data_4XCR
# 
_entry.id   4XCR 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.299 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB   4XCR         
WWPDB D_1000205445 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        4XCR 
_pdbx_database_status.recvd_initial_deposition_date   2014-12-18 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Wang, H.'        1  
'Logan, D.T.'     2  
'Danielsson, J.'  3  
'Mu, X.'          4  
'Binolfi, A.'     5  
'Theillet, F.'    6  
'Bekei, B.'       7  
'Lang, L.'        8  
'Wennerstrom, H.' 9  
'Selenko, P.'     10 
'Oliveberg, M.'   11 
# 
_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                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Proc. Natl. Acad. Sci. U.S.A.' 
_citation.journal_id_ASTM           PNASA6 
_citation.journal_id_CSD            0040 
_citation.journal_id_ISSN           1091-6490 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            112 
_citation.language                  ? 
_citation.page_first                12402 
_citation.page_last                 12407 
_citation.title                     'Thermodynamics of protein destabilization in live cells.' 
_citation.year                      2015 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1073/pnas.1511308112 
_citation.pdbx_database_id_PubMed   26392565 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Danielsson, J.'  1  ? 
primary 'Mu, X.'          2  ? 
primary 'Lang, L.'        3  ? 
primary 'Wang, H.'        4  ? 
primary 'Binolfi, A.'     5  ? 
primary 'Theillet, F.X.'  6  ? 
primary 'Bekei, B.'       7  ? 
primary 'Logan, D.T.'     8  ? 
primary 'Selenko, P.'     9  ? 
primary 'Wennerstrom, H.' 10 ? 
primary 'Oliveberg, M.'   11 ? 
# 
_cell.length_a           70.820 
_cell.length_b           70.820 
_cell.length_c           70.010 
_cell.angle_alpha        90.000 
_cell.angle_beta         90.000 
_cell.angle_gamma        120.000 
_cell.entry_id           4XCR 
_cell.Z_PDB              12 
_cell.pdbx_unique_axis   ? 
# 
_symmetry.space_group_name_H-M             'P 65' 
_symmetry.entry_id                         4XCR 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                170 
# 
_entity.id                         1 
_entity.type                       polymer 
_entity.src_method                 man 
_entity.pdbx_description           'Superoxide dismutase [Cu-Zn]' 
_entity.formula_weight             10948.210 
_entity.pdbx_number_of_molecules   2 
_entity.pdbx_ec                    1.15.1.1 
_entity.pdbx_mutation              I45A 
_entity.pdbx_fragment              ? 
_entity.details                    ? 
# 
_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       
;ATKAVAVLKGDGPVQGIINFEQKESNGPVKVWGSAKGLTEGLHGFHVHGAGGDLGNVTADKDGVADVSIEDSVISLSGDH
SIIGRTLVVHEKAGAGAGSRLASGVIGIAQ
;
_entity_poly.pdbx_seq_one_letter_code_can   
;ATKAVAVLKGDGPVQGIINFEQKESNGPVKVWGSAKGLTEGLHGFHVHGAGGDLGNVTADKDGVADVSIEDSVISLSGDH
SIIGRTLVVHEKAGAGAGSRLASGVIGIAQ
;
_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   ALA n 
1 2   THR n 
1 3   LYS n 
1 4   ALA n 
1 5   VAL n 
1 6   ALA n 
1 7   VAL n 
1 8   LEU n 
1 9   LYS n 
1 10  GLY n 
1 11  ASP n 
1 12  GLY n 
1 13  PRO n 
1 14  VAL n 
1 15  GLN n 
1 16  GLY n 
1 17  ILE n 
1 18  ILE n 
1 19  ASN n 
1 20  PHE n 
1 21  GLU n 
1 22  GLN n 
1 23  LYS n 
1 24  GLU n 
1 25  SER n 
1 26  ASN n 
1 27  GLY n 
1 28  PRO n 
1 29  VAL n 
1 30  LYS n 
1 31  VAL n 
1 32  TRP n 
1 33  GLY n 
1 34  SER n 
1 35  ALA n 
1 36  LYS n 
1 37  GLY n 
1 38  LEU n 
1 39  THR n 
1 40  GLU n 
1 41  GLY n 
1 42  LEU n 
1 43  HIS n 
1 44  GLY n 
1 45  PHE n 
1 46  HIS n 
1 47  VAL n 
1 48  HIS n 
1 49  GLY n 
1 50  ALA n 
1 51  GLY n 
1 52  GLY n 
1 53  ASP n 
1 54  LEU n 
1 55  GLY n 
1 56  ASN n 
1 57  VAL n 
1 58  THR n 
1 59  ALA n 
1 60  ASP n 
1 61  LYS n 
1 62  ASP n 
1 63  GLY n 
1 64  VAL n 
1 65  ALA n 
1 66  ASP n 
1 67  VAL n 
1 68  SER n 
1 69  ILE n 
1 70  GLU n 
1 71  ASP n 
1 72  SER n 
1 73  VAL n 
1 74  ILE n 
1 75  SER n 
1 76  LEU n 
1 77  SER n 
1 78  GLY n 
1 79  ASP n 
1 80  HIS n 
1 81  SER n 
1 82  ILE n 
1 83  ILE n 
1 84  GLY n 
1 85  ARG n 
1 86  THR n 
1 87  LEU n 
1 88  VAL n 
1 89  VAL n 
1 90  HIS n 
1 91  GLU n 
1 92  LYS n 
1 93  ALA n 
1 94  GLY n 
1 95  ALA n 
1 96  GLY n 
1 97  ALA n 
1 98  GLY n 
1 99  SER n 
1 100 ARG n 
1 101 LEU n 
1 102 ALA n 
1 103 SER n 
1 104 GLY n 
1 105 VAL n 
1 106 ILE n 
1 107 GLY n 
1 108 ILE n 
1 109 ALA n 
1 110 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                   110 
_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' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_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   
;ATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEERH
VGDLGNVTADKDGVADVSIEDSVISLSGDHCIIGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
;
_struct_ref.pdbx_align_begin           2 
# 
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 4XCR A 1 ? 110 ? P00441 2 ? 154 ? 1 110 
2 1 4XCR B 1 ? 110 ? P00441 2 ? 154 ? 1 110 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 4XCR ALA A 6   ? UNP P00441 CYS 7   conflict              6   1   
1 4XCR ALA A 35  ? UNP P00441 ILE 36  'engineered mutation' 35  2   
1 4XCR GLY A 49  ? UNP P00441 GLU 50  conflict              49  3   
1 4XCR ALA A 50  ? UNP P00441 PHE 51  conflict              50  4   
1 4XCR ?   A ?   ? UNP P00441 ASP 53  deletion              ?   5   
1 4XCR ?   A ?   ? UNP P00441 ASN 54  deletion              ?   6   
1 4XCR ?   A ?   ? UNP P00441 THR 55  deletion              ?   7   
1 4XCR ?   A ?   ? UNP P00441 ALA 56  deletion              ?   8   
1 4XCR ?   A ?   ? UNP P00441 GLY 57  deletion              ?   9   
1 4XCR ?   A ?   ? UNP P00441 CYS 58  deletion              ?   10  
1 4XCR ?   A ?   ? UNP P00441 THR 59  deletion              ?   11  
1 4XCR ?   A ?   ? UNP P00441 SER 60  deletion              ?   12  
1 4XCR ?   A ?   ? UNP P00441 ALA 61  deletion              ?   13  
1 4XCR ?   A ?   ? UNP P00441 GLY 62  deletion              ?   14  
1 4XCR ?   A ?   ? UNP P00441 PRO 63  deletion              ?   15  
1 4XCR ?   A ?   ? UNP P00441 HIS 64  deletion              ?   16  
1 4XCR ?   A ?   ? UNP P00441 PHE 65  deletion              ?   17  
1 4XCR ?   A ?   ? UNP P00441 ASN 66  deletion              ?   18  
1 4XCR ?   A ?   ? UNP P00441 PRO 67  deletion              ?   19  
1 4XCR ?   A ?   ? UNP P00441 LEU 68  deletion              ?   20  
1 4XCR ?   A ?   ? UNP P00441 SER 69  deletion              ?   21  
1 4XCR ?   A ?   ? UNP P00441 ARG 70  deletion              ?   22  
1 4XCR ?   A ?   ? UNP P00441 LYS 71  deletion              ?   23  
1 4XCR ?   A ?   ? UNP P00441 HIS 72  deletion              ?   24  
1 4XCR ?   A ?   ? UNP P00441 GLY 73  deletion              ?   25  
1 4XCR ?   A ?   ? UNP P00441 GLY 74  deletion              ?   26  
1 4XCR ?   A ?   ? UNP P00441 PRO 75  deletion              ?   27  
1 4XCR ?   A ?   ? UNP P00441 LYS 76  deletion              ?   28  
1 4XCR ?   A ?   ? UNP P00441 ASP 77  deletion              ?   29  
1 4XCR ?   A ?   ? UNP P00441 GLU 78  deletion              ?   30  
1 4XCR ?   A ?   ? UNP P00441 GLU 79  deletion              ?   31  
1 4XCR ?   A ?   ? UNP P00441 ARG 80  deletion              ?   32  
1 4XCR ?   A ?   ? UNP P00441 HIS 81  deletion              ?   33  
1 4XCR ?   A ?   ? UNP P00441 VAL 82  deletion              ?   34  
1 4XCR SER A 81  ? UNP P00441 CYS 112 conflict              81  35  
1 4XCR ?   A ?   ? UNP P00441 ASP 125 deletion              ?   36  
1 4XCR ?   A ?   ? UNP P00441 ASP 126 deletion              ?   37  
1 4XCR ?   A ?   ? UNP P00441 LEU 127 deletion              ?   38  
1 4XCR ?   A ?   ? UNP P00441 GLY 128 deletion              ?   39  
1 4XCR ?   A ?   ? UNP P00441 LYS 129 deletion              ?   40  
1 4XCR ?   A ?   ? UNP P00441 GLY 130 deletion              ?   41  
1 4XCR ?   A ?   ? UNP P00441 GLY 131 deletion              ?   42  
1 4XCR ?   A ?   ? UNP P00441 ASN 132 deletion              ?   43  
1 4XCR ?   A ?   ? UNP P00441 GLU 133 deletion              ?   44  
1 4XCR ?   A ?   ? UNP P00441 GLU 134 deletion              ?   45  
1 4XCR ?   A ?   ? UNP P00441 SER 135 deletion              ?   46  
1 4XCR ?   A ?   ? UNP P00441 THR 136 deletion              ?   47  
1 4XCR ?   A ?   ? UNP P00441 LYS 137 deletion              ?   48  
1 4XCR GLY A 94  ? UNP P00441 THR 138 conflict              94  49  
1 4XCR ALA A 95  ? UNP P00441 GLY 139 conflict              95  50  
1 4XCR GLY A 96  ? UNP P00441 ASN 140 conflict              96  51  
1 4XCR SER A 103 ? UNP P00441 CYS 147 conflict              103 52  
2 4XCR ALA B 6   ? UNP P00441 CYS 7   conflict              6   53  
2 4XCR ALA B 35  ? UNP P00441 ILE 36  'engineered mutation' 35  54  
2 4XCR GLY B 49  ? UNP P00441 GLU 50  conflict              49  55  
2 4XCR ALA B 50  ? UNP P00441 PHE 51  conflict              50  56  
2 4XCR ?   B ?   ? UNP P00441 ASP 53  deletion              ?   57  
2 4XCR ?   B ?   ? UNP P00441 ASN 54  deletion              ?   58  
2 4XCR ?   B ?   ? UNP P00441 THR 55  deletion              ?   59  
2 4XCR ?   B ?   ? UNP P00441 ALA 56  deletion              ?   60  
2 4XCR ?   B ?   ? UNP P00441 GLY 57  deletion              ?   61  
2 4XCR ?   B ?   ? UNP P00441 CYS 58  deletion              ?   62  
2 4XCR ?   B ?   ? UNP P00441 THR 59  deletion              ?   63  
2 4XCR ?   B ?   ? UNP P00441 SER 60  deletion              ?   64  
2 4XCR ?   B ?   ? UNP P00441 ALA 61  deletion              ?   65  
2 4XCR ?   B ?   ? UNP P00441 GLY 62  deletion              ?   66  
2 4XCR ?   B ?   ? UNP P00441 PRO 63  deletion              ?   67  
2 4XCR ?   B ?   ? UNP P00441 HIS 64  deletion              ?   68  
2 4XCR ?   B ?   ? UNP P00441 PHE 65  deletion              ?   69  
2 4XCR ?   B ?   ? UNP P00441 ASN 66  deletion              ?   70  
2 4XCR ?   B ?   ? UNP P00441 PRO 67  deletion              ?   71  
2 4XCR ?   B ?   ? UNP P00441 LEU 68  deletion              ?   72  
2 4XCR ?   B ?   ? UNP P00441 SER 69  deletion              ?   73  
2 4XCR ?   B ?   ? UNP P00441 ARG 70  deletion              ?   74  
2 4XCR ?   B ?   ? UNP P00441 LYS 71  deletion              ?   75  
2 4XCR ?   B ?   ? UNP P00441 HIS 72  deletion              ?   76  
2 4XCR ?   B ?   ? UNP P00441 GLY 73  deletion              ?   77  
2 4XCR ?   B ?   ? UNP P00441 GLY 74  deletion              ?   78  
2 4XCR ?   B ?   ? UNP P00441 PRO 75  deletion              ?   79  
2 4XCR ?   B ?   ? UNP P00441 LYS 76  deletion              ?   80  
2 4XCR ?   B ?   ? UNP P00441 ASP 77  deletion              ?   81  
2 4XCR ?   B ?   ? UNP P00441 GLU 78  deletion              ?   82  
2 4XCR ?   B ?   ? UNP P00441 GLU 79  deletion              ?   83  
2 4XCR ?   B ?   ? UNP P00441 ARG 80  deletion              ?   84  
2 4XCR ?   B ?   ? UNP P00441 HIS 81  deletion              ?   85  
2 4XCR ?   B ?   ? UNP P00441 VAL 82  deletion              ?   86  
2 4XCR SER B 81  ? UNP P00441 CYS 112 conflict              81  87  
2 4XCR ?   B ?   ? UNP P00441 ASP 125 deletion              ?   88  
2 4XCR ?   B ?   ? UNP P00441 ASP 126 deletion              ?   89  
2 4XCR ?   B ?   ? UNP P00441 LEU 127 deletion              ?   90  
2 4XCR ?   B ?   ? UNP P00441 GLY 128 deletion              ?   91  
2 4XCR ?   B ?   ? UNP P00441 LYS 129 deletion              ?   92  
2 4XCR ?   B ?   ? UNP P00441 GLY 130 deletion              ?   93  
2 4XCR ?   B ?   ? UNP P00441 GLY 131 deletion              ?   94  
2 4XCR ?   B ?   ? UNP P00441 ASN 132 deletion              ?   95  
2 4XCR ?   B ?   ? UNP P00441 GLU 133 deletion              ?   96  
2 4XCR ?   B ?   ? UNP P00441 GLU 134 deletion              ?   97  
2 4XCR ?   B ?   ? UNP P00441 SER 135 deletion              ?   98  
2 4XCR ?   B ?   ? UNP P00441 THR 136 deletion              ?   99  
2 4XCR ?   B ?   ? UNP P00441 LYS 137 deletion              ?   100 
2 4XCR GLY B 94  ? UNP P00441 THR 138 conflict              94  101 
2 4XCR ALA B 95  ? UNP P00441 GLY 139 conflict              95  102 
2 4XCR GLY B 96  ? UNP P00441 ASN 140 conflict              96  103 
2 4XCR SER B 103 ? UNP P00441 CYS 147 conflict              103 104 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
ILE 'L-peptide linking' y ISOLEUCINE      ? 'C6 H13 N O2'    131.173 
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 
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ? 'C11 H12 N2 O2'  204.225 
VAL 'L-peptide linking' y VALINE          ? 'C5 H11 N O2'    117.146 
# 
_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                   4XCR 
_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            2.31 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         46.86 
_exptl_crystal.description                 ? 
_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_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          EVAPORATION 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              5.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp            293 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.1 M Bis Tris  and 2.0 M ammonium sulfate' 
_exptl_crystal_grow.pdbx_pH_range   5.5 
# 
_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_detector.details                      ? 
_diffrn_detector.detector                     CCD 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         MARRESEARCH 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2014-11-21 
# 
_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   1.0 
_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                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'MAX II BEAMLINE I911-3' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.0 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I911-3 
_diffrn_source.pdbx_synchrotron_site       'MAX II' 
# 
_reflns.B_iso_Wilson_estimate            ? 
_reflns.entry_id                         4XCR 
_reflns.data_reduction_details           ? 
_reflns.data_reduction_method            ? 
_reflns.d_resolution_high                3.60 
_reflns.d_resolution_low                 46.13 
_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                       2203 
_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             92.8 
_reflns.R_free_details                   ? 
_reflns.Rmerge_F_all                     ? 
_reflns.Rmerge_F_obs                     ? 
_reflns.Friedel_coverage                 ? 
_reflns.number_gt                        ? 
_reflns.threshold_expression             ? 
_reflns.pdbx_redundancy                  5.1 
_reflns.pdbx_Rmerge_I_obs                0.326 
_reflns.pdbx_Rmerge_I_all                ? 
_reflns.pdbx_Rsym_value                  ? 
_reflns.pdbx_netI_over_av_sigmaI         ? 
_reflns.pdbx_netI_over_sigmaI            2.3 
_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                  ? 
_reflns.pdbx_Rpim_I_all                  ? 
_reflns.pdbx_d_opt                       ? 
_reflns.pdbx_number_measured_all         ? 
_reflns.pdbx_diffrn_id                   1 
_reflns.pdbx_ordinal                     1 
_reflns.pdbx_CC_half                     ? 
_reflns.pdbx_R_split                     ? 
# 
_reflns_shell.d_res_high                  3.60 
_reflns_shell.d_res_low                   3.94 
_reflns_shell.meanI_over_sigI_all         ? 
_reflns_shell.meanI_over_sigI_obs         1.8 
_reflns_shell.number_measured_all         ? 
_reflns_shell.number_measured_obs         2754 
_reflns_shell.number_possible             ? 
_reflns_shell.number_unique_all           533 
_reflns_shell.number_unique_obs           ? 
_reflns_shell.percent_possible_all        93.8 
_reflns_shell.percent_possible_obs        ? 
_reflns_shell.Rmerge_F_all                ? 
_reflns_shell.Rmerge_F_obs                ? 
_reflns_shell.Rmerge_I_all                ? 
_reflns_shell.Rmerge_I_obs                0.663 
_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             5.2 
_reflns_shell.pdbx_Rsym_value             ? 
_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                1 
_reflns_shell.pdbx_diffrn_id              1 
_reflns_shell.pdbx_CC_half                ? 
_reflns_shell.pdbx_R_split                ? 
# 
_refine.entry_id                                 4XCR 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_d_res_high                            3.6020 
_refine.ls_d_res_low                             46.1330 
_refine.pdbx_ls_sigma_F                          0.000 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.ls_percent_reflns_obs                    93.0500 
_refine.ls_number_reflns_obs                     2197 
_refine.ls_number_reflns_all                     ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.ls_matrix_type                           ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.details                                  ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1906 
_refine.ls_R_factor_R_work                       0.1853 
_refine.ls_wR_factor_R_work                      ? 
_refine.ls_R_factor_R_free                       0.2392 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_percent_reflns_R_free                 9.9700 
_refine.ls_number_reflns_R_free                  219 
_refine.ls_number_reflns_R_work                  1978 
_refine.ls_R_factor_R_free_error                 ? 
_refine.B_iso_mean                               58.2323 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.overall_SU_R_free                        ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.overall_SU_ML                            0.2900 
_refine.overall_SU_B                             ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.pdbx_solvent_vdw_probe_radii             1.1100 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_refine.ls_number_parameters                     ? 
_refine.ls_number_restraints                     ? 
_refine.pdbx_starting_model                      4BCZ 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.B_iso_max                                96.620 
_refine.B_iso_min                                42.380 
_refine.pdbx_overall_phase_error                 20.8200 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.pdbx_diffrn_id                           1 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.ls_R_factor_R_free_error_details         ? 
# 
_refine_hist.cycle_id                         final 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.d_res_high                       3.6020 
_refine_hist.d_res_low                        46.1330 
_refine_hist.pdbx_number_atoms_ligand         0 
_refine_hist.number_atoms_solvent             0 
_refine_hist.number_atoms_total               1542 
_refine_hist.pdbx_number_residues_total       220 
_refine_hist.pdbx_number_atoms_protein        1542 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.type 
_refine_ls_restr.number 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' f_bond_d           1562 0.004  ? ? ? 
'X-RAY DIFFRACTION' f_angle_d          2110 0.780  ? ? ? 
'X-RAY DIFFRACTION' f_chiral_restr     244  0.033  ? ? ? 
'X-RAY DIFFRACTION' f_plane_restr      280  0.002  ? ? ? 
'X-RAY DIFFRACTION' f_dihedral_angle_d 540  14.062 ? ? ? 
# 
loop_
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.R_factor_R_free 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.pdbx_refine_id 
3.6021 4.5376  2 94.0000 995 . 0.1889 0.2355 . 110 . 1105 . 'X-RAY DIFFRACTION' 
4.5376 46.1368 2 92.0000 983 . 0.1823 0.2424 . 109 . 1092 . 'X-RAY DIFFRACTION' 
# 
_struct.entry_id                     4XCR 
_struct.title                        'Monomeric Human Cu,Zn Superoxide dismutase, loops IV and VII deleted, apo form, mutant I35A' 
_struct.pdbx_descriptor              'ROXIDE DISMUTASE [CU-ZN]' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               ? 
# 
_struct_keywords.entry_id        4XCR 
_struct_keywords.text            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 ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 8 ? 
AA2 ? 6 ? 
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 
AA1 5 6 ? anti-parallel 
AA1 6 7 ? anti-parallel 
AA1 7 8 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA2 5 6 ? 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 ASP A 53  ? ALA A 59  ? ASP A 53  ALA A 59  
AA1 2 GLY A 41  ? VAL A 47  ? GLY A 41  VAL A 47  
AA1 3 THR A 86  ? HIS A 90  ? THR A 86  HIS A 90  
AA1 4 LEU A 101 ? VAL A 105 ? LEU A 101 VAL A 105 
AA1 5 LYS A 3   ? GLY A 10  ? LYS A 3   GLY A 10  
AA1 6 GLN A 15  ? GLU A 21  ? GLN A 15  GLU A 21  
AA1 7 VAL A 29  ? LYS A 36  ? VAL A 29  LYS A 36  
AA1 8 VAL A 64  ? ASP A 71  ? VAL A 64  ASP A 71  
AA2 1 ASP A 53  ? ALA A 59  ? ASP A 53  ALA A 59  
AA2 2 GLY A 41  ? VAL A 47  ? GLY A 41  VAL A 47  
AA2 3 THR A 86  ? HIS A 90  ? THR A 86  HIS A 90  
AA2 4 LEU A 101 ? VAL A 105 ? LEU A 101 VAL A 105 
AA2 5 LYS A 3   ? GLY A 10  ? LYS A 3   GLY A 10  
AA2 6 GLY A 107 ? GLN A 110 ? GLY A 107 GLN A 110 
AA3 1 ASP B 66  ? ASP B 71  ? ASP B 66  ASP B 71  
AA3 2 VAL B 29  ? LYS B 36  ? VAL B 29  LYS B 36  
AA3 3 GLN B 15  ? GLN B 22  ? GLN B 15  GLN B 22  
AA3 4 LYS B 3   ? LYS B 9   ? LYS B 3   LYS B 9   
AA3 5 GLY B 107 ? ILE B 108 ? GLY B 107 ILE B 108 
AA4 1 ASP B 53  ? ALA B 59  ? ASP B 53  ALA B 59  
AA4 2 GLY B 41  ? VAL B 47  ? GLY B 41  VAL B 47  
AA4 3 THR B 86  ? HIS B 90  ? THR B 86  HIS B 90  
AA4 4 LEU B 101 ? VAL B 105 ? LEU B 101 VAL B 105 
# 
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 GLY A 55  ? O GLY A 55  N PHE A 45  ? N PHE A 45  
AA1 2 3 N HIS A 46  ? N HIS A 46  O VAL A 88  ? O VAL A 88  
AA1 3 4 N LEU A 87  ? N LEU A 87  O GLY A 104 ? O GLY A 104 
AA1 4 5 O SER A 103 ? O SER A 103 N LYS A 9   ? N LYS A 9   
AA1 5 6 N ALA A 6   ? N ALA A 6   O ILE A 18  ? O ILE A 18  
AA1 6 7 N GLU A 21  ? N GLU A 21  O LYS A 30  ? O LYS A 30  
AA1 7 8 N VAL A 31  ? N VAL A 31  O ILE A 69  ? O ILE A 69  
AA2 1 2 O GLY A 55  ? O GLY A 55  N PHE A 45  ? N PHE A 45  
AA2 2 3 N HIS A 46  ? N HIS A 46  O VAL A 88  ? O VAL A 88  
AA2 3 4 N LEU A 87  ? N LEU A 87  O GLY A 104 ? O GLY A 104 
AA2 4 5 O SER A 103 ? O SER A 103 N LYS A 9   ? N LYS A 9   
AA2 5 6 N LYS A 3   ? N LYS A 3   O GLN A 110 ? O GLN A 110 
AA3 1 2 O VAL B 67  ? O VAL B 67  N GLY B 33  ? N GLY B 33  
AA3 2 3 O TRP B 32  ? O TRP B 32  N ASN B 19  ? N ASN B 19  
AA3 3 4 O PHE B 20  ? O PHE B 20  N ALA B 4   ? N ALA B 4   
AA3 4 5 N VAL B 5   ? N VAL B 5   O GLY B 107 ? O GLY B 107 
AA4 1 2 O LEU B 54  ? O LEU B 54  N PHE B 45  ? N PHE B 45  
AA4 2 3 N HIS B 46  ? N HIS B 46  O VAL B 88  ? O VAL B 88  
AA4 3 4 N VAL B 89  ? N VAL B 89  O ALA B 102 ? O ALA B 102 
# 
_atom_sites.entry_id                    4XCR 
_atom_sites.fract_transf_matrix[1][1]   0.014120 
_atom_sites.fract_transf_matrix[1][2]   0.008152 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.016305 
_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]   0.014284 
_atom_sites.fract_transf_vector[1]      0.000000 
_atom_sites.fract_transf_vector[2]      0.000000 
_atom_sites.fract_transf_vector[3]      0.000000 
# 
loop_
_atom_type.symbol 
C 
H 
N 
O 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM 1    N N    . ALA A 1 1   ? -33.309 -18.301 3.421   1.00 55.88 ? 1   ALA A N    1 
ATOM 2    C CA   . ALA A 1 1   ? -32.277 -18.530 2.368   1.00 53.61 ? 1   ALA A CA   1 
ATOM 3    C C    . ALA A 1 1   ? -31.820 -19.983 2.372   1.00 54.01 ? 1   ALA A C    1 
ATOM 4    O O    . ALA A 1 1   ? -32.236 -20.765 3.227   1.00 55.93 ? 1   ALA A O    1 
ATOM 5    C CB   . ALA A 1 1   ? -31.091 -17.605 2.579   1.00 51.82 ? 1   ALA A CB   1 
ATOM 6    H H1   . ALA A 1 1   ? -34.097 -18.152 3.036   1.00 54.72 ? 1   ALA A H1   1 
ATOM 7    H H2   . ALA A 1 1   ? -33.364 -19.019 3.943   1.00 54.72 ? 1   ALA A H2   1 
ATOM 8    H H3   . ALA A 1 1   ? -33.080 -17.594 3.911   1.00 54.72 ? 1   ALA A H3   1 
ATOM 9    H HA   . ALA A 1 1   ? -32.661 -18.336 1.498   1.00 54.72 ? 1   ALA A HA   1 
ATOM 10   H HB1  . ALA A 1 1   ? -30.434 -17.770 1.885   1.00 54.72 ? 1   ALA A HB1  1 
ATOM 11   H HB2  . ALA A 1 1   ? -31.397 -16.685 2.533   1.00 54.72 ? 1   ALA A HB2  1 
ATOM 12   H HB3  . ALA A 1 1   ? -30.704 -17.782 3.451   1.00 54.72 ? 1   ALA A HB3  1 
ATOM 13   N N    . THR A 1 2   ? -30.971 -20.339 1.410   1.00 54.61 ? 2   THR A N    1 
ATOM 14   C CA   . THR A 1 2   ? -30.378 -21.672 1.366   1.00 55.03 ? 2   THR A CA   1 
ATOM 15   C C    . THR A 1 2   ? -28.851 -21.594 1.420   1.00 52.77 ? 2   THR A C    1 
ATOM 16   O O    . THR A 1 2   ? -28.189 -22.577 1.753   1.00 53.11 ? 2   THR A O    1 
ATOM 17   C CB   . THR A 1 2   ? -30.817 -22.451 0.104   1.00 57.52 ? 2   THR A CB   1 
ATOM 18   O OG1  . THR A 1 2   ? -30.122 -23.703 0.043   1.00 58.04 ? 2   THR A OG1  1 
ATOM 19   C CG2  . THR A 1 2   ? -30.539 -21.654 -1.159  1.00 55.99 ? 2   THR A CG2  1 
ATOM 20   H H    . THR A 1 2   ? -30.721 -19.823 0.769   1.00 54.72 ? 2   THR A H    1 
ATOM 21   H HA   . THR A 1 2   ? -30.676 -22.172 2.142   1.00 54.72 ? 2   THR A HA   1 
ATOM 22   H HB   . THR A 1 2   ? -31.771 -22.619 0.150   1.00 54.72 ? 2   THR A HB   1 
ATOM 23   H HG1  . THR A 1 2   ? -30.297 -24.162 0.724   1.00 54.72 ? 2   THR A HG1  1 
ATOM 24   H HG21 . THR A 1 2   ? -30.821 -22.159 -1.938  1.00 54.72 ? 2   THR A HG21 1 
ATOM 25   H HG22 . THR A 1 2   ? -31.024 -20.815 -1.134  1.00 54.72 ? 2   THR A HG22 1 
ATOM 26   H HG23 . THR A 1 2   ? -29.589 -21.468 -1.230  1.00 54.72 ? 2   THR A HG23 1 
ATOM 27   N N    . LYS A 1 3   ? -28.297 -20.426 1.101   1.00 51.34 ? 3   LYS A N    1 
ATOM 28   C CA   . LYS A 1 3   ? -26.865 -20.195 1.264   1.00 49.67 ? 3   LYS A CA   1 
ATOM 29   C C    . LYS A 1 3   ? -26.568 -18.752 1.655   1.00 48.50 ? 3   LYS A C    1 
ATOM 30   O O    . LYS A 1 3   ? -27.403 -17.862 1.488   1.00 48.76 ? 3   LYS A O    1 
ATOM 31   C CB   . LYS A 1 3   ? -26.104 -20.541 -0.013  1.00 49.67 ? 3   LYS A CB   1 
ATOM 32   C CG   . LYS A 1 3   ? -26.416 -21.917 -0.575  1.00 51.15 ? 3   LYS A CG   1 
ATOM 33   C CD   . LYS A 1 3   ? -25.473 -22.269 -1.707  1.00 50.82 ? 3   LYS A CD   1 
ATOM 34   C CE   . LYS A 1 3   ? -25.665 -23.707 -2.176  1.00 52.63 ? 3   LYS A CE   1 
ATOM 35   N NZ   . LYS A 1 3   ? -25.246 -24.696 -1.143  1.00 53.49 ? 3   LYS A NZ   1 
ATOM 36   H H    . LYS A 1 3   ? -28.730 -19.752 0.788   1.00 54.72 ? 3   LYS A H    1 
ATOM 37   H HA   . LYS A 1 3   ? -26.533 -20.769 1.973   1.00 54.72 ? 3   LYS A HA   1 
ATOM 38   H HB2  . LYS A 1 3   ? -26.327 -19.887 -0.694  1.00 54.72 ? 3   LYS A HB2  1 
ATOM 39   H HB3  . LYS A 1 3   ? -25.153 -20.507 0.173   1.00 54.72 ? 3   LYS A HB3  1 
ATOM 40   H HG2  . LYS A 1 3   ? -26.314 -22.581 0.125   1.00 54.72 ? 3   LYS A HG2  1 
ATOM 41   H HG3  . LYS A 1 3   ? -27.322 -21.926 -0.919  1.00 54.72 ? 3   LYS A HG3  1 
ATOM 42   H HD2  . LYS A 1 3   ? -25.642 -21.680 -2.458  1.00 54.72 ? 3   LYS A HD2  1 
ATOM 43   H HD3  . LYS A 1 3   ? -24.558 -22.170 -1.402  1.00 54.72 ? 3   LYS A HD3  1 
ATOM 44   H HE2  . LYS A 1 3   ? -26.604 -23.854 -2.372  1.00 54.72 ? 3   LYS A HE2  1 
ATOM 45   H HE3  . LYS A 1 3   ? -25.131 -23.855 -2.972  1.00 54.72 ? 3   LYS A HE3  1 
ATOM 46   H HZ1  . LYS A 1 3   ? -25.370 -25.524 -1.447  1.00 54.72 ? 3   LYS A HZ1  1 
ATOM 47   H HZ2  . LYS A 1 3   ? -24.384 -24.586 -0.949  1.00 54.72 ? 3   LYS A HZ2  1 
ATOM 48   H HZ3  . LYS A 1 3   ? -25.726 -24.585 -0.402  1.00 54.72 ? 3   LYS A HZ3  1 
ATOM 49   N N    . ALA A 1 4   ? -25.364 -18.537 2.174   1.00 46.50 ? 4   ALA A N    1 
ATOM 50   C CA   . ALA A 1 4   ? -24.942 -17.226 2.646   1.00 45.82 ? 4   ALA A CA   1 
ATOM 51   C C    . ALA A 1 4   ? -23.448 -17.241 2.961   1.00 45.24 ? 4   ALA A C    1 
ATOM 52   O O    . ALA A 1 4   ? -22.891 -18.297 3.258   1.00 45.48 ? 4   ALA A O    1 
ATOM 53   C CB   . ALA A 1 4   ? -25.739 -16.835 3.868   1.00 44.36 ? 4   ALA A CB   1 
ATOM 54   H H    . ALA A 1 4   ? -24.763 -19.146 2.265   1.00 54.72 ? 4   ALA A H    1 
ATOM 55   H HA   . ALA A 1 4   ? -25.102 -16.568 1.952   1.00 54.72 ? 4   ALA A HA   1 
ATOM 56   H HB1  . ALA A 1 4   ? -25.446 -15.961 4.169   1.00 54.72 ? 4   ALA A HB1  1 
ATOM 57   H HB2  . ALA A 1 4   ? -26.681 -16.806 3.634   1.00 54.72 ? 4   ALA A HB2  1 
ATOM 58   H HB3  . ALA A 1 4   ? -25.591 -17.492 4.565   1.00 54.72 ? 4   ALA A HB3  1 
ATOM 59   N N    . VAL A 1 5   ? -22.807 -16.074 2.905   1.00 45.17 ? 5   VAL A N    1 
ATOM 60   C CA   . VAL A 1 5   ? -21.374 -15.977 3.179   1.00 45.11 ? 5   VAL A CA   1 
ATOM 61   C C    . VAL A 1 5   ? -21.068 -14.841 4.150   1.00 45.45 ? 5   VAL A C    1 
ATOM 62   O O    . VAL A 1 5   ? -21.667 -13.766 4.082   1.00 45.63 ? 5   VAL A O    1 
ATOM 63   C CB   . VAL A 1 5   ? -20.560 -15.768 1.880   1.00 45.74 ? 5   VAL A CB   1 
ATOM 64   C CG1  . VAL A 1 5   ? -19.056 -15.772 2.170   1.00 46.25 ? 5   VAL A CG1  1 
ATOM 65   C CG2  . VAL A 1 5   ? -20.906 -16.845 0.859   1.00 45.68 ? 5   VAL A CG2  1 
ATOM 66   H H    . VAL A 1 5   ? -23.180 -15.324 2.710   1.00 54.72 ? 5   VAL A H    1 
ATOM 67   H HA   . VAL A 1 5   ? -21.076 -16.805 3.587   1.00 54.72 ? 5   VAL A HA   1 
ATOM 68   H HB   . VAL A 1 5   ? -20.790 -14.906 1.498   1.00 54.72 ? 5   VAL A HB   1 
ATOM 69   H HG11 . VAL A 1 5   ? -18.574 -15.639 1.339   1.00 54.72 ? 5   VAL A HG11 1 
ATOM 70   H HG12 . VAL A 1 5   ? -18.852 -15.054 2.789   1.00 54.72 ? 5   VAL A HG12 1 
ATOM 71   H HG13 . VAL A 1 5   ? -18.812 -16.625 2.561   1.00 54.72 ? 5   VAL A HG13 1 
ATOM 72   H HG21 . VAL A 1 5   ? -20.386 -16.696 0.054   1.00 54.72 ? 5   VAL A HG21 1 
ATOM 73   H HG22 . VAL A 1 5   ? -20.694 -17.715 1.234   1.00 54.72 ? 5   VAL A HG22 1 
ATOM 74   H HG23 . VAL A 1 5   ? -21.853 -16.795 0.656   1.00 54.72 ? 5   VAL A HG23 1 
ATOM 75   N N    . ALA A 1 6   ? -20.137 -15.107 5.061   1.00 44.10 ? 6   ALA A N    1 
ATOM 76   C CA   . ALA A 1 6   ? -19.652 -14.107 6.002   1.00 44.81 ? 6   ALA A CA   1 
ATOM 77   C C    . ALA A 1 6   ? -18.163 -13.862 5.789   1.00 45.46 ? 6   ALA A C    1 
ATOM 78   O O    . ALA A 1 6   ? -17.328 -14.673 6.190   1.00 45.83 ? 6   ALA A O    1 
ATOM 79   C CB   . ALA A 1 6   ? -19.919 -14.549 7.424   1.00 46.12 ? 6   ALA A CB   1 
ATOM 80   H H    . ALA A 1 6   ? -19.763 -15.876 5.154   1.00 54.72 ? 6   ALA A H    1 
ATOM 81   H HA   . ALA A 1 6   ? -20.121 -13.272 5.850   1.00 54.72 ? 6   ALA A HA   1 
ATOM 82   H HB1  . ALA A 1 6   ? -19.589 -13.870 8.032   1.00 54.72 ? 6   ALA A HB1  1 
ATOM 83   H HB2  . ALA A 1 6   ? -20.875 -14.665 7.544   1.00 54.72 ? 6   ALA A HB2  1 
ATOM 84   H HB3  . ALA A 1 6   ? -19.461 -15.389 7.584   1.00 54.72 ? 6   ALA A HB3  1 
ATOM 85   N N    . VAL A 1 7   ? -17.842 -12.739 5.155   1.00 44.75 ? 7   VAL A N    1 
ATOM 86   C CA   . VAL A 1 7   ? -16.461 -12.382 4.864   1.00 45.98 ? 7   VAL A CA   1 
ATOM 87   C C    . VAL A 1 7   ? -15.823 -11.727 6.080   1.00 47.37 ? 7   VAL A C    1 
ATOM 88   O O    . VAL A 1 7   ? -16.109 -10.573 6.393   1.00 48.16 ? 7   VAL A O    1 
ATOM 89   C CB   . VAL A 1 7   ? -16.366 -11.428 3.661   1.00 44.58 ? 7   VAL A CB   1 
ATOM 90   C CG1  . VAL A 1 7   ? -14.939 -10.961 3.453   1.00 46.57 ? 7   VAL A CG1  1 
ATOM 91   C CG2  . VAL A 1 7   ? -16.847 -12.116 2.410   1.00 43.56 ? 7   VAL A CG2  1 
ATOM 92   H H    . VAL A 1 7   ? -18.416 -12.160 4.880   1.00 54.72 ? 7   VAL A H    1 
ATOM 93   H HA   . VAL A 1 7   ? -15.961 -13.186 4.654   1.00 54.72 ? 7   VAL A HA   1 
ATOM 94   H HB   . VAL A 1 7   ? -16.925 -10.651 3.819   1.00 54.72 ? 7   VAL A HB   1 
ATOM 95   H HG11 . VAL A 1 7   ? -14.911 -10.362 2.690   1.00 54.72 ? 7   VAL A HG11 1 
ATOM 96   H HG12 . VAL A 1 7   ? -14.640 -10.496 4.250   1.00 54.72 ? 7   VAL A HG12 1 
ATOM 97   H HG13 . VAL A 1 7   ? -14.375 -11.733 3.289   1.00 54.72 ? 7   VAL A HG13 1 
ATOM 98   H HG21 . VAL A 1 7   ? -16.779 -11.499 1.665   1.00 54.72 ? 7   VAL A HG21 1 
ATOM 99   H HG22 . VAL A 1 7   ? -16.293 -12.895 2.246   1.00 54.72 ? 7   VAL A HG22 1 
ATOM 100  H HG23 . VAL A 1 7   ? -17.770 -12.386 2.534   1.00 54.72 ? 7   VAL A HG23 1 
ATOM 101  N N    . LEU A 1 8   ? -14.961 -12.468 6.767   1.00 47.15 ? 8   LEU A N    1 
ATOM 102  C CA   . LEU A 1 8   ? -14.271 -11.935 7.934   1.00 48.79 ? 8   LEU A CA   1 
ATOM 103  C C    . LEU A 1 8   ? -13.139 -10.984 7.550   1.00 50.95 ? 8   LEU A C    1 
ATOM 104  O O    . LEU A 1 8   ? -12.227 -11.350 6.809   1.00 51.73 ? 8   LEU A O    1 
ATOM 105  C CB   . LEU A 1 8   ? -13.707 -13.069 8.793   1.00 49.79 ? 8   LEU A CB   1 
ATOM 106  C CG   . LEU A 1 8   ? -14.685 -13.884 9.646   1.00 48.71 ? 8   LEU A CG   1 
ATOM 107  C CD1  . LEU A 1 8   ? -13.934 -14.950 10.437  1.00 49.56 ? 8   LEU A CD1  1 
ATOM 108  C CD2  . LEU A 1 8   ? -15.489 -12.999 10.591  1.00 49.03 ? 8   LEU A CD2  1 
ATOM 109  H H    . LEU A 1 8   ? -14.758 -13.282 6.577   1.00 54.72 ? 8   LEU A H    1 
ATOM 110  H HA   . LEU A 1 8   ? -14.906 -11.439 8.474   1.00 54.72 ? 8   LEU A HA   1 
ATOM 111  H HB2  . LEU A 1 8   ? -13.259 -13.695 8.202   1.00 54.72 ? 8   LEU A HB2  1 
ATOM 112  H HB3  . LEU A 1 8   ? -13.055 -12.686 9.400   1.00 54.72 ? 8   LEU A HB3  1 
ATOM 113  H HG   . LEU A 1 8   ? -15.311 -14.336 9.058   1.00 54.72 ? 8   LEU A HG   1 
ATOM 114  H HD11 . LEU A 1 8   ? -14.570 -15.454 10.969  1.00 54.72 ? 8   LEU A HD11 1 
ATOM 115  H HD12 . LEU A 1 8   ? -13.480 -15.541 9.817   1.00 54.72 ? 8   LEU A HD12 1 
ATOM 116  H HD13 . LEU A 1 8   ? -13.288 -14.516 11.016  1.00 54.72 ? 8   LEU A HD13 1 
ATOM 117  H HD21 . LEU A 1 8   ? -16.092 -13.555 11.108  1.00 54.72 ? 8   LEU A HD21 1 
ATOM 118  H HD22 . LEU A 1 8   ? -14.878 -12.533 11.183  1.00 54.72 ? 8   LEU A HD22 1 
ATOM 119  H HD23 . LEU A 1 8   ? -15.996 -12.358 10.068  1.00 54.72 ? 8   LEU A HD23 1 
ATOM 120  N N    . LYS A 1 9   ? -13.220 -9.759  8.062   1.00 51.58 ? 9   LYS A N    1 
ATOM 121  C CA   . LYS A 1 9   ? -12.134 -8.790  7.972   1.00 54.40 ? 9   LYS A CA   1 
ATOM 122  C C    . LYS A 1 9   ? -11.903 -8.216  9.367   1.00 56.14 ? 9   LYS A C    1 
ATOM 123  O O    . LYS A 1 9   ? -12.851 -8.041  10.133  1.00 55.29 ? 9   LYS A O    1 
ATOM 124  C CB   . LYS A 1 9   ? -12.465 -7.680  6.965   1.00 52.50 ? 9   LYS A CB   1 
ATOM 125  C CG   . LYS A 1 9   ? -11.383 -6.617  6.797   1.00 56.02 ? 9   LYS A CG   1 
ATOM 126  C CD   . LYS A 1 9   ? -10.286 -7.069  5.853   1.00 57.27 ? 9   LYS A CD   1 
ATOM 127  C CE   . LYS A 1 9   ? -9.148  -6.061  5.819   1.00 61.46 ? 9   LYS A CE   1 
ATOM 128  N NZ   . LYS A 1 9   ? -8.460  -5.928  7.136   1.00 63.46 ? 9   LYS A NZ   1 
ATOM 129  H H    . LYS A 1 9   ? -13.912 -9.460  8.476   1.00 54.72 ? 9   LYS A H    1 
ATOM 130  H HA   . LYS A 1 9   ? -11.322 -9.237  7.684   1.00 54.72 ? 9   LYS A HA   1 
ATOM 131  H HB2  . LYS A 1 9   ? -12.613 -8.086  6.096   1.00 54.72 ? 9   LYS A HB2  1 
ATOM 132  H HB3  . LYS A 1 9   ? -13.273 -7.231  7.256   1.00 54.72 ? 9   LYS A HB3  1 
ATOM 133  H HG2  . LYS A 1 9   ? -11.782 -5.811  6.433   1.00 54.72 ? 9   LYS A HG2  1 
ATOM 134  H HG3  . LYS A 1 9   ? -10.982 -6.431  7.660   1.00 54.72 ? 9   LYS A HG3  1 
ATOM 135  H HD2  . LYS A 1 9   ? -9.932  -7.919  6.156   1.00 54.72 ? 9   LYS A HD2  1 
ATOM 136  H HD3  . LYS A 1 9   ? -10.647 -7.153  4.957   1.00 54.72 ? 9   LYS A HD3  1 
ATOM 137  H HE2  . LYS A 1 9   ? -8.491  -6.347  5.164   1.00 54.72 ? 9   LYS A HE2  1 
ATOM 138  H HE3  . LYS A 1 9   ? -9.502  -5.191  5.576   1.00 54.72 ? 9   LYS A HE3  1 
ATOM 139  H HZ1  . LYS A 1 9   ? -7.802  -5.332  7.077   1.00 54.72 ? 9   LYS A HZ1  1 
ATOM 140  H HZ2  . LYS A 1 9   ? -9.040  -5.659  7.756   1.00 54.72 ? 9   LYS A HZ2  1 
ATOM 141  H HZ3  . LYS A 1 9   ? -8.118  -6.713  7.381   1.00 54.72 ? 9   LYS A HZ3  1 
ATOM 142  N N    . GLY A 1 10  ? -10.648 -7.936  9.701   1.00 57.47 ? 10  GLY A N    1 
ATOM 143  C CA   . GLY A 1 10  ? -10.321 -7.433  11.022  1.00 59.55 ? 10  GLY A CA   1 
ATOM 144  C C    . GLY A 1 10  ? -8.980  -6.738  11.093  1.00 63.43 ? 10  GLY A C    1 
ATOM 145  O O    . GLY A 1 10  ? -8.509  -6.162  10.113  1.00 64.98 ? 10  GLY A O    1 
ATOM 146  H H    . GLY A 1 10  ? -9.971  -8.029  9.179   1.00 54.72 ? 10  GLY A H    1 
ATOM 147  H HA2  . GLY A 1 10  ? -11.004 -6.802  11.301  1.00 54.72 ? 10  GLY A HA2  1 
ATOM 148  H HA3  . GLY A 1 10  ? -10.314 -8.171  11.651  1.00 54.72 ? 10  GLY A HA3  1 
ATOM 149  N N    . ASP A 1 11  ? -8.364  -6.803  12.269  1.00 64.25 ? 11  ASP A N    1 
ATOM 150  C CA   . ASP A 1 11  ? -7.100  -6.122  12.513  1.00 68.54 ? 11  ASP A CA   1 
ATOM 151  C C    . ASP A 1 11  ? -5.954  -6.766  11.745  1.00 69.82 ? 11  ASP A C    1 
ATOM 152  O O    . ASP A 1 11  ? -5.543  -7.888  12.046  1.00 69.14 ? 11  ASP A O    1 
ATOM 153  C CB   . ASP A 1 11  ? -6.772  -6.117  14.008  1.00 71.71 ? 11  ASP A CB   1 
ATOM 154  C CG   . ASP A 1 11  ? -7.829  -5.412  14.837  1.00 71.20 ? 11  ASP A CG   1 
ATOM 155  O OD1  . ASP A 1 11  ? -9.024  -5.490  14.476  1.00 68.14 ? 11  ASP A OD1  1 
ATOM 156  O OD2  . ASP A 1 11  ? -7.463  -4.789  15.858  1.00 74.18 ? 11  ASP A OD2  1 
ATOM 157  H H    . ASP A 1 11  ? -8.661  -7.239  12.947  1.00 54.72 ? 11  ASP A H    1 
ATOM 158  H HA   . ASP A 1 11  ? -7.176  -5.201  12.220  1.00 54.72 ? 11  ASP A HA   1 
ATOM 159  H HB2  . ASP A 1 11  ? -6.707  -7.032  14.321  1.00 54.72 ? 11  ASP A HB2  1 
ATOM 160  H HB3  . ASP A 1 11  ? -5.928  -5.658  14.145  1.00 54.72 ? 11  ASP A HB3  1 
ATOM 161  N N    . GLY A 1 12  ? -5.449  -6.045  10.751  1.00 72.02 ? 12  GLY A N    1 
ATOM 162  C CA   . GLY A 1 12  ? -4.268  -6.450  10.011  1.00 74.32 ? 12  GLY A CA   1 
ATOM 163  C C    . GLY A 1 12  ? -4.406  -7.815  9.354   1.00 71.27 ? 12  GLY A C    1 
ATOM 164  O O    . GLY A 1 12  ? -5.346  -8.029  8.586   1.00 68.06 ? 12  GLY A O    1 
ATOM 165  H H    . GLY A 1 12  ? -5.784  -5.299  10.482  1.00 54.72 ? 12  GLY A H    1 
ATOM 166  H HA2  . GLY A 1 12  ? -4.084  -5.797  9.318   1.00 54.72 ? 12  GLY A HA2  1 
ATOM 167  H HA3  . GLY A 1 12  ? -3.508  -6.478  10.613  1.00 54.72 ? 12  GLY A HA3  1 
ATOM 168  N N    . PRO A 1 13  ? -3.471  -8.746  9.640   1.00 72.57 ? 13  PRO A N    1 
ATOM 169  C CA   . PRO A 1 13  ? -3.476  -10.040 8.936   1.00 70.43 ? 13  PRO A CA   1 
ATOM 170  C C    . PRO A 1 13  ? -4.712  -10.914 9.172   1.00 65.79 ? 13  PRO A C    1 
ATOM 171  O O    . PRO A 1 13  ? -4.857  -11.938 8.501   1.00 64.02 ? 13  PRO A O    1 
ATOM 172  C CB   . PRO A 1 13  ? -2.228  -10.749 9.484   1.00 73.40 ? 13  PRO A CB   1 
ATOM 173  C CG   . PRO A 1 13  ? -1.895  -10.050 10.754  1.00 75.82 ? 13  PRO A CG   1 
ATOM 174  C CD   . PRO A 1 13  ? -2.331  -8.636  10.570  1.00 76.56 ? 13  PRO A CD   1 
ATOM 175  H HA   . PRO A 1 13  ? -3.366  -9.900  7.983   1.00 54.72 ? 13  PRO A HA   1 
ATOM 176  H HB2  . PRO A 1 13  ? -2.430  -11.683 9.651   1.00 54.72 ? 13  PRO A HB2  1 
ATOM 177  H HB3  . PRO A 1 13  ? -1.500  -10.665 8.847   1.00 54.72 ? 13  PRO A HB3  1 
ATOM 178  H HG2  . PRO A 1 13  ? -2.377  -10.462 11.488  1.00 54.72 ? 13  PRO A HG2  1 
ATOM 179  H HG3  . PRO A 1 13  ? -0.938  -10.094 10.908  1.00 54.72 ? 13  PRO A HG3  1 
ATOM 180  H HD2  . PRO A 1 13  ? -2.620  -8.258  11.416  1.00 54.72 ? 13  PRO A HD2  1 
ATOM 181  H HD3  . PRO A 1 13  ? -1.619  -8.111  10.172  1.00 54.72 ? 13  PRO A HD3  1 
ATOM 182  N N    . VAL A 1 14  ? -5.583  -10.524 10.098  1.00 66.67 ? 14  VAL A N    1 
ATOM 183  C CA   . VAL A 1 14  ? -6.798  -11.292 10.367  1.00 62.87 ? 14  VAL A CA   1 
ATOM 184  C C    . VAL A 1 14  ? -7.846  -11.057 9.285   1.00 60.27 ? 14  VAL A C    1 
ATOM 185  O O    . VAL A 1 14  ? -8.378  -9.954  9.146   1.00 60.35 ? 14  VAL A O    1 
ATOM 186  C CB   . VAL A 1 14  ? -7.414  -10.941 11.740  1.00 62.57 ? 14  VAL A CB   1 
ATOM 187  C CG1  . VAL A 1 14  ? -8.712  -11.713 11.962  1.00 59.14 ? 14  VAL A CG1  1 
ATOM 188  C CG2  . VAL A 1 14  ? -6.446  -11.256 12.858  1.00 65.15 ? 14  VAL A CG2  1 
ATOM 189  H H    . VAL A 1 14  ? -5.496  -9.820  10.584  1.00 54.72 ? 14  VAL A H    1 
ATOM 190  H HA   . VAL A 1 14  ? -6.578  -12.237 10.370  1.00 54.72 ? 14  VAL A HA   1 
ATOM 191  H HB   . VAL A 1 14  ? -7.615  -9.992  11.769  1.00 54.72 ? 14  VAL A HB   1 
ATOM 192  H HG11 . VAL A 1 14  ? -9.077  -11.475 12.828  1.00 54.72 ? 14  VAL A HG11 1 
ATOM 193  H HG12 . VAL A 1 14  ? -9.341  -11.479 11.262  1.00 54.72 ? 14  VAL A HG12 1 
ATOM 194  H HG13 . VAL A 1 14  ? -8.522  -12.664 11.932  1.00 54.72 ? 14  VAL A HG13 1 
ATOM 195  H HG21 . VAL A 1 14  ? -6.857  -11.027 13.705  1.00 54.72 ? 14  VAL A HG21 1 
ATOM 196  H HG22 . VAL A 1 14  ? -6.237  -12.203 12.836  1.00 54.72 ? 14  VAL A HG22 1 
ATOM 197  H HG23 . VAL A 1 14  ? -5.637  -10.736 12.730  1.00 54.72 ? 14  VAL A HG23 1 
ATOM 198  N N    . GLN A 1 15  ? -8.128  -12.108 8.521   1.00 58.45 ? 15  GLN A N    1 
ATOM 199  C CA   . GLN A 1 15  ? -9.199  -12.099 7.532   1.00 55.92 ? 15  GLN A CA   1 
ATOM 200  C C    . GLN A 1 15  ? -9.790  -13.501 7.435   1.00 53.59 ? 15  GLN A C    1 
ATOM 201  O O    . GLN A 1 15  ? -9.335  -14.410 8.129   1.00 54.06 ? 15  GLN A O    1 
ATOM 202  C CB   . GLN A 1 15  ? -8.678  -11.624 6.171   1.00 55.52 ? 15  GLN A CB   1 
ATOM 203  C CG   . GLN A 1 15  ? -7.492  -12.428 5.617   1.00 57.34 ? 15  GLN A CG   1 
ATOM 204  C CD   . GLN A 1 15  ? -7.899  -13.715 4.908   0.30 55.29 ? 15  GLN A CD   1 
ATOM 205  O OE1  . GLN A 1 15  ? -9.076  -13.940 4.622   0.48 52.60 ? 15  GLN A OE1  1 
ATOM 206  N NE2  . GLN A 1 15  ? -6.918  -14.565 4.618   0.77 56.96 ? 15  GLN A NE2  1 
ATOM 207  H H    . GLN A 1 15  ? -7.703  -12.854 8.559   1.00 54.72 ? 15  GLN A H    1 
ATOM 208  H HA   . GLN A 1 15  ? -9.899  -11.491 7.820   1.00 54.72 ? 15  GLN A HA   1 
ATOM 209  H HB2  . GLN A 1 15  ? -9.400  -11.684 5.526   1.00 54.72 ? 15  GLN A HB2  1 
ATOM 210  H HB3  . GLN A 1 15  ? -8.392  -10.701 6.254   1.00 54.72 ? 15  GLN A HB3  1 
ATOM 211  H HG2  . GLN A 1 15  ? -7.012  -11.877 4.978   1.00 54.72 ? 15  GLN A HG2  1 
ATOM 212  H HG3  . GLN A 1 15  ? -6.905  -12.667 6.352   1.00 54.72 ? 15  GLN A HG3  1 
ATOM 213  H HE21 . GLN A 1 15  ? -6.106  -14.374 4.829   0.77 54.72 ? 15  GLN A HE21 1 
ATOM 214  H HE22 . GLN A 1 15  ? -7.095  -15.306 4.218   0.77 54.72 ? 15  GLN A HE22 1 
ATOM 215  N N    . GLY A 1 16  ? -10.796 -13.682 6.583   1.00 52.82 ? 16  GLY A N    1 
ATOM 216  C CA   . GLY A 1 16  ? -11.389 -14.996 6.389   1.00 51.06 ? 16  GLY A CA   1 
ATOM 217  C C    . GLY A 1 16  ? -12.766 -14.985 5.748   1.00 48.86 ? 16  GLY A C    1 
ATOM 218  O O    . GLY A 1 16  ? -13.394 -13.933 5.623   1.00 48.48 ? 16  GLY A O    1 
ATOM 219  H H    . GLY A 1 16  ? -11.151 -13.059 6.107   1.00 54.72 ? 16  GLY A H    1 
ATOM 220  H HA2  . GLY A 1 16  ? -10.802 -15.526 5.827   1.00 54.72 ? 16  GLY A HA2  1 
ATOM 221  H HA3  . GLY A 1 16  ? -11.462 -15.438 7.249   1.00 54.72 ? 16  GLY A HA3  1 
ATOM 222  N N    . ILE A 1 17  ? -13.226 -16.169 5.344   1.00 47.25 ? 17  ILE A N    1 
ATOM 223  C CA   . ILE A 1 17  ? -14.558 -16.349 4.770   1.00 45.53 ? 17  ILE A CA   1 
ATOM 224  C C    . ILE A 1 17  ? -15.251 -17.551 5.410   1.00 44.89 ? 17  ILE A C    1 
ATOM 225  O O    . ILE A 1 17  ? -14.608 -18.555 5.707   1.00 45.68 ? 17  ILE A O    1 
ATOM 226  C CB   . ILE A 1 17  ? -14.496 -16.547 3.246   1.00 43.84 ? 17  ILE A CB   1 
ATOM 227  C CG1  . ILE A 1 17  ? -13.819 -15.337 2.604   1.00 44.96 ? 17  ILE A CG1  1 
ATOM 228  C CG2  . ILE A 1 17  ? -15.903 -16.740 2.684   1.00 42.38 ? 17  ILE A CG2  1 
ATOM 229  C CD1  . ILE A 1 17  ? -13.741 -15.388 1.108   1.00 45.23 ? 17  ILE A CD1  1 
ATOM 230  H H    . ILE A 1 17  ? -12.774 -16.899 5.394   1.00 54.72 ? 17  ILE A H    1 
ATOM 231  H HA   . ILE A 1 17  ? -15.092 -15.560 4.951   1.00 54.72 ? 17  ILE A HA   1 
ATOM 232  H HB   . ILE A 1 17  ? -13.971 -17.339 3.054   1.00 54.72 ? 17  ILE A HB   1 
ATOM 233  H HG12 . ILE A 1 17  ? -14.315 -14.539 2.845   1.00 54.72 ? 17  ILE A HG12 1 
ATOM 234  H HG13 . ILE A 1 17  ? -12.912 -15.273 2.943   1.00 54.72 ? 17  ILE A HG13 1 
ATOM 235  H HG21 . ILE A 1 17  ? -15.845 -16.863 1.724   1.00 54.72 ? 17  ILE A HG21 1 
ATOM 236  H HG22 . ILE A 1 17  ? -16.302 -17.523 3.095   1.00 54.72 ? 17  ILE A HG22 1 
ATOM 237  H HG23 . ILE A 1 17  ? -16.434 -15.954 2.886   1.00 54.72 ? 17  ILE A HG23 1 
ATOM 238  H HD11 . ILE A 1 17  ? -13.299 -14.587 0.788   1.00 54.72 ? 17  ILE A HD11 1 
ATOM 239  H HD12 . ILE A 1 17  ? -13.235 -16.173 0.846   1.00 54.72 ? 17  ILE A HD12 1 
ATOM 240  H HD13 . ILE A 1 17  ? -14.640 -15.438 0.748   1.00 54.72 ? 17  ILE A HD13 1 
ATOM 241  N N    . ILE A 1 18  ? -16.563 -17.441 5.610   1.00 47.31 ? 18  ILE A N    1 
ATOM 242  C CA   . ILE A 1 18  ? -17.355 -18.506 6.227   1.00 47.20 ? 18  ILE A CA   1 
ATOM 243  C C    . ILE A 1 18  ? -18.663 -18.697 5.461   1.00 46.42 ? 18  ILE A C    1 
ATOM 244  O O    . ILE A 1 18  ? -19.450 -17.759 5.333   1.00 45.91 ? 18  ILE A O    1 
ATOM 245  C CB   . ILE A 1 18  ? -17.688 -18.194 7.715   1.00 47.13 ? 18  ILE A CB   1 
ATOM 246  C CG1  . ILE A 1 18  ? -16.416 -17.937 8.536   1.00 48.22 ? 18  ILE A CG1  1 
ATOM 247  C CG2  . ILE A 1 18  ? -18.528 -19.321 8.341   1.00 47.55 ? 18  ILE A CG2  1 
ATOM 248  C CD1  . ILE A 1 18  ? -15.666 -19.184 8.971   1.00 49.25 ? 18  ILE A CD1  1 
ATOM 249  H H    . ILE A 1 18  ? -17.025 -16.749 5.394   1.00 54.72 ? 18  ILE A H    1 
ATOM 250  H HA   . ILE A 1 18  ? -16.856 -19.337 6.193   1.00 54.72 ? 18  ILE A HA   1 
ATOM 251  H HB   . ILE A 1 18  ? -18.221 -17.384 7.735   1.00 54.72 ? 18  ILE A HB   1 
ATOM 252  H HG12 . ILE A 1 18  ? -15.807 -17.402 8.002   1.00 54.72 ? 18  ILE A HG12 1 
ATOM 253  H HG13 . ILE A 1 18  ? -16.659 -17.448 9.337   1.00 54.72 ? 18  ILE A HG13 1 
ATOM 254  H HG21 . ILE A 1 18  ? -18.718 -19.097 9.265   1.00 54.72 ? 18  ILE A HG21 1 
ATOM 255  H HG22 . ILE A 1 18  ? -19.356 -19.410 7.845   1.00 54.72 ? 18  ILE A HG22 1 
ATOM 256  H HG23 . ILE A 1 18  ? -18.025 -20.150 8.298   1.00 54.72 ? 18  ILE A HG23 1 
ATOM 257  H HD11 . ILE A 1 18  ? -14.883 -18.921 9.479   1.00 54.72 ? 18  ILE A HD11 1 
ATOM 258  H HD12 . ILE A 1 18  ? -16.252 -19.728 9.522   1.00 54.72 ? 18  ILE A HD12 1 
ATOM 259  H HD13 . ILE A 1 18  ? -15.397 -19.682 8.183   1.00 54.72 ? 18  ILE A HD13 1 
ATOM 260  N N    . ASN A 1 19  ? -18.894 -19.908 4.959   1.00 46.72 ? 19  ASN A N    1 
ATOM 261  C CA   . ASN A 1 19  ? -20.130 -20.214 4.245   1.00 46.47 ? 19  ASN A CA   1 
ATOM 262  C C    . ASN A 1 19  ? -21.154 -20.892 5.157   1.00 47.25 ? 19  ASN A C    1 
ATOM 263  O O    . ASN A 1 19  ? -20.793 -21.684 6.029   1.00 48.19 ? 19  ASN A O    1 
ATOM 264  C CB   . ASN A 1 19  ? -19.846 -21.101 3.024   1.00 48.18 ? 19  ASN A CB   1 
ATOM 265  C CG   . ASN A 1 19  ? -18.818 -20.494 2.084   1.00 47.92 ? 19  ASN A CG   1 
ATOM 266  O OD1  . ASN A 1 19  ? -19.090 -19.505 1.402   1.00 47.33 ? 19  ASN A OD1  1 
ATOM 267  N ND2  . ASN A 1 19  ? -17.634 -21.096 2.032   1.00 48.76 ? 19  ASN A ND2  1 
ATOM 268  H H    . ASN A 1 19  ? -18.350 -20.571 5.020   1.00 54.72 ? 19  ASN A H    1 
ATOM 269  H HA   . ASN A 1 19  ? -20.520 -19.385 3.925   1.00 54.72 ? 19  ASN A HA   1 
ATOM 270  H HB2  . ASN A 1 19  ? -19.506 -21.957 3.328   1.00 54.72 ? 19  ASN A HB2  1 
ATOM 271  H HB3  . ASN A 1 19  ? -20.669 -21.228 2.527   1.00 54.72 ? 19  ASN A HB3  1 
ATOM 272  H HD21 . ASN A 1 19  ? -17.019 -20.791 1.514   1.00 54.72 ? 19  ASN A HD21 1 
ATOM 273  H HD22 . ASN A 1 19  ? -17.484 -21.791 2.515   1.00 54.72 ? 19  ASN A HD22 1 
ATOM 274  N N    . PHE A 1 20  ? -22.426 -20.557 4.950   1.00 47.23 ? 20  PHE A N    1 
ATOM 275  C CA   . PHE A 1 20  ? -23.543 -21.185 5.654   1.00 48.52 ? 20  PHE A CA   1 
ATOM 276  C C    . PHE A 1 20  ? -24.441 -21.858 4.618   1.00 49.19 ? 20  PHE A C    1 
ATOM 277  O O    . PHE A 1 20  ? -24.519 -21.404 3.477   1.00 48.39 ? 20  PHE A O    1 
ATOM 278  C CB   . PHE A 1 20  ? -24.339 -20.157 6.473   1.00 45.76 ? 20  PHE A CB   1 
ATOM 279  C CG   . PHE A 1 20  ? -23.495 -19.329 7.412   1.00 45.31 ? 20  PHE A CG   1 
ATOM 280  C CD1  . PHE A 1 20  ? -22.610 -18.382 6.921   1.00 44.16 ? 20  PHE A CD1  1 
ATOM 281  C CD2  . PHE A 1 20  ? -23.602 -19.484 8.787   1.00 46.46 ? 20  PHE A CD2  1 
ATOM 282  C CE1  . PHE A 1 20  ? -21.837 -17.619 7.777   1.00 44.21 ? 20  PHE A CE1  1 
ATOM 283  C CE2  . PHE A 1 20  ? -22.830 -18.720 9.649   1.00 46.35 ? 20  PHE A CE2  1 
ATOM 284  C CZ   . PHE A 1 20  ? -21.948 -17.787 9.141   1.00 45.25 ? 20  PHE A CZ   1 
ATOM 285  H H    . PHE A 1 20  ? -22.674 -19.953 4.391   1.00 54.72 ? 20  PHE A H    1 
ATOM 286  H HA   . PHE A 1 20  ? -23.204 -21.865 6.257   1.00 54.72 ? 20  PHE A HA   1 
ATOM 287  H HB2  . PHE A 1 20  ? -24.784 -19.549 5.862   1.00 54.72 ? 20  PHE A HB2  1 
ATOM 288  H HB3  . PHE A 1 20  ? -24.999 -20.627 7.006   1.00 54.72 ? 20  PHE A HB3  1 
ATOM 289  H HD1  . PHE A 1 20  ? -22.528 -18.265 6.002   1.00 54.72 ? 20  PHE A HD1  1 
ATOM 290  H HD2  . PHE A 1 20  ? -24.193 -20.112 9.134   1.00 54.72 ? 20  PHE A HD2  1 
ATOM 291  H HE1  . PHE A 1 20  ? -21.245 -16.990 7.433   1.00 54.72 ? 20  PHE A HE1  1 
ATOM 292  H HE2  . PHE A 1 20  ? -22.907 -18.836 10.568  1.00 54.72 ? 20  PHE A HE2  1 
ATOM 293  H HZ   . PHE A 1 20  ? -21.431 -17.274 9.718   1.00 54.72 ? 20  PHE A HZ   1 
ATOM 294  N N    . GLU A 1 21  ? -25.110 -22.939 5.016   1.00 49.83 ? 21  GLU A N    1 
ATOM 295  C CA   . GLU A 1 21  ? -25.962 -23.702 4.104   1.00 51.10 ? 21  GLU A CA   1 
ATOM 296  C C    . GLU A 1 21  ? -27.132 -24.386 4.808   1.00 53.64 ? 21  GLU A C    1 
ATOM 297  O O    . GLU A 1 21  ? -26.954 -25.048 5.829   1.00 54.99 ? 21  GLU A O    1 
ATOM 298  C CB   . GLU A 1 21  ? -25.131 -24.750 3.371   1.00 53.07 ? 21  GLU A CB   1 
ATOM 299  C CG   . GLU A 1 21  ? -24.235 -24.175 2.307   1.00 51.30 ? 21  GLU A CG   1 
ATOM 300  C CD   . GLU A 1 21  ? -23.544 -25.254 1.507   1.00 52.16 ? 21  GLU A CD   1 
ATOM 301  O OE1  . GLU A 1 21  ? -24.138 -25.738 0.519   1.00 53.11 ? 21  GLU A OE1  1 
ATOM 302  O OE2  . GLU A 1 21  ? -22.413 -25.635 1.878   1.00 52.18 ? 21  GLU A OE2  1 
ATOM 303  H H    . GLU A 1 21  ? -25.087 -23.254 5.816   1.00 54.72 ? 21  GLU A H    1 
ATOM 304  H HA   . GLU A 1 21  ? -26.328 -23.096 3.440   1.00 54.72 ? 21  GLU A HA   1 
ATOM 305  H HB2  . GLU A 1 21  ? -24.570 -25.210 4.014   1.00 54.72 ? 21  GLU A HB2  1 
ATOM 306  H HB3  . GLU A 1 21  ? -25.731 -25.382 2.944   1.00 54.72 ? 21  GLU A HB3  1 
ATOM 307  H HG2  . GLU A 1 21  ? -24.767 -23.640 1.696   1.00 54.72 ? 21  GLU A HG2  1 
ATOM 308  H HG3  . GLU A 1 21  ? -23.554 -23.625 2.726   1.00 54.72 ? 21  GLU A HG3  1 
ATOM 309  N N    . GLN A 1 22  ? -28.323 -24.220 4.234   1.00 52.09 ? 22  GLN A N    1 
ATOM 310  C CA   . GLN A 1 22  ? -29.559 -24.793 4.763   1.00 55.10 ? 22  GLN A CA   1 
ATOM 311  C C    . GLN A 1 22  ? -30.418 -25.326 3.613   1.00 56.75 ? 22  GLN A C    1 
ATOM 312  O O    . GLN A 1 22  ? -30.443 -24.734 2.534   1.00 55.34 ? 22  GLN A O    1 
ATOM 313  C CB   . GLN A 1 22  ? -30.334 -23.742 5.559   1.00 53.66 ? 22  GLN A CB   1 
ATOM 314  C CG   . GLN A 1 22  ? -31.399 -24.312 6.470   1.00 57.14 ? 22  GLN A CG   1 
ATOM 315  C CD   . GLN A 1 22  ? -32.352 -23.249 6.979   1.00 57.89 ? 22  GLN A CD   1 
ATOM 316  O OE1  . GLN A 1 22  ? -33.063 -22.613 6.201   1.00 57.85 ? 22  GLN A OE1  1 
ATOM 317  N NE2  . GLN A 1 22  ? -32.363 -23.044 8.291   1.00 58.84 ? 22  GLN A NE2  1 
ATOM 318  H H    . GLN A 1 22  ? -28.443 -23.766 3.514   1.00 54.72 ? 22  GLN A H    1 
ATOM 319  H HA   . GLN A 1 22  ? -29.346 -25.531 5.355   1.00 54.72 ? 22  GLN A HA   1 
ATOM 320  H HB2  . GLN A 1 22  ? -29.709 -23.246 6.110   1.00 54.72 ? 22  GLN A HB2  1 
ATOM 321  H HB3  . GLN A 1 22  ? -30.771 -23.140 4.936   1.00 54.72 ? 22  GLN A HB3  1 
ATOM 322  H HG2  . GLN A 1 22  ? -31.916 -24.971 5.981   1.00 54.72 ? 22  GLN A HG2  1 
ATOM 323  H HG3  . GLN A 1 22  ? -30.972 -24.725 7.237   1.00 54.72 ? 22  GLN A HG3  1 
ATOM 324  H HE21 . GLN A 1 22  ? -31.846 -23.503 8.802   1.00 54.72 ? 22  GLN A HE21 1 
ATOM 325  H HE22 . GLN A 1 22  ? -32.886 -22.451 8.629   1.00 54.72 ? 22  GLN A HE22 1 
ATOM 326  N N    . LYS A 1 23  ? -31.118 -26.436 3.845   1.00 56.96 ? 23  LYS A N    1 
ATOM 327  C CA   . LYS A 1 23  ? -31.906 -27.090 2.800   1.00 59.19 ? 23  LYS A CA   1 
ATOM 328  C C    . LYS A 1 23  ? -33.404 -26.829 2.960   1.00 61.98 ? 23  LYS A C    1 
ATOM 329  O O    . LYS A 1 23  ? -34.082 -26.461 2.000   1.00 62.33 ? 23  LYS A O    1 
ATOM 330  C CB   . LYS A 1 23  ? -31.643 -28.595 2.809   1.00 61.75 ? 23  LYS A CB   1 
ATOM 331  C CG   . LYS A 1 23  ? -31.869 -29.261 1.470   1.00 63.09 ? 23  LYS A CG   1 
ATOM 332  C CD   . LYS A 1 23  ? -32.174 -30.747 1.619   1.00 67.30 ? 23  LYS A CD   1 
ATOM 333  C CE   . LYS A 1 23  ? -31.076 -31.496 2.372   1.00 67.20 ? 23  LYS A CE   1 
ATOM 334  N NZ   . LYS A 1 23  ? -31.314 -32.969 2.401   1.00 71.61 ? 23  LYS A NZ   1 
ATOM 335  H H    . LYS A 1 23  ? -31.153 -26.833 4.607   1.00 54.72 ? 23  LYS A H    1 
ATOM 336  H HA   . LYS A 1 23  ? -31.633 -26.743 1.937   1.00 54.72 ? 23  LYS A HA   1 
ATOM 337  H HB2  . LYS A 1 23  ? -30.720 -28.750 3.065   1.00 54.72 ? 23  LYS A HB2  1 
ATOM 338  H HB3  . LYS A 1 23  ? -32.237 -29.013 3.452   1.00 54.72 ? 23  LYS A HB3  1 
ATOM 339  H HG2  . LYS A 1 23  ? -32.622 -28.840 1.028   1.00 54.72 ? 23  LYS A HG2  1 
ATOM 340  H HG3  . LYS A 1 23  ? -31.069 -29.169 0.929   1.00 54.72 ? 23  LYS A HG3  1 
ATOM 341  H HD2  . LYS A 1 23  ? -33.003 -30.852 2.112   1.00 54.72 ? 23  LYS A HD2  1 
ATOM 342  H HD3  . LYS A 1 23  ? -32.259 -31.143 0.738   1.00 54.72 ? 23  LYS A HD3  1 
ATOM 343  H HE2  . LYS A 1 23  ? -30.225 -31.336 1.935   1.00 54.72 ? 23  LYS A HE2  1 
ATOM 344  H HE3  . LYS A 1 23  ? -31.045 -31.177 3.288   1.00 54.72 ? 23  LYS A HE3  1 
ATOM 345  H HZ1  . LYS A 1 23  ? -30.658 -33.374 2.846   1.00 54.72 ? 23  LYS A HZ1  1 
ATOM 346  H HZ2  . LYS A 1 23  ? -32.088 -33.144 2.804   1.00 54.72 ? 23  LYS A HZ2  1 
ATOM 347  H HZ3  . LYS A 1 23  ? -31.341 -33.289 1.571   1.00 54.72 ? 23  LYS A HZ3  1 
ATOM 348  N N    . GLU A 1 24  ? -33.915 -27.049 4.170   1.00 64.33 ? 24  GLU A N    1 
ATOM 349  C CA   . GLU A 1 24  ? -35.306 -26.743 4.491   1.00 67.41 ? 24  GLU A CA   1 
ATOM 350  C C    . GLU A 1 24  ? -35.385 -25.768 5.665   1.00 66.63 ? 24  GLU A C    1 
ATOM 351  O O    . GLU A 1 24  ? -34.420 -25.596 6.407   1.00 64.50 ? 24  GLU A O    1 
ATOM 352  C CB   . GLU A 1 24  ? -36.081 -28.026 4.793   1.00 72.45 ? 24  GLU A CB   1 
ATOM 353  C CG   . GLU A 1 24  ? -36.486 -28.791 3.537   1.00 74.41 ? 24  GLU A CG   1 
ATOM 354  C CD   . GLU A 1 24  ? -37.563 -29.827 3.801   1.00 80.29 ? 24  GLU A CD   1 
ATOM 355  O OE1  . GLU A 1 24  ? -37.608 -30.365 4.928   1.00 82.72 ? 24  GLU A OE1  1 
ATOM 356  O OE2  . GLU A 1 24  ? -38.367 -30.101 2.882   1.00 82.84 ? 24  GLU A OE2  1 
ATOM 357  H H    . GLU A 1 24  ? -33.470 -27.378 4.828   1.00 54.72 ? 24  GLU A H    1 
ATOM 358  H HA   . GLU A 1 24  ? -35.719 -26.319 3.723   1.00 54.72 ? 24  GLU A HA   1 
ATOM 359  H HB2  . GLU A 1 24  ? -35.525 -28.610 5.332   1.00 54.72 ? 24  GLU A HB2  1 
ATOM 360  H HB3  . GLU A 1 24  ? -36.889 -27.799 5.279   1.00 54.72 ? 24  GLU A HB3  1 
ATOM 361  H HG2  . GLU A 1 24  ? -36.829 -28.164 2.882   1.00 54.72 ? 24  GLU A HG2  1 
ATOM 362  H HG3  . GLU A 1 24  ? -35.709 -29.251 3.182   1.00 54.72 ? 24  GLU A HG3  1 
ATOM 363  N N    . SER A 1 25  ? -36.549 -25.146 5.828   1.00 68.75 ? 25  SER A N    1 
ATOM 364  C CA   . SER A 1 25  ? -36.699 -23.976 6.694   1.00 67.91 ? 25  SER A CA   1 
ATOM 365  C C    . SER A 1 25  ? -36.372 -24.216 8.168   1.00 68.91 ? 25  SER A C    1 
ATOM 366  O O    . SER A 1 25  ? -36.111 -23.262 8.903   1.00 67.44 ? 25  SER A O    1 
ATOM 367  C CB   . SER A 1 25  ? -38.128 -23.441 6.588   1.00 71.05 ? 25  SER A CB   1 
ATOM 368  O OG   . SER A 1 25  ? -39.060 -24.414 7.026   1.00 76.08 ? 25  SER A OG   1 
ATOM 369  H H    . SER A 1 25  ? -37.279 -25.386 5.443   1.00 54.72 ? 25  SER A H    1 
ATOM 370  H HA   . SER A 1 25  ? -36.103 -23.281 6.374   1.00 54.72 ? 25  SER A HA   1 
ATOM 371  H HB2  . SER A 1 25  ? -38.211 -22.650 7.143   1.00 54.72 ? 25  SER A HB2  1 
ATOM 372  H HB3  . SER A 1 25  ? -38.314 -23.219 5.662   1.00 54.72 ? 25  SER A HB3  1 
ATOM 373  H HG   . SER A 1 25  ? -39.841 -24.111 6.965   1.00 54.72 ? 25  SER A HG   1 
ATOM 374  N N    . ASN A 1 26  ? -36.397 -25.474 8.601   1.00 71.73 ? 26  ASN A N    1 
ATOM 375  C CA   . ASN A 1 26  ? -36.104 -25.810 9.994   1.00 73.20 ? 26  ASN A CA   1 
ATOM 376  C C    . ASN A 1 26  ? -35.068 -26.931 10.111  1.00 72.72 ? 26  ASN A C    1 
ATOM 377  O O    . ASN A 1 26  ? -35.008 -27.642 11.114  1.00 75.36 ? 26  ASN A O    1 
ATOM 378  C CB   . ASN A 1 26  ? -37.398 -26.190 10.724  1.00 78.75 ? 26  ASN A CB   1 
ATOM 379  C CG   . ASN A 1 26  ? -37.966 -25.038 11.538  1.00 79.39 ? 26  ASN A CG   1 
ATOM 380  O OD1  . ASN A 1 26  ? -39.061 -24.548 11.263  1.00 81.61 ? 26  ASN A OD1  1 
ATOM 381  N ND2  . ASN A 1 26  ? -37.220 -24.601 12.547  1.00 77.75 ? 26  ASN A ND2  1 
ATOM 382  H H    . ASN A 1 26  ? -36.582 -26.154 8.107   1.00 54.72 ? 26  ASN A H    1 
ATOM 383  H HA   . ASN A 1 26  ? -35.739 -25.025 10.431  1.00 54.72 ? 26  ASN A HA   1 
ATOM 384  H HB2  . ASN A 1 26  ? -38.065 -26.454 10.071  1.00 54.72 ? 26  ASN A HB2  1 
ATOM 385  H HB3  . ASN A 1 26  ? -37.216 -26.925 11.330  1.00 54.72 ? 26  ASN A HB3  1 
ATOM 386  H HD21 . ASN A 1 26  ? -37.498 -23.951 13.037  1.00 54.72 ? 26  ASN A HD21 1 
ATOM 387  H HD22 . ASN A 1 26  ? -36.460 -24.968 12.710  1.00 54.72 ? 26  ASN A HD22 1 
ATOM 388  N N    . GLY A 1 27  ? -34.238 -27.067 9.082   1.00 69.59 ? 27  GLY A N    1 
ATOM 389  C CA   . GLY A 1 27  ? -33.172 -28.052 9.087   1.00 69.01 ? 27  GLY A CA   1 
ATOM 390  C C    . GLY A 1 27  ? -31.905 -27.490 9.700   1.00 65.58 ? 27  GLY A C    1 
ATOM 391  O O    . GLY A 1 27  ? -31.895 -26.364 10.198  1.00 63.92 ? 27  GLY A O    1 
ATOM 392  H H    . GLY A 1 27  ? -34.275 -26.596 8.364   1.00 54.72 ? 27  GLY A H    1 
ATOM 393  H HA2  . GLY A 1 27  ? -33.447 -28.829 9.598   1.00 54.72 ? 27  GLY A HA2  1 
ATOM 394  H HA3  . GLY A 1 27  ? -32.980 -28.330 8.177   1.00 54.72 ? 27  GLY A HA3  1 
ATOM 395  N N    . PRO A 1 28  ? -30.821 -28.276 9.668   1.00 65.25 ? 28  PRO A N    1 
ATOM 396  C CA   . PRO A 1 28  ? -29.578 -27.874 10.327  1.00 62.71 ? 28  PRO A CA   1 
ATOM 397  C C    . PRO A 1 28  ? -28.657 -27.079 9.413   1.00 58.55 ? 28  PRO A C    1 
ATOM 398  O O    . PRO A 1 28  ? -28.285 -27.563 8.344   1.00 57.83 ? 28  PRO A O    1 
ATOM 399  C CB   . PRO A 1 28  ? -28.950 -29.212 10.699  1.00 64.39 ? 28  PRO A CB   1 
ATOM 400  C CG   . PRO A 1 28  ? -29.368 -30.121 9.581   1.00 65.98 ? 28  PRO A CG   1 
ATOM 401  C CD   . PRO A 1 28  ? -30.713 -29.625 9.083   1.00 66.97 ? 28  PRO A CD   1 
ATOM 402  H HA   . PRO A 1 28  ? -29.764 -27.364 11.130  1.00 54.72 ? 28  PRO A HA   1 
ATOM 403  H HB2  . PRO A 1 28  ? -27.985 -29.126 10.735  1.00 54.72 ? 28  PRO A HB2  1 
ATOM 404  H HB3  . PRO A 1 28  ? -29.305 -29.519 11.548  1.00 54.72 ? 28  PRO A HB3  1 
ATOM 405  H HG2  . PRO A 1 28  ? -28.709 -30.081 8.871   1.00 54.72 ? 28  PRO A HG2  1 
ATOM 406  H HG3  . PRO A 1 28  ? -29.446 -31.028 9.918   1.00 54.72 ? 28  PRO A HG3  1 
ATOM 407  H HD2  . PRO A 1 28  ? -30.717 -29.574 8.114   1.00 54.72 ? 28  PRO A HD2  1 
ATOM 408  H HD3  . PRO A 1 28  ? -31.426 -30.194 9.412   1.00 54.72 ? 28  PRO A HD3  1 
ATOM 409  N N    . VAL A 1 29  ? -28.289 -25.874 9.829   1.00 60.54 ? 29  VAL A N    1 
ATOM 410  C CA   . VAL A 1 29  ? -27.374 -25.057 9.044   1.00 57.10 ? 29  VAL A CA   1 
ATOM 411  C C    . VAL A 1 29  ? -25.973 -25.651 9.113   1.00 56.29 ? 29  VAL A C    1 
ATOM 412  O O    . VAL A 1 29  ? -25.512 -26.028 10.192  1.00 57.38 ? 29  VAL A O    1 
ATOM 413  C CB   . VAL A 1 29  ? -27.342 -23.599 9.540   1.00 57.88 ? 29  VAL A CB   1 
ATOM 414  C CG1  . VAL A 1 29  ? -26.388 -22.758 8.688   1.00 54.86 ? 29  VAL A CG1  1 
ATOM 415  C CG2  . VAL A 1 29  ? -28.742 -23.005 9.518   1.00 59.10 ? 29  VAL A CG2  1 
ATOM 416  H H    . VAL A 1 29  ? -28.555 -25.507 10.560  1.00 54.72 ? 29  VAL A H    1 
ATOM 417  H HA   . VAL A 1 29  ? -27.660 -25.057 8.117   1.00 54.72 ? 29  VAL A HA   1 
ATOM 418  H HB   . VAL A 1 29  ? -27.022 -23.583 10.455  1.00 54.72 ? 29  VAL A HB   1 
ATOM 419  H HG11 . VAL A 1 29  ? -26.388 -21.847 9.022   1.00 54.72 ? 29  VAL A HG11 1 
ATOM 420  H HG12 . VAL A 1 29  ? -25.496 -23.133 8.750   1.00 54.72 ? 29  VAL A HG12 1 
ATOM 421  H HG13 . VAL A 1 29  ? -26.691 -22.773 7.767   1.00 54.72 ? 29  VAL A HG13 1 
ATOM 422  H HG21 . VAL A 1 29  ? -28.700 -22.089 9.833   1.00 54.72 ? 29  VAL A HG21 1 
ATOM 423  H HG22 . VAL A 1 29  ? -29.080 -23.028 8.609   1.00 54.72 ? 29  VAL A HG22 1 
ATOM 424  H HG23 . VAL A 1 29  ? -29.316 -23.529 10.098  1.00 54.72 ? 29  VAL A HG23 1 
ATOM 425  N N    . LYS A 1 30  ? -25.309 -25.746 7.962   1.00 56.16 ? 30  LYS A N    1 
ATOM 426  C CA   . LYS A 1 30  ? -23.942 -26.260 7.906   1.00 55.63 ? 30  LYS A CA   1 
ATOM 427  C C    . LYS A 1 30  ? -22.944 -25.129 7.678   1.00 53.04 ? 30  LYS A C    1 
ATOM 428  O O    . LYS A 1 30  ? -22.944 -24.478 6.632   1.00 51.49 ? 30  LYS A O    1 
ATOM 429  C CB   . LYS A 1 30  ? -23.807 -27.317 6.810   1.00 54.35 ? 30  LYS A CB   1 
ATOM 430  C CG   . LYS A 1 30  ? -22.481 -28.073 6.829   1.00 54.72 ? 30  LYS A CG   1 
ATOM 431  C CD   . LYS A 1 30  ? -22.231 -28.732 8.182   1.00 56.69 ? 30  LYS A CD   1 
ATOM 432  C CE   . LYS A 1 30  ? -21.100 -29.749 8.132   1.00 57.96 ? 30  LYS A CE   1 
ATOM 433  N NZ   . LYS A 1 30  ? -19.757 -29.111 8.211   1.00 56.27 ? 30  LYS A NZ   1 
ATOM 434  H H    . LYS A 1 30  ? -25.630 -25.520 7.197   1.00 54.72 ? 30  LYS A H    1 
ATOM 435  H HA   . LYS A 1 30  ? -23.729 -26.680 8.754   1.00 54.72 ? 30  LYS A HA   1 
ATOM 436  H HB2  . LYS A 1 30  ? -24.519 -27.967 6.915   1.00 54.72 ? 30  LYS A HB2  1 
ATOM 437  H HB3  . LYS A 1 30  ? -23.886 -26.882 5.946   1.00 54.72 ? 30  LYS A HB3  1 
ATOM 438  H HG2  . LYS A 1 30  ? -22.498 -28.767 6.152   1.00 54.72 ? 30  LYS A HG2  1 
ATOM 439  H HG3  . LYS A 1 30  ? -21.756 -27.452 6.655   1.00 54.72 ? 30  LYS A HG3  1 
ATOM 440  H HD2  . LYS A 1 30  ? -21.993 -28.049 8.829   1.00 54.72 ? 30  LYS A HD2  1 
ATOM 441  H HD3  . LYS A 1 30  ? -23.037 -29.192 8.465   1.00 54.72 ? 30  LYS A HD3  1 
ATOM 442  H HE2  . LYS A 1 30  ? -21.188 -30.358 8.882   1.00 54.72 ? 30  LYS A HE2  1 
ATOM 443  H HE3  . LYS A 1 30  ? -21.151 -30.239 7.297   1.00 54.72 ? 30  LYS A HE3  1 
ATOM 444  H HZ1  . LYS A 1 30  ? -19.122 -29.734 8.179   1.00 54.72 ? 30  LYS A HZ1  1 
ATOM 445  H HZ2  . LYS A 1 30  ? -19.646 -28.550 7.529   1.00 54.72 ? 30  LYS A HZ2  1 
ATOM 446  H HZ3  . LYS A 1 30  ? -19.680 -28.658 8.974   1.00 54.72 ? 30  LYS A HZ3  1 
ATOM 447  N N    . VAL A 1 31  ? -22.088 -24.919 8.673   1.00 53.18 ? 31  VAL A N    1 
ATOM 448  C CA   . VAL A 1 31  ? -21.175 -23.785 8.702   1.00 51.41 ? 31  VAL A CA   1 
ATOM 449  C C    . VAL A 1 31  ? -19.733 -24.244 8.473   1.00 51.45 ? 31  VAL A C    1 
ATOM 450  O O    . VAL A 1 31  ? -19.081 -24.739 9.394   1.00 52.65 ? 31  VAL A O    1 
ATOM 451  C CB   . VAL A 1 31  ? -21.266 -23.035 10.052  1.00 51.24 ? 31  VAL A CB   1 
ATOM 452  C CG1  . VAL A 1 31  ? -20.621 -21.671 9.936   1.00 49.68 ? 31  VAL A CG1  1 
ATOM 453  C CG2  . VAL A 1 31  ? -22.722 -22.906 10.515  1.00 52.22 ? 31  VAL A CG2  1 
ATOM 454  H H    . VAL A 1 31  ? -22.016 -25.433 9.358   1.00 54.72 ? 31  VAL A H    1 
ATOM 455  H HA   . VAL A 1 31  ? -21.412 -23.165 7.994   1.00 54.72 ? 31  VAL A HA   1 
ATOM 456  H HB   . VAL A 1 31  ? -20.781 -23.539 10.725  1.00 54.72 ? 31  VAL A HB   1 
ATOM 457  H HG11 . VAL A 1 31  ? -20.688 -21.218 10.791  1.00 54.72 ? 31  VAL A HG11 1 
ATOM 458  H HG12 . VAL A 1 31  ? -19.689 -21.782 9.692   1.00 54.72 ? 31  VAL A HG12 1 
ATOM 459  H HG13 . VAL A 1 31  ? -21.084 -21.161 9.253   1.00 54.72 ? 31  VAL A HG13 1 
ATOM 460  H HG21 . VAL A 1 31  ? -22.743 -22.433 11.361  1.00 54.72 ? 31  VAL A HG21 1 
ATOM 461  H HG22 . VAL A 1 31  ? -23.223 -22.413 9.847   1.00 54.72 ? 31  VAL A HG22 1 
ATOM 462  H HG23 . VAL A 1 31  ? -23.099 -23.794 10.622  1.00 54.72 ? 31  VAL A HG23 1 
ATOM 463  N N    . TRP A 1 32  ? -19.243 -24.075 7.246   1.00 50.36 ? 32  TRP A N    1 
ATOM 464  C CA   . TRP A 1 32  ? -17.902 -24.525 6.884   1.00 50.82 ? 32  TRP A CA   1 
ATOM 465  C C    . TRP A 1 32  ? -17.062 -23.405 6.290   1.00 49.66 ? 32  TRP A C    1 
ATOM 466  O O    . TRP A 1 32  ? -17.588 -22.496 5.648   1.00 48.41 ? 32  TRP A O    1 
ATOM 467  C CB   . TRP A 1 32  ? -17.973 -25.690 5.893   1.00 50.58 ? 32  TRP A CB   1 
ATOM 468  C CG   . TRP A 1 32  ? -18.677 -25.374 4.605   1.00 49.61 ? 32  TRP A CG   1 
ATOM 469  C CD1  . TRP A 1 32  ? -20.020 -25.424 4.371   1.00 49.58 ? 32  TRP A CD1  1 
ATOM 470  C CD2  . TRP A 1 32  ? -18.070 -24.973 3.370   1.00 48.94 ? 32  TRP A CD2  1 
ATOM 471  N NE1  . TRP A 1 32  ? -20.287 -25.075 3.069   1.00 48.81 ? 32  TRP A NE1  1 
ATOM 472  C CE2  . TRP A 1 32  ? -19.107 -24.791 2.434   1.00 48.38 ? 32  TRP A CE2  1 
ATOM 473  C CE3  . TRP A 1 32  ? -16.752 -24.747 2.967   1.00 49.12 ? 32  TRP A CE3  1 
ATOM 474  C CZ2  . TRP A 1 32  ? -18.867 -24.397 1.121   1.00 47.90 ? 32  TRP A CZ2  1 
ATOM 475  C CZ3  . TRP A 1 32  ? -16.516 -24.355 1.664   1.00 48.78 ? 32  TRP A CZ3  1 
ATOM 476  C CH2  . TRP A 1 32  ? -17.568 -24.182 0.757   1.00 48.11 ? 32  TRP A CH2  1 
ATOM 477  H H    . TRP A 1 32  ? -19.671 -23.700 6.601   1.00 54.72 ? 32  TRP A H    1 
ATOM 478  H HA   . TRP A 1 32  ? -17.452 -24.842 7.683   1.00 54.72 ? 32  TRP A HA   1 
ATOM 479  H HB2  . TRP A 1 32  ? -17.069 -25.966 5.674   1.00 54.72 ? 32  TRP A HB2  1 
ATOM 480  H HB3  . TRP A 1 32  ? -18.446 -26.425 6.314   1.00 54.72 ? 32  TRP A HB3  1 
ATOM 481  H HD1  . TRP A 1 32  ? -20.662 -25.659 5.002   1.00 54.72 ? 32  TRP A HD1  1 
ATOM 482  H HE1  . TRP A 1 32  ? -21.069 -25.038 2.712   1.00 54.72 ? 32  TRP A HE1  1 
ATOM 483  H HE3  . TRP A 1 32  ? -16.047 -24.858 3.564   1.00 54.72 ? 32  TRP A HE3  1 
ATOM 484  H HZ2  . TRP A 1 32  ? -19.564 -24.282 0.516   1.00 54.72 ? 32  TRP A HZ2  1 
ATOM 485  H HZ3  . TRP A 1 32  ? -15.643 -24.200 1.385   1.00 54.72 ? 32  TRP A HZ3  1 
ATOM 486  H HH2  . TRP A 1 32  ? -17.377 -23.917 -0.114  1.00 54.72 ? 32  TRP A HH2  1 
ATOM 487  N N    . GLY A 1 33  ? -15.754 -23.479 6.515   1.00 49.52 ? 33  GLY A N    1 
ATOM 488  C CA   . GLY A 1 33  ? -14.830 -22.493 5.990   1.00 49.18 ? 33  GLY A CA   1 
ATOM 489  C C    . GLY A 1 33  ? -13.583 -22.362 6.840   1.00 50.49 ? 33  GLY A C    1 
ATOM 490  O O    . GLY A 1 33  ? -13.201 -23.293 7.549   1.00 51.84 ? 33  GLY A O    1 
ATOM 491  H H    . GLY A 1 33  ? -15.377 -24.101 6.974   1.00 54.72 ? 33  GLY A H    1 
ATOM 492  H HA2  . GLY A 1 33  ? -14.566 -22.744 5.091   1.00 54.72 ? 33  GLY A HA2  1 
ATOM 493  H HA3  . GLY A 1 33  ? -15.268 -21.628 5.952   1.00 54.72 ? 33  GLY A HA3  1 
ATOM 494  N N    . SER A 1 34  ? -12.956 -21.192 6.773   1.00 49.77 ? 34  SER A N    1 
ATOM 495  C CA   . SER A 1 34  ? -11.692 -20.947 7.458   1.00 51.45 ? 34  SER A CA   1 
ATOM 496  C C    . SER A 1 34  ? -11.386 -19.453 7.573   1.00 51.46 ? 34  SER A C    1 
ATOM 497  O O    . SER A 1 34  ? -11.928 -18.637 6.825   1.00 50.34 ? 34  SER A O    1 
ATOM 498  C CB   . SER A 1 34  ? -10.549 -21.661 6.727   1.00 52.67 ? 34  SER A CB   1 
ATOM 499  O OG   . SER A 1 34  ? -10.622 -21.458 5.326   1.00 52.17 ? 34  SER A OG   1 
ATOM 500  H H    . SER A 1 34  ? -13.247 -20.514 6.331   1.00 54.72 ? 34  SER A H    1 
ATOM 501  H HA   . SER A 1 34  ? -11.746 -21.311 8.355   1.00 54.72 ? 34  SER A HA   1 
ATOM 502  H HB2  . SER A 1 34  ? -9.703  -21.313 7.050   1.00 54.72 ? 34  SER A HB2  1 
ATOM 503  H HB3  . SER A 1 34  ? -10.605 -22.612 6.909   1.00 54.72 ? 34  SER A HB3  1 
ATOM 504  H HG   . SER A 1 34  ? -9.988  -21.856 4.945   1.00 54.72 ? 34  SER A HG   1 
ATOM 505  N N    . ALA A 1 35  ? -10.518 -19.113 8.523   1.00 51.96 ? 35  ALA A N    1 
ATOM 506  C CA   . ALA A 1 35  ? -10.041 -17.743 8.716   1.00 52.79 ? 35  ALA A CA   1 
ATOM 507  C C    . ALA A 1 35  ? -8.542  -17.755 9.016   1.00 55.59 ? 35  ALA A C    1 
ATOM 508  O O    . ALA A 1 35  ? -8.060  -18.622 9.747   1.00 56.75 ? 35  ALA A O    1 
ATOM 509  C CB   . ALA A 1 35  ? -10.804 -17.057 9.841   1.00 52.77 ? 35  ALA A CB   1 
ATOM 510  H H    . ALA A 1 35  ? -10.182 -19.672 9.083   1.00 54.72 ? 35  ALA A H    1 
ATOM 511  H HA   . ALA A 1 35  ? -10.183 -17.237 7.900   1.00 54.72 ? 35  ALA A HA   1 
ATOM 512  H HB1  . ALA A 1 35  ? -10.467 -16.153 9.945   1.00 54.72 ? 35  ALA A HB1  1 
ATOM 513  H HB2  . ALA A 1 35  ? -11.747 -17.035 9.614   1.00 54.72 ? 35  ALA A HB2  1 
ATOM 514  H HB3  . ALA A 1 35  ? -10.672 -17.556 10.662  1.00 54.72 ? 35  ALA A HB3  1 
ATOM 515  N N    . LYS A 1 36  ? -7.820  -16.782 8.462   1.00 53.55 ? 36  LYS A N    1 
ATOM 516  C CA   . LYS A 1 36  ? -6.358  -16.776 8.493   1.00 56.75 ? 36  LYS A CA   1 
ATOM 517  C C    . LYS A 1 36  ? -5.775  -15.558 9.201   1.00 58.90 ? 36  LYS A C    1 
ATOM 518  O O    . LYS A 1 36  ? -6.372  -14.481 9.209   1.00 58.14 ? 36  LYS A O    1 
ATOM 519  C CB   . LYS A 1 36  ? -5.810  -16.836 7.065   1.00 57.69 ? 36  LYS A CB   1 
ATOM 520  C CG   . LYS A 1 36  ? -6.479  -17.895 6.211   1.00 55.70 ? 36  LYS A CG   1 
ATOM 521  C CD   . LYS A 1 36  ? -5.634  -18.288 5.011   1.00 57.59 ? 36  LYS A CD   1 
ATOM 522  C CE   . LYS A 1 36  ? -6.149  -19.572 4.375   1.00 56.27 ? 36  LYS A CE   1 
ATOM 523  N NZ   . LYS A 1 36  ? -5.283  -20.021 3.252   1.00 58.53 ? 36  LYS A NZ   1 
ATOM 524  H H    . LYS A 1 36  ? -8.159  -16.104 8.056   1.00 54.72 ? 36  LYS A H    1 
ATOM 525  H HA   . LYS A 1 36  ? -6.051  -17.568 8.962   1.00 54.72 ? 36  LYS A HA   1 
ATOM 526  H HB2  . LYS A 1 36  ? -5.950  -15.976 6.639   1.00 54.72 ? 36  LYS A HB2  1 
ATOM 527  H HB3  . LYS A 1 36  ? -4.861  -17.036 7.101   1.00 54.72 ? 36  LYS A HB3  1 
ATOM 528  H HG2  . LYS A 1 36  ? -6.627  -18.689 6.748   1.00 54.72 ? 36  LYS A HG2  1 
ATOM 529  H HG3  . LYS A 1 36  ? -7.325  -17.551 5.884   1.00 54.72 ? 36  LYS A HG3  1 
ATOM 530  H HD2  . LYS A 1 36  ? -5.671  -17.582 4.346   1.00 54.72 ? 36  LYS A HD2  1 
ATOM 531  H HD3  . LYS A 1 36  ? -4.719  -18.434 5.296   1.00 54.72 ? 36  LYS A HD3  1 
ATOM 532  H HE2  . LYS A 1 36  ? -6.165  -20.275 5.044   1.00 54.72 ? 36  LYS A HE2  1 
ATOM 533  H HE3  . LYS A 1 36  ? -7.042  -19.420 4.028   1.00 54.72 ? 36  LYS A HE3  1 
ATOM 534  H HZ1  . LYS A 1 36  ? -5.606  -20.772 2.900   1.00 54.72 ? 36  LYS A HZ1  1 
ATOM 535  H HZ2  . LYS A 1 36  ? -5.255  -19.394 2.620   1.00 54.72 ? 36  LYS A HZ2  1 
ATOM 536  H HZ3  . LYS A 1 36  ? -4.457  -20.172 3.546   1.00 54.72 ? 36  LYS A HZ3  1 
ATOM 537  N N    . GLY A 1 37  ? -4.598  -15.751 9.791   1.00 61.95 ? 37  GLY A N    1 
ATOM 538  C CA   . GLY A 1 37  ? -3.821  -14.669 10.371  1.00 64.93 ? 37  GLY A CA   1 
ATOM 539  C C    . GLY A 1 37  ? -4.049  -14.487 11.859  1.00 65.15 ? 37  GLY A C    1 
ATOM 540  O O    . GLY A 1 37  ? -4.174  -13.360 12.334  1.00 66.00 ? 37  GLY A O    1 
ATOM 541  H H    . GLY A 1 37  ? -4.222  -16.521 9.867   1.00 54.72 ? 37  GLY A H    1 
ATOM 542  H HA2  . GLY A 1 37  ? -2.877  -14.842 10.227  1.00 54.72 ? 37  GLY A HA2  1 
ATOM 543  H HA3  . GLY A 1 37  ? -4.049  -13.838 9.925   1.00 54.72 ? 37  GLY A HA3  1 
ATOM 544  N N    . LEU A 1 38  ? -4.072  -15.597 12.592  1.00 64.77 ? 38  LEU A N    1 
ATOM 545  C CA   . LEU A 1 38  ? -4.405  -15.585 14.014  1.00 64.90 ? 38  LEU A CA   1 
ATOM 546  C C    . LEU A 1 38  ? -3.198  -15.886 14.908  1.00 68.55 ? 38  LEU A C    1 
ATOM 547  O O    . LEU A 1 38  ? -2.077  -16.038 14.422  1.00 71.19 ? 38  LEU A O    1 
ATOM 548  C CB   . LEU A 1 38  ? -5.524  -16.596 14.277  1.00 63.34 ? 38  LEU A CB   1 
ATOM 549  C CG   . LEU A 1 38  ? -6.846  -16.239 13.590  1.00 60.03 ? 38  LEU A CG   1 
ATOM 550  C CD1  . LEU A 1 38  ? -7.727  -17.459 13.410  1.00 57.76 ? 38  LEU A CD1  1 
ATOM 551  C CD2  . LEU A 1 38  ? -7.584  -15.177 14.386  1.00 59.65 ? 38  LEU A CD2  1 
ATOM 552  H H    . LEU A 1 38  ? -3.896  -16.381 12.285  1.00 54.72 ? 38  LEU A H    1 
ATOM 553  H HA   . LEU A 1 38  ? -4.738  -14.704 14.250  1.00 54.72 ? 38  LEU A HA   1 
ATOM 554  H HB2  . LEU A 1 38  ? -5.245  -17.465 13.950  1.00 54.72 ? 38  LEU A HB2  1 
ATOM 555  H HB3  . LEU A 1 38  ? -5.689  -16.640 15.232  1.00 54.72 ? 38  LEU A HB3  1 
ATOM 556  H HG   . LEU A 1 38  ? -6.655  -15.875 12.711  1.00 54.72 ? 38  LEU A HG   1 
ATOM 557  H HD11 . LEU A 1 38  ? -8.551  -17.192 12.973  1.00 54.72 ? 38  LEU A HD11 1 
ATOM 558  H HD12 . LEU A 1 38  ? -7.259  -18.109 12.863  1.00 54.72 ? 38  LEU A HD12 1 
ATOM 559  H HD13 . LEU A 1 38  ? -7.923  -17.839 14.281  1.00 54.72 ? 38  LEU A HD13 1 
ATOM 560  H HD21 . LEU A 1 38  ? -8.416  -14.966 13.935  1.00 54.72 ? 38  LEU A HD21 1 
ATOM 561  H HD22 . LEU A 1 38  ? -7.767  -15.520 15.275  1.00 54.72 ? 38  LEU A HD22 1 
ATOM 562  H HD23 . LEU A 1 38  ? -7.028  -14.384 14.445  1.00 54.72 ? 38  LEU A HD23 1 
ATOM 563  N N    . THR A 1 39  ? -3.439  -15.930 16.218  1.00 69.03 ? 39  THR A N    1 
ATOM 564  C CA   . THR A 1 39  ? -2.451  -16.404 17.184  1.00 72.34 ? 39  THR A CA   1 
ATOM 565  C C    . THR A 1 39  ? -2.809  -17.828 17.596  1.00 71.26 ? 39  THR A C    1 
ATOM 566  O O    . THR A 1 39  ? -3.904  -18.303 17.293  1.00 68.09 ? 39  THR A O    1 
ATOM 567  C CB   . THR A 1 39  ? -2.385  -15.505 18.435  1.00 74.34 ? 39  THR A CB   1 
ATOM 568  O OG1  . THR A 1 39  ? -3.710  -15.253 18.921  1.00 71.58 ? 39  THR A OG1  1 
ATOM 569  C CG2  . THR A 1 39  ? -1.704  -14.183 18.109  1.00 76.86 ? 39  THR A CG2  1 
ATOM 570  H H    . THR A 1 39  ? -4.182  -15.687 16.577  1.00 54.72 ? 39  THR A H    1 
ATOM 571  H HA   . THR A 1 39  ? -1.574  -16.416 16.769  1.00 54.72 ? 39  THR A HA   1 
ATOM 572  H HB   . THR A 1 39  ? -1.869  -15.952 19.125  1.00 54.72 ? 39  THR A HB   1 
ATOM 573  H HG1  . THR A 1 39  ? -3.677  -14.763 19.602  1.00 54.72 ? 39  THR A HG1  1 
ATOM 574  H HG21 . THR A 1 39  ? -1.667  -13.626 18.902  1.00 54.72 ? 39  THR A HG21 1 
ATOM 575  H HG22 . THR A 1 39  ? -0.800  -14.345 17.795  1.00 54.72 ? 39  THR A HG22 1 
ATOM 576  H HG23 . THR A 1 39  ? -2.199  -13.717 17.418  1.00 54.72 ? 39  THR A HG23 1 
ATOM 577  N N    . GLU A 1 40  ? -1.899  -18.508 18.287  1.00 74.24 ? 40  GLU A N    1 
ATOM 578  C CA   . GLU A 1 40  ? -2.153  -19.879 18.711  1.00 73.90 ? 40  GLU A CA   1 
ATOM 579  C C    . GLU A 1 40  ? -3.086  -19.906 19.915  1.00 73.02 ? 40  GLU A C    1 
ATOM 580  O O    . GLU A 1 40  ? -2.900  -19.146 20.866  1.00 74.74 ? 40  GLU A O    1 
ATOM 581  C CB   . GLU A 1 40  ? -0.847  -20.595 19.050  1.00 77.82 ? 40  GLU A CB   1 
ATOM 582  C CG   . GLU A 1 40  ? -1.033  -22.065 19.377  1.00 77.94 ? 40  GLU A CG   1 
ATOM 583  C CD   . GLU A 1 40  ? 0.266   -22.748 19.750  1.00 82.21 ? 40  GLU A CD   1 
ATOM 584  O OE1  . GLU A 1 40  ? 1.191   -22.053 20.221  1.00 85.32 ? 40  GLU A OE1  1 
ATOM 585  O OE2  . GLU A 1 40  ? 0.364   -23.980 19.570  1.00 82.79 ? 40  GLU A OE2  1 
ATOM 586  H H    . GLU A 1 40  ? -1.131  -18.199 18.522  1.00 54.72 ? 40  GLU A H    1 
ATOM 587  H HA   . GLU A 1 40  ? -2.582  -20.361 17.986  1.00 54.72 ? 40  GLU A HA   1 
ATOM 588  H HB2  . GLU A 1 40  ? -0.248  -20.533 18.289  1.00 54.72 ? 40  GLU A HB2  1 
ATOM 589  H HB3  . GLU A 1 40  ? -0.445  -20.166 19.822  1.00 54.72 ? 40  GLU A HB3  1 
ATOM 590  H HG2  . GLU A 1 40  ? -1.642  -22.148 20.128  1.00 54.72 ? 40  GLU A HG2  1 
ATOM 591  H HG3  . GLU A 1 40  ? -1.398  -22.519 18.602  1.00 54.72 ? 40  GLU A HG3  1 
ATOM 592  N N    . GLY A 1 41  ? -4.087  -20.782 19.866  1.00 70.72 ? 41  GLY A N    1 
ATOM 593  C CA   . GLY A 1 41  ? -5.020  -20.949 20.967  1.00 70.27 ? 41  GLY A CA   1 
ATOM 594  C C    . GLY A 1 41  ? -6.458  -21.031 20.496  1.00 66.84 ? 41  GLY A C    1 
ATOM 595  O O    . GLY A 1 41  ? -6.722  -21.212 19.306  1.00 64.78 ? 41  GLY A O    1 
ATOM 596  H H    . GLY A 1 41  ? -4.245  -21.297 19.195  1.00 54.72 ? 41  GLY A H    1 
ATOM 597  H HA2  . GLY A 1 41  ? -4.808  -21.763 21.450  1.00 54.72 ? 41  GLY A HA2  1 
ATOM 598  H HA3  . GLY A 1 41  ? -4.938  -20.200 21.576  1.00 54.72 ? 41  GLY A HA3  1 
ATOM 599  N N    . LEU A 1 42  ? -7.385  -20.892 21.438  1.00 66.58 ? 42  LEU A N    1 
ATOM 600  C CA   . LEU A 1 42  ? -8.811  -20.942 21.140  1.00 63.93 ? 42  LEU A CA   1 
ATOM 601  C C    . LEU A 1 42  ? -9.379  -19.533 21.055  1.00 62.58 ? 42  LEU A C    1 
ATOM 602  O O    . LEU A 1 42  ? -8.945  -18.638 21.778  1.00 64.22 ? 42  LEU A O    1 
ATOM 603  C CB   . LEU A 1 42  ? -9.556  -21.742 22.208  1.00 65.01 ? 42  LEU A CB   1 
ATOM 604  C CG   . LEU A 1 42  ? -8.999  -23.133 22.518  1.00 67.11 ? 42  LEU A CG   1 
ATOM 605  C CD1  . LEU A 1 42  ? -9.837  -23.813 23.594  1.00 68.52 ? 42  LEU A CD1  1 
ATOM 606  C CD2  . LEU A 1 42  ? -8.920  -24.001 21.266  1.00 65.83 ? 42  LEU A CD2  1 
ATOM 607  H H    . LEU A 1 42  ? -7.210  -20.766 22.271  1.00 54.72 ? 42  LEU A H    1 
ATOM 608  H HA   . LEU A 1 42  ? -8.945  -21.377 20.284  1.00 54.72 ? 42  LEU A HA   1 
ATOM 609  H HB2  . LEU A 1 42  ? -9.541  -21.234 23.034  1.00 54.72 ? 42  LEU A HB2  1 
ATOM 610  H HB3  . LEU A 1 42  ? -10.474 -21.856 21.917  1.00 54.72 ? 42  LEU A HB3  1 
ATOM 611  H HG   . LEU A 1 42  ? -8.098  -23.036 22.865  1.00 54.72 ? 42  LEU A HG   1 
ATOM 612  H HD11 . LEU A 1 42  ? -9.466  -24.692 23.774  1.00 54.72 ? 42  LEU A HD11 1 
ATOM 613  H HD12 . LEU A 1 42  ? -9.814  -23.273 24.399  1.00 54.72 ? 42  LEU A HD12 1 
ATOM 614  H HD13 . LEU A 1 42  ? -10.750 -23.898 23.277  1.00 54.72 ? 42  LEU A HD13 1 
ATOM 615  H HD21 . LEU A 1 42  ? -8.563  -24.870 21.506  1.00 54.72 ? 42  LEU A HD21 1 
ATOM 616  H HD22 . LEU A 1 42  ? -9.810  -24.099 20.893  1.00 54.72 ? 42  LEU A HD22 1 
ATOM 617  H HD23 . LEU A 1 42  ? -8.336  -23.571 20.621  1.00 54.72 ? 42  LEU A HD23 1 
ATOM 618  N N    . HIS A 1 43  ? -10.357 -19.348 20.174  1.00 62.21 ? 43  HIS A N    1 
ATOM 619  C CA   . HIS A 1 43  ? -10.967 -18.042 19.960  1.00 60.98 ? 43  HIS A CA   1 
ATOM 620  C C    . HIS A 1 43  ? -12.490 -18.138 19.980  1.00 59.36 ? 43  HIS A C    1 
ATOM 621  O O    . HIS A 1 43  ? -13.069 -19.096 19.466  1.00 58.23 ? 43  HIS A O    1 
ATOM 622  C CB   . HIS A 1 43  ? -10.496 -17.454 18.630  1.00 60.54 ? 43  HIS A CB   1 
ATOM 623  C CG   . HIS A 1 43  ? -9.015  -17.237 18.554  1.00 62.64 ? 43  HIS A CG   1 
ATOM 624  N ND1  . HIS A 1 43  ? -8.432  -16.005 18.758  1.00 64.18 ? 43  HIS A ND1  1 
ATOM 625  C CD2  . HIS A 1 43  ? -8.002  -18.095 18.292  1.00 63.90 ? 43  HIS A CD2  1 
ATOM 626  C CE1  . HIS A 1 43  ? -7.122  -16.115 18.626  1.00 66.36 ? 43  HIS A CE1  1 
ATOM 627  N NE2  . HIS A 1 43  ? -6.834  -17.372 18.343  1.00 66.20 ? 43  HIS A NE2  1 
ATOM 628  H H    . HIS A 1 43  ? -10.688 -19.971 19.683  1.00 54.72 ? 43  HIS A H    1 
ATOM 629  H HA   . HIS A 1 43  ? -10.692 -17.442 20.670  1.00 54.72 ? 43  HIS A HA   1 
ATOM 630  H HB2  . HIS A 1 43  ? -10.743 -18.061 17.914  1.00 54.72 ? 43  HIS A HB2  1 
ATOM 631  H HB3  . HIS A 1 43  ? -10.928 -16.596 18.497  1.00 54.72 ? 43  HIS A HB3  1 
ATOM 632  H HD1  . HIS A 1 43  ? -8.854  -15.279 18.942  1.00 54.72 ? 43  HIS A HD1  1 
ATOM 633  H HD2  . HIS A 1 43  ? -8.081  -19.004 18.111  1.00 54.72 ? 43  HIS A HD2  1 
ATOM 634  H HE1  . HIS A 1 43  ? -6.506  -15.423 18.717  1.00 54.72 ? 43  HIS A HE1  1 
ATOM 635  N N    . GLY A 1 44  ? -13.133 -17.139 20.578  1.00 60.13 ? 44  GLY A N    1 
ATOM 636  C CA   . GLY A 1 44  ? -14.582 -17.097 20.648  1.00 59.14 ? 44  GLY A CA   1 
ATOM 637  C C    . GLY A 1 44  ? -15.181 -16.858 19.277  1.00 56.61 ? 44  GLY A C    1 
ATOM 638  O O    . GLY A 1 44  ? -14.971 -15.807 18.680  1.00 55.93 ? 44  GLY A O    1 
ATOM 639  H H    . GLY A 1 44  ? -12.745 -16.469 20.954  1.00 54.72 ? 44  GLY A H    1 
ATOM 640  H HA2  . GLY A 1 44  ? -14.919 -17.939 20.993  1.00 54.72 ? 44  GLY A HA2  1 
ATOM 641  H HA3  . GLY A 1 44  ? -14.862 -16.382 21.240  1.00 54.72 ? 44  GLY A HA3  1 
ATOM 642  N N    . PHE A 1 45  ? -15.930 -17.842 18.788  1.00 57.85 ? 45  PHE A N    1 
ATOM 643  C CA   . PHE A 1 45  ? -16.488 -17.820 17.440  1.00 55.66 ? 45  PHE A CA   1 
ATOM 644  C C    . PHE A 1 45  ? -18.010 -17.900 17.502  1.00 55.35 ? 45  PHE A C    1 
ATOM 645  O O    . PHE A 1 45  ? -18.566 -18.966 17.764  1.00 56.04 ? 45  PHE A O    1 
ATOM 646  C CB   . PHE A 1 45  ? -15.911 -18.985 16.629  1.00 56.95 ? 45  PHE A CB   1 
ATOM 647  C CG   . PHE A 1 45  ? -16.281 -18.969 15.174  1.00 54.96 ? 45  PHE A CG   1 
ATOM 648  C CD1  . PHE A 1 45  ? -15.848 -17.947 14.345  1.00 53.99 ? 45  PHE A CD1  1 
ATOM 649  C CD2  . PHE A 1 45  ? -17.035 -19.994 14.628  1.00 54.46 ? 45  PHE A CD2  1 
ATOM 650  C CE1  . PHE A 1 45  ? -16.179 -17.939 13.002  1.00 52.42 ? 45  PHE A CE1  1 
ATOM 651  C CE2  . PHE A 1 45  ? -17.364 -19.993 13.287  1.00 52.88 ? 45  PHE A CE2  1 
ATOM 652  C CZ   . PHE A 1 45  ? -16.936 -18.965 12.473  1.00 51.79 ? 45  PHE A CZ   1 
ATOM 653  H H    . PHE A 1 45  ? -16.133 -18.551 19.230  1.00 54.72 ? 45  PHE A H    1 
ATOM 654  H HA   . PHE A 1 45  ? -16.243 -16.990 17.002  1.00 54.72 ? 45  PHE A HA   1 
ATOM 655  H HB2  . PHE A 1 45  ? -14.944 -18.955 16.688  1.00 54.72 ? 45  PHE A HB2  1 
ATOM 656  H HB3  . PHE A 1 45  ? -16.237 -19.817 17.006  1.00 54.72 ? 45  PHE A HB3  1 
ATOM 657  H HD1  . PHE A 1 45  ? -15.338 -17.254 14.697  1.00 54.72 ? 45  PHE A HD1  1 
ATOM 658  H HD2  . PHE A 1 45  ? -17.326 -20.690 15.172  1.00 54.72 ? 45  PHE A HD2  1 
ATOM 659  H HE1  . PHE A 1 45  ? -15.888 -17.245 12.455  1.00 54.72 ? 45  PHE A HE1  1 
ATOM 660  H HE2  . PHE A 1 45  ? -17.877 -20.684 12.933  1.00 54.72 ? 45  PHE A HE2  1 
ATOM 661  H HZ   . PHE A 1 45  ? -17.160 -18.961 11.570  1.00 54.72 ? 45  PHE A HZ   1 
ATOM 662  N N    . HIS A 1 46  ? -18.683 -16.775 17.269  1.00 54.54 ? 46  HIS A N    1 
ATOM 663  C CA   . HIS A 1 46  ? -20.137 -16.729 17.402  1.00 54.78 ? 46  HIS A CA   1 
ATOM 664  C C    . HIS A 1 46  ? -20.809 -15.576 16.655  1.00 53.74 ? 46  HIS A C    1 
ATOM 665  O O    . HIS A 1 46  ? -20.186 -14.560 16.341  1.00 53.30 ? 46  HIS A O    1 
ATOM 666  C CB   . HIS A 1 46  ? -20.520 -16.661 18.883  1.00 54.81 ? 46  HIS A CB   1 
ATOM 667  C CG   . HIS A 1 46  ? -19.488 -16.017 19.756  1.00 56.01 ? 46  HIS A CG   1 
ATOM 668  N ND1  . HIS A 1 46  ? -19.065 -16.588 20.937  1.00 58.05 ? 46  HIS A ND1  1 
ATOM 669  C CD2  . HIS A 1 46  ? -18.798 -14.859 19.630  1.00 55.87 ? 46  HIS A CD2  1 
ATOM 670  C CE1  . HIS A 1 46  ? -18.156 -15.813 21.499  1.00 59.04 ? 46  HIS A CE1  1 
ATOM 671  N NE2  . HIS A 1 46  ? -17.975 -14.757 20.726  1.00 57.82 ? 46  HIS A NE2  1 
ATOM 672  H H    . HIS A 1 46  ? -18.324 -16.030 17.034  1.00 54.72 ? 46  HIS A H    1 
ATOM 673  H HA   . HIS A 1 46  ? -20.501 -17.555 17.046  1.00 54.72 ? 46  HIS A HA   1 
ATOM 674  H HB2  . HIS A 1 46  ? -21.340 -16.149 18.969  1.00 54.72 ? 46  HIS A HB2  1 
ATOM 675  H HB3  . HIS A 1 46  ? -20.662 -17.563 19.210  1.00 54.72 ? 46  HIS A HB3  1 
ATOM 676  H HD2  . HIS A 1 46  ? -18.865 -14.249 18.931  1.00 54.72 ? 46  HIS A HD2  1 
ATOM 677  H HE1  . HIS A 1 46  ? -17.719 -15.981 22.302  1.00 54.72 ? 46  HIS A HE1  1 
ATOM 678  H HE2  . HIS A 1 46  ? -17.432 -14.109 20.884  1.00 54.72 ? 46  HIS A HE2  1 
ATOM 679  N N    . VAL A 1 47  ? -22.097 -15.770 16.381  1.00 52.04 ? 47  VAL A N    1 
ATOM 680  C CA   . VAL A 1 47  ? -22.935 -14.786 15.708  1.00 51.46 ? 47  VAL A CA   1 
ATOM 681  C C    . VAL A 1 47  ? -23.469 -13.777 16.722  1.00 53.31 ? 47  VAL A C    1 
ATOM 682  O O    . VAL A 1 47  ? -23.811 -14.143 17.848  1.00 55.21 ? 47  VAL A O    1 
ATOM 683  C CB   . VAL A 1 47  ? -24.117 -15.471 14.982  1.00 52.86 ? 47  VAL A CB   1 
ATOM 684  C CG1  . VAL A 1 47  ? -24.977 -14.455 14.251  1.00 52.49 ? 47  VAL A CG1  1 
ATOM 685  C CG2  . VAL A 1 47  ? -23.615 -16.538 14.017  1.00 51.44 ? 47  VAL A CG2  1 
ATOM 686  H H    . VAL A 1 47  ? -22.520 -16.491 16.584  1.00 54.72 ? 47  VAL A H    1 
ATOM 687  H HA   . VAL A 1 47  ? -22.407 -14.309 15.049  1.00 54.72 ? 47  VAL A HA   1 
ATOM 688  H HB   . VAL A 1 47  ? -24.676 -15.909 15.643  1.00 54.72 ? 47  VAL A HB   1 
ATOM 689  H HG11 . VAL A 1 47  ? -25.706 -14.918 13.809  1.00 54.72 ? 47  VAL A HG11 1 
ATOM 690  H HG12 . VAL A 1 47  ? -25.329 -13.819 14.893  1.00 54.72 ? 47  VAL A HG12 1 
ATOM 691  H HG13 . VAL A 1 47  ? -24.431 -13.994 13.595  1.00 54.72 ? 47  VAL A HG13 1 
ATOM 692  H HG21 . VAL A 1 47  ? -24.376 -16.949 13.578  1.00 54.72 ? 47  VAL A HG21 1 
ATOM 693  H HG22 . VAL A 1 47  ? -23.038 -16.121 13.358  1.00 54.72 ? 47  VAL A HG22 1 
ATOM 694  H HG23 . VAL A 1 47  ? -23.120 -17.206 14.516  1.00 54.72 ? 47  VAL A HG23 1 
ATOM 695  N N    . HIS A 1 48  ? -23.547 -12.511 16.319  1.00 52.23 ? 48  HIS A N    1 
ATOM 696  C CA   . HIS A 1 48  ? -23.961 -11.444 17.227  1.00 54.25 ? 48  HIS A CA   1 
ATOM 697  C C    . HIS A 1 48  ? -25.481 -11.346 17.305  1.00 55.50 ? 48  HIS A C    1 
ATOM 698  O O    . HIS A 1 48  ? -26.179 -11.507 16.302  1.00 54.50 ? 48  HIS A O    1 
ATOM 699  C CB   . HIS A 1 48  ? -23.368 -10.102 16.788  1.00 51.79 ? 48  HIS A CB   1 
ATOM 700  C CG   . HIS A 1 48  ? -23.643 -8.978  17.740  1.00 54.22 ? 48  HIS A CG   1 
ATOM 701  N ND1  . HIS A 1 48  ? -23.265 -9.015  19.065  1.00 56.16 ? 48  HIS A ND1  1 
ATOM 702  C CD2  . HIS A 1 48  ? -24.252 -7.782  17.557  1.00 55.33 ? 48  HIS A CD2  1 
ATOM 703  C CE1  . HIS A 1 48  ? -23.634 -7.893  19.658  1.00 58.36 ? 48  HIS A CE1  1 
ATOM 704  N NE2  . HIS A 1 48  ? -24.234 -7.128  18.765  1.00 57.94 ? 48  HIS A NE2  1 
ATOM 705  H H    . HIS A 1 48  ? -23.366 -12.243 15.522  1.00 54.72 ? 48  HIS A H    1 
ATOM 706  H HA   . HIS A 1 48  ? -23.628 -11.641 18.117  1.00 54.72 ? 48  HIS A HA   1 
ATOM 707  H HB2  . HIS A 1 48  ? -22.406 -10.195 16.710  1.00 54.72 ? 48  HIS A HB2  1 
ATOM 708  H HB3  . HIS A 1 48  ? -23.746 -9.860  15.928  1.00 54.72 ? 48  HIS A HB3  1 
ATOM 709  H HD2  . HIS A 1 48  ? -24.616 -7.464  16.762  1.00 54.72 ? 48  HIS A HD2  1 
ATOM 710  H HE1  . HIS A 1 48  ? -23.493 -7.678  20.552  1.00 54.72 ? 48  HIS A HE1  1 
ATOM 711  H HE2  . HIS A 1 48  ? -24.561 -6.346  18.915  1.00 54.72 ? 48  HIS A HE2  1 
ATOM 712  N N    . GLY A 1 49  ? -25.977 -11.077 18.509  1.00 55.75 ? 49  GLY A N    1 
ATOM 713  C CA   . GLY A 1 49  ? -27.403 -11.021 18.774  1.00 57.73 ? 49  GLY A CA   1 
ATOM 714  C C    . GLY A 1 49  ? -27.851 -12.265 19.518  1.00 59.23 ? 49  GLY A C    1 
ATOM 715  O O    . GLY A 1 49  ? -27.035 -13.139 19.813  1.00 58.60 ? 49  GLY A O    1 
ATOM 716  H H    . GLY A 1 49  ? -25.492 -10.921 19.203  1.00 54.72 ? 49  GLY A H    1 
ATOM 717  H HA2  . GLY A 1 49  ? -27.608 -10.241 19.314  1.00 54.72 ? 49  GLY A HA2  1 
ATOM 718  H HA3  . GLY A 1 49  ? -27.891 -10.962 17.938  1.00 54.72 ? 49  GLY A HA3  1 
ATOM 719  N N    . ALA A 1 50  ? -29.143 -12.350 19.822  1.00 61.61 ? 50  ALA A N    1 
ATOM 720  C CA   . ALA A 1 50  ? -29.678 -13.481 20.573  1.00 63.84 ? 50  ALA A CA   1 
ATOM 721  C C    . ALA A 1 50  ? -29.743 -14.751 19.726  1.00 62.43 ? 50  ALA A C    1 
ATOM 722  O O    . ALA A 1 50  ? -30.351 -14.766 18.656  1.00 61.47 ? 50  ALA A O    1 
ATOM 723  C CB   . ALA A 1 50  ? -31.062 -13.147 21.119  1.00 67.41 ? 50  ALA A CB   1 
ATOM 724  H H    . ALA A 1 50  ? -29.732 -11.763 19.604  1.00 54.72 ? 50  ALA A H    1 
ATOM 725  H HA   . ALA A 1 50  ? -29.096 -13.658 21.329  1.00 54.72 ? 50  ALA A HA   1 
ATOM 726  H HB1  . ALA A 1 50  ? -31.399 -13.910 21.613  1.00 54.72 ? 50  ALA A HB1  1 
ATOM 727  H HB2  . ALA A 1 50  ? -30.993 -12.377 21.704  1.00 54.72 ? 50  ALA A HB2  1 
ATOM 728  H HB3  . ALA A 1 50  ? -31.654 -12.946 20.376  1.00 54.72 ? 50  ALA A HB3  1 
ATOM 729  N N    . GLY A 1 51  ? -29.110 -15.815 20.212  1.00 62.60 ? 51  GLY A N    1 
ATOM 730  C CA   . GLY A 1 51  ? -29.200 -17.116 19.574  1.00 62.06 ? 51  GLY A CA   1 
ATOM 731  C C    . GLY A 1 51  ? -28.299 -17.227 18.359  1.00 58.44 ? 51  GLY A C    1 
ATOM 732  O O    . GLY A 1 51  ? -28.767 -17.142 17.222  1.00 57.15 ? 51  GLY A O    1 
ATOM 733  H H    . GLY A 1 51  ? -28.618 -15.805 20.917  1.00 54.72 ? 51  GLY A H    1 
ATOM 734  H HA2  . GLY A 1 51  ? -28.948 -17.805 20.208  1.00 54.72 ? 51  GLY A HA2  1 
ATOM 735  H HA3  . GLY A 1 51  ? -30.115 -17.276 19.294  1.00 54.72 ? 51  GLY A HA3  1 
ATOM 736  N N    . GLY A 1 52  ? -27.003 -17.411 18.600  1.00 60.64 ? 52  GLY A N    1 
ATOM 737  C CA   . GLY A 1 52  ? -26.042 -17.557 17.520  1.00 57.69 ? 52  GLY A CA   1 
ATOM 738  C C    . GLY A 1 52  ? -24.633 -17.937 17.960  1.00 57.13 ? 52  GLY A C    1 
ATOM 739  O O    . GLY A 1 52  ? -23.670 -17.678 17.236  1.00 55.05 ? 52  GLY A O    1 
ATOM 740  H H    . GLY A 1 52  ? -26.657 -17.454 19.386  1.00 54.72 ? 52  GLY A H    1 
ATOM 741  H HA2  . GLY A 1 52  ? -26.358 -18.240 16.908  1.00 54.72 ? 52  GLY A HA2  1 
ATOM 742  H HA3  . GLY A 1 52  ? -25.987 -16.720 17.033  1.00 54.72 ? 52  GLY A HA3  1 
ATOM 743  N N    . ASP A 1 53  ? -24.507 -18.554 19.135  1.00 59.65 ? 53  ASP A N    1 
ATOM 744  C CA   . ASP A 1 53  ? -23.202 -18.956 19.672  1.00 59.69 ? 53  ASP A CA   1 
ATOM 745  C C    . ASP A 1 53  ? -22.760 -20.266 19.041  1.00 59.12 ? 53  ASP A C    1 
ATOM 746  O O    . ASP A 1 53  ? -23.534 -21.221 18.965  1.00 60.41 ? 53  ASP A O    1 
ATOM 747  C CB   . ASP A 1 53  ? -23.255 -19.102 21.199  1.00 59.44 ? 53  ASP A CB   1 
ATOM 748  C CG   . ASP A 1 53  ? -21.882 -18.989 21.857  1.00 59.65 ? 53  ASP A CG   1 
ATOM 749  O OD1  . ASP A 1 53  ? -20.875 -19.413 21.250  1.00 58.18 ? 53  ASP A OD1  1 
ATOM 750  O OD2  . ASP A 1 53  ? -21.816 -18.480 22.997  1.00 61.61 ? 53  ASP A OD2  1 
ATOM 751  H H    . ASP A 1 53  ? -25.168 -18.754 19.647  1.00 54.72 ? 53  ASP A H    1 
ATOM 752  H HA   . ASP A 1 53  ? -22.544 -18.277 19.455  1.00 54.72 ? 53  ASP A HA   1 
ATOM 753  H HB2  . ASP A 1 53  ? -23.820 -18.403 21.563  1.00 54.72 ? 53  ASP A HB2  1 
ATOM 754  H HB3  . ASP A 1 53  ? -23.621 -19.973 21.419  1.00 54.72 ? 53  ASP A HB3  1 
ATOM 755  N N    . LEU A 1 54  ? -21.507 -20.303 18.601  1.00 61.07 ? 54  LEU A N    1 
ATOM 756  C CA   . LEU A 1 54  ? -20.989 -21.437 17.850  1.00 60.49 ? 54  LEU A CA   1 
ATOM 757  C C    . LEU A 1 54  ? -19.711 -21.979 18.480  1.00 61.47 ? 54  LEU A C    1 
ATOM 758  O O    . LEU A 1 54  ? -18.861 -22.544 17.790  1.00 60.73 ? 54  LEU A O    1 
ATOM 759  C CB   . LEU A 1 54  ? -20.735 -21.026 16.397  1.00 61.95 ? 54  LEU A CB   1 
ATOM 760  C CG   . LEU A 1 54  ? -21.964 -20.510 15.643  1.00 61.06 ? 54  LEU A CG   1 
ATOM 761  C CD1  . LEU A 1 54  ? -21.554 -19.616 14.478  1.00 58.73 ? 54  LEU A CD1  1 
ATOM 762  C CD2  . LEU A 1 54  ? -22.801 -21.685 15.169  1.00 61.90 ? 54  LEU A CD2  1 
ATOM 763  H H    . LEU A 1 54  ? -20.931 -19.677 18.726  1.00 54.72 ? 54  LEU A H    1 
ATOM 764  H HA   . LEU A 1 54  ? -21.650 -22.147 17.851  1.00 54.72 ? 54  LEU A HA   1 
ATOM 765  H HB2  . LEU A 1 54  ? -20.069 -20.321 16.388  1.00 54.72 ? 54  LEU A HB2  1 
ATOM 766  H HB3  . LEU A 1 54  ? -20.398 -21.797 15.914  1.00 54.72 ? 54  LEU A HB3  1 
ATOM 767  H HG   . LEU A 1 54  ? -22.506 -19.981 16.249  1.00 54.72 ? 54  LEU A HG   1 
ATOM 768  H HD11 . LEU A 1 54  ? -22.352 -19.307 14.022  1.00 54.72 ? 54  LEU A HD11 1 
ATOM 769  H HD12 . LEU A 1 54  ? -21.054 -18.860 14.821  1.00 54.72 ? 54  LEU A HD12 1 
ATOM 770  H HD13 . LEU A 1 54  ? -21.001 -20.128 13.867  1.00 54.72 ? 54  LEU A HD13 1 
ATOM 771  H HD21 . LEU A 1 54  ? -23.576 -21.348 14.693  1.00 54.72 ? 54  LEU A HD21 1 
ATOM 772  H HD22 . LEU A 1 54  ? -22.265 -22.237 14.579  1.00 54.72 ? 54  LEU A HD22 1 
ATOM 773  H HD23 . LEU A 1 54  ? -23.085 -22.201 15.940  1.00 54.72 ? 54  LEU A HD23 1 
ATOM 774  N N    . GLY A 1 55  ? -19.574 -21.804 19.790  1.00 60.56 ? 55  GLY A N    1 
ATOM 775  C CA   . GLY A 1 55  ? -18.453 -22.377 20.513  1.00 62.06 ? 55  GLY A CA   1 
ATOM 776  C C    . GLY A 1 55  ? -17.124 -21.693 20.242  1.00 60.98 ? 55  GLY A C    1 
ATOM 777  O O    . GLY A 1 55  ? -16.958 -20.503 20.513  1.00 60.65 ? 55  GLY A O    1 
ATOM 778  H H    . GLY A 1 55  ? -20.120 -21.356 20.282  1.00 54.72 ? 55  GLY A H    1 
ATOM 779  H HA2  . GLY A 1 55  ? -18.630 -22.324 21.466  1.00 54.72 ? 55  GLY A HA2  1 
ATOM 780  H HA3  . GLY A 1 55  ? -18.366 -23.312 20.274  1.00 54.72 ? 55  GLY A HA3  1 
ATOM 781  N N    . ASN A 1 56  ? -16.178 -22.458 19.700  1.00 58.94 ? 56  ASN A N    1 
ATOM 782  C CA   . ASN A 1 56  ? -14.826 -21.970 19.437  1.00 58.61 ? 56  ASN A CA   1 
ATOM 783  C C    . ASN A 1 56  ? -14.274 -22.537 18.131  1.00 57.39 ? 56  ASN A C    1 
ATOM 784  O O    . ASN A 1 56  ? -14.928 -23.349 17.475  1.00 56.82 ? 56  ASN A O    1 
ATOM 785  C CB   . ASN A 1 56  ? -13.892 -22.342 20.593  1.00 60.44 ? 56  ASN A CB   1 
ATOM 786  C CG   . ASN A 1 56  ? -14.388 -21.836 21.934  1.00 62.09 ? 56  ASN A CG   1 
ATOM 787  O OD1  . ASN A 1 56  ? -14.635 -20.642 22.108  1.00 61.54 ? 56  ASN A OD1  1 
ATOM 788  N ND2  . ASN A 1 56  ? -14.542 -22.746 22.892  1.00 64.47 ? 56  ASN A ND2  1 
ATOM 789  H H    . ASN A 1 56  ? -16.297 -23.278 19.472  1.00 54.72 ? 56  ASN A H    1 
ATOM 790  H HA   . ASN A 1 56  ? -14.845 -21.003 19.362  1.00 54.72 ? 56  ASN A HA   1 
ATOM 791  H HB2  . ASN A 1 56  ? -13.822 -23.308 20.644  1.00 54.72 ? 56  ASN A HB2  1 
ATOM 792  H HB3  . ASN A 1 56  ? -13.018 -21.954 20.430  1.00 54.72 ? 56  ASN A HB3  1 
ATOM 793  H HD21 . ASN A 1 56  ? -14.820 -22.509 23.670  1.00 54.72 ? 56  ASN A HD21 1 
ATOM 794  H HD22 . ASN A 1 56  ? -14.362 -23.572 22.733  1.00 54.72 ? 56  ASN A HD22 1 
ATOM 795  N N    . VAL A 1 57  ? -13.079 -22.090 17.751  1.00 56.21 ? 57  VAL A N    1 
ATOM 796  C CA   . VAL A 1 57  ? -12.336 -22.706 16.653  1.00 55.86 ? 57  VAL A CA   1 
ATOM 797  C C    . VAL A 1 57  ? -10.857 -22.811 17.014  1.00 57.91 ? 57  VAL A C    1 
ATOM 798  O O    . VAL A 1 57  ? -10.357 -22.050 17.841  1.00 59.06 ? 57  VAL A O    1 
ATOM 799  C CB   . VAL A 1 57  ? -12.496 -21.918 15.342  1.00 55.95 ? 57  VAL A CB   1 
ATOM 800  C CG1  . VAL A 1 57  ? -13.948 -21.941 14.899  1.00 54.24 ? 57  VAL A CG1  1 
ATOM 801  C CG2  . VAL A 1 57  ? -12.002 -20.485 15.511  1.00 55.91 ? 57  VAL A CG2  1 
ATOM 802  H H    . VAL A 1 57  ? -12.674 -21.425 18.116  1.00 54.72 ? 57  VAL A H    1 
ATOM 803  H HA   . VAL A 1 57  ? -12.675 -23.603 16.507  1.00 54.72 ? 57  VAL A HA   1 
ATOM 804  H HB   . VAL A 1 57  ? -11.963 -22.341 14.651  1.00 54.72 ? 57  VAL A HB   1 
ATOM 805  H HG11 . VAL A 1 57  ? -14.033 -21.441 14.073  1.00 54.72 ? 57  VAL A HG11 1 
ATOM 806  H HG12 . VAL A 1 57  ? -14.220 -22.862 14.759  1.00 54.72 ? 57  VAL A HG12 1 
ATOM 807  H HG13 . VAL A 1 57  ? -14.495 -21.535 15.590  1.00 54.72 ? 57  VAL A HG13 1 
ATOM 808  H HG21 . VAL A 1 57  ? -12.114 -20.012 14.671  1.00 54.72 ? 57  VAL A HG21 1 
ATOM 809  H HG22 . VAL A 1 57  ? -12.522 -20.052 16.207  1.00 54.72 ? 57  VAL A HG22 1 
ATOM 810  H HG23 . VAL A 1 57  ? -11.065 -20.502 15.760  1.00 54.72 ? 57  VAL A HG23 1 
ATOM 811  N N    . THR A 1 58  ? -10.161 -23.751 16.382  1.00 57.35 ? 58  THR A N    1 
ATOM 812  C CA   . THR A 1 58  ? -8.795  -24.081 16.771  1.00 59.91 ? 58  THR A CA   1 
ATOM 813  C C    . THR A 1 58  ? -7.778  -23.521 15.785  1.00 59.97 ? 58  THR A C    1 
ATOM 814  O O    . THR A 1 58  ? -7.467  -24.143 14.770  1.00 59.94 ? 58  THR A O    1 
ATOM 815  C CB   . THR A 1 58  ? -8.607  -25.607 16.885  1.00 61.71 ? 58  THR A CB   1 
ATOM 816  O OG1  . THR A 1 58  ? -9.677  -26.162 17.659  1.00 61.85 ? 58  THR A OG1  1 
ATOM 817  C CG2  . THR A 1 58  ? -7.280  -25.943 17.549  1.00 64.85 ? 58  THR A CG2  1 
ATOM 818  H H    . THR A 1 58  ? -10.459 -24.214 15.721  1.00 54.72 ? 58  THR A H    1 
ATOM 819  H HA   . THR A 1 58  ? -8.613  -23.692 17.641  1.00 54.72 ? 58  THR A HA   1 
ATOM 820  H HB   . THR A 1 58  ? -8.614  -26.000 15.998  1.00 54.72 ? 58  THR A HB   1 
ATOM 821  H HG1  . THR A 1 58  ? -9.582  -26.993 17.726  1.00 54.72 ? 58  THR A HG1  1 
ATOM 822  H HG21 . THR A 1 58  ? -7.175  -26.905 17.614  1.00 54.72 ? 58  THR A HG21 1 
ATOM 823  H HG22 . THR A 1 58  ? -6.547  -25.580 17.027  1.00 54.72 ? 58  THR A HG22 1 
ATOM 824  H HG23 . THR A 1 58  ? -7.250  -25.561 18.441  1.00 54.72 ? 58  THR A HG23 1 
ATOM 825  N N    . ALA A 1 59  ? -7.260  -22.336 16.086  1.00 60.46 ? 59  ALA A N    1 
ATOM 826  C CA   . ALA A 1 59  ? -6.162  -21.782 15.307  1.00 61.50 ? 59  ALA A CA   1 
ATOM 827  C C    . ALA A 1 59  ? -4.908  -22.606 15.561  1.00 64.68 ? 59  ALA A C    1 
ATOM 828  O O    . ALA A 1 59  ? -4.550  -22.857 16.712  1.00 66.71 ? 59  ALA A O    1 
ATOM 829  C CB   . ALA A 1 59  ? -5.922  -20.318 15.660  1.00 61.91 ? 59  ALA A CB   1 
ATOM 830  H H    . ALA A 1 59  ? -7.526  -21.835 16.732  1.00 54.72 ? 59  ALA A H    1 
ATOM 831  H HA   . ALA A 1 59  ? -6.378  -21.838 14.362  1.00 54.72 ? 59  ALA A HA   1 
ATOM 832  H HB1  . ALA A 1 59  ? -5.186  -19.981 15.125  1.00 54.72 ? 59  ALA A HB1  1 
ATOM 833  H HB2  . ALA A 1 59  ? -6.728  -19.812 15.471  1.00 54.72 ? 59  ALA A HB2  1 
ATOM 834  H HB3  . ALA A 1 59  ? -5.703  -20.253 16.603  1.00 54.72 ? 59  ALA A HB3  1 
ATOM 835  N N    . ASP A 1 60  ? -4.252  -23.032 14.487  1.00 65.38 ? 60  ASP A N    1 
ATOM 836  C CA   . ASP A 1 60  ? -3.032  -23.828 14.607  1.00 68.77 ? 60  ASP A CA   1 
ATOM 837  C C    . ASP A 1 60  ? -1.821  -22.903 14.658  1.00 71.45 ? 60  ASP A C    1 
ATOM 838  O O    . ASP A 1 60  ? -1.963  -21.680 14.600  1.00 70.65 ? 60  ASP A O    1 
ATOM 839  C CB   . ASP A 1 60  ? -2.896  -24.841 13.454  1.00 68.87 ? 60  ASP A CB   1 
ATOM 840  C CG   . ASP A 1 60  ? -3.788  -24.518 12.266  1.00 65.71 ? 60  ASP A CG   1 
ATOM 841  O OD1  . ASP A 1 60  ? -3.375  -23.712 11.403  1.00 65.72 ? 60  ASP A OD1  1 
ATOM 842  O OD2  . ASP A 1 60  ? -4.906  -25.077 12.193  1.00 63.56 ? 60  ASP A OD2  1 
ATOM 843  H H    . ASP A 1 60  ? -4.490  -22.874 13.676  1.00 54.72 ? 60  ASP A H    1 
ATOM 844  H HA   . ASP A 1 60  ? -3.063  -24.326 15.439  1.00 54.72 ? 60  ASP A HA   1 
ATOM 845  H HB2  . ASP A 1 60  ? -1.977  -24.844 13.145  1.00 54.72 ? 60  ASP A HB2  1 
ATOM 846  H HB3  . ASP A 1 60  ? -3.139  -25.722 13.779  1.00 54.72 ? 60  ASP A HB3  1 
ATOM 847  N N    . LYS A 1 61  ? -0.631  -23.487 14.756  1.00 75.05 ? 61  LYS A N    1 
ATOM 848  C CA   . LYS A 1 61  ? 0.601   -22.715 14.935  1.00 78.52 ? 61  LYS A CA   1 
ATOM 849  C C    . LYS A 1 61  ? 0.896   -21.739 13.795  1.00 78.45 ? 61  LYS A C    1 
ATOM 850  O O    . LYS A 1 61  ? 1.893   -21.018 13.841  1.00 81.68 ? 61  LYS A O    1 
ATOM 851  C CB   . LYS A 1 61  ? 1.794   -23.662 15.105  1.00 82.70 ? 61  LYS A CB   1 
ATOM 852  C CG   . LYS A 1 61  ? 2.020   -24.138 16.532  1.00 84.76 ? 61  LYS A CG   1 
ATOM 853  C CD   . LYS A 1 61  ? 3.420   -24.708 16.711  1.00 89.79 ? 61  LYS A CD   1 
ATOM 854  C CE   . LYS A 1 61  ? 3.749   -24.923 18.178  1.00 92.35 ? 61  LYS A CE   1 
ATOM 855  N NZ   . LYS A 1 61  ? 2.736   -25.762 18.875  1.00 90.22 ? 61  LYS A NZ   1 
ATOM 856  H H    . LYS A 1 61  ? -0.506  -24.337 14.722  1.00 54.72 ? 61  LYS A H    1 
ATOM 857  H HA   . LYS A 1 61  ? 0.521   -22.196 15.751  1.00 54.72 ? 61  LYS A HA   1 
ATOM 858  H HB2  . LYS A 1 61  ? 1.649   -24.446 14.552  1.00 54.72 ? 61  LYS A HB2  1 
ATOM 859  H HB3  . LYS A 1 61  ? 2.598   -23.202 14.817  1.00 54.72 ? 61  LYS A HB3  1 
ATOM 860  H HG2  . LYS A 1 61  ? 1.916   -23.389 17.140  1.00 54.72 ? 61  LYS A HG2  1 
ATOM 861  H HG3  . LYS A 1 61  ? 1.378   -24.834 16.744  1.00 54.72 ? 61  LYS A HG3  1 
ATOM 862  H HD2  . LYS A 1 61  ? 3.478   -25.563 16.258  1.00 54.72 ? 61  LYS A HD2  1 
ATOM 863  H HD3  . LYS A 1 61  ? 4.068   -24.087 16.342  1.00 54.72 ? 61  LYS A HD3  1 
ATOM 864  H HE2  . LYS A 1 61  ? 4.608   -25.369 18.248  1.00 54.72 ? 61  LYS A HE2  1 
ATOM 865  H HE3  . LYS A 1 61  ? 3.784   -24.063 18.624  1.00 54.72 ? 61  LYS A HE3  1 
ATOM 866  H HZ1  . LYS A 1 61  ? 2.963   -25.866 19.730  1.00 54.72 ? 61  LYS A HZ1  1 
ATOM 867  H HZ2  . LYS A 1 61  ? 1.937   -25.372 18.833  1.00 54.72 ? 61  LYS A HZ2  1 
ATOM 868  H HZ3  . LYS A 1 61  ? 2.687   -26.563 18.490  1.00 54.72 ? 61  LYS A HZ3  1 
ATOM 869  N N    . ASP A 1 62  ? 0.041   -21.726 12.777  1.00 75.19 ? 62  ASP A N    1 
ATOM 870  C CA   . ASP A 1 62  ? 0.153   -20.758 11.693  1.00 74.91 ? 62  ASP A CA   1 
ATOM 871  C C    . ASP A 1 62  ? -0.941  -19.695 11.783  1.00 71.66 ? 62  ASP A C    1 
ATOM 872  O O    . ASP A 1 62  ? -1.071  -18.857 10.892  1.00 71.02 ? 62  ASP A O    1 
ATOM 873  C CB   . ASP A 1 62  ? 0.083   -21.465 10.337  1.00 74.21 ? 62  ASP A CB   1 
ATOM 874  C CG   . ASP A 1 62  ? 0.935   -22.719 10.289  1.00 77.13 ? 62  ASP A CG   1 
ATOM 875  O OD1  . ASP A 1 62  ? 1.953   -22.776 11.010  1.00 80.73 ? 62  ASP A OD1  1 
ATOM 876  O OD2  . ASP A 1 62  ? 0.583   -23.647 9.533   1.00 76.09 ? 62  ASP A OD2  1 
ATOM 877  H H    . ASP A 1 62  ? -0.618  -22.272 12.691  1.00 54.72 ? 62  ASP A H    1 
ATOM 878  H HA   . ASP A 1 62  ? 1.012   -20.312 11.755  1.00 54.72 ? 62  ASP A HA   1 
ATOM 879  H HB2  . ASP A 1 62  ? -0.836  -21.719 10.160  1.00 54.72 ? 62  ASP A HB2  1 
ATOM 880  H HB3  . ASP A 1 62  ? 0.399   -20.860 9.648   1.00 54.72 ? 62  ASP A HB3  1 
ATOM 881  N N    . GLY A 1 63  ? -1.724  -19.724 12.856  1.00 69.96 ? 63  GLY A N    1 
ATOM 882  C CA   . GLY A 1 63  ? -2.809  -18.772 13.012  1.00 67.18 ? 63  GLY A CA   1 
ATOM 883  C C    . GLY A 1 63  ? -3.874  -18.966 11.947  1.00 63.73 ? 63  GLY A C    1 
ATOM 884  O O    . GLY A 1 63  ? -4.284  -18.004 11.295  1.00 62.51 ? 63  GLY A O    1 
ATOM 885  H H    . GLY A 1 63  ? -1.646  -20.283 13.505  1.00 54.72 ? 63  GLY A H    1 
ATOM 886  H HA2  . GLY A 1 63  ? -3.218  -18.883 13.884  1.00 54.72 ? 63  GLY A HA2  1 
ATOM 887  H HA3  . GLY A 1 63  ? -2.462  -17.869 12.943  1.00 54.72 ? 63  GLY A HA3  1 
ATOM 888  N N    . VAL A 1 64  ? -4.307  -20.213 11.763  1.00 63.71 ? 64  VAL A N    1 
ATOM 889  C CA   . VAL A 1 64  ? -5.309  -20.552 10.755  1.00 60.86 ? 64  VAL A CA   1 
ATOM 890  C C    . VAL A 1 64  ? -6.344  -21.517 11.323  1.00 59.16 ? 64  VAL A C    1 
ATOM 891  O O    . VAL A 1 64  ? -5.989  -22.521 11.941  1.00 60.67 ? 64  VAL A O    1 
ATOM 892  C CB   . VAL A 1 64  ? -4.665  -21.196 9.515   1.00 61.19 ? 64  VAL A CB   1 
ATOM 893  C CG1  . VAL A 1 64  ? -5.658  -21.268 8.365   1.00 58.51 ? 64  VAL A CG1  1 
ATOM 894  C CG2  . VAL A 1 64  ? -3.427  -20.422 9.097   1.00 64.05 ? 64  VAL A CG2  1 
ATOM 895  H H    . VAL A 1 64  ? -4.031  -20.889 12.217  1.00 54.72 ? 64  VAL A H    1 
ATOM 896  H HA   . VAL A 1 64  ? -5.768  -19.745 10.475  1.00 54.72 ? 64  VAL A HA   1 
ATOM 897  H HB   . VAL A 1 64  ? -4.393  -22.101 9.734   1.00 54.72 ? 64  VAL A HB   1 
ATOM 898  H HG11 . VAL A 1 64  ? -5.226  -21.677 7.600   1.00 54.72 ? 64  VAL A HG11 1 
ATOM 899  H HG12 . VAL A 1 64  ? -6.420  -21.803 8.640   1.00 54.72 ? 64  VAL A HG12 1 
ATOM 900  H HG13 . VAL A 1 64  ? -5.948  -20.370 8.142   1.00 54.72 ? 64  VAL A HG13 1 
ATOM 901  H HG21 . VAL A 1 64  ? -3.040  -20.845 8.315   1.00 54.72 ? 64  VAL A HG21 1 
ATOM 902  H HG22 . VAL A 1 64  ? -3.682  -19.509 8.888   1.00 54.72 ? 64  VAL A HG22 1 
ATOM 903  H HG23 . VAL A 1 64  ? -2.790  -20.428 9.828   1.00 54.72 ? 64  VAL A HG23 1 
ATOM 904  N N    . ALA A 1 65  ? -7.620  -21.219 11.097  1.00 59.31 ? 65  ALA A N    1 
ATOM 905  C CA   . ALA A 1 65  ? -8.704  -22.047 11.613  1.00 58.06 ? 65  ALA A CA   1 
ATOM 906  C C    . ALA A 1 65  ? -9.409  -22.784 10.479  1.00 56.61 ? 65  ALA A C    1 
ATOM 907  O O    . ALA A 1 65  ? -9.564  -22.245 9.385   1.00 55.47 ? 65  ALA A O    1 
ATOM 908  C CB   . ALA A 1 65  ? -9.700  -21.191 12.392  1.00 55.48 ? 65  ALA A CB   1 
ATOM 909  H H    . ALA A 1 65  ? -7.886  -20.538 10.645  1.00 54.72 ? 65  ALA A H    1 
ATOM 910  H HA   . ALA A 1 65  ? -8.336  -22.709 12.219  1.00 54.72 ? 65  ALA A HA   1 
ATOM 911  H HB1  . ALA A 1 65  ? -10.411 -21.760 12.725  1.00 54.72 ? 65  ALA A HB1  1 
ATOM 912  H HB2  . ALA A 1 65  ? -9.240  -20.767 13.133  1.00 54.72 ? 65  ALA A HB2  1 
ATOM 913  H HB3  . ALA A 1 65  ? -10.066 -20.516 11.800  1.00 54.72 ? 65  ALA A HB3  1 
ATOM 914  N N    . ASP A 1 66  ? -9.816  -24.022 10.747  1.00 57.84 ? 66  ASP A N    1 
ATOM 915  C CA   . ASP A 1 66  ? -10.698 -24.766 9.853   1.00 56.74 ? 66  ASP A CA   1 
ATOM 916  C C    . ASP A 1 66  ? -11.999 -25.047 10.592  1.00 55.96 ? 66  ASP A C    1 
ATOM 917  O O    . ASP A 1 66  ? -11.988 -25.493 11.741  1.00 57.29 ? 66  ASP A O    1 
ATOM 918  C CB   . ASP A 1 66  ? -10.039 -26.065 9.375   1.00 56.95 ? 66  ASP A CB   1 
ATOM 919  C CG   . ASP A 1 66  ? -9.209  -25.870 8.115   1.00 57.38 ? 66  ASP A CG   1 
ATOM 920  O OD1  . ASP A 1 66  ? -8.837  -24.714 7.813   1.00 56.77 ? 66  ASP A OD1  1 
ATOM 921  O OD2  . ASP A 1 66  ? -8.923  -26.874 7.426   1.00 58.68 ? 66  ASP A OD2  1 
ATOM 922  H H    . ASP A 1 66  ? -9.591  -24.459 11.453  1.00 54.72 ? 66  ASP A H    1 
ATOM 923  H HA   . ASP A 1 66  ? -10.900 -24.222 9.076   1.00 54.72 ? 66  ASP A HA   1 
ATOM 924  H HB2  . ASP A 1 66  ? -9.453  -26.398 10.072  1.00 54.72 ? 66  ASP A HB2  1 
ATOM 925  H HB3  . ASP A 1 66  ? -10.730 -26.718 9.181   1.00 54.72 ? 66  ASP A HB3  1 
ATOM 926  N N    . VAL A 1 67  ? -13.113 -24.762 9.928   1.00 53.89 ? 67  VAL A N    1 
ATOM 927  C CA   . VAL A 1 67  ? -14.425 -24.842 10.551  1.00 53.37 ? 67  VAL A CA   1 
ATOM 928  C C    . VAL A 1 67  ? -15.336 -25.778 9.775   1.00 53.36 ? 67  VAL A C    1 
ATOM 929  O O    . VAL A 1 67  ? -15.432 -25.699 8.552   1.00 52.43 ? 67  VAL A O    1 
ATOM 930  C CB   . VAL A 1 67  ? -15.078 -23.454 10.640  1.00 52.47 ? 67  VAL A CB   1 
ATOM 931  C CG1  . VAL A 1 67  ? -16.363 -23.512 11.445  1.00 52.54 ? 67  VAL A CG1  1 
ATOM 932  C CG2  . VAL A 1 67  ? -14.116 -22.468 11.275  1.00 52.82 ? 67  VAL A CG2  1 
ATOM 933  H H    . VAL A 1 67  ? -13.134 -24.516 9.104   1.00 54.72 ? 67  VAL A H    1 
ATOM 934  H HA   . VAL A 1 67  ? -14.329 -25.190 11.451  1.00 54.72 ? 67  VAL A HA   1 
ATOM 935  H HB   . VAL A 1 67  ? -15.291 -23.140 9.747   1.00 54.72 ? 67  VAL A HB   1 
ATOM 936  H HG11 . VAL A 1 67  ? -16.751 -22.624 11.485  1.00 54.72 ? 67  VAL A HG11 1 
ATOM 937  H HG12 . VAL A 1 67  ? -16.978 -24.124 11.012  1.00 54.72 ? 67  VAL A HG12 1 
ATOM 938  H HG13 . VAL A 1 67  ? -16.160 -23.825 12.341  1.00 54.72 ? 67  VAL A HG13 1 
ATOM 939  H HG21 . VAL A 1 67  ? -14.542 -21.598 11.324  1.00 54.72 ? 67  VAL A HG21 1 
ATOM 940  H HG22 . VAL A 1 67  ? -13.890 -22.777 12.167  1.00 54.72 ? 67  VAL A HG22 1 
ATOM 941  H HG23 . VAL A 1 67  ? -13.315 -22.414 10.731  1.00 54.72 ? 67  VAL A HG23 1 
ATOM 942  N N    . SER A 1 68  ? -15.993 -26.673 10.501  1.00 54.58 ? 68  SER A N    1 
ATOM 943  C CA   . SER A 1 68  ? -17.003 -27.546 9.922   1.00 55.14 ? 68  SER A CA   1 
ATOM 944  C C    . SER A 1 68  ? -18.016 -27.932 10.989  1.00 56.56 ? 68  SER A C    1 
ATOM 945  O O    . SER A 1 68  ? -17.954 -29.020 11.564  1.00 58.95 ? 68  SER A O    1 
ATOM 946  C CB   . SER A 1 68  ? -16.368 -28.792 9.313   1.00 55.40 ? 68  SER A CB   1 
ATOM 947  O OG   . SER A 1 68  ? -17.371 -29.686 8.860   1.00 56.51 ? 68  SER A OG   1 
ATOM 948  H H    . SER A 1 68  ? -15.870 -26.795 11.344  1.00 54.72 ? 68  SER A H    1 
ATOM 949  H HA   . SER A 1 68  ? -17.471 -27.070 9.218   1.00 54.72 ? 68  SER A HA   1 
ATOM 950  H HB2  . SER A 1 68  ? -15.813 -28.531 8.562   1.00 54.72 ? 68  SER A HB2  1 
ATOM 951  H HB3  . SER A 1 68  ? -15.829 -29.235 9.987   1.00 54.72 ? 68  SER A HB3  1 
ATOM 952  H HG   . SER A 1 68  ? -17.017 -30.370 8.526   1.00 54.72 ? 68  SER A HG   1 
ATOM 953  N N    . ILE A 1 69  ? -18.943 -27.015 11.244  1.00 57.81 ? 69  ILE A N    1 
ATOM 954  C CA   . ILE A 1 69  ? -19.943 -27.174 12.289  1.00 59.34 ? 69  ILE A CA   1 
ATOM 955  C C    . ILE A 1 69  ? -21.340 -27.221 11.687  1.00 59.42 ? 69  ILE A C    1 
ATOM 956  O O    . ILE A 1 69  ? -21.800 -26.245 11.096  1.00 57.52 ? 69  ILE A O    1 
ATOM 957  C CB   . ILE A 1 69  ? -19.868 -26.013 13.312  1.00 59.85 ? 69  ILE A CB   1 
ATOM 958  C CG1  . ILE A 1 69  ? -18.510 -26.003 14.013  1.00 60.35 ? 69  ILE A CG1  1 
ATOM 959  C CG2  . ILE A 1 69  ? -20.973 -26.122 14.356  1.00 61.73 ? 69  ILE A CG2  1 
ATOM 960  C CD1  . ILE A 1 69  ? -18.189 -24.683 14.698  1.00 59.43 ? 69  ILE A CD1  1 
ATOM 961  H H    . ILE A 1 69  ? -19.013 -26.274 10.814  1.00 54.72 ? 69  ILE A H    1 
ATOM 962  H HA   . ILE A 1 69  ? -19.785 -28.007 12.761  1.00 54.72 ? 69  ILE A HA   1 
ATOM 963  H HB   . ILE A 1 69  ? -19.976 -25.175 12.835  1.00 54.72 ? 69  ILE A HB   1 
ATOM 964  H HG12 . ILE A 1 69  ? -18.501 -26.699 14.688  1.00 54.72 ? 69  ILE A HG12 1 
ATOM 965  H HG13 . ILE A 1 69  ? -17.817 -26.172 13.356  1.00 54.72 ? 69  ILE A HG13 1 
ATOM 966  H HG21 . ILE A 1 69  ? -20.895 -25.381 14.977  1.00 54.72 ? 69  ILE A HG21 1 
ATOM 967  H HG22 . ILE A 1 69  ? -21.834 -26.090 13.909  1.00 54.72 ? 69  ILE A HG22 1 
ATOM 968  H HG23 . ILE A 1 69  ? -20.878 -26.963 14.830  1.00 54.72 ? 69  ILE A HG23 1 
ATOM 969  H HD11 . ILE A 1 69  ? -17.318 -24.750 15.119  1.00 54.72 ? 69  ILE A HD11 1 
ATOM 970  H HD12 . ILE A 1 69  ? -18.183 -23.976 14.034  1.00 54.72 ? 69  ILE A HD12 1 
ATOM 971  H HD13 . ILE A 1 69  ? -18.867 -24.503 15.368  1.00 54.72 ? 69  ILE A HD13 1 
ATOM 972  N N    . GLU A 1 70  ? -22.004 -28.363 11.820  1.00 60.38 ? 70  GLU A N    1 
ATOM 973  C CA   . GLU A 1 70  ? -23.423 -28.433 11.518  1.00 61.34 ? 70  GLU A CA   1 
ATOM 974  C C    . GLU A 1 70  ? -24.140 -27.732 12.669  1.00 62.06 ? 70  GLU A C    1 
ATOM 975  O O    . GLU A 1 70  ? -23.605 -27.672 13.775  1.00 62.78 ? 70  GLU A O    1 
ATOM 976  C CB   . GLU A 1 70  ? -23.885 -29.883 11.351  1.00 63.33 ? 70  GLU A CB   1 
ATOM 977  C CG   . GLU A 1 70  ? -25.270 -30.006 10.740  1.00 64.53 ? 70  GLU A CG   1 
ATOM 978  C CD   . GLU A 1 70  ? -25.599 -31.412 10.268  1.00 67.67 ? 70  GLU A CD   1 
ATOM 979  O OE1  . GLU A 1 70  ? -24.672 -32.149 9.867   1.00 67.87 ? 70  GLU A OE1  1 
ATOM 980  O OE2  . GLU A 1 70  ? -26.794 -31.778 10.291  1.00 70.32 ? 70  GLU A OE2  1 
ATOM 981  H H    . GLU A 1 70  ? -21.658 -29.105 12.081  1.00 54.72 ? 70  GLU A H    1 
ATOM 982  H HA   . GLU A 1 70  ? -23.607 -27.952 10.697  1.00 54.72 ? 70  GLU A HA   1 
ATOM 983  H HB2  . GLU A 1 70  ? -23.261 -30.346 10.771  1.00 54.72 ? 70  GLU A HB2  1 
ATOM 984  H HB3  . GLU A 1 70  ? -23.905 -30.308 12.223  1.00 54.72 ? 70  GLU A HB3  1 
ATOM 985  H HG2  . GLU A 1 70  ? -25.930 -29.752 11.404  1.00 54.72 ? 70  GLU A HG2  1 
ATOM 986  H HG3  . GLU A 1 70  ? -25.328 -29.413 9.974   1.00 54.72 ? 70  GLU A HG3  1 
ATOM 987  N N    . ASP A 1 71  ? -25.323 -27.176 12.424  1.00 60.10 ? 71  ASP A N    1 
ATOM 988  C CA   . ASP A 1 71  ? -26.002 -26.409 13.464  1.00 60.93 ? 71  ASP A CA   1 
ATOM 989  C C    . ASP A 1 71  ? -27.510 -26.409 13.284  1.00 62.87 ? 71  ASP A C    1 
ATOM 990  O O    . ASP A 1 71  ? -28.025 -26.021 12.236  1.00 61.66 ? 71  ASP A O    1 
ATOM 991  C CB   . ASP A 1 71  ? -25.483 -24.969 13.488  1.00 62.24 ? 71  ASP A CB   1 
ATOM 992  C CG   . ASP A 1 71  ? -25.719 -24.288 14.822  1.00 63.36 ? 71  ASP A CG   1 
ATOM 993  O OD1  . ASP A 1 71  ? -26.887 -23.979 15.143  1.00 64.95 ? 71  ASP A OD1  1 
ATOM 994  O OD2  . ASP A 1 71  ? -24.731 -24.055 15.550  1.00 62.94 ? 71  ASP A OD2  1 
ATOM 995  H H    . ASP A 1 71  ? -25.748 -27.227 11.678  1.00 54.72 ? 71  ASP A H    1 
ATOM 996  H HA   . ASP A 1 71  ? -25.806 -26.809 14.325  1.00 54.72 ? 71  ASP A HA   1 
ATOM 997  H HB2  . ASP A 1 71  ? -24.528 -24.974 13.318  1.00 54.72 ? 71  ASP A HB2  1 
ATOM 998  H HB3  . ASP A 1 71  ? -25.940 -24.457 12.803  1.00 54.72 ? 71  ASP A HB3  1 
ATOM 999  N N    . SER A 1 72  ? -28.204 -26.845 14.330  1.00 63.03 ? 72  SER A N    1 
ATOM 1000 C CA   . SER A 1 72  ? -29.659 -26.928 14.330  1.00 65.86 ? 72  SER A CA   1 
ATOM 1001 C C    . SER A 1 72  ? -30.300 -25.710 14.993  1.00 65.92 ? 72  SER A C    1 
ATOM 1002 O O    . SER A 1 72  ? -31.475 -25.421 14.765  1.00 67.54 ? 72  SER A O    1 
ATOM 1003 C CB   . SER A 1 72  ? -30.114 -28.206 15.040  1.00 70.43 ? 72  SER A CB   1 
ATOM 1004 O OG   . SER A 1 72  ? -29.998 -29.334 14.188  1.00 71.34 ? 72  SER A OG   1 
ATOM 1005 H H    . SER A 1 72  ? -27.846 -27.103 15.068  1.00 54.72 ? 72  SER A H    1 
ATOM 1006 H HA   . SER A 1 72  ? -29.972 -26.968 13.413  1.00 54.72 ? 72  SER A HA   1 
ATOM 1007 H HB2  . SER A 1 72  ? -29.560 -28.346 15.824  1.00 54.72 ? 72  SER A HB2  1 
ATOM 1008 H HB3  . SER A 1 72  ? -31.042 -28.106 15.305  1.00 54.72 ? 72  SER A HB3  1 
ATOM 1009 H HG   . SER A 1 72  ? -30.250 -30.026 14.591  1.00 54.72 ? 72  SER A HG   1 
ATOM 1010 N N    . VAL A 1 73  ? -29.535 -25.003 15.819  1.00 64.97 ? 73  VAL A N    1 
ATOM 1011 C CA   . VAL A 1 73  ? -30.050 -23.811 16.488  1.00 65.21 ? 73  VAL A CA   1 
ATOM 1012 C C    . VAL A 1 73  ? -30.287 -22.677 15.494  1.00 62.45 ? 73  VAL A C    1 
ATOM 1013 O O    . VAL A 1 73  ? -31.418 -22.220 15.335  1.00 63.89 ? 73  VAL A O    1 
ATOM 1014 C CB   . VAL A 1 73  ? -29.092 -23.318 17.596  1.00 64.15 ? 73  VAL A CB   1 
ATOM 1015 C CG1  . VAL A 1 73  ? -29.613 -22.025 18.231  1.00 64.56 ? 73  VAL A CG1  1 
ATOM 1016 C CG2  . VAL A 1 73  ? -28.913 -24.394 18.655  1.00 67.31 ? 73  VAL A CG2  1 
ATOM 1017 H H    . VAL A 1 73  ? -28.718 -25.191 16.009  1.00 54.72 ? 73  VAL A H    1 
ATOM 1018 H HA   . VAL A 1 73  ? -30.899 -24.027 16.903  1.00 54.72 ? 73  VAL A HA   1 
ATOM 1019 H HB   . VAL A 1 73  ? -28.224 -23.133 17.205  1.00 54.72 ? 73  VAL A HB   1 
ATOM 1020 H HG11 . VAL A 1 73  ? -28.993 -21.740 18.921  1.00 54.72 ? 73  VAL A HG11 1 
ATOM 1021 H HG12 . VAL A 1 73  ? -29.682 -21.342 17.545  1.00 54.72 ? 73  VAL A HG12 1 
ATOM 1022 H HG13 . VAL A 1 73  ? -30.486 -22.193 18.619  1.00 54.72 ? 73  VAL A HG13 1 
ATOM 1023 H HG21 . VAL A 1 73  ? -28.309 -24.064 19.340  1.00 54.72 ? 73  VAL A HG21 1 
ATOM 1024 H HG22 . VAL A 1 73  ? -29.777 -24.598 19.046  1.00 54.72 ? 73  VAL A HG22 1 
ATOM 1025 H HG23 . VAL A 1 73  ? -28.541 -25.187 18.240  1.00 54.72 ? 73  VAL A HG23 1 
ATOM 1026 N N    . ILE A 1 74  ? -29.224 -22.224 14.834  1.00 63.91 ? 74  ILE A N    1 
ATOM 1027 C CA   . ILE A 1 74  ? -29.319 -21.081 13.929  1.00 61.45 ? 74  ILE A CA   1 
ATOM 1028 C C    . ILE A 1 74  ? -30.178 -21.403 12.710  1.00 61.63 ? 74  ILE A C    1 
ATOM 1029 O O    . ILE A 1 74  ? -30.468 -22.568 12.432  1.00 63.21 ? 74  ILE A O    1 
ATOM 1030 C CB   . ILE A 1 74  ? -27.926 -20.612 13.468  1.00 60.62 ? 74  ILE A CB   1 
ATOM 1031 C CG1  . ILE A 1 74  ? -27.219 -21.703 12.656  1.00 59.69 ? 74  ILE A CG1  1 
ATOM 1032 C CG2  . ILE A 1 74  ? -27.104 -20.228 14.678  1.00 60.81 ? 74  ILE A CG2  1 
ATOM 1033 C CD1  . ILE A 1 74  ? -25.841 -21.306 12.160  1.00 57.01 ? 74  ILE A CD1  1 
ATOM 1034 H H    . ILE A 1 74  ? -28.435 -22.561 14.892  1.00 54.72 ? 74  ILE A H    1 
ATOM 1035 H HA   . ILE A 1 74  ? -29.739 -20.344 14.401  1.00 54.72 ? 74  ILE A HA   1 
ATOM 1036 H HB   . ILE A 1 74  ? -28.033 -19.829 12.906  1.00 54.72 ? 74  ILE A HB   1 
ATOM 1037 H HG12 . ILE A 1 74  ? -27.118 -22.491 13.213  1.00 54.72 ? 74  ILE A HG12 1 
ATOM 1038 H HG13 . ILE A 1 74  ? -27.762 -21.917 11.881  1.00 54.72 ? 74  ILE A HG13 1 
ATOM 1039 H HG21 . ILE A 1 74  ? -26.228 -19.934 14.384  1.00 54.72 ? 74  ILE A HG21 1 
ATOM 1040 H HG22 . ILE A 1 74  ? -27.554 -19.509 15.150  1.00 54.72 ? 74  ILE A HG22 1 
ATOM 1041 H HG23 . ILE A 1 74  ? -27.016 -21.001 15.258  1.00 54.72 ? 74  ILE A HG23 1 
ATOM 1042 H HD11 . ILE A 1 74  ? -25.462 -22.045 11.659  1.00 54.72 ? 74  ILE A HD11 1 
ATOM 1043 H HD12 . ILE A 1 74  ? -25.924 -20.526 11.590  1.00 54.72 ? 74  ILE A HD12 1 
ATOM 1044 H HD13 . ILE A 1 74  ? -25.279 -21.101 12.924  1.00 54.72 ? 74  ILE A HD13 1 
ATOM 1045 N N    . SER A 1 75  ? -30.580 -20.361 11.986  1.00 58.94 ? 75  SER A N    1 
ATOM 1046 C CA   . SER A 1 75  ? -31.484 -20.519 10.853  1.00 59.41 ? 75  SER A CA   1 
ATOM 1047 C C    . SER A 1 75  ? -31.268 -19.443 9.797   1.00 56.78 ? 75  SER A C    1 
ATOM 1048 O O    . SER A 1 75  ? -31.023 -18.285 10.126  1.00 55.79 ? 75  SER A O    1 
ATOM 1049 C CB   . SER A 1 75  ? -32.935 -20.477 11.331  1.00 59.06 ? 75  SER A CB   1 
ATOM 1050 O OG   . SER A 1 75  ? -33.827 -20.750 10.266  1.00 60.06 ? 75  SER A OG   1 
ATOM 1051 H H    . SER A 1 75  ? -30.341 -19.548 12.133  1.00 54.72 ? 75  SER A H    1 
ATOM 1052 H HA   . SER A 1 75  ? -31.327 -21.383 10.440  1.00 54.72 ? 75  SER A HA   1 
ATOM 1053 H HB2  . SER A 1 75  ? -33.058 -21.143 12.025  1.00 54.72 ? 75  SER A HB2  1 
ATOM 1054 H HB3  . SER A 1 75  ? -33.125 -19.593 11.683  1.00 54.72 ? 75  SER A HB3  1 
ATOM 1055 H HG   . SER A 1 75  ? -33.731 -20.180 9.657   1.00 54.72 ? 75  SER A HG   1 
ATOM 1056 N N    . LEU A 1 76  ? -31.374 -19.829 8.528   1.00 56.47 ? 76  LEU A N    1 
ATOM 1057 C CA   . LEU A 1 76  ? -31.247 -18.876 7.432   1.00 54.44 ? 76  LEU A CA   1 
ATOM 1058 C C    . LEU A 1 76  ? -32.576 -18.155 7.196   1.00 56.16 ? 76  LEU A C    1 
ATOM 1059 O O    . LEU A 1 76  ? -32.601 -16.958 6.903   1.00 55.20 ? 76  LEU A O    1 
ATOM 1060 C CB   . LEU A 1 76  ? -30.786 -19.580 6.152   1.00 55.00 ? 76  LEU A CB   1 
ATOM 1061 C CG   . LEU A 1 76  ? -29.392 -20.221 6.159   1.00 53.37 ? 76  LEU A CG   1 
ATOM 1062 C CD1  . LEU A 1 76  ? -28.996 -20.618 4.747   1.00 52.27 ? 76  LEU A CD1  1 
ATOM 1063 C CD2  . LEU A 1 76  ? -28.340 -19.296 6.745   1.00 51.58 ? 76  LEU A CD2  1 
ATOM 1064 H H    . LEU A 1 76  ? -31.520 -20.638 8.276   1.00 54.72 ? 76  LEU A H    1 
ATOM 1065 H HA   . LEU A 1 76  ? -30.582 -18.210 7.666   1.00 54.72 ? 76  LEU A HA   1 
ATOM 1066 H HB2  . LEU A 1 76  ? -31.421 -20.285 5.952   1.00 54.72 ? 76  LEU A HB2  1 
ATOM 1067 H HB3  . LEU A 1 76  ? -30.795 -18.930 5.432   1.00 54.72 ? 76  LEU A HB3  1 
ATOM 1068 H HG   . LEU A 1 76  ? -29.418 -21.025 6.700   1.00 54.72 ? 76  LEU A HG   1 
ATOM 1069 H HD11 . LEU A 1 76  ? -28.114 -21.021 4.769   1.00 54.72 ? 76  LEU A HD11 1 
ATOM 1070 H HD12 . LEU A 1 76  ? -29.642 -21.255 4.405   1.00 54.72 ? 76  LEU A HD12 1 
ATOM 1071 H HD13 . LEU A 1 76  ? -28.984 -19.826 4.188   1.00 54.72 ? 76  LEU A HD13 1 
ATOM 1072 H HD21 . LEU A 1 76  ? -27.480 -19.745 6.727   1.00 54.72 ? 76  LEU A HD21 1 
ATOM 1073 H HD22 . LEU A 1 76  ? -28.302 -18.486 6.214   1.00 54.72 ? 76  LEU A HD22 1 
ATOM 1074 H HD23 . LEU A 1 76  ? -28.583 -19.082 7.659   1.00 54.72 ? 76  LEU A HD23 1 
ATOM 1075 N N    . SER A 1 77  ? -33.675 -18.894 7.317   1.00 54.83 ? 77  SER A N    1 
ATOM 1076 C CA   . SER A 1 77  ? -35.010 -18.313 7.283   1.00 57.31 ? 77  SER A CA   1 
ATOM 1077 C C    . SER A 1 77  ? -35.500 -18.106 8.709   1.00 59.76 ? 77  SER A C    1 
ATOM 1078 O O    . SER A 1 77  ? -34.709 -18.123 9.652   1.00 58.92 ? 77  SER A O    1 
ATOM 1079 C CB   . SER A 1 77  ? -35.970 -19.220 6.517   1.00 59.49 ? 77  SER A CB   1 
ATOM 1080 O OG   . SER A 1 77  ? -36.124 -20.455 7.197   1.00 61.84 ? 77  SER A OG   1 
ATOM 1081 H H    . SER A 1 77  ? -33.672 -19.748 7.422   1.00 54.72 ? 77  SER A H    1 
ATOM 1082 H HA   . SER A 1 77  ? -34.978 -17.451 6.838   1.00 54.72 ? 77  SER A HA   1 
ATOM 1083 H HB2  . SER A 1 77  ? -36.834 -18.784 6.450   1.00 54.72 ? 77  SER A HB2  1 
ATOM 1084 H HB3  . SER A 1 77  ? -35.611 -19.387 5.631   1.00 54.72 ? 77  SER A HB3  1 
ATOM 1085 H HG   . SER A 1 77  ? -36.653 -20.952 6.774   1.00 54.72 ? 77  SER A HG   1 
ATOM 1086 N N    . GLY A 1 78  ? -36.805 -17.914 8.864   1.00 62.84 ? 78  GLY A N    1 
ATOM 1087 C CA   . GLY A 1 78  ? -37.418 -17.857 10.178  1.00 66.04 ? 78  GLY A CA   1 
ATOM 1088 C C    . GLY A 1 78  ? -37.233 -16.535 10.903  1.00 65.47 ? 78  GLY A C    1 
ATOM 1089 O O    . GLY A 1 78  ? -36.729 -15.562 10.339  1.00 62.83 ? 78  GLY A O    1 
ATOM 1090 H H    . GLY A 1 78  ? -37.360 -17.813 8.215   1.00 54.72 ? 78  GLY A H    1 
ATOM 1091 H HA2  . GLY A 1 78  ? -38.370 -18.020 10.090  1.00 54.72 ? 78  GLY A HA2  1 
ATOM 1092 H HA3  . GLY A 1 78  ? -37.042 -18.558 10.732  1.00 54.72 ? 78  GLY A HA3  1 
ATOM 1093 N N    . ASP A 1 79  ? -37.643 -16.516 12.169  1.00 68.35 ? 79  ASP A N    1 
ATOM 1094 C CA   . ASP A 1 79  ? -37.640 -15.302 12.988  1.00 68.83 ? 79  ASP A CA   1 
ATOM 1095 C C    . ASP A 1 79  ? -36.235 -14.910 13.462  1.00 65.58 ? 79  ASP A C    1 
ATOM 1096 O O    . ASP A 1 79  ? -35.823 -13.757 13.315  1.00 63.95 ? 79  ASP A O    1 
ATOM 1097 C CB   . ASP A 1 79  ? -38.581 -15.479 14.194  1.00 73.58 ? 79  ASP A CB   1 
ATOM 1098 C CG   . ASP A 1 79  ? -38.301 -16.748 14.989  1.00 74.91 ? 79  ASP A CG   1 
ATOM 1099 O OD1  . ASP A 1 79  ? -37.653 -17.671 14.451  1.00 72.81 ? 79  ASP A OD1  1 
ATOM 1100 O OD2  . ASP A 1 79  ? -38.748 -16.825 16.155  1.00 78.42 ? 79  ASP A OD2  1 
ATOM 1101 H H    . ASP A 1 79  ? -37.935 -17.209 12.587  1.00 54.72 ? 79  ASP A H    1 
ATOM 1102 H HA   . ASP A 1 79  ? -37.983 -14.569 12.453  1.00 54.72 ? 79  ASP A HA   1 
ATOM 1103 H HB2  . ASP A 1 79  ? -38.472 -14.722 14.791  1.00 54.72 ? 79  ASP A HB2  1 
ATOM 1104 H HB3  . ASP A 1 79  ? -39.496 -15.521 13.876  1.00 54.72 ? 79  ASP A HB3  1 
ATOM 1105 N N    . HIS A 1 80  ? -35.507 -15.870 14.027  1.00 65.04 ? 80  HIS A N    1 
ATOM 1106 C CA   . HIS A 1 80  ? -34.129 -15.647 14.462  1.00 62.29 ? 80  HIS A CA   1 
ATOM 1107 C C    . HIS A 1 80  ? -33.170 -15.883 13.298  1.00 58.54 ? 80  HIS A C    1 
ATOM 1108 O O    . HIS A 1 80  ? -32.175 -16.600 13.428  1.00 57.02 ? 80  HIS A O    1 
ATOM 1109 C CB   . HIS A 1 80  ? -33.773 -16.561 15.639  1.00 63.84 ? 80  HIS A CB   1 
ATOM 1110 C CG   . HIS A 1 80  ? -34.670 -16.398 16.828  1.00 67.94 ? 80  HIS A CG   1 
ATOM 1111 N ND1  . HIS A 1 80  ? -35.842 -17.108 16.984  0.48 71.72 ? 80  HIS A ND1  1 
ATOM 1112 C CD2  . HIS A 1 80  ? -34.561 -15.608 17.922  1.00 69.28 ? 80  HIS A CD2  1 
ATOM 1113 C CE1  . HIS A 1 80  ? -36.417 -16.760 18.122  1.00 75.21 ? 80  HIS A CE1  1 
ATOM 1114 N NE2  . HIS A 1 80  ? -35.660 -15.851 18.709  1.00 73.74 ? 80  HIS A NE2  1 
ATOM 1115 H H    . HIS A 1 80  ? -35.791 -16.669 14.171  1.00 54.72 ? 80  HIS A H    1 
ATOM 1116 H HA   . HIS A 1 80  ? -34.032 -14.727 14.753  1.00 54.72 ? 80  HIS A HA   1 
ATOM 1117 H HB2  . HIS A 1 80  ? -33.833 -17.484 15.347  1.00 54.72 ? 80  HIS A HB2  1 
ATOM 1118 H HB3  . HIS A 1 80  ? -32.867 -16.365 15.924  1.00 54.72 ? 80  HIS A HB3  1 
ATOM 1119 H HD1  . HIS A 1 80  ? -36.151 -17.687 16.427  0.48 54.72 ? 80  HIS A HD1  1 
ATOM 1120 H HD2  . HIS A 1 80  ? -33.872 -15.011 18.105  1.00 54.72 ? 80  HIS A HD2  1 
ATOM 1121 H HE1  . HIS A 1 80  ? -37.218 -17.097 18.452  1.00 54.72 ? 80  HIS A HE1  1 
ATOM 1122 N N    . SER A 1 81  ? -33.486 -15.276 12.158  1.00 57.39 ? 81  SER A N    1 
ATOM 1123 C CA   . SER A 1 81  ? -32.661 -15.380 10.961  1.00 54.22 ? 81  SER A CA   1 
ATOM 1124 C C    . SER A 1 81  ? -31.340 -14.647 11.156  1.00 51.82 ? 81  SER A C    1 
ATOM 1125 O O    . SER A 1 81  ? -31.323 -13.476 11.536  1.00 52.12 ? 81  SER A O    1 
ATOM 1126 C CB   . SER A 1 81  ? -33.408 -14.813 9.752   1.00 54.96 ? 81  SER A CB   1 
ATOM 1127 O OG   . SER A 1 81  ? -32.636 -14.932 8.570   1.00 52.25 ? 81  SER A OG   1 
ATOM 1128 H H    . SER A 1 81  ? -34.187 -14.789 12.053  1.00 54.72 ? 81  SER A H    1 
ATOM 1129 H HA   . SER A 1 81  ? -32.467 -16.314 10.787  1.00 54.72 ? 81  SER A HA   1 
ATOM 1130 H HB2  . SER A 1 81  ? -34.238 -15.303 9.636   1.00 54.72 ? 81  SER A HB2  1 
ATOM 1131 H HB3  . SER A 1 81  ? -33.598 -13.875 9.910   1.00 54.72 ? 81  SER A HB3  1 
ATOM 1132 H HG   . SER A 1 81  ? -32.464 -15.741 8.420   1.00 54.72 ? 81  SER A HG   1 
ATOM 1133 N N    . ILE A 1 82  ? -30.237 -15.344 10.899  1.00 52.59 ? 82  ILE A N    1 
ATOM 1134 C CA   . ILE A 1 82  ? -28.906 -14.770 11.067  1.00 50.73 ? 82  ILE A CA   1 
ATOM 1135 C C    . ILE A 1 82  ? -28.467 -13.968 9.845   1.00 48.85 ? 82  ILE A C    1 
ATOM 1136 O O    . ILE A 1 82  ? -27.463 -13.254 9.893   1.00 47.82 ? 82  ILE A O    1 
ATOM 1137 C CB   . ILE A 1 82  ? -27.851 -15.862 11.351  1.00 50.82 ? 82  ILE A CB   1 
ATOM 1138 C CG1  . ILE A 1 82  ? -27.873 -16.936 10.255  1.00 50.02 ? 82  ILE A CG1  1 
ATOM 1139 C CG2  . ILE A 1 82  ? -28.100 -16.478 12.718  1.00 52.94 ? 82  ILE A CG2  1 
ATOM 1140 C CD1  . ILE A 1 82  ? -26.741 -17.945 10.341  1.00 49.26 ? 82  ILE A CD1  1 
ATOM 1141 H H    . ILE A 1 82  ? -30.233 -16.159 10.624  1.00 54.72 ? 82  ILE A H    1 
ATOM 1142 H HA   . ILE A 1 82  ? -28.920 -14.167 11.827  1.00 54.72 ? 82  ILE A HA   1 
ATOM 1143 H HB   . ILE A 1 82  ? -26.974 -15.448 11.357  1.00 54.72 ? 82  ILE A HB   1 
ATOM 1144 H HG12 . ILE A 1 82  ? -28.709 -17.425 10.317  1.00 54.72 ? 82  ILE A HG12 1 
ATOM 1145 H HG13 . ILE A 1 82  ? -27.813 -16.500 9.391   1.00 54.72 ? 82  ILE A HG13 1 
ATOM 1146 H HG21 . ILE A 1 82  ? -27.432 -17.162 12.883  1.00 54.72 ? 82  ILE A HG21 1 
ATOM 1147 H HG22 . ILE A 1 82  ? -28.038 -15.784 13.393  1.00 54.72 ? 82  ILE A HG22 1 
ATOM 1148 H HG23 . ILE A 1 82  ? -28.987 -16.873 12.729  1.00 54.72 ? 82  ILE A HG23 1 
ATOM 1149 H HD11 . ILE A 1 82  ? -26.831 -18.583 9.616   1.00 54.72 ? 82  ILE A HD11 1 
ATOM 1150 H HD12 . ILE A 1 82  ? -25.895 -17.476 10.267  1.00 54.72 ? 82  ILE A HD12 1 
ATOM 1151 H HD13 . ILE A 1 82  ? -26.792 -18.403 11.195  1.00 54.72 ? 82  ILE A HD13 1 
ATOM 1152 N N    . ILE A 1 83  ? -29.209 -14.098 8.747   1.00 48.53 ? 83  ILE A N    1 
ATOM 1153 C CA   . ILE A 1 83  ? -28.952 -13.302 7.551   1.00 47.23 ? 83  ILE A CA   1 
ATOM 1154 C C    . ILE A 1 83  ? -29.011 -11.821 7.898   1.00 47.87 ? 83  ILE A C    1 
ATOM 1155 O O    . ILE A 1 83  ? -30.089 -11.267 8.122   1.00 49.59 ? 83  ILE A O    1 
ATOM 1156 C CB   . ILE A 1 83  ? -29.966 -13.611 6.430   1.00 50.15 ? 83  ILE A CB   1 
ATOM 1157 C CG1  . ILE A 1 83  ? -29.772 -15.033 5.893   1.00 49.62 ? 83  ILE A CG1  1 
ATOM 1158 C CG2  . ILE A 1 83  ? -29.843 -12.615 5.278   1.00 49.34 ? 83  ILE A CG2  1 
ATOM 1159 C CD1  . ILE A 1 83  ? -28.396 -15.319 5.272   1.00 47.58 ? 83  ILE A CD1  1 
ATOM 1160 H H    . ILE A 1 83  ? -29.869 -14.644 8.670   1.00 54.72 ? 83  ILE A H    1 
ATOM 1161 H HA   . ILE A 1 83  ? -28.062 -13.501 7.220   1.00 54.72 ? 83  ILE A HA   1 
ATOM 1162 H HB   . ILE A 1 83  ? -30.860 -13.543 6.799   1.00 54.72 ? 83  ILE A HB   1 
ATOM 1163 H HG12 . ILE A 1 83  ? -29.897 -15.658 6.625   1.00 54.72 ? 83  ILE A HG12 1 
ATOM 1164 H HG13 . ILE A 1 83  ? -30.440 -15.197 5.209   1.00 54.72 ? 83  ILE A HG13 1 
ATOM 1165 H HG21 . ILE A 1 83  ? -30.494 -12.841 4.595   1.00 54.72 ? 83  ILE A HG21 1 
ATOM 1166 H HG22 . ILE A 1 83  ? -30.013 -11.721 5.614   1.00 54.72 ? 83  ILE A HG22 1 
ATOM 1167 H HG23 . ILE A 1 83  ? -28.947 -12.667 4.911   1.00 54.72 ? 83  ILE A HG23 1 
ATOM 1168 H HD11 . ILE A 1 83  ? -28.374 -16.239 4.964   1.00 54.72 ? 83  ILE A HD11 1 
ATOM 1169 H HD12 . ILE A 1 83  ? -28.256 -14.716 4.525   1.00 54.72 ? 83  ILE A HD12 1 
ATOM 1170 H HD13 . ILE A 1 83  ? -27.711 -15.178 5.944   1.00 54.72 ? 83  ILE A HD13 1 
ATOM 1171 N N    . GLY A 1 84  ? -27.840 -11.195 7.945   1.00 48.34 ? 84  GLY A N    1 
ATOM 1172 C CA   . GLY A 1 84  ? -27.724 -9.795  8.304   1.00 49.26 ? 84  GLY A CA   1 
ATOM 1173 C C    . GLY A 1 84  ? -27.062 -9.613  9.657   1.00 49.96 ? 84  GLY A C    1 
ATOM 1174 O O    . GLY A 1 84  ? -26.473 -8.568  9.933   1.00 50.56 ? 84  GLY A O    1 
ATOM 1175 H H    . GLY A 1 84  ? -27.087 -11.571 7.770   1.00 54.72 ? 84  GLY A H    1 
ATOM 1176 H HA2  . GLY A 1 84  ? -27.195 -9.331  7.636   1.00 54.72 ? 84  GLY A HA2  1 
ATOM 1177 H HA3  . GLY A 1 84  ? -28.606 -9.393  8.334   1.00 54.72 ? 84  GLY A HA3  1 
ATOM 1178 N N    . ARG A 1 85  ? -27.159 -10.633 10.505  1.00 49.27 ? 85  ARG A N    1 
ATOM 1179 C CA   . ARG A 1 85  ? -26.551 -10.580 11.830  1.00 50.15 ? 85  ARG A CA   1 
ATOM 1180 C C    . ARG A 1 85  ? -25.058 -10.880 11.732  1.00 48.81 ? 85  ARG A C    1 
ATOM 1181 O O    . ARG A 1 85  ? -24.630 -11.697 10.919  1.00 47.33 ? 85  ARG A O    1 
ATOM 1182 C CB   . ARG A 1 85  ? -27.252 -11.551 12.780  1.00 48.45 ? 85  ARG A CB   1 
ATOM 1183 C CG   . ARG A 1 85  ? -28.600 -11.023 13.262  1.00 50.76 ? 85  ARG A CG   1 
ATOM 1184 C CD   . ARG A 1 85  ? -29.391 -12.051 14.044  1.00 52.52 ? 85  ARG A CD   1 
ATOM 1185 N NE   . ARG A 1 85  ? -28.625 -12.614 15.149  1.00 52.94 ? 85  ARG A NE   1 
ATOM 1186 C CZ   . ARG A 1 85  ? -29.073 -13.571 15.954  1.00 54.69 ? 85  ARG A CZ   1 
ATOM 1187 N NH1  . ARG A 1 85  ? -30.286 -14.077 15.778  1.00 56.32 ? 85  ARG A NH1  1 
ATOM 1188 N NH2  . ARG A 1 85  ? -28.304 -14.024 16.934  1.00 55.17 ? 85  ARG A NH2  1 
ATOM 1189 H H    . ARG A 1 85  ? -27.572 -11.368 10.337  1.00 54.72 ? 85  ARG A H    1 
ATOM 1190 H HA   . ARG A 1 85  ? -26.653 -9.684  12.188  1.00 54.72 ? 85  ARG A HA   1 
ATOM 1191 H HB2  . ARG A 1 85  ? -27.405 -12.391 12.320  1.00 54.72 ? 85  ARG A HB2  1 
ATOM 1192 H HB3  . ARG A 1 85  ? -26.690 -11.695 13.558  1.00 54.72 ? 85  ARG A HB3  1 
ATOM 1193 H HG2  . ARG A 1 85  ? -28.450 -10.257 13.839  1.00 54.72 ? 85  ARG A HG2  1 
ATOM 1194 H HG3  . ARG A 1 85  ? -29.129 -10.760 12.492  1.00 54.72 ? 85  ARG A HG3  1 
ATOM 1195 H HD2  . ARG A 1 85  ? -30.184 -11.630 14.411  1.00 54.72 ? 85  ARG A HD2  1 
ATOM 1196 H HD3  . ARG A 1 85  ? -29.642 -12.776 13.451  1.00 54.72 ? 85  ARG A HD3  1 
ATOM 1197 H HE   . ARG A 1 85  ? -27.854 -12.274 15.319  1.00 54.72 ? 85  ARG A HE   1 
ATOM 1198 H HH11 . ARG A 1 85  ? -30.786 -13.785 15.142  1.00 54.72 ? 85  ARG A HH11 1 
ATOM 1199 H HH12 . ARG A 1 85  ? -30.574 -14.697 16.301  1.00 54.72 ? 85  ARG A HH12 1 
ATOM 1200 H HH21 . ARG A 1 85  ? -27.517 -13.697 17.049  1.00 54.72 ? 85  ARG A HH21 1 
ATOM 1201 H HH22 . ARG A 1 85  ? -28.593 -14.643 17.456  1.00 54.72 ? 85  ARG A HH22 1 
ATOM 1202 N N    . THR A 1 86  ? -24.276 -10.210 12.571  1.00 51.92 ? 86  THR A N    1 
ATOM 1203 C CA   . THR A 1 86  ? -22.829 -10.142 12.395  1.00 51.26 ? 86  THR A CA   1 
ATOM 1204 C C    . THR A 1 86  ? -22.049 -11.255 13.098  1.00 51.12 ? 86  THR A C    1 
ATOM 1205 O O    . THR A 1 86  ? -22.090 -11.386 14.323  1.00 52.47 ? 86  THR A O    1 
ATOM 1206 C CB   . THR A 1 86  ? -22.304 -8.784  12.895  1.00 50.88 ? 86  THR A CB   1 
ATOM 1207 O OG1  . THR A 1 86  ? -23.126 -7.737  12.363  1.00 51.50 ? 86  THR A OG1  1 
ATOM 1208 C CG2  . THR A 1 86  ? -20.852 -8.564  12.472  1.00 50.67 ? 86  THR A CG2  1 
ATOM 1209 H H    . THR A 1 86  ? -24.563 -9.781  13.259  1.00 54.72 ? 86  THR A H    1 
ATOM 1210 H HA   . THR A 1 86  ? -22.632 -10.202 11.447  1.00 54.72 ? 86  THR A HA   1 
ATOM 1211 H HB   . THR A 1 86  ? -22.345 -8.763  13.864  1.00 54.72 ? 86  THR A HB   1 
ATOM 1212 H HG1  . THR A 1 86  ? -22.848 -6.990  12.630  1.00 54.72 ? 86  THR A HG1  1 
ATOM 1213 H HG21 . THR A 1 86  ? -20.540 -7.705  12.796  1.00 54.72 ? 86  THR A HG21 1 
ATOM 1214 H HG22 . THR A 1 86  ? -20.290 -9.263  12.840  1.00 54.72 ? 86  THR A HG22 1 
ATOM 1215 H HG23 . THR A 1 86  ? -20.783 -8.580  11.505  1.00 54.72 ? 86  THR A HG23 1 
ATOM 1216 N N    . LEU A 1 87  ? -21.328 -12.043 12.306  1.00 51.26 ? 87  LEU A N    1 
ATOM 1217 C CA   . LEU A 1 87  ? -20.421 -13.058 12.830  1.00 51.34 ? 87  LEU A CA   1 
ATOM 1218 C C    . LEU A 1 87  ? -19.136 -12.396 13.322  1.00 52.35 ? 87  LEU A C    1 
ATOM 1219 O O    . LEU A 1 87  ? -18.400 -11.807 12.530  1.00 52.15 ? 87  LEU A O    1 
ATOM 1220 C CB   . LEU A 1 87  ? -20.105 -14.103 11.753  1.00 50.67 ? 87  LEU A CB   1 
ATOM 1221 C CG   . LEU A 1 87  ? -19.087 -15.187 12.116  1.00 50.94 ? 87  LEU A CG   1 
ATOM 1222 C CD1  . LEU A 1 87  ? -19.658 -16.151 13.139  1.00 51.85 ? 87  LEU A CD1  1 
ATOM 1223 C CD2  . LEU A 1 87  ? -18.651 -15.932 10.871  1.00 49.86 ? 87  LEU A CD2  1 
ATOM 1224 H H    . LEU A 1 87  ? -21.348 -12.008 11.446  1.00 54.72 ? 87  LEU A H    1 
ATOM 1225 H HA   . LEU A 1 87  ? -20.840 -13.508 13.580  1.00 54.72 ? 87  LEU A HA   1 
ATOM 1226 H HB2  . LEU A 1 87  ? -20.931 -14.554 11.519  1.00 54.72 ? 87  LEU A HB2  1 
ATOM 1227 H HB3  . LEU A 1 87  ? -19.763 -13.639 10.974  1.00 54.72 ? 87  LEU A HB3  1 
ATOM 1228 H HG   . LEU A 1 87  ? -18.303 -14.767 12.504  1.00 54.72 ? 87  LEU A HG   1 
ATOM 1229 H HD11 . LEU A 1 87  ? -18.989 -16.823 13.347  1.00 54.72 ? 87  LEU A HD11 1 
ATOM 1230 H HD12 . LEU A 1 87  ? -19.891 -15.657 13.941  1.00 54.72 ? 87  LEU A HD12 1 
ATOM 1231 H HD13 . LEU A 1 87  ? -20.448 -16.573 12.768  1.00 54.72 ? 87  LEU A HD13 1 
ATOM 1232 H HD21 . LEU A 1 87  ? -18.007 -16.613 11.120  1.00 54.72 ? 87  LEU A HD21 1 
ATOM 1233 H HD22 . LEU A 1 87  ? -19.428 -16.345 10.462  1.00 54.72 ? 87  LEU A HD22 1 
ATOM 1234 H HD23 . LEU A 1 87  ? -18.246 -15.304 10.252  1.00 54.72 ? 87  LEU A HD23 1 
ATOM 1235 N N    . VAL A 1 88  ? -18.873 -12.491 14.625  1.00 51.18 ? 88  VAL A N    1 
ATOM 1236 C CA   . VAL A 1 88  ? -17.667 -11.913 15.216  1.00 52.64 ? 88  VAL A CA   1 
ATOM 1237 C C    . VAL A 1 88  ? -16.745 -13.016 15.710  1.00 53.08 ? 88  VAL A C    1 
ATOM 1238 O O    . VAL A 1 88  ? -17.184 -14.145 15.933  1.00 52.66 ? 88  VAL A O    1 
ATOM 1239 C CB   . VAL A 1 88  ? -17.998 -10.963 16.388  1.00 52.84 ? 88  VAL A CB   1 
ATOM 1240 C CG1  . VAL A 1 88  ? -18.908 -9.862  15.914  1.00 52.80 ? 88  VAL A CG1  1 
ATOM 1241 C CG2  . VAL A 1 88  ? -18.650 -11.713 17.541  1.00 53.68 ? 88  VAL A CG2  1 
ATOM 1242 H H    . VAL A 1 88  ? -19.382 -12.888 15.192  1.00 54.72 ? 88  VAL A H    1 
ATOM 1243 H HA   . VAL A 1 88  ? -17.193 -11.405 14.540  1.00 54.72 ? 88  VAL A HA   1 
ATOM 1244 H HB   . VAL A 1 88  ? -17.178 -10.559 16.714  1.00 54.72 ? 88  VAL A HB   1 
ATOM 1245 H HG11 . VAL A 1 88  ? -19.107 -9.274  16.659  1.00 54.72 ? 88  VAL A HG11 1 
ATOM 1246 H HG12 . VAL A 1 88  ? -18.461 -9.365  15.210  1.00 54.72 ? 88  VAL A HG12 1 
ATOM 1247 H HG13 . VAL A 1 88  ? -19.727 -10.254 15.574  1.00 54.72 ? 88  VAL A HG13 1 
ATOM 1248 H HG21 . VAL A 1 88  ? -18.843 -11.086 18.256  1.00 54.72 ? 88  VAL A HG21 1 
ATOM 1249 H HG22 . VAL A 1 88  ? -19.472 -12.121 17.227  1.00 54.72 ? 88  VAL A HG22 1 
ATOM 1250 H HG23 . VAL A 1 88  ? -18.040 -12.398 17.857  1.00 54.72 ? 88  VAL A HG23 1 
ATOM 1251 N N    . VAL A 1 89  ? -15.468 -12.687 15.878  1.00 52.58 ? 89  VAL A N    1 
ATOM 1252 C CA   . VAL A 1 89  ? -14.494 -13.656 16.359  1.00 53.44 ? 89  VAL A CA   1 
ATOM 1253 C C    . VAL A 1 89  ? -13.376 -12.966 17.142  1.00 55.88 ? 89  VAL A C    1 
ATOM 1254 O O    . VAL A 1 89  ? -12.893 -11.904 16.751  1.00 56.70 ? 89  VAL A O    1 
ATOM 1255 C CB   . VAL A 1 89  ? -13.894 -14.469 15.190  1.00 51.12 ? 89  VAL A CB   1 
ATOM 1256 C CG1  . VAL A 1 89  ? -13.355 -13.545 14.112  1.00 51.01 ? 89  VAL A CG1  1 
ATOM 1257 C CG2  . VAL A 1 89  ? -12.809 -15.417 15.684  1.00 52.48 ? 89  VAL A CG2  1 
ATOM 1258 H H    . VAL A 1 89  ? -15.142 -11.907 15.719  1.00 54.72 ? 89  VAL A H    1 
ATOM 1259 H HA   . VAL A 1 89  ? -14.938 -14.277 16.957  1.00 54.72 ? 89  VAL A HA   1 
ATOM 1260 H HB   . VAL A 1 89  ? -14.597 -15.006 14.793  1.00 54.72 ? 89  VAL A HB   1 
ATOM 1261 H HG11 . VAL A 1 89  ? -12.986 -14.081 13.393  1.00 54.72 ? 89  VAL A HG11 1 
ATOM 1262 H HG12 . VAL A 1 89  ? -14.081 -12.995 13.777  1.00 54.72 ? 89  VAL A HG12 1 
ATOM 1263 H HG13 . VAL A 1 89  ? -12.664 -12.983 14.495  1.00 54.72 ? 89  VAL A HG13 1 
ATOM 1264 H HG21 . VAL A 1 89  ? -12.454 -15.911 14.929  1.00 54.72 ? 89  VAL A HG21 1 
ATOM 1265 H HG22 . VAL A 1 89  ? -12.103 -14.899 16.102  1.00 54.72 ? 89  VAL A HG22 1 
ATOM 1266 H HG23 . VAL A 1 89  ? -13.195 -16.031 16.329  1.00 54.72 ? 89  VAL A HG23 1 
ATOM 1267 N N    . HIS A 1 90  ? -12.970 -13.578 18.251  1.00 55.93 ? 90  HIS A N    1 
ATOM 1268 C CA   . HIS A 1 90  ? -11.956 -12.992 19.123  1.00 58.66 ? 90  HIS A CA   1 
ATOM 1269 C C    . HIS A 1 90  ? -10.551 -13.127 18.548  1.00 59.71 ? 90  HIS A C    1 
ATOM 1270 O O    . HIS A 1 90  ? -10.136 -14.214 18.150  1.00 59.14 ? 90  HIS A O    1 
ATOM 1271 C CB   . HIS A 1 90  ? -11.996 -13.644 20.507  1.00 62.44 ? 90  HIS A CB   1 
ATOM 1272 C CG   . HIS A 1 90  ? -13.219 -13.305 21.300  1.00 62.57 ? 90  HIS A CG   1 
ATOM 1273 N ND1  . HIS A 1 90  ? -13.341 -13.601 22.640  1.00 64.58 ? 90  HIS A ND1  1 
ATOM 1274 C CD2  . HIS A 1 90  ? -14.372 -12.693 20.942  1.00 61.30 ? 90  HIS A CD2  1 
ATOM 1275 C CE1  . HIS A 1 90  ? -14.518 -13.184 23.074  1.00 64.61 ? 90  HIS A CE1  1 
ATOM 1276 N NE2  . HIS A 1 90  ? -15.163 -12.633 22.062  1.00 62.65 ? 90  HIS A NE2  1 
ATOM 1277 H H    . HIS A 1 90  ? -13.268 -14.338 18.523  1.00 54.72 ? 90  HIS A H    1 
ATOM 1278 H HA   . HIS A 1 90  ? -12.145 -12.047 19.233  1.00 54.72 ? 90  HIS A HA   1 
ATOM 1279 H HB2  . HIS A 1 90  ? -11.971 -14.608 20.398  1.00 54.72 ? 90  HIS A HB2  1 
ATOM 1280 H HB3  . HIS A 1 90  ? -11.223 -13.350 21.013  1.00 54.72 ? 90  HIS A HB3  1 
ATOM 1281 H HD2  . HIS A 1 90  ? -14.588 -12.375 20.095  1.00 54.72 ? 90  HIS A HD2  1 
ATOM 1282 H HE1  . HIS A 1 90  ? -14.838 -13.269 23.943  1.00 54.72 ? 90  HIS A HE1  1 
ATOM 1283 H HE2  . HIS A 1 90  ? -15.951 -12.289 22.100  1.00 54.72 ? 90  HIS A HE2  1 
ATOM 1284 N N    . GLU A 1 91  ? -9.817  -12.020 18.514  1.00 60.82 ? 91  GLU A N    1 
ATOM 1285 C CA   . GLU A 1 91  ? -8.415  -12.050 18.113  1.00 62.75 ? 91  GLU A CA   1 
ATOM 1286 C C    . GLU A 1 91  ? -7.555  -12.500 19.281  1.00 65.47 ? 91  GLU A C    1 
ATOM 1287 O O    . GLU A 1 91  ? -6.494  -13.093 19.093  1.00 66.90 ? 91  GLU A O    1 
ATOM 1288 C CB   . GLU A 1 91  ? -7.957  -10.678 17.626  1.00 67.26 ? 91  GLU A CB   1 
ATOM 1289 C CG   . GLU A 1 91  ? -8.751  -10.163 16.445  1.00 64.98 ? 91  GLU A CG   1 
ATOM 1290 C CD   . GLU A 1 91  ? -8.176  -8.883  15.870  1.00 67.19 ? 91  GLU A CD   1 
ATOM 1291 O OE1  . GLU A 1 91  ? -7.151  -8.399  16.403  1.00 70.63 ? 91  GLU A OE1  1 
ATOM 1292 O OE2  . GLU A 1 91  ? -8.743  -8.367  14.882  1.00 65.82 ? 91  GLU A OE2  1 
ATOM 1293 H H    . GLU A 1 91  ? -10.108 -11.237 18.720  1.00 54.72 ? 91  GLU A H    1 
ATOM 1294 H HA   . GLU A 1 91  ? -8.302  -12.684 17.388  1.00 54.72 ? 91  GLU A HA   1 
ATOM 1295 H HB2  . GLU A 1 91  ? -8.053  -10.040 18.351  1.00 54.72 ? 91  GLU A HB2  1 
ATOM 1296 H HB3  . GLU A 1 91  ? -7.026  -10.735 17.358  1.00 54.72 ? 91  GLU A HB3  1 
ATOM 1297 H HG2  . GLU A 1 91  ? -8.748  -10.835 15.745  1.00 54.72 ? 91  GLU A HG2  1 
ATOM 1298 H HG3  . GLU A 1 91  ? -9.661  -9.983  16.730  1.00 54.72 ? 91  GLU A HG3  1 
ATOM 1299 N N    . LYS A 1 92  ? -8.028  -12.206 20.488  1.00 66.47 ? 92  LYS A N    1 
ATOM 1300 C CA   . LYS A 1 92  ? -7.341  -12.597 21.712  1.00 69.24 ? 92  LYS A CA   1 
ATOM 1301 C C    . LYS A 1 92  ? -7.664  -14.043 22.063  1.00 68.10 ? 92  LYS A C    1 
ATOM 1302 O O    . LYS A 1 92  ? -8.798  -14.368 22.414  1.00 66.51 ? 92  LYS A O    1 
ATOM 1303 C CB   . LYS A 1 92  ? -7.740  -11.671 22.861  1.00 71.13 ? 92  LYS A CB   1 
ATOM 1304 C CG   . LYS A 1 92  ? -6.998  -11.918 24.164  1.00 74.50 ? 92  LYS A CG   1 
ATOM 1305 C CD   . LYS A 1 92  ? -7.582  -11.064 25.281  1.00 76.24 ? 92  LYS A CD   1 
ATOM 1306 C CE   . LYS A 1 92  ? -6.586  -10.813 26.403  1.00 80.55 ? 92  LYS A CE   1 
ATOM 1307 N NZ   . LYS A 1 92  ? -6.123  -12.073 27.040  1.00 81.42 ? 92  LYS A NZ   1 
ATOM 1308 H H    . LYS A 1 92  ? -8.758  -11.773 20.626  1.00 54.72 ? 92  LYS A H    1 
ATOM 1309 H HA   . LYS A 1 92  ? -6.383  -12.522 21.580  1.00 54.72 ? 92  LYS A HA   1 
ATOM 1310 H HB2  . LYS A 1 92  ? -7.566  -10.755 22.594  1.00 54.72 ? 92  LYS A HB2  1 
ATOM 1311 H HB3  . LYS A 1 92  ? -8.687  -11.785 23.036  1.00 54.72 ? 92  LYS A HB3  1 
ATOM 1312 H HG2  . LYS A 1 92  ? -7.085  -12.851 24.414  1.00 54.72 ? 92  LYS A HG2  1 
ATOM 1313 H HG3  . LYS A 1 92  ? -6.064  -11.682 24.054  1.00 54.72 ? 92  LYS A HG3  1 
ATOM 1314 H HD2  . LYS A 1 92  ? -7.848  -10.205 24.917  1.00 54.72 ? 92  LYS A HD2  1 
ATOM 1315 H HD3  . LYS A 1 92  ? -8.352  -11.518 25.658  1.00 54.72 ? 92  LYS A HD3  1 
ATOM 1316 H HE2  . LYS A 1 92  ? -5.811  -10.355 26.043  1.00 54.72 ? 92  LYS A HE2  1 
ATOM 1317 H HE3  . LYS A 1 92  ? -7.008  -10.268 27.086  1.00 54.72 ? 92  LYS A HE3  1 
ATOM 1318 H HZ1  . LYS A 1 92  ? -5.544  -11.890 27.690  1.00 54.72 ? 92  LYS A HZ1  1 
ATOM 1319 H HZ2  . LYS A 1 92  ? -6.817  -12.511 27.385  1.00 54.72 ? 92  LYS A HZ2  1 
ATOM 1320 H HZ3  . LYS A 1 92  ? -5.726  -12.591 26.435  1.00 54.72 ? 92  LYS A HZ3  1 
ATOM 1321 N N    . ALA A 1 93  ? -6.658  -14.906 21.971  1.00 69.35 ? 93  ALA A N    1 
ATOM 1322 C CA   . ALA A 1 93  ? -6.855  -16.334 22.194  1.00 68.69 ? 93  ALA A CA   1 
ATOM 1323 C C    . ALA A 1 93  ? -7.063  -16.657 23.668  1.00 70.63 ? 93  ALA A C    1 
ATOM 1324 O O    . ALA A 1 93  ? -6.170  -16.436 24.485  1.00 73.78 ? 93  ALA A O    1 
ATOM 1325 C CB   . ALA A 1 93  ? -5.670  -17.118 21.660  1.00 69.97 ? 93  ALA A CB   1 
ATOM 1326 H H    . ALA A 1 93  ? -5.848  -14.690 21.781  1.00 54.72 ? 93  ALA A H    1 
ATOM 1327 H HA   . ALA A 1 93  ? -7.646  -16.622 21.711  1.00 54.72 ? 93  ALA A HA   1 
ATOM 1328 H HB1  . ALA A 1 93  ? -5.820  -18.063 21.817  1.00 54.72 ? 93  ALA A HB1  1 
ATOM 1329 H HB2  . ALA A 1 93  ? -5.584  -16.950 20.708  1.00 54.72 ? 93  ALA A HB2  1 
ATOM 1330 H HB3  . ALA A 1 93  ? -4.867  -16.828 22.121  1.00 54.72 ? 93  ALA A HB3  1 
ATOM 1331 N N    . GLY A 1 94  ? -8.241  -17.181 24.003  1.00 69.12 ? 94  GLY A N    1 
ATOM 1332 C CA   . GLY A 1 94  ? -8.499  -17.661 25.349  1.00 71.15 ? 94  GLY A CA   1 
ATOM 1333 C C    . GLY A 1 94  ? -9.924  -17.466 25.822  1.00 70.14 ? 94  GLY A C    1 
ATOM 1334 O O    . GLY A 1 94  ? -10.878 -17.760 25.099  1.00 67.59 ? 94  GLY A O    1 
ATOM 1335 H H    . GLY A 1 94  ? -8.906  -17.268 23.465  1.00 54.72 ? 94  GLY A H    1 
ATOM 1336 H HA2  . GLY A 1 94  ? -8.296  -18.609 25.391  1.00 54.72 ? 94  GLY A HA2  1 
ATOM 1337 H HA3  . GLY A 1 94  ? -7.912  -17.199 25.967  1.00 54.72 ? 94  GLY A HA3  1 
ATOM 1338 N N    . ALA A 1 95  ? -10.054 -16.968 27.048  1.00 72.53 ? 95  ALA A N    1 
ATOM 1339 C CA   . ALA A 1 95  ? -11.349 -16.776 27.681  1.00 72.47 ? 95  ALA A CA   1 
ATOM 1340 C C    . ALA A 1 95  ? -11.553 -15.303 27.974  1.00 73.20 ? 95  ALA A C    1 
ATOM 1341 O O    . ALA A 1 95  ? -10.630 -14.500 27.831  1.00 74.19 ? 95  ALA A O    1 
ATOM 1342 C CB   . ALA A 1 95  ? -11.451 -17.592 28.964  1.00 75.25 ? 95  ALA A CB   1 
ATOM 1343 H H    . ALA A 1 95  ? -9.391  -16.731 27.542  1.00 54.72 ? 95  ALA A H    1 
ATOM 1344 H HA   . ALA A 1 95  ? -12.050 -17.067 27.076  1.00 54.72 ? 95  ALA A HA   1 
ATOM 1345 H HB1  . ALA A 1 95  ? -12.323 -17.445 29.364  1.00 54.72 ? 95  ALA A HB1  1 
ATOM 1346 H HB2  . ALA A 1 95  ? -11.340 -18.532 28.750  1.00 54.72 ? 95  ALA A HB2  1 
ATOM 1347 H HB3  . ALA A 1 95  ? -10.754 -17.307 29.576  1.00 54.72 ? 95  ALA A HB3  1 
ATOM 1348 N N    . GLY A 1 96  ? -12.770 -14.961 28.379  1.00 73.11 ? 96  GLY A N    1 
ATOM 1349 C CA   . GLY A 1 96  ? -13.088 -13.617 28.822  1.00 74.40 ? 96  GLY A CA   1 
ATOM 1350 C C    . GLY A 1 96  ? -13.669 -12.721 27.743  1.00 71.96 ? 96  GLY A C    1 
ATOM 1351 O O    . GLY A 1 96  ? -13.752 -13.104 26.574  1.00 69.13 ? 96  GLY A O    1 
ATOM 1352 H H    . GLY A 1 96  ? -13.438 -15.501 28.405  1.00 54.72 ? 96  GLY A H    1 
ATOM 1353 H HA2  . GLY A 1 96  ? -13.729 -13.667 29.548  1.00 54.72 ? 96  GLY A HA2  1 
ATOM 1354 H HA3  . GLY A 1 96  ? -12.282 -13.196 29.159  1.00 54.72 ? 96  GLY A HA3  1 
ATOM 1355 N N    . ALA A 1 97  ? -14.067 -11.518 28.149  1.00 73.71 ? 97  ALA A N    1 
ATOM 1356 C CA   . ALA A 1 97  ? -14.693 -10.560 27.244  1.00 72.01 ? 97  ALA A CA   1 
ATOM 1357 C C    . ALA A 1 97  ? -13.680 -9.971  26.265  1.00 71.25 ? 97  ALA A C    1 
ATOM 1358 O O    . ALA A 1 97  ? -13.191 -8.858  26.463  1.00 73.32 ? 97  ALA A O    1 
ATOM 1359 C CB   . ALA A 1 97  ? -15.368 -9.444  28.042  1.00 74.11 ? 97  ALA A CB   1 
ATOM 1360 H H    . ALA A 1 97  ? -13.984 -11.230 28.954  1.00 54.72 ? 97  ALA A H    1 
ATOM 1361 H HA   . ALA A 1 97  ? -15.377 -11.015 26.729  1.00 54.72 ? 97  ALA A HA   1 
ATOM 1362 H HB1  . ALA A 1 97  ? -15.777 -8.818  27.425  1.00 54.72 ? 97  ALA A HB1  1 
ATOM 1363 H HB2  . ALA A 1 97  ? -16.045 -9.834  28.618  1.00 54.72 ? 97  ALA A HB2  1 
ATOM 1364 H HB3  . ALA A 1 97  ? -14.698 -8.991  28.578  1.00 54.72 ? 97  ALA A HB3  1 
ATOM 1365 N N    . GLY A 1 98  ? -13.372 -10.722 25.210  1.00 69.83 ? 98  GLY A N    1 
ATOM 1366 C CA   . GLY A 1 98  ? -12.491 -10.245 24.158  1.00 69.17 ? 98  GLY A CA   1 
ATOM 1367 C C    . GLY A 1 98  ? -13.008 -8.951  23.565  1.00 68.91 ? 98  GLY A C    1 
ATOM 1368 O O    . GLY A 1 98  ? -14.218 -8.733  23.502  1.00 67.83 ? 98  GLY A O    1 
ATOM 1369 H H    . GLY A 1 98  ? -13.666 -11.520 25.082  1.00 54.72 ? 98  GLY A H    1 
ATOM 1370 H HA2  . GLY A 1 98  ? -11.604 -10.091 24.518  1.00 54.72 ? 98  GLY A HA2  1 
ATOM 1371 H HA3  . GLY A 1 98  ? -12.431 -10.909 23.454  1.00 54.72 ? 98  GLY A HA3  1 
ATOM 1372 N N    . SER A 1 99  ? -12.091 -8.092  23.131  1.00 68.82 ? 99  SER A N    1 
ATOM 1373 C CA   . SER A 1 99  ? -12.456 -6.770  22.635  1.00 69.37 ? 99  SER A CA   1 
ATOM 1374 C C    . SER A 1 99  ? -11.927 -6.496  21.226  1.00 68.20 ? 99  SER A C    1 
ATOM 1375 O O    . SER A 1 99  ? -12.635 -5.922  20.400  1.00 66.88 ? 99  SER A O    1 
ATOM 1376 C CB   . SER A 1 99  ? -11.954 -5.697  23.605  1.00 73.43 ? 99  SER A CB   1 
ATOM 1377 O OG   . SER A 1 99  ? -10.638 -5.980  24.045  1.00 75.68 ? 99  SER A OG   1 
ATOM 1378 H H    . SER A 1 99  ? -11.246 -8.252  23.113  1.00 54.72 ? 99  SER A H    1 
ATOM 1379 H HA   . SER A 1 99  ? -13.423 -6.708  22.602  1.00 54.72 ? 99  SER A HA   1 
ATOM 1380 H HB2  . SER A 1 99  ? -11.958 -4.839  23.154  1.00 54.72 ? 99  SER A HB2  1 
ATOM 1381 H HB3  . SER A 1 99  ? -12.544 -5.669  24.374  1.00 54.72 ? 99  SER A HB3  1 
ATOM 1382 H HG   . SER A 1 99  ? -10.378 -5.383  24.576  1.00 54.72 ? 99  SER A HG   1 
ATOM 1383 N N    . ARG A 1 100 ? -10.689 -6.893  20.953  1.00 69.03 ? 100 ARG A N    1 
ATOM 1384 C CA   . ARG A 1 100 ? -10.143 -6.782  19.604  1.00 68.18 ? 100 ARG A CA   1 
ATOM 1385 C C    . ARG A 1 100 ? -10.789 -7.850  18.723  1.00 64.30 ? 100 ARG A C    1 
ATOM 1386 O O    . ARG A 1 100 ? -10.486 -9.034  18.860  1.00 63.37 ? 100 ARG A O    1 
ATOM 1387 C CB   . ARG A 1 100 ? -8.618  -6.927  19.618  1.00 70.79 ? 100 ARG A CB   1 
ATOM 1388 C CG   . ARG A 1 100 ? -7.908  -5.800  20.358  1.00 75.18 ? 100 ARG A CG   1 
ATOM 1389 C CD   . ARG A 1 100 ? -6.396  -5.985  20.411  1.00 78.29 ? 100 ARG A CD   1 
ATOM 1390 N NE   . ARG A 1 100 ? -5.711  -5.188  19.391  1.00 80.16 ? 100 ARG A NE   1 
ATOM 1391 C CZ   . ARG A 1 100 ? -5.250  -5.654  18.230  1.00 79.06 ? 100 ARG A CZ   1 
ATOM 1392 N NH1  . ARG A 1 100 ? -5.378  -6.935  17.902  1.00 76.02 ? 100 ARG A NH1  1 
ATOM 1393 N NH2  . ARG A 1 100 ? -4.648  -4.827  17.386  1.00 81.43 ? 100 ARG A NH2  1 
ATOM 1394 H H    . ARG A 1 100 ? -10.145 -7.230  21.529  1.00 54.72 ? 100 ARG A H    1 
ATOM 1395 H HA   . ARG A 1 100 ? -10.364 -5.911  19.239  1.00 54.72 ? 100 ARG A HA   1 
ATOM 1396 H HB2  . ARG A 1 100 ? -8.386  -7.762  20.053  1.00 54.72 ? 100 ARG A HB2  1 
ATOM 1397 H HB3  . ARG A 1 100 ? -8.296  -6.931  18.703  1.00 54.72 ? 100 ARG A HB3  1 
ATOM 1398 H HG2  . ARG A 1 100 ? -8.092  -4.961  19.907  1.00 54.72 ? 100 ARG A HG2  1 
ATOM 1399 H HG3  . ARG A 1 100 ? -8.238  -5.765  21.270  1.00 54.72 ? 100 ARG A HG3  1 
ATOM 1400 H HD2  . ARG A 1 100 ? -6.071  -5.705  21.282  1.00 54.72 ? 100 ARG A HD2  1 
ATOM 1401 H HD3  . ARG A 1 100 ? -6.183  -6.919  20.259  1.00 54.72 ? 100 ARG A HD3  1 
ATOM 1402 H HE   . ARG A 1 100 ? -5.596  -4.351  19.554  1.00 54.72 ? 100 ARG A HE   1 
ATOM 1403 H HH11 . ARG A 1 100 ? -5.767  -7.480  18.442  1.00 54.72 ? 100 ARG A HH11 1 
ATOM 1404 H HH12 . ARG A 1 100 ? -5.074  -7.219  17.150  1.00 54.72 ? 100 ARG A HH12 1 
ATOM 1405 H HH21 . ARG A 1 100 ? -4.558  -3.996  17.589  1.00 54.72 ? 100 ARG A HH21 1 
ATOM 1406 H HH22 . ARG A 1 100 ? -4.346  -5.121  16.637  1.00 54.72 ? 100 ARG A HH22 1 
ATOM 1407 N N    . LEU A 1 101 ? -11.681 -7.427  17.829  1.00 64.08 ? 101 LEU A N    1 
ATOM 1408 C CA   . LEU A 1 101 ? -12.496 -8.359  17.047  1.00 60.65 ? 101 LEU A CA   1 
ATOM 1409 C C    . LEU A 1 101 ? -12.177 -8.313  15.557  1.00 59.48 ? 101 LEU A C    1 
ATOM 1410 O O    . LEU A 1 101 ? -11.370 -7.505  15.097  1.00 61.39 ? 101 LEU A O    1 
ATOM 1411 C CB   . LEU A 1 101 ? -13.987 -8.061  17.231  1.00 59.73 ? 101 LEU A CB   1 
ATOM 1412 C CG   . LEU A 1 101 ? -14.567 -8.041  18.642  1.00 61.01 ? 101 LEU A CG   1 
ATOM 1413 C CD1  . LEU A 1 101 ? -15.935 -7.412  18.595  1.00 60.53 ? 101 LEU A CD1  1 
ATOM 1414 C CD2  . LEU A 1 101 ? -14.664 -9.437  19.221  1.00 60.11 ? 101 LEU A CD2  1 
ATOM 1415 H H    . LEU A 1 101 ? -11.835 -6.599  17.654  1.00 54.72 ? 101 LEU A H    1 
ATOM 1416 H HA   . LEU A 1 101 ? -12.329 -9.262  17.361  1.00 54.72 ? 101 LEU A HA   1 
ATOM 1417 H HB2  . LEU A 1 101 ? -14.163 -7.188  16.845  1.00 54.72 ? 101 LEU A HB2  1 
ATOM 1418 H HB3  . LEU A 1 101 ? -14.485 -8.729  16.734  1.00 54.72 ? 101 LEU A HB3  1 
ATOM 1419 H HG   . LEU A 1 101 ? -14.001 -7.506  19.219  1.00 54.72 ? 101 LEU A HG   1 
ATOM 1420 H HD11 . LEU A 1 101 ? -16.308 -7.397  19.490  1.00 54.72 ? 101 LEU A HD11 1 
ATOM 1421 H HD12 . LEU A 1 101 ? -15.854 -6.506  18.255  1.00 54.72 ? 101 LEU A HD12 1 
ATOM 1422 H HD13 . LEU A 1 101 ? -16.503 -7.935  18.008  1.00 54.72 ? 101 LEU A HD13 1 
ATOM 1423 H HD21 . LEU A 1 101 ? -15.035 -9.382  20.116  1.00 54.72 ? 101 LEU A HD21 1 
ATOM 1424 H HD22 . LEU A 1 101 ? -15.240 -9.974  18.656  1.00 54.72 ? 101 LEU A HD22 1 
ATOM 1425 H HD23 . LEU A 1 101 ? -13.776 -9.826  19.255  1.00 54.72 ? 101 LEU A HD23 1 
ATOM 1426 N N    . ALA A 1 102 ? -12.835 -9.200  14.818  1.00 59.68 ? 102 ALA A N    1 
ATOM 1427 C CA   . ALA A 1 102 ? -12.878 -9.159  13.362  1.00 58.30 ? 102 ALA A CA   1 
ATOM 1428 C C    . ALA A 1 102 ? -14.289 -9.564  12.934  1.00 55.68 ? 102 ALA A C    1 
ATOM 1429 O O    . ALA A 1 102 ? -14.743 -10.659 13.262  1.00 54.38 ? 102 ALA A O    1 
ATOM 1430 C CB   . ALA A 1 102 ? -11.835 -10.086 12.755  1.00 58.89 ? 102 ALA A CB   1 
ATOM 1431 H H    . ALA A 1 102 ? -13.279 -9.858  15.150  1.00 54.72 ? 102 ALA A H    1 
ATOM 1432 H HA   . ALA A 1 102 ? -12.707 -8.255  13.055  1.00 54.72 ? 102 ALA A HA   1 
ATOM 1433 H HB1  . ALA A 1 102 ? -11.891 -10.033 11.788  1.00 54.72 ? 102 ALA A HB1  1 
ATOM 1434 H HB2  . ALA A 1 102 ? -10.954 -9.806  13.051  1.00 54.72 ? 102 ALA A HB2  1 
ATOM 1435 H HB3  . ALA A 1 102 ? -12.010 -10.993 13.048  1.00 54.72 ? 102 ALA A HB3  1 
ATOM 1436 N N    . SER A 1 103 ? -14.983 -8.681  12.218  1.00 56.53 ? 103 SER A N    1 
ATOM 1437 C CA   . SER A 1 103 ? -16.400 -8.881  11.914  1.00 54.67 ? 103 SER A CA   1 
ATOM 1438 C C    . SER A 1 103 ? -16.667 -9.187  10.441  1.00 52.97 ? 103 SER A C    1 
ATOM 1439 O O    . SER A 1 103 ? -15.852 -8.884  9.569   1.00 53.49 ? 103 SER A O    1 
ATOM 1440 C CB   . SER A 1 103 ? -17.196 -7.639  12.322  1.00 56.68 ? 103 SER A CB   1 
ATOM 1441 O OG   . SER A 1 103 ? -16.763 -6.506  11.589  1.00 57.96 ? 103 SER A OG   1 
ATOM 1442 H H    . SER A 1 103 ? -14.655 -7.955  11.895  1.00 54.72 ? 103 SER A H    1 
ATOM 1443 H HA   . SER A 1 103 ? -16.729 -9.629  12.437  1.00 54.72 ? 103 SER A HA   1 
ATOM 1444 H HB2  . SER A 1 103 ? -18.136 -7.792  12.141  1.00 54.72 ? 103 SER A HB2  1 
ATOM 1445 H HB3  . SER A 1 103 ? -17.061 -7.474  13.268  1.00 54.72 ? 103 SER A HB3  1 
ATOM 1446 H HG   . SER A 1 103 ? -17.205 -5.829  11.819  1.00 54.72 ? 103 SER A HG   1 
ATOM 1447 N N    . GLY A 1 104 ? -17.825 -9.785  10.178  1.00 52.98 ? 104 GLY A N    1 
ATOM 1448 C CA   . GLY A 1 104 ? -18.279 -10.051 8.825   1.00 51.56 ? 104 GLY A CA   1 
ATOM 1449 C C    . GLY A 1 104 ? -19.780 -10.254 8.828   1.00 50.68 ? 104 GLY A C    1 
ATOM 1450 O O    . GLY A 1 104 ? -20.274 -11.283 9.290   1.00 50.08 ? 104 GLY A O    1 
ATOM 1451 H H    . GLY A 1 104 ? -18.376 -10.050 10.783  1.00 54.72 ? 104 GLY A H    1 
ATOM 1452 H HA2  . GLY A 1 104 ? -18.061 -9.303  8.247   1.00 54.72 ? 104 GLY A HA2  1 
ATOM 1453 H HA3  . GLY A 1 104 ? -17.851 -10.851 8.482   1.00 54.72 ? 104 GLY A HA3  1 
ATOM 1454 N N    . VAL A 1 105 ? -20.511 -9.263  8.326   1.00 50.22 ? 105 VAL A N    1 
ATOM 1455 C CA   . VAL A 1 105 ? -21.966 -9.332  8.298   1.00 49.91 ? 105 VAL A CA   1 
ATOM 1456 C C    . VAL A 1 105 ? -22.400 -10.407 7.310   1.00 48.44 ? 105 VAL A C    1 
ATOM 1457 O O    . VAL A 1 105 ? -21.868 -10.504 6.205   1.00 47.80 ? 105 VAL A O    1 
ATOM 1458 C CB   . VAL A 1 105 ? -22.592 -7.974  7.925   1.00 47.64 ? 105 VAL A CB   1 
ATOM 1459 C CG1  . VAL A 1 105 ? -24.064 -8.124  7.566   1.00 47.45 ? 105 VAL A CG1  1 
ATOM 1460 C CG2  . VAL A 1 105 ? -22.443 -6.998  9.074   1.00 49.53 ? 105 VAL A CG2  1 
ATOM 1461 H H    . VAL A 1 105 ? -20.186 -8.538  7.995   1.00 54.72 ? 105 VAL A H    1 
ATOM 1462 H HA   . VAL A 1 105 ? -22.289 -9.581  9.178   1.00 54.72 ? 105 VAL A HA   1 
ATOM 1463 H HB   . VAL A 1 105 ? -22.128 -7.609  7.155   1.00 54.72 ? 105 VAL A HB   1 
ATOM 1464 H HG11 . VAL A 1 105 ? -24.424 -7.253  7.338   1.00 54.72 ? 105 VAL A HG11 1 
ATOM 1465 H HG12 . VAL A 1 105 ? -24.145 -8.725  6.809   1.00 54.72 ? 105 VAL A HG12 1 
ATOM 1466 H HG13 . VAL A 1 105 ? -24.539 -8.488  8.330   1.00 54.72 ? 105 VAL A HG13 1 
ATOM 1467 H HG21 . VAL A 1 105 ? -22.841 -6.150  8.822   1.00 54.72 ? 105 VAL A HG21 1 
ATOM 1468 H HG22 . VAL A 1 105 ? -22.894 -7.357  9.854   1.00 54.72 ? 105 VAL A HG22 1 
ATOM 1469 H HG23 . VAL A 1 105 ? -21.499 -6.876  9.265   1.00 54.72 ? 105 VAL A HG23 1 
ATOM 1470 N N    . ILE A 1 106 ? -23.363 -11.219 7.729   1.00 48.11 ? 106 ILE A N    1 
ATOM 1471 C CA   . ILE A 1 106 ? -23.826 -12.348 6.936   1.00 47.19 ? 106 ILE A CA   1 
ATOM 1472 C C    . ILE A 1 106 ? -24.781 -11.893 5.831   1.00 47.15 ? 106 ILE A C    1 
ATOM 1473 O O    . ILE A 1 106 ? -25.818 -11.294 6.110   1.00 48.12 ? 106 ILE A O    1 
ATOM 1474 C CB   . ILE A 1 106 ? -24.522 -13.389 7.833   1.00 46.65 ? 106 ILE A CB   1 
ATOM 1475 C CG1  . ILE A 1 106 ? -23.543 -13.890 8.900   1.00 46.89 ? 106 ILE A CG1  1 
ATOM 1476 C CG2  . ILE A 1 106 ? -25.044 -14.556 7.003   1.00 46.22 ? 106 ILE A CG2  1 
ATOM 1477 C CD1  . ILE A 1 106 ? -24.167 -14.756 9.968   1.00 47.96 ? 106 ILE A CD1  1 
ATOM 1478 H H    . ILE A 1 106 ? -23.771 -11.134 8.482   1.00 54.72 ? 106 ILE A H    1 
ATOM 1479 H HA   . ILE A 1 106 ? -23.062 -12.775 6.517   1.00 54.72 ? 106 ILE A HA   1 
ATOM 1480 H HB   . ILE A 1 106 ? -25.272 -12.964 8.277   1.00 54.72 ? 106 ILE A HB   1 
ATOM 1481 H HG12 . ILE A 1 106 ? -22.852 -14.413 8.465   1.00 54.72 ? 106 ILE A HG12 1 
ATOM 1482 H HG13 . ILE A 1 106 ? -23.144 -13.123 9.339   1.00 54.72 ? 106 ILE A HG13 1 
ATOM 1483 H HG21 . ILE A 1 106 ? -25.476 -15.193 7.593   1.00 54.72 ? 106 ILE A HG21 1 
ATOM 1484 H HG22 . ILE A 1 106 ? -25.682 -14.220 6.354   1.00 54.72 ? 106 ILE A HG22 1 
ATOM 1485 H HG23 . ILE A 1 106 ? -24.299 -14.978 6.548   1.00 54.72 ? 106 ILE A HG23 1 
ATOM 1486 H HD11 . ILE A 1 106 ? -23.479 -15.026 10.596  1.00 54.72 ? 106 ILE A HD11 1 
ATOM 1487 H HD12 . ILE A 1 106 ? -24.853 -14.246 10.427  1.00 54.72 ? 106 ILE A HD12 1 
ATOM 1488 H HD13 . ILE A 1 106 ? -24.559 -15.539 9.550   1.00 54.72 ? 106 ILE A HD13 1 
ATOM 1489 N N    . GLY A 1 107 ? -24.422 -12.187 4.581   1.00 48.69 ? 107 GLY A N    1 
ATOM 1490 C CA   . GLY A 1 107 ? -25.225 -11.810 3.428   1.00 48.79 ? 107 GLY A CA   1 
ATOM 1491 C C    . GLY A 1 107 ? -25.603 -13.024 2.594   1.00 48.30 ? 107 GLY A C    1 
ATOM 1492 O O    . GLY A 1 107 ? -24.973 -14.074 2.705   1.00 47.80 ? 107 GLY A O    1 
ATOM 1493 H H    . GLY A 1 107 ? -23.703 -12.612 4.376   1.00 54.72 ? 107 GLY A H    1 
ATOM 1494 H HA2  . GLY A 1 107 ? -26.038 -11.371 3.725   1.00 54.72 ? 107 GLY A HA2  1 
ATOM 1495 H HA3  . GLY A 1 107 ? -24.726 -11.193 2.870   1.00 54.72 ? 107 GLY A HA3  1 
ATOM 1496 N N    . ILE A 1 108 ? -26.624 -12.877 1.753   1.00 51.62 ? 108 ILE A N    1 
ATOM 1497 C CA   . ILE A 1 108 ? -27.183 -13.998 0.991   1.00 51.70 ? 108 ILE A CA   1 
ATOM 1498 C C    . ILE A 1 108 ? -26.316 -14.405 -0.198  1.00 50.97 ? 108 ILE A C    1 
ATOM 1499 O O    . ILE A 1 108 ? -25.736 -13.555 -0.873  1.00 50.80 ? 108 ILE A O    1 
ATOM 1500 C CB   . ILE A 1 108 ? -28.602 -13.656 0.482   1.00 50.37 ? 108 ILE A CB   1 
ATOM 1501 C CG1  . ILE A 1 108 ? -29.592 -13.757 1.639   1.00 51.65 ? 108 ILE A CG1  1 
ATOM 1502 C CG2  . ILE A 1 108 ? -29.034 -14.594 -0.658  1.00 50.70 ? 108 ILE A CG2  1 
ATOM 1503 C CD1  . ILE A 1 108 ? -30.974 -13.228 1.337   1.00 53.36 ? 108 ILE A CD1  1 
ATOM 1504 H H    . ILE A 1 108 ? -27.017 -12.127 1.601   1.00 54.72 ? 108 ILE A H    1 
ATOM 1505 H HA   . ILE A 1 108 ? -27.257 -14.766 1.579   1.00 54.72 ? 108 ILE A HA   1 
ATOM 1506 H HB   . ILE A 1 108 ? -28.603 -12.744 0.151   1.00 54.72 ? 108 ILE A HB   1 
ATOM 1507 H HG12 . ILE A 1 108 ? -29.683 -14.690 1.888   1.00 54.72 ? 108 ILE A HG12 1 
ATOM 1508 H HG13 . ILE A 1 108 ? -29.242 -13.252 2.390   1.00 54.72 ? 108 ILE A HG13 1 
ATOM 1509 H HG21 . ILE A 1 108 ? -29.926 -14.348 -0.948  1.00 54.72 ? 108 ILE A HG21 1 
ATOM 1510 H HG22 . ILE A 1 108 ? -28.410 -14.505 -1.394  1.00 54.72 ? 108 ILE A HG22 1 
ATOM 1511 H HG23 . ILE A 1 108 ? -29.033 -15.508 -0.331  1.00 54.72 ? 108 ILE A HG23 1 
ATOM 1512 H HD11 . ILE A 1 108 ? -31.531 -13.332 2.125   1.00 54.72 ? 108 ILE A HD11 1 
ATOM 1513 H HD12 . ILE A 1 108 ? -30.908 -12.289 1.100   1.00 54.72 ? 108 ILE A HD12 1 
ATOM 1514 H HD13 . ILE A 1 108 ? -31.350 -13.730 0.597   1.00 54.72 ? 108 ILE A HD13 1 
ATOM 1515 N N    . ALA A 1 109 ? -26.243 -15.711 -0.449  1.00 50.08 ? 109 ALA A N    1 
ATOM 1516 C CA   . ALA A 1 109 ? -25.562 -16.238 -1.627  1.00 49.84 ? 109 ALA A CA   1 
ATOM 1517 C C    . ALA A 1 109 ? -26.592 -16.899 -2.535  1.00 50.75 ? 109 ALA A C    1 
ATOM 1518 O O    . ALA A 1 109 ? -26.643 -16.626 -3.735  1.00 51.01 ? 109 ALA A O    1 
ATOM 1519 C CB   . ALA A 1 109 ? -24.475 -17.227 -1.234  1.00 48.65 ? 109 ALA A CB   1 
ATOM 1520 H H    . ALA A 1 109 ? -26.584 -16.319 0.055   1.00 54.72 ? 109 ALA A H    1 
ATOM 1521 H HA   . ALA A 1 109 ? -25.149 -15.507 -2.114  1.00 54.72 ? 109 ALA A HA   1 
ATOM 1522 H HB1  . ALA A 1 109 ? -24.044 -17.557 -2.038  1.00 54.72 ? 109 ALA A HB1  1 
ATOM 1523 H HB2  . ALA A 1 109 ? -23.827 -16.776 -0.672  1.00 54.72 ? 109 ALA A HB2  1 
ATOM 1524 H HB3  . ALA A 1 109 ? -24.880 -17.963 -0.749  1.00 54.72 ? 109 ALA A HB3  1 
ATOM 1525 N N    . GLN A 1 110 ? -27.413 -17.764 -1.942  1.00 50.85 ? 110 GLN A N    1 
ATOM 1526 C CA   . GLN A 1 110 ? -28.489 -18.447 -2.658  1.00 52.31 ? 110 GLN A CA   1 
ATOM 1527 C C    . GLN A 1 110 ? -29.752 -18.545 -1.809  1.00 53.75 ? 110 GLN A C    1 
ATOM 1528 O O    . GLN A 1 110 ? -29.694 -18.686 -0.587  1.00 53.80 ? 110 GLN A O    1 
ATOM 1529 C CB   . GLN A 1 110 ? -28.061 -19.856 -3.081  1.00 52.67 ? 110 GLN A CB   1 
ATOM 1530 C CG   . GLN A 1 110 ? -27.387 -19.941 -4.443  1.00 52.45 ? 110 GLN A CG   1 
ATOM 1531 C CD   . GLN A 1 110 ? -27.317 -21.364 -4.986  1.00 53.77 ? 110 GLN A CD   1 
ATOM 1532 O OE1  . GLN A 1 110 ? -26.259 -21.814 -5.423  1.00 53.52 ? 110 GLN A OE1  1 
ATOM 1533 N NE2  . GLN A 1 110 ? -28.445 -22.073 -4.972  1.00 55.59 ? 110 GLN A NE2  1 
ATOM 1534 O OXT  . GLN A 1 110 ? -30.863 -18.496 -2.335  1.00 55.04 ? 110 GLN A OXT  1 
ATOM 1535 H H    . GLN A 1 110 ? -27.366 -17.975 -1.109  1.00 54.72 ? 110 GLN A H    1 
ATOM 1536 H HA   . GLN A 1 110 ? -28.704 -17.944 -3.460  1.00 54.72 ? 110 GLN A HA   1 
ATOM 1537 H HB2  . GLN A 1 110 ? -27.436 -20.199 -2.424  1.00 54.72 ? 110 GLN A HB2  1 
ATOM 1538 H HB3  . GLN A 1 110 ? -28.848 -20.422 -3.108  1.00 54.72 ? 110 GLN A HB3  1 
ATOM 1539 H HG2  . GLN A 1 110 ? -27.888 -19.404 -5.077  1.00 54.72 ? 110 GLN A HG2  1 
ATOM 1540 H HG3  . GLN A 1 110 ? -26.481 -19.605 -4.368  1.00 54.72 ? 110 GLN A HG3  1 
ATOM 1541 H HE21 . GLN A 1 110 ? -29.169 -21.724 -4.665  1.00 54.72 ? 110 GLN A HE21 1 
ATOM 1542 H HE22 . GLN A 1 110 ? -28.449 -22.880 -5.269  1.00 54.72 ? 110 GLN A HE22 1 
ATOM 1543 N N    . ALA B 1 1   ? -17.753 -36.984 -1.943  1.00 62.75 ? 1   ALA B N    1 
ATOM 1544 C CA   . ALA B 1 1   ? -18.472 -36.263 -0.850  1.00 61.82 ? 1   ALA B CA   1 
ATOM 1545 C C    . ALA B 1 1   ? -17.607 -35.168 -0.226  1.00 58.73 ? 1   ALA B C    1 
ATOM 1546 O O    . ALA B 1 1   ? -17.484 -35.089 0.996   1.00 58.74 ? 1   ALA B O    1 
ATOM 1547 C CB   . ALA B 1 1   ? -18.918 -37.248 0.214   1.00 64.62 ? 1   ALA B CB   1 
ATOM 1548 H H1   . ALA B 1 1   ? -18.264 -37.647 -2.247  1.00 54.72 ? 1   ALA B H1   1 
ATOM 1549 H H2   . ALA B 1 1   ? -17.577 -36.418 -2.606  1.00 54.72 ? 1   ALA B H2   1 
ATOM 1550 H H3   . ALA B 1 1   ? -16.991 -37.318 -1.627  1.00 54.72 ? 1   ALA B H3   1 
ATOM 1551 H HA   . ALA B 1 1   ? -19.265 -35.843 -1.220  1.00 54.72 ? 1   ALA B HA   1 
ATOM 1552 H HB1  . ALA B 1 1   ? -19.383 -36.766 0.916   1.00 54.72 ? 1   ALA B HB1  1 
ATOM 1553 H HB2  . ALA B 1 1   ? -19.513 -37.901 -0.188  1.00 54.72 ? 1   ALA B HB2  1 
ATOM 1554 H HB3  . ALA B 1 1   ? -18.137 -37.693 0.580   1.00 54.72 ? 1   ALA B HB3  1 
ATOM 1555 N N    . THR B 1 2   ? -17.027 -34.320 -1.073  1.00 56.54 ? 2   THR B N    1 
ATOM 1556 C CA   . THR B 1 2   ? -16.057 -33.322 -0.636  1.00 54.12 ? 2   THR B CA   1 
ATOM 1557 C C    . THR B 1 2   ? -16.485 -31.893 -0.950  1.00 52.19 ? 2   THR B C    1 
ATOM 1558 O O    . THR B 1 2   ? -17.445 -31.663 -1.685  1.00 52.53 ? 2   THR B O    1 
ATOM 1559 C CB   . THR B 1 2   ? -14.700 -33.569 -1.300  1.00 53.70 ? 2   THR B CB   1 
ATOM 1560 O OG1  . THR B 1 2   ? -14.633 -34.927 -1.751  1.00 56.07 ? 2   THR B OG1  1 
ATOM 1561 C CG2  . THR B 1 2   ? -13.570 -33.298 -0.325  1.00 52.93 ? 2   THR B CG2  1 
ATOM 1562 H H    . THR B 1 2   ? -17.182 -34.304 -1.919  1.00 54.72 ? 2   THR B H    1 
ATOM 1563 H HA   . THR B 1 2   ? -15.940 -33.395 0.324   1.00 54.72 ? 2   THR B HA   1 
ATOM 1564 H HB   . THR B 1 2   ? -14.599 -32.972 -2.058  1.00 54.72 ? 2   THR B HB   1 
ATOM 1565 H HG1  . THR B 1 2   ? -13.891 -35.072 -2.117  1.00 54.72 ? 2   THR B HG1  1 
ATOM 1566 H HG21 . THR B 1 2   ? -12.716 -33.457 -0.755  1.00 54.72 ? 2   THR B HG21 1 
ATOM 1567 H HG22 . THR B 1 2   ? -13.605 -32.376 -0.025  1.00 54.72 ? 2   THR B HG22 1 
ATOM 1568 H HG23 . THR B 1 2   ? -13.650 -33.883 0.445   1.00 54.72 ? 2   THR B HG23 1 
ATOM 1569 N N    . LYS B 1 3   ? -15.744 -30.941 -0.390  1.00 50.56 ? 3   LYS B N    1 
ATOM 1570 C CA   . LYS B 1 3   ? -15.950 -29.527 -0.656  1.00 49.00 ? 3   LYS B CA   1 
ATOM 1571 C C    . LYS B 1 3   ? -14.664 -28.935 -1.221  1.00 47.75 ? 3   LYS B C    1 
ATOM 1572 O O    . LYS B 1 3   ? -13.567 -29.384 -0.885  1.00 47.94 ? 3   LYS B O    1 
ATOM 1573 C CB   . LYS B 1 3   ? -16.369 -28.795 0.621   1.00 48.95 ? 3   LYS B CB   1 
ATOM 1574 C CG   . LYS B 1 3   ? -17.623 -29.354 1.283   1.00 50.64 ? 3   LYS B CG   1 
ATOM 1575 C CD   . LYS B 1 3   ? -18.100 -28.463 2.428   1.00 50.89 ? 3   LYS B CD   1 
ATOM 1576 C CE   . LYS B 1 3   ? -17.116 -28.433 3.592   1.00 51.05 ? 3   LYS B CE   1 
ATOM 1577 N NZ   . LYS B 1 3   ? -16.925 -29.772 4.212   1.00 52.65 ? 3   LYS B NZ   1 
ATOM 1578 H H    . LYS B 1 3   ? -15.102 -31.097 0.161   1.00 54.72 ? 3   LYS B H    1 
ATOM 1579 H HA   . LYS B 1 3   ? -16.653 -29.421 -1.316  1.00 54.72 ? 3   LYS B HA   1 
ATOM 1580 H HB2  . LYS B 1 3   ? -15.645 -28.853 1.264   1.00 54.72 ? 3   LYS B HB2  1 
ATOM 1581 H HB3  . LYS B 1 3   ? -16.540 -27.865 0.404   1.00 54.72 ? 3   LYS B HB3  1 
ATOM 1582 H HG2  . LYS B 1 3   ? -18.334 -29.409 0.626   1.00 54.72 ? 3   LYS B HG2  1 
ATOM 1583 H HG3  . LYS B 1 3   ? -17.430 -30.233 1.643   1.00 54.72 ? 3   LYS B HG3  1 
ATOM 1584 H HD2  . LYS B 1 3   ? -18.206 -27.556 2.101   1.00 54.72 ? 3   LYS B HD2  1 
ATOM 1585 H HD3  . LYS B 1 3   ? -18.947 -28.799 2.760   1.00 54.72 ? 3   LYS B HD3  1 
ATOM 1586 H HE2  . LYS B 1 3   ? -16.254 -28.125 3.270   1.00 54.72 ? 3   LYS B HE2  1 
ATOM 1587 H HE3  . LYS B 1 3   ? -17.451 -27.831 4.274   1.00 54.72 ? 3   LYS B HE3  1 
ATOM 1588 H HZ1  . LYS B 1 3   ? -16.346 -29.716 4.885   1.00 54.72 ? 3   LYS B HZ1  1 
ATOM 1589 H HZ2  . LYS B 1 3   ? -17.701 -30.077 4.523   1.00 54.72 ? 3   LYS B HZ2  1 
ATOM 1590 H HZ3  . LYS B 1 3   ? -16.610 -30.345 3.608   1.00 54.72 ? 3   LYS B HZ3  1 
ATOM 1591 N N    . ALA B 1 4   ? -14.804 -27.934 -2.084  1.00 48.82 ? 4   ALA B N    1 
ATOM 1592 C CA   . ALA B 1 4   ? -13.655 -27.303 -2.721  1.00 48.06 ? 4   ALA B CA   1 
ATOM 1593 C C    . ALA B 1 4   ? -13.970 -25.847 -3.068  1.00 47.30 ? 4   ALA B C    1 
ATOM 1594 O O    . ALA B 1 4   ? -15.117 -25.510 -3.365  1.00 47.42 ? 4   ALA B O    1 
ATOM 1595 C CB   . ALA B 1 4   ? -13.248 -28.086 -3.967  1.00 48.06 ? 4   ALA B CB   1 
ATOM 1596 H H    . ALA B 1 4   ? -15.560 -27.600 -2.320  1.00 54.72 ? 4   ALA B H    1 
ATOM 1597 H HA   . ALA B 1 4   ? -12.907 -27.310 -2.104  1.00 54.72 ? 4   ALA B HA   1 
ATOM 1598 H HB1  . ALA B 1 4   ? -12.484 -27.651 -4.377  1.00 54.72 ? 4   ALA B HB1  1 
ATOM 1599 H HB2  . ALA B 1 4   ? -13.016 -28.991 -3.709  1.00 54.72 ? 4   ALA B HB2  1 
ATOM 1600 H HB3  . ALA B 1 4   ? -13.993 -28.099 -4.588  1.00 54.72 ? 4   ALA B HB3  1 
ATOM 1601 N N    . VAL B 1 5   ? -12.946 -24.996 -3.013  1.00 49.55 ? 5   VAL B N    1 
ATOM 1602 C CA   . VAL B 1 5   ? -13.081 -23.564 -3.280  1.00 49.27 ? 5   VAL B CA   1 
ATOM 1603 C C    . VAL B 1 5   ? -12.045 -23.112 -4.307  1.00 49.44 ? 5   VAL B C    1 
ATOM 1604 O O    . VAL B 1 5   ? -10.961 -23.691 -4.399  1.00 49.77 ? 5   VAL B O    1 
ATOM 1605 C CB   . VAL B 1 5   ? -12.915 -22.739 -1.985  1.00 47.31 ? 5   VAL B CB   1 
ATOM 1606 C CG1  . VAL B 1 5   ? -13.083 -21.251 -2.245  1.00 47.54 ? 5   VAL B CG1  1 
ATOM 1607 C CG2  . VAL B 1 5   ? -13.925 -23.183 -0.957  1.00 47.57 ? 5   VAL B CG2  1 
ATOM 1608 H H    . VAL B 1 5   ? -12.142 -25.232 -2.818  1.00 54.72 ? 5   VAL B H    1 
ATOM 1609 H HA   . VAL B 1 5   ? -13.964 -23.388 -3.641  1.00 54.72 ? 5   VAL B HA   1 
ATOM 1610 H HB   . VAL B 1 5   ? -12.028 -22.887 -1.623  1.00 54.72 ? 5   VAL B HB   1 
ATOM 1611 H HG11 . VAL B 1 5   ? -12.972 -20.770 -1.410  1.00 54.72 ? 5   VAL B HG11 1 
ATOM 1612 H HG12 . VAL B 1 5   ? -12.411 -20.965 -2.884  1.00 54.72 ? 5   VAL B HG12 1 
ATOM 1613 H HG13 . VAL B 1 5   ? -13.970 -21.091 -2.604  1.00 54.72 ? 5   VAL B HG13 1 
ATOM 1614 H HG21 . VAL B 1 5   ? -13.807 -22.656 -0.151  1.00 54.72 ? 5   VAL B HG21 1 
ATOM 1615 H HG22 . VAL B 1 5   ? -14.817 -23.049 -1.313  1.00 54.72 ? 5   VAL B HG22 1 
ATOM 1616 H HG23 . VAL B 1 5   ? -13.784 -24.123 -0.762  1.00 54.72 ? 5   VAL B HG23 1 
ATOM 1617 N N    . ALA B 1 6   ? -12.382 -22.074 -5.069  1.00 50.37 ? 6   ALA B N    1 
ATOM 1618 C CA   . ALA B 1 6   ? -11.483 -21.542 -6.088  1.00 50.97 ? 6   ALA B CA   1 
ATOM 1619 C C    . ALA B 1 6   ? -11.544 -20.018 -6.146  1.00 51.46 ? 6   ALA B C    1 
ATOM 1620 O O    . ALA B 1 6   ? -12.567 -19.442 -6.511  1.00 51.56 ? 6   ALA B O    1 
ATOM 1621 C CB   . ALA B 1 6   ? -11.823 -22.128 -7.449  1.00 52.36 ? 6   ALA B CB   1 
ATOM 1622 H H    . ALA B 1 6   ? -13.132 -21.658 -5.015  1.00 54.72 ? 6   ALA B H    1 
ATOM 1623 H HA   . ALA B 1 6   ? -10.573 -21.797 -5.870  1.00 54.72 ? 6   ALA B HA   1 
ATOM 1624 H HB1  . ALA B 1 6   ? -11.215 -21.762 -8.110  1.00 54.72 ? 6   ALA B HB1  1 
ATOM 1625 H HB2  . ALA B 1 6   ? -11.727 -23.093 -7.409  1.00 54.72 ? 6   ALA B HB2  1 
ATOM 1626 H HB3  . ALA B 1 6   ? -12.737 -21.895 -7.673  1.00 54.72 ? 6   ALA B HB3  1 
ATOM 1627 N N    . VAL B 1 7   ? -10.437 -19.372 -5.796  1.00 51.14 ? 7   VAL B N    1 
ATOM 1628 C CA   . VAL B 1 7   ? -10.346 -17.919 -5.854  1.00 52.23 ? 7   VAL B CA   1 
ATOM 1629 C C    . VAL B 1 7   ? -9.928  -17.462 -7.247  1.00 53.30 ? 7   VAL B C    1 
ATOM 1630 O O    . VAL B 1 7   ? -8.744  -17.481 -7.586  1.00 54.32 ? 7   VAL B O    1 
ATOM 1631 C CB   . VAL B 1 7   ? -9.344  -17.380 -4.815  1.00 50.30 ? 7   VAL B CB   1 
ATOM 1632 C CG1  . VAL B 1 7   ? -9.215  -15.867 -4.916  1.00 52.04 ? 7   VAL B CG1  1 
ATOM 1633 C CG2  . VAL B 1 7   ? -9.782  -17.769 -3.416  1.00 49.70 ? 7   VAL B CG2  1 
ATOM 1634 H H    . VAL B 1 7   ? -9.719  -19.757 -5.519  1.00 54.72 ? 7   VAL B H    1 
ATOM 1635 H HA   . VAL B 1 7   ? -11.217 -17.538 -5.659  1.00 54.72 ? 7   VAL B HA   1 
ATOM 1636 H HB   . VAL B 1 7   ? -8.472  -17.771 -4.980  1.00 54.72 ? 7   VAL B HB   1 
ATOM 1637 H HG11 . VAL B 1 7   ? -8.579  -15.559 -4.251  1.00 54.72 ? 7   VAL B HG11 1 
ATOM 1638 H HG12 . VAL B 1 7   ? -8.903  -15.635 -5.805  1.00 54.72 ? 7   VAL B HG12 1 
ATOM 1639 H HG13 . VAL B 1 7   ? -10.083 -15.465 -4.755  1.00 54.72 ? 7   VAL B HG13 1 
ATOM 1640 H HG21 . VAL B 1 7   ? -9.140  -17.422 -2.777  1.00 54.72 ? 7   VAL B HG21 1 
ATOM 1641 H HG22 . VAL B 1 7   ? -10.658 -17.392 -3.243  1.00 54.72 ? 7   VAL B HG22 1 
ATOM 1642 H HG23 . VAL B 1 7   ? -9.820  -18.737 -3.355  1.00 54.72 ? 7   VAL B HG23 1 
ATOM 1643 N N    . LEU B 1 8   ? -10.905 -17.055 -8.052  1.00 53.12 ? 8   LEU B N    1 
ATOM 1644 C CA   . LEU B 1 8   ? -10.634 -16.581 -9.404  1.00 54.51 ? 8   LEU B CA   1 
ATOM 1645 C C    . LEU B 1 8   ? -10.066 -15.164 -9.382  1.00 56.34 ? 8   LEU B C    1 
ATOM 1646 O O    . LEU B 1 8   ? -10.727 -14.233 -8.925  1.00 56.77 ? 8   LEU B O    1 
ATOM 1647 C CB   . LEU B 1 8   ? -11.909 -16.624 -10.253 1.00 55.23 ? 8   LEU B CB   1 
ATOM 1648 C CG   . LEU B 1 8   ? -12.378 -18.005 -10.722 1.00 54.46 ? 8   LEU B CG   1 
ATOM 1649 C CD1  . LEU B 1 8   ? -13.709 -17.892 -11.430 1.00 54.97 ? 8   LEU B CD1  1 
ATOM 1650 C CD2  . LEU B 1 8   ? -11.364 -18.651 -11.648 1.00 55.37 ? 8   LEU B CD2  1 
ATOM 1651 H H    . LEU B 1 8   ? -11.738 -17.044 -7.836  1.00 54.72 ? 8   LEU B H    1 
ATOM 1652 H HA   . LEU B 1 8   ? -9.977  -17.162 -9.818  1.00 54.72 ? 8   LEU B HA   1 
ATOM 1653 H HB2  . LEU B 1 8   ? -12.631 -16.237 -9.735  1.00 54.72 ? 8   LEU B HB2  1 
ATOM 1654 H HB3  . LEU B 1 8   ? -11.762 -16.086 -11.048 1.00 54.72 ? 8   LEU B HB3  1 
ATOM 1655 H HG   . LEU B 1 8   ? -12.493 -18.581 -9.950  1.00 54.72 ? 8   LEU B HG   1 
ATOM 1656 H HD11 . LEU B 1 8   ? -13.988 -18.775 -11.718 1.00 54.72 ? 8   LEU B HD11 1 
ATOM 1657 H HD12 . LEU B 1 8   ? -14.362 -17.522 -10.815 1.00 54.72 ? 8   LEU B HD12 1 
ATOM 1658 H HD13 . LEU B 1 8   ? -13.609 -17.308 -12.198 1.00 54.72 ? 8   LEU B HD13 1 
ATOM 1659 H HD21 . LEU B 1 8   ? -11.696 -19.521 -11.922 1.00 54.72 ? 8   LEU B HD21 1 
ATOM 1660 H HD22 . LEU B 1 8   ? -11.241 -18.085 -12.426 1.00 54.72 ? 8   LEU B HD22 1 
ATOM 1661 H HD23 . LEU B 1 8   ? -10.523 -18.752 -11.175 1.00 54.72 ? 8   LEU B HD23 1 
ATOM 1662 N N    . LYS B 1 9   ? -8.837  -15.018 -9.877  1.00 53.79 ? 9   LYS B N    1 
ATOM 1663 C CA   . LYS B 1 9   ? -8.171  -13.720 -9.956  1.00 56.20 ? 9   LYS B CA   1 
ATOM 1664 C C    . LYS B 1 9   ? -7.816  -13.391 -11.399 1.00 58.19 ? 9   LYS B C    1 
ATOM 1665 O O    . LYS B 1 9   ? -7.368  -14.259 -12.149 1.00 58.20 ? 9   LYS B O    1 
ATOM 1666 C CB   . LYS B 1 9   ? -6.908  -13.704 -9.094  1.00 57.09 ? 9   LYS B CB   1 
ATOM 1667 C CG   . LYS B 1 9   ? -7.180  -13.859 -7.614  1.00 55.86 ? 9   LYS B CG   1 
ATOM 1668 C CD   . LYS B 1 9   ? -5.887  -13.873 -6.813  1.00 57.24 ? 9   LYS B CD   1 
ATOM 1669 C CE   . LYS B 1 9   ? -6.145  -14.034 -5.321  1.00 56.45 ? 9   LYS B CE   1 
ATOM 1670 N NZ   . LYS B 1 9   ? -4.883  -14.019 -4.529  1.00 58.29 ? 9   LYS B NZ   1 
ATOM 1671 H H    . LYS B 1 9   ? -8.361  -15.668 -10.177 1.00 54.72 ? 9   LYS B H    1 
ATOM 1672 H HA   . LYS B 1 9   ? -8.771  -13.033 -9.627  1.00 54.72 ? 9   LYS B HA   1 
ATOM 1673 H HB2  . LYS B 1 9   ? -6.332  -14.436 -9.369  1.00 54.72 ? 9   LYS B HB2  1 
ATOM 1674 H HB3  . LYS B 1 9   ? -6.450  -12.859 -9.225  1.00 54.72 ? 9   LYS B HB3  1 
ATOM 1675 H HG2  . LYS B 1 9   ? -7.720  -13.114 -7.308  1.00 54.72 ? 9   LYS B HG2  1 
ATOM 1676 H HG3  . LYS B 1 9   ? -7.644  -14.697 -7.459  1.00 54.72 ? 9   LYS B HG3  1 
ATOM 1677 H HD2  . LYS B 1 9   ? -5.338  -14.617 -7.107  1.00 54.72 ? 9   LYS B HD2  1 
ATOM 1678 H HD3  . LYS B 1 9   ? -5.418  -13.036 -6.951  1.00 54.72 ? 9   LYS B HD3  1 
ATOM 1679 H HE2  . LYS B 1 9   ? -6.703  -13.302 -5.014  1.00 54.72 ? 9   LYS B HE2  1 
ATOM 1680 H HE3  . LYS B 1 9   ? -6.590  -14.882 -5.164  1.00 54.72 ? 9   LYS B HE3  1 
ATOM 1681 H HZ1  . LYS B 1 9   ? -5.067  -14.114 -3.663  1.00 54.72 ? 9   LYS B HZ1  1 
ATOM 1682 H HZ2  . LYS B 1 9   ? -4.354  -14.686 -4.788  1.00 54.72 ? 9   LYS B HZ2  1 
ATOM 1683 H HZ3  . LYS B 1 9   ? -4.457  -13.247 -4.651  1.00 54.72 ? 9   LYS B HZ3  1 
ATOM 1684 N N    . GLY B 1 10  ? -8.017  -12.133 -11.778 1.00 60.26 ? 10  GLY B N    1 
ATOM 1685 C CA   . GLY B 1 10  ? -7.712  -11.694 -13.125 1.00 62.68 ? 10  GLY B CA   1 
ATOM 1686 C C    . GLY B 1 10  ? -7.457  -10.203 -13.242 1.00 65.78 ? 10  GLY B C    1 
ATOM 1687 O O    . GLY B 1 10  ? -7.115  -9.539  -12.262 1.00 66.56 ? 10  GLY B O    1 
ATOM 1688 H H    . GLY B 1 10  ? -8.331  -11.515 -11.269 1.00 54.72 ? 10  GLY B H    1 
ATOM 1689 H HA2  . GLY B 1 10  ? -6.922  -12.161 -13.441 1.00 54.72 ? 10  GLY B HA2  1 
ATOM 1690 H HA3  . GLY B 1 10  ? -8.452  -11.921 -13.709 1.00 54.72 ? 10  GLY B HA3  1 
ATOM 1691 N N    . ASP B 1 11  ? -7.640  -9.683  -14.453 1.00 67.97 ? 11  ASP B N    1 
ATOM 1692 C CA   . ASP B 1 11  ? -7.312  -8.296  -14.781 1.00 71.66 ? 11  ASP B CA   1 
ATOM 1693 C C    . ASP B 1 11  ? -8.151  -7.276  -14.016 1.00 72.02 ? 11  ASP B C    1 
ATOM 1694 O O    . ASP B 1 11  ? -9.299  -7.543  -13.672 1.00 69.76 ? 11  ASP B O    1 
ATOM 1695 C CB   . ASP B 1 11  ? -7.501  -8.054  -16.281 1.00 73.97 ? 11  ASP B CB   1 
ATOM 1696 C CG   . ASP B 1 11  ? -6.432  -8.719  -17.125 1.00 75.27 ? 11  ASP B CG   1 
ATOM 1697 O OD1  . ASP B 1 11  ? -6.463  -9.960  -17.260 1.00 73.00 ? 11  ASP B OD1  1 
ATOM 1698 O OD2  . ASP B 1 11  ? -5.573  -7.994  -17.673 1.00 78.98 ? 11  ASP B OD2  1 
ATOM 1699 H H    . ASP B 1 11  ? -7.961  -10.124 -15.118 1.00 54.72 ? 11  ASP B H    1 
ATOM 1700 H HA   . ASP B 1 11  ? -6.380  -8.135  -14.568 1.00 54.72 ? 11  ASP B HA   1 
ATOM 1701 H HB2  . ASP B 1 11  ? -8.361  -8.411  -16.552 1.00 54.72 ? 11  ASP B HB2  1 
ATOM 1702 H HB3  . ASP B 1 11  ? -7.468  -7.100  -16.453 1.00 54.72 ? 11  ASP B HB3  1 
ATOM 1703 N N    . GLY B 1 12  ? -7.571  -6.101  -13.780 1.00 75.37 ? 12  GLY B N    1 
ATOM 1704 C CA   . GLY B 1 12  ? -8.270  -4.989  -13.152 1.00 76.78 ? 12  GLY B CA   1 
ATOM 1705 C C    . GLY B 1 12  ? -9.058  -5.375  -11.906 1.00 73.77 ? 12  GLY B C    1 
ATOM 1706 O O    . GLY B 1 12  ? -8.452  -5.745  -10.898 1.00 72.80 ? 12  GLY B O    1 
ATOM 1707 H H    . GLY B 1 12  ? -6.754  -5.922  -13.980 1.00 54.72 ? 12  GLY B H    1 
ATOM 1708 H HA2  . GLY B 1 12  ? -7.626  -4.308  -12.903 1.00 54.72 ? 12  GLY B HA2  1 
ATOM 1709 H HA3  . GLY B 1 12  ? -8.888  -4.601  -13.792 1.00 54.72 ? 12  GLY B HA3  1 
ATOM 1710 N N    . PRO B 1 13  ? -10.408 -5.279  -11.956 1.00 72.67 ? 13  PRO B N    1 
ATOM 1711 C CA   . PRO B 1 13  ? -11.244 -5.678  -10.814 1.00 70.12 ? 13  PRO B CA   1 
ATOM 1712 C C    . PRO B 1 13  ? -11.610 -7.163  -10.816 1.00 66.19 ? 13  PRO B C    1 
ATOM 1713 O O    . PRO B 1 13  ? -12.020 -7.690  -9.780  1.00 64.10 ? 13  PRO B O    1 
ATOM 1714 C CB   . PRO B 1 13  ? -12.500 -4.822  -10.994 1.00 71.59 ? 13  PRO B CB   1 
ATOM 1715 C CG   . PRO B 1 13  ? -12.646 -4.720  -12.460 1.00 72.82 ? 13  PRO B CG   1 
ATOM 1716 C CD   . PRO B 1 13  ? -11.236 -4.714  -13.040 1.00 74.35 ? 13  PRO B CD   1 
ATOM 1717 H HA   . PRO B 1 13  ? -10.811 -5.449  -9.977  1.00 54.72 ? 13  PRO B HA   1 
ATOM 1718 H HB2  . PRO B 1 13  ? -13.265 -5.270  -10.599 1.00 54.72 ? 13  PRO B HB2  1 
ATOM 1719 H HB3  . PRO B 1 13  ? -12.365 -3.948  -10.597 1.00 54.72 ? 13  PRO B HB3  1 
ATOM 1720 H HG2  . PRO B 1 13  ? -13.144 -5.486  -12.789 1.00 54.72 ? 13  PRO B HG2  1 
ATOM 1721 H HG3  . PRO B 1 13  ? -13.107 -3.896  -12.682 1.00 54.72 ? 13  PRO B HG3  1 
ATOM 1722 H HD2  . PRO B 1 13  ? -11.192 -5.279  -13.827 1.00 54.72 ? 13  PRO B HD2  1 
ATOM 1723 H HD3  . PRO B 1 13  ? -10.957 -3.806  -13.239 1.00 54.72 ? 13  PRO B HD3  1 
ATOM 1724 N N    . VAL B 1 14  ? -11.460 -7.818  -11.965 1.00 65.65 ? 14  VAL B N    1 
ATOM 1725 C CA   . VAL B 1 14  ? -11.882 -9.207  -12.134 1.00 62.61 ? 14  VAL B CA   1 
ATOM 1726 C C    . VAL B 1 14  ? -11.315 -10.124 -11.057 1.00 60.31 ? 14  VAL B C    1 
ATOM 1727 O O    . VAL B 1 14  ? -10.254 -10.729 -11.227 1.00 60.10 ? 14  VAL B O    1 
ATOM 1728 C CB   . VAL B 1 14  ? -11.469 -9.755  -13.517 1.00 63.19 ? 14  VAL B CB   1 
ATOM 1729 C CG1  . VAL B 1 14  ? -11.974 -11.184 -13.704 1.00 60.62 ? 14  VAL B CG1  1 
ATOM 1730 C CG2  . VAL B 1 14  ? -12.018 -8.870  -14.624 1.00 65.86 ? 14  VAL B CG2  1 
ATOM 1731 H H    . VAL B 1 14  ? -11.111 -7.474  -12.672 1.00 54.72 ? 14  VAL B H    1 
ATOM 1732 H HA   . VAL B 1 14  ? -12.850 -9.247  -12.077 1.00 54.72 ? 14  VAL B HA   1 
ATOM 1733 H HB   . VAL B 1 14  ? -10.502 -9.763  -13.583 1.00 54.72 ? 14  VAL B HB   1 
ATOM 1734 H HG11 . VAL B 1 14  ? -11.701 -11.503 -14.578 1.00 54.72 ? 14  VAL B HG11 1 
ATOM 1735 H HG12 . VAL B 1 14  ? -11.592 -11.746 -13.012 1.00 54.72 ? 14  VAL B HG12 1 
ATOM 1736 H HG13 . VAL B 1 14  ? -12.942 -11.187 -13.637 1.00 54.72 ? 14  VAL B HG13 1 
ATOM 1737 H HG21 . VAL B 1 14  ? -11.746 -9.234  -15.482 1.00 54.72 ? 14  VAL B HG21 1 
ATOM 1738 H HG22 . VAL B 1 14  ? -12.986 -8.853  -14.563 1.00 54.72 ? 14  VAL B HG22 1 
ATOM 1739 H HG23 . VAL B 1 14  ? -11.663 -7.974  -14.517 1.00 54.72 ? 14  VAL B HG23 1 
ATOM 1740 N N    . GLN B 1 15  ? -12.031 -10.204 -9.942  1.00 58.96 ? 15  GLN B N    1 
ATOM 1741 C CA   . GLN B 1 15  ? -11.780 -11.220 -8.932  1.00 56.71 ? 15  GLN B CA   1 
ATOM 1742 C C    . GLN B 1 15  ? -13.126 -11.758 -8.468  1.00 54.96 ? 15  GLN B C    1 
ATOM 1743 O O    . GLN B 1 15  ? -14.172 -11.216 -8.828  1.00 55.73 ? 15  GLN B O    1 
ATOM 1744 C CB   . GLN B 1 15  ? -10.966 -10.656 -7.763  1.00 57.80 ? 15  GLN B CB   1 
ATOM 1745 C CG   . GLN B 1 15  ? -11.707 -9.657  -6.878  1.00 59.09 ? 15  GLN B CG   1 
ATOM 1746 C CD   . GLN B 1 15  ? -12.429 -10.299 -5.699  0.42 57.32 ? 15  GLN B CD   1 
ATOM 1747 O OE1  . GLN B 1 15  ? -12.233 -11.476 -5.391  0.50 55.21 ? 15  GLN B OE1  1 
ATOM 1748 N NE2  . GLN B 1 15  ? -13.267 -9.516  -5.030  0.72 58.56 ? 15  GLN B NE2  1 
ATOM 1749 H H    . GLN B 1 15  ? -12.677 -9.671  -9.745  1.00 54.72 ? 15  GLN B H    1 
ATOM 1750 H HA   . GLN B 1 15  ? -11.280 -11.950 -9.328  1.00 54.72 ? 15  GLN B HA   1 
ATOM 1751 H HB2  . GLN B 1 15  ? -10.686 -11.394 -7.200  1.00 54.72 ? 15  GLN B HB2  1 
ATOM 1752 H HB3  . GLN B 1 15  ? -10.185 -10.206 -8.121  1.00 54.72 ? 15  GLN B HB3  1 
ATOM 1753 H HG2  . GLN B 1 15  ? -11.067 -9.020  -6.523  1.00 54.72 ? 15  GLN B HG2  1 
ATOM 1754 H HG3  . GLN B 1 15  ? -12.369 -9.194  -7.415  1.00 54.72 ? 15  GLN B HG3  1 
ATOM 1755 H HE21 . GLN B 1 15  ? -13.376 -8.698  -5.271  0.72 54.72 ? 15  GLN B HE21 1 
ATOM 1756 H HE22 . GLN B 1 15  ? -13.701 -9.827  -4.356  0.72 54.72 ? 15  GLN B HE22 1 
ATOM 1757 N N    . GLY B 1 16  ? -13.106 -12.829 -7.683  1.00 55.88 ? 16  GLY B N    1 
ATOM 1758 C CA   . GLY B 1 16  ? -14.338 -13.476 -7.274  1.00 54.53 ? 16  GLY B CA   1 
ATOM 1759 C C    . GLY B 1 16  ? -14.112 -14.831 -6.636  1.00 52.66 ? 16  GLY B C    1 
ATOM 1760 O O    . GLY B 1 16  ? -12.974 -15.289 -6.519  1.00 52.34 ? 16  GLY B O    1 
ATOM 1761 H H    . GLY B 1 16  ? -12.392 -13.197 -7.376  1.00 54.72 ? 16  GLY B H    1 
ATOM 1762 H HA2  . GLY B 1 16  ? -14.801 -12.912 -6.634  1.00 54.72 ? 16  GLY B HA2  1 
ATOM 1763 H HA3  . GLY B 1 16  ? -14.911 -13.594 -8.047  1.00 54.72 ? 16  GLY B HA3  1 
ATOM 1764 N N    . ILE B 1 17  ? -15.206 -15.476 -6.237  1.00 52.66 ? 17  ILE B N    1 
ATOM 1765 C CA   . ILE B 1 17  ? -15.138 -16.670 -5.398  1.00 51.36 ? 17  ILE B CA   1 
ATOM 1766 C C    . ILE B 1 17  ? -16.149 -17.740 -5.822  1.00 50.75 ? 17  ILE B C    1 
ATOM 1767 O O    . ILE B 1 17  ? -17.330 -17.451 -6.026  1.00 51.38 ? 17  ILE B O    1 
ATOM 1768 C CB   . ILE B 1 17  ? -15.376 -16.308 -3.910  1.00 49.89 ? 17  ILE B CB   1 
ATOM 1769 C CG1  . ILE B 1 17  ? -14.560 -15.064 -3.532  1.00 51.30 ? 17  ILE B CG1  1 
ATOM 1770 C CG2  . ILE B 1 17  ? -15.032 -17.496 -3.010  1.00 48.93 ? 17  ILE B CG2  1 
ATOM 1771 C CD1  . ILE B 1 17  ? -14.784 -14.569 -2.131  1.00 52.34 ? 17  ILE B CD1  1 
ATOM 1772 H H    . ILE B 1 17  ? -16.007 -15.240 -6.441  1.00 54.72 ? 17  ILE B H    1 
ATOM 1773 H HA   . ILE B 1 17  ? -14.251 -17.054 -5.472  1.00 54.72 ? 17  ILE B HA   1 
ATOM 1774 H HB   . ILE B 1 17  ? -16.317 -16.102 -3.794  1.00 54.72 ? 17  ILE B HB   1 
ATOM 1775 H HG12 . ILE B 1 17  ? -13.617 -15.272 -3.623  1.00 54.72 ? 17  ILE B HG12 1 
ATOM 1776 H HG13 . ILE B 1 17  ? -14.794 -14.344 -4.139  1.00 54.72 ? 17  ILE B HG13 1 
ATOM 1777 H HG21 . ILE B 1 17  ? -15.188 -17.247 -2.086  1.00 54.72 ? 17  ILE B HG21 1 
ATOM 1778 H HG22 . ILE B 1 17  ? -15.596 -18.247 -3.250  1.00 54.72 ? 17  ILE B HG22 1 
ATOM 1779 H HG23 . ILE B 1 17  ? -14.099 -17.728 -3.137  1.00 54.72 ? 17  ILE B HG23 1 
ATOM 1780 H HD11 . ILE B 1 17  ? -14.232 -13.786 -1.981  1.00 54.72 ? 17  ILE B HD11 1 
ATOM 1781 H HD12 . ILE B 1 17  ? -15.721 -14.340 -2.023  1.00 54.72 ? 17  ILE B HD12 1 
ATOM 1782 H HD13 . ILE B 1 17  ? -14.541 -15.271 -1.506  1.00 54.72 ? 17  ILE B HD13 1 
ATOM 1783 N N    . ILE B 1 18  ? -15.656 -18.973 -5.951  1.00 49.32 ? 18  ILE B N    1 
ATOM 1784 C CA   . ILE B 1 18  ? -16.462 -20.139 -6.320  1.00 49.21 ? 18  ILE B CA   1 
ATOM 1785 C C    . ILE B 1 18  ? -16.326 -21.247 -5.274  1.00 48.63 ? 18  ILE B C    1 
ATOM 1786 O O    . ILE B 1 18  ? -15.250 -21.434 -4.708  1.00 48.18 ? 18  ILE B O    1 
ATOM 1787 C CB   . ILE B 1 18  ? -16.033 -20.707 -7.691  1.00 49.20 ? 18  ILE B CB   1 
ATOM 1788 C CG1  . ILE B 1 18  ? -16.145 -19.646 -8.788  1.00 50.17 ? 18  ILE B CG1  1 
ATOM 1789 C CG2  . ILE B 1 18  ? -16.875 -21.917 -8.066  1.00 49.69 ? 18  ILE B CG2  1 
ATOM 1790 C CD1  . ILE B 1 18  ? -17.568 -19.298 -9.163  1.00 51.12 ? 18  ILE B CD1  1 
ATOM 1791 H H    . ILE B 1 18  ? -14.827 -19.165 -5.825  1.00 54.72 ? 18  ILE B H    1 
ATOM 1792 H HA   . ILE B 1 18  ? -17.395 -19.881 -6.374  1.00 54.72 ? 18  ILE B HA   1 
ATOM 1793 H HB   . ILE B 1 18  ? -15.106 -20.987 -7.630  1.00 54.72 ? 18  ILE B HB   1 
ATOM 1794 H HG12 . ILE B 1 18  ? -15.713 -18.834 -8.481  1.00 54.72 ? 18  ILE B HG12 1 
ATOM 1795 H HG13 . ILE B 1 18  ? -15.701 -19.974 -9.585  1.00 54.72 ? 18  ILE B HG13 1 
ATOM 1796 H HG21 . ILE B 1 18  ? -16.583 -22.250 -8.929  1.00 54.72 ? 18  ILE B HG21 1 
ATOM 1797 H HG22 . ILE B 1 18  ? -16.761 -22.603 -7.390  1.00 54.72 ? 18  ILE B HG22 1 
ATOM 1798 H HG23 . ILE B 1 18  ? -17.807 -21.650 -8.113  1.00 54.72 ? 18  ILE B HG23 1 
ATOM 1799 H HD11 . ILE B 1 18  ? -17.555 -18.623 -9.859  1.00 54.72 ? 18  ILE B HD11 1 
ATOM 1800 H HD12 . ILE B 1 18  ? -18.014 -20.098 -9.485  1.00 54.72 ? 18  ILE B HD12 1 
ATOM 1801 H HD13 . ILE B 1 18  ? -18.027 -18.956 -8.379  1.00 54.72 ? 18  ILE B HD13 1 
ATOM 1802 N N    . ASN B 1 19  ? -17.412 -21.983 -5.035  1.00 47.51 ? 19  ASN B N    1 
ATOM 1803 C CA   . ASN B 1 19  ? -17.392 -23.152 -4.154  1.00 47.45 ? 19  ASN B CA   1 
ATOM 1804 C C    . ASN B 1 19  ? -17.953 -24.394 -4.850  1.00 48.28 ? 19  ASN B C    1 
ATOM 1805 O O    . ASN B 1 19  ? -19.017 -24.341 -5.467  1.00 49.26 ? 19  ASN B O    1 
ATOM 1806 C CB   . ASN B 1 19  ? -18.186 -22.879 -2.876  1.00 47.66 ? 19  ASN B CB   1 
ATOM 1807 C CG   . ASN B 1 19  ? -17.711 -21.639 -2.146  1.00 47.48 ? 19  ASN B CG   1 
ATOM 1808 O OD1  . ASN B 1 19  ? -16.551 -21.248 -2.255  1.00 46.95 ? 19  ASN B OD1  1 
ATOM 1809 N ND2  . ASN B 1 19  ? -18.607 -21.016 -1.391  1.00 48.36 ? 19  ASN B ND2  1 
ATOM 1810 H H    . ASN B 1 19  ? -18.185 -21.822 -5.376  1.00 54.72 ? 19  ASN B H    1 
ATOM 1811 H HA   . ASN B 1 19  ? -16.475 -23.340 -3.902  1.00 54.72 ? 19  ASN B HA   1 
ATOM 1812 H HB2  . ASN B 1 19  ? -19.121 -22.753 -3.104  1.00 54.72 ? 19  ASN B HB2  1 
ATOM 1813 H HB3  . ASN B 1 19  ? -18.090 -23.636 -2.276  1.00 54.72 ? 19  ASN B HB3  1 
ATOM 1814 H HD21 . ASN B 1 19  ? -18.386 -20.308 -0.957  1.00 54.72 ? 19  ASN B HD21 1 
ATOM 1815 H HD22 . ASN B 1 19  ? -19.409 -21.321 -1.336  1.00 54.72 ? 19  ASN B HD22 1 
ATOM 1816 N N    . PHE B 1 20  ? -17.230 -25.505 -4.733  1.00 48.80 ? 20  PHE B N    1 
ATOM 1817 C CA   . PHE B 1 20  ? -17.636 -26.782 -5.313  1.00 50.10 ? 20  PHE B CA   1 
ATOM 1818 C C    . PHE B 1 20  ? -18.070 -27.746 -4.214  1.00 50.89 ? 20  PHE B C    1 
ATOM 1819 O O    . PHE B 1 20  ? -17.385 -27.867 -3.196  1.00 50.30 ? 20  PHE B O    1 
ATOM 1820 C CB   . PHE B 1 20  ? -16.486 -27.402 -6.114  1.00 48.89 ? 20  PHE B CB   1 
ATOM 1821 C CG   . PHE B 1 20  ? -16.134 -26.656 -7.367  1.00 48.84 ? 20  PHE B CG   1 
ATOM 1822 C CD1  . PHE B 1 20  ? -15.569 -25.397 -7.301  1.00 47.72 ? 20  PHE B CD1  1 
ATOM 1823 C CD2  . PHE B 1 20  ? -16.338 -27.230 -8.610  1.00 50.38 ? 20  PHE B CD2  1 
ATOM 1824 C CE1  . PHE B 1 20  ? -15.235 -24.714 -8.448  1.00 48.07 ? 20  PHE B CE1  1 
ATOM 1825 C CE2  . PHE B 1 20  ? -16.005 -26.551 -9.762  1.00 50.72 ? 20  PHE B CE2  1 
ATOM 1826 C CZ   . PHE B 1 20  ? -15.452 -25.291 -9.681  1.00 49.53 ? 20  PHE B CZ   1 
ATOM 1827 H H    . PHE B 1 20  ? -16.481 -25.545 -4.311  1.00 54.72 ? 20  PHE B H    1 
ATOM 1828 H HA   . PHE B 1 20  ? -18.387 -26.641 -5.911  1.00 54.72 ? 20  PHE B HA   1 
ATOM 1829 H HB2  . PHE B 1 20  ? -15.695 -27.427 -5.553  1.00 54.72 ? 20  PHE B HB2  1 
ATOM 1830 H HB3  . PHE B 1 20  ? -16.736 -28.305 -6.368  1.00 54.72 ? 20  PHE B HB3  1 
ATOM 1831 H HD1  . PHE B 1 20  ? -15.422 -25.001 -6.472  1.00 54.72 ? 20  PHE B HD1  1 
ATOM 1832 H HD2  . PHE B 1 20  ? -16.713 -28.079 -8.668  1.00 54.72 ? 20  PHE B HD2  1 
ATOM 1833 H HE1  . PHE B 1 20  ? -14.861 -23.864 -8.392  1.00 54.72 ? 20  PHE B HE1  1 
ATOM 1834 H HE2  . PHE B 1 20  ? -16.152 -26.943 -10.592 1.00 54.72 ? 20  PHE B HE2  1 
ATOM 1835 H HZ   . PHE B 1 20  ? -15.226 -24.831 -10.457 1.00 54.72 ? 20  PHE B HZ   1 
ATOM 1836 N N    . GLU B 1 21  ? -19.196 -28.426 -4.419  1.00 51.76 ? 21  GLU B N    1 
ATOM 1837 C CA   . GLU B 1 21  ? -19.666 -29.437 -3.472  1.00 53.15 ? 21  GLU B CA   1 
ATOM 1838 C C    . GLU B 1 21  ? -20.253 -30.652 -4.185  1.00 55.60 ? 21  GLU B C    1 
ATOM 1839 O O    . GLU B 1 21  ? -20.685 -30.569 -5.336  1.00 56.49 ? 21  GLU B O    1 
ATOM 1840 C CB   . GLU B 1 21  ? -20.702 -28.843 -2.515  1.00 52.27 ? 21  GLU B CB   1 
ATOM 1841 C CG   . GLU B 1 21  ? -20.112 -27.855 -1.517  1.00 50.64 ? 21  GLU B CG   1 
ATOM 1842 C CD   . GLU B 1 21  ? -21.161 -27.139 -0.687  1.00 51.43 ? 21  GLU B CD   1 
ATOM 1843 O OE1  . GLU B 1 21  ? -22.071 -27.810 -0.153  1.00 53.35 ? 21  GLU B OE1  1 
ATOM 1844 O OE2  . GLU B 1 21  ? -21.073 -25.899 -0.568  1.00 50.48 ? 21  GLU B OE2  1 
ATOM 1845 H H    . GLU B 1 21  ? -19.708 -28.321 -5.102  1.00 54.72 ? 21  GLU B H    1 
ATOM 1846 H HA   . GLU B 1 21  ? -18.912 -29.741 -2.942  1.00 54.72 ? 21  GLU B HA   1 
ATOM 1847 H HB2  . GLU B 1 21  ? -21.376 -28.375 -3.034  1.00 54.72 ? 21  GLU B HB2  1 
ATOM 1848 H HB3  . GLU B 1 21  ? -21.114 -29.563 -2.013  1.00 54.72 ? 21  GLU B HB3  1 
ATOM 1849 H HG2  . GLU B 1 21  ? -19.527 -28.334 -0.909  1.00 54.72 ? 21  GLU B HG2  1 
ATOM 1850 H HG3  . GLU B 1 21  ? -19.606 -27.183 -2.001  1.00 54.72 ? 21  GLU B HG3  1 
ATOM 1851 N N    . GLN B 1 22  ? -20.269 -31.775 -3.474  1.00 55.95 ? 22  GLN B N    1 
ATOM 1852 C CA   . GLN B 1 22  ? -20.649 -33.064 -4.039  1.00 58.80 ? 22  GLN B CA   1 
ATOM 1853 C C    . GLN B 1 22  ? -21.164 -33.965 -2.915  1.00 60.87 ? 22  GLN B C    1 
ATOM 1854 O O    . GLN B 1 22  ? -20.628 -33.934 -1.808  1.00 59.89 ? 22  GLN B O    1 
ATOM 1855 C CB   . GLN B 1 22  ? -19.441 -33.688 -4.748  1.00 58.75 ? 22  GLN B CB   1 
ATOM 1856 C CG   . GLN B 1 22  ? -19.740 -34.831 -5.711  1.00 61.96 ? 22  GLN B CG   1 
ATOM 1857 C CD   . GLN B 1 22  ? -18.473 -35.561 -6.150  1.00 62.36 ? 22  GLN B CD   1 
ATOM 1858 O OE1  . GLN B 1 22  ? -17.540 -35.736 -5.365  1.00 61.25 ? 22  GLN B OE1  1 
ATOM 1859 N NE2  . GLN B 1 22  ? -18.437 -35.983 -7.410  1.00 64.32 ? 22  GLN B NE2  1 
ATOM 1860 H H    . GLN B 1 22  ? -20.059 -31.816 -2.641  1.00 54.72 ? 22  GLN B H    1 
ATOM 1861 H HA   . GLN B 1 22  ? -21.359 -32.940 -4.688  1.00 54.72 ? 22  GLN B HA   1 
ATOM 1862 H HB2  . GLN B 1 22  ? -18.994 -32.993 -5.256  1.00 54.72 ? 22  GLN B HB2  1 
ATOM 1863 H HB3  . GLN B 1 22  ? -18.835 -34.032 -4.072  1.00 54.72 ? 22  GLN B HB3  1 
ATOM 1864 H HG2  . GLN B 1 22  ? -20.321 -35.472 -5.273  1.00 54.72 ? 22  GLN B HG2  1 
ATOM 1865 H HG3  . GLN B 1 22  ? -20.172 -34.474 -6.503  1.00 54.72 ? 22  GLN B HG3  1 
ATOM 1866 H HE21 . GLN B 1 22  ? -19.105 -35.839 -7.932  1.00 54.72 ? 22  GLN B HE21 1 
ATOM 1867 H HE22 . GLN B 1 22  ? -17.744 -36.399 -7.704  1.00 54.72 ? 22  GLN B HE22 1 
ATOM 1868 N N    . LYS B 1 23  ? -22.210 -34.746 -3.182  1.00 63.97 ? 23  LYS B N    1 
ATOM 1869 C CA   . LYS B 1 23  ? -22.775 -35.626 -2.159  1.00 66.57 ? 23  LYS B CA   1 
ATOM 1870 C C    . LYS B 1 23  ? -22.134 -37.011 -2.191  1.00 68.72 ? 23  LYS B C    1 
ATOM 1871 O O    . LYS B 1 23  ? -21.728 -37.539 -1.155  1.00 69.20 ? 23  LYS B O    1 
ATOM 1872 C CB   . LYS B 1 23  ? -24.290 -35.763 -2.326  1.00 69.67 ? 23  LYS B CB   1 
ATOM 1873 C CG   . LYS B 1 23  ? -24.957 -36.440 -1.135  1.00 72.44 ? 23  LYS B CG   1 
ATOM 1874 C CD   . LYS B 1 23  ? -26.329 -36.994 -1.478  1.00 76.78 ? 23  LYS B CD   1 
ATOM 1875 C CE   . LYS B 1 23  ? -26.861 -37.892 -0.368  1.00 80.29 ? 23  LYS B CE   1 
ATOM 1876 N NZ   . LYS B 1 23  ? -26.978 -37.185 0.936   1.00 78.90 ? 23  LYS B NZ   1 
ATOM 1877 H H    . LYS B 1 23  ? -22.609 -34.785 -3.943  1.00 54.72 ? 23  LYS B H    1 
ATOM 1878 H HA   . LYS B 1 23  ? -22.606 -35.240 -1.286  1.00 54.72 ? 23  LYS B HA   1 
ATOM 1879 H HB2  . LYS B 1 23  ? -24.678 -34.880 -2.425  1.00 54.72 ? 23  LYS B HB2  1 
ATOM 1880 H HB3  . LYS B 1 23  ? -24.474 -36.297 -3.115  1.00 54.72 ? 23  LYS B HB3  1 
ATOM 1881 H HG2  . LYS B 1 23  ? -24.401 -37.176 -0.836  1.00 54.72 ? 23  LYS B HG2  1 
ATOM 1882 H HG3  . LYS B 1 23  ? -25.063 -35.792 -0.421  1.00 54.72 ? 23  LYS B HG3  1 
ATOM 1883 H HD2  . LYS B 1 23  ? -26.951 -36.259 -1.598  1.00 54.72 ? 23  LYS B HD2  1 
ATOM 1884 H HD3  . LYS B 1 23  ? -26.269 -37.519 -2.291  1.00 54.72 ? 23  LYS B HD3  1 
ATOM 1885 H HE2  . LYS B 1 23  ? -27.742 -38.213 -0.615  1.00 54.72 ? 23  LYS B HE2  1 
ATOM 1886 H HE3  . LYS B 1 23  ? -26.256 -38.641 -0.249  1.00 54.72 ? 23  LYS B HE3  1 
ATOM 1887 H HZ1  . LYS B 1 23  ? -27.291 -37.741 1.556   1.00 54.72 ? 23  LYS B HZ1  1 
ATOM 1888 H HZ2  . LYS B 1 23  ? -26.180 -36.885 1.191   1.00 54.72 ? 23  LYS B HZ2  1 
ATOM 1889 H HZ3  . LYS B 1 23  ? -27.535 -36.496 0.858   1.00 54.72 ? 23  LYS B HZ3  1 
ATOM 1890 N N    . GLU B 1 24  ? -22.062 -37.593 -3.385  1.00 70.41 ? 24  GLU B N    1 
ATOM 1891 C CA   . GLU B 1 24  ? -21.508 -38.932 -3.575  1.00 73.13 ? 24  GLU B CA   1 
ATOM 1892 C C    . GLU B 1 24  ? -20.268 -38.862 -4.470  1.00 71.51 ? 24  GLU B C    1 
ATOM 1893 O O    . GLU B 1 24  ? -20.099 -37.908 -5.226  1.00 69.21 ? 24  GLU B O    1 
ATOM 1894 C CB   . GLU B 1 24  ? -22.558 -39.866 -4.191  1.00 77.90 ? 24  GLU B CB   1 
ATOM 1895 C CG   . GLU B 1 24  ? -23.975 -39.758 -3.588  1.00 79.96 ? 24  GLU B CG   1 
ATOM 1896 C CD   . GLU B 1 24  ? -24.237 -40.729 -2.441  1.00 82.94 ? 24  GLU B CD   1 
ATOM 1897 O OE1  . GLU B 1 24  ? -23.557 -41.775 -2.358  1.00 84.82 ? 24  GLU B OE1  1 
ATOM 1898 O OE2  . GLU B 1 24  ? -25.136 -40.446 -1.621  1.00 83.75 ? 24  GLU B OE2  1 
ATOM 1899 H H    . GLU B 1 24  ? -22.333 -37.226 -4.114  1.00 54.72 ? 24  GLU B H    1 
ATOM 1900 H HA   . GLU B 1 24  ? -21.244 -39.295 -2.715  1.00 54.72 ? 24  GLU B HA   1 
ATOM 1901 H HB2  . GLU B 1 24  ? -22.629 -39.667 -5.138  1.00 54.72 ? 24  GLU B HB2  1 
ATOM 1902 H HB3  . GLU B 1 24  ? -22.261 -40.782 -4.074  1.00 54.72 ? 24  GLU B HB3  1 
ATOM 1903 H HG2  . GLU B 1 24  ? -24.102 -38.858 -3.249  1.00 54.72 ? 24  GLU B HG2  1 
ATOM 1904 H HG3  . GLU B 1 24  ? -24.626 -39.941 -4.284  1.00 54.72 ? 24  GLU B HG3  1 
ATOM 1905 N N    . SER B 1 25  ? -19.414 -39.881 -4.397  1.00 73.12 ? 25  SER B N    1 
ATOM 1906 C CA   . SER B 1 25  ? -18.142 -39.879 -5.127  1.00 72.00 ? 25  SER B CA   1 
ATOM 1907 C C    . SER B 1 25  ? -18.335 -40.079 -6.635  1.00 74.04 ? 25  SER B C    1 
ATOM 1908 O O    . SER B 1 25  ? -17.375 -40.018 -7.406  1.00 73.54 ? 25  SER B O    1 
ATOM 1909 C CB   . SER B 1 25  ? -17.217 -40.967 -4.571  1.00 73.76 ? 25  SER B CB   1 
ATOM 1910 O OG   . SER B 1 25  ? -17.733 -42.261 -4.827  1.00 78.50 ? 25  SER B OG   1 
ATOM 1911 H H    . SER B 1 25  ? -19.546 -40.590 -3.929  1.00 54.72 ? 25  SER B H    1 
ATOM 1912 H HA   . SER B 1 25  ? -17.707 -39.023 -4.994  1.00 54.72 ? 25  SER B HA   1 
ATOM 1913 H HB2  . SER B 1 25  ? -16.347 -40.887 -4.994  1.00 54.72 ? 25  SER B HB2  1 
ATOM 1914 H HB3  . SER B 1 25  ? -17.130 -40.847 -3.612  1.00 54.72 ? 25  SER B HB3  1 
ATOM 1915 H HG   . SER B 1 25  ? -17.215 -42.844 -4.517  1.00 54.72 ? 25  SER B HG   1 
ATOM 1916 N N    . ASN B 1 26  ? -19.580 -40.319 -7.038  1.00 76.75 ? 26  ASN B N    1 
ATOM 1917 C CA   . ASN B 1 26  ? -19.945 -40.492 -8.442  1.00 79.34 ? 26  ASN B CA   1 
ATOM 1918 C C    . ASN B 1 26  ? -21.245 -39.744 -8.737  1.00 79.42 ? 26  ASN B C    1 
ATOM 1919 O O    . ASN B 1 26  ? -21.970 -40.070 -9.680  1.00 82.87 ? 26  ASN B O    1 
ATOM 1920 C CB   . ASN B 1 26  ? -20.080 -41.980 -8.783  1.00 84.74 ? 26  ASN B CB   1 
ATOM 1921 C CG   . ASN B 1 26  ? -20.830 -42.756 -7.722  1.00 87.24 ? 26  ASN B CG   1 
ATOM 1922 O OD1  . ASN B 1 26  ? -21.720 -42.224 -7.061  1.00 86.20 ? 26  ASN B OD1  1 
ATOM 1923 N ND2  . ASN B 1 26  ? -20.464 -44.024 -7.549  1.00 90.92 ? 26  ASN B ND2  1 
ATOM 1924 H H    . ASN B 1 26  ? -20.249 -40.387 -6.502  1.00 54.72 ? 26  ASN B H    1 
ATOM 1925 H HA   . ASN B 1 26  ? -19.247 -40.116 -9.001  1.00 54.72 ? 26  ASN B HA   1 
ATOM 1926 H HB2  . ASN B 1 26  ? -20.563 -42.071 -9.619  1.00 54.72 ? 26  ASN B HB2  1 
ATOM 1927 H HB3  . ASN B 1 26  ? -19.194 -42.367 -8.867  1.00 54.72 ? 26  ASN B HB3  1 
ATOM 1928 H HD21 . ASN B 1 26  ? -20.859 -44.508 -6.958  1.00 54.72 ? 26  ASN B HD21 1 
ATOM 1929 H HD22 . ASN B 1 26  ? -19.832 -44.358 -8.027  1.00 54.72 ? 26  ASN B HD22 1 
ATOM 1930 N N    . GLY B 1 27  ? -21.524 -38.735 -7.916  1.00 75.97 ? 27  GLY B N    1 
ATOM 1931 C CA   . GLY B 1 27  ? -22.737 -37.947 -8.036  1.00 75.97 ? 27  GLY B CA   1 
ATOM 1932 C C    . GLY B 1 27  ? -22.516 -36.617 -8.721  1.00 72.83 ? 27  GLY B C    1 
ATOM 1933 O O    . GLY B 1 27  ? -21.425 -36.329 -9.214  1.00 70.91 ? 27  GLY B O    1 
ATOM 1934 H H    . GLY B 1 27  ? -21.013 -38.485 -7.271  1.00 54.72 ? 27  GLY B H    1 
ATOM 1935 H HA2  . GLY B 1 27  ? -23.395 -38.446 -8.544  1.00 54.72 ? 27  GLY B HA2  1 
ATOM 1936 H HA3  . GLY B 1 27  ? -23.098 -37.778 -7.152  1.00 54.72 ? 27  GLY B HA3  1 
ATOM 1937 N N    . PRO B 1 28  ? -23.566 -35.791 -8.755  1.00 72.67 ? 28  PRO B N    1 
ATOM 1938 C CA   . PRO B 1 28  ? -23.504 -34.476 -9.393  1.00 70.21 ? 28  PRO B CA   1 
ATOM 1939 C C    . PRO B 1 28  ? -22.688 -33.479 -8.577  1.00 65.74 ? 28  PRO B C    1 
ATOM 1940 O O    . PRO B 1 28  ? -22.513 -33.672 -7.373  1.00 64.69 ? 28  PRO B O    1 
ATOM 1941 C CB   . PRO B 1 28  ? -24.974 -34.061 -9.477  1.00 72.17 ? 28  PRO B CB   1 
ATOM 1942 C CG   . PRO B 1 28  ? -25.632 -34.787 -8.341  1.00 73.91 ? 28  PRO B CG   1 
ATOM 1943 C CD   . PRO B 1 28  ? -24.899 -36.083 -8.196  1.00 75.37 ? 28  PRO B CD   1 
ATOM 1944 H HA   . PRO B 1 28  ? -23.134 -34.546 -10.287 1.00 54.72 ? 28  PRO B HA   1 
ATOM 1945 H HB2  . PRO B 1 28  ? -25.052 -33.101 -9.364  1.00 54.72 ? 28  PRO B HB2  1 
ATOM 1946 H HB3  . PRO B 1 28  ? -25.346 -34.341 -10.328 1.00 54.72 ? 28  PRO B HB3  1 
ATOM 1947 H HG2  . PRO B 1 28  ? -25.555 -34.260 -7.531  1.00 54.72 ? 28  PRO B HG2  1 
ATOM 1948 H HG3  . PRO B 1 28  ? -26.565 -34.947 -8.556  1.00 54.72 ? 28  PRO B HG3  1 
ATOM 1949 H HD2  . PRO B 1 28  ? -24.826 -36.327 -7.260  1.00 54.72 ? 28  PRO B HD2  1 
ATOM 1950 H HD3  . PRO B 1 28  ? -25.336 -36.778 -8.712  1.00 54.72 ? 28  PRO B HD3  1 
ATOM 1951 N N    . VAL B 1 29  ? -22.191 -32.439 -9.241  1.00 63.60 ? 29  VAL B N    1 
ATOM 1952 C CA   . VAL B 1 29  ? -21.375 -31.415 -8.596  1.00 59.88 ? 29  VAL B CA   1 
ATOM 1953 C C    . VAL B 1 29  ? -22.062 -30.057 -8.637  1.00 58.74 ? 29  VAL B C    1 
ATOM 1954 O O    . VAL B 1 29  ? -22.227 -29.465 -9.703  1.00 59.21 ? 29  VAL B O    1 
ATOM 1955 C CB   . VAL B 1 29  ? -19.997 -31.294 -9.266  1.00 59.22 ? 29  VAL B CB   1 
ATOM 1956 C CG1  . VAL B 1 29  ? -19.158 -30.222 -8.582  1.00 55.92 ? 29  VAL B CG1  1 
ATOM 1957 C CG2  . VAL B 1 29  ? -19.281 -32.628 -9.229  1.00 60.68 ? 29  VAL B CG2  1 
ATOM 1958 H H    . VAL B 1 29  ? -22.315 -32.301 -10.080 1.00 54.72 ? 29  VAL B H    1 
ATOM 1959 H HA   . VAL B 1 29  ? -21.239 -31.657 -7.667  1.00 54.72 ? 29  VAL B HA   1 
ATOM 1960 H HB   . VAL B 1 29  ? -20.115 -31.039 -10.194 1.00 54.72 ? 29  VAL B HB   1 
ATOM 1961 H HG11 . VAL B 1 29  ? -18.296 -30.167 -9.023  1.00 54.72 ? 29  VAL B HG11 1 
ATOM 1962 H HG12 . VAL B 1 29  ? -19.618 -29.371 -8.647  1.00 54.72 ? 29  VAL B HG12 1 
ATOM 1963 H HG13 . VAL B 1 29  ? -19.037 -30.463 -7.650  1.00 54.72 ? 29  VAL B HG13 1 
ATOM 1964 H HG21 . VAL B 1 29  ? -18.415 -32.533 -9.656  1.00 54.72 ? 29  VAL B HG21 1 
ATOM 1965 H HG22 . VAL B 1 29  ? -19.167 -32.900 -8.305  1.00 54.72 ? 29  VAL B HG22 1 
ATOM 1966 H HG23 . VAL B 1 29  ? -19.814 -33.285 -9.705  1.00 54.72 ? 29  VAL B HG23 1 
ATOM 1967 N N    . LYS B 1 30  ? -22.453 -29.568 -7.466  1.00 59.16 ? 30  LYS B N    1 
ATOM 1968 C CA   . LYS B 1 30  ? -23.055 -28.247 -7.343  1.00 58.26 ? 30  LYS B CA   1 
ATOM 1969 C C    . LYS B 1 30  ? -21.979 -27.172 -7.279  1.00 55.45 ? 30  LYS B C    1 
ATOM 1970 O O    . LYS B 1 30  ? -21.155 -27.177 -6.364  1.00 53.81 ? 30  LYS B O    1 
ATOM 1971 C CB   . LYS B 1 30  ? -23.926 -28.168 -6.091  1.00 58.64 ? 30  LYS B CB   1 
ATOM 1972 C CG   . LYS B 1 30  ? -25.116 -29.120 -6.073  1.00 61.96 ? 30  LYS B CG   1 
ATOM 1973 C CD   . LYS B 1 30  ? -26.305 -28.588 -6.875  1.00 64.06 ? 30  LYS B CD   1 
ATOM 1974 C CE   . LYS B 1 30  ? -27.633 -29.044 -6.282  1.00 67.16 ? 30  LYS B CE   1 
ATOM 1975 N NZ   . LYS B 1 30  ? -27.686 -30.518 -6.087  1.00 69.44 ? 30  LYS B NZ   1 
ATOM 1976 H H    . LYS B 1 30  ? -22.379 -29.988 -6.718  1.00 54.72 ? 30  LYS B H    1 
ATOM 1977 H HA   . LYS B 1 30  ? -23.614 -28.075 -8.116  1.00 54.72 ? 30  LYS B HA   1 
ATOM 1978 H HB2  . LYS B 1 30  ? -23.376 -28.372 -5.319  1.00 54.72 ? 30  LYS B HB2  1 
ATOM 1979 H HB3  . LYS B 1 30  ? -24.273 -27.265 -6.013  1.00 54.72 ? 30  LYS B HB3  1 
ATOM 1980 H HG2  . LYS B 1 30  ? -24.848 -29.969 -6.460  1.00 54.72 ? 30  LYS B HG2  1 
ATOM 1981 H HG3  . LYS B 1 30  ? -25.405 -29.249 -5.156  1.00 54.72 ? 30  LYS B HG3  1 
ATOM 1982 H HD2  . LYS B 1 30  ? -26.286 -27.618 -6.869  1.00 54.72 ? 30  LYS B HD2  1 
ATOM 1983 H HD3  . LYS B 1 30  ? -26.249 -28.919 -7.786  1.00 54.72 ? 30  LYS B HD3  1 
ATOM 1984 H HE2  . LYS B 1 30  ? -27.757 -28.621 -5.419  1.00 54.72 ? 30  LYS B HE2  1 
ATOM 1985 H HE3  . LYS B 1 30  ? -28.352 -28.793 -6.884  1.00 54.72 ? 30  LYS B HE3  1 
ATOM 1986 H HZ1  . LYS B 1 30  ? -28.472 -30.751 -5.740  1.00 54.72 ? 30  LYS B HZ1  1 
ATOM 1987 H HZ2  . LYS B 1 30  ? -27.580 -30.932 -6.867  1.00 54.72 ? 30  LYS B HZ2  1 
ATOM 1988 H HZ3  . LYS B 1 30  ? -27.039 -30.775 -5.533  1.00 54.72 ? 30  LYS B HZ3  1 
ATOM 1989 N N    . VAL B 1 31  ? -21.993 -26.254 -8.242  1.00 57.40 ? 31  VAL B N    1 
ATOM 1990 C CA   . VAL B 1 31  ? -21.051 -25.140 -8.261  1.00 55.35 ? 31  VAL B CA   1 
ATOM 1991 C C    . VAL B 1 31  ? -21.799 -23.827 -8.038  1.00 55.31 ? 31  VAL B C    1 
ATOM 1992 O O    . VAL B 1 31  ? -22.749 -23.527 -8.761  1.00 56.96 ? 31  VAL B O    1 
ATOM 1993 C CB   . VAL B 1 31  ? -20.284 -25.071 -9.594  1.00 55.21 ? 31  VAL B CB   1 
ATOM 1994 C CG1  . VAL B 1 31  ? -19.108 -24.124 -9.478  1.00 53.40 ? 31  VAL B CG1  1 
ATOM 1995 C CG2  . VAL B 1 31  ? -19.798 -26.454 -10.006 1.00 56.22 ? 31  VAL B CG2  1 
ATOM 1996 H H    . VAL B 1 31  ? -22.543 -26.256 -8.903  1.00 54.72 ? 31  VAL B H    1 
ATOM 1997 H HA   . VAL B 1 31  ? -20.407 -25.251 -7.543  1.00 54.72 ? 31  VAL B HA   1 
ATOM 1998 H HB   . VAL B 1 31  ? -20.875 -24.738 -10.286 1.00 54.72 ? 31  VAL B HB   1 
ATOM 1999 H HG11 . VAL B 1 31  ? -18.641 -24.096 -10.328 1.00 54.72 ? 31  VAL B HG11 1 
ATOM 2000 H HG12 . VAL B 1 31  ? -19.437 -23.239 -9.252  1.00 54.72 ? 31  VAL B HG12 1 
ATOM 2001 H HG13 . VAL B 1 31  ? -18.513 -24.443 -8.782  1.00 54.72 ? 31  VAL B HG13 1 
ATOM 2002 H HG21 . VAL B 1 31  ? -19.320 -26.383 -10.846 1.00 54.72 ? 31  VAL B HG21 1 
ATOM 2003 H HG22 . VAL B 1 31  ? -19.209 -26.800 -9.317  1.00 54.72 ? 31  VAL B HG22 1 
ATOM 2004 H HG23 . VAL B 1 31  ? -20.565 -27.039 -10.110 1.00 54.72 ? 31  VAL B HG23 1 
ATOM 2005 N N    . TRP B 1 32  ? -21.376 -23.044 -7.049  1.00 54.52 ? 32  TRP B N    1 
ATOM 2006 C CA   . TRP B 1 32  ? -22.045 -21.778 -6.758  1.00 54.87 ? 32  TRP B CA   1 
ATOM 2007 C C    . TRP B 1 32  ? -21.074 -20.717 -6.239  1.00 53.51 ? 32  TRP B C    1 
ATOM 2008 O O    . TRP B 1 32  ? -19.898 -20.996 -5.998  1.00 52.27 ? 32  TRP B O    1 
ATOM 2009 C CB   . TRP B 1 32  ? -23.178 -21.995 -5.749  1.00 52.67 ? 32  TRP B CB   1 
ATOM 2010 C CG   . TRP B 1 32  ? -22.738 -22.566 -4.442  1.00 51.87 ? 32  TRP B CG   1 
ATOM 2011 C CD1  . TRP B 1 32  ? -22.484 -23.876 -4.166  1.00 51.91 ? 32  TRP B CD1  1 
ATOM 2012 C CD2  . TRP B 1 32  ? -22.514 -21.847 -3.224  1.00 51.40 ? 32  TRP B CD2  1 
ATOM 2013 N NE1  . TRP B 1 32  ? -22.110 -24.019 -2.853  1.00 51.41 ? 32  TRP B NE1  1 
ATOM 2014 C CE2  . TRP B 1 32  ? -22.120 -22.787 -2.252  1.00 51.12 ? 32  TRP B CE2  1 
ATOM 2015 C CE3  . TRP B 1 32  ? -22.605 -20.499 -2.862  1.00 51.60 ? 32  TRP B CE3  1 
ATOM 2016 C CZ2  . TRP B 1 32  ? -21.815 -22.423 -0.942  1.00 51.04 ? 32  TRP B CZ2  1 
ATOM 2017 C CZ3  . TRP B 1 32  ? -22.301 -20.139 -1.562  1.00 51.59 ? 32  TRP B CZ3  1 
ATOM 2018 C CH2  . TRP B 1 32  ? -21.912 -21.098 -0.617  1.00 51.32 ? 32  TRP B CH2  1 
ATOM 2019 H H    . TRP B 1 32  ? -20.710 -23.221 -6.534  1.00 54.72 ? 32  TRP B H    1 
ATOM 2020 H HA   . TRP B 1 32  ? -22.440 -21.440 -7.577  1.00 54.72 ? 32  TRP B HA   1 
ATOM 2021 H HB2  . TRP B 1 32  ? -23.602 -21.142 -5.570  1.00 54.72 ? 32  TRP B HB2  1 
ATOM 2022 H HB3  . TRP B 1 32  ? -23.824 -22.607 -6.136  1.00 54.72 ? 32  TRP B HB3  1 
ATOM 2023 H HD1  . TRP B 1 32  ? -22.554 -24.573 -4.778  1.00 54.72 ? 32  TRP B HD1  1 
ATOM 2024 H HE1  . TRP B 1 32  ? -21.903 -24.760 -2.470  1.00 54.72 ? 32  TRP B HE1  1 
ATOM 2025 H HE3  . TRP B 1 32  ? -22.861 -19.857 -3.484  1.00 54.72 ? 32  TRP B HE3  1 
ATOM 2026 H HZ2  . TRP B 1 32  ? -21.557 -23.057 -0.313  1.00 54.72 ? 32  TRP B HZ2  1 
ATOM 2027 H HZ3  . TRP B 1 32  ? -22.358 -19.246 -1.309  1.00 54.72 ? 32  TRP B HZ3  1 
ATOM 2028 H HH2  . TRP B 1 32  ? -21.715 -20.828 0.251   1.00 54.72 ? 32  TRP B HH2  1 
ATOM 2029 N N    . GLY B 1 33  ? -21.582 -19.498 -6.079  1.00 51.92 ? 33  GLY B N    1 
ATOM 2030 C CA   . GLY B 1 33  ? -20.768 -18.359 -5.700  1.00 51.40 ? 33  GLY B CA   1 
ATOM 2031 C C    . GLY B 1 33  ? -20.935 -17.260 -6.728  1.00 52.42 ? 33  GLY B C    1 
ATOM 2032 O O    . GLY B 1 33  ? -21.785 -17.366 -7.612  1.00 53.57 ? 33  GLY B O    1 
ATOM 2033 H H    . GLY B 1 33  ? -22.414 -19.307 -6.187  1.00 54.72 ? 33  GLY B H    1 
ATOM 2034 H HA2  . GLY B 1 33  ? -21.043 -18.026 -4.832  1.00 54.72 ? 33  GLY B HA2  1 
ATOM 2035 H HA3  . GLY B 1 33  ? -19.833 -18.616 -5.659  1.00 54.72 ? 33  GLY B HA3  1 
ATOM 2036 N N    . SER B 1 34  ? -20.126 -16.210 -6.625  1.00 55.79 ? 34  SER B N    1 
ATOM 2037 C CA   . SER B 1 34  ? -20.239 -15.084 -7.544  1.00 57.18 ? 34  SER B CA   1 
ATOM 2038 C C    . SER B 1 34  ? -18.890 -14.470 -7.901  1.00 57.04 ? 34  SER B C    1 
ATOM 2039 O O    . SER B 1 34  ? -18.030 -14.275 -7.040  1.00 56.52 ? 34  SER B O    1 
ATOM 2040 C CB   . SER B 1 34  ? -21.148 -14.005 -6.948  1.00 54.77 ? 34  SER B CB   1 
ATOM 2041 O OG   . SER B 1 34  ? -20.591 -13.444 -5.772  1.00 54.74 ? 34  SER B OG   1 
ATOM 2042 H H    . SER B 1 34  ? -19.506 -16.126 -6.034  1.00 54.72 ? 34  SER B H    1 
ATOM 2043 H HA   . SER B 1 34  ? -20.649 -15.395 -8.367  1.00 54.72 ? 34  SER B HA   1 
ATOM 2044 H HB2  . SER B 1 34  ? -21.269 -13.300 -7.604  1.00 54.72 ? 34  SER B HB2  1 
ATOM 2045 H HB3  . SER B 1 34  ? -22.005 -14.402 -6.730  1.00 54.72 ? 34  SER B HB3  1 
ATOM 2046 H HG   . SER B 1 34  ? -21.105 -12.856 -5.463  1.00 54.72 ? 34  SER B HG   1 
ATOM 2047 N N    . ALA B 1 35  ? -18.712 -14.182 -9.186  1.00 57.07 ? 35  ALA B N    1 
ATOM 2048 C CA   . ALA B 1 35  ? -17.604 -13.353 -9.635  1.00 57.83 ? 35  ALA B CA   1 
ATOM 2049 C C    . ALA B 1 35  ? -18.006 -11.887 -9.540  1.00 59.88 ? 35  ALA B C    1 
ATOM 2050 O O    . ALA B 1 35  ? -19.170 -11.579 -9.291  1.00 60.69 ? 35  ALA B O    1 
ATOM 2051 C CB   . ALA B 1 35  ? -17.211 -13.701 -11.056 1.00 56.78 ? 35  ALA B CB   1 
ATOM 2052 H H    . ALA B 1 35  ? -19.224 -14.456 -9.820  1.00 54.72 ? 35  ALA B H    1 
ATOM 2053 H HA   . ALA B 1 35  ? -16.836 -13.499 -9.060  1.00 54.72 ? 35  ALA B HA   1 
ATOM 2054 H HB1  . ALA B 1 35  ? -16.472 -13.134 -11.327 1.00 54.72 ? 35  ALA B HB1  1 
ATOM 2055 H HB2  . ALA B 1 35  ? -16.943 -14.633 -11.090 1.00 54.72 ? 35  ALA B HB2  1 
ATOM 2056 H HB3  . ALA B 1 35  ? -17.972 -13.554 -11.639 1.00 54.72 ? 35  ALA B HB3  1 
ATOM 2057 N N    . LYS B 1 36  ? -17.045 -10.988 -9.743  1.00 59.13 ? 36  LYS B N    1 
ATOM 2058 C CA   . LYS B 1 36  ? -17.330 -9.553  -9.774  1.00 61.68 ? 36  LYS B CA   1 
ATOM 2059 C C    . LYS B 1 36  ? -16.345 -8.791  -10.654 1.00 63.56 ? 36  LYS B C    1 
ATOM 2060 O O    . LYS B 1 36  ? -15.197 -9.204  -10.817 1.00 62.93 ? 36  LYS B O    1 
ATOM 2061 C CB   . LYS B 1 36  ? -17.310 -8.967  -8.358  1.00 64.82 ? 36  LYS B CB   1 
ATOM 2062 C CG   . LYS B 1 36  ? -18.571 -9.281  -7.554  1.00 64.31 ? 36  LYS B CG   1 
ATOM 2063 C CD   . LYS B 1 36  ? -18.842 -8.259  -6.450  1.00 66.28 ? 36  LYS B CD   1 
ATOM 2064 C CE   . LYS B 1 36  ? -20.313 -8.267  -6.049  1.00 66.96 ? 36  LYS B CE   1 
ATOM 2065 N NZ   . LYS B 1 36  ? -20.767 -9.599  -5.568  1.00 64.66 ? 36  LYS B NZ   1 
ATOM 2066 H H    . LYS B 1 36  ? -16.217 -11.183 -9.866  1.00 54.72 ? 36  LYS B H    1 
ATOM 2067 H HA   . LYS B 1 36  ? -18.219 -9.418  -10.138 1.00 54.72 ? 36  LYS B HA   1 
ATOM 2068 H HB2  . LYS B 1 36  ? -16.552 -9.334  -7.877  1.00 54.72 ? 36  LYS B HB2  1 
ATOM 2069 H HB3  . LYS B 1 36  ? -17.228 -8.003  -8.418  1.00 54.72 ? 36  LYS B HB3  1 
ATOM 2070 H HG2  . LYS B 1 36  ? -19.334 -9.285  -8.153  1.00 54.72 ? 36  LYS B HG2  1 
ATOM 2071 H HG3  . LYS B 1 36  ? -18.472 -10.152 -7.138  1.00 54.72 ? 36  LYS B HG3  1 
ATOM 2072 H HD2  . LYS B 1 36  ? -18.311 -8.480  -5.669  1.00 54.72 ? 36  LYS B HD2  1 
ATOM 2073 H HD3  . LYS B 1 36  ? -18.617 -7.371  -6.771  1.00 54.72 ? 36  LYS B HD3  1 
ATOM 2074 H HE2  . LYS B 1 36  ? -20.450 -7.626  -5.334  1.00 54.72 ? 36  LYS B HE2  1 
ATOM 2075 H HE3  . LYS B 1 36  ? -20.852 -8.026  -6.819  1.00 54.72 ? 36  LYS B HE3  1 
ATOM 2076 H HZ1  . LYS B 1 36  ? -21.628 -9.564  -5.344  1.00 54.72 ? 36  LYS B HZ1  1 
ATOM 2077 H HZ2  . LYS B 1 36  ? -20.659 -10.207 -6.208  1.00 54.72 ? 36  LYS B HZ2  1 
ATOM 2078 H HZ3  . LYS B 1 36  ? -20.293 -9.842  -4.855  1.00 54.72 ? 36  LYS B HZ3  1 
ATOM 2079 N N    . GLY B 1 37  ? -16.802 -7.679  -11.222 1.00 63.76 ? 37  GLY B N    1 
ATOM 2080 C CA   . GLY B 1 37  ? -15.940 -6.825  -12.019 1.00 66.24 ? 37  GLY B CA   1 
ATOM 2081 C C    . GLY B 1 37  ? -15.779 -7.296  -13.455 1.00 66.57 ? 37  GLY B C    1 
ATOM 2082 O O    . GLY B 1 37  ? -14.744 -7.046  -14.074 1.00 67.95 ? 37  GLY B O    1 
ATOM 2083 H H    . GLY B 1 37  ? -17.612 -7.398  -11.157 1.00 54.72 ? 37  GLY B H    1 
ATOM 2084 H HA2  . GLY B 1 37  ? -16.306 -5.927  -12.034 1.00 54.72 ? 37  GLY B HA2  1 
ATOM 2085 H HA3  . GLY B 1 37  ? -15.061 -6.788  -11.611 1.00 54.72 ? 37  GLY B HA3  1 
ATOM 2086 N N    . LEU B 1 38  ? -16.794 -7.976  -13.984 1.00 66.32 ? 38  LEU B N    1 
ATOM 2087 C CA   . LEU B 1 38  ? -16.772 -8.432  -15.373 1.00 67.17 ? 38  LEU B CA   1 
ATOM 2088 C C    . LEU B 1 38  ? -17.313 -7.352  -16.298 1.00 70.64 ? 38  LEU B C    1 
ATOM 2089 O O    . LEU B 1 38  ? -17.757 -6.300  -15.837 1.00 72.25 ? 38  LEU B O    1 
ATOM 2090 C CB   . LEU B 1 38  ? -17.595 -9.709  -15.544 1.00 67.61 ? 38  LEU B CB   1 
ATOM 2091 C CG   . LEU B 1 38  ? -17.147 -10.919 -14.729 1.00 64.49 ? 38  LEU B CG   1 
ATOM 2092 C CD1  . LEU B 1 38  ? -18.287 -11.900 -14.588 1.00 63.28 ? 38  LEU B CD1  1 
ATOM 2093 C CD2  . LEU B 1 38  ? -15.952 -11.603 -15.374 1.00 64.22 ? 38  LEU B CD2  1 
ATOM 2094 H H    . LEU B 1 38  ? -17.510 -8.188  -13.557 1.00 54.72 ? 38  LEU B H    1 
ATOM 2095 H HA   . LEU B 1 38  ? -15.857 -8.623  -15.632 1.00 54.72 ? 38  LEU B HA   1 
ATOM 2096 H HB2  . LEU B 1 38  ? -18.512 -9.515  -15.292 1.00 54.72 ? 38  LEU B HB2  1 
ATOM 2097 H HB3  . LEU B 1 38  ? -17.567 -9.965  -16.479 1.00 54.72 ? 38  LEU B HB3  1 
ATOM 2098 H HG   . LEU B 1 38  ? -16.886 -10.627 -13.841 1.00 54.72 ? 38  LEU B HG   1 
ATOM 2099 H HD11 . LEU B 1 38  ? -17.986 -12.662 -14.068 1.00 54.72 ? 38  LEU B HD11 1 
ATOM 2100 H HD12 . LEU B 1 38  ? -19.026 -11.463 -14.137 1.00 54.72 ? 38  LEU B HD12 1 
ATOM 2101 H HD13 . LEU B 1 38  ? -18.564 -12.191 -15.471 1.00 54.72 ? 38  LEU B HD13 1 
ATOM 2102 H HD21 . LEU B 1 38  ? -15.695 -12.365 -14.832 1.00 54.72 ? 38  LEU B HD21 1 
ATOM 2103 H HD22 . LEU B 1 38  ? -16.201 -11.898 -16.264 1.00 54.72 ? 38  LEU B HD22 1 
ATOM 2104 H HD23 . LEU B 1 38  ? -15.218 -10.971 -15.428 1.00 54.72 ? 38  LEU B HD23 1 
ATOM 2105 N N    . THR B 1 39  ? -17.265 -7.617  -17.602 1.00 72.35 ? 39  THR B N    1 
ATOM 2106 C CA   . THR B 1 39  ? -17.949 -6.781  -18.582 1.00 75.82 ? 39  THR B CA   1 
ATOM 2107 C C    . THR B 1 39  ? -19.271 -7.452  -18.940 1.00 75.60 ? 39  THR B C    1 
ATOM 2108 O O    . THR B 1 39  ? -19.287 -8.618  -19.338 1.00 74.30 ? 39  THR B O    1 
ATOM 2109 C CB   . THR B 1 39  ? -17.108 -6.564  -19.857 1.00 77.61 ? 39  THR B CB   1 
ATOM 2110 O OG1  . THR B 1 39  ? -17.110 -7.755  -20.654 1.00 76.92 ? 39  THR B OG1  1 
ATOM 2111 C CG2  . THR B 1 39  ? -15.677 -6.176  -19.503 1.00 77.76 ? 39  THR B CG2  1 
ATOM 2112 H H    . THR B 1 39  ? -16.840 -8.281  -17.945 1.00 54.72 ? 39  THR B H    1 
ATOM 2113 H HA   . THR B 1 39  ? -18.140 -5.914  -18.190 1.00 54.72 ? 39  THR B HA   1 
ATOM 2114 H HB   . THR B 1 39  ? -17.496 -5.839  -20.372 1.00 54.72 ? 39  THR B HB   1 
ATOM 2115 H HG1  . THR B 1 39  ? -16.783 -8.393  -20.217 1.00 54.72 ? 39  THR B HG1  1 
ATOM 2116 H HG21 . THR B 1 39  ? -15.160 -6.043  -20.313 1.00 54.72 ? 39  THR B HG21 1 
ATOM 2117 H HG22 . THR B 1 39  ? -15.674 -5.354  -18.988 1.00 54.72 ? 39  THR B HG22 1 
ATOM 2118 H HG23 . THR B 1 39  ? -15.264 -6.879  -18.977 1.00 54.72 ? 39  THR B HG23 1 
ATOM 2119 N N    . GLU B 1 40  ? -20.371 -6.717  -18.784 1.00 76.38 ? 40  GLU B N    1 
ATOM 2120 C CA   . GLU B 1 40  ? -21.716 -7.267  -18.957 1.00 76.57 ? 40  GLU B CA   1 
ATOM 2121 C C    . GLU B 1 40  ? -21.873 -8.106  -20.222 1.00 77.72 ? 40  GLU B C    1 
ATOM 2122 O O    . GLU B 1 40  ? -21.629 -7.626  -21.330 1.00 80.70 ? 40  GLU B O    1 
ATOM 2123 C CB   . GLU B 1 40  ? -22.745 -6.138  -18.973 1.00 79.62 ? 40  GLU B CB   1 
ATOM 2124 C CG   . GLU B 1 40  ? -24.179 -6.617  -19.007 1.00 80.22 ? 40  GLU B CG   1 
ATOM 2125 C CD   . GLU B 1 40  ? -25.163 -5.471  -18.928 1.00 83.45 ? 40  GLU B CD   1 
ATOM 2126 O OE1  . GLU B 1 40  ? -25.041 -4.532  -19.743 1.00 86.77 ? 40  GLU B OE1  1 
ATOM 2127 O OE2  . GLU B 1 40  ? -26.049 -5.503  -18.047 1.00 83.01 ? 40  GLU B OE2  1 
ATOM 2128 H H    . GLU B 1 40  ? -20.364 -5.883  -18.575 1.00 54.72 ? 40  GLU B H    1 
ATOM 2129 H HA   . GLU B 1 40  ? -21.917 -7.838  -18.199 1.00 54.72 ? 40  GLU B HA   1 
ATOM 2130 H HB2  . GLU B 1 40  ? -22.631 -5.600  -18.175 1.00 54.72 ? 40  GLU B HB2  1 
ATOM 2131 H HB3  . GLU B 1 40  ? -22.597 -5.592  -19.761 1.00 54.72 ? 40  GLU B HB3  1 
ATOM 2132 H HG2  . GLU B 1 40  ? -24.336 -7.094  -19.837 1.00 54.72 ? 40  GLU B HG2  1 
ATOM 2133 H HG3  . GLU B 1 40  ? -24.337 -7.203  -18.250 1.00 54.72 ? 40  GLU B HG3  1 
ATOM 2134 N N    . GLY B 1 41  ? -22.275 -9.362  -20.041 1.00 75.75 ? 41  GLY B N    1 
ATOM 2135 C CA   . GLY B 1 41  ? -22.499 -10.268 -21.155 1.00 77.15 ? 41  GLY B CA   1 
ATOM 2136 C C    . GLY B 1 41  ? -22.267 -11.730 -20.813 1.00 74.45 ? 41  GLY B C    1 
ATOM 2137 O O    . GLY B 1 41  ? -22.234 -12.109 -19.642 1.00 71.48 ? 41  GLY B O    1 
ATOM 2138 H H    . GLY B 1 41  ? -22.426 -9.714  -19.271 1.00 54.72 ? 41  GLY B H    1 
ATOM 2139 H HA2  . GLY B 1 41  ? -23.413 -10.172 -21.465 1.00 54.72 ? 41  GLY B HA2  1 
ATOM 2140 H HA3  . GLY B 1 41  ? -21.905 -10.030 -21.884 1.00 54.72 ? 41  GLY B HA3  1 
ATOM 2141 N N    . LEU B 1 42  ? -22.108 -12.549 -21.849 1.00 75.90 ? 42  LEU B N    1 
ATOM 2142 C CA   . LEU B 1 42  ? -21.865 -13.979 -21.683 1.00 74.12 ? 42  LEU B CA   1 
ATOM 2143 C C    . LEU B 1 42  ? -20.365 -14.261 -21.617 1.00 72.42 ? 42  LEU B C    1 
ATOM 2144 O O    . LEU B 1 42  ? -19.602 -13.793 -22.464 1.00 74.30 ? 42  LEU B O    1 
ATOM 2145 C CB   . LEU B 1 42  ? -22.516 -14.766 -22.830 1.00 77.24 ? 42  LEU B CB   1 
ATOM 2146 C CG   . LEU B 1 42  ? -24.019 -15.064 -22.725 1.00 78.68 ? 42  LEU B CG   1 
ATOM 2147 C CD1  . LEU B 1 42  ? -24.797 -13.891 -22.133 1.00 78.85 ? 42  LEU B CD1  1 
ATOM 2148 C CD2  . LEU B 1 42  ? -24.568 -15.431 -24.104 1.00 83.06 ? 42  LEU B CD2  1 
ATOM 2149 H H    . LEU B 1 42  ? -22.137 -12.297 -22.671 1.00 54.72 ? 42  LEU B H    1 
ATOM 2150 H HA   . LEU B 1 42  ? -22.264 -14.274 -20.850 1.00 54.72 ? 42  LEU B HA   1 
ATOM 2151 H HB2  . LEU B 1 42  ? -22.384 -14.265 -23.650 1.00 54.72 ? 42  LEU B HB2  1 
ATOM 2152 H HB3  . LEU B 1 42  ? -22.062 -15.620 -22.903 1.00 54.72 ? 42  LEU B HB3  1 
ATOM 2153 H HG   . LEU B 1 42  ? -24.146 -15.829 -22.142 1.00 54.72 ? 42  LEU B HG   1 
ATOM 2154 H HD11 . LEU B 1 42  ? -25.737 -14.127 -22.087 1.00 54.72 ? 42  LEU B HD11 1 
ATOM 2155 H HD12 . LEU B 1 42  ? -24.458 -13.705 -21.243 1.00 54.72 ? 42  LEU B HD12 1 
ATOM 2156 H HD13 . LEU B 1 42  ? -24.678 -13.114 -22.702 1.00 54.72 ? 42  LEU B HD13 1 
ATOM 2157 H HD21 . LEU B 1 42  ? -25.516 -15.618 -24.026 1.00 54.72 ? 42  LEU B HD21 1 
ATOM 2158 H HD22 . LEU B 1 42  ? -24.425 -14.687 -24.708 1.00 54.72 ? 42  LEU B HD22 1 
ATOM 2159 H HD23 . LEU B 1 42  ? -24.101 -16.217 -24.430 1.00 54.72 ? 42  LEU B HD23 1 
ATOM 2160 N N    . HIS B 1 43  ? -19.954 -15.011 -20.595 1.00 71.01 ? 43  HIS B N    1 
ATOM 2161 C CA   . HIS B 1 43  ? -18.547 -15.359 -20.387 1.00 69.40 ? 43  HIS B CA   1 
ATOM 2162 C C    . HIS B 1 43  ? -18.331 -16.867 -20.339 1.00 68.44 ? 43  HIS B C    1 
ATOM 2163 O O    . HIS B 1 43  ? -19.034 -17.580 -19.624 1.00 67.03 ? 43  HIS B O    1 
ATOM 2164 C CB   . HIS B 1 43  ? -18.026 -14.732 -19.092 1.00 66.54 ? 43  HIS B CB   1 
ATOM 2165 C CG   . HIS B 1 43  ? -17.899 -13.244 -19.149 1.00 67.89 ? 43  HIS B CG   1 
ATOM 2166 N ND1  . HIS B 1 43  ? -16.857 -12.611 -19.792 1.00 69.55 ? 43  HIS B ND1  1 
ATOM 2167 C CD2  . HIS B 1 43  ? -18.681 -12.262 -18.642 1.00 68.27 ? 43  HIS B CD2  1 
ATOM 2168 C CE1  . HIS B 1 43  ? -17.001 -11.303 -19.678 1.00 70.92 ? 43  HIS B CE1  1 
ATOM 2169 N NE2  . HIS B 1 43  ? -18.102 -11.065 -18.984 1.00 70.16 ? 43  HIS B NE2  1 
ATOM 2170 H H    . HIS B 1 43  ? -20.480 -15.336 -19.997 1.00 54.72 ? 43  HIS B H    1 
ATOM 2171 H HA   . HIS B 1 43  ? -18.024 -15.005 -21.123 1.00 54.72 ? 43  HIS B HA   1 
ATOM 2172 H HB2  . HIS B 1 43  ? -18.637 -14.950 -18.371 1.00 54.72 ? 43  HIS B HB2  1 
ATOM 2173 H HB3  . HIS B 1 43  ? -17.147 -15.097 -18.900 1.00 54.72 ? 43  HIS B HB3  1 
ATOM 2174 H HD1  . HIS B 1 43  ? -16.213 -13.006 -20.202 1.00 54.72 ? 43  HIS B HD1  1 
ATOM 2175 H HD2  . HIS B 1 43  ? -19.463 -12.377 -18.152 1.00 54.72 ? 43  HIS B HD2  1 
ATOM 2176 H HE1  . HIS B 1 43  ? -16.428 -10.659 -20.027 1.00 54.72 ? 43  HIS B HE1  1 
ATOM 2177 H HE2  . HIS B 1 43  ? -18.406 -10.287 -18.780 1.00 54.72 ? 43  HIS B HE2  1 
ATOM 2178 N N    . GLY B 1 44  ? -17.344 -17.339 -21.097 1.00 69.66 ? 44  GLY B N    1 
ATOM 2179 C CA   . GLY B 1 44  ? -16.968 -18.744 -21.102 1.00 69.23 ? 44  GLY B CA   1 
ATOM 2180 C C    . GLY B 1 44  ? -16.502 -19.213 -19.738 1.00 65.78 ? 44  GLY B C    1 
ATOM 2181 O O    . GLY B 1 44  ? -15.716 -18.534 -19.085 1.00 64.19 ? 44  GLY B O    1 
ATOM 2182 H H    . GLY B 1 44  ? -16.870 -16.853 -21.625 1.00 54.72 ? 44  GLY B H    1 
ATOM 2183 H HA2  . GLY B 1 44  ? -17.730 -19.282 -21.369 1.00 54.72 ? 44  GLY B HA2  1 
ATOM 2184 H HA3  . GLY B 1 44  ? -16.251 -18.885 -21.739 1.00 54.72 ? 44  GLY B HA3  1 
ATOM 2185 N N    . PHE B 1 45  ? -16.967 -20.390 -19.327 1.00 66.52 ? 45  PHE B N    1 
ATOM 2186 C CA   . PHE B 1 45  ? -16.804 -20.859 -17.951 1.00 63.54 ? 45  PHE B CA   1 
ATOM 2187 C C    . PHE B 1 45  ? -16.220 -22.271 -17.911 1.00 63.57 ? 45  PHE B C    1 
ATOM 2188 O O    . PHE B 1 45  ? -16.948 -23.245 -17.714 1.00 63.93 ? 45  PHE B O    1 
ATOM 2189 C CB   . PHE B 1 45  ? -18.164 -20.812 -17.248 1.00 67.01 ? 45  PHE B CB   1 
ATOM 2190 C CG   . PHE B 1 45  ? -18.099 -20.870 -15.742 1.00 64.18 ? 45  PHE B CG   1 
ATOM 2191 C CD1  . PHE B 1 45  ? -17.034 -20.329 -15.035 1.00 62.37 ? 45  PHE B CD1  1 
ATOM 2192 C CD2  . PHE B 1 45  ? -19.134 -21.456 -15.033 1.00 63.83 ? 45  PHE B CD2  1 
ATOM 2193 C CE1  . PHE B 1 45  ? -17.004 -20.385 -13.650 1.00 60.24 ? 45  PHE B CE1  1 
ATOM 2194 C CE2  . PHE B 1 45  ? -19.110 -21.513 -13.653 1.00 61.67 ? 45  PHE B CE2  1 
ATOM 2195 C CZ   . PHE B 1 45  ? -18.046 -20.976 -12.960 1.00 59.87 ? 45  PHE B CZ   1 
ATOM 2196 H H    . PHE B 1 45  ? -17.387 -20.944 -19.833 1.00 54.72 ? 45  PHE B H    1 
ATOM 2197 H HA   . PHE B 1 45  ? -16.197 -20.266 -17.480 1.00 54.72 ? 45  PHE B HA   1 
ATOM 2198 H HB2  . PHE B 1 45  ? -18.609 -19.985 -17.490 1.00 54.72 ? 45  PHE B HB2  1 
ATOM 2199 H HB3  . PHE B 1 45  ? -18.693 -21.567 -17.548 1.00 54.72 ? 45  PHE B HB3  1 
ATOM 2200 H HD1  . PHE B 1 45  ? -16.332 -19.928 -15.495 1.00 54.72 ? 45  PHE B HD1  1 
ATOM 2201 H HD2  . PHE B 1 45  ? -19.857 -21.818 -15.493 1.00 54.72 ? 45  PHE B HD2  1 
ATOM 2202 H HE1  . PHE B 1 45  ? -16.285 -20.023 -13.185 1.00 54.72 ? 45  PHE B HE1  1 
ATOM 2203 H HE2  . PHE B 1 45  ? -19.812 -21.913 -13.192 1.00 54.72 ? 45  PHE B HE2  1 
ATOM 2204 H HZ   . PHE B 1 45  ? -18.027 -21.017 -12.031 1.00 54.72 ? 45  PHE B HZ   1 
ATOM 2205 N N    . HIS B 1 46  ? -14.903 -22.369 -18.084 1.00 62.54 ? 46  HIS B N    1 
ATOM 2206 C CA   . HIS B 1 46  ? -14.247 -23.657 -18.314 1.00 63.47 ? 46  HIS B CA   1 
ATOM 2207 C C    . HIS B 1 46  ? -13.323 -24.124 -17.189 1.00 61.26 ? 46  HIS B C    1 
ATOM 2208 O O    . HIS B 1 46  ? -12.496 -23.360 -16.694 1.00 59.95 ? 46  HIS B O    1 
ATOM 2209 C CB   . HIS B 1 46  ? -13.429 -23.588 -19.604 1.00 64.11 ? 46  HIS B CB   1 
ATOM 2210 C CG   . HIS B 1 46  ? -14.192 -23.068 -20.781 1.00 66.80 ? 46  HIS B CG   1 
ATOM 2211 N ND1  . HIS B 1 46  ? -15.529 -23.336 -20.981 1.00 67.78 ? 46  HIS B ND1  1 
ATOM 2212 C CD2  . HIS B 1 46  ? -13.804 -22.294 -21.821 1.00 69.11 ? 46  HIS B CD2  1 
ATOM 2213 C CE1  . HIS B 1 46  ? -15.931 -22.751 -22.095 1.00 70.54 ? 46  HIS B CE1  1 
ATOM 2214 N NE2  . HIS B 1 46  ? -14.903 -22.111 -22.623 1.00 71.37 ? 46  HIS B NE2  1 
ATOM 2215 H H    . HIS B 1 46  ? -14.362 -21.701 -18.072 1.00 54.72 ? 46  HIS B H    1 
ATOM 2216 H HA   . HIS B 1 46  ? -14.931 -24.335 -18.434 1.00 54.72 ? 46  HIS B HA   1 
ATOM 2217 H HB2  . HIS B 1 46  ? -12.669 -23.002 -19.461 1.00 54.72 ? 46  HIS B HB2  1 
ATOM 2218 H HB3  . HIS B 1 46  ? -13.118 -24.480 -19.824 1.00 54.72 ? 46  HIS B HB3  1 
ATOM 2219 H HD2  . HIS B 1 46  ? -12.952 -21.950 -21.966 1.00 54.72 ? 46  HIS B HD2  1 
ATOM 2220 H HE1  . HIS B 1 46  ? -16.791 -22.782 -22.446 1.00 54.72 ? 46  HIS B HE1  1 
ATOM 2221 H HE2  . HIS B 1 46  ? -14.920 -21.654 -23.352 1.00 54.72 ? 46  HIS B HE2  1 
ATOM 2222 N N    . VAL B 1 47  ? -13.470 -25.387 -16.792 1.00 61.16 ? 47  VAL B N    1 
ATOM 2223 C CA   . VAL B 1 47  ? -12.421 -26.072 -16.044 1.00 60.19 ? 47  VAL B CA   1 
ATOM 2224 C C    . VAL B 1 47  ? -11.305 -26.370 -17.033 1.00 62.53 ? 47  VAL B C    1 
ATOM 2225 O O    . VAL B 1 47  ? -11.542 -26.987 -18.072 1.00 65.29 ? 47  VAL B O    1 
ATOM 2226 C CB   . VAL B 1 47  ? -12.899 -27.393 -15.393 1.00 60.32 ? 47  VAL B CB   1 
ATOM 2227 C CG1  . VAL B 1 47  ? -11.760 -28.051 -14.607 1.00 59.58 ? 47  VAL B CG1  1 
ATOM 2228 C CG2  . VAL B 1 47  ? -14.096 -27.158 -14.493 1.00 58.65 ? 47  VAL B CG2  1 
ATOM 2229 H H    . VAL B 1 47  ? -14.166 -25.868 -16.944 1.00 54.72 ? 47  VAL B H    1 
ATOM 2230 H HA   . VAL B 1 47  ? -12.077 -25.488 -15.350 1.00 54.72 ? 47  VAL B HA   1 
ATOM 2231 H HB   . VAL B 1 47  ? -13.170 -28.006 -16.094 1.00 54.72 ? 47  VAL B HB   1 
ATOM 2232 H HG11 . VAL B 1 47  ? -12.085 -28.874 -14.211 1.00 54.72 ? 47  VAL B HG11 1 
ATOM 2233 H HG12 . VAL B 1 47  ? -11.028 -28.242 -15.214 1.00 54.72 ? 47  VAL B HG12 1 
ATOM 2234 H HG13 . VAL B 1 47  ? -11.464 -27.443 -13.912 1.00 54.72 ? 47  VAL B HG13 1 
ATOM 2235 H HG21 . VAL B 1 47  ? -14.368 -28.003 -14.103 1.00 54.72 ? 47  VAL B HG21 1 
ATOM 2236 H HG22 . VAL B 1 47  ? -13.846 -26.535 -13.792 1.00 54.72 ? 47  VAL B HG22 1 
ATOM 2237 H HG23 . VAL B 1 47  ? -14.820 -26.788 -15.021 1.00 54.72 ? 47  VAL B HG23 1 
ATOM 2238 N N    . HIS B 1 48  ? -10.091 -25.932 -16.720 1.00 59.76 ? 48  HIS B N    1 
ATOM 2239 C CA   . HIS B 1 48  ? -8.981  -26.104 -17.647 1.00 62.32 ? 48  HIS B CA   1 
ATOM 2240 C C    . HIS B 1 48  ? -8.729  -27.569 -17.947 1.00 64.38 ? 48  HIS B C    1 
ATOM 2241 O O    . HIS B 1 48  ? -8.933  -28.441 -17.101 1.00 63.34 ? 48  HIS B O    1 
ATOM 2242 C CB   . HIS B 1 48  ? -7.695  -25.481 -17.099 1.00 62.08 ? 48  HIS B CB   1 
ATOM 2243 C CG   . HIS B 1 48  ? -6.479  -25.799 -17.915 1.00 65.00 ? 48  HIS B CG   1 
ATOM 2244 N ND1  . HIS B 1 48  ? -6.405  -25.554 -19.271 1.00 67.98 ? 48  HIS B ND1  1 
ATOM 2245 C CD2  . HIS B 1 48  ? -5.290  -26.347 -17.568 1.00 65.79 ? 48  HIS B CD2  1 
ATOM 2246 C CE1  . HIS B 1 48  ? -5.225  -25.941 -19.723 1.00 70.50 ? 48  HIS B CE1  1 
ATOM 2247 N NE2  . HIS B 1 48  ? -4.528  -26.423 -18.711 1.00 69.22 ? 48  HIS B NE2  1 
ATOM 2248 H H    . HIS B 1 48  ? -9.885  -25.537 -15.985 1.00 54.72 ? 48  HIS B H    1 
ATOM 2249 H HA   . HIS B 1 48  ? -9.197  -25.660 -18.482 1.00 54.72 ? 48  HIS B HA   1 
ATOM 2250 H HB2  . HIS B 1 48  ? -7.798  -24.516 -17.081 1.00 54.72 ? 48  HIS B HB2  1 
ATOM 2251 H HB3  . HIS B 1 48  ? -7.545  -25.813 -16.200 1.00 54.72 ? 48  HIS B HB3  1 
ATOM 2252 H HD2  . HIS B 1 48  ? -5.037  -26.622 -16.717 1.00 54.72 ? 48  HIS B HD2  1 
ATOM 2253 H HE1  . HIS B 1 48  ? -4.933  -25.878 -20.603 1.00 54.72 ? 48  HIS B HE1  1 
ATOM 2254 H HE2  . HIS B 1 48  ? -3.728  -26.734 -18.758 1.00 54.72 ? 48  HIS B HE2  1 
ATOM 2255 N N    . GLY B 1 49  ? -8.297  -27.823 -19.175 1.00 67.63 ? 49  GLY B N    1 
ATOM 2256 C CA   . GLY B 1 49  ? -7.753  -29.111 -19.541 1.00 70.32 ? 49  GLY B CA   1 
ATOM 2257 C C    . GLY B 1 49  ? -8.753  -30.135 -20.036 1.00 72.42 ? 49  GLY B C    1 
ATOM 2258 O O    . GLY B 1 49  ? -8.577  -30.687 -21.125 1.00 76.25 ? 49  GLY B O    1 
ATOM 2259 H H    . GLY B 1 49  ? -8.311  -27.254 -19.820 1.00 54.72 ? 49  GLY B H    1 
ATOM 2260 H HA2  . GLY B 1 49  ? -7.092  -28.983 -20.239 1.00 54.72 ? 49  GLY B HA2  1 
ATOM 2261 H HA3  . GLY B 1 49  ? -7.301  -29.489 -18.770 1.00 54.72 ? 49  GLY B HA3  1 
ATOM 2262 N N    . ALA B 1 50  ? -9.804  -30.385 -19.258 1.00 70.41 ? 50  ALA B N    1 
ATOM 2263 C CA   . ALA B 1 50  ? -10.632 -31.566 -19.491 1.00 72.71 ? 50  ALA B CA   1 
ATOM 2264 C C    . ALA B 1 50  ? -12.094 -31.415 -19.062 1.00 71.32 ? 50  ALA B C    1 
ATOM 2265 O O    . ALA B 1 50  ? -12.398 -31.265 -17.875 1.00 68.23 ? 50  ALA B O    1 
ATOM 2266 C CB   . ALA B 1 50  ? -10.010 -32.768 -18.775 1.00 73.15 ? 50  ALA B CB   1 
ATOM 2267 H H    . ALA B 1 50  ? -10.056 -29.895 -18.598 1.00 54.72 ? 50  ALA B H    1 
ATOM 2268 H HA   . ALA B 1 50  ? -10.628 -31.759 -20.441 1.00 54.72 ? 50  ALA B HA   1 
ATOM 2269 H HB1  . ALA B 1 50  ? -10.563 -33.550 -18.933 1.00 54.72 ? 50  ALA B HB1  1 
ATOM 2270 H HB2  . ALA B 1 50  ? -9.118  -32.918 -19.127 1.00 54.72 ? 50  ALA B HB2  1 
ATOM 2271 H HB3  . ALA B 1 50  ? -9.964  -32.581 -17.825 1.00 54.72 ? 50  ALA B HB3  1 
ATOM 2272 N N    . GLY B 1 51  ? -12.992 -31.467 -20.043 1.00 74.05 ? 51  GLY B N    1 
ATOM 2273 C CA   . GLY B 1 51  ? -14.416 -31.583 -19.778 1.00 74.01 ? 51  GLY B CA   1 
ATOM 2274 C C    . GLY B 1 51  ? -14.983 -30.433 -18.971 1.00 70.22 ? 51  GLY B C    1 
ATOM 2275 O O    . GLY B 1 51  ? -15.882 -30.630 -18.153 1.00 69.05 ? 51  GLY B O    1 
ATOM 2276 H H    . GLY B 1 51  ? -12.796 -31.437 -20.880 1.00 54.72 ? 51  GLY B H    1 
ATOM 2277 H HA2  . GLY B 1 51  ? -14.894 -31.626 -20.620 1.00 54.72 ? 51  GLY B HA2  1 
ATOM 2278 H HA3  . GLY B 1 51  ? -14.583 -32.405 -19.291 1.00 54.72 ? 51  GLY B HA3  1 
ATOM 2279 N N    . GLY B 1 52  ? -14.477 -29.228 -19.214 1.00 70.12 ? 52  GLY B N    1 
ATOM 2280 C CA   . GLY B 1 52  ? -14.733 -28.107 -18.327 1.00 66.59 ? 52  GLY B CA   1 
ATOM 2281 C C    . GLY B 1 52  ? -15.916 -27.197 -18.634 1.00 66.72 ? 52  GLY B C    1 
ATOM 2282 O O    . GLY B 1 52  ? -16.212 -26.306 -17.840 1.00 64.13 ? 52  GLY B O    1 
ATOM 2283 H H    . GLY B 1 52  ? -13.980 -29.036 -19.889 1.00 54.72 ? 52  GLY B H    1 
ATOM 2284 H HA2  . GLY B 1 52  ? -14.865 -28.455 -17.431 1.00 54.72 ? 52  GLY B HA2  1 
ATOM 2285 H HA3  . GLY B 1 52  ? -13.940 -27.550 -18.308 1.00 54.72 ? 52  GLY B HA3  1 
ATOM 2286 N N    . ASP B 1 53  ? -16.601 -27.413 -19.756 1.00 68.72 ? 53  ASP B N    1 
ATOM 2287 C CA   . ASP B 1 53  ? -17.642 -26.480 -20.212 1.00 69.48 ? 53  ASP B CA   1 
ATOM 2288 C C    . ASP B 1 53  ? -18.907 -26.569 -19.355 1.00 68.50 ? 53  ASP B C    1 
ATOM 2289 O O    . ASP B 1 53  ? -19.706 -27.501 -19.489 1.00 70.78 ? 53  ASP B O    1 
ATOM 2290 C CB   . ASP B 1 53  ? -17.996 -26.738 -21.687 1.00 73.97 ? 53  ASP B CB   1 
ATOM 2291 C CG   . ASP B 1 53  ? -18.481 -25.483 -22.412 1.00 74.98 ? 53  ASP B CG   1 
ATOM 2292 O OD1  . ASP B 1 53  ? -18.779 -24.467 -21.747 1.00 72.41 ? 53  ASP B OD1  1 
ATOM 2293 O OD2  . ASP B 1 53  ? -18.570 -25.520 -23.659 1.00 78.75 ? 53  ASP B OD2  1 
ATOM 2294 H H    . ASP B 1 53  ? -16.486 -28.090 -20.273 1.00 54.72 ? 53  ASP B H    1 
ATOM 2295 H HA   . ASP B 1 53  ? -17.301 -25.575 -20.143 1.00 54.72 ? 53  ASP B HA   1 
ATOM 2296 H HB2  . ASP B 1 53  ? -17.207 -27.064 -22.148 1.00 54.72 ? 53  ASP B HB2  1 
ATOM 2297 H HB3  . ASP B 1 53  ? -18.702 -27.401 -21.730 1.00 54.72 ? 53  ASP B HB3  1 
ATOM 2298 N N    . LEU B 1 54  ? -19.068 -25.586 -18.473 1.00 67.53 ? 54  LEU B N    1 
ATOM 2299 C CA   . LEU B 1 54  ? -20.262 -25.450 -17.645 1.00 66.77 ? 54  LEU B CA   1 
ATOM 2300 C C    . LEU B 1 54  ? -21.185 -24.375 -18.217 1.00 68.09 ? 54  LEU B C    1 
ATOM 2301 O O    . LEU B 1 54  ? -22.054 -23.855 -17.514 1.00 67.25 ? 54  LEU B O    1 
ATOM 2302 C CB   . LEU B 1 54  ? -19.886 -25.086 -16.204 1.00 65.34 ? 54  LEU B CB   1 
ATOM 2303 C CG   . LEU B 1 54  ? -18.671 -25.744 -15.541 1.00 63.53 ? 54  LEU B CG   1 
ATOM 2304 C CD1  . LEU B 1 54  ? -18.236 -24.922 -14.323 1.00 60.37 ? 54  LEU B CD1  1 
ATOM 2305 C CD2  . LEU B 1 54  ? -18.975 -27.187 -15.159 1.00 64.57 ? 54  LEU B CD2  1 
ATOM 2306 H H    . LEU B 1 54  ? -18.484 -24.971 -18.333 1.00 54.72 ? 54  LEU B H    1 
ATOM 2307 H HA   . LEU B 1 54  ? -20.743 -26.292 -17.633 1.00 54.72 ? 54  LEU B HA   1 
ATOM 2308 H HB2  . LEU B 1 54  ? -19.731 -24.129 -16.176 1.00 54.72 ? 54  LEU B HB2  1 
ATOM 2309 H HB3  . LEU B 1 54  ? -20.651 -25.293 -15.643 1.00 54.72 ? 54  LEU B HB3  1 
ATOM 2310 H HG   . LEU B 1 54  ? -17.935 -25.752 -16.173 1.00 54.72 ? 54  LEU B HG   1 
ATOM 2311 H HD11 . LEU B 1 54  ? -17.467 -25.348 -13.913 1.00 54.72 ? 54  LEU B HD11 1 
ATOM 2312 H HD12 . LEU B 1 54  ? -18.002 -24.026 -14.614 1.00 54.72 ? 54  LEU B HD12 1 
ATOM 2313 H HD13 . LEU B 1 54  ? -18.970 -24.884 -13.690 1.00 54.72 ? 54  LEU B HD13 1 
ATOM 2314 H HD21 . LEU B 1 54  ? -18.189 -27.576 -14.743 1.00 54.72 ? 54  LEU B HD21 1 
ATOM 2315 H HD22 . LEU B 1 54  ? -19.718 -27.199 -14.536 1.00 54.72 ? 54  LEU B HD22 1 
ATOM 2316 H HD23 . LEU B 1 54  ? -19.206 -27.684 -15.959 1.00 54.72 ? 54  LEU B HD23 1 
ATOM 2317 N N    . GLY B 1 55  ? -20.985 -24.033 -19.487 1.00 69.05 ? 55  GLY B N    1 
ATOM 2318 C CA   . GLY B 1 55  ? -21.761 -22.984 -20.127 1.00 70.73 ? 55  GLY B CA   1 
ATOM 2319 C C    . GLY B 1 55  ? -21.170 -21.610 -19.887 1.00 68.68 ? 55  GLY B C    1 
ATOM 2320 O O    . GLY B 1 55  ? -19.953 -21.430 -19.962 1.00 67.54 ? 55  GLY B O    1 
ATOM 2321 H H    . GLY B 1 55  ? -20.401 -24.399 -20.001 1.00 54.72 ? 55  GLY B H    1 
ATOM 2322 H HA2  . GLY B 1 55  ? -21.793 -23.143 -21.084 1.00 54.72 ? 55  GLY B HA2  1 
ATOM 2323 H HA3  . GLY B 1 55  ? -22.667 -22.995 -19.782 1.00 54.72 ? 55  GLY B HA3  1 
ATOM 2324 N N    . ASN B 1 56  ? -22.035 -20.644 -19.589 1.00 71.59 ? 56  ASN B N    1 
ATOM 2325 C CA   . ASN B 1 56  ? -21.611 -19.265 -19.369 1.00 70.33 ? 56  ASN B CA   1 
ATOM 2326 C C    . ASN B 1 56  ? -22.232 -18.666 -18.108 1.00 68.34 ? 56  ASN B C    1 
ATOM 2327 O O    . ASN B 1 56  ? -23.259 -19.148 -17.622 1.00 68.67 ? 56  ASN B O    1 
ATOM 2328 C CB   . ASN B 1 56  ? -21.968 -18.396 -20.584 1.00 70.01 ? 56  ASN B CB   1 
ATOM 2329 C CG   . ASN B 1 56  ? -21.232 -18.816 -21.850 1.00 72.37 ? 56  ASN B CG   1 
ATOM 2330 O OD1  . ASN B 1 56  ? -20.142 -19.382 -21.789 1.00 71.19 ? 56  ASN B OD1  1 
ATOM 2331 N ND2  . ASN B 1 56  ? -21.824 -18.528 -23.007 1.00 76.08 ? 56  ASN B ND2  1 
ATOM 2332 H H    . ASN B 1 56  ? -22.883 -20.763 -19.507 1.00 54.72 ? 56  ASN B H    1 
ATOM 2333 H HA   . ASN B 1 56  ? -20.647 -19.246 -19.263 1.00 54.72 ? 56  ASN B HA   1 
ATOM 2334 H HB2  . ASN B 1 56  ? -22.921 -18.467 -20.753 1.00 54.72 ? 56  ASN B HB2  1 
ATOM 2335 H HB3  . ASN B 1 56  ? -21.734 -17.474 -20.393 1.00 54.72 ? 56  ASN B HB3  1 
ATOM 2336 H HD21 . ASN B 1 56  ? -21.447 -18.745 -23.749 1.00 54.72 ? 56  ASN B HD21 1 
ATOM 2337 H HD22 . ASN B 1 56  ? -22.583 -18.124 -23.012 1.00 54.72 ? 56  ASN B HD22 1 
ATOM 2338 N N    . VAL B 1 57  ? -21.584 -17.631 -17.575 1.00 68.45 ? 57  VAL B N    1 
ATOM 2339 C CA   . VAL B 1 57  ? -22.132 -16.851 -16.468 1.00 67.24 ? 57  VAL B CA   1 
ATOM 2340 C C    . VAL B 1 57  ? -22.483 -15.443 -16.953 1.00 69.15 ? 57  VAL B C    1 
ATOM 2341 O O    . VAL B 1 57  ? -21.697 -14.798 -17.652 1.00 69.99 ? 57  VAL B O    1 
ATOM 2342 C CB   . VAL B 1 57  ? -21.145 -16.783 -15.275 1.00 64.30 ? 57  VAL B CB   1 
ATOM 2343 C CG1  . VAL B 1 57  ? -20.782 -18.184 -14.819 1.00 62.77 ? 57  VAL B CG1  1 
ATOM 2344 C CG2  . VAL B 1 57  ? -19.882 -15.998 -15.632 1.00 64.18 ? 57  VAL B CG2  1 
ATOM 2345 H H    . VAL B 1 57  ? -20.814 -17.358 -17.842 1.00 54.72 ? 57  VAL B H    1 
ATOM 2346 H HA   . VAL B 1 57  ? -22.948 -17.274 -16.158 1.00 54.72 ? 57  VAL B HA   1 
ATOM 2347 H HB   . VAL B 1 57  ? -21.578 -16.331 -14.534 1.00 54.72 ? 57  VAL B HB   1 
ATOM 2348 H HG11 . VAL B 1 57  ? -20.165 -18.123 -14.073 1.00 54.72 ? 57  VAL B HG11 1 
ATOM 2349 H HG12 . VAL B 1 57  ? -21.590 -18.645 -14.544 1.00 54.72 ? 57  VAL B HG12 1 
ATOM 2350 H HG13 . VAL B 1 57  ? -20.365 -18.657 -15.556 1.00 54.72 ? 57  VAL B HG13 1 
ATOM 2351 H HG21 . VAL B 1 57  ? -19.294 -15.979 -14.861 1.00 54.72 ? 57  VAL B HG21 1 
ATOM 2352 H HG22 . VAL B 1 57  ? -19.439 -16.435 -16.376 1.00 54.72 ? 57  VAL B HG22 1 
ATOM 2353 H HG23 . VAL B 1 57  ? -20.133 -15.094 -15.880 1.00 54.72 ? 57  VAL B HG23 1 
ATOM 2354 N N    . THR B 1 58  ? -23.675 -14.981 -16.584 1.00 69.08 ? 58  THR B N    1 
ATOM 2355 C CA   . THR B 1 58  ? -24.201 -13.709 -17.070 1.00 71.51 ? 58  THR B CA   1 
ATOM 2356 C C    . THR B 1 58  ? -23.989 -12.592 -16.054 1.00 70.54 ? 58  THR B C    1 
ATOM 2357 O O    . THR B 1 58  ? -24.690 -12.515 -15.044 1.00 70.01 ? 58  THR B O    1 
ATOM 2358 C CB   . THR B 1 58  ? -25.713 -13.806 -17.395 1.00 70.06 ? 58  THR B CB   1 
ATOM 2359 O OG1  . THR B 1 58  ? -25.940 -14.863 -18.336 1.00 71.54 ? 58  THR B OG1  1 
ATOM 2360 C CG2  . THR B 1 58  ? -26.235 -12.492 -17.979 1.00 73.02 ? 58  THR B CG2  1 
ATOM 2361 H H    . THR B 1 58  ? -24.205 -15.393 -16.046 1.00 54.72 ? 58  THR B H    1 
ATOM 2362 H HA   . THR B 1 58  ? -23.735 -13.465 -17.885 1.00 54.72 ? 58  THR B HA   1 
ATOM 2363 H HB   . THR B 1 58  ? -26.204 -13.993 -16.580 1.00 54.72 ? 58  THR B HB   1 
ATOM 2364 H HG1  . THR B 1 58  ? -26.759 -14.918 -18.514 1.00 54.72 ? 58  THR B HG1  1 
ATOM 2365 H HG21 . THR B 1 58  ? -27.181 -12.570 -18.177 1.00 54.72 ? 58  THR B HG21 1 
ATOM 2366 H HG22 . THR B 1 58  ? -26.104 -11.772 -17.342 1.00 54.72 ? 58  THR B HG22 1 
ATOM 2367 H HG23 . THR B 1 58  ? -25.758 -12.280 -18.797 1.00 54.72 ? 58  THR B HG23 1 
ATOM 2368 N N    . ALA B 1 59  ? -23.016 -11.732 -16.333 1.00 68.48 ? 59  ALA B N    1 
ATOM 2369 C CA   . ALA B 1 59  ? -22.812 -10.522 -15.550 1.00 68.60 ? 59  ALA B CA   1 
ATOM 2370 C C    . ALA B 1 59  ? -23.972 -9.557  -15.781 1.00 71.59 ? 59  ALA B C    1 
ATOM 2371 O O    . ALA B 1 59  ? -24.394 -9.352  -16.918 1.00 74.15 ? 59  ALA B O    1 
ATOM 2372 C CB   . ALA B 1 59  ? -21.488 -9.866  -15.920 1.00 68.46 ? 59  ALA B CB   1 
ATOM 2373 H H    . ALA B 1 59  ? -22.455 -11.829 -16.978 1.00 54.72 ? 59  ALA B H    1 
ATOM 2374 H HA   . ALA B 1 59  ? -22.787 -10.750 -14.608 1.00 54.72 ? 59  ALA B HA   1 
ATOM 2375 H HB1  . ALA B 1 59  ? -21.375 -9.064  -15.387 1.00 54.72 ? 59  ALA B HB1  1 
ATOM 2376 H HB2  . ALA B 1 59  ? -20.767 -10.489 -15.740 1.00 54.72 ? 59  ALA B HB2  1 
ATOM 2377 H HB3  . ALA B 1 59  ? -21.502 -9.638  -16.863 1.00 54.72 ? 59  ALA B HB3  1 
ATOM 2378 N N    . ASP B 1 60  ? -24.489 -8.973  -14.703 1.00 69.78 ? 60  ASP B N    1 
ATOM 2379 C CA   . ASP B 1 60  ? -25.547 -7.976  -14.816 1.00 72.94 ? 60  ASP B CA   1 
ATOM 2380 C C    . ASP B 1 60  ? -24.917 -6.625  -15.144 1.00 75.01 ? 60  ASP B C    1 
ATOM 2381 O O    . ASP B 1 60  ? -23.750 -6.560  -15.529 1.00 74.31 ? 60  ASP B O    1 
ATOM 2382 C CB   . ASP B 1 60  ? -26.378 -7.903  -13.529 1.00 73.82 ? 60  ASP B CB   1 
ATOM 2383 C CG   . ASP B 1 60  ? -25.566 -7.462  -12.326 1.00 72.28 ? 60  ASP B CG   1 
ATOM 2384 O OD1  . ASP B 1 60  ? -24.320 -7.483  -12.397 1.00 70.74 ? 60  ASP B OD1  1 
ATOM 2385 O OD2  . ASP B 1 60  ? -26.183 -7.112  -11.297 1.00 72.94 ? 60  ASP B OD2  1 
ATOM 2386 H H    . ASP B 1 60  ? -24.244 -9.136  -13.895 1.00 54.72 ? 60  ASP B H    1 
ATOM 2387 H HA   . ASP B 1 60  ? -26.139 -8.219  -15.545 1.00 54.72 ? 60  ASP B HA   1 
ATOM 2388 H HB2  . ASP B 1 60  ? -27.099 -7.266  -13.654 1.00 54.72 ? 60  ASP B HB2  1 
ATOM 2389 H HB3  . ASP B 1 60  ? -26.742 -8.782  -13.339 1.00 54.72 ? 60  ASP B HB3  1 
ATOM 2390 N N    . LYS B 1 61  ? -25.684 -5.550  -14.997 1.00 77.96 ? 61  LYS B N    1 
ATOM 2391 C CA   . LYS B 1 61  ? -25.212 -4.221  -15.369 1.00 80.75 ? 61  LYS B CA   1 
ATOM 2392 C C    . LYS B 1 61  ? -24.279 -3.625  -14.309 1.00 79.87 ? 61  LYS B C    1 
ATOM 2393 O O    . LYS B 1 61  ? -23.722 -2.542  -14.498 1.00 82.27 ? 61  LYS B O    1 
ATOM 2394 C CB   . LYS B 1 61  ? -26.404 -3.296  -15.607 1.00 84.75 ? 61  LYS B CB   1 
ATOM 2395 C CG   . LYS B 1 61  ? -26.241 -2.362  -16.799 1.00 88.44 ? 61  LYS B CG   1 
ATOM 2396 C CD   . LYS B 1 61  ? -27.506 -1.549  -17.039 1.00 92.62 ? 61  LYS B CD   1 
ATOM 2397 C CE   . LYS B 1 61  ? -27.424 -0.732  -18.320 1.00 96.62 ? 61  LYS B CE   1 
ATOM 2398 N NZ   . LYS B 1 61  ? -27.543 -1.585  -19.536 1.00 96.62 ? 61  LYS B NZ   1 
ATOM 2399 H H    . LYS B 1 61  ? -26.485 -5.564  -14.682 1.00 54.72 ? 61  LYS B H    1 
ATOM 2400 H HA   . LYS B 1 61  ? -24.715 -4.286  -16.200 1.00 54.72 ? 61  LYS B HA   1 
ATOM 2401 H HB2  . LYS B 1 61  ? -27.193 -3.839  -15.764 1.00 54.72 ? 61  LYS B HB2  1 
ATOM 2402 H HB3  . LYS B 1 61  ? -26.535 -2.748  -14.818 1.00 54.72 ? 61  LYS B HB3  1 
ATOM 2403 H HG2  . LYS B 1 61  ? -25.511 -1.746  -16.626 1.00 54.72 ? 61  LYS B HG2  1 
ATOM 2404 H HG3  . LYS B 1 61  ? -26.058 -2.885  -17.595 1.00 54.72 ? 61  LYS B HG3  1 
ATOM 2405 H HD2  . LYS B 1 61  ? -28.263 -2.152  -17.114 1.00 54.72 ? 61  LYS B HD2  1 
ATOM 2406 H HD3  . LYS B 1 61  ? -27.638 -0.938  -16.298 1.00 54.72 ? 61  LYS B HD3  1 
ATOM 2407 H HE2  . LYS B 1 61  ? -28.147 -0.086  -18.332 1.00 54.72 ? 61  LYS B HE2  1 
ATOM 2408 H HE3  . LYS B 1 61  ? -26.568 -0.276  -18.353 1.00 54.72 ? 61  LYS B HE3  1 
ATOM 2409 H HZ1  . LYS B 1 61  ? -27.491 -1.080  -20.267 1.00 54.72 ? 61  LYS B HZ1  1 
ATOM 2410 H HZ2  . LYS B 1 61  ? -26.886 -2.185  -19.552 1.00 54.72 ? 61  LYS B HZ2  1 
ATOM 2411 H HZ3  . LYS B 1 61  ? -28.324 -2.011  -19.533 1.00 54.72 ? 61  LYS B HZ3  1 
ATOM 2412 N N    . ASP B 1 62  ? -24.112 -4.337  -13.198 1.00 76.85 ? 62  ASP B N    1 
ATOM 2413 C CA   . ASP B 1 62  ? -23.146 -3.955  -12.171 1.00 75.96 ? 62  ASP B CA   1 
ATOM 2414 C C    . ASP B 1 62  ? -21.790 -4.618  -12.424 1.00 73.46 ? 62  ASP B C    1 
ATOM 2415 O O    . ASP B 1 62  ? -20.782 -4.229  -11.831 1.00 73.32 ? 62  ASP B O    1 
ATOM 2416 C CB   . ASP B 1 62  ? -23.675 -4.331  -10.781 1.00 74.81 ? 62  ASP B CB   1 
ATOM 2417 C CG   . ASP B 1 62  ? -25.071 -3.784  -10.521 1.00 77.50 ? 62  ASP B CG   1 
ATOM 2418 O OD1  . ASP B 1 62  ? -25.313 -2.594  -10.826 1.00 81.03 ? 62  ASP B OD1  1 
ATOM 2419 O OD2  . ASP B 1 62  ? -25.929 -4.542  -10.011 1.00 76.45 ? 62  ASP B OD2  1 
ATOM 2420 H H    . ASP B 1 62  ? -24.551 -5.053  -13.014 1.00 54.72 ? 62  ASP B H    1 
ATOM 2421 H HA   . ASP B 1 62  ? -23.021 -2.994  -12.196 1.00 54.72 ? 62  ASP B HA   1 
ATOM 2422 H HB2  . ASP B 1 62  ? -23.712 -5.297  -10.706 1.00 54.72 ? 62  ASP B HB2  1 
ATOM 2423 H HB3  . ASP B 1 62  ? -23.079 -3.968  -10.107 1.00 54.72 ? 62  ASP B HB3  1 
ATOM 2424 N N    . GLY B 1 63  ? -21.771 -5.609  -13.313 1.00 72.81 ? 63  GLY B N    1 
ATOM 2425 C CA   . GLY B 1 63  ? -20.557 -6.346  -13.620 1.00 70.72 ? 63  GLY B CA   1 
ATOM 2426 C C    . GLY B 1 63  ? -20.347 -7.439  -12.591 1.00 67.31 ? 63  GLY B C    1 
ATOM 2427 O O    . GLY B 1 63  ? -19.279 -7.533  -11.986 1.00 66.04 ? 63  GLY B O    1 
ATOM 2428 H H    . GLY B 1 63  ? -22.460 -5.875  -13.754 1.00 54.72 ? 63  GLY B H    1 
ATOM 2429 H HA2  . GLY B 1 63  ? -20.627 -6.750  -14.500 1.00 54.72 ? 63  GLY B HA2  1 
ATOM 2430 H HA3  . GLY B 1 63  ? -19.793 -5.749  -13.607 1.00 54.72 ? 63  GLY B HA3  1 
ATOM 2431 N N    . VAL B 1 64  ? -21.376 -8.262  -12.394 1.00 68.97 ? 64  VAL B N    1 
ATOM 2432 C CA   . VAL B 1 64  ? -21.385 -9.275  -11.335 1.00 66.26 ? 64  VAL B CA   1 
ATOM 2433 C C    . VAL B 1 64  ? -22.166 -10.511 -11.780 1.00 65.32 ? 64  VAL B C    1 
ATOM 2434 O O    . VAL B 1 64  ? -23.362 -10.427 -12.070 1.00 66.92 ? 64  VAL B O    1 
ATOM 2435 C CB   . VAL B 1 64  ? -22.011 -8.722  -10.021 1.00 67.20 ? 64  VAL B CB   1 
ATOM 2436 C CG1  . VAL B 1 64  ? -22.053 -9.793  -8.917  1.00 64.78 ? 64  VAL B CG1  1 
ATOM 2437 C CG2  . VAL B 1 64  ? -21.258 -7.485  -9.539  1.00 68.75 ? 64  VAL B CG2  1 
ATOM 2438 H H    . VAL B 1 64  ? -22.093 -8.255  -12.869 1.00 54.72 ? 64  VAL B H    1 
ATOM 2439 H HA   . VAL B 1 64  ? -20.473 -9.545  -11.146 1.00 54.72 ? 64  VAL B HA   1 
ATOM 2440 H HB   . VAL B 1 64  ? -22.925 -8.454  -10.204 1.00 54.72 ? 64  VAL B HB   1 
ATOM 2441 H HG11 . VAL B 1 64  ? -22.448 -9.408  -8.119  1.00 54.72 ? 64  VAL B HG11 1 
ATOM 2442 H HG12 . VAL B 1 64  ? -22.588 -10.541 -9.224  1.00 54.72 ? 64  VAL B HG12 1 
ATOM 2443 H HG13 . VAL B 1 64  ? -21.148 -10.088 -8.729  1.00 54.72 ? 64  VAL B HG13 1 
ATOM 2444 H HG21 . VAL B 1 64  ? -21.669 -7.164  -8.721  1.00 54.72 ? 64  VAL B HG21 1 
ATOM 2445 H HG22 . VAL B 1 64  ? -20.333 -7.724  -9.372  1.00 54.72 ? 64  VAL B HG22 1 
ATOM 2446 H HG23 . VAL B 1 64  ? -21.305 -6.800  -10.224 1.00 54.72 ? 64  VAL B HG23 1 
ATOM 2447 N N    . ALA B 1 65  ? -21.486 -11.655 -11.823 1.00 63.55 ? 65  ALA B N    1 
ATOM 2448 C CA   . ALA B 1 65  ? -22.093 -12.900 -12.290 1.00 63.06 ? 65  ALA B CA   1 
ATOM 2449 C C    . ALA B 1 65  ? -22.304 -13.894 -11.151 1.00 61.14 ? 65  ALA B C    1 
ATOM 2450 O O    . ALA B 1 65  ? -21.351 -14.490 -10.650 1.00 59.21 ? 65  ALA B O    1 
ATOM 2451 C CB   . ALA B 1 65  ? -21.233 -13.528 -13.378 1.00 63.63 ? 65  ALA B CB   1 
ATOM 2452 H H    . ALA B 1 65  ? -20.664 -11.737 -11.586 1.00 54.72 ? 65  ALA B H    1 
ATOM 2453 H HA   . ALA B 1 65  ? -22.961 -12.700 -12.674 1.00 54.72 ? 65  ALA B HA   1 
ATOM 2454 H HB1  . ALA B 1 65  ? -21.651 -14.352 -13.674 1.00 54.72 ? 65  ALA B HB1  1 
ATOM 2455 H HB2  . ALA B 1 65  ? -21.160 -12.908 -14.120 1.00 54.72 ? 65  ALA B HB2  1 
ATOM 2456 H HB3  . ALA B 1 65  ? -20.353 -13.716 -13.015 1.00 54.72 ? 65  ALA B HB3  1 
ATOM 2457 N N    . ASP B 1 66  ? -23.560 -14.069 -10.751 1.00 58.26 ? 66  ASP B N    1 
ATOM 2458 C CA   . ASP B 1 66  ? -23.925 -15.108 -9.794  1.00 57.08 ? 66  ASP B CA   1 
ATOM 2459 C C    . ASP B 1 66  ? -23.928 -16.473 -10.478 1.00 56.74 ? 66  ASP B C    1 
ATOM 2460 O O    . ASP B 1 66  ? -24.490 -16.628 -11.563 1.00 58.49 ? 66  ASP B O    1 
ATOM 2461 C CB   . ASP B 1 66  ? -25.296 -14.819 -9.178  1.00 58.58 ? 66  ASP B CB   1 
ATOM 2462 C CG   . ASP B 1 66  ? -25.245 -13.721 -8.135  1.00 58.91 ? 66  ASP B CG   1 
ATOM 2463 O OD1  . ASP B 1 66  ? -24.355 -13.771 -7.262  1.00 57.28 ? 66  ASP B OD1  1 
ATOM 2464 O OD2  . ASP B 1 66  ? -26.086 -12.802 -8.193  1.00 61.18 ? 66  ASP B OD2  1 
ATOM 2465 H H    . ASP B 1 66  ? -24.225 -13.595 -11.022 1.00 54.72 ? 66  ASP B H    1 
ATOM 2466 H HA   . ASP B 1 66  ? -23.269 -15.128 -9.079  1.00 54.72 ? 66  ASP B HA   1 
ATOM 2467 H HB2  . ASP B 1 66  ? -25.906 -14.540 -9.878  1.00 54.72 ? 66  ASP B HB2  1 
ATOM 2468 H HB3  . ASP B 1 66  ? -25.627 -15.624 -8.750  1.00 54.72 ? 66  ASP B HB3  1 
ATOM 2469 N N    . VAL B 1 67  ? -23.293 -17.455 -9.842  1.00 55.22 ? 67  VAL B N    1 
ATOM 2470 C CA   . VAL B 1 67  ? -23.201 -18.800 -10.405 1.00 55.17 ? 67  VAL B CA   1 
ATOM 2471 C C    . VAL B 1 67  ? -24.145 -19.750 -9.674  1.00 55.73 ? 67  VAL B C    1 
ATOM 2472 O O    . VAL B 1 67  ? -24.238 -19.730 -8.444  1.00 54.95 ? 67  VAL B O    1 
ATOM 2473 C CB   . VAL B 1 67  ? -21.756 -19.347 -10.334 1.00 55.63 ? 67  VAL B CB   1 
ATOM 2474 C CG1  . VAL B 1 67  ? -21.652 -20.698 -11.047 1.00 56.18 ? 67  VAL B CG1  1 
ATOM 2475 C CG2  . VAL B 1 67  ? -20.774 -18.341 -10.937 1.00 55.43 ? 67  VAL B CG2  1 
ATOM 2476 H H    . VAL B 1 67  ? -22.906 -17.368 -9.080  1.00 54.72 ? 67  VAL B H    1 
ATOM 2477 H HA   . VAL B 1 67  ? -23.466 -18.771 -11.337 1.00 54.72 ? 67  VAL B HA   1 
ATOM 2478 H HB   . VAL B 1 67  ? -21.514 -19.480 -9.404  1.00 54.72 ? 67  VAL B HB   1 
ATOM 2479 H HG11 . VAL B 1 67  ? -20.738 -21.017 -10.987 1.00 54.72 ? 67  VAL B HG11 1 
ATOM 2480 H HG12 . VAL B 1 67  ? -22.252 -21.328 -10.617 1.00 54.72 ? 67  VAL B HG12 1 
ATOM 2481 H HG13 . VAL B 1 67  ? -21.903 -20.583 -11.977 1.00 54.72 ? 67  VAL B HG13 1 
ATOM 2482 H HG21 . VAL B 1 67  ? -19.876 -18.704 -10.882 1.00 54.72 ? 67  VAL B HG21 1 
ATOM 2483 H HG22 . VAL B 1 67  ? -21.012 -18.185 -11.865 1.00 54.72 ? 67  VAL B HG22 1 
ATOM 2484 H HG23 . VAL B 1 67  ? -20.826 -17.511 -10.438 1.00 54.72 ? 67  VAL B HG23 1 
ATOM 2485 N N    . SER B 1 68  ? -24.853 -20.572 -10.443 1.00 57.02 ? 68  SER B N    1 
ATOM 2486 C CA   . SER B 1 68  ? -25.769 -21.555 -9.873  1.00 58.23 ? 68  SER B CA   1 
ATOM 2487 C C    . SER B 1 68  ? -26.061 -22.694 -10.853 1.00 60.21 ? 68  SER B C    1 
ATOM 2488 O O    . SER B 1 68  ? -27.022 -22.632 -11.623 1.00 62.90 ? 68  SER B O    1 
ATOM 2489 C CB   . SER B 1 68  ? -27.072 -20.876 -9.450  1.00 60.09 ? 68  SER B CB   1 
ATOM 2490 O OG   . SER B 1 68  ? -27.823 -21.715 -8.589  1.00 61.14 ? 68  SER B OG   1 
ATOM 2491 H H    . SER B 1 68  ? -24.821 -20.581 -11.302 1.00 54.72 ? 68  SER B H    1 
ATOM 2492 H HA   . SER B 1 68  ? -25.363 -21.941 -9.081  1.00 54.72 ? 68  SER B HA   1 
ATOM 2493 H HB2  . SER B 1 68  ? -26.861 -20.052 -8.984  1.00 54.72 ? 68  SER B HB2  1 
ATOM 2494 H HB3  . SER B 1 68  ? -27.599 -20.684 -10.242 1.00 54.72 ? 68  SER B HB3  1 
ATOM 2495 H HG   . SER B 1 68  ? -28.535 -21.332 -8.364  1.00 54.72 ? 68  SER B HG   1 
ATOM 2496 N N    . ILE B 1 69  ? -25.227 -23.732 -10.814 1.00 60.05 ? 69  ILE B N    1 
ATOM 2497 C CA   . ILE B 1 69  ? -25.392 -24.891 -11.689 1.00 62.27 ? 69  ILE B CA   1 
ATOM 2498 C C    . ILE B 1 69  ? -25.409 -26.200 -10.912 1.00 62.59 ? 69  ILE B C    1 
ATOM 2499 O O    . ILE B 1 69  ? -25.157 -26.241 -9.705  1.00 60.84 ? 69  ILE B O    1 
ATOM 2500 C CB   . ILE B 1 69  ? -24.257 -25.013 -12.748 1.00 63.16 ? 69  ILE B CB   1 
ATOM 2501 C CG1  . ILE B 1 69  ? -23.465 -23.710 -12.892 1.00 61.12 ? 69  ILE B CG1  1 
ATOM 2502 C CG2  . ILE B 1 69  ? -24.839 -25.464 -14.092 1.00 66.63 ? 69  ILE B CG2  1 
ATOM 2503 C CD1  . ILE B 1 69  ? -22.218 -23.850 -13.754 1.00 60.73 ? 69  ILE B CD1  1 
ATOM 2504 H H    . ILE B 1 69  ? -24.552 -23.789 -10.285 1.00 54.72 ? 69  ILE B H    1 
ATOM 2505 H HA   . ILE B 1 69  ? -26.235 -24.811 -12.161 1.00 54.72 ? 69  ILE B HA   1 
ATOM 2506 H HB   . ILE B 1 69  ? -23.643 -25.701 -12.446 1.00 54.72 ? 69  ILE B HB   1 
ATOM 2507 H HG12 . ILE B 1 69  ? -24.035 -23.039 -13.300 1.00 54.72 ? 69  ILE B HG12 1 
ATOM 2508 H HG13 . ILE B 1 69  ? -23.186 -23.413 -12.012 1.00 54.72 ? 69  ILE B HG13 1 
ATOM 2509 H HG21 . ILE B 1 69  ? -24.120 -25.535 -14.739 1.00 54.72 ? 69  ILE B HG21 1 
ATOM 2510 H HG22 . ILE B 1 69  ? -25.267 -26.327 -13.976 1.00 54.72 ? 69  ILE B HG22 1 
ATOM 2511 H HG23 . ILE B 1 69  ? -25.489 -24.809 -14.390 1.00 54.72 ? 69  ILE B HG23 1 
ATOM 2512 H HD11 . ILE B 1 69  ? -21.769 -22.991 -13.800 1.00 54.72 ? 69  ILE B HD11 1 
ATOM 2513 H HD12 . ILE B 1 69  ? -21.631 -24.509 -13.353 1.00 54.72 ? 69  ILE B HD12 1 
ATOM 2514 H HD13 . ILE B 1 69  ? -22.480 -24.135 -14.643 1.00 54.72 ? 69  ILE B HD13 1 
ATOM 2515 N N    . GLU B 1 70  ? -25.725 -27.266 -11.638 1.00 64.55 ? 70  GLU B N    1 
ATOM 2516 C CA   . GLU B 1 70  ? -25.466 -28.630 -11.207 1.00 65.31 ? 70  GLU B CA   1 
ATOM 2517 C C    . GLU B 1 70  ? -25.029 -29.432 -12.430 1.00 67.42 ? 70  GLU B C    1 
ATOM 2518 O O    . GLU B 1 70  ? -25.804 -29.592 -13.376 1.00 70.67 ? 70  GLU B O    1 
ATOM 2519 C CB   . GLU B 1 70  ? -26.701 -29.257 -10.566 1.00 67.93 ? 70  GLU B CB   1 
ATOM 2520 C CG   . GLU B 1 70  ? -26.436 -30.647 -10.016 1.00 69.01 ? 70  GLU B CG   1 
ATOM 2521 C CD   . GLU B 1 70  ? -27.667 -31.297 -9.420  1.00 72.23 ? 70  GLU B CD   1 
ATOM 2522 O OE1  . GLU B 1 70  ? -28.497 -30.579 -8.822  1.00 72.24 ? 70  GLU B OE1  1 
ATOM 2523 O OE2  . GLU B 1 70  ? -27.805 -32.531 -9.550  1.00 75.14 ? 70  GLU B OE2  1 
ATOM 2524 H H    . GLU B 1 70  ? -26.103 -27.220 -12.409 1.00 54.72 ? 70  GLU B H    1 
ATOM 2525 H HA   . GLU B 1 70  ? -24.744 -28.635 -10.559 1.00 54.72 ? 70  GLU B HA   1 
ATOM 2526 H HB2  . GLU B 1 70  ? -26.996 -28.695 -9.832  1.00 54.72 ? 70  GLU B HB2  1 
ATOM 2527 H HB3  . GLU B 1 70  ? -27.402 -29.327 -11.233 1.00 54.72 ? 70  GLU B HB3  1 
ATOM 2528 H HG2  . GLU B 1 70  ? -26.118 -31.214 -10.736 1.00 54.72 ? 70  GLU B HG2  1 
ATOM 2529 H HG3  . GLU B 1 70  ? -25.763 -30.587 -9.320  1.00 54.72 ? 70  GLU B HG3  1 
ATOM 2530 N N    . ASP B 1 71  ? -23.792 -29.925 -12.411 1.00 65.95 ? 71  ASP B N    1 
ATOM 2531 C CA   . ASP B 1 71  ? -23.216 -30.629 -13.556 1.00 68.01 ? 71  ASP B CA   1 
ATOM 2532 C C    . ASP B 1 71  ? -22.782 -32.048 -13.183 1.00 69.30 ? 71  ASP B C    1 
ATOM 2533 O O    . ASP B 1 71  ? -22.587 -32.355 -12.007 1.00 67.71 ? 71  ASP B O    1 
ATOM 2534 C CB   . ASP B 1 71  ? -22.028 -29.837 -14.107 1.00 65.78 ? 71  ASP B CB   1 
ATOM 2535 C CG   . ASP B 1 71  ? -21.541 -30.366 -15.440 1.00 68.43 ? 71  ASP B CG   1 
ATOM 2536 O OD1  . ASP B 1 71  ? -22.378 -30.574 -16.343 1.00 71.86 ? 71  ASP B OD1  1 
ATOM 2537 O OD2  . ASP B 1 71  ? -20.320 -30.579 -15.583 1.00 67.46 ? 71  ASP B OD2  1 
ATOM 2538 H H    . ASP B 1 71  ? -23.259 -29.863 -11.739 1.00 54.72 ? 71  ASP B H    1 
ATOM 2539 H HA   . ASP B 1 71  ? -23.884 -30.694 -14.256 1.00 54.72 ? 71  ASP B HA   1 
ATOM 2540 H HB2  . ASP B 1 71  ? -22.295 -28.913 -14.230 1.00 54.72 ? 71  ASP B HB2  1 
ATOM 2541 H HB3  . ASP B 1 71  ? -21.293 -29.890 -13.476 1.00 54.72 ? 71  ASP B HB3  1 
ATOM 2542 N N    . SER B 1 72  ? -22.626 -32.900 -14.194 1.00 72.56 ? 72  SER B N    1 
ATOM 2543 C CA   . SER B 1 72  ? -22.311 -34.310 -13.983 1.00 74.78 ? 72  SER B CA   1 
ATOM 2544 C C    . SER B 1 72  ? -21.006 -34.708 -14.666 1.00 75.01 ? 72  SER B C    1 
ATOM 2545 O O    . SER B 1 72  ? -20.409 -35.731 -14.327 1.00 75.99 ? 72  SER B O    1 
ATOM 2546 C CB   . SER B 1 72  ? -23.455 -35.176 -14.501 1.00 79.83 ? 72  SER B CB   1 
ATOM 2547 O OG   . SER B 1 72  ? -24.696 -34.645 -14.070 1.00 80.06 ? 72  SER B OG   1 
ATOM 2548 H H    . SER B 1 72  ? -22.700 -32.683 -15.023 1.00 54.72 ? 72  SER B H    1 
ATOM 2549 H HA   . SER B 1 72  ? -22.215 -34.475 -13.032 1.00 54.72 ? 72  SER B HA   1 
ATOM 2550 H HB2  . SER B 1 72  ? -23.433 -35.186 -15.471 1.00 54.72 ? 72  SER B HB2  1 
ATOM 2551 H HB3  . SER B 1 72  ? -23.355 -36.076 -14.154 1.00 54.72 ? 72  SER B HB3  1 
ATOM 2552 H HG   . SER B 1 72  ? -25.327 -35.121 -14.355 1.00 54.72 ? 72  SER B HG   1 
ATOM 2553 N N    . VAL B 1 73  ? -20.574 -33.900 -15.630 1.00 74.48 ? 73  VAL B N    1 
ATOM 2554 C CA   . VAL B 1 73  ? -19.315 -34.143 -16.326 1.00 74.91 ? 73  VAL B CA   1 
ATOM 2555 C C    . VAL B 1 73  ? -18.163 -34.171 -15.333 1.00 71.59 ? 73  VAL B C    1 
ATOM 2556 O O    . VAL B 1 73  ? -17.229 -34.958 -15.475 1.00 72.77 ? 73  VAL B O    1 
ATOM 2557 C CB   . VAL B 1 73  ? -19.025 -33.065 -17.388 1.00 74.59 ? 73  VAL B CB   1 
ATOM 2558 C CG1  . VAL B 1 73  ? -17.640 -33.266 -17.979 1.00 74.99 ? 73  VAL B CG1  1 
ATOM 2559 C CG2  . VAL B 1 73  ? -20.073 -33.086 -18.482 1.00 78.51 ? 73  VAL B CG2  1 
ATOM 2560 H H    . VAL B 1 73  ? -20.994 -33.200 -15.901 1.00 54.72 ? 73  VAL B H    1 
ATOM 2561 H HA   . VAL B 1 73  ? -19.356 -35.004 -16.770 1.00 54.72 ? 73  VAL B HA   1 
ATOM 2562 H HB   . VAL B 1 73  ? -19.048 -32.191 -16.967 1.00 54.72 ? 73  VAL B HB   1 
ATOM 2563 H HG11 . VAL B 1 73  ? -17.478 -32.578 -18.644 1.00 54.72 ? 73  VAL B HG11 1 
ATOM 2564 H HG12 . VAL B 1 73  ? -16.982 -33.203 -17.270 1.00 54.72 ? 73  VAL B HG12 1 
ATOM 2565 H HG13 . VAL B 1 73  ? -17.598 -34.143 -18.393 1.00 54.72 ? 73  VAL B HG13 1 
ATOM 2566 H HG21 . VAL B 1 73  ? -19.863 -32.398 -19.133 1.00 54.72 ? 73  VAL B HG21 1 
ATOM 2567 H HG22 . VAL B 1 73  ? -20.066 -33.958 -18.908 1.00 54.72 ? 73  VAL B HG22 1 
ATOM 2568 H HG23 . VAL B 1 73  ? -20.943 -32.916 -18.089 1.00 54.72 ? 73  VAL B HG23 1 
ATOM 2569 N N    . ILE B 1 74  ? -18.243 -33.307 -14.327 1.00 67.86 ? 74  ILE B N    1 
ATOM 2570 C CA   . ILE B 1 74  ? -17.159 -33.146 -13.369 1.00 64.81 ? 74  ILE B CA   1 
ATOM 2571 C C    . ILE B 1 74  ? -17.383 -33.960 -12.102 1.00 64.57 ? 74  ILE B C    1 
ATOM 2572 O O    . ILE B 1 74  ? -18.520 -34.200 -11.696 1.00 65.57 ? 74  ILE B O    1 
ATOM 2573 C CB   . ILE B 1 74  ? -16.974 -31.666 -12.983 1.00 61.27 ? 74  ILE B CB   1 
ATOM 2574 C CG1  . ILE B 1 74  ? -18.286 -31.068 -12.463 1.00 60.57 ? 74  ILE B CG1  1 
ATOM 2575 C CG2  . ILE B 1 74  ? -16.475 -30.882 -14.183 1.00 61.64 ? 74  ILE B CG2  1 
ATOM 2576 C CD1  . ILE B 1 74  ? -18.135 -29.687 -11.863 1.00 57.42 ? 74  ILE B CD1  1 
ATOM 2577 H H    . ILE B 1 74  ? -18.920 -32.798 -14.178 1.00 54.72 ? 74  ILE B H    1 
ATOM 2578 H HA   . ILE B 1 74  ? -16.334 -33.452 -13.777 1.00 54.72 ? 74  ILE B HA   1 
ATOM 2579 H HB   . ILE B 1 74  ? -16.308 -31.611 -12.279 1.00 54.72 ? 74  ILE B HB   1 
ATOM 2580 H HG12 . ILE B 1 74  ? -18.913 -31.004 -13.200 1.00 54.72 ? 74  ILE B HG12 1 
ATOM 2581 H HG13 . ILE B 1 74  ? -18.644 -31.652 -11.777 1.00 54.72 ? 74  ILE B HG13 1 
ATOM 2582 H HG21 . ILE B 1 74  ? -16.363 -29.953 -13.928 1.00 54.72 ? 74  ILE B HG21 1 
ATOM 2583 H HG22 . ILE B 1 74  ? -15.626 -31.252 -14.470 1.00 54.72 ? 74  ILE B HG22 1 
ATOM 2584 H HG23 . ILE B 1 74  ? -17.127 -30.952 -14.898 1.00 54.72 ? 74  ILE B HG23 1 
ATOM 2585 H HD11 . ILE B 1 74  ? -19.003 -29.379 -11.559 1.00 54.72 ? 74  ILE B HD11 1 
ATOM 2586 H HD12 . ILE B 1 74  ? -17.520 -29.734 -11.115 1.00 54.72 ? 74  ILE B HD12 1 
ATOM 2587 H HD13 . ILE B 1 74  ? -17.788 -29.085 -12.540 1.00 54.72 ? 74  ILE B HD13 1 
ATOM 2588 N N    . SER B 1 75  ? -16.277 -34.384 -11.497 1.00 63.63 ? 75  SER B N    1 
ATOM 2589 C CA   . SER B 1 75  ? -16.290 -35.092 -10.223 1.00 63.36 ? 75  SER B CA   1 
ATOM 2590 C C    . SER B 1 75  ? -15.389 -34.335 -9.249  1.00 59.96 ? 75  SER B C    1 
ATOM 2591 O O    . SER B 1 75  ? -14.806 -33.318 -9.616  1.00 58.11 ? 75  SER B O    1 
ATOM 2592 C CB   . SER B 1 75  ? -15.808 -36.537 -10.395 1.00 66.53 ? 75  SER B CB   1 
ATOM 2593 O OG   . SER B 1 75  ? -16.261 -37.362 -9.336  1.00 67.51 ? 75  SER B OG   1 
ATOM 2594 H H    . SER B 1 75  ? -15.486 -34.270 -11.815 1.00 54.72 ? 75  SER B H    1 
ATOM 2595 H HA   . SER B 1 75  ? -17.192 -35.106 -9.866  1.00 54.72 ? 75  SER B HA   1 
ATOM 2596 H HB2  . SER B 1 75  ? -16.152 -36.885 -11.233 1.00 54.72 ? 75  SER B HB2  1 
ATOM 2597 H HB3  . SER B 1 75  ? -14.839 -36.546 -10.407 1.00 54.72 ? 75  SER B HB3  1 
ATOM 2598 H HG   . SER B 1 75  ? -15.988 -38.148 -9.447  1.00 54.72 ? 75  SER B HG   1 
ATOM 2599 N N    . LEU B 1 76  ? -15.287 -34.821 -8.015  1.00 59.56 ? 76  LEU B N    1 
ATOM 2600 C CA   . LEU B 1 76  ? -14.337 -34.276 -7.042  1.00 57.09 ? 76  LEU B CA   1 
ATOM 2601 C C    . LEU B 1 76  ? -13.615 -35.427 -6.346  1.00 58.52 ? 76  LEU B C    1 
ATOM 2602 O O    . LEU B 1 76  ? -13.458 -35.435 -5.125  1.00 57.66 ? 76  LEU B O    1 
ATOM 2603 C CB   . LEU B 1 76  ? -15.040 -33.384 -6.010  1.00 56.72 ? 76  LEU B CB   1 
ATOM 2604 C CG   . LEU B 1 76  ? -15.506 -31.997 -6.465  1.00 54.97 ? 76  LEU B CG   1 
ATOM 2605 C CD1  . LEU B 1 76  ? -16.452 -31.398 -5.446  1.00 54.04 ? 76  LEU B CD1  1 
ATOM 2606 C CD2  . LEU B 1 76  ? -14.329 -31.063 -6.674  1.00 53.20 ? 76  LEU B CD2  1 
ATOM 2607 H H    . LEU B 1 76  ? -15.759 -35.473 -7.713  1.00 54.72 ? 76  LEU B H    1 
ATOM 2608 H HA   . LEU B 1 76  ? -13.676 -33.740 -7.506  1.00 54.72 ? 76  LEU B HA   1 
ATOM 2609 H HB2  . LEU B 1 76  ? -15.826 -33.856 -5.692  1.00 54.72 ? 76  LEU B HB2  1 
ATOM 2610 H HB3  . LEU B 1 76  ? -14.430 -33.248 -5.268  1.00 54.72 ? 76  LEU B HB3  1 
ATOM 2611 H HG   . LEU B 1 76  ? -15.981 -32.079 -7.307  1.00 54.72 ? 76  LEU B HG   1 
ATOM 2612 H HD11 . LEU B 1 76  ? -16.734 -30.522 -5.753  1.00 54.72 ? 76  LEU B HD11 1 
ATOM 2613 H HD12 . LEU B 1 76  ? -17.223 -31.980 -5.351  1.00 54.72 ? 76  LEU B HD12 1 
ATOM 2614 H HD13 . LEU B 1 76  ? -15.991 -31.318 -4.596  1.00 54.72 ? 76  LEU B HD13 1 
ATOM 2615 H HD21 . LEU B 1 76  ? -14.660 -30.197 -6.960  1.00 54.72 ? 76  LEU B HD21 1 
ATOM 2616 H HD22 . LEU B 1 76  ? -13.846 -30.973 -5.837  1.00 54.72 ? 76  LEU B HD22 1 
ATOM 2617 H HD23 . LEU B 1 76  ? -13.747 -31.437 -7.354  1.00 54.72 ? 76  LEU B HD23 1 
ATOM 2618 N N    . SER B 1 77  ? -13.181 -36.401 -7.139  1.00 61.09 ? 77  SER B N    1 
ATOM 2619 C CA   . SER B 1 77  ? -12.549 -37.603 -6.611  1.00 63.17 ? 77  SER B CA   1 
ATOM 2620 C C    . SER B 1 77  ? -11.986 -38.459 -7.737  1.00 66.18 ? 77  SER B C    1 
ATOM 2621 O O    . SER B 1 77  ? -12.326 -38.267 -8.904  1.00 67.09 ? 77  SER B O    1 
ATOM 2622 C CB   . SER B 1 77  ? -13.551 -38.423 -5.795  1.00 64.89 ? 77  SER B CB   1 
ATOM 2623 O OG   . SER B 1 77  ? -14.626 -38.862 -6.612  1.00 67.26 ? 77  SER B OG   1 
ATOM 2624 H H    . SER B 1 77  ? -13.242 -36.389 -7.997  1.00 54.72 ? 77  SER B H    1 
ATOM 2625 H HA   . SER B 1 77  ? -11.817 -37.349 -6.027  1.00 54.72 ? 77  SER B HA   1 
ATOM 2626 H HB2  . SER B 1 77  ? -13.099 -39.198 -5.426  1.00 54.72 ? 77  SER B HB2  1 
ATOM 2627 H HB3  . SER B 1 77  ? -13.902 -37.872 -5.079  1.00 54.72 ? 77  SER B HB3  1 
ATOM 2628 H HG   . SER B 1 77  ? -15.170 -39.311 -6.155  1.00 54.72 ? 77  SER B HG   1 
ATOM 2629 N N    . GLY B 1 78  ? -11.133 -39.411 -7.375  1.00 68.11 ? 78  GLY B N    1 
ATOM 2630 C CA   . GLY B 1 78  ? -10.589 -40.360 -8.328  1.00 71.66 ? 78  GLY B CA   1 
ATOM 2631 C C    . GLY B 1 78  ? -9.685  -39.742 -9.377  1.00 71.25 ? 78  GLY B C    1 
ATOM 2632 O O    . GLY B 1 78  ? -8.924  -38.815 -9.098  1.00 68.58 ? 78  GLY B O    1 
ATOM 2633 H H    . GLY B 1 78  ? -10.853 -39.527 -6.571  1.00 54.72 ? 78  GLY B H    1 
ATOM 2634 H HA2  . GLY B 1 78  ? -10.079 -41.032 -7.849  1.00 54.72 ? 78  GLY B HA2  1 
ATOM 2635 H HA3  . GLY B 1 78  ? -11.320 -40.805 -8.785  1.00 54.72 ? 78  GLY B HA3  1 
ATOM 2636 N N    . ASP B 1 79  ? -9.776  -40.265 -10.596 1.00 74.40 ? 79  ASP B N    1 
ATOM 2637 C CA   . ASP B 1 79  ? -8.888  -39.862 -11.681 1.00 75.07 ? 79  ASP B CA   1 
ATOM 2638 C C    . ASP B 1 79  ? -9.392  -38.611 -12.400 1.00 72.85 ? 79  ASP B C    1 
ATOM 2639 O O    . ASP B 1 79  ? -8.599  -37.770 -12.821 1.00 71.63 ? 79  ASP B O    1 
ATOM 2640 C CB   . ASP B 1 79  ? -8.729  -41.010 -12.683 1.00 80.10 ? 79  ASP B CB   1 
ATOM 2641 C CG   . ASP B 1 79  ? -8.355  -42.323 -12.014 1.00 82.97 ? 79  ASP B CG   1 
ATOM 2642 O OD1  . ASP B 1 79  ? -7.565  -42.298 -11.046 1.00 81.45 ? 79  ASP B OD1  1 
ATOM 2643 O OD2  . ASP B 1 79  ? -8.851  -43.382 -12.459 1.00 87.13 ? 79  ASP B OD2  1 
ATOM 2644 H H    . ASP B 1 79  ? -10.351 -40.863 -10.822 1.00 54.72 ? 79  ASP B H    1 
ATOM 2645 H HA   . ASP B 1 79  ? -8.013  -39.662 -11.314 1.00 54.72 ? 79  ASP B HA   1 
ATOM 2646 H HB2  . ASP B 1 79  ? -9.568  -41.139 -13.152 1.00 54.72 ? 79  ASP B HB2  1 
ATOM 2647 H HB3  . ASP B 1 79  ? -8.027  -40.784 -13.314 1.00 54.72 ? 79  ASP B HB3  1 
ATOM 2648 N N    . HIS B 1 80  ? -10.710 -38.489 -12.530 1.00 72.71 ? 80  HIS B N    1 
ATOM 2649 C CA   . HIS B 1 80  ? -11.314 -37.353 -13.226 1.00 71.11 ? 80  HIS B CA   1 
ATOM 2650 C C    . HIS B 1 80  ? -11.383 -36.121 -12.325 1.00 66.65 ? 80  HIS B C    1 
ATOM 2651 O O    . HIS B 1 80  ? -11.898 -35.077 -12.730 1.00 65.10 ? 80  HIS B O    1 
ATOM 2652 C CB   . HIS B 1 80  ? -12.722 -37.710 -13.711 1.00 73.21 ? 80  HIS B CB   1 
ATOM 2653 C CG   . HIS B 1 80  ? -13.134 -36.999 -14.963 1.00 74.01 ? 80  HIS B CG   1 
ATOM 2654 N ND1  . HIS B 1 80  ? -14.401 -36.485 -15.143 1.00 73.68 ? 80  HIS B ND1  1 
ATOM 2655 C CD2  . HIS B 1 80  ? -12.455 -36.728 -16.105 1.00 75.55 ? 80  HIS B CD2  1 
ATOM 2656 C CE1  . HIS B 1 80  ? -14.482 -35.923 -16.335 1.00 74.91 ? 80  HIS B CE1  1 
ATOM 2657 N NE2  . HIS B 1 80  ? -13.316 -36.055 -16.939 1.00 76.07 ? 80  HIS B NE2  1 
ATOM 2658 H H    . HIS B 1 80  ? -11.282 -39.054 -12.224 1.00 54.72 ? 80  HIS B H    1 
ATOM 2659 H HA   . HIS B 1 80  ? -10.775 -37.131 -14.001 1.00 54.72 ? 80  HIS B HA   1 
ATOM 2660 H HB2  . HIS B 1 80  ? -12.759 -38.663 -13.886 1.00 54.72 ? 80  HIS B HB2  1 
ATOM 2661 H HB3  . HIS B 1 80  ? -13.358 -37.479 -13.016 1.00 54.72 ? 80  HIS B HB3  1 
ATOM 2662 H HD2  . HIS B 1 80  ? -11.571 -36.952 -16.287 1.00 54.72 ? 80  HIS B HD2  1 
ATOM 2663 H HE1  . HIS B 1 80  ? -15.234 -35.504 -16.688 1.00 54.72 ? 80  HIS B HE1  1 
ATOM 2664 H HE2  . HIS B 1 80  ? -13.126 -35.769 -17.727 1.00 54.72 ? 80  HIS B HE2  1 
ATOM 2665 N N    . SER B 1 81  ? -10.861 -36.260 -11.109 1.00 65.05 ? 81  SER B N    1 
ATOM 2666 C CA   . SER B 1 81  ? -10.957 -35.230 -10.076 1.00 61.43 ? 81  SER B CA   1 
ATOM 2667 C C    . SER B 1 81  ? -10.527 -33.849 -10.555 1.00 59.41 ? 81  SER B C    1 
ATOM 2668 O O    . SER B 1 81  ? -9.490  -33.701 -11.203 1.00 60.22 ? 81  SER B O    1 
ATOM 2669 C CB   . SER B 1 81  ? -10.109 -35.630 -8.869  1.00 60.85 ? 81  SER B CB   1 
ATOM 2670 O OG   . SER B 1 81  ? -10.499 -34.911 -7.714  1.00 58.19 ? 81  SER B OG   1 
ATOM 2671 H H    . SER B 1 81  ? -10.435 -36.961 -10.851 1.00 54.72 ? 81  SER B H    1 
ATOM 2672 H HA   . SER B 1 81  ? -11.880 -35.168 -9.784  1.00 54.72 ? 81  SER B HA   1 
ATOM 2673 H HB2  . SER B 1 81  ? -10.225 -36.579 -8.703  1.00 54.72 ? 81  SER B HB2  1 
ATOM 2674 H HB3  . SER B 1 81  ? -9.178  -35.439 -9.060  1.00 54.72 ? 81  SER B HB3  1 
ATOM 2675 H HG   . SER B 1 81  ? -10.025 -35.140 -7.059  1.00 54.72 ? 81  SER B HG   1 
ATOM 2676 N N    . ILE B 1 82  ? -11.338 -32.846 -10.228 1.00 57.19 ? 82  ILE B N    1 
ATOM 2677 C CA   . ILE B 1 82  ? -11.039 -31.462 -10.577 1.00 55.47 ? 82  ILE B CA   1 
ATOM 2678 C C    . ILE B 1 82  ? -10.368 -30.739 -9.409  1.00 53.22 ? 82  ILE B C    1 
ATOM 2679 O O    . ILE B 1 82  ? -10.272 -29.513 -9.405  1.00 51.76 ? 82  ILE B O    1 
ATOM 2680 C CB   . ILE B 1 82  ? -12.315 -30.686 -10.997 1.00 54.89 ? 82  ILE B CB   1 
ATOM 2681 C CG1  . ILE B 1 82  ? -13.281 -30.550 -9.811  1.00 53.38 ? 82  ILE B CG1  1 
ATOM 2682 C CG2  . ILE B 1 82  ? -12.972 -31.367 -12.193 1.00 57.64 ? 82  ILE B CG2  1 
ATOM 2683 C CD1  . ILE B 1 82  ? -14.635 -29.935 -10.149 1.00 53.34 ? 82  ILE B CD1  1 
ATOM 2684 H H    . ILE B 1 82  ? -12.077 -32.944 -9.799  1.00 54.72 ? 82  ILE B H    1 
ATOM 2685 H HA   . ILE B 1 82  ? -10.424 -31.452 -11.327 1.00 54.72 ? 82  ILE B HA   1 
ATOM 2686 H HB   . ILE B 1 82  ? -12.048 -29.794 -11.269 1.00 54.72 ? 82  ILE B HB   1 
ATOM 2687 H HG12 . ILE B 1 82  ? -13.444 -31.433 -9.443  1.00 54.72 ? 82  ILE B HG12 1 
ATOM 2688 H HG13 . ILE B 1 82  ? -12.865 -29.989 -9.137  1.00 54.72 ? 82  ILE B HG13 1 
ATOM 2689 H HG21 . ILE B 1 82  ? -13.766 -30.870 -12.442 1.00 54.72 ? 82  ILE B HG21 1 
ATOM 2690 H HG22 . ILE B 1 82  ? -12.344 -31.380 -12.932 1.00 54.72 ? 82  ILE B HG22 1 
ATOM 2691 H HG23 . ILE B 1 82  ? -13.212 -32.274 -11.946 1.00 54.72 ? 82  ILE B HG23 1 
ATOM 2692 H HD11 . ILE B 1 82  ? -15.172 -29.890 -9.343  1.00 54.72 ? 82  ILE B HD11 1 
ATOM 2693 H HD12 . ILE B 1 82  ? -14.496 -29.043 -10.504 1.00 54.72 ? 82  ILE B HD12 1 
ATOM 2694 H HD13 . ILE B 1 82  ? -15.077 -30.489 -10.811 1.00 54.72 ? 82  ILE B HD13 1 
ATOM 2695 N N    . ILE B 1 83  ? -9.916  -31.501 -8.416  1.00 53.34 ? 83  ILE B N    1 
ATOM 2696 C CA   . ILE B 1 83  ? -9.139  -30.935 -7.317  1.00 51.92 ? 83  ILE B CA   1 
ATOM 2697 C C    . ILE B 1 83  ? -7.756  -30.549 -7.827  1.00 52.56 ? 83  ILE B C    1 
ATOM 2698 O O    . ILE B 1 83  ? -7.097  -31.338 -8.505  1.00 54.55 ? 83  ILE B O    1 
ATOM 2699 C CB   . ILE B 1 83  ? -8.983  -31.923 -6.144  1.00 52.45 ? 83  ILE B CB   1 
ATOM 2700 C CG1  . ILE B 1 83  ? -10.344 -32.448 -5.681  1.00 52.52 ? 83  ILE B CG1  1 
ATOM 2701 C CG2  . ILE B 1 83  ? -8.246  -31.264 -4.985  1.00 51.33 ? 83  ILE B CG2  1 
ATOM 2702 C CD1  . ILE B 1 83  ? -11.283 -31.390 -5.172  1.00 50.66 ? 83  ILE B CD1  1 
ATOM 2703 H H    . ILE B 1 83  ? -10.046 -32.349 -8.355  1.00 54.72 ? 83  ILE B H    1 
ATOM 2704 H HA   . ILE B 1 83  ? -9.580  -30.136 -6.988  1.00 54.72 ? 83  ILE B HA   1 
ATOM 2705 H HB   . ILE B 1 83  ? -8.455  -32.677 -6.450  1.00 54.72 ? 83  ILE B HB   1 
ATOM 2706 H HG12 . ILE B 1 83  ? -10.776 -32.889 -6.429  1.00 54.72 ? 83  ILE B HG12 1 
ATOM 2707 H HG13 . ILE B 1 83  ? -10.203 -33.085 -4.964  1.00 54.72 ? 83  ILE B HG13 1 
ATOM 2708 H HG21 . ILE B 1 83  ? -8.160  -31.904 -4.261  1.00 54.72 ? 83  ILE B HG21 1 
ATOM 2709 H HG22 . ILE B 1 83  ? -7.367  -30.987 -5.288  1.00 54.72 ? 83  ILE B HG22 1 
ATOM 2710 H HG23 . ILE B 1 83  ? -8.752  -30.493 -4.687  1.00 54.72 ? 83  ILE B HG23 1 
ATOM 2711 H HD11 . ILE B 1 83  ? -12.115 -31.810 -4.902  1.00 54.72 ? 83  ILE B HD11 1 
ATOM 2712 H HD12 . ILE B 1 83  ? -10.876 -30.946 -4.412  1.00 54.72 ? 83  ILE B HD12 1 
ATOM 2713 H HD13 . ILE B 1 83  ? -11.450 -30.749 -5.880  1.00 54.72 ? 83  ILE B HD13 1 
ATOM 2714 N N    . GLY B 1 84  ? -7.314  -29.339 -7.500  1.00 51.33 ? 84  GLY B N    1 
ATOM 2715 C CA   . GLY B 1 84  ? -6.009  -28.869 -7.933  1.00 52.30 ? 84  GLY B CA   1 
ATOM 2716 C C    . GLY B 1 84  ? -5.976  -28.413 -9.379  1.00 53.25 ? 84  GLY B C    1 
ATOM 2717 O O    . GLY B 1 84  ? -4.976  -27.860 -9.836  1.00 54.31 ? 84  GLY B O    1 
ATOM 2718 H H    . GLY B 1 84  ? -7.754  -28.771 -7.027  1.00 54.72 ? 84  GLY B H    1 
ATOM 2719 H HA2  . GLY B 1 84  ? -5.737  -28.125 -7.373  1.00 54.72 ? 84  GLY B HA2  1 
ATOM 2720 H HA3  . GLY B 1 84  ? -5.361  -29.583 -7.825  1.00 54.72 ? 84  GLY B HA3  1 
ATOM 2721 N N    . ARG B 1 85  ? -7.062  -28.652 -10.106 1.00 53.31 ? 85  ARG B N    1 
ATOM 2722 C CA   . ARG B 1 85  ? -7.169  -28.196 -11.486 1.00 54.49 ? 85  ARG B CA   1 
ATOM 2723 C C    . ARG B 1 85  ? -7.420  -26.692 -11.513 1.00 53.21 ? 85  ARG B C    1 
ATOM 2724 O O    . ARG B 1 85  ? -7.744  -26.092 -10.487 1.00 51.41 ? 85  ARG B O    1 
ATOM 2725 C CB   . ARG B 1 85  ? -8.289  -28.933 -12.219 1.00 55.44 ? 85  ARG B CB   1 
ATOM 2726 C CG   . ARG B 1 85  ? -8.103  -30.442 -12.308 1.00 57.40 ? 85  ARG B CG   1 
ATOM 2727 C CD   . ARG B 1 85  ? -6.848  -30.810 -13.093 1.00 59.89 ? 85  ARG B CD   1 
ATOM 2728 N NE   . ARG B 1 85  ? -6.916  -32.164 -13.641 1.00 62.67 ? 85  ARG B NE   1 
ATOM 2729 C CZ   . ARG B 1 85  ? -5.962  -32.739 -14.370 1.00 65.58 ? 85  ARG B CZ   1 
ATOM 2730 N NH1  . ARG B 1 85  ? -4.837  -32.094 -14.657 1.00 66.10 ? 85  ARG B NH1  1 
ATOM 2731 N NH2  . ARG B 1 85  ? -6.138  -33.975 -14.818 1.00 68.42 ? 85  ARG B NH2  1 
ATOM 2732 H H    . ARG B 1 85  ? -7.754  -29.078 -9.822  1.00 54.72 ? 85  ARG B H    1 
ATOM 2733 H HA   . ARG B 1 85  ? -6.334  -28.374 -11.947 1.00 54.72 ? 85  ARG B HA   1 
ATOM 2734 H HB2  . ARG B 1 85  ? -9.124  -28.767 -11.755 1.00 54.72 ? 85  ARG B HB2  1 
ATOM 2735 H HB3  . ARG B 1 85  ? -8.344  -28.591 -13.125 1.00 54.72 ? 85  ARG B HB3  1 
ATOM 2736 H HG2  . ARG B 1 85  ? -8.019  -30.807 -11.413 1.00 54.72 ? 85  ARG B HG2  1 
ATOM 2737 H HG3  . ARG B 1 85  ? -8.868  -30.833 -12.758 1.00 54.72 ? 85  ARG B HG3  1 
ATOM 2738 H HD2  . ARG B 1 85  ? -6.742  -30.191 -13.832 1.00 54.72 ? 85  ARG B HD2  1 
ATOM 2739 H HD3  . ARG B 1 85  ? -6.079  -30.761 -12.504 1.00 54.72 ? 85  ARG B HD3  1 
ATOM 2740 H HE   . ARG B 1 85  ? -7.625  -32.623 -13.479 1.00 54.72 ? 85  ARG B HE   1 
ATOM 2741 H HH11 . ARG B 1 85  ? -4.716  -31.292 -14.371 1.00 54.72 ? 85  ARG B HH11 1 
ATOM 2742 H HH12 . ARG B 1 85  ? -4.229  -32.478 -15.129 1.00 54.72 ? 85  ARG B HH12 1 
ATOM 2743 H HH21 . ARG B 1 85  ? -6.864  -34.399 -14.636 1.00 54.72 ? 85  ARG B HH21 1 
ATOM 2744 H HH22 . ARG B 1 85  ? -5.526  -34.353 -15.288 1.00 54.72 ? 85  ARG B HH22 1 
ATOM 2745 N N    . THR B 1 86  ? -7.267  -26.093 -12.690 1.00 54.68 ? 86  THR B N    1 
ATOM 2746 C CA   . THR B 1 86  ? -7.454  -24.657 -12.857 1.00 54.10 ? 86  THR B CA   1 
ATOM 2747 C C    . THR B 1 86  ? -8.836  -24.329 -13.423 1.00 53.82 ? 86  THR B C    1 
ATOM 2748 O O    . THR B 1 86  ? -9.162  -24.691 -14.552 1.00 55.54 ? 86  THR B O    1 
ATOM 2749 C CB   . THR B 1 86  ? -6.372  -24.060 -13.783 1.00 56.12 ? 86  THR B CB   1 
ATOM 2750 O OG1  . THR B 1 86  ? -5.082  -24.242 -13.190 1.00 56.67 ? 86  THR B OG1  1 
ATOM 2751 C CG2  . THR B 1 86  ? -6.609  -22.573 -14.017 1.00 56.03 ? 86  THR B CG2  1 
ATOM 2752 H H    . THR B 1 86  ? -7.053  -26.502 -13.415 1.00 54.72 ? 86  THR B H    1 
ATOM 2753 H HA   . THR B 1 86  ? -7.376  -24.227 -11.991 1.00 54.72 ? 86  THR B HA   1 
ATOM 2754 H HB   . THR B 1 86  ? -6.398  -24.513 -14.641 1.00 54.72 ? 86  THR B HB   1 
ATOM 2755 H HG1  . THR B 1 86  ? -4.488  -23.920 -13.689 1.00 54.72 ? 86  THR B HG1  1 
ATOM 2756 H HG21 . THR B 1 86  ? -5.922  -22.216 -14.600 1.00 54.72 ? 86  THR B HG21 1 
ATOM 2757 H HG22 . THR B 1 86  ? -7.476  -22.437 -14.431 1.00 54.72 ? 86  THR B HG22 1 
ATOM 2758 H HG23 . THR B 1 86  ? -6.585  -22.097 -13.172 1.00 54.72 ? 86  THR B HG23 1 
ATOM 2759 N N    . LEU B 1 87  ? -9.643  -23.640 -12.623 1.00 55.97 ? 87  LEU B N    1 
ATOM 2760 C CA   . LEU B 1 87  ? -10.906 -23.081 -13.091 1.00 55.94 ? 87  LEU B CA   1 
ATOM 2761 C C    . LEU B 1 87  ? -10.625 -21.867 -13.972 1.00 57.19 ? 87  LEU B C    1 
ATOM 2762 O O    . LEU B 1 87  ? -9.819  -21.013 -13.603 1.00 57.09 ? 87  LEU B O    1 
ATOM 2763 C CB   . LEU B 1 87  ? -11.790 -22.689 -11.905 1.00 54.38 ? 87  LEU B CB   1 
ATOM 2764 C CG   . LEU B 1 87  ? -13.150 -22.063 -12.219 1.00 54.51 ? 87  LEU B CG   1 
ATOM 2765 C CD1  . LEU B 1 87  ? -14.109 -23.092 -12.815 1.00 55.51 ? 87  LEU B CD1  1 
ATOM 2766 C CD2  . LEU B 1 87  ? -13.720 -21.439 -10.957 1.00 53.02 ? 87  LEU B CD2  1 
ATOM 2767 H H    . LEU B 1 87  ? -9.478  -23.480 -11.794 1.00 54.72 ? 87  LEU B H    1 
ATOM 2768 H HA   . LEU B 1 87  ? -11.377 -23.744 -13.620 1.00 54.72 ? 87  LEU B HA   1 
ATOM 2769 H HB2  . LEU B 1 87  ? -11.959 -23.487 -11.379 1.00 54.72 ? 87  LEU B HB2  1 
ATOM 2770 H HB3  . LEU B 1 87  ? -11.301 -22.049 -11.364 1.00 54.72 ? 87  LEU B HB3  1 
ATOM 2771 H HG   . LEU B 1 87  ? -13.027 -21.357 -12.872 1.00 54.72 ? 87  LEU B HG   1 
ATOM 2772 H HD11 . LEU B 1 87  ? -14.958 -22.660 -13.001 1.00 54.72 ? 87  LEU B HD11 1 
ATOM 2773 H HD12 . LEU B 1 87  ? -13.728 -23.440 -13.636 1.00 54.72 ? 87  LEU B HD12 1 
ATOM 2774 H HD13 . LEU B 1 87  ? -14.236 -23.811 -12.177 1.00 54.72 ? 87  LEU B HD13 1 
ATOM 2775 H HD21 . LEU B 1 87  ? -14.582 -21.044 -11.162 1.00 54.72 ? 87  LEU B HD21 1 
ATOM 2776 H HD22 . LEU B 1 87  ? -13.824 -22.129 -10.283 1.00 54.72 ? 87  LEU B HD22 1 
ATOM 2777 H HD23 . LEU B 1 87  ? -13.109 -20.755 -10.640 1.00 54.72 ? 87  LEU B HD23 1 
ATOM 2778 N N    . VAL B 1 88  ? -11.283 -21.796 -15.127 1.00 56.53 ? 88  VAL B N    1 
ATOM 2779 C CA   . VAL B 1 88  ? -11.052 -20.710 -16.079 1.00 58.26 ? 88  VAL B CA   1 
ATOM 2780 C C    . VAL B 1 88  ? -12.362 -20.031 -16.441 1.00 58.59 ? 88  VAL B C    1 
ATOM 2781 O O    . VAL B 1 88  ? -13.411 -20.672 -16.529 1.00 58.56 ? 88  VAL B O    1 
ATOM 2782 C CB   . VAL B 1 88  ? -10.341 -21.222 -17.367 1.00 59.78 ? 88  VAL B CB   1 
ATOM 2783 C CG1  . VAL B 1 88  ? -10.823 -20.491 -18.631 1.00 62.18 ? 88  VAL B CG1  1 
ATOM 2784 C CG2  . VAL B 1 88  ? -8.839  -21.080 -17.224 1.00 60.39 ? 88  VAL B CG2  1 
ATOM 2785 H H    . VAL B 1 88  ? -11.871 -22.368 -15.386 1.00 54.72 ? 88  VAL B H    1 
ATOM 2786 H HA   . VAL B 1 88  ? -10.477 -20.047 -15.665 1.00 54.72 ? 88  VAL B HA   1 
ATOM 2787 H HB   . VAL B 1 88  ? -10.539 -22.165 -17.478 1.00 54.72 ? 88  VAL B HB   1 
ATOM 2788 H HG11 . VAL B 1 88  ? -10.351 -20.846 -19.400 1.00 54.72 ? 88  VAL B HG11 1 
ATOM 2789 H HG12 . VAL B 1 88  ? -11.777 -20.634 -18.732 1.00 54.72 ? 88  VAL B HG12 1 
ATOM 2790 H HG13 . VAL B 1 88  ? -10.638 -19.543 -18.537 1.00 54.72 ? 88  VAL B HG13 1 
ATOM 2791 H HG21 . VAL B 1 88  ? -8.413  -21.403 -18.033 1.00 54.72 ? 88  VAL B HG21 1 
ATOM 2792 H HG22 . VAL B 1 88  ? -8.623  -20.145 -17.086 1.00 54.72 ? 88  VAL B HG22 1 
ATOM 2793 H HG23 . VAL B 1 88  ? -8.544  -21.604 -16.463 1.00 54.72 ? 88  VAL B HG23 1 
ATOM 2794 N N    . VAL B 1 89  ? -12.284 -18.719 -16.627 1.00 57.42 ? 89  VAL B N    1 
ATOM 2795 C CA   . VAL B 1 89  ? -13.425 -17.931 -17.051 1.00 58.28 ? 89  VAL B CA   1 
ATOM 2796 C C    . VAL B 1 89  ? -12.948 -16.873 -18.049 1.00 60.79 ? 89  VAL B C    1 
ATOM 2797 O O    . VAL B 1 89  ? -11.915 -16.241 -17.842 1.00 61.12 ? 89  VAL B O    1 
ATOM 2798 C CB   . VAL B 1 89  ? -14.137 -17.268 -15.846 1.00 58.81 ? 89  VAL B CB   1 
ATOM 2799 C CG1  . VAL B 1 89  ? -13.168 -16.422 -15.023 1.00 58.17 ? 89  VAL B CG1  1 
ATOM 2800 C CG2  . VAL B 1 89  ? -15.318 -16.433 -16.311 1.00 60.12 ? 89  VAL B CG2  1 
ATOM 2801 H H    . VAL B 1 89  ? -11.568 -18.258 -16.512 1.00 54.72 ? 89  VAL B H    1 
ATOM 2802 H HA   . VAL B 1 89  ? -14.063 -18.507 -17.500 1.00 54.72 ? 89  VAL B HA   1 
ATOM 2803 H HB   . VAL B 1 89  ? -14.480 -17.966 -15.267 1.00 54.72 ? 89  VAL B HB   1 
ATOM 2804 H HG11 . VAL B 1 89  ? -13.649 -16.025 -14.281 1.00 54.72 ? 89  VAL B HG11 1 
ATOM 2805 H HG12 . VAL B 1 89  ? -12.456 -16.991 -14.691 1.00 54.72 ? 89  VAL B HG12 1 
ATOM 2806 H HG13 . VAL B 1 89  ? -12.799 -15.726 -15.589 1.00 54.72 ? 89  VAL B HG13 1 
ATOM 2807 H HG21 . VAL B 1 89  ? -15.744 -16.031 -15.537 1.00 54.72 ? 89  VAL B HG21 1 
ATOM 2808 H HG22 . VAL B 1 89  ? -14.999 -15.741 -16.910 1.00 54.72 ? 89  VAL B HG22 1 
ATOM 2809 H HG23 . VAL B 1 89  ? -15.948 -17.008 -16.773 1.00 54.72 ? 89  VAL B HG23 1 
ATOM 2810 N N    . HIS B 1 90  ? -13.682 -16.703 -19.145 1.00 63.00 ? 90  HIS B N    1 
ATOM 2811 C CA   . HIS B 1 90  ? -13.305 -15.731 -20.171 1.00 65.91 ? 90  HIS B CA   1 
ATOM 2812 C C    . HIS B 1 90  ? -13.636 -14.297 -19.780 1.00 66.15 ? 90  HIS B C    1 
ATOM 2813 O O    . HIS B 1 90  ? -14.772 -13.992 -19.420 1.00 65.55 ? 90  HIS B O    1 
ATOM 2814 C CB   . HIS B 1 90  ? -14.001 -16.054 -21.488 1.00 68.69 ? 90  HIS B CB   1 
ATOM 2815 C CG   . HIS B 1 90  ? -13.349 -17.153 -22.262 1.00 70.16 ? 90  HIS B CG   1 
ATOM 2816 N ND1  . HIS B 1 90  ? -12.833 -18.282 -21.662 1.00 68.32 ? 90  HIS B ND1  1 
ATOM 2817 C CD2  . HIS B 1 90  ? -13.136 -17.303 -23.590 1.00 73.69 ? 90  HIS B CD2  1 
ATOM 2818 C CE1  . HIS B 1 90  ? -12.328 -19.078 -22.586 1.00 70.68 ? 90  HIS B CE1  1 
ATOM 2819 N NE2  . HIS B 1 90  ? -12.501 -18.507 -23.766 1.00 73.98 ? 90  HIS B NE2  1 
ATOM 2820 H H    . HIS B 1 90  ? -14.403 -17.137 -19.320 1.00 54.72 ? 90  HIS B H    1 
ATOM 2821 H HA   . HIS B 1 90  ? -12.347 -15.786 -20.318 1.00 54.72 ? 90  HIS B HA   1 
ATOM 2822 H HB2  . HIS B 1 90  ? -14.913 -16.324 -21.302 1.00 54.72 ? 90  HIS B HB2  1 
ATOM 2823 H HB3  . HIS B 1 90  ? -14.000 -15.260 -22.045 1.00 54.72 ? 90  HIS B HB3  1 
ATOM 2824 H HD2  . HIS B 1 90  ? -13.376 -16.703 -24.258 1.00 54.72 ? 90  HIS B HD2  1 
ATOM 2825 H HE1  . HIS B 1 90  ? -11.921 -19.900 -22.434 1.00 54.72 ? 90  HIS B HE1  1 
ATOM 2826 H HE2  . HIS B 1 90  ? -12.252 -18.835 -24.521 1.00 54.72 ? 90  HIS B HE2  1 
ATOM 2827 N N    . GLU B 1 91  ? -12.652 -13.410 -19.889 1.00 67.54 ? 91  GLU B N    1 
ATOM 2828 C CA   . GLU B 1 91  ? -12.855 -12.014 -19.523 1.00 68.38 ? 91  GLU B CA   1 
ATOM 2829 C C    . GLU B 1 91  ? -13.497 -11.220 -20.657 1.00 71.64 ? 91  GLU B C    1 
ATOM 2830 O O    . GLU B 1 91  ? -14.130 -10.194 -20.412 1.00 72.45 ? 91  GLU B O    1 
ATOM 2831 C CB   . GLU B 1 91  ? -11.533 -11.361 -19.117 1.00 70.75 ? 91  GLU B CB   1 
ATOM 2832 C CG   . GLU B 1 91  ? -10.981 -11.857 -17.792 1.00 67.88 ? 91  GLU B CG   1 
ATOM 2833 C CD   . GLU B 1 91  ? -9.757  -11.080 -17.353 1.00 69.22 ? 91  GLU B CD   1 
ATOM 2834 O OE1  . GLU B 1 91  ? -9.096  -10.475 -18.224 1.00 72.34 ? 91  GLU B OE1  1 
ATOM 2835 O OE2  . GLU B 1 91  ? -9.460  -11.065 -16.140 1.00 67.55 ? 91  GLU B OE2  1 
ATOM 2836 H H    . GLU B 1 91  ? -11.860 -13.591 -20.171 1.00 54.72 ? 91  GLU B H    1 
ATOM 2837 H HA   . GLU B 1 91  ? -13.452 -11.975 -18.759 1.00 54.72 ? 91  GLU B HA   1 
ATOM 2838 H HB2  . GLU B 1 91  ? -10.871 -11.546 -19.801 1.00 54.72 ? 91  GLU B HB2  1 
ATOM 2839 H HB3  . GLU B 1 91  ? -11.668 -10.403 -19.042 1.00 54.72 ? 91  GLU B HB3  1 
ATOM 2840 H HG2  . GLU B 1 91  ? -11.662 -11.759 -17.108 1.00 54.72 ? 91  GLU B HG2  1 
ATOM 2841 H HG3  . GLU B 1 91  ? -10.730 -12.790 -17.881 1.00 54.72 ? 91  GLU B HG3  1 
ATOM 2842 N N    . LYS B 1 92  ? -13.331 -11.686 -21.894 1.00 73.90 ? 92  LYS B N    1 
ATOM 2843 C CA   . LYS B 1 92  ? -13.948 -11.020 -23.040 1.00 77.43 ? 92  LYS B CA   1 
ATOM 2844 C C    . LYS B 1 92  ? -15.373 -11.525 -23.241 1.00 77.13 ? 92  LYS B C    1 
ATOM 2845 O O    . LYS B 1 92  ? -15.624 -12.732 -23.275 1.00 75.87 ? 92  LYS B O    1 
ATOM 2846 C CB   . LYS B 1 92  ? -13.120 -11.225 -24.315 1.00 80.74 ? 92  LYS B CB   1 
ATOM 2847 C CG   . LYS B 1 92  ? -13.439 -10.209 -25.417 1.00 85.10 ? 92  LYS B CG   1 
ATOM 2848 C CD   . LYS B 1 92  ? -12.383 -10.183 -26.513 1.00 88.77 ? 92  LYS B CD   1 
ATOM 2849 C CE   . LYS B 1 92  ? -12.810 -11.014 -27.711 1.00 91.21 ? 92  LYS B CE   1 
ATOM 2850 N NZ   . LYS B 1 92  ? -13.107 -12.427 -27.348 1.00 88.33 ? 92  LYS B NZ   1 
ATOM 2851 H H    . LYS B 1 92  ? -12.868 -12.382 -22.096 1.00 54.72 ? 92  LYS B H    1 
ATOM 2852 H HA   . LYS B 1 92  ? -13.992 -10.067 -22.863 1.00 54.72 ? 92  LYS B HA   1 
ATOM 2853 H HB2  . LYS B 1 92  ? -12.179 -11.141 -24.095 1.00 54.72 ? 92  LYS B HB2  1 
ATOM 2854 H HB3  . LYS B 1 92  ? -13.299 -12.111 -24.666 1.00 54.72 ? 92  LYS B HB3  1 
ATOM 2855 H HG2  . LYS B 1 92  ? -14.289 -10.440 -25.824 1.00 54.72 ? 92  LYS B HG2  1 
ATOM 2856 H HG3  . LYS B 1 92  ? -13.488 -9.323  -25.026 1.00 54.72 ? 92  LYS B HG3  1 
ATOM 2857 H HD2  . LYS B 1 92  ? -12.250 -9.269  -26.808 1.00 54.72 ? 92  LYS B HD2  1 
ATOM 2858 H HD3  . LYS B 1 92  ? -11.554 -10.550 -26.168 1.00 54.72 ? 92  LYS B HD3  1 
ATOM 2859 H HE2  . LYS B 1 92  ? -13.612 -10.627 -28.095 1.00 54.72 ? 92  LYS B HE2  1 
ATOM 2860 H HE3  . LYS B 1 92  ? -12.095 -11.015 -28.366 1.00 54.72 ? 92  LYS B HE3  1 
ATOM 2861 H HZ1  . LYS B 1 92  ? -13.352 -12.881 -28.073 1.00 54.72 ? 92  LYS B HZ1  1 
ATOM 2862 H HZ2  . LYS B 1 92  ? -12.383 -12.809 -26.998 1.00 54.72 ? 92  LYS B HZ2  1 
ATOM 2863 H HZ3  . LYS B 1 92  ? -13.766 -12.455 -26.751 1.00 54.72 ? 92  LYS B HZ3  1 
ATOM 2864 N N    . ALA B 1 93  ? -16.299 -10.582 -23.376 1.00 78.72 ? 93  ALA B N    1 
ATOM 2865 C CA   . ALA B 1 93  ? -17.722 -10.889 -23.396 1.00 78.67 ? 93  ALA B CA   1 
ATOM 2866 C C    . ALA B 1 93  ? -18.160 -11.462 -24.737 1.00 81.77 ? 93  ALA B C    1 
ATOM 2867 O O    . ALA B 1 93  ? -17.851 -10.910 -25.795 1.00 85.33 ? 93  ALA B O    1 
ATOM 2868 C CB   . ALA B 1 93  ? -18.536 -9.639  -23.063 1.00 79.79 ? 93  ALA B CB   1 
ATOM 2869 H H    . ALA B 1 93  ? -16.125 -9.744  -23.460 1.00 54.72 ? 93  ALA B H    1 
ATOM 2870 H HA   . ALA B 1 93  ? -17.908 -11.554 -22.714 1.00 54.72 ? 93  ALA B HA   1 
ATOM 2871 H HB1  . ALA B 1 93  ? -19.479 -9.863  -23.080 1.00 54.72 ? 93  ALA B HB1  1 
ATOM 2872 H HB2  . ALA B 1 93  ? -18.286 -9.327  -22.179 1.00 54.72 ? 93  ALA B HB2  1 
ATOM 2873 H HB3  . ALA B 1 93  ? -18.346 -8.954  -23.722 1.00 54.72 ? 93  ALA B HB3  1 
ATOM 2874 N N    . GLY B 1 94  ? -18.877 -12.582 -24.670 1.00 82.96 ? 94  GLY B N    1 
ATOM 2875 C CA   . GLY B 1 94  ? -19.484 -13.197 -25.836 1.00 86.20 ? 94  GLY B CA   1 
ATOM 2876 C C    . GLY B 1 94  ? -19.310 -14.704 -25.873 1.00 85.21 ? 94  GLY B C    1 
ATOM 2877 O O    . GLY B 1 94  ? -19.149 -15.349 -24.834 1.00 81.68 ? 94  GLY B O    1 
ATOM 2878 H H    . GLY B 1 94  ? -19.027 -13.010 -23.939 1.00 54.72 ? 94  GLY B H    1 
ATOM 2879 H HA2  . GLY B 1 94  ? -20.434 -12.999 -25.844 1.00 54.72 ? 94  GLY B HA2  1 
ATOM 2880 H HA3  . GLY B 1 94  ? -19.088 -12.824 -26.638 1.00 54.72 ? 94  GLY B HA3  1 
ATOM 2881 N N    . ALA B 1 95  ? -19.352 -15.260 -27.081 1.00 86.99 ? 95  ALA B N    1 
ATOM 2882 C CA   . ALA B 1 95  ? -19.203 -16.695 -27.295 1.00 87.15 ? 95  ALA B CA   1 
ATOM 2883 C C    . ALA B 1 95  ? -17.910 -16.995 -28.043 1.00 88.83 ? 95  ALA B C    1 
ATOM 2884 O O    . ALA B 1 95  ? -17.506 -18.151 -28.160 1.00 88.95 ? 95  ALA B O    1 
ATOM 2885 C CB   . ALA B 1 95  ? -20.397 -17.243 -28.063 1.00 90.27 ? 95  ALA B CB   1 
ATOM 2886 H H    . ALA B 1 95  ? -19.467 -14.815 -27.809 1.00 54.72 ? 95  ALA B H    1 
ATOM 2887 H HA   . ALA B 1 95  ? -19.166 -17.143 -26.435 1.00 54.72 ? 95  ALA B HA   1 
ATOM 2888 H HB1  . ALA B 1 95  ? -20.277 -18.197 -28.193 1.00 54.72 ? 95  ALA B HB1  1 
ATOM 2889 H HB2  . ALA B 1 95  ? -21.204 -17.077 -27.552 1.00 54.72 ? 95  ALA B HB2  1 
ATOM 2890 H HB3  . ALA B 1 95  ? -20.450 -16.795 -28.922 1.00 54.72 ? 95  ALA B HB3  1 
ATOM 2891 N N    . GLY B 1 96  ? -17.267 -15.948 -28.553 1.00 91.11 ? 96  GLY B N    1 
ATOM 2892 C CA   . GLY B 1 96  ? -16.036 -16.104 -29.304 1.00 93.32 ? 96  GLY B CA   1 
ATOM 2893 C C    . GLY B 1 96  ? -14.843 -16.328 -28.396 1.00 89.87 ? 96  GLY B C    1 
ATOM 2894 O O    . GLY B 1 96  ? -14.706 -15.661 -27.368 1.00 86.67 ? 96  GLY B O    1 
ATOM 2895 H H    . GLY B 1 96  ? -17.530 -15.133 -28.476 1.00 54.72 ? 96  GLY B H    1 
ATOM 2896 H HA2  . GLY B 1 96  ? -16.115 -16.863 -29.903 1.00 54.72 ? 96  GLY B HA2  1 
ATOM 2897 H HA3  . GLY B 1 96  ? -15.875 -15.307 -29.834 1.00 54.72 ? 96  GLY B HA3  1 
ATOM 2898 N N    . ALA B 1 97  ? -13.988 -17.275 -28.780 1.00 90.01 ? 97  ALA B N    1 
ATOM 2899 C CA   . ALA B 1 97  ? -12.786 -17.616 -28.019 1.00 87.43 ? 97  ALA B CA   1 
ATOM 2900 C C    . ALA B 1 97  ? -12.014 -16.372 -27.574 1.00 86.54 ? 97  ALA B C    1 
ATOM 2901 O O    . ALA B 1 97  ? -11.721 -15.492 -28.385 1.00 89.83 ? 97  ALA B O    1 
ATOM 2902 C CB   . ALA B 1 97  ? -11.884 -18.525 -28.850 1.00 91.74 ? 97  ALA B CB   1 
ATOM 2903 H H    . ALA B 1 97  ? -14.085 -17.744 -29.494 1.00 54.72 ? 97  ALA B H    1 
ATOM 2904 H HA   . ALA B 1 97  ? -13.048 -18.104 -27.223 1.00 54.72 ? 97  ALA B HA   1 
ATOM 2905 H HB1  . ALA B 1 97  ? -11.093 -18.742 -28.333 1.00 54.72 ? 97  ALA B HB1  1 
ATOM 2906 H HB2  . ALA B 1 97  ? -12.370 -19.336 -29.069 1.00 54.72 ? 97  ALA B HB2  1 
ATOM 2907 H HB3  . ALA B 1 97  ? -11.632 -18.061 -29.663 1.00 54.72 ? 97  ALA B HB3  1 
ATOM 2908 N N    . GLY B 1 98  ? -11.688 -16.316 -26.283 1.00 83.36 ? 98  GLY B N    1 
ATOM 2909 C CA   . GLY B 1 98  ? -11.036 -15.159 -25.692 1.00 82.52 ? 98  GLY B CA   1 
ATOM 2910 C C    . GLY B 1 98  ? -9.647  -15.443 -25.149 1.00 81.57 ? 98  GLY B C    1 
ATOM 2911 O O    . GLY B 1 98  ? -9.364  -16.539 -24.661 1.00 79.65 ? 98  GLY B O    1 
ATOM 2912 H H    . GLY B 1 98  ? -11.839 -16.950 -25.722 1.00 54.72 ? 98  GLY B H    1 
ATOM 2913 H HA2  . GLY B 1 98  ? -10.961 -14.459 -26.360 1.00 54.72 ? 98  GLY B HA2  1 
ATOM 2914 H HA3  . GLY B 1 98  ? -11.582 -14.824 -24.963 1.00 54.72 ? 98  GLY B HA3  1 
ATOM 2915 N N    . SER B 1 99  ? -8.781  -14.438 -25.226 1.00 82.45 ? 99  SER B N    1 
ATOM 2916 C CA   . SER B 1 99  ? -7.406  -14.562 -24.758 1.00 82.33 ? 99  SER B CA   1 
ATOM 2917 C C    . SER B 1 99  ? -7.290  -14.192 -23.287 1.00 78.76 ? 99  SER B C    1 
ATOM 2918 O O    . SER B 1 99  ? -6.489  -14.772 -22.554 1.00 77.21 ? 99  SER B O    1 
ATOM 2919 C CB   . SER B 1 99  ? -6.476  -13.674 -25.593 1.00 86.72 ? 99  SER B CB   1 
ATOM 2920 O OG   . SER B 1 99  ? -6.281  -14.210 -26.890 1.00 90.40 ? 99  SER B OG   1 
ATOM 2921 H H    . SER B 1 99  ? -8.969  -13.664 -25.550 1.00 54.72 ? 99  SER B H    1 
ATOM 2922 H HA   . SER B 1 99  ? -7.117  -15.482 -24.861 1.00 54.72 ? 99  SER B HA   1 
ATOM 2923 H HB2  . SER B 1 99  ? -6.871  -12.792 -25.674 1.00 54.72 ? 99  SER B HB2  1 
ATOM 2924 H HB3  . SER B 1 99  ? -5.617  -13.611 -25.147 1.00 54.72 ? 99  SER B HB3  1 
ATOM 2925 H HG   . SER B 1 99  ? -5.770  -13.712 -27.333 1.00 54.72 ? 99  SER B HG   1 
ATOM 2926 N N    . ARG B 1 100 ? -8.106  -13.236 -22.857 1.00 77.82 ? 100 ARG B N    1 
ATOM 2927 C CA   . ARG B 1 100 ? -7.973  -12.664 -21.525 1.00 75.40 ? 100 ARG B CA   1 
ATOM 2928 C C    . ARG B 1 100 ? -8.679  -13.513 -20.470 1.00 71.25 ? 100 ARG B C    1 
ATOM 2929 O O    . ARG B 1 100 ? -9.904  -13.640 -20.479 1.00 70.10 ? 100 ARG B O    1 
ATOM 2930 C CB   . ARG B 1 100 ? -8.510  -11.232 -21.525 1.00 76.85 ? 100 ARG B CB   1 
ATOM 2931 C CG   . ARG B 1 100 ? -7.785  -10.335 -22.514 1.00 81.39 ? 100 ARG B CG   1 
ATOM 2932 C CD   . ARG B 1 100 ? -8.257  -8.891  -22.429 1.00 83.17 ? 100 ARG B CD   1 
ATOM 2933 N NE   . ARG B 1 100 ? -8.067  -8.312  -21.095 1.00 81.47 ? 100 ARG B NE   1 
ATOM 2934 C CZ   . ARG B 1 100 ? -9.019  -8.187  -20.170 1.00 78.73 ? 100 ARG B CZ   1 
ATOM 2935 N NH1  . ARG B 1 100 ? -10.263 -8.600  -20.398 1.00 77.23 ? 100 ARG B NH1  1 
ATOM 2936 N NH2  . ARG B 1 100 ? -8.727  -7.645  -18.995 1.00 77.89 ? 100 ARG B NH2  1 
ATOM 2937 H H    . ARG B 1 100 ? -8.748  -12.901 -23.321 1.00 54.72 ? 100 ARG B H    1 
ATOM 2938 H HA   . ARG B 1 100 ? -7.031  -12.627 -21.293 1.00 54.72 ? 100 ARG B HA   1 
ATOM 2939 H HB2  . ARG B 1 100 ? -9.450  -11.247 -21.766 1.00 54.72 ? 100 ARG B HB2  1 
ATOM 2940 H HB3  . ARG B 1 100 ? -8.401  -10.853 -20.639 1.00 54.72 ? 100 ARG B HB3  1 
ATOM 2941 H HG2  . ARG B 1 100 ? -6.834  -10.354 -22.322 1.00 54.72 ? 100 ARG B HG2  1 
ATOM 2942 H HG3  . ARG B 1 100 ? -7.951  -10.654 -23.414 1.00 54.72 ? 100 ARG B HG3  1 
ATOM 2943 H HD2  . ARG B 1 100 ? -7.753  -8.356  -23.063 1.00 54.72 ? 100 ARG B HD2  1 
ATOM 2944 H HD3  . ARG B 1 100 ? -9.202  -8.854  -22.641 1.00 54.72 ? 100 ARG B HD3  1 
ATOM 2945 H HE   . ARG B 1 100 ? -7.280  -8.031  -20.894 1.00 54.72 ? 100 ARG B HE   1 
ATOM 2946 H HH11 . ARG B 1 100 ? -10.467 -8.953  -21.155 1.00 54.72 ? 100 ARG B HH11 1 
ATOM 2947 H HH12 . ARG B 1 100 ? -10.863 -8.511  -19.789 1.00 54.72 ? 100 ARG B HH12 1 
ATOM 2948 H HH21 . ARG B 1 100 ? -7.927  -7.374  -18.834 1.00 54.72 ? 100 ARG B HH21 1 
ATOM 2949 H HH22 . ARG B 1 100 ? -9.338  -7.563  -18.396 1.00 54.72 ? 100 ARG B HH22 1 
ATOM 2950 N N    . LEU B 1 101 ? -7.887  -14.080 -19.561 1.00 69.42 ? 101 LEU B N    1 
ATOM 2951 C CA   . LEU B 1 101 ? -8.378  -15.059 -18.597 1.00 65.93 ? 101 LEU B CA   1 
ATOM 2952 C C    . LEU B 1 101 ? -8.110  -14.672 -17.147 1.00 63.88 ? 101 LEU B C    1 
ATOM 2953 O O    . LEU B 1 101 ? -7.022  -14.206 -16.802 1.00 64.98 ? 101 LEU B O    1 
ATOM 2954 C CB   . LEU B 1 101 ? -7.738  -16.426 -18.865 1.00 65.89 ? 101 LEU B CB   1 
ATOM 2955 C CG   . LEU B 1 101 ? -7.851  -16.989 -20.283 1.00 68.45 ? 101 LEU B CG   1 
ATOM 2956 C CD1  . LEU B 1 101 ? -7.256  -18.381 -20.342 1.00 68.41 ? 101 LEU B CD1  1 
ATOM 2957 C CD2  . LEU B 1 101 ? -9.291  -17.027 -20.745 1.00 68.27 ? 101 LEU B CD2  1 
ATOM 2958 H H    . LEU B 1 101 ? -7.048  -13.909 -19.482 1.00 54.72 ? 101 LEU B H    1 
ATOM 2959 H HA   . LEU B 1 101 ? -9.337  -15.153 -18.707 1.00 54.72 ? 101 LEU B HA   1 
ATOM 2960 H HB2  . LEU B 1 101 ? -6.792  -16.360 -18.660 1.00 54.72 ? 101 LEU B HB2  1 
ATOM 2961 H HB3  . LEU B 1 101 ? -8.148  -17.072 -18.269 1.00 54.72 ? 101 LEU B HB3  1 
ATOM 2962 H HG   . LEU B 1 101 ? -7.353  -16.421 -20.892 1.00 54.72 ? 101 LEU B HG   1 
ATOM 2963 H HD11 . LEU B 1 101 ? -7.337  -18.720 -21.248 1.00 54.72 ? 101 LEU B HD11 1 
ATOM 2964 H HD12 . LEU B 1 101 ? -6.321  -18.336 -20.088 1.00 54.72 ? 101 LEU B HD12 1 
ATOM 2965 H HD13 . LEU B 1 101 ? -7.739  -18.957 -19.729 1.00 54.72 ? 101 LEU B HD13 1 
ATOM 2966 H HD21 . LEU B 1 101 ? -9.325  -17.388 -21.644 1.00 54.72 ? 101 LEU B HD21 1 
ATOM 2967 H HD22 . LEU B 1 101 ? -9.801  -17.591 -20.142 1.00 54.72 ? 101 LEU B HD22 1 
ATOM 2968 H HD23 . LEU B 1 101 ? -9.649  -16.126 -20.736 1.00 54.72 ? 101 LEU B HD23 1 
ATOM 2969 N N    . ALA B 1 102 ? -9.123  -14.869 -16.311 1.00 61.61 ? 102 ALA B N    1 
ATOM 2970 C CA   . ALA B 1 102 ? -8.948  -14.906 -14.867 1.00 59.49 ? 102 ALA B CA   1 
ATOM 2971 C C    . ALA B 1 102 ? -8.948  -16.366 -14.447 1.00 57.46 ? 102 ALA B C    1 
ATOM 2972 O O    . ALA B 1 102 ? -9.764  -17.152 -14.931 1.00 56.93 ? 102 ALA B O    1 
ATOM 2973 C CB   . ALA B 1 102 ? -10.053 -14.138 -14.156 1.00 60.50 ? 102 ALA B CB   1 
ATOM 2974 H H    . ALA B 1 102 ? -9.937  -14.987 -16.562 1.00 54.72 ? 102 ALA B H    1 
ATOM 2975 H HA   . ALA B 1 102 ? -8.093  -14.514 -14.631 1.00 54.72 ? 102 ALA B HA   1 
ATOM 2976 H HB1  . ALA B 1 102 ? -9.903  -14.184 -13.199 1.00 54.72 ? 102 ALA B HB1  1 
ATOM 2977 H HB2  . ALA B 1 102 ? -10.033 -13.213 -14.450 1.00 54.72 ? 102 ALA B HB2  1 
ATOM 2978 H HB3  . ALA B 1 102 ? -10.908 -14.538 -14.377 1.00 54.72 ? 102 ALA B HB3  1 
ATOM 2979 N N    . SER B 1 103 ? -8.031  -16.728 -13.555 1.00 56.46 ? 103 SER B N    1 
ATOM 2980 C CA   . SER B 1 103 ? -7.925  -18.108 -13.097 1.00 54.92 ? 103 SER B CA   1 
ATOM 2981 C C    . SER B 1 103 ? -7.839  -18.194 -11.584 1.00 53.19 ? 103 SER B C    1 
ATOM 2982 O O    . SER B 1 103 ? -7.595  -17.203 -10.893 1.00 53.53 ? 103 SER B O    1 
ATOM 2983 C CB   . SER B 1 103 ? -6.707  -18.801 -13.720 1.00 56.53 ? 103 SER B CB   1 
ATOM 2984 O OG   . SER B 1 103 ? -5.489  -18.299 -13.200 1.00 57.59 ? 103 SER B OG   1 
ATOM 2985 H H    . SER B 1 103 ? -7.459  -16.194 -13.200 1.00 54.72 ? 103 SER B H    1 
ATOM 2986 H HA   . SER B 1 103 ? -8.717  -18.592 -13.378 1.00 54.72 ? 103 SER B HA   1 
ATOM 2987 H HB2  . SER B 1 103 ? -6.759  -19.751 -13.531 1.00 54.72 ? 103 SER B HB2  1 
ATOM 2988 H HB3  . SER B 1 103 ? -6.721  -18.655 -14.679 1.00 54.72 ? 103 SER B HB3  1 
ATOM 2989 H HG   . SER B 1 103 ? -4.839  -18.694 -13.557 1.00 54.72 ? 103 SER B HG   1 
ATOM 2990 N N    . GLY B 1 104 ? -8.050  -19.407 -11.092 1.00 54.08 ? 104 GLY B N    1 
ATOM 2991 C CA   . GLY B 1 104 ? -8.021  -19.701 -9.674  1.00 52.67 ? 104 GLY B CA   1 
ATOM 2992 C C    . GLY B 1 104 ? -7.988  -21.204 -9.488  1.00 51.97 ? 104 GLY B C    1 
ATOM 2993 O O    . GLY B 1 104 ? -8.958  -21.893 -9.803  1.00 51.37 ? 104 GLY B O    1 
ATOM 2994 H H    . GLY B 1 104 ? -8.218  -20.096 -11.578 1.00 54.72 ? 104 GLY B H    1 
ATOM 2995 H HA2  . GLY B 1 104 ? -7.231  -19.311 -9.268  1.00 54.72 ? 104 GLY B HA2  1 
ATOM 2996 H HA3  . GLY B 1 104 ? -8.812  -19.343 -9.242  1.00 54.72 ? 104 GLY B HA3  1 
ATOM 2997 N N    . VAL B 1 105 ? -6.871  -21.720 -8.987  1.00 50.14 ? 105 VAL B N    1 
ATOM 2998 C CA   . VAL B 1 105 ? -6.714  -23.160 -8.844  1.00 50.00 ? 105 VAL B CA   1 
ATOM 2999 C C    . VAL B 1 105 ? -7.680  -23.687 -7.789  1.00 48.41 ? 105 VAL B C    1 
ATOM 3000 O O    . VAL B 1 105 ? -7.801  -23.124 -6.701  1.00 47.70 ? 105 VAL B O    1 
ATOM 3001 C CB   . VAL B 1 105 ? -5.272  -23.542 -8.471  1.00 51.26 ? 105 VAL B CB   1 
ATOM 3002 C CG1  . VAL B 1 105 ? -5.159  -25.044 -8.230  1.00 51.38 ? 105 VAL B CG1  1 
ATOM 3003 C CG2  . VAL B 1 105 ? -4.313  -23.112 -9.572  1.00 53.35 ? 105 VAL B CG2  1 
ATOM 3004 H H    . VAL B 1 105 ? -6.193  -21.260 -8.724  1.00 54.72 ? 105 VAL B H    1 
ATOM 3005 H HA   . VAL B 1 105 ? -6.929  -23.586 -9.688  1.00 54.72 ? 105 VAL B HA   1 
ATOM 3006 H HB   . VAL B 1 105 ? -5.021  -23.084 -7.653  1.00 54.72 ? 105 VAL B HB   1 
ATOM 3007 H HG11 . VAL B 1 105 ? -4.242  -25.258 -7.997  1.00 54.72 ? 105 VAL B HG11 1 
ATOM 3008 H HG12 . VAL B 1 105 ? -5.752  -25.293 -7.504  1.00 54.72 ? 105 VAL B HG12 1 
ATOM 3009 H HG13 . VAL B 1 105 ? -5.413  -25.513 -9.041  1.00 54.72 ? 105 VAL B HG13 1 
ATOM 3010 H HG21 . VAL B 1 105 ? -3.410  -23.361 -9.320  1.00 54.72 ? 105 VAL B HG21 1 
ATOM 3011 H HG22 . VAL B 1 105 ? -4.561  -23.557 -10.398 1.00 54.72 ? 105 VAL B HG22 1 
ATOM 3012 H HG23 . VAL B 1 105 ? -4.372  -22.150 -9.684  1.00 54.72 ? 105 VAL B HG23 1 
ATOM 3013 N N    . ILE B 1 106 ? -8.369  -24.769 -8.129  1.00 50.89 ? 106 ILE B N    1 
ATOM 3014 C CA   . ILE B 1 106 ? -9.355  -25.362 -7.237  1.00 49.89 ? 106 ILE B CA   1 
ATOM 3015 C C    . ILE B 1 106 ? -8.659  -26.047 -6.069  1.00 49.94 ? 106 ILE B C    1 
ATOM 3016 O O    . ILE B 1 106 ? -7.923  -27.019 -6.255  1.00 50.98 ? 106 ILE B O    1 
ATOM 3017 C CB   . ILE B 1 106 ? -10.249 -26.372 -7.987  1.00 50.47 ? 106 ILE B CB   1 
ATOM 3018 C CG1  . ILE B 1 106 ? -11.064 -25.646 -9.059  1.00 50.70 ? 106 ILE B CG1  1 
ATOM 3019 C CG2  . ILE B 1 106 ? -11.194 -27.094 -7.023  1.00 49.99 ? 106 ILE B CG2  1 
ATOM 3020 C CD1  . ILE B 1 106 ? -11.733 -26.562 -10.058 1.00 52.09 ? 106 ILE B CD1  1 
ATOM 3021 H H    . ILE B 1 106 ? -8.282  -25.183 -8.878  1.00 54.72 ? 106 ILE B H    1 
ATOM 3022 H HA   . ILE B 1 106 ? -9.923  -24.662 -6.882  1.00 54.72 ? 106 ILE B HA   1 
ATOM 3023 H HB   . ILE B 1 106 ? -9.683  -27.030 -8.419  1.00 54.72 ? 106 ILE B HB   1 
ATOM 3024 H HG12 . ILE B 1 106 ? -11.759 -25.128 -8.623  1.00 54.72 ? 106 ILE B HG12 1 
ATOM 3025 H HG13 . ILE B 1 106 ? -10.474 -25.054 -9.551  1.00 54.72 ? 106 ILE B HG13 1 
ATOM 3026 H HG21 . ILE B 1 106 ? -11.740 -27.719 -7.526  1.00 54.72 ? 106 ILE B HG21 1 
ATOM 3027 H HG22 . ILE B 1 106 ? -10.667 -27.571 -6.363  1.00 54.72 ? 106 ILE B HG22 1 
ATOM 3028 H HG23 . ILE B 1 106 ? -11.759 -26.438 -6.586  1.00 54.72 ? 106 ILE B HG23 1 
ATOM 3029 H HD11 . ILE B 1 106 ? -12.226 -26.024 -10.698 1.00 54.72 ? 106 ILE B HD11 1 
ATOM 3030 H HD12 . ILE B 1 106 ? -11.053 -27.080 -10.515 1.00 54.72 ? 106 ILE B HD12 1 
ATOM 3031 H HD13 . ILE B 1 106 ? -12.340 -27.154 -9.586  1.00 54.72 ? 106 ILE B HD13 1 
ATOM 3032 N N    . GLY B 1 107 ? -8.895  -25.524 -4.870  1.00 48.28 ? 107 GLY B N    1 
ATOM 3033 C CA   . GLY B 1 107 ? -8.317  -26.071 -3.657  1.00 48.60 ? 107 GLY B CA   1 
ATOM 3034 C C    . GLY B 1 107 ? -9.350  -26.864 -2.885  1.00 48.29 ? 107 GLY B C    1 
ATOM 3035 O O    . GLY B 1 107 ? -10.536 -26.829 -3.211  1.00 47.80 ? 107 GLY B O    1 
ATOM 3036 H H    . GLY B 1 107 ? -9.396  -24.838 -4.734  1.00 54.72 ? 107 GLY B H    1 
ATOM 3037 H HA2  . GLY B 1 107 ? -7.576  -26.656 -3.880  1.00 54.72 ? 107 GLY B HA2  1 
ATOM 3038 H HA3  . GLY B 1 107 ? -7.990  -25.352 -3.094  1.00 54.72 ? 107 GLY B HA3  1 
ATOM 3039 N N    . ILE B 1 108 ? -8.898  -27.581 -1.862  1.00 47.93 ? 108 ILE B N    1 
ATOM 3040 C CA   . ILE B 1 108 ? -9.792  -28.364 -1.021  1.00 48.15 ? 108 ILE B CA   1 
ATOM 3041 C C    . ILE B 1 108 ? -10.230 -27.519 0.170   1.00 47.84 ? 108 ILE B C    1 
ATOM 3042 O O    . ILE B 1 108 ? -9.432  -26.766 0.731   1.00 48.10 ? 108 ILE B O    1 
ATOM 3043 C CB   . ILE B 1 108 ? -9.122  -29.659 -0.523  1.00 48.91 ? 108 ILE B CB   1 
ATOM 3044 C CG1  . ILE B 1 108 ? -8.543  -30.452 -1.696  1.00 49.73 ? 108 ILE B CG1  1 
ATOM 3045 C CG2  . ILE B 1 108 ? -10.130 -30.521 0.222   1.00 49.56 ? 108 ILE B CG2  1 
ATOM 3046 C CD1  . ILE B 1 108 ? -7.557  -31.521 -1.285  1.00 51.46 ? 108 ILE B CD1  1 
ATOM 3047 H H    . ILE B 1 108 ? -8.070  -27.630 -1.633  1.00 54.72 ? 108 ILE B H    1 
ATOM 3048 H HA   . ILE B 1 108 ? -10.581 -28.606 -1.530  1.00 54.72 ? 108 ILE B HA   1 
ATOM 3049 H HB   . ILE B 1 108 ? -8.401  -29.425 0.083   1.00 54.72 ? 108 ILE B HB   1 
ATOM 3050 H HG12 . ILE B 1 108 ? -9.271  -30.886 -2.169  1.00 54.72 ? 108 ILE B HG12 1 
ATOM 3051 H HG13 . ILE B 1 108 ? -8.085  -29.839 -2.292  1.00 54.72 ? 108 ILE B HG13 1 
ATOM 3052 H HG21 . ILE B 1 108 ? -9.689  -31.329 0.527   1.00 54.72 ? 108 ILE B HG21 1 
ATOM 3053 H HG22 . ILE B 1 108 ? -10.471 -30.023 0.981   1.00 54.72 ? 108 ILE B HG22 1 
ATOM 3054 H HG23 . ILE B 1 108 ? -10.857 -30.747 -0.379  1.00 54.72 ? 108 ILE B HG23 1 
ATOM 3055 H HD11 . ILE B 1 108 ? -7.237  -31.977 -2.080  1.00 54.72 ? 108 ILE B HD11 1 
ATOM 3056 H HD12 . ILE B 1 108 ? -6.815  -31.103 -0.821  1.00 54.72 ? 108 ILE B HD12 1 
ATOM 3057 H HD13 . ILE B 1 108 ? -8.002  -32.152 -0.698  1.00 54.72 ? 108 ILE B HD13 1 
ATOM 3058 N N    . ALA B 1 109 ? -11.495 -27.656 0.553   1.00 49.70 ? 109 ALA B N    1 
ATOM 3059 C CA   . ALA B 1 109 ? -12.078 -26.833 1.605   1.00 49.78 ? 109 ALA B CA   1 
ATOM 3060 C C    . ALA B 1 109 ? -12.082 -27.581 2.930   1.00 51.09 ? 109 ALA B C    1 
ATOM 3061 O O    . ALA B 1 109 ? -11.310 -27.268 3.838   1.00 51.85 ? 109 ALA B O    1 
ATOM 3062 C CB   . ALA B 1 109 ? -13.490 -26.421 1.231   1.00 50.12 ? 109 ALA B CB   1 
ATOM 3063 H H    . ALA B 1 109 ? -12.043 -28.226 0.214   1.00 54.72 ? 109 ALA B H    1 
ATOM 3064 H HA   . ALA B 1 109 ? -11.547 -26.028 1.713   1.00 54.72 ? 109 ALA B HA   1 
ATOM 3065 H HB1  . ALA B 1 109 ? -13.859 -25.876 1.943   1.00 54.72 ? 109 ALA B HB1  1 
ATOM 3066 H HB2  . ALA B 1 109 ? -13.461 -25.913 0.405   1.00 54.72 ? 109 ALA B HB2  1 
ATOM 3067 H HB3  . ALA B 1 109 ? -14.029 -27.219 1.111   1.00 54.72 ? 109 ALA B HB3  1 
ATOM 3068 N N    . GLN B 1 110 ? -12.958 -28.575 3.027   1.00 53.37 ? 110 GLN B N    1 
ATOM 3069 C CA   . GLN B 1 110 ? -13.100 -29.354 4.248   1.00 55.03 ? 110 GLN B CA   1 
ATOM 3070 C C    . GLN B 1 110 ? -13.832 -30.674 3.996   1.00 56.13 ? 110 GLN B C    1 
ATOM 3071 O O    . GLN B 1 110 ? -14.945 -30.896 4.479   1.00 57.18 ? 110 GLN B O    1 
ATOM 3072 C CB   . GLN B 1 110 ? -13.841 -28.533 5.307   1.00 54.99 ? 110 GLN B CB   1 
ATOM 3073 C CG   . GLN B 1 110 ? -13.953 -29.227 6.667   1.00 57.15 ? 110 GLN B CG   1 
ATOM 3074 C CD   . GLN B 1 110 ? -13.231 -28.499 7.800   1.00 58.14 ? 110 GLN B CD   1 
ATOM 3075 O OE1  . GLN B 1 110 ? -12.860 -27.330 7.680   1.00 57.39 ? 110 GLN B OE1  1 
ATOM 3076 N NE2  . GLN B 1 110 ? -13.038 -29.197 8.916   1.00 60.29 ? 110 GLN B NE2  1 
ATOM 3077 O OXT  . GLN B 1 110 ? -13.321 -31.555 3.302   1.00 55.76 ? 110 GLN B OXT  1 
ATOM 3078 H H    . GLN B 1 110 ? -13.486 -28.820 2.393   1.00 54.72 ? 110 GLN B H    1 
ATOM 3079 H HA   . GLN B 1 110 ? -12.218 -29.562 4.594   1.00 54.72 ? 110 GLN B HA   1 
ATOM 3080 H HB2  . GLN B 1 110 ? -13.368 -27.696 5.440   1.00 54.72 ? 110 GLN B HB2  1 
ATOM 3081 H HB3  . GLN B 1 110 ? -14.740 -28.355 4.990   1.00 54.72 ? 110 GLN B HB3  1 
ATOM 3082 H HG2  . GLN B 1 110 ? -14.891 -29.291 6.907   1.00 54.72 ? 110 GLN B HG2  1 
ATOM 3083 H HG3  . GLN B 1 110 ? -13.572 -30.116 6.596   1.00 54.72 ? 110 GLN B HG3  1 
ATOM 3084 H HE21 . GLN B 1 110 ? -13.316 -30.010 8.968   1.00 54.72 ? 110 GLN B HE21 1 
ATOM 3085 H HE22 . GLN B 1 110 ? -12.637 -28.836 9.585   1.00 54.72 ? 110 GLN B HE22 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   ALA 1   1   1   ALA ALA A . n 
A 1 2   THR 2   2   2   THR THR A . n 
A 1 3   LYS 3   3   3   LYS LYS A . n 
A 1 4   ALA 4   4   4   ALA ALA A . n 
A 1 5   VAL 5   5   5   VAL VAL A . n 
A 1 6   ALA 6   6   6   ALA ALA A . n 
A 1 7   VAL 7   7   7   VAL VAL A . n 
A 1 8   LEU 8   8   8   LEU LEU A . n 
A 1 9   LYS 9   9   9   LYS LYS A . n 
A 1 10  GLY 10  10  10  GLY GLY A . n 
A 1 11  ASP 11  11  11  ASP ASP A . n 
A 1 12  GLY 12  12  12  GLY GLY A . n 
A 1 13  PRO 13  13  13  PRO PRO A . n 
A 1 14  VAL 14  14  14  VAL VAL A . n 
A 1 15  GLN 15  15  15  GLN GLN A . n 
A 1 16  GLY 16  16  16  GLY GLY A . n 
A 1 17  ILE 17  17  17  ILE ILE A . n 
A 1 18  ILE 18  18  18  ILE ILE A . n 
A 1 19  ASN 19  19  19  ASN ASN A . n 
A 1 20  PHE 20  20  20  PHE PHE A . n 
A 1 21  GLU 21  21  21  GLU GLU A . n 
A 1 22  GLN 22  22  22  GLN GLN A . n 
A 1 23  LYS 23  23  23  LYS LYS A . n 
A 1 24  GLU 24  24  24  GLU GLU A . n 
A 1 25  SER 25  25  25  SER SER A . n 
A 1 26  ASN 26  26  26  ASN ASN A . n 
A 1 27  GLY 27  27  27  GLY GLY A . n 
A 1 28  PRO 28  28  28  PRO PRO A . n 
A 1 29  VAL 29  29  29  VAL VAL A . n 
A 1 30  LYS 30  30  30  LYS LYS A . n 
A 1 31  VAL 31  31  31  VAL VAL A . n 
A 1 32  TRP 32  32  32  TRP TRP A . n 
A 1 33  GLY 33  33  33  GLY GLY A . n 
A 1 34  SER 34  34  34  SER SER A . n 
A 1 35  ALA 35  35  35  ALA ALA A . n 
A 1 36  LYS 36  36  36  LYS LYS A . n 
A 1 37  GLY 37  37  37  GLY GLY A . n 
A 1 38  LEU 38  38  38  LEU LEU A . n 
A 1 39  THR 39  39  39  THR THR A . n 
A 1 40  GLU 40  40  40  GLU GLU A . n 
A 1 41  GLY 41  41  41  GLY GLY A . n 
A 1 42  LEU 42  42  42  LEU LEU A . n 
A 1 43  HIS 43  43  43  HIS HIS A . n 
A 1 44  GLY 44  44  44  GLY GLY A . n 
A 1 45  PHE 45  45  45  PHE PHE A . n 
A 1 46  HIS 46  46  46  HIS HIS A . n 
A 1 47  VAL 47  47  47  VAL VAL A . n 
A 1 48  HIS 48  48  48  HIS HIS A . n 
A 1 49  GLY 49  49  49  GLY GLY A . n 
A 1 50  ALA 50  50  50  ALA ALA A . n 
A 1 51  GLY 51  51  51  GLY GLY A . n 
A 1 52  GLY 52  52  52  GLY GLY A . n 
A 1 53  ASP 53  53  53  ASP ASP A . n 
A 1 54  LEU 54  54  54  LEU LEU A . n 
A 1 55  GLY 55  55  55  GLY GLY A . n 
A 1 56  ASN 56  56  56  ASN ASN A . n 
A 1 57  VAL 57  57  57  VAL VAL A . n 
A 1 58  THR 58  58  58  THR THR A . n 
A 1 59  ALA 59  59  59  ALA ALA A . n 
A 1 60  ASP 60  60  60  ASP ASP A . n 
A 1 61  LYS 61  61  61  LYS LYS A . n 
A 1 62  ASP 62  62  62  ASP ASP A . n 
A 1 63  GLY 63  63  63  GLY GLY A . n 
A 1 64  VAL 64  64  64  VAL VAL A . n 
A 1 65  ALA 65  65  65  ALA ALA A . n 
A 1 66  ASP 66  66  66  ASP ASP A . n 
A 1 67  VAL 67  67  67  VAL VAL A . n 
A 1 68  SER 68  68  68  SER SER A . n 
A 1 69  ILE 69  69  69  ILE ILE A . n 
A 1 70  GLU 70  70  70  GLU GLU A . n 
A 1 71  ASP 71  71  71  ASP ASP A . n 
A 1 72  SER 72  72  72  SER SER A . n 
A 1 73  VAL 73  73  73  VAL VAL A . n 
A 1 74  ILE 74  74  74  ILE ILE A . n 
A 1 75  SER 75  75  75  SER SER A . n 
A 1 76  LEU 76  76  76  LEU LEU A . n 
A 1 77  SER 77  77  77  SER SER A . n 
A 1 78  GLY 78  78  78  GLY GLY A . n 
A 1 79  ASP 79  79  79  ASP ASP A . n 
A 1 80  HIS 80  80  80  HIS HIS A . n 
A 1 81  SER 81  81  81  SER SER A . n 
A 1 82  ILE 82  82  82  ILE ILE A . n 
A 1 83  ILE 83  83  83  ILE ILE A . n 
A 1 84  GLY 84  84  84  GLY GLY A . n 
A 1 85  ARG 85  85  85  ARG ARG A . n 
A 1 86  THR 86  86  86  THR THR A . n 
A 1 87  LEU 87  87  87  LEU LEU A . n 
A 1 88  VAL 88  88  88  VAL VAL A . n 
A 1 89  VAL 89  89  89  VAL VAL A . n 
A 1 90  HIS 90  90  90  HIS HIS A . n 
A 1 91  GLU 91  91  91  GLU GLU A . n 
A 1 92  LYS 92  92  92  LYS LYS A . n 
A 1 93  ALA 93  93  93  ALA ALA A . n 
A 1 94  GLY 94  94  94  GLY GLY A . n 
A 1 95  ALA 95  95  95  ALA ALA A . n 
A 1 96  GLY 96  96  96  GLY GLY A . n 
A 1 97  ALA 97  97  97  ALA ALA A . n 
A 1 98  GLY 98  98  98  GLY GLY A . n 
A 1 99  SER 99  99  99  SER SER A . n 
A 1 100 ARG 100 100 100 ARG ARG A . n 
A 1 101 LEU 101 101 101 LEU LEU A . n 
A 1 102 ALA 102 102 102 ALA ALA A . n 
A 1 103 SER 103 103 103 SER SER A . n 
A 1 104 GLY 104 104 104 GLY GLY A . n 
A 1 105 VAL 105 105 105 VAL VAL A . n 
A 1 106 ILE 106 106 106 ILE ILE A . n 
A 1 107 GLY 107 107 107 GLY GLY A . n 
A 1 108 ILE 108 108 108 ILE ILE A . n 
A 1 109 ALA 109 109 109 ALA ALA A . n 
A 1 110 GLN 110 110 110 GLN GLN A . n 
B 1 1   ALA 1   1   1   ALA ALA B . n 
B 1 2   THR 2   2   2   THR THR B . n 
B 1 3   LYS 3   3   3   LYS LYS B . n 
B 1 4   ALA 4   4   4   ALA ALA B . n 
B 1 5   VAL 5   5   5   VAL VAL B . n 
B 1 6   ALA 6   6   6   ALA ALA B . n 
B 1 7   VAL 7   7   7   VAL VAL B . n 
B 1 8   LEU 8   8   8   LEU LEU B . n 
B 1 9   LYS 9   9   9   LYS LYS B . n 
B 1 10  GLY 10  10  10  GLY GLY B . n 
B 1 11  ASP 11  11  11  ASP ASP B . n 
B 1 12  GLY 12  12  12  GLY GLY B . n 
B 1 13  PRO 13  13  13  PRO PRO B . n 
B 1 14  VAL 14  14  14  VAL VAL B . n 
B 1 15  GLN 15  15  15  GLN GLN B . n 
B 1 16  GLY 16  16  16  GLY GLY B . n 
B 1 17  ILE 17  17  17  ILE ILE B . n 
B 1 18  ILE 18  18  18  ILE ILE B . n 
B 1 19  ASN 19  19  19  ASN ASN B . n 
B 1 20  PHE 20  20  20  PHE PHE B . n 
B 1 21  GLU 21  21  21  GLU GLU B . n 
B 1 22  GLN 22  22  22  GLN GLN B . n 
B 1 23  LYS 23  23  23  LYS LYS B . n 
B 1 24  GLU 24  24  24  GLU GLU B . n 
B 1 25  SER 25  25  25  SER SER B . n 
B 1 26  ASN 26  26  26  ASN ASN B . n 
B 1 27  GLY 27  27  27  GLY GLY B . n 
B 1 28  PRO 28  28  28  PRO PRO B . n 
B 1 29  VAL 29  29  29  VAL VAL B . n 
B 1 30  LYS 30  30  30  LYS LYS B . n 
B 1 31  VAL 31  31  31  VAL VAL B . n 
B 1 32  TRP 32  32  32  TRP TRP B . n 
B 1 33  GLY 33  33  33  GLY GLY B . n 
B 1 34  SER 34  34  34  SER SER B . n 
B 1 35  ALA 35  35  35  ALA ALA B . n 
B 1 36  LYS 36  36  36  LYS LYS B . n 
B 1 37  GLY 37  37  37  GLY GLY B . n 
B 1 38  LEU 38  38  38  LEU LEU B . n 
B 1 39  THR 39  39  39  THR THR B . n 
B 1 40  GLU 40  40  40  GLU GLU B . n 
B 1 41  GLY 41  41  41  GLY GLY B . n 
B 1 42  LEU 42  42  42  LEU LEU B . n 
B 1 43  HIS 43  43  43  HIS HIS B . n 
B 1 44  GLY 44  44  44  GLY GLY B . n 
B 1 45  PHE 45  45  45  PHE PHE B . n 
B 1 46  HIS 46  46  46  HIS HIS B . n 
B 1 47  VAL 47  47  47  VAL VAL B . n 
B 1 48  HIS 48  48  48  HIS HIS B . n 
B 1 49  GLY 49  49  49  GLY GLY B . n 
B 1 50  ALA 50  50  50  ALA ALA B . n 
B 1 51  GLY 51  51  51  GLY GLY B . n 
B 1 52  GLY 52  52  52  GLY GLY B . n 
B 1 53  ASP 53  53  53  ASP ASP B . n 
B 1 54  LEU 54  54  54  LEU LEU B . n 
B 1 55  GLY 55  55  55  GLY GLY B . n 
B 1 56  ASN 56  56  56  ASN ASN B . n 
B 1 57  VAL 57  57  57  VAL VAL B . n 
B 1 58  THR 58  58  58  THR THR B . n 
B 1 59  ALA 59  59  59  ALA ALA B . n 
B 1 60  ASP 60  60  60  ASP ASP B . n 
B 1 61  LYS 61  61  61  LYS LYS B . n 
B 1 62  ASP 62  62  62  ASP ASP B . n 
B 1 63  GLY 63  63  63  GLY GLY B . n 
B 1 64  VAL 64  64  64  VAL VAL B . n 
B 1 65  ALA 65  65  65  ALA ALA B . n 
B 1 66  ASP 66  66  66  ASP ASP B . n 
B 1 67  VAL 67  67  67  VAL VAL B . n 
B 1 68  SER 68  68  68  SER SER B . n 
B 1 69  ILE 69  69  69  ILE ILE B . n 
B 1 70  GLU 70  70  70  GLU GLU B . n 
B 1 71  ASP 71  71  71  ASP ASP B . n 
B 1 72  SER 72  72  72  SER SER B . n 
B 1 73  VAL 73  73  73  VAL VAL B . n 
B 1 74  ILE 74  74  74  ILE ILE B . n 
B 1 75  SER 75  75  75  SER SER B . n 
B 1 76  LEU 76  76  76  LEU LEU B . n 
B 1 77  SER 77  77  77  SER SER B . n 
B 1 78  GLY 78  78  78  GLY GLY B . n 
B 1 79  ASP 79  79  79  ASP ASP B . n 
B 1 80  HIS 80  80  80  HIS HIS B . n 
B 1 81  SER 81  81  81  SER SER B . n 
B 1 82  ILE 82  82  82  ILE ILE B . n 
B 1 83  ILE 83  83  83  ILE ILE B . n 
B 1 84  GLY 84  84  84  GLY GLY B . n 
B 1 85  ARG 85  85  85  ARG ARG B . n 
B 1 86  THR 86  86  86  THR THR B . n 
B 1 87  LEU 87  87  87  LEU LEU B . n 
B 1 88  VAL 88  88  88  VAL VAL B . n 
B 1 89  VAL 89  89  89  VAL VAL B . n 
B 1 90  HIS 90  90  90  HIS HIS B . n 
B 1 91  GLU 91  91  91  GLU GLU B . n 
B 1 92  LYS 92  92  92  LYS LYS B . n 
B 1 93  ALA 93  93  93  ALA ALA B . n 
B 1 94  GLY 94  94  94  GLY GLY B . n 
B 1 95  ALA 95  95  95  ALA ALA B . n 
B 1 96  GLY 96  96  96  GLY GLY B . n 
B 1 97  ALA 97  97  97  ALA ALA B . n 
B 1 98  GLY 98  98  98  GLY GLY B . n 
B 1 99  SER 99  99  99  SER SER B . n 
B 1 100 ARG 100 100 100 ARG ARG B . n 
B 1 101 LEU 101 101 101 LEU LEU B . n 
B 1 102 ALA 102 102 102 ALA ALA B . n 
B 1 103 SER 103 103 103 SER SER B . n 
B 1 104 GLY 104 104 104 GLY GLY B . n 
B 1 105 VAL 105 105 105 VAL VAL B . n 
B 1 106 ILE 106 106 106 ILE ILE B . n 
B 1 107 GLY 107 107 107 GLY GLY B . n 
B 1 108 ILE 108 108 108 ILE ILE B . n 
B 1 109 ALA 109 109 109 ALA ALA B . n 
B 1 110 GLN 110 110 110 GLN GLN B . n 
# 
loop_
_pdbx_struct_assembly.id 
_pdbx_struct_assembly.details 
_pdbx_struct_assembly.method_details 
_pdbx_struct_assembly.oligomeric_details 
_pdbx_struct_assembly.oligomeric_count 
1 author_and_software_defined_assembly ? monomeric 1 
2 author_and_software_defined_assembly ? monomeric 1 
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 1 A 
2 1 B 
# 
_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_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2016-01-20 
2 'Structure model' 1 1 2018-01-17 
3 'Structure model' 1 2 2018-11-28 
# 
_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         ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Data collection'     
2 3 'Structure model' 'Data collection'     
3 3 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' diffrn_source   
2 3 'Structure model' citation        
3 3 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1  2 'Structure model' '_diffrn_source.pdbx_synchrotron_site' 
2  3 'Structure model' '_citation.country'                    
3  3 'Structure model' '_citation.journal_abbrev'             
4  3 'Structure model' '_citation.journal_id_ASTM'            
5  3 'Structure model' '_citation.journal_id_CSD'             
6  3 'Structure model' '_citation.journal_id_ISSN'            
7  3 'Structure model' '_citation.journal_volume'             
8  3 'Structure model' '_citation.page_first'                 
9  3 'Structure model' '_citation.page_last'                  
10 3 'Structure model' '_citation.pdbx_database_id_DOI'       
11 3 'Structure model' '_citation.pdbx_database_id_PubMed'    
12 3 'Structure model' '_citation.title'                      
13 3 'Structure model' '_citation.year'                       
14 3 'Structure model' '_citation_author.name'                
# 
loop_
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][2] 
'X-RAY DIFFRACTION' 1 ? refined -18.6865 -17.8364 11.8354  0.6868 0.4132 0.5507 -0.0279 -0.0131 0.0457  2.2874 3.4421 6.6129 
-2.0980 1.6125  0.3200  0.0681 0.2448  -0.0000 -0.5034 -0.3838 -0.2006 0.5120  -0.1378 0.0019 
'X-RAY DIFFRACTION' 2 ? refined -16.0756 -21.9857 -12.0035 0.4730 0.8250 0.6126 0.0678  -0.0953 -0.0843 4.9135 4.1673 4.9130 
-1.7663 -0.1276 -1.6683 0.1314 -0.0803 -0.0002 0.8660  0.3175  0.4236  -0.4676 0.4801  0.0226 
# 
loop_
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.selection_details 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.selection 
'X-RAY DIFFRACTION' 1 1 A 1 A 110 'chain A' ? ? ? ? ? 
'X-RAY DIFFRACTION' 2 2 B 1 B 110 'chain B' ? ? ? ? ? 
# 
_pdbx_phasing_MR.entry_id                     4XCR 
_pdbx_phasing_MR.method_rotation              ? 
_pdbx_phasing_MR.method_translation           ? 
_pdbx_phasing_MR.model_details                ? 
_pdbx_phasing_MR.R_factor                     ? 
_pdbx_phasing_MR.R_rigid_body                 ? 
_pdbx_phasing_MR.correlation_coeff_Fo_to_Fc   ? 
_pdbx_phasing_MR.correlation_coeff_Io_to_Ic   ? 
_pdbx_phasing_MR.d_res_high_rotation          35.410 
_pdbx_phasing_MR.d_res_low_rotation           3.610 
_pdbx_phasing_MR.d_res_high_translation       ? 
_pdbx_phasing_MR.d_res_low_translation        ? 
_pdbx_phasing_MR.packing                      ? 
_pdbx_phasing_MR.reflns_percent_rotation      ? 
_pdbx_phasing_MR.reflns_percent_translation   ? 
_pdbx_phasing_MR.sigma_F_rotation             ? 
_pdbx_phasing_MR.sigma_F_translation          ? 
_pdbx_phasing_MR.sigma_I_rotation             ? 
_pdbx_phasing_MR.sigma_I_translation          ? 
# 
_phasing.method   MR 
# 
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        ? ? ? ? ? ? ? ? ? ? ? PHENIX      ? ? ? .       1 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? MOSFLM      ? ? ? .       2 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless     ? ? ? .       3 
? phasing           ? ? ? ? ? ? ? ? ? ? ? MOLREP      ? ? ? 11.0.05 4 
? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.15    5 
# 
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 SER A 68  ? ? -152.30 79.98  
2 1 HIS A 80  ? ? -86.38  48.81  
3 1 ILE A 83  ? ? -56.88  106.24 
4 1 VAL B 14  ? ? -52.35  86.68  
5 1 SER B 68  ? ? -158.82 88.59  
6 1 ALA B 109 ? ? -98.51  -72.15 
# 
loop_
_pdbx_reflns_twin.domain_id 
_pdbx_reflns_twin.crystal_id 
_pdbx_reflns_twin.diffrn_id 
_pdbx_reflns_twin.fraction 
_pdbx_reflns_twin.operator 
_pdbx_reflns_twin.type 
_pdbx_reflns_twin.mean_F_square_over_mean_F2 
_pdbx_reflns_twin.mean_I2_over_mean_I_square 
1 1 1 0.791 'H,  K,  L' ? ? ? 
2 1 1 0.209 'K,  H, -L' ? ? ? 
# 
