 
ATOM   4068 H  HB3  . ASP B 1 125 ? 1.571   31.864  2.978   1.000 16.155 0 124 ASP B HB3  1 c 
ATOM   4069 N  N    . ASP B 1 126 ? 1.002   35.700  3.601   1.000 17.564 0 125 ASP B N    1 ? 
ATOM   4070 C  CA   . ASP B 1 126 ? 1.624   36.983  3.132   1.000 17.840 0 125 ASP B CA   1 ? 
ATOM   4071 C  C    . ASP B 1 126 ? 3.139   37.027  3.441   1.000 16.971 0 125 ASP B C    1 ? 
ATOM   4072 O  O    . ASP B 1 126 ? 3.742   38.062  3.147   1.000 18.042 0 125 ASP B O    1 ? 
ATOM   4073 C  CB   . ASP B 1 126 ? 0.839   38.192  3.671   1.000 19.197 0 125 ASP B CB   1 ? 
ATOM   4074 C  CG   . ASP B 1 126 ? 1.071   38.495  5.139   1.000 19.078 0 125 ASP B CG   1 ? 
ATOM   4075 O  OD1  . ASP B 1 126 ? 2.073   37.951  5.697   1.000 17.952 0 125 ASP B OD1  1 ? 
ATOM   4076 O  OD2  . ASP B 1 126 ? 0.250   39.283  5.720   1.000 18.470 0 125 ASP B OD2  1 ? 
ATOM   4077 H  H    . ASP B 1 126 ? 0.671   35.752  4.447   1.000 17.501 0 125 ASP B H    1 c 
ATOM   4078 H  HA   . ASP B 1 126 ? 1.529   37.006  2.151   1.000 17.861 0 125 ASP B HA   1 c 
ATOM   4079 H  HB2  . ASP B 1 126 ? 1.086   38.985  3.154   1.000 18.841 0 125 ASP B HB2  1 c 
ATOM   4080 H  HB3  . ASP B 1 126 ? -0.118  38.030  3.541   1.000 18.841 0 125 ASP B HB3  1 c 
ATOM   4081 N  N    . LEU B 1 127 ? 3.729   35.925  3.940   1.000 17.397 0 126 LEU B N    1 ? 
ATOM   4082 C  CA   . LEU B 1 127 ? 5.190   35.672  4.097   1.000 17.280 0 126 LEU B CA   1 ? 
ATOM   4083 C  C    . LEU B 1 127 ? 5.868   36.762  4.940   1.000 18.843 0 126 LEU B C    1 ? 
ATOM   4084 O  O    . LEU B 1 127 ? 7.083   36.981  4.741   1.000 19.720 0 126 LEU B O    1 ? 
ATOM   4085 C  CB   . LEU B 1 127 ? 5.896   35.569  2.738   1.000 17.409 0 126 LEU B CB   1 ? 
ATOM   4086 C  CG   . LEU B 1 127 ? 5.199   34.695  1.699   1.000 16.772 0 126 LEU B CG   1 ? 
ATOM   4087 C  CD1  . LEU B 1 127 ? 6.009   34.657  0.413   1.000 17.736 0 126 LEU B CD1  1 ? 
ATOM   4088 C  CD2  . LEU B 1 127 ? 4.993   33.279  2.194   1.000 17.187 0 126 LEU B CD2  1 ? 
ATOM   4089 H  H    . LEU B 1 127 ? 3.236   35.225  4.243   1.000 17.268 0 126 LEU B H    1 c 
ATOM   4090 H  HA   . LEU B 1 127 ? 5.294   34.815  4.572   1.000 17.612 0 126 LEU B HA   1 c 
ATOM   4091 H  HB2  . LEU B 1 127 ? 5.989   36.470  2.370   1.000 17.234 0 126 LEU B HB2  1 c 
ATOM   4092 H  HB3  . LEU B 1 127 ? 6.796   35.215  2.884   1.000 17.232 0 126 LEU B HB3  1 c 
ATOM   4093 H  HG   . LEU B 1 127 ? 4.315   35.089  1.499   1.000 17.152 0 126 LEU B HG   1 c 
ATOM   4094 H  HD11 . LEU B 1 127 ? 6.116   35.561  0.069   1.000 17.433 0 126 LEU B HD11 1 c 
ATOM   4095 H  HD12 . LEU B 1 127 ? 5.545   34.113  -0.247  1.000 17.433 0 126 LEU B HD12 1 c 
ATOM   4096 H  HD13 . LEU B 1 127 ? 6.885   34.273  0.592   1.000 17.433 0 126 LEU B HD13 1 c 
ATOM   4097 H  HD21 . LEU B 1 127 ? 5.851   32.894  2.445   1.000 17.057 0 126 LEU B HD21 1 c 
ATOM   4098 H  HD22 . LEU B 1 127 ? 4.593   32.743  1.487   1.000 17.058 0 126 LEU B HD22 1 c 
ATOM   4099 H  HD23 . LEU B 1 127 ? 4.402   33.286  2.967   1.000 17.059 0 126 LEU B HD23 1 c 
ATOM   4100 N  N    . GLY B 1 128 ? 5.144   37.347  5.889   1.000 21.153 0 127 GLY B N    1 ? 
ATOM   4101 C  CA   . GLY B 1 128 ? 5.658   38.415  6.766   1.000 22.671 0 127 GLY B CA   1 ? 
ATOM   4102 C  C    . GLY B 1 128 ? 5.917   39.738  6.057   1.000 25.557 0 127 GLY B C    1 ? 
ATOM   4103 O  O    . GLY B 1 128 ? 6.644   40.537  6.656   1.000 24.305 0 127 GLY B O    1 ? 
ATOM   4104 H  H    . GLY B 1 128 ? 4.282   37.109  6.062   1.000 20.897 0 127 GLY B H    1 c 
ATOM   4105 H  HA2  . GLY B 1 128 ? 5.012   38.562  7.498   1.000 22.936 0 127 GLY B HA2  1 c 
ATOM   4106 H  HA3  . GLY B 1 128 ? 6.503   38.103  7.176   1.000 22.941 0 127 GLY B HA3  1 c 
ATOM   4107 N  N    . LYS B 1 129 ? 5.324   39.986  4.875   1.000 27.910 0 128 LYS B N    1 ? 
ATOM   4108 C  CA   . LYS B 1 129 ? 5.451   41.261  4.100   1.000 28.607 0 128 LYS B CA   1 ? 
ATOM   4109 C  C    . LYS B 1 129 ? 4.161   42.101  4.116   1.000 28.989 0 128 LYS B C    1 ? 
ATOM   4110 O  O    . LYS B 1 129 ? 4.032   42.950  3.220   1.000 27.512 0 128 LYS B O    1 ? 
ATOM   4111 C  CB   . LYS B 1 129 ? 5.749   40.993  2.620   1.000 31.384 0 128 LYS B CB   1 ? 
ATOM   4112 C  CG   . LYS B 1 129 ? 6.861   40.004  2.313   1.000 33.483 0 128 LYS B CG   1 ? 
ATOM   4113 C  CD   . LYS B 1 129 ? 7.027   39.763  0.819   1.000 36.231 0 128 LYS B CD   1 ? 
ATOM   4114 C  CE   . LYS B 1 129 ? 8.182   38.832  0.506   1.000 39.501 0 128 LYS B CE   1 ? 
ATOM   4115 N  NZ   . LYS B 1 129 ? 8.809   39.167  -0.794  1.000 42.114 0 128 LYS B NZ   1 ? 
ATOM   4116 H  H    . LYS B 1 129 ? 4.787   39.376  4.465   1.000 27.460 0 128 LYS B H    1 c 
ATOM   4117 H  HA   . LYS B 1 129 ? 6.184   41.794  4.484   1.000 29.038 0 128 LYS B HA   1 c 
ATOM   4118 H  HB2  . LYS B 1 129 ? 4.927   40.666  2.197   1.000 31.166 0 128 LYS B HB2  1 c 
ATOM   4119 H  HB3  . LYS B 1 129 ? 5.978   41.846  2.195   1.000 31.169 0 128 LYS B HB3  1 c 
ATOM   4120 H  HG2  . LYS B 1 129 ? 7.704   40.347  2.680   1.000 33.606 0 128 LYS B HG2  1 c 
ATOM   4121 H  HG3  . LYS B 1 129 ? 6.663   39.151  2.756   1.000 33.587 0 128 LYS B HG3  1 c 
ATOM   4122 H  HD2  . LYS B 1 129 ? 6.200   39.375  0.462   1.000 36.301 0 128 LYS B HD2  1 c 
ATOM   4123 H  HD3  . LYS B 1 129 ? 7.179   40.622  0.369   1.000 36.319 0 128 LYS B HD3  1 c 
ATOM   4124 H  HE2  . LYS B 1 129 ? 8.856   38.900  1.208   1.000 39.269 0 128 LYS B HE2  1 c 
ATOM   4125 H  HE3  . LYS B 1 129 ? 7.863   37.910  0.479   1.000 39.290 0 128 LYS B HE3  1 c 
ATOM   4126 H  HZ1  . LYS B 1 129 ? 8.178   39.182  -1.445  1.000 41.292 0 128 LYS B HZ1  1 c 
ATOM   4127 H  HZ2  . LYS B 1 129 ? 9.437   38.545  -1.002  1.000 41.292 0 128 LYS B HZ2  1 c 
ATOM   4128 H  HZ3  . LYS B 1 129 ? 9.204   39.982  -0.744  1.000 41.282 0 128 LYS B HZ3  1 c 
ATOM   4129 N  N    . GLY B 1 130 ? 3.251   41.912  5.080   1.000 27.556 0 129 GLY B N    1 ? 
ATOM   4130 C  CA   . GLY B 1 130 ? 1.910   42.537  5.073   1.000 28.916 0 129 GLY B CA   1 ? 
ATOM   4131 C  C    . GLY B 1 130 ? 1.794   43.763  5.970   1.000 29.922 0 129 GLY B C    1 ? 
ATOM   4132 O  O    . GLY B 1 130 ? 0.704   44.369  5.996   1.000 30.445 0 129 GLY B O    1 ? 
ATOM   4133 H  H    . GLY B 1 130 ? 3.413   41.386  5.806   1.000 28.205 0 129 GLY B H    1 c 
ATOM   4134 H  HA2  . GLY B 1 130 ? 1.683   42.795  4.144   1.000 28.820 0 129 GLY B HA2  1 c 
ATOM   4135 H  HA3  . GLY B 1 130 ? 1.247   41.863  5.364   1.000 28.822 0 129 GLY B HA3  1 c 
ATOM   4136 N  N    . GLY B 1 131 ? 2.852   44.128  6.697   1.000 32.606 0 130 GLY B N    1 ? 
ATOM   4137 C  CA   . GLY B 1 131 ? 2.916   45.408  7.440   1.000 35.555 0 130 GLY B CA   1 ? 
ATOM   4138 C  C    . GLY B 1 131 ? 1.792   45.579  8.461   1.000 38.227 0 130 GLY B C    1 ? 
ATOM   4139 O  O    . GLY B 1 131 ? 1.482   46.747  8.795   1.000 39.502 0 130 GLY B O    1 ? 
ATOM   4140 H  H    . GLY B 1 131 ? 3.593   43.606  6.781   1.000 32.596 0 130 GLY B H    1 c 
ATOM   4141 H  HA2  . GLY B 1 131 ? 3.787   45.460  7.907   1.000 35.437 0 130 GLY B HA2  1 c 
ATOM   4142 H  HA3  . GLY B 1 131 ? 2.878   46.154  6.790   1.000 35.437 0 130 GLY B HA3  1 c 
ATOM   4143 N  N    . ASN B 1 132 ? 1.178   44.483  8.930   1.000 36.755 0 131 ASN B N    1 ? 
ATOM   4144 C  CA   . ASN B 1 132 ? 0.448   44.447  10.225  1.000 36.616 0 131 ASN B CA   1 ? 
ATOM   4145 C  C    . ASN B 1 132 ? 1.264   43.572  11.189  1.000 37.488 0 131 ASN B C    1 ? 
ATOM   4146 O  O    . ASN B 1 132 ? 2.226   42.908  10.735  1.000 32.229 0 131 ASN B O    1 ? 
ATOM   4147 C  CB   . ASN B 1 132 ? -1.016  44.033  10.061  1.000 37.590 0 131 ASN B CB   1 ? 
ATOM   4148 C  CG   . ASN B 1 132 ? -1.215  42.598  9.617   1.000 37.335 0 131 ASN B CG   1 ? 
ATOM   4149 O  OD1  . ASN B 1 132 ? -0.282  41.931  9.192   1.000 35.413 0 131 ASN B OD1  1 ? 
ATOM   4150 N  ND2  . ASN B 1 132 ? -2.444  42.118  9.704   1.000 39.267 0 131 ASN B ND2  1 ? 
ATOM   4151 H  H    . ASN B 1 132 ? 1.178   43.688  8.489   1.000 37.033 0 131 ASN B H    1 c 
ATOM   4152 H  HA   . ASN B 1 132 ? 0.443   45.362  10.588  1.000 36.998 0 131 ASN B HA   1 c 
ATOM   4153 H  HB2  . ASN B 1 132 ? -1.474  44.164  10.916  1.000 37.309 0 131 ASN B HB2  1 c 
ATOM   4154 H  HB3  . ASN B 1 132 ? -1.436  44.626  9.404   1.000 37.299 0 131 ASN B HB3  1 c 
ATOM   4155 H  HD21 . ASN B 1 132 ? -2.581  41.243  9.673   1.000 38.609 0 131 ASN B HD21 1 c 
ATOM   4156 H  HD22 . ASN B 1 132 ? -3.130  42.671  9.795   1.000 38.645 0 131 ASN B HD22 1 c 
ATOM   4157 N  N    . GLU B 1 133 ? 0.951   43.615  12.486  1.000 38.934 0 132 GLU B N    1 ? 
ATOM   4158 C  CA   . GLU B 1 133 ? 1.743   42.874  13.506  1.000 39.042 0 132 GLU B CA   1 ? 
ATOM   4159 C  C    . GLU B 1 133 ? 1.525   41.364  13.288  1.000 35.286 0 132 GLU B C    1 ? 
ATOM   4160 O  O    . GLU B 1 133 ? 2.493   40.614  13.469  1.000 32.934 0 132 GLU B O    1 ? 
ATOM   4161 C  CB   . GLU B 1 133 ? 1.451   43.389  14.923  1.000 40.902 0 132 GLU B CB   1 ? 
ATOM   4162 C  CG   . GLU B 1 133 ? 0.005   43.267  15.374  1.000 43.175 0 132 GLU B CG   1 ? 
ATOM   4163 C  CD   . GLU B 1 133 ? -0.378  41.983  16.091  1.000 47.305 0 132 GLU B CD   1 ? 
ATOM   4164 O  OE1  . GLU B 1 133 ? 0.495   41.101  16.257  1.000 51.466 0 132 GLU B OE1  1 ? 
ATOM   4165 O  OE2  . GLU B 1 133 ? -1.562  41.866  16.484  1.000 47.707 0 132 GLU B OE2  1 ? 
ATOM   4166 H  H    . GLU B 1 133 ? 0.259   44.105  12.814  1.000 38.646 0 132 GLU B H    1 c 
ATOM   4167 H  HA   . GLU B 1 133 ? 2.693   43.058  13.321  1.000 38.591 0 132 GLU B HA   1 c 
ATOM   4168 H  HB2  . GLU B 1 133 ? 2.021   42.900  15.552  1.000 41.007 0 132 GLU B HB2  1 c 
ATOM   4169 H  HB3  . GLU B 1 133 ? 1.710   44.333  14.964  1.000 40.982 0 132 GLU B HB3  1 c 
ATOM   4170 H  HG2  . GLU B 1 133 ? -0.193  44.014  15.974  1.000 43.553 0 132 GLU B HG2  1 c 
ATOM   4171 H  HG3  . GLU B 1 133 ? -0.576  43.361  14.595  1.000 43.534 0 132 GLU B HG3  1 c 
ATOM   4172 N  N    . GLU B 1 134 ? 0.336   40.961  12.816  1.000 33.968 0 133 GLU B N    1 ? 
ATOM   4173 C  CA   . GLU B 1 134 ? -0.076  39.537  12.661  1.000 34.849 0 133 GLU B CA   1 ? 
ATOM   4174 C  C    . GLU B 1 134 ? 0.701   38.893  11.505  1.000 30.620 0 133 GLU B C    1 ? 
ATOM   4175 O  O    . GLU B 1 134 ? 0.929   37.676  11.555  1.000 30.522 0 133 GLU B O    1 ? 
ATOM   4176 C  CB   . GLU B 1 134 ? -1.589  39.427  12.458  1.000 38.429 0 133 GLU B CB   1 ? 
ATOM   4177 C  CG   . GLU B 1 134 ? -2.407  40.130  13.538  1.000 42.330 0 133 GLU B CG   1 ? 
ATOM   4178 C  CD   . GLU B 1 134 ? -2.891  41.534  13.179  1.000 46.850 0 133 GLU B CD   1 ? 
ATOM   4179 O  OE1  . GLU B 1 134 ? -2.043  42.401  12.847  1.000 44.339 0 133 GLU B OE1  1 ? 
ATOM   4180 O  OE2  . GLU B 1 134 ? -4.128  41.759  13.219  1.000 53.188 0 133 GLU B OE2  1 ? 
ATOM   4181 H  H    . GLU B 1 134 ? -0.298  41.550  12.540  1.000 34.546 0 133 GLU B H    1 c 
ATOM   4182 H  HA   . GLU B 1 134 ? 0.161   39.063  13.491  1.000 34.472 0 133 GLU B HA   1 c 
ATOM   4183 H  HB2  . GLU B 1 134 ? -1.817  39.811  11.586  1.000 38.435 0 133 GLU B HB2  1 c 
ATOM   4184 H  HB3  . GLU B 1 134 ? -1.834  38.478  12.442  1.000 38.423 0 133 GLU B HB3  1 c 
ATOM   4185 H  HG2  . GLU B 1 134 ? -3.190  39.579  13.749  1.000 42.398 0 133 GLU B HG2  1 c 
ATOM   4186 H  HG3  . GLU B 1 134 ? -1.865  40.192  14.353  1.000 42.375 0 133 GLU B HG3  1 c 
ATOM   4187 N  N    . SER B 1 135 ? 1.128   39.681  10.520  1.000 27.637 0 134 SER B N    1 ? 
ATOM   4188 C  CA   . SER B 1 135 ? 1.925   39.190  9.362   1.000 24.612 0 134 SER B CA   1 ? 
ATOM   4189 C  C    . SER B 1 135 ? 3.173   38.408  9.819   1.000 24.333 0 134 SER B C    1 ? 
ATOM   4190 O  O    . SER B 1 135 ? 3.436   37.340  9.244   1.000 22.654 0 134 SER B O    1 ? 
ATOM   4191 C  CB   . SER B 1 135 ? 2.321   40.306  8.455   1.000 24.007 0 134 SER B CB   1 ? 
ATOM   4192 O  OG   . SER B 1 135 ? 3.023   39.804  7.332   1.000 20.278 0 134 SER B OG   1 ? 
ATOM   4193 H  H    . SER B 1 135 ? 0.957   40.578  10.474  1.000 27.544 0 134 SER B H    1 c 
ATOM   4194 H  HA   . SER B 1 135 ? 1.353   38.568  8.848   1.000 24.986 0 134 SER B HA   1 c 
ATOM   4195 H  HB2  . SER B 1 135 ? 1.512   40.787  8.150   1.000 23.243 0 134 SER B HB2  1 c 
ATOM   4196 H  HB3  . SER B 1 135 ? 2.894   40.945  8.947   1.000 23.216 0 134 SER B HB3  1 c 
ATOM   4197 H  HG   . SER B 1 135 ? 3.190   40.441  6.796   0.000 21.880 0 134 SER B HG   1 c 
ATOM   4198 N  N    . THR B 1 136 ? 3.961   38.915  10.780  1.000 23.886 0 135 THR B N    1 ? 
ATOM   4199 C  CA   . THR B 1 136 ? 5.239   38.248  11.167  1.000 25.088 0 135 THR B CA   1 ? 
ATOM   4200 C  C    . THR B 1 136 ? 5.002   37.247  12.317  1.000 25.681 0 135 THR B C    1 ? 
ATOM   4201 O  O    . THR B 1 136 ? 6.008   36.883  12.989  1.000 23.947 0 135 THR B O    1 ? 
ATOM   4202 C  CB   . THR B 1 136 ? 6.336   39.285  11.429  1.000 24.460 0 135 THR B CB   1 ? 
ATOM   4203 O  OG1  . THR B 1 136 ? 5.888   40.200  12.433  1.000 25.607 0 135 THR B OG1  1 ? 
ATOM   4204 C  CG2  . THR B 1 136 ? 6.701   40.017  10.160  1.000 23.750 0 135 THR B CG2  1 ? 
ATOM   4205 H  H    . THR B 1 136 ? 3.787   39.679  11.250  1.000 24.270 0 135 THR B H    1 c 
ATOM   4206 H  HA   . THR B 1 136 ? 5.531   37.720  10.383  1.000 24.812 0 135 THR B HA   1 c 
ATOM   4207 H  HB   . THR B 1 136 ? 7.137   38.812  11.764  1.000 24.654 0 135 THR B HB   1 c 
ATOM   4208 H  HG1  . THR B 1 136 ? 6.521   40.772  12.553  0.000 25.460 0 135 THR B HG1  1 c 
ATOM   4209 H  HG21 . THR B 1 136 ? 7.001   39.365  9.479   1.000 23.968 0 135 THR B HG21 1 c 
ATOM   4210 H  HG22 . THR B 1 136 ? 7.433   40.655  10.346  1.000 23.967 0 135 THR B HG22 1 c 
ATOM   4211 H  HG23 . THR B 1 136 ? 5.914   40.509  9.820   1.000 23.967 0 135 THR B HG23 1 c 
ATOM   4212 N  N    . LYS B 1 137 ? 3.753   36.761  12.466  1.000 27.138 0 136 LYS B N    1 ? 
ATOM   4213 C  CA   . LYS B 1 137 ? 3.331   35.677  13.394  1.000 26.443 0 136 LYS B CA   1 ? 
ATOM   4214 C  C    . LYS B 1 137 ? 2.675   34.517  12.625  1.000 24.066 0 136 LYS B C    1 ? 
ATOM   4215 O  O    . LYS B 1 137 ? 3.199   33.398  12.715  1.000 26.076 0 136 LYS B O    1 ? 
ATOM   4216 C  CB   . LYS B 1 137 ? 2.406   36.248  14.466  1.000 29.503 0 136 LYS B CB   1 ? 
ATOM   4217 C  CG   . LYS B 1 137 ? 3.048   37.343  15.312  1.000 30.285 0 136 LYS B CG   1 ? 
ATOM   4218 C  CD   . LYS B 1 137 ? 2.145   37.840  16.415  1.000 32.385 0 136 LYS B CD   1 ? 
ATOM   4219 C  CE   . LYS B 1 137 ? 2.864   38.688  17.438  1.000 35.246 0 136 LYS B CE   1 ? 
ATOM   4220 N  NZ   . LYS B 1 137 ? 2.075   38.797  18.689  1.000 35.466 0 136 LYS B NZ   1 ? 
ATOM   4221 H  H    . LYS B 1 137 ? 3.054   37.088  11.988  1.000 26.590 0 136 LYS B H    1 c 
ATOM   4222 H  HA   . LYS B 1 137 ? 4.139   35.329  13.839  1.000 26.643 0 136 LYS B HA   1 c 
ATOM   4223 H  HB2  . LYS B 1 137 ? 1.610   36.614  14.028  1.000 28.928 0 136 LYS B HB2  1 c 
ATOM   4224 H  HB3  . LYS B 1 137 ? 2.120   35.520  15.056  1.000 28.930 0 136 LYS B HB3  1 c 
ATOM   4225 H  HG2  . LYS B 1 137 ? 3.876   36.994  15.707  1.000 30.588 0 136 LYS B HG2  1 c 
ATOM   4226 H  HG3  . LYS B 1 137 ? 3.286   38.096  14.730  1.000 30.575 0 136 LYS B HG3  1 c 
ATOM   4227 H  HD2  . LYS B 1 137 ? 1.420   38.368  16.020  1.000 32.524 0 136 LYS B HD2  1 c 
ATOM   4228 H  HD3  . LYS B 1 137 ? 1.743   37.069  16.869  1.000 32.529 0 136 LYS B HD3  1 c 
ATOM   4229 H  HE2  . LYS B 1 137 ? 3.732   38.292  17.643  1.000 34.595 0 136 LYS B HE2  1 c 
ATOM   4230 H  HE3  . LYS B 1 137 ? 3.015   39.582  17.077  1.000 34.603 0 136 LYS B HE3  1 c 
ATOM   4231 H  HZ1  . LYS B 1 137 ? 1.271   39.177  18.512  1.000 35.403 0 136 LYS B HZ1  1 c 
ATOM   4232 H  HZ2  . LYS B 1 137 ? 2.520   39.312  19.287  1.000 35.403 0 136 LYS B HZ2  1 c 
ATOM   4233 H  HZ3  . LYS B 1 137 ? 1.944   37.973  19.044  1.000 35.398 0 136 LYS B HZ3  1 c 
ATOM   4234 N  N    . THR B 1 138 ? 1.575   34.770  11.899  1.000 21.442 0 137 THR B N    1 ? 
ATOM   4235 C  CA   . THR B 1 138 ? 0.765   33.745  11.180  1.000 21.130 0 137 THR B CA   1 ? 
ATOM   4236 C  C    . THR B 1 138 ? 0.758   33.990  9.665   1.000 18.223 0 137 THR B C    1 ? 
ATOM   4237 O  O    . THR B 1 138 ? 0.230   33.129  8.962   1.000 17.825 0 137 THR B O    1 ? 
ATOM   4238 C  CB   . THR B 1 138 ? -0.700  33.769  11.621  1.000 19.496 0 137 THR B CB   1 ? 
ATOM   4239 O  OG1  . THR B 1 138 ? -1.192  35.039  11.203  1.000 19.639 0 137 THR B OG1  1 ? 
ATOM   4240 C  CG2  . THR B 1 138 ? -0.890  33.569  13.108  1.000 19.444 0 137 THR B CG2  1 ? 
ATOM   4241 H  H    . THR B 1 138 ? 1.219   35.608  11.822  1.000 21.944 0 137 THR B H    1 c 
ATOM   4242 H  HA   . THR B 1 138 ? 1.145   32.851  11.363  1.000 20.303 0 137 THR B HA   1 c 
ATOM   4243 H  HB   . THR B 1 138 ? -1.186  33.057  11.137  1.000 19.809 0 137 THR B HB   1 c 
ATOM   4244 H  HG1  . THR B 1 138 ? -2.017  35.082  11.409  0.000 19.490 0 137 THR B HG1  1 c 
ATOM   4245 H  HG21 . THR B 1 138 ? -0.470  32.717  13.383  1.000 19.477 0 137 THR B HG21 1 c 
ATOM   4246 H  HG22 . THR B 1 138 ? -1.856  33.542  13.317  1.000 19.466 0 137 THR B HG22 1 c 
ATOM   4247 H  HG23 . THR B 1 138 ? -0.468  34.316  13.599  1.000 19.469 0 137 THR B HG23 1 c 
ATOM   4248 N  N    . GLY B 1 139 ? 1.234   35.152  9.203   1.000 17.888 0 138 GLY B N    1 ? 
ATOM   4249 C  CA   . GLY B 1 139 ? 1.195   35.535  7.768   1.000 18.110 0 138 GLY B CA   1 ? 
ATOM   4250 C  C    . GLY B 1 139 ? -0.215  35.809  7.249   1.000 17.536 0 138 GLY B C    1 ? 
ATOM   4251 O  O    . GLY B 1 139 ? -0.396  35.823  6.004   1.000 17.054 0 138 GLY B O    1 ? 
ATOM   4252 H  H    . GLY B 1 139 ? 1.618   35.775  9.742   1.000 18.039 0 138 GLY B H    1 c 
ATOM   4253 H  HA2  . GLY B 1 139 ? 1.748   36.343  7.641   1.000 17.929 0 138 GLY B HA2  1 c 
ATOM   4254 H  HA3  . GLY B 1 139 ? 1.599   34.806  7.235   1.000 17.919 0 138 GLY B HA3  1 c 
ATOM   4255 N  N    . ASN B 1 140 ? -1.198  35.958  8.149   1.000 20.188 0 139 ASN B N    1 ? 
ATOM   4256 C  CA   . ASN B 1 140 ? -2.600  36.353  7.814   1.000 20.045 0 139 ASN B CA   1 ? 
ATOM   4257 C  C    . ASN B 1 140 ? -3.272  35.320  6.885   1.000 19.883 0 139 ASN B C    1 ? 
ATOM   4258 O  O    . ASN B 1 140 ? -4.081  35.740  6.050   1.000 20.676 0 139 ASN B O    1 ? 
ATOM   4259 C  CB   . ASN B 1 140 ? -2.667  37.744  7.167   1.000 21.807 0 139 ASN B CB   1 ? 
ATOM   4260 C  CG   . ASN B 1 140 ? -2.257  38.876  8.086   1.000 23.696 0 139 ASN B CG   1 ? 
ATOM   4261 O  OD1  . ASN B 1 140 ? -2.970  39.221  9.030   1.000 26.021 0 139 ASN B OD1  1 ? 
ATOM   4262 N  ND2  . ASN B 1 140 ? -1.129  39.499  7.789   1.000 24.499 0 139 ASN B ND2  1 ? 
ATOM   4263 H  H    . ASN B 1 140 ? -1.067  35.840  9.041   1.000 19.488 0 139 ASN B H    1 c 
ATOM   4264 H  HA   . ASN B 1 140 ? -3.113  36.393  8.655   1.000 20.398 0 139 ASN B HA   1 c 
ATOM   4265 H  HB2  . ASN B 1 140 ? -2.091  37.750  6.376   1.000 21.793 0 139 ASN B HB2  1 c 
ATOM   4266 H  HB3  . ASN B 1 140 ? -3.585  37.906  6.869   1.000 21.793 0 139 ASN B HB3  1 c 
ATOM   4267 H  HD21 . ASN B 1 140 ? -0.733  40.007  8.396   1.000 24.268 0 139 ASN B HD21 1 c 
ATOM   4268 H  HD22 . ASN B 1 140 ? -0.772  39.411  6.986   1.000 24.227 0 139 ASN B HD22 1 c 
ATOM   4269 N  N    . ALA B 1 141 ? -3.028  34.016  7.072   1.000 18.406 0 140 ALA B N    1 ? 
ATOM   4270 C  CA   . ALA B 1 141 ? -3.561  32.920  6.216   1.000 17.734 0 140 ALA B CA   1 ? 
ATOM   4271 C  C    . ALA B 1 141 ? -4.937  32.425  6.704   1.000 18.914 0 140 ALA B C    1 ? 
ATOM   4272 O  O    . ALA B 1 141 ? -5.535  31.554  6.049   1.000 18.974 0 140 ALA B O    1 ? 
ATOM   4273 C  CB   . ALA B 1 141 ? -2.531  31.816  6.186   1.000 17.796 0 140 ALA B CB   1 ? 
ATOM   4274 H  H    . ALA B 1 141 ? -2.515  33.701  7.756   1.000 18.579 0 140 ALA B H    1 c 
ATOM   4275 H  HA   . ALA B 1 141 ? -3.669  33.270  5.300   1.000 18.100 0 140 ALA B HA   1 c 
ATOM   4276 H  HB1  . ALA B 1 141 ? -2.835  31.102  5.600   1.000 17.779 0 140 ALA B HB1  1 c 
ATOM   4277 H  HB2  . ALA B 1 141 ? -1.687  32.167  5.855   1.000 17.779 0 140 ALA B HB2  1 c 
ATOM   4278 H  HB3  . ALA B 1 141 ? -2.404  31.464  7.083   1.000 17.783 0 140 ALA B HB3  1 c 
ATOM   4279 N  N    . GLY B 1 142 ? -5.429  32.938  7.840   1.000 19.917 0 141 GLY B N    1 ? 
ATOM   4280 C  CA   . GLY B 1 142 ? -6.802  32.706  8.336   1.000 19.231 0 141 GLY B CA   1 ? 
ATOM   4281 C  C    . GLY B 1 142 ? -7.039  31.267  8.799   1.000 18.914 0 141 GLY B C    1 ? 
ATOM   4282 O  O    . GLY B 1 142 ? -6.108  30.623  9.295   1.000 18.759 0 141 GLY B O    1 ? 
ATOM   4283 H  H    . GLY B 1 142 ? -4.929  33.463  8.390   1.000 19.512 0 141 GLY B H    1 c 
ATOM   4284 H  HA2  . GLY B 1 142 ? -6.977  33.323  9.090   1.000 19.346 0 141 GLY B HA2  1 c 
ATOM   4285 H  HA3  . GLY B 1 142 ? -7.442  32.924  7.613   1.000 19.321 0 141 GLY B HA3  1 c 
ATOM   4286 N  N    . SER B 1 143 ? -8.264  30.772  8.625   1.000 20.218 0 142 SER B N    1 ? 
ATOM   4287 C  CA   . SER B 1 143 ? -8.778  29.546  9.280   1.000 18.805 0 142 SER B CA   1 ? 
ATOM   4288 C  C    . SER B 1 143 ? -8.075  28.297  8.720   1.000 18.103 0 142 SER B C    1 ? 
ATOM   4289 O  O    . SER B 1 143 ? -7.429  28.369  7.630   1.000 16.067 0 142 SER B O    1 ? 
ATOM   4290 C  CB   . SER B 1 143 ? -10.296 29.447  9.175   1.000 22.435 0 142 SER B CB   1 ? 
ATOM   4291 O  OG   . SER B 1 143 ? -10.698 28.950  7.908   1.000 23.552 0 142 SER B OG   1 ? 
ATOM   4292 H  H    . SER B 1 143 ? -8.885  31.159  8.077   1.000 19.578 0 142 SER B H    1 c 
ATOM   4293 H  HA   . SER B 1 143 ? -8.548  29.609  10.240  1.000 19.577 0 142 SER B HA   1 c 
ATOM   4294 H  HB2  . SER B 1 143 ? -10.632 28.846  9.885   1.000 21.768 0 142 SER B HB2  1 c 
ATOM   4295 H  HB3  . SER B 1 143 ? -10.693 30.342  9.319   1.000 21.763 0 142 SER B HB3  1 c 
ATOM   4296 H  HG   . SER B 1 143 ? -11.563 28.959  7.986   0.000 24.190 0 142 SER B HG   1 c 
ATOM   4297 N  N    . ARG B 1 144 ? -8.206  27.190  9.455   1.000 16.200 0 143 ARG B N    1 ? 
ATOM   4298 C  CA   . ARG B 1 144 ? -7.537  25.899  9.167   1.000 15.357 0 143 ARG B CA   1 ? 
ATOM   4299 C  C    . ARG B 1 144 ? -8.562  24.983  8.477   1.000 14.754 0 143 ARG B C    1 ? 
ATOM   4300 O  O    . ARG B 1 144 ? -9.459  24.507  9.161   1.000 14.847 0 143 ARG B O    1 ? 
ATOM   4301 C  CB   . ARG B 1 144 ? -6.952  25.349  10.478  1.000 15.309 0 143 ARG B CB   1 ? 
ATOM   4302 C  CG   . ARG B 1 144 ? -6.030  26.321  11.215  1.000 14.322 0 143 ARG B CG   1 ? 
ATOM   4303 C  CD   . ARG B 1 144 ? -5.582  25.883  12.609  1.000 14.061 0 143 ARG B CD   1 ? 
ATOM   4304 N  NE   . ARG B 1 144 ? -4.722  26.928  13.191  1.000 14.049 0 143 ARG B NE   1 ? 
ATOM   4305 C  CZ   . ARG B 1 144 ? -3.876  26.768  14.206  1.000 13.078 0 143 ARG B CZ   1 ? 
ATOM   4306 N  NH1  . ARG B 1 144 ? -3.689  25.573  14.751  1.000 11.868 0 143 ARG B NH1  1 ? 
ATOM   4307 N  NH2  . ARG B 1 144 ? -3.197  27.813  14.643  1.000 12.859 0 143 ARG B NH2  1 ? 
ATOM   4308 H  H    . ARG B 1 144 ? -8.733  27.164  10.201  1.000 16.424 0 143 ARG B H    1 c 
ATOM   4309 H  HA   . ARG B 1 144 ? -6.793  26.068  8.538   1.000 15.386 0 143 ARG B HA   1 c 
ATOM   4310 H  HB2  . ARG B 1 144 ? -7.700  25.106  11.077  1.000 15.085 0 143 ARG B HB2  1 c 
ATOM   4311 H  HB3  . ARG B 1 144 ? -6.447  24.523  10.275  1.000 15.083 0 143 ARG B HB3  1 c 
ATOM   4312 H  HG2  . ARG B 1 144 ? -5.224  26.471  10.663  1.000 14.484 0 143 ARG B HG2  1 c 
ATOM   4313 H  HG3  . ARG B 1 144 ? -6.493  27.192  11.300  1.000 14.488 0 143 ARG B HG3  1 c 
ATOM   4314 H  HD2  . ARG B 1 144 ? -6.373  25.742  13.186  1.000 14.119 0 143 ARG B HD2  1 c 
ATOM   4315 H  HD3  . ARG B 1 144 ? -5.084  25.031  12.546  1.000 14.111 0 143 ARG B HD3  1 c 
ATOM   4316 H  HE   . ARG B 1 144 ? -4.817  27.762  12.868  1.000 13.739 0 143 ARG B HE   1 c 
ATOM   4317 H  HH11 . ARG B 1 144 ? -4.156  24.862  14.461  1.000 12.324 0 143 ARG B HH11 1 c 
ATOM   4318 H  HH12 . ARG B 1 144 ? -3.105  25.479  15.428  1.000 12.320 0 143 ARG B HH12 1 c 
ATOM   4319 H  HH21 . ARG B 1 144 ? -3.314  28.618  14.261  1.000 12.936 0 143 ARG B HH21 1 c 
ATOM   4320 H  HH22 . ARG B 1 144 ? -2.603  27.714  15.311  1.000 12.936 0 143 ARG B HH22 1 c 
ATOM   4321 N  N    . LEU B 1 145 ? -8.424  24.772  7.166   1.000 13.602 0 144 LEU B N    1 ? 
ATOM   4322 C  CA   . LEU B 1 145 ? -9.392  24.025  6.309   1.000 14.756 0 144 LEU B CA   1 ? 
ATOM   4323 C  C    . LEU B 1 145 ? -9.265  22.515  6.562   1.000 13.354 0 144 LEU B C    1 ? 
ATOM   4324 O  O    . LEU B 1 145 ? -10.279 21.789  6.487   1.000 14.481 0 144 LEU B O    1 ? 
ATOM   4325 C  CB   . LEU B 1 145 ? -9.113  24.291  4.818   1.000 15.649 0 144 LEU B CB   1 ? 
ATOM   4326 C  CG   . LEU B 1 145 ? -9.170  25.738  4.311   1.000 16.903 0 144 LEU B CG   1 ? 
ATOM   4327 C  CD1  . LEU B 1 145 ? -9.034  25.796  2.782   1.000 18.893 0 144 LEU B CD1  1 ? 
ATOM   4328 C  CD2  . LEU B 1 145 ? -10.427 26.475  4.753   1.000 17.683 0 144 LEU B CD2  1 ? 
ATOM   4329 H  H    . LEU B 1 145 ? -7.703  25.082  6.702   1.000 14.144 0 144 LEU B H    1 c 
ATOM   4330 H  HA   . LEU B 1 145 ? -10.306 24.314  6.536   1.000 14.424 0 144 LEU B HA   1 c 
ATOM   4331 H  HB2  . LEU B 1 145 ? -8.224  23.937  4.615   1.000 15.712 0 144 LEU B HB2  1 c 
ATOM   4332 H  HB3  . LEU B 1 145 ? -9.754  23.767  4.298   1.000 15.715 0 144 LEU B HB3  1 c 
ATOM   4333 H  HG   . LEU B 1 145 ? -8.396  26.217  4.697   1.000 17.157 0 144 LEU B HG   1 c 
ATOM   4334 H  HD11 . LEU B 1 145 ? -8.168  25.440  2.520   1.000 18.259 0 144 LEU B HD11 1 c 
ATOM   4335 H  HD12 . LEU B 1 145 ? -9.109  26.719  2.483   1.000 18.255 0 144 LEU B HD12 1 c 
ATOM   4336 H  HD13 . LEU B 1 145 ? -9.740  25.266  2.374   1.000 18.258 0 144 LEU B HD13 1 c 
ATOM   4337 H  HD21 . LEU B 1 145 ? -11.212 25.966  4.485   1.000 17.440 0 144 LEU B HD21 1 c 
ATOM   4338 H  HD22 . LEU B 1 145 ? -10.454 27.353  4.336   1.000 17.442 0 144 LEU B HD22 1 c 
ATOM   4339 H  HD23 . LEU B 1 145 ? -10.422 26.576  5.721   1.000 17.432 0 144 LEU B HD23 1 c 
ATOM   4340 N  N    . ALA B 1 146 ? -8.042  22.024  6.711   1.000 13.218 0 145 ALA B N    1 ? 
ATOM   4341 C  CA   . ALA B 1 146 ? -7.726  20.583  6.826   1.000 12.345 0 145 ALA B CA   1 ? 
ATOM   4342 C  C    . ALA B 1 146 ? -6.341  20.422  7.452   1.000 12.098 0 145 ALA B C    1 ? 
ATOM   4343 O  O    . ALA B 1 146 ? -5.487  21.362  7.351   1.000 11.803 0 145 ALA B O    1 ? 
ATOM   4344 C  CB   . ALA B 1 146 ? -7.843  19.882  5.490   1.000 12.985 0 145 ALA B CB   1 ? 
ATOM   4345 H  H    . ALA B 1 146 ? -7.295  22.546  6.743   1.000 13.038 0 145 ALA B H    1 c 
ATOM   4346 H  HA   . ALA B 1 146 ? -8.383  20.182  7.441   1.000 12.601 0 145 ALA B HA   1 c 
ATOM   4347 H  HB1  . ALA B 1 146 ? -7.626  18.941  5.597   1.000 12.786 0 145 ALA B HB1  1 c 
ATOM   4348 H  HB2  . ALA B 1 146 ? -8.753  19.968  5.157   1.000 12.788 0 145 ALA B HB2  1 c 
ATOM   4349 H  HB3  . ALA B 1 146 ? -7.228  20.286  4.856   1.000 12.786 0 145 ALA B HB3  1 c 
ATOM   4350 N  N    . CYS B 1 147 ? -6.168  19.296  8.135   1.000 12.781 0 146 CYS B N    1 ? 
ATOM   4351 C  CA   . CYS B 1 147 ? -4.938  18.970  8.891   1.000 12.931 0 146 CYS B CA   1 ? 
ATOM   4352 C  C    . CYS B 1 147 ? -4.805  17.464  9.129   1.000 12.047 0 146 CYS B C    1 ? 
ATOM   4353 O  O    . CYS B 1 147 ? -5.756  16.690  8.880   1.000 11.607 0 146 CYS B O    1 ? 
ATOM   4354 C  CB   . CYS B 1 147 ? -4.872  19.761  10.196  1.000 14.372 0 146 CYS B CB   1 ? 
ATOM   4355 S  SG   . CYS B 1 147 ? -6.203  19.443  11.385  1.000 15.937 0 146 CYS B SG   1 ? 
ATOM   4356 H  H    . CYS B 1 147 ? -6.801  18.639  8.192   1.000 12.650 0 146 CYS B H    1 c 
ATOM   4357 H  HA   . CYS B 1 147 ? -4.173  19.252  8.332   1.000 12.986 0 146 CYS B HA   1 c 
ATOM   4358 H  HB2  . CYS B 1 147 ? -4.011  19.563  10.641  1.000 14.353 0 146 CYS B HB2  1 c 
ATOM   4359 H  HB3  . CYS B 1 147 ? -4.880  20.726  9.980   1.000 14.357 0 146 CYS B HB3  1 c 
ATOM   4360 N  N    . GLY B 1 148 ? -3.614  17.045  9.526   1.000 12.463 0 147 GLY B N    1 ? 
ATOM   4361 C  CA   . GLY B 1 148 ? -3.370  15.679  10.013  1.000 13.447 0 147 GLY B CA   1 ? 
ATOM   4362 C  C    . GLY B 1 148 ? -2.043  15.631  10.715  1.000 13.415 0 147 GLY B C    1 ? 
ATOM   4363 O  O    . GLY B 1 148 ? -1.269  16.640  10.610  1.000 14.312 0 147 GLY B O    1 ? 
ATOM   4364 H  H    . GLY B 1 148 ? -2.879  17.584  9.513   1.000 12.590 0 147 GLY B H    1 c 
ATOM   4365 H  HA2  . GLY B 1 148 ? -4.091  15.418  10.639  1.000 13.221 0 147 GLY B HA2  1 c 
ATOM   4366 H  HA3  . GLY B 1 148 ? -3.367  15.052  9.249   1.000 13.210 0 147 GLY B HA3  1 c 
ATOM   4367 N  N    . VAL B 1 149 ? -1.774  14.508  11.381  1.000 13.338 0 148 VAL B N    1 ? 
ATOM   4368 C  CA   . VAL B 1 149 ? -0.475  14.272  12.053  1.000 12.748 0 148 VAL B CA   1 ? 
ATOM   4369 C  C    . VAL B 1 149 ? 0.502   13.662  11.057  1.000 12.763 0 148 VAL B C    1 ? 
ATOM   4370 O  O    . VAL B 1 149 ? 0.073   12.851  10.233  1.000 12.075 0 148 VAL B O    1 ? 
ATOM   4371 C  CB   . VAL B 1 149 ? -0.662  13.425  13.315  1.000 12.638 0 148 VAL B CB   1 ? 
ATOM   4372 C  CG1  . VAL B 1 149 ? 0.674   13.138  13.995  1.000 11.842 0 148 VAL B CG1  1 ? 
ATOM   4373 C  CG2  . VAL B 1 149 ? -1.629  14.137  14.257  1.000 13.042 0 148 VAL B CG2  1 ? 
ATOM   4374 H  H    . VAL B 1 149 ? -2.367  13.821  11.462  1.000 13.213 0 148 VAL B H    1 c 
ATOM   4375 H  HA   . VAL B 1 149 ? -0.122  15.137  12.327  1.000 12.839 0 148 VAL B HA   1 c 
ATOM   4376 H  HB   . VAL B 1 149 ? -1.068  12.565  13.047  1.000 12.579 0 148 VAL B HB   1 c 
ATOM   4377 H  HG11 . VAL B 1 149 ? 1.203   12.541  13.437  1.000 12.083 0 148 VAL B HG11 1 c 
ATOM   4378 H  HG12 . VAL B 1 149 ? 0.515   12.717  14.858  1.000 12.081 0 148 VAL B HG12 1 c 
ATOM   4379 H  HG13 . VAL B 1 149 ? 1.158   13.972  14.126  1.000 12.081 0 148 VAL B HG13 1 c 
ATOM   4380 H  HG21 . VAL B 1 149 ? -1.304  15.037  14.436  1.000 12.915 0 148 VAL B HG21 1 c 
ATOM   4381 H  HG22 . VAL B 1 149 ? -1.690  13.643  15.093  1.000 12.915 0 148 VAL B HG22 1 c 
ATOM   4382 H  HG23 . VAL B 1 149 ? -2.509  14.186  13.846  1.000 12.916 0 148 VAL B HG23 1 c 
ATOM   4383 N  N    . ILE B 1 150 ? 1.776   14.030  11.190  1.000 12.933 0 149 ILE B N    1 ? 
ATOM   4384 C  CA   . ILE B 1 150 ? 2.891   13.585  10.302  1.000 13.083 0 149 ILE B CA   1 ? 
ATOM   4385 C  C    . ILE B 1 150 ? 3.511   12.305  10.897  1.000 12.326 0 149 ILE B C    1 ? 
ATOM   4386 O  O    . ILE B 1 150 ? 4.126   12.367  11.972  1.000 12.435 0 149 ILE B O    1 ? 
ATOM   4387 C  CB   . ILE B 1 150 ? 3.916   14.713  10.086  1.000 12.384 0 149 ILE B CB   1 ? 
ATOM   4388 C  CG1  . ILE B 1 150 ? 3.258   15.984  9.526   1.000 12.947 0 149 ILE B CG1  1 ? 
ATOM   4389 C  CG2  . ILE B 1 150 ? 5.064   14.233  9.184   1.000 11.910 0 149 ILE B CG2  1 ? 
ATOM   4390 C  CD1  . ILE B 1 150 ? 4.189   17.175  9.488   1.000 13.349 0 149 ILE B CD1  1 ? 
ATOM   4391 H  H    . ILE B 1 150 ? 2.053   14.591  11.853  1.000 12.926 0 149 ILE B H    1 c 
ATOM   4392 H  HA   . ILE B 1 150 ? 2.511   13.361  9.434   1.000 12.769 0 149 ILE B HA   1 c 
ATOM   4393 H  HB   . ILE B 1 150 ? 4.300   14.941  10.968  1.000 12.528 0 149 ILE B HB   1 c 
ATOM   4394 H  HG12 . ILE B 1 150 ? 2.941   15.802  8.616   1.000 12.905 0 149 ILE B HG12 1 c 
ATOM   4395 H  HG13 . ILE B 1 150 ? 2.480   16.210  10.078  1.000 12.905 0 149 ILE B HG13 1 c 
ATOM   4396 H  HG21 . ILE B 1 150 ? 5.510   13.474  9.597   1.000 12.056 0 149 ILE B HG21 1 c 
ATOM   4397 H  HG22 . ILE B 1 150 ? 5.707   14.952  9.060   1.000 12.060 0 149 ILE B HG22 1 c 
ATOM   4398 H  HG23 . ILE B 1 150 ? 4.709   13.966  8.318   1.000 12.055 0 149 ILE B HG23 1 c 
ATOM   4399 H  HD11 . ILE B 1 150 ? 4.611   17.286  10.359  1.000 13.224 0 149 ILE B HD11 1 c 
ATOM   4400 H  HD12 . ILE B 1 150 ? 3.682   17.977  9.271   1.000 13.224 0 149 ILE B HD12 1 c 
ATOM   4401 H  HD13 . ILE B 1 150 ? 4.873   17.034  8.812   1.000 13.222 0 149 ILE B HD13 1 c 
ATOM   4402 N  N    . GLY B 1 151 ? 3.276   11.155  10.259  1.000 12.275 0 150 GLY B N    1 ? 
ATOM   4403 C  CA   . GLY B 1 151 ? 3.726   9.848   10.764  1.000 12.546 0 150 GLY B CA   1 ? 
ATOM   4404 C  C    . GLY B 1 151 ? 4.863   9.233   9.982   1.000 13.457 0 150 GLY B C    1 ? 
ATOM   4405 O  O    . GLY B 1 151 ? 5.047   9.561   8.789   1.000 12.976 0 150 GLY B O    1 ? 
ATOM   4406 H  H    . GLY B 1 151 ? 2.822   11.118  9.470   1.000 12.352 0 150 GLY B H    1 c 
ATOM   4407 H  HA2  . GLY B 1 151 ? 4.004   9.950   11.708  1.000 12.692 0 150 GLY B HA2  1 c 
ATOM   4408 H  HA3  . GLY B 1 151 ? 2.958   9.229   10.750  1.000 12.692 0 150 GLY B HA3  1 c 
ATOM   4409 N  N    . ILE B 1 152 ? 5.561   8.281   10.614  1.000 14.325 0 151 ILE B N    1 ? 
ATOM   4410 C  CA   . ILE B 1 152 ? 6.664   7.501   10.004  1.000 14.634 0 151 ILE B CA   1 ? 
ATOM   4411 C  C    . ILE B 1 152 ? 6.067   6.593   8.924   1.000 15.105 0 151 ILE B C    1 ? 
ATOM   4412 O  O    . ILE B 1 152 ? 5.102   5.950   9.190   1.000 13.814 0 151 ILE B O    1 ? 
ATOM   4413 C  CB   . ILE B 1 152 ? 7.424   6.735   11.108  1.000 15.492 0 151 ILE B CB   1 ? 
ATOM   4414 C  CG1  . ILE B 1 152 ? 8.064   7.748   12.065  1.000 15.691 0 151 ILE B CG1  1 ? 
ATOM   4415 C  CG2  . ILE B 1 152 ? 8.443   5.794   10.505  1.000 15.978 0 151 ILE B CG2  1 ? 
ATOM   4416 C  CD1  . ILE B 1 152 ? 8.543   7.183   13.384  1.000 15.569 0 151 ILE B CD1  1 ? 
ATOM   4417 H  H    . ILE B 1 152 ? 5.376   8.036   11.472  1.000 14.192 0 151 ILE B H    1 c 
ATOM   4418 H  HA   . ILE B 1 152 ? 7.282   8.123   9.581   1.000 14.824 0 151 ILE B HA   1 c 
ATOM   4419 H  HB   . ILE B 1 152 ? 6.769   6.199   11.619  1.000 15.450 0 151 ILE B HB   1 c 
ATOM   4420 H  HG12 . ILE B 1 152 ? 8.828   8.162   11.611  1.000 15.614 0 151 ILE B HG12 1 c 
ATOM   4421 H  HG13 . ILE B 1 152 ? 7.414   8.456   12.254  1.000 15.605 0 151 ILE B HG13 1 c 
ATOM   4422 H  HG21 . ILE B 1 152 ? 7.989   5.092   10.007  1.000 15.826 0 151 ILE B HG21 1 c 
ATOM   4423 H  HG22 . ILE B 1 152 ? 8.975   5.392   11.213  1.000 15.827 0 151 ILE B HG22 1 c 
ATOM   4424 H  HG23 . ILE B 1 152 ? 9.028   6.289   9.904   1.000 15.828 0 151 ILE B HG23 1 c 
ATOM   4425 H  HD11 . ILE B 1 152 ? 7.807   6.732   13.832  1.000 15.609 0 151 ILE B HD11 1 c 
ATOM   4426 H  HD12 . ILE B 1 152 ? 8.871   7.905   13.948  1.000 15.609 0 151 ILE B HD12 1 c 
ATOM   4427 H  HD13 . ILE B 1 152 ? 9.262   6.546   13.225  1.000 15.609 0 151 ILE B HD13 1 c 
ATOM   4428 N  N    . ALA B 1 153 ? 6.645   6.616   7.724   1.000 14.953 0 152 ALA B N    1 ? 
ATOM   4429 C  CA   . ALA B 1 153 ? 6.169   5.868   6.544   1.000 16.082 0 152 ALA B CA   1 ? 
ATOM   4430 C  C    . ALA B 1 153 ? 7.194   4.789   6.199   1.000 16.087 0 152 ALA B C    1 ? 
ATOM   4431 O  O    . ALA B 1 153 ? 8.362   4.916   6.547   1.000 16.646 0 152 ALA B O    1 ? 
ATOM   4432 C  CB   . ALA B 1 153 ? 5.992   6.828   5.388   1.000 15.574 0 152 ALA B CB   1 ? 
ATOM   4433 H  H    . ALA B 1 153 ? 7.393   7.103   7.543   1.000 15.251 0 152 ALA B H    1 c 
ATOM   4434 H  HA   . ALA B 1 153 ? 5.306   5.441   6.752   1.000 15.759 0 152 ALA B HA   1 c 
ATOM   4435 H  HB1  . ALA B 1 153 ? 5.617   6.354   4.627   1.000 15.730 0 152 ALA B HB1  1 c 
ATOM   4436 H  HB2  . ALA B 1 153 ? 5.389   7.544   5.650   1.000 15.729 0 152 ALA B HB2  1 c 
ATOM   4437 H  HB3  . ALA B 1 153 ? 6.853   7.203   5.142   1.000 15.733 0 152 ALA B HB3  1 c 
ATOM   4438 N  N    . GLN B 1 154 ? 6.757   3.777   5.470   1.000 17.563 0 153 GLN B N    1 ? 
ATOM   4439 C  CA   . GLN B 1 154 ? 7.539   2.558   5.155   1.000 19.042 0 153 GLN B CA   1 ? 
ATOM   4440 C  C    . GLN B 1 154 ? 8.499   2.871   3.996   1.000 21.426 0 153 GLN B C    1 ? 
ATOM   4441 O  O    . GLN B 1 154 ? 8.181   3.615   3.056   1.000 24.845 0 153 GLN B O    1 ? 
ATOM   4442 C  CB   . GLN B 1 154 ? 6.508   1.451   4.888   1.000 19.095 0 153 GLN B CB   1 ? 
ATOM   4443 C  CG   . GLN B 1 154 ? 6.954   0.300   4.016   1.000 20.403 0 153 GLN B CG   1 ? 
ATOM   4444 C  CD   . GLN B 1 154 ? 5.738   -0.511  3.620   1.000 20.586 0 153 GLN B CD   1 ? 
ATOM   4445 O  OE1  . GLN B 1 154 ? 4.774   -0.642  4.379   1.000 20.652 0 153 GLN B OE1  1 ? 
ATOM   4446 N  NE2  . GLN B 1 154 ? 5.731   -0.979  2.386   1.000 20.937 0 153 GLN B NE2  1 ? 
ATOM   4447 O  OXT  . GLN B 1 154 ? 9.626   2.363   3.981   1.000 23.716 0 153 GLN B OXT  1 ? 
ATOM   4448 H  H    . GLN B 1 154 ? 5.926   3.780   5.099   1.000 17.540 0 153 GLN B H    1 c 
ATOM   4449 H  HA   . GLN B 1 154 ? 8.070   2.315   5.947   1.000 19.177 0 153 GLN B HA   1 c 
ATOM   4450 H  HB2  . GLN B 1 154 ? 6.219   1.095   5.749   1.000 19.383 0 153 GLN B HB2  1 c 
ATOM   4451 H  HB3  . GLN B 1 154 ? 5.724   1.864   4.470   1.000 19.375 0 153 GLN B HB3  1 c 
ATOM   4452 H  HG2  . GLN B 1 154 ? 7.401   0.640   3.213   1.000 20.133 0 153 GLN B HG2  1 c 
ATOM   4453 H  HG3  . GLN B 1 154 ? 7.585   -0.267  4.509   1.000 20.128 0 153 GLN B HG3  1 c 
ATOM   4454 H  HE21 . GLN B 1 154 ? 5.002   -1.362  2.063   1.000 20.824 0 153 GLN B HE21 1 c 
ATOM   4455 H  HE22 . GLN B 1 154 ? 6.455   -0.912  1.881   1.000 20.822 0 153 GLN B HE22 1 c 
HETATM 4456 C  C    . ACT C 2 .   ? 10.085  -2.200  13.533  1.000 16.368 0 201 ACT A C    1 ? 
HETATM 4457 O  O    . ACT C 2 .   ? 10.967  -2.311  12.616  1.000 18.277 0 201 ACT A O    1 ? 
HETATM 4458 O  OXT  . ACT C 2 .   ? 8.940   -2.813  13.581  1.000 17.296 0 201 ACT A OXT  1 ? 
HETATM 4459 C  CH3  . ACT C 2 .   ? 10.344  -1.132  14.548  1.000 14.434 0 201 ACT A CH3  1 ? 
HETATM 4460 H  H1   . ACT C 2 .   ? 9.825   -1.314  15.348  1.000 14.996 0 201 ACT A H1   1 c 
HETATM 4461 H  H2   . ACT C 2 .   ? 10.088  -0.267  14.185  1.000 15.010 0 201 ACT A H2   1 c 
HETATM 4462 H  H3   . ACT C 2 .   ? 11.288  -1.122  14.775  1.000 15.025 0 201 ACT A H3   1 c 
HETATM 4463 ZN ZN   . ZN  D 3 .   ? 2.941   -7.699  19.196  1.000 14.692 0 202 ZN  A ZN   1 ? 
HETATM 4464 CU CU   . CU  E 4 .   ? -2.696  -4.450  16.742  1.000 33.356 0 203 CU  A CU   1 ? 
HETATM 4465 S  S    . SO4 F 5 .   ? -5.376  -11.975 13.199  1.000 48.435 0 204 SO4 A S    1 ? 
HETATM 4466 O  O1   . SO4 F 5 .   ? -4.683  -10.733 13.425  1.000 51.753 0 204 SO4 A O1   1 ? 
HETATM 4467 O  O2   . SO4 F 5 .   ? -6.069  -11.916 11.939  1.000 51.308 0 204 SO4 A O2   1 ? 
HETATM 4468 O  O3   . SO4 F 5 .   ? -4.418  -13.061 13.182  1.000 47.535 0 204 SO4 A O3   1 ? 
HETATM 4469 O  O4   . SO4 F 5 .   ? -6.343  -12.189 14.252  1.000 43.328 0 204 SO4 A O4   1 ? 
HETATM 4470 S  S    . SO4 G 5 .   ? -8.362  -4.663  9.342   1.000 40.338 0 205 SO4 A S    1 ? 
HETATM 4471 O  O1   . SO4 G 5 .   ? -7.311  -3.846  8.786   1.000 46.043 0 205 SO4 A O1   1 ? 
HETATM 4472 O  O2   . SO4 G 5 .   ? -9.284  -5.041  8.294   1.000 47.699 0 205 SO4 A O2   1 ? 
HETATM 4473 O  O3   . SO4 G 5 .   ? -7.793  -5.850  9.929   1.000 43.912 0 205 SO4 A O3   1 ? 
HETATM 4474 O  O4   . SO4 G 5 .   ? -9.066  -3.924  10.340  1.000 36.485 0 205 SO4 A O4   1 ? 
HETATM 4475 ZN ZN   . ZN  H 3 .   ? 5.250   30.831  10.559  1.000 14.890 0 201 ZN  B ZN   1 ? 
HETATM 4476 CU CU   . CU  I 4 .   ? -0.601  27.321  9.560   1.000 34.858 0 202 CU  B CU   1 ? 
HETATM 4477 S  S    . SO4 J 5 .   ? -4.861  35.047  11.154  1.000 45.017 0 203 SO4 B S    1 ? 
HETATM 4478 O  O1   . SO4 J 5 .   ? -4.030  33.867  11.164  1.000 49.602 0 203 SO4 B O1   1 ? 
HETATM 4479 O  O2   . SO4 J 5 .   ? -5.264  35.334  9.794   1.000 45.931 0 203 SO4 B O2   1 ? 
HETATM 4480 O  O3   . SO4 J 5 .   ? -6.020  34.819  11.958  1.000 46.886 0 203 SO4 B O3   1 ? 
HETATM 4481 O  O4   . SO4 J 5 .   ? -4.106  36.165  11.683  1.000 46.580 0 203 SO4 B O4   1 ? 
HETATM 4482 O  O    . HOH K 6 .   ? -2.526  14.231  26.163  1.000 20.335 0 301 HOH A O    1 ? 
HETATM 4483 O  O    . HOH K 6 .   ? -2.414  -3.180  29.133  1.000 16.661 0 302 HOH A O    1 ? 
HETATM 4484 O  O    . HOH K 6 .   ? -0.146  -13.791 12.218  1.000 27.894 0 303 HOH A O    1 ? 
HETATM 4485 O  O    . HOH K 6 .   ? -1.092  18.671  26.497  1.000 49.107 0 304 HOH A O    1 ? 
HETATM 4486 O  O    . HOH K 6 .   ? -15.366 7.565   25.589  1.000 38.636 0 305 HOH A O    1 ? 
HETATM 4487 O  O    . HOH K 6 .   ? 11.497  10.729  26.884  1.000 36.386 0 306 HOH A O    1 ? 
HETATM 4488 O  O    . HOH K 6 .   ? 18.418  2.774   23.393  1.000 32.830 0 307 HOH A O    1 ? 
HETATM 4489 O  O    . HOH K 6 .   ? 1.338   -13.718 27.816  1.000 37.413 0 308 HOH A O    1 ? 
HETATM 4490 O  O    . HOH K 6 .   ? -24.053 2.436   33.167  1.000 36.438 0 309 HOH A O    1 ? 
HETATM 4491 O  O    . HOH K 6 .   ? -6.221  -16.753 20.532  1.000 35.837 0 310 HOH A O    1 ? 
HETATM 4492 O  O    . HOH K 6 .   ? -20.290 3.295   31.150  1.000 29.327 0 311 HOH A O    1 ? 
HETATM 4493 O  O    . HOH K 6 .   ? -7.512  9.883   14.266  1.000 29.366 0 312 HOH A O    1 ? 
HETATM 4494 O  O    . HOH K 6 .   ? -15.097 5.755   14.564  1.000 16.242 0 313 HOH A O    1 ? 
HETATM 4495 O  O    . HOH K 6 .   ? 7.370   -5.239  30.270  1.000 29.895 0 314 HOH A O    1 ? 
HETATM 4496 O  O    . HOH K 6 .   ? -7.265  8.491   2.709   1.000 38.975 0 315 HOH A O    1 ? 
HETATM 4497 O  O    . HOH K 6 .   ? -4.687  -8.472  14.581  1.000 20.251 0 316 HOH A O    1 ? 
HETATM 4498 O  O    . HOH K 6 .   ? 8.909   -20.390 17.052  1.000 38.563 0 317 HOH A O    1 ? 
HETATM 4499 O  O    . HOH K 6 .   ? -18.113 -1.717  18.073  1.000 27.956 0 318 HOH A O    1 ? 
HETATM 4500 O  O    . HOH K 6 .   ? -0.115  -7.316  23.868  1.000 14.651 0 319 HOH A O    1 ? 
HETATM 4501 O  O    . HOH K 6 .   ? -13.362 -7.935  21.866  1.000 25.425 0 320 HOH A O    1 ? 
HETATM 4502 O  O    . HOH K 6 .   ? -8.265  6.553   32.873  1.000 35.003 0 321 HOH A O    1 ? 
HETATM 4503 O  O    . HOH K 6 .   ? 6.050   -13.863 23.728  1.000 25.598 0 322 HOH A O    1 ? 
HETATM 4504 O  O    . HOH K 6 .   ? -2.935  -15.692 9.193   1.000 35.026 0 323 HOH A O    1 ? 
HETATM 4505 O  O    . HOH K 6 .   ? -16.320 -8.143  23.067  1.000 24.923 0 324 HOH A O    1 ? 
HETATM 4506 O  O    . HOH K 6 .   ? -28.057 -6.713  26.919  1.000 23.457 0 325 HOH A O    1 ? 
HETATM 4507 O  O    . HOH K 6 .   ? -5.563  -6.485  11.245  1.000 26.812 0 326 HOH A O    1 ? 
HETATM 4508 O  O    . HOH K 6 .   ? 9.421   9.333   16.712  1.000 22.423 0 327 HOH A O    1 ? 
HETATM 4509 O  O    . HOH K 6 .   ? 2.307   1.254   5.181   1.000 16.938 0 328 HOH A O    1 ? 
HETATM 4510 O  O    . HOH K 6 .   ? -13.477 0.448   4.981   1.000 34.722 0 329 HOH A O    1 ? 
HETATM 4511 O  O    . HOH K 6 .   ? -8.434  -13.488 15.310  1.000 50.496 0 330 HOH A O    1 ? 
HETATM 4512 O  O    . HOH K 6 .   ? 1.550   5.714   1.884   1.000 22.852 0 331 HOH A O    1 ? 
HETATM 4513 O  O    . HOH K 6 .   ? 11.285  5.137   17.097  1.000 20.664 0 332 HOH A O    1 ? 
HETATM 4514 O  O    . HOH K 6 .   ? 6.523   0.526   34.344  1.000 30.639 0 333 HOH A O    1 ? 
HETATM 4515 O  O    . HOH K 6 .   ? 16.365  -6.058  15.559  1.000 29.048 0 334 HOH A O    1 ? 
HETATM 4516 O  O    . HOH K 6 .   ? -13.099 -3.849  11.757  1.000 33.965 0 335 HOH A O    1 ? 
HETATM 4517 O  O    . HOH K 6 .   ? -4.043  11.565  16.604  1.000 11.010 0 336 HOH A O    1 ? 
HETATM 4518 O  O    . HOH K 6 .   ? 13.256  2.201   16.279  1.000 24.355 0 337 HOH A O    1 ? 
HETATM 4519 O  O    . HOH K 6 .   ? -10.015 10.532  26.864  1.000 24.627 0 338 HOH A O    1 ? 
HETATM 4520 O  O    . HOH K 6 .   ? -12.224 -0.074  31.690  1.000 33.774 0 339 HOH A O    1 ? 
HETATM 4521 O  O    . HOH K 6 .   ? -3.969  -3.765  3.490   1.000 21.866 0 340 HOH A O    1 ? 
HETATM 4522 O  O    . HOH K 6 .   ? -8.367  -13.776 20.442  1.000 23.601 0 341 HOH A O    1 ? 
HETATM 4523 O  O    . HOH K 6 .   ? 2.691   -1.999  30.952  1.000 21.431 0 342 HOH A O    1 ? 
HETATM 4524 O  O    . HOH K 6 .   ? 10.723  -1.604  8.565   1.000 23.250 0 343 HOH A O    1 ? 
HETATM 4525 O  O    . HOH K 6 .   ? -6.337  15.179  25.434  1.000 26.692 0 344 HOH A O    1 ? 
HETATM 4526 O  O    . HOH K 6 .   ? -13.744 8.003   10.784  1.000 35.695 0 345 HOH A O    1 ? 
HETATM 4527 O  O    . HOH K 6 .   ? -10.621 -6.665  32.557  1.000 18.161 0 346 HOH A O    1 ? 
HETATM 4528 O  O    . HOH K 6 .   ? 3.829   3.726   5.230   1.000 14.255 0 347 HOH A O    1 ? 
HETATM 4529 O  O    . HOH K 6 .   ? -0.558  19.054  32.893  1.000 35.194 0 348 HOH A O    1 ? 
HETATM 4530 O  O    . HOH K 6 .   ? -2.530  0.784   2.555   1.000 22.919 0 349 HOH A O    1 ? 
HETATM 4531 O  O    . HOH K 6 .   ? -16.250 -9.186  12.257  1.000 39.738 0 350 HOH A O    1 ? 
HETATM 4532 O  O    . HOH K 6 .   ? 14.410  6.969   25.768  1.000 30.107 0 351 HOH A O    1 ? 
HETATM 4533 O  O    . HOH K 6 .   ? -11.729 0.528   11.083  1.000 32.322 0 352 HOH A O    1 ? 
HETATM 4534 O  O    . HOH K 6 .   ? -3.088  -7.763  16.703  1.000 30.254 0 353 HOH A O    1 ? 
HETATM 4535 O  O    . HOH K 6 .   ? 1.103   -19.649 21.172  1.000 34.811 0 354 HOH A O    1 ? 
HETATM 4536 O  O    . HOH K 6 .   ? -8.758  0.072   3.067   1.000 21.828 0 355 HOH A O    1 ? 
HETATM 4537 O  O    . HOH K 6 .   ? -1.224  -4.209  8.099   1.000 13.735 0 356 HOH A O    1 ? 
HETATM 4538 O  O    . HOH K 6 .   ? 14.295  4.576   23.300  1.000 22.805 0 357 HOH A O    1 ? 
HETATM 4539 O  O    . HOH K 6 .   ? -7.919  -4.478  30.204  1.000 28.633 0 358 HOH A O    1 ? 
HETATM 4540 O  O    . HOH K 6 .   ? 10.966  12.268  20.609  1.000 26.044 0 359 HOH A O    1 ? 
HETATM 4541 O  O    . HOH K 6 .   ? 7.392   -2.144  31.342  1.000 20.762 0 360 HOH A O    1 ? 
HETATM 4542 O  O    . HOH K 6 .   ? 13.687  -2.972  25.479  1.000 24.880 0 361 HOH A O    1 ? 
HETATM 4543 O  O    . HOH K 6 .   ? 10.985  -5.676  22.478  1.000 20.678 0 362 HOH A O    1 ? 
HETATM 4544 O  O    . HOH K 6 .   ? -0.973  8.931   8.070   1.000 10.527 0 363 HOH A O    1 ? 
HETATM 4545 O  O    . HOH K 6 .   ? 10.601  -4.857  19.750  1.000 9.001  0 364 HOH A O    1 ? 
HETATM 4546 O  O    . HOH K 6 .   ? 5.732   9.539   33.486  1.000 31.521 0 365 HOH A O    1 ? 
HETATM 4547 O  O    . HOH K 6 .   ? -11.811 -3.077  10.192  1.000 18.004 0 366 HOH A O    1 ? 
HETATM 4548 O  O    . HOH K 6 .   ? -7.719  7.985   12.247  1.000 32.087 0 367 HOH A O    1 ? 
HETATM 4549 O  O    . HOH K 6 .   ? -20.432 -3.939  32.349  1.000 27.191 0 368 HOH A O    1 ? 
HETATM 4550 O  O    . HOH K 6 .   ? -17.530 5.970   11.132  1.000 36.144 0 369 HOH A O    1 ? 
HETATM 4551 O  O    . HOH K 6 .   ? 6.542   -16.177 16.455  1.000 33.054 0 370 HOH A O    1 ? 
HETATM 4552 O  O    . HOH K 6 .   ? -20.186 5.662   19.564  1.000 32.783 0 371 HOH A O    1 ? 
HETATM 4553 O  O    . HOH K 6 .   ? -16.387 -3.729  19.542  1.000 19.368 0 372 HOH A O    1 ? 
HETATM 4554 O  O    A HOH K 6 .   ? -3.008  4.906   10.637  0.500 21.945 0 373 HOH A O    1 ? 
HETATM 4555 O  O    B HOH K 6 .   ? -3.794  6.374   11.739  0.500 19.977 0 373 HOH A O    1 ? 
HETATM 4556 O  O    . HOH K 6 .   ? 8.973   -13.840 28.226  1.000 19.008 0 374 HOH A O    1 ? 
HETATM 4557 O  O    . HOH K 6 .   ? -15.318 1.985   14.383  1.000 24.625 0 375 HOH A O    1 ? 
HETATM 4558 O  O    . HOH K 6 .   ? 17.989  5.180   22.230  1.000 23.624 0 376 HOH A O    1 ? 
HETATM 4559 O  O    . HOH K 6 .   ? -9.423  -0.700  30.131  1.000 19.337 0 377 HOH A O    1 ? 
HETATM 4560 O  O    . HOH K 6 .   ? 1.602   -11.730 35.337  1.000 38.530 0 378 HOH A O    1 ? 
HETATM 4561 O  O    . HOH K 6 .   ? 10.730  4.064   28.988  1.000 39.750 0 379 HOH A O    1 ? 
HETATM 4562 O  O    . HOH K 6 .   ? -4.638  -2.350  30.236  1.000 24.025 0 380 HOH A O    1 ? 
HETATM 4563 O  O    B HOH K 6 .   ? 11.719  7.919   36.477  0.500 17.987 0 381 HOH A O    1 ? 
HETATM 4564 O  O    . HOH K 6 .   ? -2.315  -13.009 11.106  1.000 19.704 0 382 HOH A O    1 ? 
HETATM 4565 O  O    . HOH K 6 .   ? 7.386   -8.428  13.913  1.000 18.886 0 383 HOH A O    1 ? 
HETATM 4566 O  O    . HOH K 6 .   ? -4.396  10.419  13.228  1.000 13.852 0 384 HOH A O    1 ? 
HETATM 4567 O  O    . HOH K 6 .   ? 13.147  8.786   17.871  1.000 30.888 0 385 HOH A O    1 ? 
HETATM 4568 O  O    . HOH K 6 .   ? -16.049 -6.346  18.790  1.000 23.598 0 386 HOH A O    1 ? 
HETATM 4569 O  O    . HOH K 6 .   ? 9.195   8.890   33.577  1.000 20.711 0 387 HOH A O    1 ? 
HETATM 4570 O  O    . HOH K 6 .   ? -7.916  7.725   5.394   1.000 37.426 0 388 HOH A O    1 ? 
HETATM 4571 O  O    . HOH K 6 .   ? 4.413   -3.790  31.827  1.000 29.511 0 389 HOH A O    1 ? 
HETATM 4572 O  O    . HOH K 6 .   ? 5.961   17.394  25.013  1.000 27.700 0 390 HOH A O    1 ? 
HETATM 4573 O  O    . HOH K 6 .   ? 6.746   -11.783 16.181  1.000 28.030 0 391 HOH A O    1 ? 
HETATM 4574 O  O    . HOH K 6 .   ? 12.631  1.468   26.934  1.000 37.723 0 392 HOH A O    1 ? 
HETATM 4575 O  O    . HOH K 6 .   ? -10.776 -13.294 11.765  1.000 40.248 0 393 HOH A O    1 ? 
HETATM 4576 O  O    . HOH K 6 .   ? 18.409  6.724   25.615  1.000 30.204 0 394 HOH A O    1 ? 
HETATM 4577 O  O    . HOH K 6 .   ? -0.151  14.270  27.966  1.000 37.658 0 395 HOH A O    1 ? 
HETATM 4578 O  O    . HOH K 6 .   ? 10.173  2.064   11.072  1.000 27.272 0 396 HOH A O    1 ? 
HETATM 4579 O  O    . HOH K 6 .   ? -2.795  -6.335  8.492   1.000 31.206 0 397 HOH A O    1 ? 
HETATM 4580 O  O    . HOH K 6 .   ? 2.577   -7.946  14.306  1.000 28.502 0 398 HOH A O    1 ? 
HETATM 4581 O  O    . HOH K 6 .   ? -3.474  -6.126  29.309  1.000 19.644 0 399 HOH A O    1 ? 
HETATM 4582 O  O    . HOH K 6 .   ? -12.093 -12.355 21.717  1.000 22.560 0 400 HOH A O    1 ? 
HETATM 4583 O  O    . HOH K 6 .   ? -4.929  -9.252  29.161  1.000 20.408 0 401 HOH A O    1 ? 
HETATM 4584 O  O    . HOH K 6 .   ? 0.887   -9.180  30.022  1.000 24.746 0 402 HOH A O    1 ? 
HETATM 4585 O  O    . HOH K 6 .   ? -9.992  2.209   9.040   1.000 29.196 0 403 HOH A O    1 ? 
HETATM 4586 O  O    . HOH K 6 .   ? -12.316 10.539  19.187  1.000 36.917 0 404 HOH A O    1 ? 
HETATM 4587 O  O    . HOH K 6 .   ? -14.069 2.852   35.356  1.000 28.252 0 405 HOH A O    1 ? 
HETATM 4588 O  O    . HOH K 6 .   ? 6.366   19.871  29.867  1.000 40.447 0 406 HOH A O    1 ? 
HETATM 4589 O  O    . HOH K 6 .   ? -22.058 -5.295  24.148  1.000 30.066 0 407 HOH A O    1 ? 
HETATM 4590 O  O    . HOH K 6 .   ? 12.663  4.141   27.625  1.000 37.070 0 408 HOH A O    1 ? 
HETATM 4591 O  O    . HOH K 6 .   ? -0.487  -0.981  33.704  1.000 21.837 0 409 HOH A O    1 ? 
HETATM 4592 O  O    . HOH K 6 .   ? -0.134  23.462  29.185  1.000 44.643 0 410 HOH A O    1 ? 
HETATM 4593 O  O    . HOH K 6 .   ? -6.412  -0.097  30.772  1.000 16.835 0 411 HOH A O    1 ? 
HETATM 4594 O  O    . HOH K 6 .   ? 15.082  11.217  20.299  1.000 43.696 0 412 HOH A O    1 ? 
HETATM 4595 O  O    . HOH K 6 .   ? 7.037   15.678  31.811  1.000 33.709 0 413 HOH A O    1 ? 
HETATM 4596 O  O    . HOH K 6 .   ? -5.001  0.259   36.292  1.000 34.521 0 414 HOH A O    1 ? 
HETATM 4597 O  O    . HOH K 6 .   ? -14.829 14.122  13.857  1.000 60.383 0 415 HOH A O    1 ? 
HETATM 4598 O  O    . HOH K 6 .   ? -6.116  -8.480  8.579   1.000 43.783 0 416 HOH A O    1 ? 
HETATM 4599 O  O    . HOH K 6 .   ? 8.456   -13.175 31.396  1.000 37.406 0 417 HOH A O    1 ? 
HETATM 4600 O  O    . HOH K 6 .   ? -22.245 -2.324  24.130  1.000 36.967 0 418 HOH A O    1 ? 
HETATM 4601 O  O    . HOH K 6 .   ? -2.617  -6.743  13.909  1.000 23.262 0 419 HOH A O    1 ? 
HETATM 4602 O  O    . HOH K 6 .   ? -5.654  -21.238 23.327  1.000 42.871 0 420 HOH A O    1 ? 
HETATM 4603 O  O    . HOH K 6 .   ? 0.012   -7.165  10.238  1.000 22.164 0 421 HOH A O    1 ? 
HETATM 4604 O  O    . HOH K 6 .   ? -7.136  -17.440 18.453  1.000 41.417 0 422 HOH A O    1 ? 
HETATM 4605 O  O    . HOH K 6 .   ? 16.888  8.421   24.442  1.000 35.019 0 423 HOH A O    1 ? 
HETATM 4606 O  O    . HOH K 6 .   ? -13.750 12.684  12.109  1.000 37.957 0 424 HOH A O    1 ? 
HETATM 4607 O  O    . HOH K 6 .   ? 1.366   1.925   2.714   1.000 28.239 0 425 HOH A O    1 ? 
HETATM 4608 O  O    . HOH K 6 .   ? -5.703  -22.754 16.729  1.000 44.502 0 426 HOH A O    1 ? 
HETATM 4609 O  O    . HOH K 6 .   ? -5.589  10.223  34.664  1.000 38.415 0 427 HOH A O    1 ? 
HETATM 4610 O  O    . HOH K 6 .   ? 18.000  -6.449  17.742  1.000 35.018 0 428 HOH A O    1 ? 
HETATM 4611 O  O    . HOH K 6 .   ? 17.334  6.346   17.970  1.000 32.747 0 429 HOH A O    1 ? 
HETATM 4612 O  O    . HOH K 6 .   ? -10.541 3.554   4.792   1.000 27.914 0 430 HOH A O    1 ? 
HETATM 4613 O  O    . HOH K 6 .   ? -0.197  -7.049  12.992  1.000 27.476 0 431 HOH A O    1 ? 
HETATM 4614 O  O    . HOH K 6 .   ? -4.950  -17.872 25.113  1.000 33.115 0 432 HOH A O    1 ? 
HETATM 4615 O  O    . HOH K 6 .   ? -1.300  4.687   35.736  1.000 38.216 0 433 HOH A O    1 ? 
HETATM 4616 O  O    . HOH K 6 .   ? -7.334  -5.595  5.201   1.000 29.264 0 434 HOH A O    1 ? 
HETATM 4617 O  O    . HOH K 6 .   ? -5.164  8.448   11.691  1.000 27.774 0 435 HOH A O    1 ? 
HETATM 4618 O  O    . HOH K 6 .   ? -0.129  -12.144 32.327  1.000 30.849 0 436 HOH A O    1 ? 
HETATM 4619 O  O    . HOH K 6 .   ? 12.501  0.735   14.079  1.000 19.113 0 437 HOH A O    1 ? 
HETATM 4620 O  O    . HOH K 6 .   ? 16.920  -10.651 14.055  1.000 31.592 0 438 HOH A O    1 ? 
HETATM 4621 O  O    . HOH K 6 .   ? 6.889   16.553  38.904  1.000 59.340 0 439 HOH A O    1 ? 
HETATM 4622 O  O    B HOH K 6 .   ? 7.873   17.892  23.644  0.500 21.005 0 440 HOH A O    1 ? 
HETATM 4623 O  O    . HOH K 6 .   ? -9.842  4.481   34.698  1.000 38.802 0 441 HOH A O    1 ? 
HETATM 4624 O  O    . HOH K 6 .   ? -6.966  12.273  34.831  1.000 44.320 0 442 HOH A O    1 ? 
HETATM 4625 O  O    . HOH K 6 .   ? 0.460   12.585  37.942  1.000 52.945 0 443 HOH A O    1 ? 
HETATM 4626 O  O    . HOH K 6 .   ? -11.120 -17.198 15.585  1.000 29.929 0 444 HOH A O    1 ? 
HETATM 4627 O  O    . HOH K 6 .   ? -27.608 -4.938  24.957  1.000 34.402 0 445 HOH A O    1 ? 
HETATM 4628 O  O    . HOH K 6 .   ? -6.620  7.733   34.276  1.000 49.909 0 446 HOH A O    1 ? 
HETATM 4629 O  O    . HOH K 6 .   ? -2.273  -6.908  32.562  1.000 30.434 0 447 HOH A O    1 ? 
HETATM 4630 O  O    . HOH K 6 .   ? 20.700  7.886   26.457  1.000 38.568 0 448 HOH A O    1 ? 
HETATM 4631 O  O    . HOH K 6 .   ? 11.523  7.569   16.282  1.000 38.870 0 449 HOH A O    1 ? 
HETATM 4632 O  O    . HOH K 6 .   ? -14.970 -1.540  12.195  1.000 33.040 0 450 HOH A O    1 ? 
HETATM 4633 O  O    . HOH K 6 .   ? -9.440  -14.944 22.418  1.000 45.237 0 451 HOH A O    1 ? 
HETATM 4634 O  O    . HOH K 6 .   ? -20.724 -2.701  17.963  1.000 31.172 0 452 HOH A O    1 ? 
HETATM 4635 O  O    . HOH K 6 .   ? -14.098 -6.738  9.087   1.000 39.850 0 453 HOH A O    1 ? 
HETATM 4636 O  O    . HOH K 6 .   ? -0.367  -2.606  31.044  1.000 20.775 0 454 HOH A O    1 ? 
HETATM 4637 O  O    . HOH K 6 .   ? -3.220  20.236  26.373  1.000 28.211 0 455 HOH A O    1 ? 
HETATM 4638 O  O    . HOH K 6 .   ? -2.924  19.122  30.980  1.000 38.507 0 456 HOH A O    1 ? 
HETATM 4639 O  O    . HOH K 6 .   ? -20.652 14.184  22.431  1.000 32.148 0 457 HOH A O    1 ? 
HETATM 4640 O  O    . HOH K 6 .   ? -3.707  17.009  28.630  1.000 44.466 0 458 HOH A O    1 ? 
HETATM 4641 O  O    . HOH K 6 .   ? 9.714   14.061  19.499  1.000 30.844 0 459 HOH A O    1 ? 
HETATM 4642 O  O    . HOH K 6 .   ? 16.005  0.389   15.585  1.000 33.305 0 460 HOH A O    1 ? 
HETATM 4643 O  O    . HOH K 6 .   ? -17.327 -1.711  15.477  1.000 32.616 0 461 HOH A O    1 ? 
HETATM 4644 O  O    . HOH K 6 .   ? -19.061 -11.498 15.118  1.000 38.940 0 462 HOH A O    1 ? 
HETATM 4645 O  O    . HOH K 6 .   ? 8.552   11.835  41.033  1.000 37.579 0 463 HOH A O    1 ? 
HETATM 4646 O  O    . HOH K 6 .   ? -2.126  -8.549  30.432  1.000 10.546 0 464 HOH A O    1 ? 
HETATM 4647 O  O    . HOH K 6 .   ? -2.250  0.662   38.704  1.000 37.748 0 465 HOH A O    1 ? 
HETATM 4648 O  O    . HOH L 6 .   ? 16.640  12.045  8.614   1.000 24.783 0 301 HOH B O    1 ? 
HETATM 4649 O  O    . HOH L 6 .   ? -1.615  40.133  4.563   1.000 24.897 0 302 HOH B O    1 ? 
HETATM 4650 O  O    . HOH L 6 .   ? -19.002 20.637  2.932   1.000 44.389 0 303 HOH B O    1 ? 
HETATM 4651 O  O    . HOH L 6 .   ? 3.506   16.628  -6.743  1.000 39.199 0 304 HOH B O    1 ? 
HETATM 4652 O  O    . HOH L 6 .   ? -5.969  13.083  9.172   1.000 26.321 0 305 HOH B O    1 ? 
HETATM 4653 O  O    . HOH L 6 .   ? -12.717 23.230  5.825   1.000 26.638 0 306 HOH B O    1 ? 
HETATM 4654 O  O    . HOH L 6 .   ? -11.974 26.907  8.482   1.000 38.482 0 307 HOH B O    1 ? 
HETATM 4655 O  O    . HOH L 6 .   ? 6.396   26.575  -0.723  1.000 18.592 0 308 HOH B O    1 ? 
HETATM 4656 O  O    . HOH L 6 .   ? 16.879  18.560  12.704  1.000 19.261 0 309 HOH B O    1 ? 
HETATM 4657 O  O    . HOH L 6 .   ? -0.984  12.683  -2.796  1.000 19.460 0 310 HOH B O    1 ? 
HETATM 4658 O  O    . HOH L 6 .   ? 15.496  7.045   2.106   1.000 34.037 0 311 HOH B O    1 ? 
HETATM 4659 O  O    . HOH L 6 .   ? 14.693  27.787  21.387  1.000 30.264 0 312 HOH B O    1 ? 
HETATM 4660 O  O    . HOH L 6 .   ? 17.023  21.280  -2.839  1.000 32.160 0 313 HOH B O    1 ? 
HETATM 4661 O  O    . HOH L 6 .   ? -13.348 20.060  13.367  1.000 39.696 0 314 HOH B O    1 ? 
HETATM 4662 O  O    . HOH L 6 .   ? -1.742  11.550  8.997   1.000 12.215 0 315 HOH B O    1 ? 
HETATM 4663 O  O    . HOH L 6 .   ? 9.438   13.925  16.387  1.000 29.280 0 316 HOH B O    1 ? 
HETATM 4664 O  O    . HOH L 6 .   ? -3.572  31.425  10.525  1.000 20.734 0 317 HOH B O    1 ? 
HETATM 4665 O  O    . HOH L 6 .   ? -8.222  22.192  21.574  1.000 37.477 0 318 HOH B O    1 ? 
HETATM 4666 O  O    . HOH L 6 .   ? -3.809  36.810  3.718   1.000 30.249 0 319 HOH B O    1 ? 
HETATM 4667 O  O    . HOH L 6 .   ? -7.119  15.351  10.635  1.000 21.555 0 320 HOH B O    1 ? 
HETATM 4668 O  O    . HOH L 6 .   ? 16.196  30.057  4.932   1.000 38.183 0 321 HOH B O    1 ? 
HETATM 4669 O  O    . HOH L 6 .   ? -10.918 22.299  9.893   1.000 23.813 0 322 HOH B O    1 ? 
HETATM 4670 O  O    . HOH L 6 .   ? -10.408 32.135  -6.318  1.000 30.152 0 323 HOH B O    1 ? 
HETATM 4671 O  O    . HOH L 6 .   ? -10.278 35.663  9.185   1.000 36.639 0 324 HOH B O    1 ? 
HETATM 4672 O  O    . HOH L 6 .   ? -14.002 20.281  -8.618  1.000 42.686 0 325 HOH B O    1 ? 
HETATM 4673 O  O    . HOH L 6 .   ? 4.947   8.711   2.089   1.000 24.630 0 326 HOH B O    1 ? 
HETATM 4674 O  O    . HOH L 6 .   ? 8.977   36.991  2.854   1.000 39.788 0 327 HOH B O    1 ? 
HETATM 4675 O  O    . HOH L 6 .   ? 16.889  18.982  6.331   1.000 30.621 0 328 HOH B O    1 ? 
HETATM 4676 O  O    . HOH L 6 .   ? 13.630  36.867  15.980  1.000 24.908 0 329 HOH B O    1 ? 
HETATM 4677 O  O    . HOH L 6 .   ? 16.093  29.754  8.671   1.000 29.981 0 330 HOH B O    1 ? 
HETATM 4678 O  O    . HOH L 6 .   ? 11.398  17.985  16.733  1.000 25.944 0 331 HOH B O    1 ? 
HETATM 4679 O  O    . HOH L 6 .   ? 12.766  10.570  13.231  1.000 27.432 0 332 HOH B O    1 ? 
HETATM 4680 O  O    . HOH L 6 .   ? -11.631 19.763  -5.968  1.000 26.522 0 333 HOH B O    1 ? 
HETATM 4681 O  O    . HOH L 6 .   ? 11.365  25.295  0.575   1.000 20.043 0 334 HOH B O    1 ? 
HETATM 4682 O  O    . HOH L 6 .   ? 7.468   25.703  18.194  1.000 18.014 0 335 HOH B O    1 ? 
HETATM 4683 O  O    . HOH L 6 .   ? 16.172  22.334  -0.347  1.000 33.530 0 336 HOH B O    1 ? 
HETATM 4684 O  O    . HOH L 6 .   ? -3.493  17.389  14.095  1.000 34.439 0 337 HOH B O    1 ? 
HETATM 4685 O  O    . HOH L 6 .   ? 9.136   40.483  7.761   1.000 29.536 0 338 HOH B O    1 ? 
HETATM 4686 O  O    . HOH L 6 .   ? -4.061  20.945  -9.907  1.000 24.604 0 339 HOH B O    1 ? 
HETATM 4687 O  O    . HOH L 6 .   ? 10.452  37.239  8.828   1.000 28.660 0 340 HOH B O    1 ? 
HETATM 4688 O  O    . HOH L 6 .   ? 23.039  9.816   6.738   1.000 41.660 0 341 HOH B O    1 ? 
HETATM 4689 O  O    . HOH L 6 .   ? 12.063  36.488  17.444  1.000 31.463 0 342 HOH B O    1 ? 
HETATM 4690 O  O    . HOH L 6 .   ? -4.494  38.870  11.535  1.000 42.345 0 343 HOH B O    1 ? 
HETATM 4691 O  O    . HOH L 6 .   ? -1.307  19.454  22.847  1.000 16.219 0 344 HOH B O    1 ? 
HETATM 4692 O  O    . HOH L 6 .   ? 5.885   4.798   2.129   1.000 30.243 0 345 HOH B O    1 ? 
HETATM 4693 O  O    . HOH L 6 .   ? 14.005  29.130  12.498  1.000 18.989 0 346 HOH B O    1 ? 
HETATM 4694 O  O    . HOH L 6 .   ? -8.709  26.928  20.279  1.000 20.592 0 347 HOH B O    1 ? 
HETATM 4695 O  O    . HOH L 6 .   ? -14.109 30.818  4.039   1.000 32.280 0 348 HOH B O    1 ? 
HETATM 4696 O  O    . HOH L 6 .   ? 4.916   25.727  -2.822  1.000 15.802 0 349 HOH B O    1 ? 
HETATM 4697 O  O    . HOH L 6 .   ? 17.652  35.853  13.815  1.000 37.575 0 350 HOH B O    1 ? 
HETATM 4698 O  O    . HOH L 6 .   ? 6.281   39.465  15.068  1.000 32.093 0 351 HOH B O    1 ? 
HETATM 4699 O  O    . HOH L 6 .   ? -12.820 23.188  17.947  1.000 27.043 0 352 HOH B O    1 ? 
HETATM 4700 O  O    . HOH L 6 .   ? -2.513  21.853  22.085  1.000 25.686 0 353 HOH B O    1 ? 
HETATM 4701 O  O    . HOH L 6 .   ? 11.890  36.982  6.662   1.000 27.369 0 354 HOH B O    1 ? 
HETATM 4702 O  O    . HOH L 6 .   ? 3.748   32.307  -1.947  1.000 25.550 0 355 HOH B O    1 ? 
HETATM 4703 O  O    . HOH L 6 .   ? -6.669  27.850  -13.048 1.000 17.891 0 356 HOH B O    1 ? 
HETATM 4704 O  O    . HOH L 6 .   ? -7.906  32.817  11.442  1.000 41.580 0 357 HOH B O    1 ? 
HETATM 4705 O  O    . HOH L 6 .   ? -0.988  22.947  -8.174  1.000 30.873 0 358 HOH B O    1 ? 
HETATM 4706 O  O    . HOH L 6 .   ? 15.934  13.921  0.160   1.000 30.026 0 359 HOH B O    1 ? 
HETATM 4707 O  O    . HOH L 6 .   ? -5.193  17.440  24.404  1.000 19.830 0 360 HOH B O    1 ? 
HETATM 4708 O  O    . HOH L 6 .   ? -12.607 22.486  -13.060 1.000 32.812 0 361 HOH B O    1 ? 
HETATM 4709 O  O    . HOH L 6 .   ? -12.905 24.861  0.420   1.000 21.694 0 362 HOH B O    1 ? 
HETATM 4710 O  O    . HOH L 6 .   ? 2.139   27.727  -4.415  1.000 24.751 0 363 HOH B O    1 ? 
HETATM 4711 O  O    . HOH L 6 .   ? 15.415  28.110  3.038   1.000 26.289 0 364 HOH B O    1 ? 
HETATM 4712 O  O    . HOH L 6 .   ? -7.321  31.223  -0.759  1.000 24.257 0 365 HOH B O    1 ? 
HETATM 4713 O  O    . HOH L 6 .   ? 10.911  6.006   7.103   1.000 18.609 0 366 HOH B O    1 ? 
HETATM 4714 O  O    . HOH L 6 .   ? -10.692 26.378  -0.013  1.000 20.926 0 367 HOH B O    1 ? 
HETATM 4715 O  O    . HOH L 6 .   ? -5.538  29.564  12.552  1.000 24.793 0 368 HOH B O    1 ? 
HETATM 4716 O  O    . HOH L 6 .   ? 12.123  28.037  14.198  1.000 14.151 0 369 HOH B O    1 ? 
HETATM 4717 O  O    . HOH L 6 .   ? 1.124   7.831   0.297   1.000 22.568 0 370 HOH B O    1 ? 
HETATM 4718 O  O    . HOH L 6 .   ? -12.940 29.431  -9.614  1.000 26.648 0 371 HOH B O    1 ? 
HETATM 4719 O  O    . HOH L 6 .   ? 5.435   30.455  5.103   1.000 14.789 0 372 HOH B O    1 ? 
HETATM 4720 O  O    . HOH L 6 .   ? 10.452  35.429  0.396   1.000 28.702 0 373 HOH B O    1 ? 
HETATM 4721 O  O    . HOH L 6 .   ? -10.696 29.146  0.956   1.000 25.438 0 374 HOH B O    1 ? 
HETATM 4722 O  O    . HOH L 6 .   ? -6.938  14.829  -2.857  1.000 28.612 0 375 HOH B O    1 ? 
HETATM 4723 O  O    . HOH L 6 .   ? -8.571  31.332  -2.958  1.000 24.319 0 376 HOH B O    1 ? 
HETATM 4724 O  O    . HOH L 6 .   ? -10.838 23.550  -14.661 1.000 25.085 0 377 HOH B O    1 ? 
HETATM 4725 O  O    . HOH L 6 .   ? 5.253   43.013  7.949   1.000 33.752 0 378 HOH B O    1 ? 
HETATM 4726 O  O    . HOH L 6 .   ? 6.554   34.571  15.377  1.000 24.150 0 379 HOH B O    1 ? 
HETATM 4727 O  O    . HOH L 6 .   ? -8.245  20.316  -15.166 1.000 37.540 0 380 HOH B O    1 ? 
HETATM 4728 O  O    . HOH L 6 .   ? 3.523   41.031  19.980  1.000 29.165 0 381 HOH B O    1 ? 
HETATM 4729 O  O    . HOH L 6 .   ? 14.738  25.613  2.123   1.000 26.381 0 382 HOH B O    1 ? 
HETATM 4730 O  O    . HOH L 6 .   ? -3.936  14.064  17.868  1.000 13.174 0 383 HOH B O    1 ? 
HETATM 4731 O  O    . HOH L 6 .   ? 11.480  18.651  -5.920  1.000 30.946 0 384 HOH B O    1 ? 
HETATM 4732 O  O    . HOH L 6 .   ? -1.288  30.601  9.420   1.000 29.787 0 385 HOH B O    1 ? 
HETATM 4733 O  O    . HOH L 6 .   ? 5.454   29.251  -1.370  1.000 16.368 0 386 HOH B O    1 ? 
HETATM 4734 O  O    . HOH L 6 .   ? 8.866   31.150  -5.983  1.000 31.212 0 387 HOH B O    1 ? 
HETATM 4735 O  O    A HOH L 6 .   ? -1.213  45.538  13.273  0.500 7.431  0 388 HOH B O    1 ? 
HETATM 4736 O  O    B HOH L 6 .   ? -2.053  47.015  12.569  0.500 17.586 0 388 HOH B O    1 ? 
HETATM 4737 O  O    . HOH L 6 .   ? 7.436   20.831  20.899  1.000 26.508 0 389 HOH B O    1 ? 
HETATM 4738 O  O    . HOH L 6 .   ? 1.136   23.881  -5.373  1.000 16.635 0 390 HOH B O    1 ? 
HETATM 4739 O  O    . HOH L 6 .   ? 11.587  32.484  22.899  1.000 29.111 0 391 HOH B O    1 ? 
HETATM 4740 O  O    . HOH L 6 .   ? 15.009  3.585   4.027   1.000 48.379 0 392 HOH B O    1 ? 
HETATM 4741 O  O    . HOH L 6 .   ? 2.361   30.928  14.555  1.000 21.230 0 393 HOH B O    1 ? 
HETATM 4742 O  O    . HOH L 6 .   ? -5.152  23.273  -14.055 1.000 25.344 0 394 HOH B O    1 ? 
HETATM 4743 O  O    . HOH L 6 .   ? -3.994  12.429  11.451  1.000 13.436 0 395 HOH B O    1 ? 
HETATM 4744 O  O    . HOH L 6 .   ? 10.016  3.009   8.245   1.000 26.061 0 396 HOH B O    1 ? 
HETATM 4745 O  O    . HOH L 6 .   ? -10.744 22.737  13.294  1.000 37.695 0 397 HOH B O    1 ? 
HETATM 4746 O  O    . HOH L 6 .   ? 14.970  24.933  -0.350  1.000 25.387 0 398 HOH B O    1 ? 
HETATM 4747 O  O    . HOH L 6 .   ? 9.784   32.429  0.355   1.000 17.662 0 399 HOH B O    1 ? 
HETATM 4748 O  O    . HOH L 6 .   ? 17.577  10.609  6.233   1.000 30.213 0 400 HOH B O    1 ? 
HETATM 4749 O  O    . HOH L 6 .   ? -13.793 24.262  -7.946  1.000 34.999 0 401 HOH B O    1 ? 
HETATM 4750 O  O    . HOH L 6 .   ? 20.005  20.810  5.288   1.000 29.689 0 402 HOH B O    1 ? 
HETATM 4751 O  O    . HOH L 6 .   ? -8.359  12.491  13.722  1.000 25.205 0 403 HOH B O    1 ? 
HETATM 4752 O  O    . HOH L 6 .   ? 9.369   4.465   -3.146  1.000 46.560 0 404 HOH B O    1 ? 
HETATM 4753 O  O    . HOH L 6 .   ? -5.978  35.277  0.247   1.000 18.404 0 405 HOH B O    1 ? 
HETATM 4754 O  O    . HOH L 6 .   ? -9.366  27.471  12.396  1.000 18.735 0 406 HOH B O    1 ? 
HETATM 4755 O  O    . HOH L 6 .   ? -13.079 28.431  -6.511  1.000 23.835 0 407 HOH B O    1 ? 
HETATM 4756 O  O    . HOH L 6 .   ? 9.277   8.775   -4.162  1.000 51.368 0 408 HOH B O    1 ? 
HETATM 4757 O  O    . HOH L 6 .   ? 15.237  37.082  6.165   1.000 30.477 0 409 HOH B O    1 ? 
HETATM 4758 O  O    . HOH L 6 .   ? 13.144  25.352  -3.082  1.000 35.614 0 410 HOH B O    1 ? 
HETATM 4759 O  O    . HOH L 6 .   ? -6.918  28.338  15.302  1.000 27.519 0 411 HOH B O    1 ? 
HETATM 4760 O  O    . HOH L 6 .   ? -4.467  20.829  23.596  1.000 30.845 0 412 HOH B O    1 ? 
HETATM 4761 O  O    . HOH L 6 .   ? 10.589  0.833   6.706   1.000 29.802 0 413 HOH B O    1 ? 
HETATM 4762 O  O    . HOH L 6 .   ? 10.444  24.373  -3.438  1.000 20.156 0 414 HOH B O    1 ? 
HETATM 4763 O  O    . HOH L 6 .   ? 21.052  31.396  10.886  1.000 45.350 0 415 HOH B O    1 ? 
HETATM 4764 O  O    . HOH L 6 .   ? -12.253 31.532  -0.890  1.000 59.383 0 416 HOH B O    1 ? 
HETATM 4765 O  O    . HOH L 6 .   ? 3.723   23.259  -4.284  1.000 12.603 0 417 HOH B O    1 ? 
HETATM 4766 O  O    . HOH L 6 .   ? 23.544  36.536  6.111   1.000 48.386 0 418 HOH B O    1 ? 
HETATM 4767 O  O    . HOH L 6 .   ? 12.662  28.034  -0.067  1.000 30.495 0 419 HOH B O    1 ? 
HETATM 4768 O  O    . HOH L 6 .   ? -5.610  14.452  12.618  1.000 29.531 0 420 HOH B O    1 ? 
HETATM 4769 O  O    . HOH L 6 .   ? -3.333  36.597  14.967  1.000 37.335 0 421 HOH B O    1 ? 
HETATM 4770 O  O    . HOH L 6 .   ? 8.092   0.610   0.503   1.000 31.599 0 422 HOH B O    1 ? 
HETATM 4771 O  O    . HOH L 6 .   ? 8.284   30.325  -3.419  1.000 22.084 0 423 HOH B O    1 ? 
HETATM 4772 O  O    . HOH L 6 .   ? -13.604 11.753  4.513   1.000 37.624 0 424 HOH B O    1 ? 
HETATM 4773 O  O    . HOH L 6 .   ? 19.865  8.176   5.885   1.000 46.610 0 425 HOH B O    1 ? 
HETATM 4774 O  O    . HOH L 6 .   ? 6.195   12.654  -7.298  1.000 31.827 0 426 HOH B O    1 ? 
HETATM 4775 O  O    . HOH L 6 .   ? -1.777  30.383  16.569  1.000 23.813 0 427 HOH B O    1 ? 
HETATM 4776 O  O    . HOH L 6 .   ? -0.249  30.235  14.005  1.000 27.712 0 428 HOH B O    1 ? 
HETATM 4777 O  O    . HOH L 6 .   ? -2.082  30.014  11.955  1.000 20.114 0 429 HOH B O    1 ? 
HETATM 4778 O  O    . HOH L 6 .   ? -12.190 8.542   6.477   1.000 53.995 0 430 HOH B O    1 ? 
HETATM 4779 O  O    . HOH L 6 .   ? 16.541  39.575  11.559  1.000 53.154 0 431 HOH B O    1 ? 
HETATM 4780 O  O    . HOH L 6 .   ? 4.823   6.773   -1.317  1.000 31.339 0 432 HOH B O    1 ? 
HETATM 4781 O  O    . HOH L 6 .   ? 18.295  24.181  8.988   1.000 29.515 0 433 HOH B O    1 ? 
HETATM 4782 O  O    . HOH L 6 .   ? 2.833   26.269  -6.069  1.000 33.083 0 434 HOH B O    1 ? 
HETATM 4783 O  O    . HOH L 6 .   ? 15.483  5.356   -1.945  1.000 36.754 0 435 HOH B O    1 ? 
HETATM 4784 O  O    . HOH L 6 .   ? 21.791  10.958  -3.888  1.000 38.250 0 436 HOH B O    1 ? 
HETATM 4785 O  O    . HOH L 6 .   ? 15.237  43.031  14.046  1.000 25.963 0 437 HOH B O    1 ? 
HETATM 4786 O  O    . HOH L 6 .   ? 10.130  17.754  -9.272  1.000 29.492 0 438 HOH B O    1 ? 
HETATM 4787 O  O    . HOH L 6 .   ? -12.620 14.657  -6.545  1.000 54.884 0 439 HOH B O    1 ? 
HETATM 4788 O  O    . HOH L 6 .   ? -17.464 23.808  1.914   1.000 35.114 0 440 HOH B O    1 ? 
HETATM 4789 O  O    . HOH L 6 .   ? 0.668   41.747  1.738   1.000 40.062 0 441 HOH B O    1 ? 
HETATM 4790 O  O    . HOH L 6 .   ? -3.017  24.298  -12.038 1.000 30.317 0 442 HOH B O    1 ? 
HETATM 4791 O  O    . HOH L 6 .   ? 18.077  37.486  7.687   1.000 34.805 0 443 HOH B O    1 ? 
HETATM 4792 O  O    . HOH L 6 .   ? -10.746 29.192  16.495  1.000 33.577 0 444 HOH B O    1 ? 
HETATM 4793 O  O    . HOH L 6 .   ? 18.232  10.950  14.971  1.000 41.637 0 445 HOH B O    1 ? 
HETATM 4794 O  O    . HOH L 6 .   ? 11.031  15.421  17.743  1.000 31.749 0 446 HOH B O    1 ? 
HETATM 4795 O  O    . HOH L 6 .   ? 12.881  10.088  -5.886  1.000 40.269 0 447 HOH B O    1 ? 
HETATM 4796 O  O    . HOH L 6 .   ? 9.407   26.128  -1.265  1.000 17.797 0 448 HOH B O    1 ? 
HETATM 4797 O  O    . HOH L 6 .   ? 18.413  19.681  10.806  1.000 32.966 0 449 HOH B O    1 ? 
HETATM 4798 O  O    . HOH L 6 .   ? -9.284  29.511  12.966  1.000 43.362 0 450 HOH B O    1 ? 
HETATM 4799 O  O    . HOH L 6 .   ? 15.962  27.953  10.748  1.000 31.394 0 451 HOH B O    1 ? 
HETATM 4800 O  O    . HOH L 6 .   ? 13.095  38.813  6.185   1.000 43.897 0 452 HOH B O    1 ? 
HETATM 4801 O  O    . HOH L 6 .   ? 3.781   12.306  -8.163  1.000 39.488 0 453 HOH B O    1 ? 
HETATM 4802 O  O    . HOH L 6 .   ? 4.122   3.017   1.251   1.000 26.342 0 454 HOH B O    1 ? 
HETATM 4803 O  O    . HOH L 6 .   ? -14.568 27.190  -4.826  1.000 47.064 0 455 HOH B O    1 ? 
HETATM 4804 O  O    . HOH L 6 .   ? 6.830   3.696   -2.279  1.000 27.356 0 456 HOH B O    1 ? 
HETATM 4805 O  O    . HOH L 6 .   ? 11.823  39.394  10.327  1.000 24.728 0 457 HOH B O    1 ? 
HETATM 4806 O  O    . HOH L 6 .   ? -11.354 16.813  -7.459  1.000 27.598 0 458 HOH B O    1 ? 
HETATM 4807 O  O    . HOH L 6 .   ? -15.367 26.038  -1.406  1.000 28.734 0 459 HOH B O    1 ? 
HETATM 4808 O  O    . HOH L 6 .   ? 19.932  17.732  -2.957  1.000 51.509 0 460 HOH B O    1 ? 
HETATM 4809 O  O    . HOH L 6 .   ? 17.718  14.553  -6.988  1.000 47.259 0 461 HOH B O    1 ? 
HETATM 4810 O  O    . HOH L 6 .   ? 7.175   31.825  -1.519  1.000 10.998 0 462 HOH B O    1 ? 
HETATM 4811 O  O    . HOH L 6 .   ? -8.527  15.166  -7.136  1.000 37.528 0 463 HOH B O    1 ? 
HETATM 4812 O  O    . HOH L 6 .   ? -9.957  12.616  10.692  1.000 41.096 0 464 HOH B O    1 ? 
HETATM 4813 O  O    . HOH L 6 .   ? 15.529  34.322  -2.739  1.000 40.586 0 465 HOH B O    1 ? 
HETATM 4814 O  O    . HOH L 6 .   ? -15.769 14.779  -5.201  1.000 40.656 0 466 HOH B O    1 ? 
HETATM 4815 O  O    . HOH L 6 .   ? -8.374  44.986  13.366  1.000 42.275 0 467 HOH B O    1 ? 
HETATM 4816 O  O    . HOH L 6 .   ? 21.431  20.726  -5.871  1.000 43.222 0 468 HOH B O    1 ? 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   0   ?   ?   ?   A . n 
A 1 2   ALA 2   1   1   ALA ALA A . n 
A 1 3   THR 3   2   2   THR THR A . n 
A 1 4   LYS 4   3   3   LYS LYS A . n 
A 1 5   ALA 5   4   4   ALA ALA A . n 
A 1 6   VAL 6   5   5   VAL VAL A . n 
A 1 7   CYS 7   6   6   CYS CYS A . n 
A 1 8   VAL 8   7   7   VAL VAL A . n 
A 1 9   LEU 9   8   8   LEU LEU A . n 
A 1 10  LYS 10  9   9   LYS LYS A . n 
A 1 11  GLY 11  10  10  GLY GLY A . n 
A 1 12  ASP 12  11  11  ASP ASP A . n 
A 1 13  GLY 13  12  12  GLY GLY A . n 
A 1 14  PRO 14  13  13  PRO PRO A . n 
A 1 15  VAL 15  14  14  VAL VAL A . n 
A 1 16  GLN 16  15  15  GLN GLN A . n 
A 1 17  GLY 17  16  16  GLY GLY A . n 
A 1 18  ILE 18  17  17  ILE ILE A . n 
A 1 19  ILE 19  18  18  ILE ILE A . n 
A 1 20  ASN 20  19  19  ASN ASN A . n 
A 1 21  PHE 21  20  20  PHE PHE A . n 
A 1 22  GLU 22  21  21  GLU GLU A . n 
A 1 23  GLN 23  22  22  GLN GLN A . n 
A 1 24  LYS 24  23  23  LYS LYS A . n 
A 1 25  GLU 25  24  24  GLU GLU A . n 
A 1 26  SER 26  25  25  SER SER A . n 
A 1 27  ASN 27  26  26  ASN ASN A . n 
A 1 28  GLY 28  27  27  GLY GLY A . n 
A 1 29  PRO 29  28  28  PRO PRO A . n 
A 1 30  VAL 30  29  29  VAL VAL A . n 
A 1 31  LYS 31  30  30  LYS LYS A . n 
A 1 32  VAL 32  31  31  VAL VAL A . n 
A 1 33  TRP 33  32  32  TRP TRP A . n 
A 1 34  GLY 34  33  33  GLY GLY A . n 
A 1 35  SER 35  34  34  SER SER A . n 
A 1 36  ILE 36  35  35  ILE ILE A . n 
A 1 37  LYS 37  36  36  LYS LYS A . n 
A 1 38  GLY 38  37  37  GLY GLY A . n 
A 1 39  LEU 39  38  38  LEU LEU A . n 
A 1 40  THR 40  39  39  THR THR A . n 
A 1 41  GLU 41  40  40  GLU GLU A . n 
A 1 42  GLY 42  41  41  GLY GLY A . n 
A 1 43  LEU 43  42  42  LEU LEU A . n 
A 1 44  HIS 44  43  43  HIS HIS A . n 
A 1 45  GLY 45  44  44  GLY GLY A . n 
A 1 46  PHE 46  45  45  PHE PHE A . n 
A 1 47  HIS 47  46  46  HIS HIS A . n 
A 1 48  VAL 48  47  47  VAL VAL A . n 
A 1 49  HIS 49  48  48  HIS HIS A . n 
A 1 50  GLU 50  49  49  GLU GLU A . n 
A 1 51  PHE 51  50  50  PHE PHE A . n 
A 1 52  GLY 52  51  51  GLY GLY A . n 
A 1 53  ASP 53  52  52  ASP ASP A . n 
A 1 54  ASN 54  53  53  ASN ASN A . n 
A 1 55  THR 55  54  54  THR THR A . n 
A 1 56  ALA 56  55  55  ALA ALA A . n 
A 1 57  GLY 57  56  56  GLY GLY A . n 
A 1 58  CYS 58  57  57  CYS CYS A . n 
A 1 59  THR 59  58  58  THR THR A . n 
A 1 60  SER 60  59  59  SER SER A . n 
A 1 61  ALA 61  60  60  ALA ALA A . n 
A 1 62  GLY 62  61  61  GLY GLY A . n 
A 1 63  PRO 63  62  62  PRO PRO A . n 
A 1 64  HIS 64  63  63  HIS HIS A . n 
A 1 65  PHE 65  64  64  PHE PHE A . n 
A 1 66  ASN 66  65  65  ASN ASN A . n 
A 1 67  PRO 67  66  66  PRO PRO A . n 
A 1 68  LEU 68  67  67  LEU LEU A . n 
A 1 69  SER 69  68  68  SER SER A . n 
A 1 70  ARG 70  69  69  ARG ARG A . n 
A 1 71  LYS 71  70  70  LYS LYS A . n 
A 1 72  HIS 72  71  71  HIS HIS A . n 
A 1 73  GLY 73  72  72  GLY GLY A . n 
A 1 74  GLY 74  73  73  GLY GLY A . n 
A 1 75  PRO 75  74  74  PRO PRO A . n 
A 1 76  LYS 76  75  75  LYS LYS A . n 
A 1 77  ASP 77  76  76  ASP ASP A . n 
A 1 78  GLU 78  77  77  GLU GLU A . n 
A 1 79  GLU 79  78  78  GLU GLU A . n 
A 1 80  ARG 80  79  79  ARG ARG A . n 
A 1 81  HIS 81  80  80  HIS HIS A . n 
A 1 82  VAL 82  81  81  VAL VAL A . n 
A 1 83  GLY 83  82  82  GLY GLY A . n 
A 1 84  ASP 84  83  83  ASP ASP A . n 
A 1 85  LEU 85  84  84  LEU LEU A . n 
A 1 86  GLY 86  85  85  GLY GLY A . n 
A 1 87  ASN 87  86  86  ASN ASN A . n 
A 1 88  VAL 88  87  87  VAL VAL A . n 
A 1 89  THR 89  88  88  THR THR A . n 
A 1 90  ALA 90  89  89  ALA ALA A . n 
A 1 91  ASP 91  90  90  ASP ASP A . n 
A 1 92  LYS 92  91  91  LYS LYS A . n 
A 1 93  ASP 93  92  92  ASP ASP A . n 
A 1 94  GLY 94  93  93  GLY GLY A . n 
A 1 95  VAL 95  94  94  VAL VAL A . n 
A 1 96  ALA 96  95  95  ALA ALA A . n 
A 1 97  ASP 97  96  96  ASP ASP A . n 
A 1 98  VAL 98  97  97  VAL VAL A . n 
A 1 99  SER 99  98  98  SER SER A . n 
A 1 100 ILE 100 99  99  ILE ILE A . n 
A 1 101 GLU 101 100 100 GLU GLU A . n 
A 1 102 ASP 102 101 101 ASP ASP A . n 
A 1 103 SER 103 102 102 SER SER A . n 
A 1 104 VAL 104 103 103 VAL VAL A . n 
A 1 105 ILE 105 104 104 ILE ILE A . n 
A 1 106 SER 106 105 105 SER SER A . n 
A 1 107 LEU 107 106 106 LEU LEU A . n 
A 1 108 SER 108 107 107 SER SER A . n 
A 1 109 GLY 109 108 108 GLY GLY A . n 
A 1 110 ASP 110 109 109 ASP ASP A . n 
A 1 111 HIS 111 110 110 HIS HIS A . n 
A 1 112 CYS 112 111 111 CYS CYS A . n 
A 1 113 ILE 113 112 112 ILE ILE A . n 
A 1 114 ILE 114 113 113 ILE ILE A . n 
A 1 115 GLY 115 114 114 GLY GLY A . n 
A 1 116 ARG 116 115 115 ARG ARG A . n 
A 1 117 THR 117 116 116 THR THR A . n 
A 1 118 LEU 118 117 117 LEU LEU A . n 
A 1 119 VAL 119 118 118 VAL VAL A . n 
A 1 120 VAL 120 119 119 VAL VAL A . n 
A 1 121 HIS 121 120 120 HIS HIS A . n 
A 1 122 GLU 122 121 121 GLU GLU A . n 
A 1 123 LYS 123 122 122 LYS LYS A . n 
A 1 124 ALA 124 123 123 ALA ALA A . n 
A 1 125 ASP 125 124 124 ASP ASP A . n 
A 1 126 ASP 126 125 125 ASP ASP A . n 
A 1 127 LEU 127 126 126 LEU LEU A . n 
A 1 128 GLY 128 127 127 GLY GLY A . n 
A 1 129 LYS 129 128 128 LYS LYS A . n 
A 1 130 GLY 130 129 129 GLY GLY A . n 
A 1 131 GLY 131 130 130 GLY GLY A . n 
A 1 132 ASN 132 131 131 ASN ASN A . n 
A 1 133 GLU 133 132 132 GLU GLU A . n 
A 1 134 GLU 134 133 133 GLU GLU A . n 
A 1 135 SER 135 134 134 SER SER A . n 
A 1 136 THR 136 135 135 THR THR A . n 
A 1 137 LYS 137 136 136 LYS LYS A . n 
A 1 138 THR 138 137 137 THR THR A . n 
A 1 139 GLY 139 138 138 GLY GLY A . n 
A 1 140 ASN 140 139 139 ASN ASN A . n 
A 1 141 ALA 141 140 140 ALA ALA A . n 
A 1 142 GLY 142 141 141 GLY GLY A . n 
A 1 143 SER 143 142 142 SER SER A . n 
A 1 144 ARG 144 143 143 ARG ARG A . n 
A 1 145 LEU 145 144 144 LEU LEU A . n 
A 1 146 ALA 146 145 145 ALA ALA A . n 
A 1 147 CYS 147 146 146 CYS CYS A . n 
A 1 148 GLY 148 147 147 GLY GLY A . n 
A 1 149 VAL 149 148 148 VAL VAL A . n 
A 1 150 ILE 150 149 149 ILE ILE A . n 
A 1 151 GLY 151 150 150 GLY GLY A . n 
A 1 152 ILE 152 151 151 ILE ILE A . n 
A 1 153 ALA 153 152 152 ALA ALA A . n 
A 1 154 GLN 154 153 153 GLN GLN A . n 
B 1 1   MET 1   0   ?   ?   ?   B . n 
B 1 2   ALA 2   1   1   ALA ALA B . n 
B 1 3   THR 3   2   2   THR THR B . n 
B 1 4   LYS 4   3   3   LYS LYS B . n 
B 1 5   ALA 5   4   4   ALA ALA B . n 
B 1 6   VAL 6   5   5   VAL VAL B . n 
B 1 7   CYS 7   6   6   CYS CYS B . n 
B 1 8   VAL 8   7   7   VAL VAL B . n 
B 1 9   LEU 9   8   8   LEU LEU B . n 
B 1 10  LYS 10  9   9   LYS LYS B . n 
B 1 11  GLY 11  10  10  GLY GLY B . n 
B 1 12  ASP 12  11  11  ASP ASP B . n 
B 1 13  GLY 13  12  12  GLY GLY B . n 
B 1 14  PRO 14  13  13  PRO PRO B . n 
B 1 15  VAL 15  14  14  VAL VAL B . n 
B 1 16  GLN 16  15  15  GLN GLN B . n 
B 1 17  GLY 17  16  16  GLY GLY B . n 
B 1 18  ILE 18  17  17  ILE ILE B . n 
B 1 19  ILE 19  18  18  ILE ILE B . n 
B 1 20  ASN 20  19  19  ASN ASN B . n 
B 1 21  PHE 21  20  20  PHE PHE B . n 
B 1 22  GLU 22  21  21  GLU GLU B . n 
B 1 23  GLN 23  22  22  GLN GLN B . n 
B 1 24  LYS 24  23  23  LYS LYS B . n 
B 1 25  GLU 25  24  24  GLU GLU B . n 
B 1 26  SER 26  25  25  SER SER B . n 
B 1 27  ASN 27  26  26  ASN ASN B . n 
B 1 28  GLY 28  27  27  GLY GLY B . n 
B 1 29  PRO 29  28  28  PRO PRO B . n 
B 1 30  VAL 30  29  29  VAL VAL B . n 
B 1 31  LYS 31  30  30  LYS LYS B . n 
B 1 32  VAL 32  31  31  VAL VAL B . n 
B 1 33  TRP 33  32  32  TRP TRP B . n 
B 1 34  GLY 34  33  33  GLY GLY B . n 
B 1 35  SER 35  34  34  SER SER B . n 
B 1 36  ILE 36  35  35  ILE ILE B . n 
B 1 37  LYS 37  36  36  LYS LYS B . n 
B 1 38  GLY 38  37  37  GLY GLY B . n 
B 1 39  LEU 39  38  38  LEU LEU B . n 
B 1 40  THR 40  39  39  THR THR B . n 
B 1 41  GLU 41  40  40  GLU GLU B . n 
B 1 42  GLY 42  41  41  GLY GLY B . n 
B 1 43  LEU 43  42  42  LEU LEU B . n 
B 1 44  HIS 44  43  43  HIS HIS B . n 
B 1 45  GLY 45  44  44  GLY GLY B . n 
B 1 46  PHE 46  45  45  PHE PHE B . n 
B 1 47  HIS 47  46  46  HIS HIS B . n 
B 1 48  VAL 48  47  47  VAL VAL B . n 
B 1 49  HIS 49  48  48  HIS HIS B . n 
B 1 50  GLU 50  49  49  GLU GLU B . n 
B 1 51  PHE 51  50  50  PHE PHE B . n 
B 1 52  GLY 52  51  51  GLY GLY B . n 
B 1 53  ASP 53  52  52  ASP ASP B . n 
B 1 54  ASN 54  53  53  ASN ASN B . n 
B 1 55  THR 55  54  54  THR THR B . n 
B 1 56  ALA 56  55  55  ALA ALA B . n 
B 1 57  GLY 57  56  56  GLY GLY B . n 
B 1 58  CYS 58  57  57  CYS CYS B . n 
B 1 59  THR 59  58  58  THR THR B . n 
B 1 60  SER 60  59  59  SER SER B . n 
B 1 61  ALA 61  60  60  ALA ALA B . n 
B 1 62  GLY 62  61  61  GLY GLY B . n 
B 1 63  PRO 63  62  62  PRO PRO B . n 
B 1 64  HIS 64  63  63  HIS HIS B . n 
B 1 65  PHE 65  64  64  PHE PHE B . n 
B 1 66  ASN 66  65  65  ASN ASN B . n 
B 1 67  PRO 67  66  66  PRO PRO B . n 
B 1 68  LEU 68  67  67  LEU LEU B . n 
B 1 69  SER 69  68  68  SER SER B . n 
B 1 70  ARG 70  69  69  ARG ARG B . n 
B 1 71  LYS 71  70  70  LYS LYS B . n 
B 1 72  HIS 72  71  71  HIS HIS B . n 
B 1 73  GLY 73  72  72  GLY GLY B . n 
B 1 74  GLY 74  73  73  GLY GLY B . n 
B 1 75  PRO 75  74  74  PRO PRO B . n 
B 1 76  LYS 76  75  75  LYS LYS B . n 
B 1 77  ASP 77  76  76  ASP ASP B . n 
B 1 78  GLU 78  77  77  GLU GLU B . n 
B 1 79  GLU 79  78  78  GLU GLU B . n 
B 1 80  ARG 80  79  79  ARG ARG B . n 
B 1 81  HIS 81  80  80  HIS HIS B . n 
B 1 82  VAL 82  81  81  VAL VAL B . n 
B 1 83  GLY 83  82  82  GLY GLY B . n 
B 1 84  ASP 84  83  83  ASP ASP B . n 
B 1 85  LEU 85  84  84  LEU LEU B . n 
B 1 86  GLY 86  85  85  GLY GLY B . n 
B 1 87  ASN 87  86  86  ASN ASN B . n 
B 1 88  VAL 88  87  87  VAL VAL B . n 
B 1 89  THR 89  88  88  THR THR B . n 
B 1 90  ALA 90  89  89  ALA ALA B . n 
B 1 91  ASP 91  90  90  ASP ASP B . n 
B 1 92  LYS 92  91  91  LYS LYS B . n 
B 1 93  ASP 93  92  92  ASP ASP B . n 
B 1 94  GLY 94  93  93  GLY GLY B . n 
B 1 95  VAL 95  94  94  VAL VAL B . n 
B 1 96  ALA 96  95  95  ALA ALA B . n 
B 1 97  ASP 97  96  96  ASP ASP B . n 
B 1 98  VAL 98  97  97  VAL VAL B . n 
B 1 99  SER 99  98  98  SER SER B . n 
B 1 100 ILE 100 99  99  ILE ILE B . n 
B 1 101 GLU 101 100 100 GLU GLU B . n 
B 1 102 ASP 102 101 101 ASP ASP B . n 
B 1 103 SER 103 102 102 SER SER B . n 
B 1 104 VAL 104 103 103 VAL VAL B . n 
B 1 105 ILE 105 104 104 ILE ILE B . n 
B 1 106 SER 106 105 105 SER SER B . n 
B 1 107 LEU 107 106 106 LEU LEU B . n 
B 1 108 SER 108 107 107 SER SER B . n 
B 1 109 GLY 109 108 108 GLY GLY B . n 
B 1 110 ASP 110 109 109 ASP ASP B . n 
B 1 111 HIS 111 110 110 HIS HIS B . n 
B 1 112 CYS 112 111 111 CYS CYS B . n 
B 1 113 ILE 113 112 112 ILE ILE B . n 
B 1 114 ILE 114 113 113 ILE ILE B . n 
B 1 115 GLY 115 114 114 GLY GLY B . n 
B 1 116 ARG 116 115 115 ARG ARG B . n 
B 1 117 THR 117 116 116 THR THR B . n 
B 1 118 LEU 118 117 117 LEU LEU B . n 
B 1 119 VAL 119 118 118 VAL VAL B . n 
B 1 120 VAL 120 119 119 VAL VAL B . n 
B 1 121 HIS 121 120 120 HIS HIS B . n 
B 1 122 GLU 122 121 121 GLU GLU B . n 
B 1 123 LYS 123 122 122 LYS LYS B . n 
B 1 124 ALA 124 123 123 ALA ALA B . n 
B 1 125 ASP 125 124 124 ASP ASP B . n 
B 1 126 ASP 126 125 125 ASP ASP B . n 
B 1 127 LEU 127 126 126 LEU LEU B . n 
B 1 128 GLY 128 127 127 GLY GLY B . n 
B 1 129 LYS 129 128 128 LYS LYS B . n 
B 1 130 GLY 130 129 129 GLY GLY B . n 
B 1 131 GLY 131 130 130 GLY GLY B . n 
B 1 132 ASN 132 131 131 ASN ASN B . n 
B 1 133 GLU 133 132 132 GLU GLU B . n 
B 1 134 GLU 134 133 133 GLU GLU B . n 
B 1 135 SER 135 134 134 SER SER B . n 
B 1 136 THR 136 135 135 THR THR B . n 
B 1 137 LYS 137 136 136 LYS LYS B . n 
B 1 138 THR 138 137 137 THR THR B . n 
B 1 139 GLY 139 138 138 GLY GLY B . n 
B 1 140 ASN 140 139 139 ASN ASN B . n 
B 1 141 ALA 141 140 140 ALA ALA B . n 
B 1 142 GLY 142 141 141 GLY GLY B . n 
B 1 143 SER 143 142 142 SER SER B . n 
B 1 144 ARG 144 143 143 ARG ARG B . n 
B 1 145 LEU 145 144 144 LEU LEU B . n 
B 1 146 ALA 146 145 145 ALA ALA B . n 
B 1 147 CYS 147 146 146 CYS CYS B . n 
B 1 148 GLY 148 147 147 GLY GLY B . n 
B 1 149 VAL 149 148 148 VAL VAL B . n 
B 1 150 ILE 150 149 149 ILE ILE B . n 
B 1 151 GLY 151 150 150 GLY GLY B . n 
B 1 152 ILE 152 151 151 ILE ILE B . n 
B 1 153 ALA 153 152 152 ALA ALA B . n 
B 1 154 GLN 154 153 153 GLN GLN B . n 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              ssh98@liverpool.ac.uk 
_pdbx_contact_author.name_first         S 
_pdbx_contact_author.name_last          Hasnain 
_pdbx_contact_author.name_mi            Samar 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-2854-4718 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 2 ACT 1   201 201 ACT ACT A . 
D 3 ZN  1   202 1   ZN  ZN  A . 
E 4 CU  1   203 1   CU  CU  A . 
F 5 SO4 1   204 2   SO4 SO4 A . 
G 5 SO4 1   205 3   SO4 SO4 A . 
H 3 ZN  1   201 2   ZN  ZN  B . 
I 4 CU  1   202 2   CU  CU  B . 
J 5 SO4 1   203 1   SO4 SO4 B . 
K 6 HOH 1   301 153 HOH HOH A . 
K 6 HOH 2   302 47  HOH HOH A . 
K 6 HOH 3   303 147 HOH HOH A . 
K 6 HOH 4   304 80  HOH HOH A . 
K 6 HOH 5   305 144 HOH HOH A . 
K 6 HOH 6   306 256 HOH HOH A . 
K 6 HOH 7   307 101 HOH HOH A . 
K 6 HOH 8   308 295 HOH HOH A . 
K 6 HOH 9   309 136 HOH HOH A . 
K 6 HOH 10  310 92  HOH HOH A . 
K 6 HOH 11  311 325 HOH HOH A . 
K 6 HOH 12  312 132 HOH HOH A . 
K 6 HOH 13  313 77  HOH HOH A . 
K 6 HOH 14  314 66  HOH HOH A . 
K 6 HOH 15  315 150 HOH HOH A . 
K 6 HOH 16  316 110 HOH HOH A . 
K 6 HOH 17  317 34  HOH HOH A . 
K 6 HOH 18  318 123 HOH HOH A . 
K 6 HOH 19  319 68  HOH HOH A . 
K 6 HOH 20  320 156 HOH HOH A . 
K 6 HOH 21  321 69  HOH HOH A . 
K 6 HOH 22  322 328 HOH HOH A . 
K 6 HOH 23  323 243 HOH HOH A . 
K 6 HOH 24  324 112 HOH HOH A . 
K 6 HOH 25  325 29  HOH HOH A . 
K 6 HOH 26  326 149 HOH HOH A . 
K 6 HOH 27  327 55  HOH HOH A . 
K 6 HOH 28  328 28  HOH HOH A . 
K 6 HOH 29  329 137 HOH HOH A . 
K 6 HOH 30  330 142 HOH HOH A . 
K 6 HOH 31  331 125 HOH HOH A . 
K 6 HOH 32  332 94  HOH HOH A . 
K 6 HOH 33  333 225 HOH HOH A . 
K 6 HOH 34  334 296 HOH HOH A . 
K 6 HOH 35  335 333 HOH HOH A . 
K 6 HOH 36  336 188 HOH HOH A . 
K 6 HOH 37  337 265 HOH HOH A . 
K 6 HOH 38  338 191 HOH HOH A . 
K 6 HOH 39  339 260 HOH HOH A . 
K 6 HOH 40  340 216 HOH HOH A . 
K 6 HOH 41  341 98  HOH HOH A . 
K 6 HOH 42  342 85  HOH HOH A . 
K 6 HOH 43  343 60  HOH HOH A . 
K 6 HOH 44  344 20  HOH HOH A . 
K 6 HOH 45  345 258 HOH HOH A . 
K 6 HOH 46  346 6   HOH HOH A . 
K 6 HOH 47  347 14  HOH HOH A . 
K 6 HOH 48  348 320 HOH HOH A . 
K 6 HOH 49  349 232 HOH HOH A . 
K 6 HOH 50  350 286 HOH HOH A . 
K 6 HOH 51  351 143 HOH HOH A . 
K 6 HOH 52  352 235 HOH HOH A . 
K 6 HOH 53  353 62  HOH HOH A . 
K 6 HOH 54  354 234 HOH HOH A . 
K 6 HOH 55  355 228 HOH HOH A . 
K 6 HOH 56  356 12  HOH HOH A . 
K 6 HOH 57  357 59  HOH HOH A . 
K 6 HOH 58  358 104 HOH HOH A . 
K 6 HOH 59  359 271 HOH HOH A . 
K 6 HOH 60  360 200 HOH HOH A . 
K 6 HOH 61  361 146 HOH HOH A . 
K 6 HOH 62  362 18  HOH HOH A . 
K 6 HOH 63  363 4   HOH HOH A . 
K 6 HOH 64  364 5   HOH HOH A . 
K 6 HOH 65  365 23  HOH HOH A . 
K 6 HOH 66  366 205 HOH HOH A . 
K 6 HOH 67  367 253 HOH HOH A . 
K 6 HOH 68  368 131 HOH HOH A . 
K 6 HOH 69  369 157 HOH HOH A . 
K 6 HOH 70  370 249 HOH HOH A . 
K 6 HOH 71  371 130 HOH HOH A . 
K 6 HOH 72  372 38  HOH HOH A . 
K 6 HOH 73  373 15  HOH HOH A . 
K 6 HOH 74  374 226 HOH HOH A . 
K 6 HOH 75  375 134 HOH HOH A . 
K 6 HOH 76  376 261 HOH HOH A . 
K 6 HOH 77  377 32  HOH HOH A . 
K 6 HOH 78  378 289 HOH HOH A . 
K 6 HOH 79  379 197 HOH HOH A . 
K 6 HOH 80  380 105 HOH HOH A . 
K 6 HOH 81  381 323 HOH HOH A . 
K 6 HOH 82  382 298 HOH HOH A . 
K 6 HOH 83  383 189 HOH HOH A . 
K 6 HOH 84  384 22  HOH HOH A . 
K 6 HOH 85  385 219 HOH HOH A . 
K 6 HOH 86  386 33  HOH HOH A . 
K 6 HOH 87  387 46  HOH HOH A . 
K 6 HOH 88  388 152 HOH HOH A . 
K 6 HOH 89  389 302 HOH HOH A . 
K 6 HOH 90  390 114 HOH HOH A . 
K 6 HOH 91  391 17  HOH HOH A . 
K 6 HOH 92  392 301 HOH HOH A . 
K 6 HOH 93  393 327 HOH HOH A . 
K 6 HOH 94  394 106 HOH HOH A . 
K 6 HOH 95  395 331 HOH HOH A . 
K 6 HOH 96  396 192 HOH HOH A . 
K 6 HOH 97  397 240 HOH HOH A . 
K 6 HOH 98  398 151 HOH HOH A . 
K 6 HOH 99  399 25  HOH HOH A . 
K 6 HOH 100 400 10  HOH HOH A . 
K 6 HOH 101 401 119 HOH HOH A . 
K 6 HOH 102 402 172 HOH HOH A . 
K 6 HOH 103 403 96  HOH HOH A . 
K 6 HOH 104 404 133 HOH HOH A . 
K 6 HOH 105 405 212 HOH HOH A . 
K 6 HOH 106 406 270 HOH HOH A . 
K 6 HOH 107 407 90  HOH HOH A . 
K 6 HOH 108 408 334 HOH HOH A . 
K 6 HOH 109 409 170 HOH HOH A . 
K 6 HOH 110 410 312 HOH HOH A . 
K 6 HOH 111 411 162 HOH HOH A . 
K 6 HOH 112 412 317 HOH HOH A . 
K 6 HOH 113 413 224 HOH HOH A . 
K 6 HOH 114 414 254 HOH HOH A . 
K 6 HOH 115 415 178 HOH HOH A . 
K 6 HOH 116 416 284 HOH HOH A . 
K 6 HOH 117 417 222 HOH HOH A . 
K 6 HOH 118 418 195 HOH HOH A . 
K 6 HOH 119 419 164 HOH HOH A . 
K 6 HOH 120 420 297 HOH HOH A . 
K 6 HOH 121 421 196 HOH HOH A . 
K 6 HOH 122 422 145 HOH HOH A . 
K 6 HOH 123 423 259 HOH HOH A . 
K 6 HOH 124 424 100 HOH HOH A . 
K 6 HOH 125 425 135 HOH HOH A . 
K 6 HOH 126 426 213 HOH HOH A . 
K 6 HOH 127 427 183 HOH HOH A . 
K 6 HOH 128 428 230 HOH HOH A . 
K 6 HOH 129 429 293 HOH HOH A . 
K 6 HOH 130 430 311 HOH HOH A . 
K 6 HOH 131 431 179 HOH HOH A . 
K 6 HOH 132 432 121 HOH HOH A . 
K 6 HOH 133 433 57  HOH HOH A . 
K 6 HOH 134 434 264 HOH HOH A . 
K 6 HOH 135 435 27  HOH HOH A . 
K 6 HOH 136 436 303 HOH HOH A . 
K 6 HOH 137 437 190 HOH HOH A . 
K 6 HOH 138 438 272 HOH HOH A . 
K 6 HOH 139 439 221 HOH HOH A . 
K 6 HOH 140 440 309 HOH HOH A . 
K 6 HOH 141 441 204 HOH HOH A . 
K 6 HOH 142 442 185 HOH HOH A . 
K 6 HOH 143 443 318 HOH HOH A . 
K 6 HOH 144 444 266 HOH HOH A . 
K 6 HOH 145 445 141 HOH HOH A . 
K 6 HOH 146 446 160 HOH HOH A . 
K 6 HOH 147 447 182 HOH HOH A . 
K 6 HOH 148 448 159 HOH HOH A . 
K 6 HOH 149 449 139 HOH HOH A . 
K 6 HOH 150 450 223 HOH HOH A . 
K 6 HOH 151 451 103 HOH HOH A . 
K 6 HOH 152 452 282 HOH HOH A . 
K 6 HOH 153 453 316 HOH HOH A . 
K 6 HOH 154 454 169 HOH HOH A . 
K 6 HOH 155 455 138 HOH HOH A . 
K 6 HOH 156 456 294 HOH HOH A . 
K 6 HOH 157 457 229 HOH HOH A . 
K 6 HOH 158 458 319 HOH HOH A . 
K 6 HOH 159 459 129 HOH HOH A . 
K 6 HOH 160 460 292 HOH HOH A . 
K 6 HOH 161 461 128 HOH HOH A . 
K 6 HOH 162 462 307 HOH HOH A . 
K 6 HOH 163 463 278 HOH HOH A . 
K 6 HOH 164 464 163 HOH HOH A . 
K 6 HOH 165 465 306 HOH HOH A . 
L 6 HOH 1   301 89  HOH HOH B . 
L 6 HOH 2   302 336 HOH HOH B . 
L 6 HOH 3   303 324 HOH HOH B . 
L 6 HOH 4   304 97  HOH HOH B . 
L 6 HOH 5   305 65  HOH HOH B . 
L 6 HOH 6   306 26  HOH HOH B . 
L 6 HOH 7   307 339 HOH HOH B . 
L 6 HOH 8   308 48  HOH HOH B . 
L 6 HOH 9   309 91  HOH HOH B . 
L 6 HOH 10  310 82  HOH HOH B . 
L 6 HOH 11  311 208 HOH HOH B . 
L 6 HOH 12  312 177 HOH HOH B . 
L 6 HOH 13  313 127 HOH HOH B . 
L 6 HOH 14  314 326 HOH HOH B . 
L 6 HOH 15  315 11  HOH HOH B . 
L 6 HOH 16  316 86  HOH HOH B . 
L 6 HOH 17  317 93  HOH HOH B . 
L 6 HOH 18  318 300 HOH HOH B . 
L 6 HOH 19  319 330 HOH HOH B . 
L 6 HOH 20  320 43  HOH HOH B . 
L 6 HOH 21  321 255 HOH HOH B . 
L 6 HOH 22  322 95  HOH HOH B . 
L 6 HOH 23  323 148 HOH HOH B . 
L 6 HOH 24  324 267 HOH HOH B . 
L 6 HOH 25  325 245 HOH HOH B . 
L 6 HOH 26  326 61  HOH HOH B . 
L 6 HOH 27  327 52  HOH HOH B . 
L 6 HOH 28  328 117 HOH HOH B . 
L 6 HOH 29  329 13  HOH HOH B . 
L 6 HOH 30  330 332 HOH HOH B . 
L 6 HOH 31  331 210 HOH HOH B . 
L 6 HOH 32  332 154 HOH HOH B . 
L 6 HOH 33  333 70  HOH HOH B . 
L 6 HOH 34  334 35  HOH HOH B . 
L 6 HOH 35  335 8   HOH HOH B . 
L 6 HOH 36  336 107 HOH HOH B . 
L 6 HOH 37  337 322 HOH HOH B . 
L 6 HOH 38  338 113 HOH HOH B . 
L 6 HOH 39  339 242 HOH HOH B . 
L 6 HOH 40  340 299 HOH HOH B . 
L 6 HOH 41  341 209 HOH HOH B . 
L 6 HOH 42  342 268 HOH HOH B . 
L 6 HOH 43  343 140 HOH HOH B . 
L 6 HOH 44  344 36  HOH HOH B . 
L 6 HOH 45  345 45  HOH HOH B . 
L 6 HOH 46  346 79  HOH HOH B . 
L 6 HOH 47  347 173 HOH HOH B . 
L 6 HOH 48  348 39  HOH HOH B . 
L 6 HOH 49  349 50  HOH HOH B . 
L 6 HOH 50  350 257 HOH HOH B . 
L 6 HOH 51  351 338 HOH HOH B . 
L 6 HOH 52  352 44  HOH HOH B . 
L 6 HOH 53  353 108 HOH HOH B . 
L 6 HOH 54  354 115 HOH HOH B . 
L 6 HOH 55  355 74  HOH HOH B . 
L 6 HOH 56  356 9   HOH HOH B . 
L 6 HOH 57  357 262 HOH HOH B . 
L 6 HOH 58  358 73  HOH HOH B . 
L 6 HOH 59  359 41  HOH HOH B . 
L 6 HOH 60  360 124 HOH HOH B . 
L 6 HOH 61  361 87  HOH HOH B . 
L 6 HOH 62  362 118 HOH HOH B . 
L 6 HOH 63  363 239 HOH HOH B . 
L 6 HOH 64  364 19  HOH HOH B . 
L 6 HOH 65  365 122 HOH HOH B . 
L 6 HOH 66  366 126 HOH HOH B . 
L 6 HOH 67  367 64  HOH HOH B . 
L 6 HOH 68  368 56  HOH HOH B . 
L 6 HOH 69  369 7   HOH HOH B . 
L 6 HOH 70  370 49  HOH HOH B . 
L 6 HOH 71  371 88  HOH HOH B . 
L 6 HOH 72  372 58  HOH HOH B . 
L 6 HOH 73  373 227 HOH HOH B . 
L 6 HOH 74  374 31  HOH HOH B . 
L 6 HOH 75  375 305 HOH HOH B . 
L 6 HOH 76  376 215 HOH HOH B . 
L 6 HOH 77  377 248 HOH HOH B . 
L 6 HOH 78  378 81  HOH HOH B . 
L 6 HOH 79  379 42  HOH HOH B . 
L 6 HOH 80  380 287 HOH HOH B . 
L 6 HOH 81  381 67  HOH HOH B . 
L 6 HOH 82  382 51  HOH HOH B . 
L 6 HOH 83  383 1   HOH HOH B . 
L 6 HOH 84  384 273 HOH HOH B . 
L 6 HOH 85  385 71  HOH HOH B . 
L 6 HOH 86  386 37  HOH HOH B . 
L 6 HOH 87  387 99  HOH HOH B . 
L 6 HOH 88  388 16  HOH HOH B . 
L 6 HOH 89  389 83  HOH HOH B . 
L 6 HOH 90  390 30  HOH HOH B . 
L 6 HOH 91  391 167 HOH HOH B . 
L 6 HOH 92  392 76  HOH HOH B . 
L 6 HOH 93  393 120 HOH HOH B . 
L 6 HOH 94  394 207 HOH HOH B . 
L 6 HOH 95  395 40  HOH HOH B . 
L 6 HOH 96  396 337 HOH HOH B . 
L 6 HOH 97  397 198 HOH HOH B . 
L 6 HOH 98  398 174 HOH HOH B . 
L 6 HOH 99  399 54  HOH HOH B . 
L 6 HOH 100 400 206 HOH HOH B . 
L 6 HOH 101 401 329 HOH HOH B . 
L 6 HOH 102 402 194 HOH HOH B . 
L 6 HOH 103 403 201 HOH HOH B . 
L 6 HOH 104 404 220 HOH HOH B . 
L 6 HOH 105 405 24  HOH HOH B . 
L 6 HOH 106 406 2   HOH HOH B . 
L 6 HOH 107 407 21  HOH HOH B . 
L 6 HOH 108 408 109 HOH HOH B . 
L 6 HOH 109 409 193 HOH HOH B . 
L 6 HOH 110 410 186 HOH HOH B . 
L 6 HOH 111 411 291 HOH HOH B . 
L 6 HOH 112 412 246 HOH HOH B . 
L 6 HOH 113 413 237 HOH HOH B . 
L 6 HOH 114 414 184 HOH HOH B . 
L 6 HOH 115 415 158 HOH HOH B . 
L 6 HOH 116 416 102 HOH HOH B . 
L 6 HOH 117 417 161 HOH HOH B . 
L 6 HOH 118 418 283 HOH HOH B . 
L 6 HOH 119 419 78  HOH HOH B . 
L 6 HOH 120 420 166 HOH HOH B . 
L 6 HOH 121 421 288 HOH HOH B . 
L 6 HOH 122 422 269 HOH HOH B . 
L 6 HOH 123 423 236 HOH HOH B . 
L 6 HOH 124 424 250 HOH HOH B . 
L 6 HOH 125 425 202 HOH HOH B . 
L 6 HOH 126 426 233 HOH HOH B . 
L 6 HOH 127 427 176 HOH HOH B . 
L 6 HOH 128 428 175 HOH HOH B . 
L 6 HOH 129 429 168 HOH HOH B . 
L 6 HOH 130 430 155 HOH HOH B . 
L 6 HOH 131 431 276 HOH HOH B . 
L 6 HOH 132 432 247 HOH HOH B . 
L 6 HOH 133 433 199 HOH HOH B . 
L 6 HOH 134 434 84  HOH HOH B . 
L 6 HOH 135 435 244 HOH HOH B . 
L 6 HOH 136 436 251 HOH HOH B . 
L 6 HOH 137 437 53  HOH HOH B . 
L 6 HOH 138 438 304 HOH HOH B . 
L 6 HOH 139 439 314 HOH HOH B . 
L 6 HOH 140 440 231 HOH HOH B . 
L 6 HOH 141 441 315 HOH HOH B . 
L 6 HOH 142 442 275 HOH HOH B . 
L 6 HOH 143 443 241 HOH HOH B . 
L 6 HOH 144 444 211 HOH HOH B . 
L 6 HOH 145 445 263 HOH HOH B . 
L 6 HOH 146 446 281 HOH HOH B . 
L 6 HOH 147 447 313 HOH HOH B . 
L 6 HOH 148 448 171 HOH HOH B . 
L 6 HOH 149 449 274 HOH HOH B . 
L 6 HOH 150 450 218 HOH HOH B . 
L 6 HOH 151 451 335 HOH HOH B . 
L 6 HOH 152 452 181 HOH HOH B . 
L 6 HOH 153 453 290 HOH HOH B . 
L 6 HOH 154 454 217 HOH HOH B . 
L 6 HOH 155 455 280 HOH HOH B . 
L 6 HOH 156 456 277 HOH HOH B . 
L 6 HOH 157 457 238 HOH HOH B . 
L 6 HOH 158 458 111 HOH HOH B . 
L 6 HOH 159 459 252 HOH HOH B . 
L 6 HOH 160 460 308 HOH HOH B . 
L 6 HOH 161 461 279 HOH HOH B . 
L 6 HOH 162 462 165 HOH HOH B . 
L 6 HOH 163 463 116 HOH HOH B . 
L 6 HOH 164 464 285 HOH HOH B . 
L 6 HOH 165 465 180 HOH HOH B . 
L 6 HOH 166 466 214 HOH HOH B . 
L 6 HOH 167 467 187 HOH HOH B . 
L 6 HOH 168 468 321 HOH HOH B . 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K,L 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 2260  ? 
1 MORE         -64   ? 
1 'SSA (A^2)'  14310 ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  ND1 ? A HIS 47 ? A HIS 46 ? 1_555 CU ? E CU . ? A CU 203 ? 1_555 NE2 ? A HIS 49  ? A HIS 48  ? 1_555 133.0 ? 
2  ND1 ? A HIS 47 ? A HIS 46 ? 1_555 CU ? E CU . ? A CU 203 ? 1_555 NE2 ? A HIS 121 ? A HIS 120 ? 1_555 101.4 ? 
3  NE2 ? A HIS 49 ? A HIS 48 ? 1_555 CU ? E CU . ? A CU 203 ? 1_555 NE2 ? A HIS 121 ? A HIS 120 ? 1_555 118.7 ? 
4  ND1 ? A HIS 64 ? A HIS 63 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 ND1 ? A HIS 72  ? A HIS 71  ? 1_555 102.2 ? 
5  ND1 ? A HIS 64 ? A HIS 63 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 ND1 ? A HIS 81  ? A HIS 80  ? 1_555 116.6 ? 
6  ND1 ? A HIS 72 ? A HIS 71 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 ND1 ? A HIS 81  ? A HIS 80  ? 1_555 124.6 ? 
7  ND1 ? A HIS 64 ? A HIS 63 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 OD1 ? A ASP 84  ? A ASP 83  ? 1_555 98.1  ? 
8  ND1 ? A HIS 72 ? A HIS 71 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 OD1 ? A ASP 84  ? A ASP 83  ? 1_555 87.9  ? 
9  ND1 ? A HIS 81 ? A HIS 80 ? 1_555 ZN ? D ZN . ? A ZN 202 ? 1_555 OD1 ? A ASP 84  ? A ASP 83  ? 1_555 121.3 ? 
10 ND1 ? B HIS 47 ? B HIS 46 ? 1_555 CU ? I CU . ? B CU 202 ? 1_555 NE2 ? B HIS 49  ? B HIS 48  ? 1_555 139.9 ? 
11 ND1 ? B HIS 47 ? B HIS 46 ? 1_555 CU ? I CU . ? B CU 202 ? 1_555 NE2 ? B HIS 121 ? B HIS 120 ? 1_555 101.3 ? 
12 NE2 ? B HIS 49 ? B HIS 48 ? 1_555 CU ? I CU . ? B CU 202 ? 1_555 NE2 ? B HIS 121 ? B HIS 120 ? 1_555 118.5 ? 
13 ND1 ? B HIS 64 ? B HIS 63 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 ND1 ? B HIS 72  ? B HIS 71  ? 1_555 104.3 ? 
14 ND1 ? B HIS 64 ? B HIS 63 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 ND1 ? B HIS 81  ? B HIS 80  ? 1_555 117.7 ? 
15 ND1 ? B HIS 72 ? B HIS 71 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 ND1 ? B HIS 81  ? B HIS 80  ? 1_555 122.6 ? 
16 ND1 ? B HIS 64 ? B HIS 63 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 OD1 ? B ASP 84  ? B ASP 83  ? 1_555 107.8 ? 
17 ND1 ? B HIS 72 ? B HIS 71 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 OD1 ? B ASP 84  ? B ASP 83  ? 1_555 89.7  ? 
18 ND1 ? B HIS 81 ? B HIS 80 ? 1_555 ZN ? H ZN . ? B ZN 201 ? 1_555 OD1 ? B ASP 84  ? B ASP 83  ? 1_555 110.7 ? 
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2023-12-13 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement        ? ? ? ? ? ? ? ? ? ? ? REFMAC    ? ? ? 5.8.0267 1 
? refinement        ? ? ? ? ? ? ? ? ? ? ? REFMAC    ? ? ? 5.8.0267 2 
? 'data collection' ? ? ? ? ? ? ? ? ? ? ? MAR345dtb ? ? ? .        3 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? MOSFLM    ? ? ? .        4 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? .        5 
? phasing           ? ? ? ? ? ? ? ? ? ? ? MOLREP    ? ? ? .        6 
# 
_pdbx_entry_details.entry_id                   8Q6M 
_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   ? 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 HE2 B HIS 48  ? ? CU B CU  202 ? ? 1.17 
2  1 HD1 A HIS 80  ? ? ZN A ZN  202 ? ? 1.23 
3  1 HD1 B HIS 63  ? ? ZN B ZN  201 ? ? 1.25 
4  1 HE2 A HIS 120 ? ? CU A CU  203 ? ? 1.27 
5  1 HD1 A HIS 63  ? ? ZN A ZN  202 ? ? 1.27 
6  1 HD1 A HIS 46  ? ? CU A CU  203 ? ? 1.28 
7  1 HE2 B HIS 120 ? ? CU B CU  202 ? ? 1.28 
8  1 HD1 B HIS 80  ? ? ZN B ZN  201 ? ? 1.29 
9  1 HE2 A HIS 48  ? ? CU A CU  203 ? ? 1.31 
10 1 HD1 B HIS 71  ? ? ZN B ZN  201 ? ? 1.35 
11 1 HD1 A HIS 71  ? ? ZN A ZN  202 ? ? 1.36 
12 1 HD1 B HIS 46  ? ? CU B CU  202 ? ? 1.44 
13 1 H   B HIS 110 ? ? O  B HOH 309 ? ? 1.58 
14 1 O   B HOH 406 ? ? O  B HOH 450 ? ? 2.12 
15 1 O   A HOH 335 ? ? O  A HOH 366 ? ? 2.17 
16 1 O   B HOH 329 ? ? O  B HOH 342 ? ? 2.18 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 LYS A 136 ? ? -121.41 -56.85 
2 1 PRO B 13  ? A -90.08  35.78  
3 1 LYS B 136 ? ? -122.05 -59.73 
# 
_pdbx_validate_peptide_omega.id               1 
_pdbx_validate_peptide_omega.PDB_model_num    1 
_pdbx_validate_peptide_omega.auth_comp_id_1   GLY 
_pdbx_validate_peptide_omega.auth_asym_id_1   B 
_pdbx_validate_peptide_omega.auth_seq_id_1    12 
_pdbx_validate_peptide_omega.PDB_ins_code_1   ? 
_pdbx_validate_peptide_omega.label_alt_id_1   B 
_pdbx_validate_peptide_omega.auth_comp_id_2   PRO 
_pdbx_validate_peptide_omega.auth_asym_id_2   B 
_pdbx_validate_peptide_omega.auth_seq_id_2    13 
_pdbx_validate_peptide_omega.PDB_ins_code_2   ? 
_pdbx_validate_peptide_omega.label_alt_id_2   B 
_pdbx_validate_peptide_omega.omega            68.81 
# 
_pdbx_distant_solvent_atoms.id                                1 
_pdbx_distant_solvent_atoms.PDB_model_num                     1 
_pdbx_distant_solvent_atoms.auth_atom_id                      O 
_pdbx_distant_solvent_atoms.label_alt_id                      ? 
_pdbx_distant_solvent_atoms.auth_asym_id                      B 
_pdbx_distant_solvent_atoms.auth_comp_id                      HOH 
_pdbx_distant_solvent_atoms.auth_seq_id                       468 
_pdbx_distant_solvent_atoms.PDB_ins_code                      ? 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance   6.45 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance          . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1 1 Y 1 A MET 0 ? A MET 1 
2 1 Y 1 B MET 0 ? B MET 1 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ACT C    C  N N 1   
ACT O    O  N N 2   
ACT OXT  O  N N 3   
ACT CH3  C  N N 4   
ACT H1   H  N N 5   
ACT H2   H  N N 6   
ACT H3   H  N N 7   
ALA N    N  N N 8   
ALA CA   C  N S 9   
ALA C    C  N N 10  
ALA O    O  N N 11  
ALA CB   C  N N 12  
ALA OXT  O  N N 13  
ALA H    H  N N 14  
ALA H2   H  N N 15  
ALA HA   H  N N 16  
ALA HB1  H  N N 17  
ALA HB2  H  N N 18  
ALA HB3  H  N N 19  
ALA HXT  H  N N 20  
ARG N    N  N N 21  
ARG CA   C  N S 22  
ARG C    C  N N 23  
ARG O    O  N N 24  
ARG CB   C  N N 25  
ARG CG   C  N N 26  
ARG CD   C  N N 27  
ARG NE   N  N N 28  
ARG CZ   C  N N 29  
ARG NH1  N  N N 30  
ARG NH2  N  N N 31  
ARG OXT  O  N N 32  
ARG H    H  N N 33  
ARG H2   H  N N 34  
ARG HA   H  N N 35  
ARG HB2  H  N N 36  
ARG HB3  H  N N 37  
ARG HG2  H  N N 38  
ARG HG3  H  N N 39  
ARG HD2  H  N N 40  
ARG HD3  H  N N 41  
ARG HE   H  N N 42  
ARG HH11 H  N N 43  
ARG HH12 H  N N 44  
ARG HH21 H  N N 45  
ARG HH22 H  N N 46  
ARG HXT  H  N N 47  
ASN N    N  N N 48  
ASN CA   C  N S 49  
ASN C    C  N N 50  
ASN O    O  N N 51  
ASN CB   C  N N 52  
ASN CG   C  N N 53  
ASN OD1  O  N N 54  
ASN ND2  N  N N 55  
ASN OXT  O  N N 56  
ASN H    H  N N 57  
ASN H2   H  N N 58  
ASN HA   H  N N 59  
ASN HB2  H  N N 60  
ASN HB3  H  N N 61  
ASN HD21 H  N N 62  
ASN HD22 H  N N 63  
ASN HXT  H  N N 64  
ASP N    N  N N 65  
ASP CA   C  N S 66  
ASP C    C  N N 67  
ASP O    O  N N 68  
ASP CB   C  N N 69  
ASP CG   C  N N 70  
ASP OD1  O  N N 71  
ASP OD2  O  N N 72  
ASP OXT  O  N N 73  
ASP H    H  N N 74  
ASP H2   H  N N 75  
ASP HA   H  N N 76  
ASP HB2  H  N N 77  
ASP HB3  H  N N 78  
ASP HD2  H  N N 79  
ASP HXT  H  N N 80  
CU  CU   CU N N 81  
CYS N    N  N N 82  
CYS CA   C  N R 83  
CYS C    C  N N 84  
CYS O    O  N N 85  
CYS CB   C  N N 86  
CYS SG   S  N N 87  
CYS OXT  O  N N 88  
CYS H    H  N N 89  
CYS H2   H  N N 90  
CYS HA   H  N N 91  
CYS HB2  H  N N 92  
CYS HB3  H  N N 93  
CYS HG   H  N N 94  
CYS HXT  H  N N 95  
GLN N    N  N N 96  
GLN CA   C  N S 97  
GLN C    C  N N 98  
GLN O    O  N N 99  
GLN CB   C  N N 100 
GLN CG   C  N N 101 
GLN CD   C  N N 102 
GLN OE1  O  N N 103 
GLN NE2  N  N N 104 
GLN OXT  O  N N 105 
GLN H    H  N N 106 
GLN H2   H  N N 107 
GLN HA   H  N N 108 
GLN HB2  H  N N 109 
GLN HB3  H  N N 110 
GLN HG2  H  N N 111 
GLN HG3  H  N N 112 
GLN HE21 H  N N 113 
GLN HE22 H  N N 114 
GLN HXT  H  N N 115 
GLU N    N  N N 116 
GLU CA   C  N S 117 
GLU C    C  N N 118 
GLU O    O  N N 119 
GLU CB   C  N N 120 
GLU CG   C  N N 121 
GLU CD   C  N N 122 
GLU OE1  O  N N 123 
GLU OE2  O  N N 124 
GLU OXT  O  N N 125 
GLU H    H  N N 126 
GLU H2   H  N N 127 
GLU HA   H  N N 128 
GLU HB2  H  N N 129 
GLU HB3  H  N N 130 
GLU HG2  H  N N 131 
GLU HG3  H  N N 132 
GLU HE2  H  N N 133 
GLU HXT  H  N N 134 
GLY N    N  N N 135 
GLY CA   C  N N 136 
GLY C    C  N N 137 
GLY O    O  N N 138 
GLY OXT  O  N N 139 
GLY H    H  N N 140 
GLY H2   H  N N 141 
GLY HA2  H  N N 142 
GLY HA3  H  N N 143 
GLY HXT  H  N N 144 
HIS N    N  N N 145 
HIS CA   C  N S 146 
HIS C    C  N N 147 
HIS O    O  N N 148 
HIS CB   C  N N 149 
HIS CG   C  Y N 150 
HIS ND1  N  Y N 151 
HIS CD2  C  Y N 152 
HIS CE1  C  Y N 153 
HIS NE2  N  Y N 154 
HIS OXT  O  N N 155 
HIS H    H  N N 156 
HIS H2   H  N N 157 
HIS HA   H  N N 158 
HIS HB2  H  N N 159 
HIS HB3  H  N N 160 
HIS HD1  H  N N 161 
HIS HD2  H  N N 162 
HIS HE1  H  N N 163 
HIS HE2  H  N N 164 
HIS HXT  H  N N 165 
HOH O    O  N N 166 
HOH H1   H  N N 167 
HOH H2   H  N N 168 
ILE N    N  N N 169 
ILE CA   C  N S 170 
ILE C    C  N N 171 
ILE O    O  N N 172 
ILE CB   C  N S 173 
ILE CG1  C  N N 174 
ILE CG2  C  N N 175 
ILE CD1  C  N N 176 
ILE OXT  O  N N 177 
ILE H    H  N N 178 
ILE H2   H  N N 179 
ILE HA   H  N N 180 
ILE HB   H  N N 181 
ILE HG12 H  N N 182 
ILE HG13 H  N N 183 
ILE HG21 H  N N 184 
ILE HG22 H  N N 185 
ILE HG23 H  N N 186 
ILE HD11 H  N N 187 
ILE HD12 H  N N 188 
ILE HD13 H  N N 189 
ILE HXT  H  N N 190 
LEU N    N  N N 191 
LEU CA   C  N S 192 
LEU C    C  N N 193 
LEU O    O  N N 194 
LEU CB   C  N N 195 
LEU CG   C  N N 196 
LEU CD1  C  N N 197 
LEU CD2  C  N N 198 
LEU OXT  O  N N 199 
LEU H    H  N N 200 
LEU H2   H  N N 201 
LEU HA   H  N N 202 
LEU HB2  H  N N 203 
LEU HB3  H  N N 204 
LEU HG   H  N N 205 
LEU HD11 H  N N 206 
LEU HD12 H  N N 207 
LEU HD13 H  N N 208 
LEU HD21 H  N N 209 
LEU HD22 H  N N 210 
LEU HD23 H  N N 211 
LEU HXT  H  N N 212 
LYS N    N  N N 213 
LYS CA   C  N S 214 
LYS C    C  N N 215 
LYS O    O  N N 216 
LYS CB   C  N N 217 
LYS CG   C  N N 218 
LYS CD   C  N N 219 
LYS CE   C  N N 220 
LYS NZ   N  N N 221 
LYS OXT  O  N N 222 
LYS H    H  N N 223 
LYS H2   H  N N 224 
LYS HA   H  N N 225 
LYS HB2  H  N N 226 
LYS HB3  H  N N 227 
LYS HG2  H  N N 228 
LYS HG3  H  N N 229 
LYS HD2  H  N N 230 
LYS HD3  H  N N 231 
LYS HE2  H  N N 232 
LYS HE3  H  N N 233 
LYS HZ1  H  N N 234 
LYS HZ2  H  N N 235 
LYS HZ3  H  N N 236 
LYS HXT  H  N N 237 
MET N    N  N N 238 
MET CA   C  N S 239 
MET C    C  N N 240 
MET O    O  N N 241 
MET CB   C  N N 242 
MET CG   C  N N 243 
MET SD   S  N N 244 
MET CE   C  N N 245 
MET OXT  O  N N 246 
MET H    H  N N 247 
MET H2   H  N N 248 
MET HA   H  N N 249 
MET HB2  H  N N 250 
MET HB3  H  N N 251 
MET HG2  H  N N 252 
MET HG3  H  N N 253 
MET HE1  H  N N 254 
MET HE2  H  N N 255 
MET HE3  H  N N 256 
MET HXT  H  N N 257 
PHE N    N  N N 258 
PHE CA   C  N S 259 
PHE C    C  N N 260 
PHE O    O  N N 261 
PHE CB   C  N N 262 
PHE CG   C  Y N 263 
PHE CD1  C  Y N 264 
PHE CD2  C  Y N 265 
PHE CE1  C  Y N 266 
PHE CE2  C  Y N 267 
PHE CZ   C  Y N 268 
PHE OXT  O  N N 269 
PHE H    H  N N 270 
PHE H2   H  N N 271 
PHE HA   H  N N 272 
PHE HB2  H  N N 273 
PHE HB3  H  N N 274 
PHE HD1  H  N N 275 
PHE HD2  H  N N 276 
PHE HE1  H  N N 277 
PHE HE2  H  N N 278 
PHE HZ   H  N N 279 
PHE HXT  H  N N 280 
PRO N    N  N N 281 
PRO CA   C  N S 282 
PRO C    C  N N 283 
PRO O    O  N N 284 
PRO CB   C  N N 285 
PRO CG   C  N N 286 
PRO CD   C  N N 287 
PRO OXT  O  N N 288 
PRO H    H  N N 289 
PRO HA   H  N N 290 
PRO HB2  H  N N 291 
PRO HB3  H  N N 292 
PRO HG2  H  N N 293 
PRO HG3  H  N N 294 
PRO HD2  H  N N 295 
PRO HD3  H  N N 296 
PRO HXT  H  N N 297 
SER N    N  N N 298 
SER CA   C  N S 299 
SER C    C  N N 300 
SER O    O  N N 301 
SER CB   C  N N 302 
SER OG   O  N N 303 
SER OXT  O  N N 304 
SER H    H  N N 305 
SER H2   H  N N 306 
SER HA   H  N N 307 
SER HB2  H  N N 308 
SER HB3  H  N N 309 
SER HG   H  N N 310 
SER HXT  H  N N 311 
SO4 S    S  N N 312 
SO4 O1   O  N N 313 
SO4 O2   O  N N 314 
SO4 O3   O  N N 315 
SO4 O4   O  N N 316 
THR N    N  N N 317 
THR CA   C  N S 318 
THR C    C  N N 319 
THR O    O  N N 320 
THR CB   C  N R 321 
THR OG1  O  N N 322 
THR CG2  C  N N 323 
THR OXT  O  N N 324 
THR H    H  N N 325 
THR H2   H  N N 326 
THR HA   H  N N 327 
THR HB   H  N N 328 
THR HG1  H  N N 329 
THR HG21 H  N N 330 
THR HG22 H  N N 331 
THR HG23 H  N N 332 
THR HXT  H  N N 333 
TRP N    N  N N 334 
TRP CA   C  N S 335 
TRP C    C  N N 336 
TRP O    O  N N 337 
TRP CB   C  N N 338 
TRP CG   C  Y N 339 
TRP CD1  C  Y N 340 
TRP CD2  C  Y N 341 
TRP NE1  N  Y N 342 
TRP CE2  C  Y N 343 
TRP CE3  C  Y N 344 
TRP CZ2  C  Y N 345 
TRP CZ3  C  Y N 346 
TRP CH2  C  Y N 347 
TRP OXT  O  N N 348 
TRP H    H  N N 349 
TRP H2   H  N N 350 
TRP HA   H  N N 351 
TRP HB2  H  N N 352 
TRP HB3  H  N N 353 
TRP HD1  H  N N 354 
TRP HE1  H  N N 355 
TRP HE3  H  N N 356 
TRP HZ2  H  N N 357 
TRP HZ3  H  N N 358 
TRP HH2  H  N N 359 
TRP HXT  H  N N 360 
VAL N    N  N N 361 
VAL CA   C  N S 362 
VAL C    C  N N 363 
VAL O    O  N N 364 
VAL CB   C  N N 365 
VAL CG1  C  N N 366 
VAL CG2  C  N N 367 
VAL OXT  O  N N 368 
VAL H    H  N N 369 
VAL H2   H  N N 370 
VAL HA   H  N N 371 
VAL HB   H  N N 372 
VAL HG11 H  N N 373 
VAL HG12 H  N N 374 
VAL HG13 H  N N 375 
VAL HG21 H  N N 376 
VAL HG22 H  N N 377 
VAL HG23 H  N N 378 
VAL HXT  H  N N 379 
ZN  ZN   ZN N N 380 
# 
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 
ACT C   O    doub N N 1   
ACT C   OXT  sing N N 2   
ACT C   CH3  sing N N 3   
ACT CH3 H1   sing N N 4   
ACT CH3 H2   sing N N 5   
ACT CH3 H3   sing N N 6   
ALA N   CA   sing N N 7   
ALA N   H    sing N N 8   
ALA N   H2   sing N N 9   
ALA CA  C    sing N N 10  
ALA CA  CB   sing N N 11  
ALA CA  HA   sing N N 12  
ALA C   O    doub N N 13  
ALA C   OXT  sing N N 14  
ALA CB  HB1  sing N N 15  
ALA CB  HB2  sing N N 16  
ALA CB  HB3  sing N N 17  
ALA OXT HXT  sing N N 18  
ARG N   CA   sing N N 19  
ARG N   H    sing N N 20  
ARG N   H2   sing N N 21  
ARG CA  C    sing N N 22  
ARG CA  CB   sing N N 23  
ARG CA  HA   sing N N 24  
ARG C   O    doub N N 25  
ARG C   OXT  sing N N 26  
ARG CB  CG   sing N N 27  
ARG CB  HB2  sing N N 28  
ARG CB  HB3  sing N N 29  
ARG CG  CD   sing N N 30  
ARG CG  HG2  sing N N 31  
ARG CG  HG3  sing N N 32  
ARG CD  NE   sing N N 33  
ARG CD  HD2  sing N N 34  
ARG CD  HD3  sing N N 35  
ARG NE  CZ   sing N N 36  
ARG NE  HE   sing N N 37  
ARG CZ  NH1  sing N N 38  
ARG CZ  NH2  doub N N 39  
ARG NH1 HH11 sing N N 40  
ARG NH1 HH12 sing N N 41  
ARG NH2 HH21 sing N N 42  
ARG NH2 HH22 sing N N 43  
ARG OXT HXT  sing N N 44  
ASN N   CA   sing N N 45  
ASN N   H    sing N N 46  
ASN N   H2   sing N N 47  
ASN CA  C    sing N N 48  
ASN CA  CB   sing N N 49  
ASN CA  HA   sing N N 50  
ASN C   O    doub N N 51  
ASN C   OXT  sing N N 52  
ASN CB  CG   sing N N 53  
ASN CB  HB2  sing N N 54  
ASN CB  HB3  sing N N 55  
ASN CG  OD1  doub N N 56  
ASN CG  ND2  sing N N 57  
ASN ND2 HD21 sing N N 58  
ASN ND2 HD22 sing N N 59  
ASN OXT HXT  sing N N 60  
ASP N   CA   sing N N 61  
ASP N   H    sing N N 62  
ASP N   H2   sing N N 63  
ASP CA  C    sing N N 64  
ASP CA  CB   sing N N 65  
ASP CA  HA   sing N N 66  
ASP C   O    doub N N 67  
ASP C   OXT  sing N N 68  
ASP CB  CG   sing N N 69  
ASP CB  HB2  sing N N 70  
ASP CB  HB3  sing N N 71  
ASP CG  OD1  doub N N 72  
ASP CG  OD2  sing N N 73  
ASP OD2 HD2  sing N N 74  
ASP OXT HXT  sing N N 75  
CYS N   CA   sing N N 76  
CYS N   H    sing N N 77  
CYS N   H2   sing N N 78  
CYS CA  C    sing N N 79  
CYS CA  CB   sing N N 80  
CYS CA  HA   sing N N 81  
CYS C   O    doub N N 82  
CYS C   OXT  sing N N 83  
CYS CB  SG   sing N N 84  
CYS CB  HB2  sing N N 85  
CYS CB  HB3  sing N N 86  
CYS SG  HG   sing N N 87  
CYS OXT HXT  sing N N 88  
GLN N   CA   sing N N 89  
GLN N   H    sing N N 90  
GLN N   H2   sing N N 91  
GLN CA  C    sing N N 92  
GLN CA  CB   sing N N 93  
GLN CA  HA   sing N N 94  
GLN C   O    doub N N 95  
GLN C   OXT  sing N N 96  
GLN CB  CG   sing N N 97  
GLN CB  HB2  sing N N 98  
GLN CB  HB3  sing N N 99  
GLN CG  CD   sing N N 100 
GLN CG  HG2  sing N N 101 
GLN CG  HG3  sing N N 102 
GLN CD  OE1  doub N N 103 
GLN CD  NE2  sing N N 104 
GLN NE2 HE21 sing N N 105 
GLN NE2 HE22 sing N N 106 
GLN OXT HXT  sing N N 107 
GLU N   CA   sing N N 108 
GLU N   H    sing N N 109 
GLU N   H2   sing N N 110 
GLU CA  C    sing N N 111 
GLU CA  CB   sing N N 112 
GLU CA  HA   sing N N 113 
GLU C   O    doub N N 114 
GLU C   OXT  sing N N 115 
GLU CB  CG   sing N N 116 
GLU CB  HB2  sing N N 117 
GLU CB  HB3  sing N N 118 
GLU CG  CD   sing N N 119 
GLU CG  HG2  sing N N 120 
GLU CG  HG3  sing N N 121 
GLU CD  OE1  doub N N 122 
GLU CD  OE2  sing N N 123 
GLU OE2 HE2  sing N N 124 
GLU OXT HXT  sing N N 125 
GLY N   CA   sing N N 126 
GLY N   H    sing N N 127 
GLY N   H2   sing N N 128 
GLY CA  C    sing N N 129 
GLY CA  HA2  sing N N 130 
GLY CA  HA3  sing N N 131 
GLY C   O    doub N N 132 
GLY C   OXT  sing N N 133 
GLY OXT HXT  sing N N 134 
HIS N   CA   sing N N 135 
HIS N   H    sing N N 136 
HIS N   H2   sing N N 137 
HIS CA  C    sing N N 138 
HIS CA  CB   sing N N 139 
HIS CA  HA   sing N N 140 
HIS C   O    doub N N 141 
HIS C   OXT  sing N N 142 
HIS CB  CG   sing N N 143 
HIS CB  HB2  sing N N 144 
HIS CB  HB3  sing N N 145 
HIS CG  ND1  sing Y N 146 
HIS CG  CD2  doub Y N 147 
HIS ND1 CE1  doub Y N 148 
HIS ND1 HD1  sing N N 149 
HIS CD2 NE2  sing Y N 150 
HIS CD2 HD2  sing N N 151 
HIS CE1 NE2  sing Y N 152 
HIS CE1 HE1  sing N N 153 
HIS NE2 HE2  sing N N 154 
HIS OXT HXT  sing N N 155 
HOH O   H1   sing N N 156 
HOH O   H2   sing N N 157 
ILE N   CA   sing N N 158 
ILE N   H    sing N N 159 
ILE N   H2   sing N N 160 
ILE CA  C    sing N N 161 
ILE CA  CB   sing N N 162 
ILE CA  HA   sing N N 163 
ILE C   O    doub N N 164 
ILE C   OXT  sing N N 165 
ILE CB  CG1  sing N N 166 
ILE CB  CG2  sing N N 167 
ILE CB  HB   sing N N 168 
ILE CG1 CD1  sing N N 169 
ILE CG1 HG12 sing N N 170 
ILE CG1 HG13 sing N N 171 
ILE CG2 HG21 sing N N 172 
ILE CG2 HG22 sing N N 173 
ILE CG2 HG23 sing N N 174 
ILE CD1 HD11 sing N N 175 
ILE CD1 HD12 sing N N 176 
ILE CD1 HD13 sing N N 177 
ILE OXT HXT  sing N N 178 
LEU N   CA   sing N N 179 
LEU N   H    sing N N 180 
LEU N   H2   sing N N 181 
LEU CA  C    sing N N 182 
LEU CA  CB   sing N N 183 
LEU CA  HA   sing N N 184 
LEU C   O    doub N N 185 
LEU C   OXT  sing N N 186 
LEU CB  CG   sing N N 187 
LEU CB  HB2  sing N N 188 
LEU CB  HB3  sing N N 189 
LEU CG  CD1  sing N N 190 
LEU CG  CD2  sing N N 191 
LEU CG  HG   sing N N 192 
LEU CD1 HD11 sing N N 193 
LEU CD1 HD12 sing N N 194 
LEU CD1 HD13 sing N N 195 
LEU CD2 HD21 sing N N 196 
LEU CD2 HD22 sing N N 197 
LEU CD2 HD23 sing N N 198 
LEU OXT HXT  sing N N 199 
LYS N   CA   sing N N 200 
LYS N   H    sing N N 201 
LYS N   H2   sing N N 202 
LYS CA  C    sing N N 203 
LYS CA  CB   sing N N 204 
LYS CA  HA   sing N N 205 
LYS C   O    doub N N 206 
LYS C   OXT  sing N N 207 
LYS CB  CG   sing N N 208 
LYS CB  HB2  sing N N 209 
LYS CB  HB3  sing N N 210 
LYS CG  CD   sing N N 211 
LYS CG  HG2  sing N N 212 
LYS CG  HG3  sing N N 213 
LYS CD  CE   sing N N 214 
LYS CD  HD2  sing N N 215 
LYS CD  HD3  sing N N 216 
LYS CE  NZ   sing N N 217 
LYS CE  HE2  sing N N 218 
LYS CE  HE3  sing N N 219 
LYS NZ  HZ1  sing N N 220 
LYS NZ  HZ2  sing N N 221 
LYS NZ  HZ3  sing N N 222 
LYS OXT HXT  sing N N 223 
MET N   CA   sing N N 224 
MET N   H    sing N N 225 
MET N   H2   sing N N 226 
MET CA  C    sing N N 227 
MET CA  CB   sing N N 228 
MET CA  HA   sing N N 229 
MET C   O    doub N N 230 
MET C   OXT  sing N N 231 
MET CB  CG   sing N N 232 
MET CB  HB2  sing N N 233 
MET CB  HB3  sing N N 234 
MET CG  SD   sing N N 235 
MET CG  HG2  sing N N 236 
MET CG  HG3  sing N N 237 
MET SD  CE   sing N N 238 
MET CE  HE1  sing N N 239 
MET CE  HE2  sing N N 240 
MET CE  HE3  sing N N 241 
MET OXT HXT  sing N N 242 
PHE N   CA   sing N N 243 
PHE N   H    sing N N 244 
PHE N   H2   sing N N 245 
PHE CA  C    sing N N 246 
PHE CA  CB   sing N N 247 
PHE CA  HA   sing N N 248 
PHE C   O    doub N N 249 
PHE C   OXT  sing N N 250 
PHE CB  CG   sing N N 251 
PHE CB  HB2  sing N N 252 
PHE CB  HB3  sing N N 253 
PHE CG  CD1  doub Y N 254 
PHE CG  CD2  sing Y N 255 
PHE CD1 CE1  sing Y N 256 
PHE CD1 HD1  sing N N 257 
PHE CD2 CE2  doub Y N 258 
PHE CD2 HD2  sing N N 259 
PHE CE1 CZ   doub Y N 260 
PHE CE1 HE1  sing N N 261 
PHE CE2 CZ   sing Y N 262 
PHE CE2 HE2  sing N N 263 
PHE CZ  HZ   sing N N 264 
PHE OXT HXT  sing N N 265 
PRO N   CA   sing N N 266 
PRO N   CD   sing N N 267 
PRO N   H    sing N N 268 
PRO CA  C    sing N N 269 
PRO CA  CB   sing N N 270 
PRO CA  HA   sing N N 271 
PRO C   O    doub N N 272 
PRO C   OXT  sing N N 273 
PRO CB  CG   sing N N 274 
PRO CB  HB2  sing N N 275 
PRO CB  HB3  sing N N 276 
PRO CG  CD   sing N N 277 
PRO CG  HG2  sing N N 278 
PRO CG  HG3  sing N N 279 
PRO CD  HD2  sing N N 280 
PRO CD  HD3  sing N N 281 
PRO OXT HXT  sing N N 282 
SER N   CA   sing N N 283 
SER N   H    sing N N 284 
SER N   H2   sing N N 285 
SER CA  C    sing N N 286 
SER CA  CB   sing N N 287 
SER CA  HA   sing N N 288 
SER C   O    doub N N 289 
SER C   OXT  sing N N 290 
SER CB  OG   sing N N 291 
SER CB  HB2  sing N N 292 
SER CB  HB3  sing N N 293 
SER OG  HG   sing N N 294 
SER OXT HXT  sing N N 295 
SO4 S   O1   doub N N 296 
SO4 S   O2   doub N N 297 
SO4 S   O3   sing N N 298 
SO4 S   O4   sing N N 299 
THR N   CA   sing N N 300 
THR N   H    sing N N 301 
THR N   H2   sing N N 302 
THR CA  C    sing N N 303 
THR CA  CB   sing N N 304 
THR CA  HA   sing N N 305 
THR C   O    doub N N 306 
THR C   OXT  sing N N 307 
THR CB  OG1  sing N N 308 
THR CB  CG2  sing N N 309 
THR CB  HB   sing N N 310 
THR OG1 HG1  sing N N 311 
THR CG2 HG21 sing N N 312 
THR CG2 HG22 sing N N 313 
THR CG2 HG23 sing N N 314 
THR OXT HXT  sing N N 315 
TRP N   CA   sing N N 316 
TRP N   H    sing N N 317 
TRP N   H2   sing N N 318 
TRP CA  C    sing N N 319 
TRP CA  CB   sing N N 320 
TRP CA  HA   sing N N 321 
TRP C   O    doub N N 322 
TRP C   OXT  sing N N 323 
TRP CB  CG   sing N N 324 
TRP CB  HB2  sing N N 325 
TRP CB  HB3  sing N N 326 
TRP CG  CD1  doub Y N 327 
TRP CG  CD2  sing Y N 328 
TRP CD1 NE1  sing Y N 329 
TRP CD1 HD1  sing N N 330 
TRP CD2 CE2  doub Y N 331 
TRP CD2 CE3  sing Y N 332 
TRP NE1 CE2  sing Y N 333 
TRP NE1 HE1  sing N N 334 
TRP CE2 CZ2  sing Y N 335 
TRP CE3 CZ3  doub Y N 336 
TRP CE3 HE3  sing N N 337 
TRP CZ2 CH2  doub Y N 338 
TRP CZ2 HZ2  sing N N 339 
TRP CZ3 CH2  sing Y N 340 
TRP CZ3 HZ3  sing N N 341 
TRP CH2 HH2  sing N N 342 
TRP OXT HXT  sing N N 343 
VAL N   CA   sing N N 344 
VAL N   H    sing N N 345 
VAL N   H2   sing N N 346 
VAL CA  C    sing N N 347 
VAL CA  CB   sing N N 348 
VAL CA  HA   sing N N 349 
VAL C   O    doub N N 350 
VAL C   OXT  sing N N 351 
VAL CB  CG1  sing N N 352 
VAL CB  CG2  sing N N 353 
VAL CB  HB   sing N N 354 
VAL CG1 HG11 sing N N 355 
VAL CG1 HG12 sing N N 356 
VAL CG1 HG13 sing N N 357 
VAL CG2 HG21 sing N N 358 
VAL CG2 HG22 sing N N 359 
VAL CG2 HG23 sing N N 360 
VAL OXT HXT  sing N N 361 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'National Institutes of Health/National Cancer Institute (NIH/NCI)' 'United States' R01NS065263 1 
'National Science Foundation (NSF, United States)'                  'United States' MCB-1517290 2 
'National Science Foundation (NSF, United States)'                  'United States' CHE-1905214 3 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 CU ? ? CU ? ? 'SUBJECT OF INVESTIGATION' ? 
2 ZN ? ? ZN ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'ACETATE ION'     ACT 
3 'ZINC ION'        ZN  
4 'COPPER (II) ION' CU  
5 'SULFATE ION'     SO4 
6 water             HOH 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   2C9V 
_pdbx_initial_refinement_model.details          ? 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   SAXS 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
