data_8YCV
# 
_entry.id   8YCV 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.399 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   8YCV         pdb_00008ycv 10.2210/pdb8ycv/pdb 
WWPDB D_1300045372 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2024-12-04 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8YCV 
_pdbx_database_status.recvd_initial_deposition_date   2024-02-18 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.details        
'Structure at 2.33 angstrom resolution from same dataset but isotropically processed by AIMLESS' 
_pdbx_database_related.db_id          8XZU 
_pdbx_database_related.content_type   re-refinement 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              arpita@leos.co.in 
_pdbx_contact_author.name_first         Arpita 
_pdbx_contact_author.name_last          Goswami 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-5632-1610 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Brito, J.A.' 1 0000-0002-8307-2282 
'Goswami, A.' 2 0000-0001-5632-1610 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
;HosA transcriptional regulator from enteropathogenic Escherichia coli O127:H6 (strain E2348/69) bound with 4-hydroxy benzoic acid - Conformation II at 2.16 angstrom resolution (Staraniso processed)
;
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Brito, J.A.' 1 0000-0002-8307-2282 
primary 'Goswami, A.' 2 0000-0001-5632-1610 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'Transcriptional regulator HosA' 16592.092 1  ? ? ? 'HosA protein' 
2 non-polymer syn 'P-HYDROXYBENZOIC ACID'          138.121   1  ? ? ? ?              
3 non-polymer syn 'DI(HYDROXYETHYL)ETHER'          106.120   2  ? ? ? ?              
4 water       nat water                            18.015    51 ? ? ? ?              
# 
_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       
;MALRNKAFHQLRQLFQQHTARWQHELPDLTKPQYAVMRAIADKPGIEQVALIEAAVSTKATLAEMLARMENRGLVRREHD
AADKRRRFVWLTAEGEKVLAAAIPIGDSVDEEFLGRLSAEEQELFMQLVRKMMNTLEHHHHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MALRNKAFHQLRQLFQQHTARWQHELPDLTKPQYAVMRAIADKPGIEQVALIEAAVSTKATLAEMLARMENRGLVRREHD
AADKRRRFVWLTAEGEKVLAAAIPIGDSVDEEFLGRLSAEEQELFMQLVRKMMNTLEHHHHHH
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'P-HYDROXYBENZOIC ACID' PHB 
3 'DI(HYDROXYETHYL)ETHER' PEG 
4 water                   HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   ALA n 
1 3   LEU n 
1 4   ARG n 
1 5   ASN n 
1 6   LYS n 
1 7   ALA n 
1 8   PHE n 
1 9   HIS n 
1 10  GLN n 
1 11  LEU n 
1 12  ARG n 
1 13  GLN n 
1 14  LEU n 
1 15  PHE n 
1 16  GLN n 
1 17  GLN n 
1 18  HIS n 
1 19  THR n 
1 20  ALA n 
1 21  ARG n 
1 22  TRP n 
1 23  GLN n 
1 24  HIS n 
1 25  GLU n 
1 26  LEU n 
1 27  PRO n 
1 28  ASP n 
1 29  LEU n 
1 30  THR n 
1 31  LYS n 
1 32  PRO n 
1 33  GLN n 
1 34  TYR n 
1 35  ALA n 
1 36  VAL n 
1 37  MET n 
1 38  ARG n 
1 39  ALA n 
1 40  ILE n 
1 41  ALA n 
1 42  ASP n 
1 43  LYS n 
1 44  PRO n 
1 45  GLY n 
1 46  ILE n 
1 47  GLU n 
1 48  GLN n 
1 49  VAL n 
1 50  ALA n 
1 51  LEU n 
1 52  ILE n 
1 53  GLU n 
1 54  ALA n 
1 55  ALA n 
1 56  VAL n 
1 57  SER n 
1 58  THR n 
1 59  LYS n 
1 60  ALA n 
1 61  THR n 
1 62  LEU n 
1 63  ALA n 
1 64  GLU n 
1 65  MET n 
1 66  LEU n 
1 67  ALA n 
1 68  ARG n 
1 69  MET n 
1 70  GLU n 
1 71  ASN n 
1 72  ARG n 
1 73  GLY n 
1 74  LEU n 
1 75  VAL n 
1 76  ARG n 
1 77  ARG n 
1 78  GLU n 
1 79  HIS n 
1 80  ASP n 
1 81  ALA n 
1 82  ALA n 
1 83  ASP n 
1 84  LYS n 
1 85  ARG n 
1 86  ARG n 
1 87  ARG n 
1 88  PHE n 
1 89  VAL n 
1 90  TRP n 
1 91  LEU n 
1 92  THR n 
1 93  ALA n 
1 94  GLU n 
1 95  GLY n 
1 96  GLU n 
1 97  LYS n 
1 98  VAL n 
1 99  LEU n 
1 100 ALA n 
1 101 ALA n 
1 102 ALA n 
1 103 ILE n 
1 104 PRO n 
1 105 ILE n 
1 106 GLY n 
1 107 ASP n 
1 108 SER n 
1 109 VAL n 
1 110 ASP n 
1 111 GLU n 
1 112 GLU n 
1 113 PHE n 
1 114 LEU n 
1 115 GLY n 
1 116 ARG n 
1 117 LEU n 
1 118 SER n 
1 119 ALA n 
1 120 GLU n 
1 121 GLU n 
1 122 GLN n 
1 123 GLU n 
1 124 LEU n 
1 125 PHE n 
1 126 MET n 
1 127 GLN n 
1 128 LEU n 
1 129 VAL n 
1 130 ARG n 
1 131 LYS n 
1 132 MET n 
1 133 MET n 
1 134 ASN n 
1 135 THR n 
1 136 LEU n 
1 137 GLU n 
1 138 HIS n 
1 139 HIS n 
1 140 HIS n 
1 141 HIS n 
1 142 HIS n 
1 143 HIS 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                   143 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 hosA 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    'E2348/69 / EPEC' 
_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      'Escherichia coli O127:H6 str. E2348/69' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     574521 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE                 ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE              ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'         ? 'C4 H7 N O4'     133.103 
GLN 'L-peptide linking' y GLUTAMINE               ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'         ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                 ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE               ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER                   ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE              ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE                 ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE                  ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE              ? 'C5 H11 N O2 S'  149.211 
PEG non-polymer         . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3'      106.120 
PHB non-polymer         . 'P-HYDROXYBENZOIC ACID' ? 'C7 H6 O3'       138.121 
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 
TYR 'L-peptide linking' y TYROSINE                ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE                  ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   1   ?   ?   ?   A . n 
A 1 2   ALA 2   2   2   ALA ALA A . n 
A 1 3   LEU 3   3   3   LEU LEU A . n 
A 1 4   ARG 4   4   4   ARG ARG A . n 
A 1 5   ASN 5   5   5   ASN ASN A . n 
A 1 6   LYS 6   6   6   LYS LYS A . n 
A 1 7   ALA 7   7   7   ALA ALA A . n 
A 1 8   PHE 8   8   8   PHE PHE A . n 
A 1 9   HIS 9   9   9   HIS HIS A . n 
A 1 10  GLN 10  10  10  GLN GLN A . n 
A 1 11  LEU 11  11  11  LEU LEU A . n 
A 1 12  ARG 12  12  12  ARG ARG A . n 
A 1 13  GLN 13  13  13  GLN GLN A . n 
A 1 14  LEU 14  14  14  LEU LEU A . n 
A 1 15  PHE 15  15  15  PHE PHE A . n 
A 1 16  GLN 16  16  16  GLN GLN A . n 
A 1 17  GLN 17  17  17  GLN GLN A . n 
A 1 18  HIS 18  18  18  HIS HIS A . n 
A 1 19  THR 19  19  19  THR THR A . n 
A 1 20  ALA 20  20  20  ALA ALA A . n 
A 1 21  ARG 21  21  21  ARG ARG A . n 
A 1 22  TRP 22  22  22  TRP TRP A . n 
A 1 23  GLN 23  23  23  GLN GLN A . n 
A 1 24  HIS 24  24  24  HIS HIS A . n 
A 1 25  GLU 25  25  25  GLU GLU A . n 
A 1 26  LEU 26  26  26  LEU LEU A . n 
A 1 27  PRO 27  27  27  PRO PRO A . n 
A 1 28  ASP 28  28  28  ASP ASP A . n 
A 1 29  LEU 29  29  29  LEU LEU A . n 
A 1 30  THR 30  30  30  THR THR A . n 
A 1 31  LYS 31  31  31  LYS LYS A . n 
A 1 32  PRO 32  32  32  PRO PRO A . n 
A 1 33  GLN 33  33  33  GLN GLN A . n 
A 1 34  TYR 34  34  34  TYR TYR A . n 
A 1 35  ALA 35  35  35  ALA ALA A . n 
A 1 36  VAL 36  36  36  VAL VAL A . n 
A 1 37  MET 37  37  37  MET MET A . n 
A 1 38  ARG 38  38  38  ARG ARG A . n 
A 1 39  ALA 39  39  39  ALA ALA A . n 
A 1 40  ILE 40  40  40  ILE ILE A . n 
A 1 41  ALA 41  41  41  ALA ALA A . n 
A 1 42  ASP 42  42  42  ASP ASP A . n 
A 1 43  LYS 43  43  43  LYS LYS A . n 
A 1 44  PRO 44  44  44  PRO PRO A . n 
A 1 45  GLY 45  45  45  GLY GLY A . n 
A 1 46  ILE 46  46  46  ILE ILE A . n 
A 1 47  GLU 47  47  47  GLU GLU A . n 
A 1 48  GLN 48  48  48  GLN GLN A . n 
A 1 49  VAL 49  49  49  VAL VAL A . n 
A 1 50  ALA 50  50  50  ALA ALA A . n 
A 1 51  LEU 51  51  51  LEU LEU A . n 
A 1 52  ILE 52  52  52  ILE ILE A . n 
A 1 53  GLU 53  53  53  GLU GLU A . n 
A 1 54  ALA 54  54  54  ALA ALA A . n 
A 1 55  ALA 55  55  55  ALA ALA A . n 
A 1 56  VAL 56  56  56  VAL VAL A . n 
A 1 57  SER 57  57  57  SER SER A . n 
A 1 58  THR 58  58  58  THR THR A . n 
A 1 59  LYS 59  59  59  LYS LYS A . n 
A 1 60  ALA 60  60  60  ALA ALA A . n 
A 1 61  THR 61  61  61  THR THR A . n 
A 1 62  LEU 62  62  62  LEU LEU A . n 
A 1 63  ALA 63  63  63  ALA ALA A . n 
A 1 64  GLU 64  64  64  GLU GLU A . n 
A 1 65  MET 65  65  65  MET MET A . n 
A 1 66  LEU 66  66  66  LEU LEU A . n 
A 1 67  ALA 67  67  67  ALA ALA A . n 
A 1 68  ARG 68  68  68  ARG ARG A . n 
A 1 69  MET 69  69  69  MET MET A . n 
A 1 70  GLU 70  70  70  GLU GLU A . n 
A 1 71  ASN 71  71  71  ASN ASN A . n 
A 1 72  ARG 72  72  72  ARG ARG A . n 
A 1 73  GLY 73  73  73  GLY GLY A . n 
A 1 74  LEU 74  74  74  LEU LEU A . n 
A 1 75  VAL 75  75  75  VAL VAL A . n 
A 1 76  ARG 76  76  76  ARG ARG A . n 
A 1 77  ARG 77  77  77  ARG ARG A . n 
A 1 78  GLU 78  78  78  GLU GLU A . n 
A 1 79  HIS 79  79  79  HIS HIS A . n 
A 1 80  ASP 80  80  80  ASP ASP A . n 
A 1 81  ALA 81  81  81  ALA ALA A . n 
A 1 82  ALA 82  82  82  ALA ALA A . n 
A 1 83  ASP 83  83  83  ASP ASP A . n 
A 1 84  LYS 84  84  84  LYS LYS A . n 
A 1 85  ARG 85  85  85  ARG ARG A . n 
A 1 86  ARG 86  86  86  ARG ARG A . n 
A 1 87  ARG 87  87  87  ARG ARG A . n 
A 1 88  PHE 88  88  88  PHE PHE A . n 
A 1 89  VAL 89  89  89  VAL VAL A . n 
A 1 90  TRP 90  90  90  TRP TRP A . n 
A 1 91  LEU 91  91  91  LEU LEU A . n 
A 1 92  THR 92  92  92  THR THR A . n 
A 1 93  ALA 93  93  93  ALA ALA A . n 
A 1 94  GLU 94  94  94  GLU GLU A . n 
A 1 95  GLY 95  95  95  GLY GLY A . n 
A 1 96  GLU 96  96  96  GLU GLU A . n 
A 1 97  LYS 97  97  97  LYS LYS A . n 
A 1 98  VAL 98  98  98  VAL VAL A . n 
A 1 99  LEU 99  99  99  LEU LEU A . n 
A 1 100 ALA 100 100 100 ALA ALA A . n 
A 1 101 ALA 101 101 101 ALA ALA A . n 
A 1 102 ALA 102 102 102 ALA ALA A . n 
A 1 103 ILE 103 103 103 ILE ILE A . n 
A 1 104 PRO 104 104 104 PRO PRO A . n 
A 1 105 ILE 105 105 105 ILE ILE A . n 
A 1 106 GLY 106 106 106 GLY GLY A . n 
A 1 107 ASP 107 107 107 ASP ASP A . n 
A 1 108 SER 108 108 108 SER SER A . n 
A 1 109 VAL 109 109 109 VAL VAL A . n 
A 1 110 ASP 110 110 110 ASP ASP A . n 
A 1 111 GLU 111 111 111 GLU GLU A . n 
A 1 112 GLU 112 112 112 GLU GLU A . n 
A 1 113 PHE 113 113 113 PHE PHE A . n 
A 1 114 LEU 114 114 114 LEU LEU A . n 
A 1 115 GLY 115 115 115 GLY GLY A . n 
A 1 116 ARG 116 116 116 ARG ARG A . n 
A 1 117 LEU 117 117 117 LEU LEU A . n 
A 1 118 SER 118 118 118 SER SER A . n 
A 1 119 ALA 119 119 119 ALA ALA A . n 
A 1 120 GLU 120 120 120 GLU GLU A . n 
A 1 121 GLU 121 121 121 GLU GLU A . n 
A 1 122 GLN 122 122 122 GLN GLN A . n 
A 1 123 GLU 123 123 123 GLU GLU A . n 
A 1 124 LEU 124 124 124 LEU LEU A . n 
A 1 125 PHE 125 125 125 PHE PHE A . n 
A 1 126 MET 126 126 126 MET MET A . n 
A 1 127 GLN 127 127 127 GLN GLN A . n 
A 1 128 LEU 128 128 128 LEU LEU A . n 
A 1 129 VAL 129 129 129 VAL VAL A . n 
A 1 130 ARG 130 130 130 ARG ARG A . n 
A 1 131 LYS 131 131 131 LYS LYS A . n 
A 1 132 MET 132 132 132 MET MET A . n 
A 1 133 MET 133 133 133 MET MET A . n 
A 1 134 ASN 134 134 134 ASN ASN A . n 
A 1 135 THR 135 135 ?   ?   ?   A . n 
A 1 136 LEU 136 136 ?   ?   ?   A . n 
A 1 137 GLU 137 137 ?   ?   ?   A . n 
A 1 138 HIS 138 138 ?   ?   ?   A . n 
A 1 139 HIS 139 139 ?   ?   ?   A . n 
A 1 140 HIS 140 140 ?   ?   ?   A . n 
A 1 141 HIS 141 141 ?   ?   ?   A . n 
A 1 142 HIS 142 142 ?   ?   ?   A . n 
A 1 143 HIS 143 143 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        PHB 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   PHB 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 PHB 1  1001 1001 PHB PHB A . 
C 3 PEG 1  1002 4001 PEG PEG A . 
D 3 PEG 1  1003 4002 PEG PEG A . 
E 4 HOH 1  1101 5    HOH HOH A . 
E 4 HOH 2  1102 8    HOH HOH A . 
E 4 HOH 3  1103 1    HOH HOH A . 
E 4 HOH 4  1104 6    HOH HOH A . 
E 4 HOH 5  1105 51   HOH HOH A . 
E 4 HOH 6  1106 10   HOH HOH A . 
E 4 HOH 7  1107 26   HOH HOH A . 
E 4 HOH 8  1108 9    HOH HOH A . 
E 4 HOH 9  1109 29   HOH HOH A . 
E 4 HOH 10 1110 28   HOH HOH A . 
E 4 HOH 11 1111 34   HOH HOH A . 
E 4 HOH 12 1112 36   HOH HOH A . 
E 4 HOH 13 1113 23   HOH HOH A . 
E 4 HOH 14 1114 43   HOH HOH A . 
E 4 HOH 15 1115 14   HOH HOH A . 
E 4 HOH 16 1116 18   HOH HOH A . 
E 4 HOH 17 1117 22   HOH HOH A . 
E 4 HOH 18 1118 2    HOH HOH A . 
E 4 HOH 19 1119 7    HOH HOH A . 
E 4 HOH 20 1120 21   HOH HOH A . 
E 4 HOH 21 1121 47   HOH HOH A . 
E 4 HOH 22 1122 4    HOH HOH A . 
E 4 HOH 23 1123 45   HOH HOH A . 
E 4 HOH 24 1124 44   HOH HOH A . 
E 4 HOH 25 1125 27   HOH HOH A . 
E 4 HOH 26 1126 52   HOH HOH A . 
E 4 HOH 27 1127 19   HOH HOH A . 
E 4 HOH 28 1128 15   HOH HOH A . 
E 4 HOH 29 1129 3    HOH HOH A . 
E 4 HOH 30 1130 49   HOH HOH A . 
E 4 HOH 31 1131 31   HOH HOH A . 
E 4 HOH 32 1132 48   HOH HOH A . 
E 4 HOH 33 1133 24   HOH HOH A . 
E 4 HOH 34 1134 50   HOH HOH A . 
E 4 HOH 35 1135 13   HOH HOH A . 
E 4 HOH 36 1136 42   HOH HOH A . 
E 4 HOH 37 1137 38   HOH HOH A . 
E 4 HOH 38 1138 35   HOH HOH A . 
E 4 HOH 39 1139 30   HOH HOH A . 
E 4 HOH 40 1140 39   HOH HOH A . 
E 4 HOH 41 1141 11   HOH HOH A . 
E 4 HOH 42 1142 37   HOH HOH A . 
E 4 HOH 43 1143 16   HOH HOH A . 
E 4 HOH 44 1144 12   HOH HOH A . 
E 4 HOH 45 1145 32   HOH HOH A . 
E 4 HOH 46 1146 41   HOH HOH A . 
E 4 HOH 47 1147 25   HOH HOH A . 
E 4 HOH 48 1148 17   HOH HOH A . 
E 4 HOH 49 1149 46   HOH HOH A . 
E 4 HOH 50 1150 40   HOH HOH A . 
E 4 HOH 51 1151 20   HOH HOH A . 
# 
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 
? 'data processing' ? ? ? ? ? ? ? ? ? ? ? autoPROC  ? ? ? '1.0.5 (20240123)'                    1 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? XDS       ? ? ? 'VERSION Jun 30, 2023 BUILT=20230630' 2 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? 0.7.15                                3 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? STARANISO ? ? ? '2.4.9 (20231025)'                    4 
? phasing           ? ? ? ? ? ? ? ? ? ? ? PHASER    ? ? ? 2.8.3                                 5 
? 'model building'  ? ? ? ? ? ? ? ? ? ? ? Coot      ? ? ? 0.9.8.92                              6 
? refinement        ? ? ? ? ? ? ? ? ? ? ? PHENIX    ? ? ? 1.21rc1_4903                          7 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8YCV 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     67.169 
_cell.length_a_esd                 ? 
_cell.length_b                     67.169 
_cell.length_b_esd                 ? 
_cell.length_c                     95.104 
_cell.length_c_esd                 ? 
_cell.volume                       429082.957 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8YCV 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                95 
_symmetry.space_group_name_Hall            'P 4cw 2c' 
_symmetry.space_group_name_H-M             'P 43 2 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_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                   8YCV 
_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             3.24 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          62.04 
_exptl_crystal.description                  'Rod shaped' 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          MICROBATCH 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              6.2 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    'Sodium phosphate dibasic/ Potassium phosphate monobasic, Sodium chloride, PEG 200' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            277.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     CCD 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'MARMOSAIC 225 mm CCD' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-09-13 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.978930 
_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                        'RRCAT INDUS-2 BEAMLINE PX-BL21' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.978930 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   PX-BL21 
_diffrn_source.pdbx_synchrotron_site       'RRCAT INDUS-2' 
# 
_reflns.B_iso_Wilson_estimate                          30.44 
_reflns.entry_id                                       8YCV 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.16 
_reflns.d_resolution_low                               67.17 
_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                                     8907 
_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                           73.2 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                6.8 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          9.4 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.147 
_reflns.pdbx_Rpim_I_all                                0.055 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.997 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.135 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    2.16 
_reflns_shell.d_res_low                                     2.33 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.4 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             445 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               4.1 
_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                               1.172 
_reflns_shell.pdbx_Rpim_I_all                               0.553 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.46 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          19.3 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  1.022 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               41.99 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8YCV 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.16 
_refine.ls_d_res_low                             67.17 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     8905 
_refine.ls_number_reflns_R_free                  463 
_refine.ls_number_reflns_R_work                  8442 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    73.16 
_refine.ls_percent_reflns_R_free                 5.20 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2035 
_refine.ls_R_factor_R_free                       0.2319 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2018 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.36 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library + CDL v1.2' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 26.8081 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.3176 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.16 
_refine_hist.d_res_low                        67.17 
_refine_hist.number_atoms_solvent             51 
_refine_hist.number_atoms_total               1146 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1071 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         24 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.0027  ? 1110 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.4995  ? 1486 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0332  ? 161  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0047  ? 194  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 14.3608 ? 427  ? f_dihedral_angle_d ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 2.16 2.48  . . 47  1102 29.09 . . . . 0.2911 . . . . . . . . . . . 0.3218 
'X-RAY DIFFRACTION' 2.48 3.12  . . 164 3384 88.81 . . . . 0.2381 . . . . . . . . . . . 0.2888 
'X-RAY DIFFRACTION' 3.12 67.17 . . 252 3956 99.57 . . . . 0.1799 . . . . . . . . . . . 0.2091 
# 
_struct.entry_id                     8YCV 
_struct.title                        
;HosA transcriptional regulator from enteropathogenic Escherichia coli O127:H6 (strain E2348/69) bound with 4-hydroxy benzoic acid - Conformation II at 2.16 angstrom resolution (STARANISO processed)
;
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        8YCV 
_struct_keywords.text            
'Antibiotic resistance, MarR transcription factor, HosA, Enteropathogenic Escherichia coli, DNA binding protein, Paraben' 
_struct_keywords.pdbx_keywords   'DNA BINDING PROTEIN' 
# 
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 2 ? 
C N N 3 ? 
D N N 3 ? 
E N N 4 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    HOSA_ECO27 
_struct_ref.pdbx_db_accession          P69782 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MALRNKAFHQLRQLFQQHTARWQHELPDLTKPQYAVMRAIADKPGIEQVALIEAAVSTKATLAEMLARMENRGLVRREHD
AADKRRRFVWLTAEGEKVLAAAIPIGDSVDEEFLGRLSAEEQELFMQLVRKMMNT
;
_struct_ref.pdbx_align_begin           1 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              8YCV 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 135 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P69782 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  135 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       135 
# 
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 8YCV LEU A 136 ? UNP P69782 ? ? 'expression tag' 136 1 
1 8YCV GLU A 137 ? UNP P69782 ? ? 'expression tag' 137 2 
1 8YCV HIS A 138 ? UNP P69782 ? ? 'expression tag' 138 3 
1 8YCV HIS A 139 ? UNP P69782 ? ? 'expression tag' 139 4 
1 8YCV HIS A 140 ? UNP P69782 ? ? 'expression tag' 140 5 
1 8YCV HIS A 141 ? UNP P69782 ? ? 'expression tag' 141 6 
1 8YCV HIS A 142 ? UNP P69782 ? ? 'expression tag' 142 7 
1 8YCV HIS A 143 ? UNP P69782 ? ? 'expression tag' 143 8 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 1 A,B,C,D,E 
1 2 A,B,C,D,E 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                'PISA analysis predicted the assembly as homodimer.' 
# 
loop_
_pdbx_struct_oper_list.id 
_pdbx_struct_oper_list.type 
_pdbx_struct_oper_list.name 
_pdbx_struct_oper_list.symmetry_operation 
_pdbx_struct_oper_list.matrix[1][1] 
_pdbx_struct_oper_list.matrix[1][2] 
_pdbx_struct_oper_list.matrix[1][3] 
_pdbx_struct_oper_list.vector[1] 
_pdbx_struct_oper_list.matrix[2][1] 
_pdbx_struct_oper_list.matrix[2][2] 
_pdbx_struct_oper_list.matrix[2][3] 
_pdbx_struct_oper_list.vector[2] 
_pdbx_struct_oper_list.matrix[3][1] 
_pdbx_struct_oper_list.matrix[3][2] 
_pdbx_struct_oper_list.matrix[3][3] 
_pdbx_struct_oper_list.vector[3] 
1 'identity operation'       1_555 x,y,z 1.0  -0.0 0.0 0.0     0.0 1.0 0.0  0.0 0.0 0.0 1.0  0.0 
2 'point symmetry operation' ?     ?     -1.0 0.0  0.0 -67.169 0.0 1.0 -0.0 0.0 0.0 0.0 -1.0 0.0 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ALA A 2   ? ASN A 5   ? ALA A 2   ASN A 5   5 ? 4  
HELX_P HELX_P2 AA2 LYS A 6   ? LEU A 26  ? LYS A 6   LEU A 26  1 ? 21 
HELX_P HELX_P3 AA3 THR A 30  ? LYS A 43  ? THR A 30  LYS A 43  1 ? 14 
HELX_P HELX_P4 AA4 LEU A 51  ? VAL A 56  ? LEU A 51  VAL A 56  1 ? 6  
HELX_P HELX_P5 AA5 THR A 58  ? ARG A 72  ? THR A 58  ARG A 72  1 ? 15 
HELX_P HELX_P6 AA6 THR A 92  ? GLY A 115 ? THR A 92  GLY A 115 1 ? 24 
HELX_P HELX_P7 AA7 SER A 118 ? ASN A 134 ? SER A 118 ASN A 134 1 ? 17 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   3 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ILE A 46 ? GLU A 47 ? ILE A 46 GLU A 47 
AA1 2 ARG A 87 ? LEU A 91 ? ARG A 87 LEU A 91 
AA1 3 VAL A 75 ? HIS A 79 ? VAL A 75 HIS A 79 
# 
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 N ILE A 46 ? N ILE A 46 O VAL A 89 ? O VAL A 89 
AA1 2 3 O PHE A 88 ? O PHE A 88 N GLU A 78 ? N GLU A 78 
# 
_pdbx_entry_details.entry_id                   8YCV 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 OE1 A GLU 25   ? ? O A HOH 1101 ? ? 2.06 
2 1 O   A HOH 1104 ? ? O A HOH 1143 ? ? 2.07 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z        
2 -y,x,z+3/4   
3 y,-x,z+1/4   
4 x,-y,-z+1/2  
5 -x,y,-z      
6 -x,-y,z+1/2  
7 y,x,-z+1/4   
8 -y,-x,-z+3/4 
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_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[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1 'X-RAY DIFFRACTION' ? refined -38.7235517671 -16.6211813521 -3.84223666302 0.292833173746 ? 0.0492476390141  ? -0.0618510618199 
? 0.178798664931 ? 0.0153843951625  ? 0.306249445316 ? 1.68494535219  ? -0.0639883218768 ? -1.48377156218  ? 2.32613317246  ? 
1.68414965984   ? 5.7730828984   ? -0.16126412613  ? 0.1546754639     ? -0.0558923964615 ? -0.00535702950346 ? -0.164699908792   ? 
0.361758391472  ? -0.24895721767  ? -0.591471222576 ? 0.329929945068   ? 
2 'X-RAY DIFFRACTION' ? refined -18.8214813227 -21.3018471491 -8.91951385747 0.249839058689 ? -0.0515220402678 ? -0.0237939905142 
? 0.428637239288 ? 0.0626174264462  ? 0.244525789373 ? 1.90336741659  ? -0.661064963812  ? -0.587076188608 ? 2.32361153928  ? 
0.805695863022  ? 4.79130806789  ? -0.255526218094 ? -0.167750397936  ? 0.0755599551972  ? 0.0241024725469   ? 0.133767259075    ? 
-0.363814981673 ? -0.223590162255 ? 1.28339078673   ? 0.0940889628743  ? 
3 'X-RAY DIFFRACTION' ? refined -21.6664395121 -31.5805828936 -7.15747058668 0.306814934668 ? 0.129828032003   ? 0.142977990244   
? 0.32449703618  ? 0.161035542177   ? 0.500653106824 ? 2.24030766131  ? -1.06604507215   ? -0.775538149638 ? 5.09575798753  ? 
2.99383563665   ? 3.37410700584  ? -0.370729896191 ? -0.139592949134  ? -0.335675646728  ? 0.281089111188    ? -0.230067841032   ? 
0.456974155526  ? 0.601551527055  ? 0.316809730216  ? 0.256188494827   ? 
4 'X-RAY DIFFRACTION' ? refined -15.7861979836 -31.6423832594 -14.8196412766 0.289632293767 ? 0.140854889232   ? 0.119881386282   
? 0.688934563132 ? 0.0822419921349  ? 0.396794392222 ? 4.59072355954  ? -0.668394696983  ? 0.491181867145  ? 1.61964908894  ? 
0.625614158435  ? 1.34600800108  ? -0.190548988244 ? -0.330356558494  ? -0.262108006365  ? 0.1945319284      ? -0.112083355694   ? 
0.190565666501  ? 0.284773342131  ? 0.558826824638  ? 0.166147315622   ? 
5 'X-RAY DIFFRACTION' ? refined -4.67189416138 -33.0842401512 -4.47222043172 0.504209408928 ? 0.2984067611     ? 0.131529081961   
? 1.13311031863  ? 0.0860523625511  ? 0.470423044074 ? 1.12577175741  ? 0.484182795524   ? -0.685196415822 ? 1.50227348931  ? 
-0.863972966097 ? 0.667438487022 ? -0.151506289427 ? 0.626033147933   ? -0.425303488529  ? -0.304897298903   ? -0.153030619904   ? 
-0.298334239662 ? 0.445703506574  ? 0.638681396452  ? 0.402517710205   ? 
6 'X-RAY DIFFRACTION' ? refined -26.3965745276 -18.571779454  -16.7578793309 0.323750075531 ? -0.0140058211271 ? -0.0264158306716 
? 0.257945037577 ? 0.0715607047414  ? 0.203254760874 ? 0.519668012101 ? 0.314410320307   ? -0.30931151212  ? 1.94395885485  ? 
0.930375156673  ? 2.87868176718  ? -0.202066480895 ? -0.0997867199658 ? -0.206323014025  ? -0.365037598203   ? -0.00920060453775 ? 
0.157332891762  ? -0.463039007916 ? 0.448221447737  ? 0.163410525078   ? 
7 'X-RAY DIFFRACTION' ? refined -28.9705291942 -2.01758574794 -2.21376867326 0.544753854673 ? 0.0185408558639  ? 0.0516757255133  
? 0.145437963705 ? -0.0233264023947 ? 0.441062241776 ? 2.62880327215  ? -0.470792202911  ? 0.423744804055  ? 0.682211535828 ? 
-1.57787892593  ? 3.84158562789  ? 0.374535214758  ? 0.201474783227   ? 0.10855719891    ? -0.352536498184   ? -0.325351125238   ? 
-0.488178348099 ? -0.572866320987 ? 0.185646433092  ? -0.0689764269882 ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 A 1   A 2   ? A 29  A 30  ? ? 
;chain 'A' and (resid 2 through 30 )
;
2 'X-RAY DIFFRACTION' 2 A 30  A 31  ? A 57  A 58  ? ? 
;chain 'A' and (resid 31 through 58 )
;
3 'X-RAY DIFFRACTION' 3 A 58  A 59  ? A 70  A 71  ? ? 
;chain 'A' and (resid 59 through 71 )
;
4 'X-RAY DIFFRACTION' 4 A 71  A 72  ? A 78  A 79  ? ? 
;chain 'A' and (resid 72 through 79 )
;
5 'X-RAY DIFFRACTION' 5 A 79  A 80  ? A 85  A 86  ? ? 
;chain 'A' and (resid 80 through 86 )
;
6 'X-RAY DIFFRACTION' 6 A 86  A 87  ? A 115 A 116 ? ? 
;chain 'A' and (resid 87 through 116 )
;
7 'X-RAY DIFFRACTION' 7 A 116 A 117 ? A 133 A 134 ? ? 
;chain 'A' and (resid 117 through 134 )
;
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET 1   ? A MET 1   
2  1 Y 1 A THR 135 ? A THR 135 
3  1 Y 1 A LEU 136 ? A LEU 136 
4  1 Y 1 A GLU 137 ? A GLU 137 
5  1 Y 1 A HIS 138 ? A HIS 138 
6  1 Y 1 A HIS 139 ? A HIS 139 
7  1 Y 1 A HIS 140 ? A HIS 140 
8  1 Y 1 A HIS 141 ? A HIS 141 
9  1 Y 1 A HIS 142 ? A HIS 142 
10 1 Y 1 A HIS 143 ? A HIS 143 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N      N N N 1   
ALA CA     C N S 2   
ALA C      C N N 3   
ALA O      O N N 4   
ALA CB     C N N 5   
ALA OXT    O N N 6   
ALA H      H N N 7   
ALA H2     H N N 8   
ALA HA     H N N 9   
ALA HB1    H N N 10  
ALA HB2    H N N 11  
ALA HB3    H N N 12  
ALA HXT    H N N 13  
ARG N      N N N 14  
ARG CA     C N S 15  
ARG C      C N N 16  
ARG O      O N N 17  
ARG CB     C N N 18  
ARG CG     C N N 19  
ARG CD     C N N 20  
ARG NE     N N N 21  
ARG CZ     C N N 22  
ARG NH1    N N N 23  
ARG NH2    N N N 24  
ARG OXT    O N N 25  
ARG H      H N N 26  
ARG H2     H N N 27  
ARG HA     H N N 28  
ARG HB2    H N N 29  
ARG HB3    H N N 30  
ARG HG2    H N N 31  
ARG HG3    H N N 32  
ARG HD2    H N N 33  
ARG HD3    H N N 34  
ARG HE     H N N 35  
ARG HH11   H N N 36  
ARG HH12   H N N 37  
ARG HH21   H N N 38  
ARG HH22   H N N 39  
ARG HXT    H N N 40  
ASN N      N N N 41  
ASN CA     C N S 42  
ASN C      C N N 43  
ASN O      O N N 44  
ASN CB     C N N 45  
ASN CG     C N N 46  
ASN OD1    O N N 47  
ASN ND2    N N N 48  
ASN OXT    O N N 49  
ASN H      H N N 50  
ASN H2     H N N 51  
ASN HA     H N N 52  
ASN HB2    H N N 53  
ASN HB3    H N N 54  
ASN HD21   H N N 55  
ASN HD22   H N N 56  
ASN HXT    H N N 57  
ASP N      N N N 58  
ASP CA     C N S 59  
ASP C      C N N 60  
ASP O      O N N 61  
ASP CB     C N N 62  
ASP CG     C N N 63  
ASP OD1    O N N 64  
ASP OD2    O N N 65  
ASP OXT    O N N 66  
ASP H      H N N 67  
ASP H2     H N N 68  
ASP HA     H N N 69  
ASP HB2    H N N 70  
ASP HB3    H N N 71  
ASP HD2    H N N 72  
ASP HXT    H N N 73  
GLN N      N N N 74  
GLN CA     C N S 75  
GLN C      C N N 76  
GLN O      O N N 77  
GLN CB     C N N 78  
GLN CG     C N N 79  
GLN CD     C N N 80  
GLN OE1    O N N 81  
GLN NE2    N N N 82  
GLN OXT    O N N 83  
GLN H      H N N 84  
GLN H2     H N N 85  
GLN HA     H N N 86  
GLN HB2    H N N 87  
GLN HB3    H N N 88  
GLN HG2    H N N 89  
GLN HG3    H N N 90  
GLN HE21   H N N 91  
GLN HE22   H N N 92  
GLN HXT    H N N 93  
GLU N      N N N 94  
GLU CA     C N S 95  
GLU C      C N N 96  
GLU O      O N N 97  
GLU CB     C N N 98  
GLU CG     C N N 99  
GLU CD     C N N 100 
GLU OE1    O N N 101 
GLU OE2    O N N 102 
GLU OXT    O N N 103 
GLU H      H N N 104 
GLU H2     H N N 105 
GLU HA     H N N 106 
GLU HB2    H N N 107 
GLU HB3    H N N 108 
GLU HG2    H N N 109 
GLU HG3    H N N 110 
GLU HE2    H N N 111 
GLU HXT    H N N 112 
GLY N      N N N 113 
GLY CA     C N N 114 
GLY C      C N N 115 
GLY O      O N N 116 
GLY OXT    O N N 117 
GLY H      H N N 118 
GLY H2     H N N 119 
GLY HA2    H N N 120 
GLY HA3    H N N 121 
GLY HXT    H N N 122 
HIS N      N N N 123 
HIS CA     C N S 124 
HIS C      C N N 125 
HIS O      O N N 126 
HIS CB     C N N 127 
HIS CG     C Y N 128 
HIS ND1    N Y N 129 
HIS CD2    C Y N 130 
HIS CE1    C Y N 131 
HIS NE2    N Y N 132 
HIS OXT    O N N 133 
HIS H      H N N 134 
HIS H2     H N N 135 
HIS HA     H N N 136 
HIS HB2    H N N 137 
HIS HB3    H N N 138 
HIS HD1    H N N 139 
HIS HD2    H N N 140 
HIS HE1    H N N 141 
HIS HE2    H N N 142 
HIS HXT    H N N 143 
HOH O      O N N 144 
HOH H1     H N N 145 
HOH H2     H N N 146 
ILE N      N N N 147 
ILE CA     C N S 148 
ILE C      C N N 149 
ILE O      O N N 150 
ILE CB     C N S 151 
ILE CG1    C N N 152 
ILE CG2    C N N 153 
ILE CD1    C N N 154 
ILE OXT    O N N 155 
ILE H      H N N 156 
ILE H2     H N N 157 
ILE HA     H N N 158 
ILE HB     H N N 159 
ILE HG12   H N N 160 
ILE HG13   H N N 161 
ILE HG21   H N N 162 
ILE HG22   H N N 163 
ILE HG23   H N N 164 
ILE HD11   H N N 165 
ILE HD12   H N N 166 
ILE HD13   H N N 167 
ILE HXT    H N N 168 
LEU N      N N N 169 
LEU CA     C N S 170 
LEU C      C N N 171 
LEU O      O N N 172 
LEU CB     C N N 173 
LEU CG     C N N 174 
LEU CD1    C N N 175 
LEU CD2    C N N 176 
LEU OXT    O N N 177 
LEU H      H N N 178 
LEU H2     H N N 179 
LEU HA     H N N 180 
LEU HB2    H N N 181 
LEU HB3    H N N 182 
LEU HG     H N N 183 
LEU HD11   H N N 184 
LEU HD12   H N N 185 
LEU HD13   H N N 186 
LEU HD21   H N N 187 
LEU HD22   H N N 188 
LEU HD23   H N N 189 
LEU HXT    H N N 190 
LYS N      N N N 191 
LYS CA     C N S 192 
LYS C      C N N 193 
LYS O      O N N 194 
LYS CB     C N N 195 
LYS CG     C N N 196 
LYS CD     C N N 197 
LYS CE     C N N 198 
LYS NZ     N N N 199 
LYS OXT    O N N 200 
LYS H      H N N 201 
LYS H2     H N N 202 
LYS HA     H N N 203 
LYS HB2    H N N 204 
LYS HB3    H N N 205 
LYS HG2    H N N 206 
LYS HG3    H N N 207 
LYS HD2    H N N 208 
LYS HD3    H N N 209 
LYS HE2    H N N 210 
LYS HE3    H N N 211 
LYS HZ1    H N N 212 
LYS HZ2    H N N 213 
LYS HZ3    H N N 214 
LYS HXT    H N N 215 
MET N      N N N 216 
MET CA     C N S 217 
MET C      C N N 218 
MET O      O N N 219 
MET CB     C N N 220 
MET CG     C N N 221 
MET SD     S N N 222 
MET CE     C N N 223 
MET OXT    O N N 224 
MET H      H N N 225 
MET H2     H N N 226 
MET HA     H N N 227 
MET HB2    H N N 228 
MET HB3    H N N 229 
MET HG2    H N N 230 
MET HG3    H N N 231 
MET HE1    H N N 232 
MET HE2    H N N 233 
MET HE3    H N N 234 
MET HXT    H N N 235 
PEG C1     C N N 236 
PEG O1     O N N 237 
PEG C2     C N N 238 
PEG O2     O N N 239 
PEG C3     C N N 240 
PEG C4     C N N 241 
PEG O4     O N N 242 
PEG H11    H N N 243 
PEG H12    H N N 244 
PEG HO1    H N N 245 
PEG H21    H N N 246 
PEG H22    H N N 247 
PEG H31    H N N 248 
PEG H32    H N N 249 
PEG H41    H N N 250 
PEG H42    H N N 251 
PEG HO4    H N N 252 
PHB "C1'"  C N N 253 
PHB "O1'"  O N N 254 
PHB "O2'"  O N N 255 
PHB C1     C Y N 256 
PHB C2     C Y N 257 
PHB C3     C Y N 258 
PHB C4     C Y N 259 
PHB C5     C Y N 260 
PHB C6     C Y N 261 
PHB O4     O N N 262 
PHB "HO2'" H N N 263 
PHB H2     H N N 264 
PHB H3     H N N 265 
PHB H5     H N N 266 
PHB H6     H N N 267 
PHB HO4    H N N 268 
PHE N      N N N 269 
PHE CA     C N S 270 
PHE C      C N N 271 
PHE O      O N N 272 
PHE CB     C N N 273 
PHE CG     C Y N 274 
PHE CD1    C Y N 275 
PHE CD2    C Y N 276 
PHE CE1    C Y N 277 
PHE CE2    C Y N 278 
PHE CZ     C Y N 279 
PHE OXT    O N N 280 
PHE H      H N N 281 
PHE H2     H N N 282 
PHE HA     H N N 283 
PHE HB2    H N N 284 
PHE HB3    H N N 285 
PHE HD1    H N N 286 
PHE HD2    H N N 287 
PHE HE1    H N N 288 
PHE HE2    H N N 289 
PHE HZ     H N N 290 
PHE HXT    H N N 291 
PRO N      N N N 292 
PRO CA     C N S 293 
PRO C      C N N 294 
PRO O      O N N 295 
PRO CB     C N N 296 
PRO CG     C N N 297 
PRO CD     C N N 298 
PRO OXT    O N N 299 
PRO H      H N N 300 
PRO HA     H N N 301 
PRO HB2    H N N 302 
PRO HB3    H N N 303 
PRO HG2    H N N 304 
PRO HG3    H N N 305 
PRO HD2    H N N 306 
PRO HD3    H N N 307 
PRO HXT    H N N 308 
SER N      N N N 309 
SER CA     C N S 310 
SER C      C N N 311 
SER O      O N N 312 
SER CB     C N N 313 
SER OG     O N N 314 
SER OXT    O N N 315 
SER H      H N N 316 
SER H2     H N N 317 
SER HA     H N N 318 
SER HB2    H N N 319 
SER HB3    H N N 320 
SER HG     H N N 321 
SER HXT    H N N 322 
THR N      N N N 323 
THR CA     C N S 324 
THR C      C N N 325 
THR O      O N N 326 
THR CB     C N R 327 
THR OG1    O N N 328 
THR CG2    C N N 329 
THR OXT    O N N 330 
THR H      H N N 331 
THR H2     H N N 332 
THR HA     H N N 333 
THR HB     H N N 334 
THR HG1    H N N 335 
THR HG21   H N N 336 
THR HG22   H N N 337 
THR HG23   H N N 338 
THR HXT    H N N 339 
TRP N      N N N 340 
TRP CA     C N S 341 
TRP C      C N N 342 
TRP O      O N N 343 
TRP CB     C N N 344 
TRP CG     C Y N 345 
TRP CD1    C Y N 346 
TRP CD2    C Y N 347 
TRP NE1    N Y N 348 
TRP CE2    C Y N 349 
TRP CE3    C Y N 350 
TRP CZ2    C Y N 351 
TRP CZ3    C Y N 352 
TRP CH2    C Y N 353 
TRP OXT    O N N 354 
TRP H      H N N 355 
TRP H2     H N N 356 
TRP HA     H N N 357 
TRP HB2    H N N 358 
TRP HB3    H N N 359 
TRP HD1    H N N 360 
TRP HE1    H N N 361 
TRP HE3    H N N 362 
TRP HZ2    H N N 363 
TRP HZ3    H N N 364 
TRP HH2    H N N 365 
TRP HXT    H N N 366 
TYR N      N N N 367 
TYR CA     C N S 368 
TYR C      C N N 369 
TYR O      O N N 370 
TYR CB     C N N 371 
TYR CG     C Y N 372 
TYR CD1    C Y N 373 
TYR CD2    C Y N 374 
TYR CE1    C Y N 375 
TYR CE2    C Y N 376 
TYR CZ     C Y N 377 
TYR OH     O N N 378 
TYR OXT    O N N 379 
TYR H      H N N 380 
TYR H2     H N N 381 
TYR HA     H N N 382 
TYR HB2    H N N 383 
TYR HB3    H N N 384 
TYR HD1    H N N 385 
TYR HD2    H N N 386 
TYR HE1    H N N 387 
TYR HE2    H N N 388 
TYR HH     H N N 389 
TYR HXT    H N N 390 
VAL N      N N N 391 
VAL CA     C N S 392 
VAL C      C N N 393 
VAL O      O N N 394 
VAL CB     C N N 395 
VAL CG1    C N N 396 
VAL CG2    C N N 397 
VAL OXT    O N N 398 
VAL H      H N N 399 
VAL H2     H N N 400 
VAL HA     H N N 401 
VAL HB     H N N 402 
VAL HG11   H N N 403 
VAL HG12   H N N 404 
VAL HG13   H N N 405 
VAL HG21   H N N 406 
VAL HG22   H N N 407 
VAL HG23   H N N 408 
VAL HXT    H N N 409 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N     CA     sing N N 1   
ALA N     H      sing N N 2   
ALA N     H2     sing N N 3   
ALA CA    C      sing N N 4   
ALA CA    CB     sing N N 5   
ALA CA    HA     sing N N 6   
ALA C     O      doub N N 7   
ALA C     OXT    sing N N 8   
ALA CB    HB1    sing N N 9   
ALA CB    HB2    sing N N 10  
ALA CB    HB3    sing N N 11  
ALA OXT   HXT    sing N N 12  
ARG N     CA     sing N N 13  
ARG N     H      sing N N 14  
ARG N     H2     sing N N 15  
ARG CA    C      sing N N 16  
ARG CA    CB     sing N N 17  
ARG CA    HA     sing N N 18  
ARG C     O      doub N N 19  
ARG C     OXT    sing N N 20  
ARG CB    CG     sing N N 21  
ARG CB    HB2    sing N N 22  
ARG CB    HB3    sing N N 23  
ARG CG    CD     sing N N 24  
ARG CG    HG2    sing N N 25  
ARG CG    HG3    sing N N 26  
ARG CD    NE     sing N N 27  
ARG CD    HD2    sing N N 28  
ARG CD    HD3    sing N N 29  
ARG NE    CZ     sing N N 30  
ARG NE    HE     sing N N 31  
ARG CZ    NH1    sing N N 32  
ARG CZ    NH2    doub N N 33  
ARG NH1   HH11   sing N N 34  
ARG NH1   HH12   sing N N 35  
ARG NH2   HH21   sing N N 36  
ARG NH2   HH22   sing N N 37  
ARG OXT   HXT    sing N N 38  
ASN N     CA     sing N N 39  
ASN N     H      sing N N 40  
ASN N     H2     sing N N 41  
ASN CA    C      sing N N 42  
ASN CA    CB     sing N N 43  
ASN CA    HA     sing N N 44  
ASN C     O      doub N N 45  
ASN C     OXT    sing N N 46  
ASN CB    CG     sing N N 47  
ASN CB    HB2    sing N N 48  
ASN CB    HB3    sing N N 49  
ASN CG    OD1    doub N N 50  
ASN CG    ND2    sing N N 51  
ASN ND2   HD21   sing N N 52  
ASN ND2   HD22   sing N N 53  
ASN OXT   HXT    sing N N 54  
ASP N     CA     sing N N 55  
ASP N     H      sing N N 56  
ASP N     H2     sing N N 57  
ASP CA    C      sing N N 58  
ASP CA    CB     sing N N 59  
ASP CA    HA     sing N N 60  
ASP C     O      doub N N 61  
ASP C     OXT    sing N N 62  
ASP CB    CG     sing N N 63  
ASP CB    HB2    sing N N 64  
ASP CB    HB3    sing N N 65  
ASP CG    OD1    doub N N 66  
ASP CG    OD2    sing N N 67  
ASP OD2   HD2    sing N N 68  
ASP OXT   HXT    sing N N 69  
GLN N     CA     sing N N 70  
GLN N     H      sing N N 71  
GLN N     H2     sing N N 72  
GLN CA    C      sing N N 73  
GLN CA    CB     sing N N 74  
GLN CA    HA     sing N N 75  
GLN C     O      doub N N 76  
GLN C     OXT    sing N N 77  
GLN CB    CG     sing N N 78  
GLN CB    HB2    sing N N 79  
GLN CB    HB3    sing N N 80  
GLN CG    CD     sing N N 81  
GLN CG    HG2    sing N N 82  
GLN CG    HG3    sing N N 83  
GLN CD    OE1    doub N N 84  
GLN CD    NE2    sing N N 85  
GLN NE2   HE21   sing N N 86  
GLN NE2   HE22   sing N N 87  
GLN OXT   HXT    sing N N 88  
GLU N     CA     sing N N 89  
GLU N     H      sing N N 90  
GLU N     H2     sing N N 91  
GLU CA    C      sing N N 92  
GLU CA    CB     sing N N 93  
GLU CA    HA     sing N N 94  
GLU C     O      doub N N 95  
GLU C     OXT    sing N N 96  
GLU CB    CG     sing N N 97  
GLU CB    HB2    sing N N 98  
GLU CB    HB3    sing N N 99  
GLU CG    CD     sing N N 100 
GLU CG    HG2    sing N N 101 
GLU CG    HG3    sing N N 102 
GLU CD    OE1    doub N N 103 
GLU CD    OE2    sing N N 104 
GLU OE2   HE2    sing N N 105 
GLU OXT   HXT    sing N N 106 
GLY N     CA     sing N N 107 
GLY N     H      sing N N 108 
GLY N     H2     sing N N 109 
GLY CA    C      sing N N 110 
GLY CA    HA2    sing N N 111 
GLY CA    HA3    sing N N 112 
GLY C     O      doub N N 113 
GLY C     OXT    sing N N 114 
GLY OXT   HXT    sing N N 115 
HIS N     CA     sing N N 116 
HIS N     H      sing N N 117 
HIS N     H2     sing N N 118 
HIS CA    C      sing N N 119 
HIS CA    CB     sing N N 120 
HIS CA    HA     sing N N 121 
HIS C     O      doub N N 122 
HIS C     OXT    sing N N 123 
HIS CB    CG     sing N N 124 
HIS CB    HB2    sing N N 125 
HIS CB    HB3    sing N N 126 
HIS CG    ND1    sing Y N 127 
HIS CG    CD2    doub Y N 128 
HIS ND1   CE1    doub Y N 129 
HIS ND1   HD1    sing N N 130 
HIS CD2   NE2    sing Y N 131 
HIS CD2   HD2    sing N N 132 
HIS CE1   NE2    sing Y N 133 
HIS CE1   HE1    sing N N 134 
HIS NE2   HE2    sing N N 135 
HIS OXT   HXT    sing N N 136 
HOH O     H1     sing N N 137 
HOH O     H2     sing N N 138 
ILE N     CA     sing N N 139 
ILE N     H      sing N N 140 
ILE N     H2     sing N N 141 
ILE CA    C      sing N N 142 
ILE CA    CB     sing N N 143 
ILE CA    HA     sing N N 144 
ILE C     O      doub N N 145 
ILE C     OXT    sing N N 146 
ILE CB    CG1    sing N N 147 
ILE CB    CG2    sing N N 148 
ILE CB    HB     sing N N 149 
ILE CG1   CD1    sing N N 150 
ILE CG1   HG12   sing N N 151 
ILE CG1   HG13   sing N N 152 
ILE CG2   HG21   sing N N 153 
ILE CG2   HG22   sing N N 154 
ILE CG2   HG23   sing N N 155 
ILE CD1   HD11   sing N N 156 
ILE CD1   HD12   sing N N 157 
ILE CD1   HD13   sing N N 158 
ILE OXT   HXT    sing N N 159 
LEU N     CA     sing N N 160 
LEU N     H      sing N N 161 
LEU N     H2     sing N N 162 
LEU CA    C      sing N N 163 
LEU CA    CB     sing N N 164 
LEU CA    HA     sing N N 165 
LEU C     O      doub N N 166 
LEU C     OXT    sing N N 167 
LEU CB    CG     sing N N 168 
LEU CB    HB2    sing N N 169 
LEU CB    HB3    sing N N 170 
LEU CG    CD1    sing N N 171 
LEU CG    CD2    sing N N 172 
LEU CG    HG     sing N N 173 
LEU CD1   HD11   sing N N 174 
LEU CD1   HD12   sing N N 175 
LEU CD1   HD13   sing N N 176 
LEU CD2   HD21   sing N N 177 
LEU CD2   HD22   sing N N 178 
LEU CD2   HD23   sing N N 179 
LEU OXT   HXT    sing N N 180 
LYS N     CA     sing N N 181 
LYS N     H      sing N N 182 
LYS N     H2     sing N N 183 
LYS CA    C      sing N N 184 
LYS CA    CB     sing N N 185 
LYS CA    HA     sing N N 186 
LYS C     O      doub N N 187 
LYS C     OXT    sing N N 188 
LYS CB    CG     sing N N 189 
LYS CB    HB2    sing N N 190 
LYS CB    HB3    sing N N 191 
LYS CG    CD     sing N N 192 
LYS CG    HG2    sing N N 193 
LYS CG    HG3    sing N N 194 
LYS CD    CE     sing N N 195 
LYS CD    HD2    sing N N 196 
LYS CD    HD3    sing N N 197 
LYS CE    NZ     sing N N 198 
LYS CE    HE2    sing N N 199 
LYS CE    HE3    sing N N 200 
LYS NZ    HZ1    sing N N 201 
LYS NZ    HZ2    sing N N 202 
LYS NZ    HZ3    sing N N 203 
LYS OXT   HXT    sing N N 204 
MET N     CA     sing N N 205 
MET N     H      sing N N 206 
MET N     H2     sing N N 207 
MET CA    C      sing N N 208 
MET CA    CB     sing N N 209 
MET CA    HA     sing N N 210 
MET C     O      doub N N 211 
MET C     OXT    sing N N 212 
MET CB    CG     sing N N 213 
MET CB    HB2    sing N N 214 
MET CB    HB3    sing N N 215 
MET CG    SD     sing N N 216 
MET CG    HG2    sing N N 217 
MET CG    HG3    sing N N 218 
MET SD    CE     sing N N 219 
MET CE    HE1    sing N N 220 
MET CE    HE2    sing N N 221 
MET CE    HE3    sing N N 222 
MET OXT   HXT    sing N N 223 
PEG C1    O1     sing N N 224 
PEG C1    C2     sing N N 225 
PEG C1    H11    sing N N 226 
PEG C1    H12    sing N N 227 
PEG O1    HO1    sing N N 228 
PEG C2    O2     sing N N 229 
PEG C2    H21    sing N N 230 
PEG C2    H22    sing N N 231 
PEG O2    C3     sing N N 232 
PEG C3    C4     sing N N 233 
PEG C3    H31    sing N N 234 
PEG C3    H32    sing N N 235 
PEG C4    O4     sing N N 236 
PEG C4    H41    sing N N 237 
PEG C4    H42    sing N N 238 
PEG O4    HO4    sing N N 239 
PHB "C1'" "O1'"  doub N N 240 
PHB "C1'" "O2'"  sing N N 241 
PHB "C1'" C1     sing N N 242 
PHB "O2'" "HO2'" sing N N 243 
PHB C1    C2     sing Y N 244 
PHB C1    C6     doub Y N 245 
PHB C2    C3     doub Y N 246 
PHB C2    H2     sing N N 247 
PHB C3    C4     sing Y N 248 
PHB C3    H3     sing N N 249 
PHB C4    C5     doub Y N 250 
PHB C4    O4     sing N N 251 
PHB C5    C6     sing Y N 252 
PHB C5    H5     sing N N 253 
PHB C6    H6     sing N N 254 
PHB O4    HO4    sing N N 255 
PHE N     CA     sing N N 256 
PHE N     H      sing N N 257 
PHE N     H2     sing N N 258 
PHE CA    C      sing N N 259 
PHE CA    CB     sing N N 260 
PHE CA    HA     sing N N 261 
PHE C     O      doub N N 262 
PHE C     OXT    sing N N 263 
PHE CB    CG     sing N N 264 
PHE CB    HB2    sing N N 265 
PHE CB    HB3    sing N N 266 
PHE CG    CD1    doub Y N 267 
PHE CG    CD2    sing Y N 268 
PHE CD1   CE1    sing Y N 269 
PHE CD1   HD1    sing N N 270 
PHE CD2   CE2    doub Y N 271 
PHE CD2   HD2    sing N N 272 
PHE CE1   CZ     doub Y N 273 
PHE CE1   HE1    sing N N 274 
PHE CE2   CZ     sing Y N 275 
PHE CE2   HE2    sing N N 276 
PHE CZ    HZ     sing N N 277 
PHE OXT   HXT    sing N N 278 
PRO N     CA     sing N N 279 
PRO N     CD     sing N N 280 
PRO N     H      sing N N 281 
PRO CA    C      sing N N 282 
PRO CA    CB     sing N N 283 
PRO CA    HA     sing N N 284 
PRO C     O      doub N N 285 
PRO C     OXT    sing N N 286 
PRO CB    CG     sing N N 287 
PRO CB    HB2    sing N N 288 
PRO CB    HB3    sing N N 289 
PRO CG    CD     sing N N 290 
PRO CG    HG2    sing N N 291 
PRO CG    HG3    sing N N 292 
PRO CD    HD2    sing N N 293 
PRO CD    HD3    sing N N 294 
PRO OXT   HXT    sing N N 295 
SER N     CA     sing N N 296 
SER N     H      sing N N 297 
SER N     H2     sing N N 298 
SER CA    C      sing N N 299 
SER CA    CB     sing N N 300 
SER CA    HA     sing N N 301 
SER C     O      doub N N 302 
SER C     OXT    sing N N 303 
SER CB    OG     sing N N 304 
SER CB    HB2    sing N N 305 
SER CB    HB3    sing N N 306 
SER OG    HG     sing N N 307 
SER OXT   HXT    sing N N 308 
THR N     CA     sing N N 309 
THR N     H      sing N N 310 
THR N     H2     sing N N 311 
THR CA    C      sing N N 312 
THR CA    CB     sing N N 313 
THR CA    HA     sing N N 314 
THR C     O      doub N N 315 
THR C     OXT    sing N N 316 
THR CB    OG1    sing N N 317 
THR CB    CG2    sing N N 318 
THR CB    HB     sing N N 319 
THR OG1   HG1    sing N N 320 
THR CG2   HG21   sing N N 321 
THR CG2   HG22   sing N N 322 
THR CG2   HG23   sing N N 323 
THR OXT   HXT    sing N N 324 
TRP N     CA     sing N N 325 
TRP N     H      sing N N 326 
TRP N     H2     sing N N 327 
TRP CA    C      sing N N 328 
TRP CA    CB     sing N N 329 
TRP CA    HA     sing N N 330 
TRP C     O      doub N N 331 
TRP C     OXT    sing N N 332 
TRP CB    CG     sing N N 333 
TRP CB    HB2    sing N N 334 
TRP CB    HB3    sing N N 335 
TRP CG    CD1    doub Y N 336 
TRP CG    CD2    sing Y N 337 
TRP CD1   NE1    sing Y N 338 
TRP CD1   HD1    sing N N 339 
TRP CD2   CE2    doub Y N 340 
TRP CD2   CE3    sing Y N 341 
TRP NE1   CE2    sing Y N 342 
TRP NE1   HE1    sing N N 343 
TRP CE2   CZ2    sing Y N 344 
TRP CE3   CZ3    doub Y N 345 
TRP CE3   HE3    sing N N 346 
TRP CZ2   CH2    doub Y N 347 
TRP CZ2   HZ2    sing N N 348 
TRP CZ3   CH2    sing Y N 349 
TRP CZ3   HZ3    sing N N 350 
TRP CH2   HH2    sing N N 351 
TRP OXT   HXT    sing N N 352 
TYR N     CA     sing N N 353 
TYR N     H      sing N N 354 
TYR N     H2     sing N N 355 
TYR CA    C      sing N N 356 
TYR CA    CB     sing N N 357 
TYR CA    HA     sing N N 358 
TYR C     O      doub N N 359 
TYR C     OXT    sing N N 360 
TYR CB    CG     sing N N 361 
TYR CB    HB2    sing N N 362 
TYR CB    HB3    sing N N 363 
TYR CG    CD1    doub Y N 364 
TYR CG    CD2    sing Y N 365 
TYR CD1   CE1    sing Y N 366 
TYR CD1   HD1    sing N N 367 
TYR CD2   CE2    doub Y N 368 
TYR CD2   HD2    sing N N 369 
TYR CE1   CZ     doub Y N 370 
TYR CE1   HE1    sing N N 371 
TYR CE2   CZ     sing Y N 372 
TYR CE2   HE2    sing N N 373 
TYR CZ    OH     sing N N 374 
TYR OH    HH     sing N N 375 
TYR OXT   HXT    sing N N 376 
VAL N     CA     sing N N 377 
VAL N     H      sing N N 378 
VAL N     H2     sing N N 379 
VAL CA    C      sing N N 380 
VAL CA    CB     sing N N 381 
VAL CA    HA     sing N N 382 
VAL C     O      doub N N 383 
VAL C     OXT    sing N N 384 
VAL CB    CG1    sing N N 385 
VAL CB    CG2    sing N N 386 
VAL CB    HB     sing N N 387 
VAL CG1   HG11   sing N N 388 
VAL CG1   HG12   sing N N 389 
VAL CG1   HG13   sing N N 390 
VAL CG2   HG21   sing N N 391 
VAL CG2   HG22   sing N N 392 
VAL CG2   HG23   sing N N 393 
VAL OXT   HXT    sing N N 394 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   8PQ4 
_pdbx_initial_refinement_model.details          Apoprotein 
# 
_space_group.name_H-M_alt     'P 43 2 2' 
_space_group.name_Hall        'P 4cw 2c' 
_space_group.IT_number        95 
_space_group.crystal_system   tetragonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    8YCV 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.014888 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.014888 
_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]   0.010515 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C ? ? 3.54356 2.42580 ? ? 25.62398 1.50364  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
H ? ? 0.51345 0.48472 ? ? 24.73122 6.32584  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N ? ? 4.01032 2.96436 ? ? 19.97189 1.75589  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O ? ? 4.49882 3.47563 ? ? 15.80542 1.70748  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S ? ? 9.55732 6.39887 ? ? 1.23737  29.19336 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
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 2   ? -47.86816 -9.38406  12.60319  1.000 48.25049  ? 2    ALA A N     1 
ATOM   2    C CA    . ALA A 1 2   ? -48.04427 -10.40300 11.57519  1.000 53.52318  ? 2    ALA A CA    1 
ATOM   3    C C     . ALA A 1 2   ? -46.72127 -10.68456 10.86901  1.000 54.05969  ? 2    ALA A C     1 
ATOM   4    O O     . ALA A 1 2   ? -45.78930 -9.88171  10.92419  1.000 43.60563  ? 2    ALA A O     1 
ATOM   5    C CB    . ALA A 1 2   ? -49.09995 -9.96988  10.57136  1.000 54.37111  ? 2    ALA A CB    1 
ATOM   6    H HA    . ALA A 1 2   ? -48.35021 -11.22438 11.99070  1.000 64.32753  ? 2    ALA A HA    1 
ATOM   7    H HB1   . ALA A 1 2   ? -49.19749 -10.66091 9.89766   1.000 65.34504  ? 2    ALA A HB1   1 
ATOM   8    H HB2   . ALA A 1 2   ? -49.94178 -9.83884  11.03509  1.000 65.34504  ? 2    ALA A HB2   1 
ATOM   9    H HB3   . ALA A 1 2   ? -48.81867 -9.13989  10.15555  1.000 65.34504  ? 2    ALA A HB3   1 
ATOM   10   N N     . LEU A 1 3   ? -46.64675 -11.83576 10.20032  1.000 56.85516  ? 3    LEU A N     1 
ATOM   11   C CA    . LEU A 1 3   ? -45.40526 -12.22024 9.53979   1.000 48.35643  ? 3    LEU A CA    1 
ATOM   12   C C     . LEU A 1 3   ? -45.05136 -11.26961 8.40454   1.000 48.65463  ? 3    LEU A C     1 
ATOM   13   O O     . LEU A 1 3   ? -43.86723 -11.09355 8.09673   1.000 51.83185  ? 3    LEU A O     1 
ATOM   14   C CB    . LEU A 1 3   ? -45.51570 -13.65384 9.02477   1.000 48.30932  ? 3    LEU A CB    1 
ATOM   15   C CG    . LEU A 1 3   ? -45.18159 -14.73808 10.04808  1.000 34.22180  ? 3    LEU A CG    1 
ATOM   16   C CD1   . LEU A 1 3   ? -45.83289 -16.04883 9.66447   1.000 36.99999  ? 3    LEU A CD1   1 
ATOM   17   C CD2   . LEU A 1 3   ? -43.67494 -14.89776 10.15283  1.000 43.16982  ? 3    LEU A CD2   1 
ATOM   18   H H     . LEU A 1 3   ? -47.28971 -12.40070 10.11636  1.000 68.32590  ? 3    LEU A H     1 
ATOM   19   H HA    . LEU A 1 3   ? -44.68233 -12.18751 10.18570  1.000 58.12742  ? 3    LEU A HA    1 
ATOM   20   H HB2   . LEU A 1 3   ? -46.42750 -13.80339 8.72955   1.000 58.07090  ? 3    LEU A HB2   1 
ATOM   21   H HB3   . LEU A 1 3   ? -44.90413 -13.75897 8.27923   1.000 58.07090  ? 3    LEU A HB3   1 
ATOM   22   H HG    . LEU A 1 3   ? -45.52569 -14.48099 10.91779  1.000 41.16587  ? 3    LEU A HG    1 
ATOM   23   H HD11  . LEU A 1 3   ? -45.57666 -16.72876 10.30707  1.000 44.49970  ? 3    LEU A HD11  1 
ATOM   24   H HD12  . LEU A 1 3   ? -46.79629 -15.93593 9.66878   1.000 44.49970  ? 3    LEU A HD12  1 
ATOM   25   H HD13  . LEU A 1 3   ? -45.53354 -16.30250 8.77738   1.000 44.49970  ? 3    LEU A HD13  1 
ATOM   26   H HD21  . LEU A 1 3   ? -43.47464 -15.57573 10.81700  1.000 51.90350  ? 3    LEU A HD21  1 
ATOM   27   H HD22  . LEU A 1 3   ? -43.32513 -15.16724 9.28916   1.000 51.90350  ? 3    LEU A HD22  1 
ATOM   28   H HD23  . LEU A 1 3   ? -43.28517 -14.04991 10.41766  1.000 51.90350  ? 3    LEU A HD23  1 
ATOM   29   N N     . ARG A 1 4   ? -46.05160 -10.64517 7.77673   1.000 45.37675  ? 4    ARG A N     1 
ATOM   30   C CA    . ARG A 1 4   ? -45.77138 -9.70777  6.69629   1.000 50.08923  ? 4    ARG A CA    1 
ATOM   31   C C     . ARG A 1 4   ? -44.94415 -8.52001  7.16799   1.000 50.80405  ? 4    ARG A C     1 
ATOM   32   O O     . ARG A 1 4   ? -44.32948 -7.83670  6.34138   1.000 51.03328  ? 4    ARG A O     1 
ATOM   33   C CB    . ARG A 1 4   ? -47.07550 -9.20012  6.07511   1.000 64.28142  ? 4    ARG A CB    1 
ATOM   34   C CG    . ARG A 1 4   ? -47.93695 -8.35240  7.00717   1.000 72.91541  ? 4    ARG A CG    1 
ATOM   35   C CD    . ARG A 1 4   ? -48.91794 -7.49231  6.21800   1.000 79.05205  ? 4    ARG A CD    1 
ATOM   36   N NE    . ARG A 1 4   ? -49.71341 -8.28741  5.28905   1.000 91.50871  ? 4    ARG A NE    1 
ATOM   37   C CZ    . ARG A 1 4   ? -50.90725 -8.79782  5.56284   1.000 84.61103  ? 4    ARG A CZ    1 
ATOM   38   N NH1   . ARG A 1 4   ? -51.49276 -8.60290  6.73354   1.000 88.45426  ? 4    ARG A NH1   1 
ATOM   39   N NH2   . ARG A 1 4   ? -51.52937 -9.52272  4.63783   1.000 84.08822  ? 4    ARG A NH2   1 
ATOM   40   H H     . ARG A 1 4   ? -46.88635 -10.74726 7.95667   1.000 54.55181  ? 4    ARG A H     1 
ATOM   41   H HA    . ARG A 1 4   ? -45.27303 -10.17778 6.00953   1.000 60.20678  ? 4    ARG A HA    1 
ATOM   42   H HB2   . ARG A 1 4   ? -46.85751 -8.65550  5.30260   1.000 77.23741  ? 4    ARG A HB2   1 
ATOM   43   H HB3   . ARG A 1 4   ? -47.60556 -9.96540  5.80258   1.000 77.23741  ? 4    ARG A HB3   1 
ATOM   44   H HG2   . ARG A 1 4   ? -48.44366 -8.93346  7.59582   1.000 87.59820  ? 4    ARG A HG2   1 
ATOM   45   H HG3   . ARG A 1 4   ? -47.36706 -7.76644  7.52945   1.000 87.59820  ? 4    ARG A HG3   1 
ATOM   46   H HD2   . ARG A 1 4   ? -49.52287 -7.05039  6.83416   1.000 94.96217  ? 4    ARG A HD2   1 
ATOM   47   H HD3   . ARG A 1 4   ? -48.42443 -6.83207  5.70669   1.000 94.96217  ? 4    ARG A HD3   1 
ATOM   48   H HE    . ARG A 1 4   ? -49.38519 -8.43597  4.50815   1.000 109.91016 ? 4    ARG A HE    1 
ATOM   49   H HH11  . ARG A 1 4   ? -51.09899 -8.13575  7.33878   1.000 106.24482 ? 4    ARG A HH11  1 
ATOM   50   H HH12  . ARG A 1 4   ? -52.26701 -8.94339  6.88908   1.000 106.24482 ? 4    ARG A HH12  1 
ATOM   51   H HH21  . ARG A 1 4   ? -51.15763 -9.65556  3.87378   1.000 101.00558 ? 4    ARG A HH21  1 
ATOM   52   H HH22  . ARG A 1 4   ? -52.30346 -9.85872  4.80362   1.000 101.00558 ? 4    ARG A HH22  1 
ATOM   53   N N     . ASN A 1 5   ? -44.93113 -8.25006  8.47019   1.000 46.84669  ? 5    ASN A N     1 
ATOM   54   C CA    . ASN A 1 5   ? -44.19037 -7.13294  9.03539   1.000 36.97084  ? 5    ASN A CA    1 
ATOM   55   C C     . ASN A 1 5   ? -42.76293 -7.50270  9.40861   1.000 39.45715  ? 5    ASN A C     1 
ATOM   56   O O     . ASN A 1 5   ? -42.02884 -6.64922  9.91760   1.000 34.51152  ? 5    ASN A O     1 
ATOM   57   C CB    . ASN A 1 5   ? -44.92299 -6.60006  10.26799  1.000 43.35491  ? 5    ASN A CB    1 
ATOM   58   C CG    . ASN A 1 5   ? -46.37556 -6.26824  9.98244   1.000 60.28604  ? 5    ASN A CG    1 
ATOM   59   O OD1   . ASN A 1 5   ? -46.68214 -5.48756  9.07878   1.000 58.19092  ? 5    ASN A OD1   1 
ATOM   60   N ND2   . ASN A 1 5   ? -47.28053 -6.87425  10.74406  1.000 60.50824  ? 5    ASN A ND2   1 
ATOM   61   H H     . ASN A 1 5   ? -45.35471 -8.71221  9.05892   1.000 56.31574  ? 5    ASN A H     1 
ATOM   62   H HA    . ASN A 1 5   ? -44.14748 -6.41944  8.37966   1.000 44.46471  ? 5    ASN A HA    1 
ATOM   63   H HB2   . ASN A 1 5   ? -44.89968 -7.27303  10.96618  1.000 52.12561  ? 5    ASN A HB2   1 
ATOM   64   H HB3   . ASN A 1 5   ? -44.48368 -5.79066  10.57258  1.000 52.12561  ? 5    ASN A HB3   1 
ATOM   65   H HD21  . ASN A 1 5   ? -48.11778 -6.72002  10.62229  1.000 72.70959  ? 5    ASN A HD21  1 
ATOM   66   H HD22  . ASN A 1 5   ? -47.02888 -7.42062  11.35868  1.000 72.70959  ? 5    ASN A HD22  1 
ATOM   67   N N     . LYS A 1 6   ? -42.35658 -8.74691  9.17862   1.000 38.19190  ? 6    LYS A N     1 
ATOM   68   C CA    . LYS A 1 6   ? -40.98928 -9.17866  9.43521   1.000 33.23240  ? 6    LYS A CA    1 
ATOM   69   C C     . LYS A 1 6   ? -40.18775 -9.05490  8.14469   1.000 37.26116  ? 6    LYS A C     1 
ATOM   70   O O     . LYS A 1 6   ? -40.53265 -9.67045  7.12873   1.000 32.12027  ? 6    LYS A O     1 
ATOM   71   C CB    . LYS A 1 6   ? -40.96375 -10.61089 9.96344   1.000 35.05517  ? 6    LYS A CB    1 
ATOM   72   C CG    . LYS A 1 6   ? -41.50921 -10.75904 11.38154  1.000 35.62326  ? 6    LYS A CG    1 
ATOM   73   C CD    . LYS A 1 6   ? -40.55479 -10.18050 12.42215  1.000 35.01608  ? 6    LYS A CD    1 
ATOM   74   C CE    . LYS A 1 6   ? -41.14046 -10.27030 13.82543  1.000 41.48954  ? 6    LYS A CE    1 
ATOM   75   N NZ    . LYS A 1 6   ? -40.27492 -9.60284  14.83654  1.000 53.97246  ? 6    LYS A NZ    1 
ATOM   76   H H     . LYS A 1 6   ? -42.86331 -9.36892  8.86890   1.000 45.92998  ? 6    LYS A H     1 
ATOM   77   H HA    . LYS A 1 6   ? -40.58354 -8.60895  10.10730  1.000 39.97860  ? 6    LYS A HA    1 
ATOM   78   H HB2   . LYS A 1 6   ? -41.50332 -11.16712 9.38003   1.000 42.16591  ? 6    LYS A HB2   1 
ATOM   79   H HB3   . LYS A 1 6   ? -40.04605 -10.92508 9.96584   1.000 42.16591  ? 6    LYS A HB3   1 
ATOM   80   H HG2   . LYS A 1 6   ? -42.35418 -10.28762 11.44997  1.000 42.84762  ? 6    LYS A HG2   1 
ATOM   81   H HG3   . LYS A 1 6   ? -41.63754 -11.70022 11.57804  1.000 42.84762  ? 6    LYS A HG3   1 
ATOM   82   H HD2   . LYS A 1 6   ? -39.72219 -10.67792 12.40659  1.000 42.11900  ? 6    LYS A HD2   1 
ATOM   83   H HD3   . LYS A 1 6   ? -40.38711 -9.24659  12.22067  1.000 42.11900  ? 6    LYS A HD3   1 
ATOM   84   H HE2   . LYS A 1 6   ? -42.00848 -9.83750  13.83709  1.000 49.88715  ? 6    LYS A HE2   1 
ATOM   85   H HE3   . LYS A 1 6   ? -41.23169 -11.20350 14.07387  1.000 49.88715  ? 6    LYS A HE3   1 
ATOM   86   H HZ1   . LYS A 1 6   ? -40.64269 -9.67036  15.64418  1.000 64.86667  ? 6    LYS A HZ1   1 
ATOM   87   H HZ2   . LYS A 1 6   ? -39.47237 -9.98728  14.85156  1.000 64.86667  ? 6    LYS A HZ2   1 
ATOM   88   H HZ3   . LYS A 1 6   ? -40.17886 -8.74154  14.63399  1.000 64.86667  ? 6    LYS A HZ3   1 
ATOM   89   N N     . ALA A 1 7   ? -39.12130 -8.25461  8.18806   1.000 33.61362  ? 7    ALA A N     1 
ATOM   90   C CA    . ALA A 1 7   ? -38.33615 -8.00227  6.98558   1.000 26.71326  ? 7    ALA A CA    1 
ATOM   91   C C     . ALA A 1 7   ? -37.80143 -9.29505  6.38206   1.000 30.79627  ? 7    ALA A C     1 
ATOM   92   O O     . ALA A 1 7   ? -37.80596 -9.46434  5.15682   1.000 28.25776  ? 7    ALA A O     1 
ATOM   93   C CB    . ALA A 1 7   ? -37.18388 -7.05015  7.30471   1.000 35.31420  ? 7    ALA A CB    1 
ATOM   94   H H     . ALA A 1 7   ? -38.83638 -7.85174  8.89241   1.000 40.43606  ? 7    ALA A H     1 
ATOM   95   H HA    . ALA A 1 7   ? -38.90970 -7.58034  6.32686   1.000 32.15563  ? 7    ALA A HA    1 
ATOM   96   H HB1   . ALA A 1 7   ? -36.67189 -6.89182  6.49620   1.000 42.47675  ? 7    ALA A HB1   1 
ATOM   97   H HB2   . ALA A 1 7   ? -37.54757 -6.21378  7.63504   1.000 42.47675  ? 7    ALA A HB2   1 
ATOM   98   H HB3   . ALA A 1 7   ? -36.61795 -7.45468  7.98072   1.000 42.47675  ? 7    ALA A HB3   1 
ATOM   99   N N     . PHE A 1 8   ? -37.32537 -10.21738 7.21740   1.000 24.90019  ? 8    PHE A N     1 
ATOM   100  C CA    . PHE A 1 8   ? -36.73991 -11.43874 6.67895   1.000 35.63096  ? 8    PHE A CA    1 
ATOM   101  C C     . PHE A 1 8   ? -37.78883 -12.45373 6.24847   1.000 27.27065  ? 8    PHE A C     1 
ATOM   102  O O     . PHE A 1 8   ? -37.46593 -13.36239 5.47553   1.000 21.57249  ? 8    PHE A O     1 
ATOM   103  C CB    . PHE A 1 8   ? -35.77255 -12.05193 7.69183   1.000 27.32637  ? 8    PHE A CB    1 
ATOM   104  C CG    . PHE A 1 8   ? -34.38681 -11.48052 7.60056   1.000 33.31992  ? 8    PHE A CG    1 
ATOM   105  C CD1   . PHE A 1 8   ? -33.51245 -11.91145 6.61600   1.000 31.02502  ? 8    PHE A CD1   1 
ATOM   106  C CD2   . PHE A 1 8   ? -33.96790 -10.49325 8.47460   1.000 34.26145  ? 8    PHE A CD2   1 
ATOM   107  C CE1   . PHE A 1 8   ? -32.24234 -11.37721 6.51373   1.000 33.55634  ? 8    PHE A CE1   1 
ATOM   108  C CE2   . PHE A 1 8   ? -32.69755 -9.95852  8.37900   1.000 30.13789  ? 8    PHE A CE2   1 
ATOM   109  C CZ    . PHE A 1 8   ? -31.83494 -10.40042 7.39617   1.000 31.38691  ? 8    PHE A CZ    1 
ATOM   110  H H     . PHE A 1 8   ? -37.33028 -10.15968 8.07545   1.000 29.97994  ? 8    PHE A H     1 
ATOM   111  H HA    . PHE A 1 8   ? -36.22044 -11.21790 5.89011   1.000 42.85686  ? 8    PHE A HA    1 
ATOM   112  H HB2   . PHE A 1 8   ? -36.10664 -11.88504 8.58706   1.000 32.89136  ? 8    PHE A HB2   1 
ATOM   113  H HB3   . PHE A 1 8   ? -35.71351 -13.00691 7.53242   1.000 32.89136  ? 8    PHE A HB3   1 
ATOM   114  H HD1   . PHE A 1 8   ? -33.78384 -12.56854 6.01644   1.000 37.32973  ? 8    PHE A HD1   1 
ATOM   115  H HD2   . PHE A 1 8   ? -34.54775 -10.18620 9.13368   1.000 41.21345  ? 8    PHE A HD2   1 
ATOM   116  H HE1   . PHE A 1 8   ? -31.66328 -11.67641 5.85035   1.000 40.36732  ? 8    PHE A HE1   1 
ATOM   117  H HE2   . PHE A 1 8   ? -32.42364 -9.30087  8.97681   1.000 36.26518  ? 8    PHE A HE2   1 
ATOM   118  H HZ    . PHE A 1 8   ? -30.98038 -10.03957 7.32967   1.000 37.76400  ? 8    PHE A HZ    1 
ATOM   119  N N     . HIS A 1 9   ? -39.03371 -12.31766 6.70592   1.000 25.77485  ? 9    HIS A N     1 
ATOM   120  C CA    . HIS A 1 9   ? -40.09400 -13.14155 6.14109   1.000 31.77768  ? 9    HIS A CA    1 
ATOM   121  C C     . HIS A 1 9   ? -40.43625 -12.67471 4.73393   1.000 23.62863  ? 9    HIS A C     1 
ATOM   122  O O     . HIS A 1 9   ? -40.45173 -13.47105 3.78919   1.000 23.11481  ? 9    HIS A O     1 
ATOM   123  C CB    . HIS A 1 9   ? -41.33857 -13.10907 7.01767   1.000 29.32520  ? 9    HIS A CB    1 
ATOM   124  C CG    . HIS A 1 9   ? -42.46937 -13.92037 6.46816   1.000 28.32493  ? 9    HIS A CG    1 
ATOM   125  N ND1   . HIS A 1 9   ? -42.51386 -15.29449 6.56553   1.000 31.96404  ? 9    HIS A ND1   1 
ATOM   126  C CD2   . HIS A 1 9   ? -43.58338 -13.55497 5.79190   1.000 28.89693  ? 9    HIS A CD2   1 
ATOM   127  C CE1   . HIS A 1 9   ? -43.61637 -15.73911 5.98969   1.000 29.93825  ? 9    HIS A CE1   1 
ATOM   128  N NE2   . HIS A 1 9   ? -44.28308 -14.70377 5.51224   1.000 33.62513  ? 9    HIS A NE2   1 
ATOM   129  H H     . HIS A 1 9   ? -39.28075 -11.77222 7.32322   1.000 31.02953  ? 9    HIS A H     1 
ATOM   130  H HA    . HIS A 1 9   ? -39.78248 -14.05960 6.10872   1.000 38.23292  ? 9    HIS A HA    1 
ATOM   131  H HB2   . HIS A 1 9   ? -41.11538 -13.46292 7.89281   1.000 35.28995  ? 9    HIS A HB2   1 
ATOM   132  H HB3   . HIS A 1 9   ? -41.64172 -12.19121 7.09839   1.000 35.28995  ? 9    HIS A HB3   1 
ATOM   133  H HD1   . HIS A 1 9   ? -41.91698 -15.78574 6.94237   1.000 38.45656  ? 9    HIS A HD1   1 
ATOM   134  H HD2   . HIS A 1 9   ? -43.82917 -12.68854 5.55997   1.000 34.77603  ? 9    HIS A HD2   1 
ATOM   135  H HE1   . HIS A 1 9   ? -43.87848 -16.62945 5.93053   1.000 36.02561  ? 9    HIS A HE1   1 
ATOM   136  N N     . GLN A 1 10  ? -40.71811 -11.37863 4.57806   1.000 27.41819  ? 10   GLN A N     1 
ATOM   137  C CA    . GLN A 1 10  ? -40.94126 -10.83467 3.24451   1.000 30.63159  ? 10   GLN A CA    1 
ATOM   138  C C     . GLN A 1 10  ? -39.75607 -11.12298 2.33608   1.000 26.28996  ? 10   GLN A C     1 
ATOM   139  O O     . GLN A 1 10  ? -39.92765 -11.30366 1.12571   1.000 29.61116  ? 10   GLN A O     1 
ATOM   140  C CB    . GLN A 1 10  ? -41.19993 -9.33021  3.31933   1.000 31.01757  ? 10   GLN A CB    1 
ATOM   141  C CG    . GLN A 1 10  ? -42.51471 -8.95013  3.98611   1.000 40.03117  ? 10   GLN A CG    1 
ATOM   142  C CD    . GLN A 1 10  ? -43.72056 -9.56390  3.30052   1.000 52.06321  ? 10   GLN A CD    1 
ATOM   143  O OE1   . GLN A 1 10  ? -44.34731 -10.48141 3.82863   1.000 63.33013  ? 10   GLN A OE1   1 
ATOM   144  N NE2   . GLN A 1 10  ? -44.05205 -9.05862  2.12048   1.000 58.53235  ? 10   GLN A NE2   1 
ATOM   145  H H     . GLN A 1 10  ? -40.78397 -10.80675 5.21697   1.000 33.00154  ? 10   GLN A H     1 
ATOM   146  H HA    . GLN A 1 10  ? -41.73115 -11.24831 2.86258   1.000 36.85762  ? 10   GLN A HA    1 
ATOM   147  H HB2   . GLN A 1 10  ? -40.48358 -8.91815  3.82722   1.000 37.32079  ? 10   GLN A HB2   1 
ATOM   148  H HB3   . GLN A 1 10  ? -41.21468 -8.97374  2.41732   1.000 37.32079  ? 10   GLN A HB3   1 
ATOM   149  H HG2   . GLN A 1 10  ? -42.50339 -9.25874  4.90564   1.000 48.13712  ? 10   GLN A HG2   1 
ATOM   150  H HG3   . GLN A 1 10  ? -42.61437 -7.98559  3.96109   1.000 48.13712  ? 10   GLN A HG3   1 
ATOM   151  H HE21  . GLN A 1 10  ? -43.59074 -8.41609  1.78291   1.000 70.33853  ? 10   GLN A HE21  1 
ATOM   152  H HE22  . GLN A 1 10  ? -44.72838 -9.37339  1.69258   1.000 70.33853  ? 10   GLN A HE22  1 
ATOM   153  N N     . LEU A 1 11  ? -38.54944 -11.18653 2.90029   1.000 27.12604  ? 11   LEU A N     1 
ATOM   154  C CA    . LEU A 1 11  ? -37.38088 -11.50711 2.08900   1.000 21.79756  ? 11   LEU A CA    1 
ATOM   155  C C     . LEU A 1 11  ? -37.46619 -12.92547 1.54009   1.000 26.30442  ? 11   LEU A C     1 
ATOM   156  O O     . LEU A 1 11  ? -37.18286 -13.15843 0.35974   1.000 28.90362  ? 11   LEU A O     1 
ATOM   157  C CB    . LEU A 1 11  ? -36.10828 -11.32894 2.91049   1.000 29.49240  ? 11   LEU A CB    1 
ATOM   158  C CG    . LEU A 1 11  ? -34.81085 -11.53705 2.13051   1.000 27.71353  ? 11   LEU A CG    1 
ATOM   159  C CD1   . LEU A 1 11  ? -34.76048 -10.53524 0.99958   1.000 42.38602  ? 11   LEU A CD1   1 
ATOM   160  C CD2   . LEU A 1 11  ? -33.60055 -11.39199 3.02206   1.000 28.95649  ? 11   LEU A CD2   1 
ATOM   161  H H     . LEU A 1 11  ? -38.38517 -11.05087 3.73348   1.000 32.65096  ? 11   LEU A H     1 
ATOM   162  H HA    . LEU A 1 11  ? -37.34283 -10.89341 1.33879   1.000 26.25678  ? 11   LEU A HA    1 
ATOM   163  H HB2   . LEU A 1 11  ? -36.09510 -10.42624 3.26526   1.000 35.49059  ? 11   LEU A HB2   1 
ATOM   164  H HB3   . LEU A 1 11  ? -36.11911 -11.97100 3.63750   1.000 35.49059  ? 11   LEU A HB3   1 
ATOM   165  H HG    . LEU A 1 11  ? -34.78777 -12.43765 1.77095   1.000 33.35594  ? 11   LEU A HG    1 
ATOM   166  H HD11  . LEU A 1 11  ? -33.92290 -10.04823 1.04617   1.000 50.96293  ? 11   LEU A HD11  1 
ATOM   167  H HD12  . LEU A 1 11  ? -34.82121 -11.00884 0.15523   1.000 50.96293  ? 11   LEU A HD12  1 
ATOM   168  H HD13  . LEU A 1 11  ? -35.50577 -9.92081  1.08855   1.000 50.96293  ? 11   LEU A HD13  1 
ATOM   169  H HD21  . LEU A 1 11  ? -32.80125 -11.56287 2.49973   1.000 34.84750  ? 11   LEU A HD21  1 
ATOM   170  H HD22  . LEU A 1 11  ? -33.57665 -10.48989 3.37779   1.000 34.84750  ? 11   LEU A HD22  1 
ATOM   171  H HD23  . LEU A 1 11  ? -33.66448 -12.03222 3.74795   1.000 34.84750  ? 11   LEU A HD23  1 
ATOM   172  N N     . ARG A 1 12  ? -37.84825 -13.88956 2.37988   1.000 24.50441  ? 12   ARG A N     1 
ATOM   173  C CA    . ARG A 1 12  ? -38.02398 -15.24943 1.88672   1.000 25.87170  ? 12   ARG A CA    1 
ATOM   174  C C     . ARG A 1 12  ? -39.15726 -15.32530 0.87146   1.000 26.22336  ? 12   ARG A C     1 
ATOM   175  O O     . ARG A 1 12  ? -39.09196 -16.12065 -0.07236  1.000 25.38960  ? 12   ARG A O     1 
ATOM   176  C CB    . ARG A 1 12  ? -38.28107 -16.20295 3.05156   1.000 24.69610  ? 12   ARG A CB    1 
ATOM   177  C CG    . ARG A 1 12  ? -38.21428 -17.67302 2.66464   1.000 27.96006  ? 12   ARG A CG    1 
ATOM   178  C CD    . ARG A 1 12  ? -37.98770 -18.55347 3.87794   1.000 24.80550  ? 12   ARG A CD    1 
ATOM   179  N NE    . ARG A 1 12  ? -39.07683 -18.45302 4.84116   1.000 26.48500  ? 12   ARG A NE    1 
ATOM   180  C CZ    . ARG A 1 12  ? -40.15868 -19.21876 4.82797   1.000 25.96037  ? 12   ARG A CZ    1 
ATOM   181  N NH1   . ARG A 1 12  ? -40.33783 -20.14576 3.90094   1.000 34.30938  ? 12   ARG A NH1   1 
ATOM   182  N NH2   . ARG A 1 12  ? -41.08245 -19.05208 5.76970   1.000 24.47761  ? 12   ARG A NH2   1 
ATOM   183  H H     . ARG A 1 12  ? -38.00757 -13.78286 3.21823   1.000 29.50500  ? 12   ARG A H     1 
ATOM   184  H HA    . ARG A 1 12  ? -37.20720 -15.53507 1.44834   1.000 31.14574  ? 12   ARG A HA    1 
ATOM   185  H HB2   . ARG A 1 12  ? -37.61249 -16.04609 3.73661   1.000 29.73503  ? 12   ARG A HB2   1 
ATOM   186  H HB3   . ARG A 1 12  ? -39.16695 -16.02990 3.40678   1.000 29.73503  ? 12   ARG A HB3   1 
ATOM   187  H HG2   . ARG A 1 12  ? -39.05079 -17.93482 2.24917   1.000 33.65178  ? 12   ARG A HG2   1 
ATOM   188  H HG3   . ARG A 1 12  ? -37.47959 -17.81004 2.04630   1.000 33.65178  ? 12   ARG A HG3   1 
ATOM   189  H HD2   . ARG A 1 12  ? -37.92087 -19.47813 3.59256   1.000 29.86631  ? 12   ARG A HD2   1 
ATOM   190  H HD3   . ARG A 1 12  ? -37.16766 -18.28248 4.31954   1.000 29.86631  ? 12   ARG A HD3   1 
ATOM   191  H HE    . ARG A 1 12  ? -39.01342 -17.85782 5.45867   1.000 31.88171  ? 12   ARG A HE    1 
ATOM   192  H HH11  . ARG A 1 12  ? -39.74501 -20.26200 3.28885   1.000 41.27097  ? 12   ARG A HH11  1 
ATOM   193  H HH12  . ARG A 1 12  ? -41.04710 -20.63202 3.91050   1.000 41.27097  ? 12   ARG A HH12  1 
ATOM   194  H HH21  . ARG A 1 12  ? -40.97389 -18.45323 6.37732   1.000 29.39399  ? 12   ARG A HH21  1 
ATOM   195  H HH22  . ARG A 1 12  ? -41.78847 -19.54312 5.77118   1.000 29.39399  ? 12   ARG A HH22  1 
ATOM   196  N N     . GLN A 1 13  ? -40.20089 -14.51139 1.04384   1.000 24.61095  ? 13   GLN A N     1 
ATOM   197  C CA    . GLN A 1 13  ? -41.26829 -14.46512 0.04959   1.000 28.95063  ? 13   GLN A CA    1 
ATOM   198  C C     . GLN A 1 13  ? -40.71359 -14.06788 -1.31388  1.000 28.45642  ? 13   GLN A C     1 
ATOM   199  O O     . GLN A 1 13  ? -40.97737 -14.72976 -2.32459  1.000 34.82793  ? 13   GLN A O     1 
ATOM   200  C CB    . GLN A 1 13  ? -42.35821 -13.48638 0.49093   1.000 31.11231  ? 13   GLN A CB    1 
ATOM   201  C CG    . GLN A 1 13  ? -43.01315 -13.81474 1.82643   1.000 41.15768  ? 13   GLN A CG    1 
ATOM   202  C CD    . GLN A 1 13  ? -44.27191 -14.64799 1.67848   1.000 46.38247  ? 13   GLN A CD    1 
ATOM   203  O OE1   . GLN A 1 13  ? -44.40696 -15.42982 0.73858   1.000 53.41810  ? 13   GLN A OE1   1 
ATOM   204  N NE2   . GLN A 1 13  ? -45.20563 -14.47797 2.60673   1.000 54.46433  ? 13   GLN A NE2   1 
ATOM   205  H H     . GLN A 1 13  ? -40.31142 -13.98615 1.71578   1.000 29.63285  ? 13   GLN A H     1 
ATOM   206  H HA    . GLN A 1 13  ? -41.66944 -15.34521 -0.02407  1.000 34.84046  ? 13   GLN A HA    1 
ATOM   207  H HB2   . GLN A 1 13  ? -41.96483 -12.60315 0.56889   1.000 37.43449  ? 13   GLN A HB2   1 
ATOM   208  H HB3   . GLN A 1 13  ? -43.05661 -13.48026 -0.18219  1.000 37.43449  ? 13   GLN A HB3   1 
ATOM   209  H HG2   . GLN A 1 13  ? -42.38545 -14.31508 2.37099   1.000 49.48892  ? 13   GLN A HG2   1 
ATOM   210  H HG3   . GLN A 1 13  ? -43.25284 -12.98720 2.27210   1.000 49.48892  ? 13   GLN A HG3   1 
ATOM   211  H HE21  . GLN A 1 13  ? -45.07823 -13.91858 3.24739   1.000 65.45690  ? 13   GLN A HE21  1 
ATOM   212  H HE22  . GLN A 1 13  ? -45.93790 -14.92723 2.56740   1.000 65.45690  ? 13   GLN A HE22  1 
ATOM   213  N N     . LEU A 1 14  ? -39.93108 -12.98633 -1.35658  1.000 33.07730  ? 14   LEU A N     1 
ATOM   214  C CA    . LEU A 1 14  ? -39.34619 -12.53678 -2.61605  1.000 29.90026  ? 14   LEU A CA    1 
ATOM   215  C C     . LEU A 1 14  ? -38.39766 -13.58410 -3.17991  1.000 29.69450  ? 14   LEU A C     1 
ATOM   216  O O     . LEU A 1 14  ? -38.48096 -13.94762 -4.35931  1.000 29.58136  ? 14   LEU A O     1 
ATOM   217  C CB    . LEU A 1 14  ? -38.61146 -11.21278 -2.40590  1.000 26.07176  ? 14   LEU A CB    1 
ATOM   218  C CG    . LEU A 1 14  ? -37.85555 -10.65818 -3.61369  1.000 33.85188  ? 14   LEU A CG    1 
ATOM   219  C CD1   . LEU A 1 14  ? -38.80779 -10.30167 -4.74195  1.000 36.06188  ? 14   LEU A CD1   1 
ATOM   220  C CD2   . LEU A 1 14  ? -37.03666 -9.44641  -3.20391  1.000 24.40421  ? 14   LEU A CD2   1 
ATOM   221  H H     . LEU A 1 14  ? -39.72649 -12.50146 -0.67640  1.000 39.79247  ? 14   LEU A H     1 
ATOM   222  H HA    . LEU A 1 14  ? -40.05865 -12.39215 -3.25822  1.000 35.98002  ? 14   LEU A HA    1 
ATOM   223  H HB2   . LEU A 1 14  ? -39.26417 -10.54415 -2.14550  1.000 31.38582  ? 14   LEU A HB2   1 
ATOM   224  H HB3   . LEU A 1 14  ? -37.96294 -11.33767 -1.69546  1.000 31.38582  ? 14   LEU A HB3   1 
ATOM   225  H HG    . LEU A 1 14  ? -37.25315 -11.34151 -3.94699  1.000 40.72197  ? 14   LEU A HG    1 
ATOM   226  H HD11  . LEU A 1 14  ? -38.29443 -9.97289  -5.49645  1.000 43.37396  ? 14   LEU A HD11  1 
ATOM   227  H HD12  . LEU A 1 14  ? -39.30331 -11.09479 -4.99946  1.000 43.37396  ? 14   LEU A HD12  1 
ATOM   228  H HD13  . LEU A 1 14  ? -39.41960 -9.61495  -4.43372  1.000 43.37396  ? 14   LEU A HD13  1 
ATOM   229  H HD21  . LEU A 1 14  ? -36.57889 -9.09611  -3.98407  1.000 29.38477  ? 14   LEU A HD21  1 
ATOM   230  H HD22  . LEU A 1 14  ? -37.63103 -8.77240  -2.83876  1.000 29.38477  ? 14   LEU A HD22  1 
ATOM   231  H HD23  . LEU A 1 14  ? -36.38926 -9.71485  -2.53331  1.000 29.38477  ? 14   LEU A HD23  1 
ATOM   232  N N     . PHE A 1 15  ? -37.48046 -14.07590 -2.34514  1.000 24.18814  ? 15   PHE A N     1 
ATOM   233  C CA    . PHE A 1 15  ? -36.50298 -15.05122 -2.80931  1.000 23.67344  ? 15   PHE A CA    1 
ATOM   234  C C     . PHE A 1 15  ? -37.18292 -16.28162 -3.39463  1.000 31.30770  ? 15   PHE A C     1 
ATOM   235  O O     . PHE A 1 15  ? -36.70673 -16.85192 -4.38297  1.000 23.38809  ? 15   PHE A O     1 
ATOM   236  C CB    . PHE A 1 15  ? -35.58110 -15.45032 -1.65913  1.000 24.86498  ? 15   PHE A CB    1 
ATOM   237  C CG    . PHE A 1 15  ? -34.54513 -16.45672 -2.04426  1.000 24.41553  ? 15   PHE A CG    1 
ATOM   238  C CD1   . PHE A 1 15  ? -33.43031 -16.07304 -2.76983  1.000 28.15419  ? 15   PHE A CD1   1 
ATOM   239  C CD2   . PHE A 1 15  ? -34.68229 -17.78570 -1.68656  1.000 27.46709  ? 15   PHE A CD2   1 
ATOM   240  C CE1   . PHE A 1 15  ? -32.47058 -16.99708 -3.13290  1.000 29.63385  ? 15   PHE A CE1   1 
ATOM   241  C CE2   . PHE A 1 15  ? -33.72477 -18.71668 -2.04758  1.000 36.41537  ? 15   PHE A CE2   1 
ATOM   242  C CZ    . PHE A 1 15  ? -32.61762 -18.32112 -2.77077  1.000 31.00360  ? 15   PHE A CZ    1 
ATOM   243  H H     . PHE A 1 15  ? -37.40549 -13.86234 -1.51546  1.000 29.12547  ? 15   PHE A H     1 
ATOM   244  H HA    . PHE A 1 15  ? -35.96397 -14.64560 -3.50633  1.000 28.50784  ? 15   PHE A HA    1 
ATOM   245  H HB2   . PHE A 1 15  ? -35.12112 -14.65888 -1.33827  1.000 29.93768  ? 15   PHE A HB2   1 
ATOM   246  H HB3   . PHE A 1 15  ? -36.11726 -15.83380 -0.94754  1.000 29.93768  ? 15   PHE A HB3   1 
ATOM   247  H HD1   . PHE A 1 15  ? -33.32651 -15.18216 -3.01572  1.000 33.88473  ? 15   PHE A HD1   1 
ATOM   248  H HD2   . PHE A 1 15  ? -35.42604 -18.05632 -1.19819  1.000 33.06021  ? 15   PHE A HD2   1 
ATOM   249  H HE1   . PHE A 1 15  ? -31.72603 -16.72779 -3.62079  1.000 35.66033  ? 15   PHE A HE1   1 
ATOM   250  H HE2   . PHE A 1 15  ? -33.82695 -19.60818 -1.80325  1.000 43.79815  ? 15   PHE A HE2   1 
ATOM   251  H HZ    . PHE A 1 15  ? -31.97220 -18.94514 -3.01353  1.000 37.30403  ? 15   PHE A HZ    1 
ATOM   252  N N     . GLN A 1 16  ? -38.29601 -16.70988 -2.79737  1.000 33.49686  ? 16   GLN A N     1 
ATOM   253  C CA    . GLN A 1 16  ? -38.98472 -17.89459 -3.29624  1.000 31.37270  ? 16   GLN A CA    1 
ATOM   254  C C     . GLN A 1 16  ? -39.75251 -17.59610 -4.57770  1.000 29.43465  ? 16   GLN A C     1 
ATOM   255  O O     . GLN A 1 16  ? -39.82780 -18.45016 -5.46631  1.000 24.60163  ? 16   GLN A O     1 
ATOM   256  C CB    . GLN A 1 16  ? -39.92612 -18.44918 -2.22870  1.000 31.40741  ? 16   GLN A CB    1 
ATOM   257  C CG    . GLN A 1 16  ? -39.21375 -19.19402 -1.11217  1.000 41.45280  ? 16   GLN A CG    1 
ATOM   258  C CD    . GLN A 1 16  ? -38.38407 -20.36178 -1.62085  1.000 45.46688  ? 16   GLN A CD    1 
ATOM   259  O OE1   . GLN A 1 16  ? -37.26672 -20.58924 -1.15812  1.000 61.92249  ? 16   GLN A OE1   1 
ATOM   260  N NE2   . GLN A 1 16  ? -38.92801 -21.10577 -2.57833  1.000 45.18529  ? 16   GLN A NE2   1 
ATOM   261  H H     . GLN A 1 16  ? -38.66453 -16.33832 -2.11492  1.000 40.29594  ? 16   GLN A H     1 
ATOM   262  H HA    . GLN A 1 16  ? -38.32390 -18.57695 -3.49269  1.000 37.74695  ? 16   GLN A HA    1 
ATOM   263  H HB2   . GLN A 1 16  ? -40.41337 -17.71178 -1.82904  1.000 37.78860  ? 16   GLN A HB2   1 
ATOM   264  H HB3   . GLN A 1 16  ? -40.54494 -19.06671 -2.64896  1.000 37.78860  ? 16   GLN A HB3   1 
ATOM   265  H HG2   . GLN A 1 16  ? -38.61886 -18.58105 -0.65253  1.000 49.84307  ? 16   GLN A HG2   1 
ATOM   266  H HG3   . GLN A 1 16  ? -39.87413 -19.54241 -0.49296  1.000 49.84307  ? 16   GLN A HG3   1 
ATOM   267  H HE21  . GLN A 1 16  ? -39.71127 -20.91542 -2.87811  1.000 54.32206  ? 16   GLN A HE21  1 
ATOM   268  H HE22  . GLN A 1 16  ? -38.49673 -21.77757 -2.89816  1.000 54.32206  ? 16   GLN A HE22  1 
ATOM   269  N N     . GLN A 1 17  ? -40.33497 -16.39929 -4.69070  1.000 29.85630  ? 17   GLN A N     1 
ATOM   270  C CA    . GLN A 1 17  ? -40.99102 -16.02080 -5.93796  1.000 34.25810  ? 17   GLN A CA    1 
ATOM   271  C C     . GLN A 1 17  ? -39.99327 -16.01330 -7.08911  1.000 30.54666  ? 17   GLN A C     1 
ATOM   272  O O     . GLN A 1 17  ? -40.26824 -16.54316 -8.17200  1.000 31.45853  ? 17   GLN A O     1 
ATOM   273  C CB    . GLN A 1 17  ? -41.65182 -14.65005 -5.79813  1.000 33.55204  ? 17   GLN A CB    1 
ATOM   274  C CG    . GLN A 1 17  ? -42.99712 -14.66262 -5.09516  1.000 36.89966  ? 17   GLN A CG    1 
ATOM   275  C CD    . GLN A 1 17  ? -43.64789 -13.28839 -5.06288  1.000 45.83233  ? 17   GLN A CD    1 
ATOM   276  O OE1   . GLN A 1 17  ? -43.42030 -12.45844 -5.94340  1.000 45.46699  ? 17   GLN A OE1   1 
ATOM   277  N NE2   . GLN A 1 17  ? -44.45726 -13.04159 -4.04040  1.000 57.00908  ? 17   GLN A NE2   1 
ATOM   278  H H     . GLN A 1 17  ? -40.36250 -15.80255 -4.07205  1.000 35.92727  ? 17   GLN A H     1 
ATOM   279  H HA    . GLN A 1 17  ? -41.68656 -16.66827 -6.13267  1.000 41.20943  ? 17   GLN A HA    1 
ATOM   280  H HB2   . GLN A 1 17  ? -41.06119 -14.07393 -5.28809  1.000 40.36216  ? 17   GLN A HB2   1 
ATOM   281  H HB3   . GLN A 1 17  ? -41.78927 -14.28241 -6.68518  1.000 40.36216  ? 17   GLN A HB3   1 
ATOM   282  H HG2   . GLN A 1 17  ? -43.59388 -15.26770 -5.56276  1.000 44.37930  ? 17   GLN A HG2   1 
ATOM   283  H HG3   . GLN A 1 17  ? -42.87416 -14.95936 -4.17989  1.000 44.37930  ? 17   GLN A HG3   1 
ATOM   284  H HE21  . GLN A 1 17  ? -44.58946 -13.64436 -3.44141  1.000 68.51061  ? 17   GLN A HE21  1 
ATOM   285  H HE22  . GLN A 1 17  ? -44.84952 -12.27890 -3.97685  1.000 68.51061  ? 17   GLN A HE22  1 
ATOM   286  N N     . HIS A 1 18  ? -38.82444 -15.40725 -6.86997  1.000 28.24376  ? 18   HIS A N     1 
ATOM   287  C CA    . HIS A 1 18  ? -37.78795 -15.39588 -7.89620  1.000 29.62967  ? 18   HIS A CA    1 
ATOM   288  C C     . HIS A 1 18  ? -37.27697 -16.80346 -8.17016  1.000 25.99569  ? 18   HIS A C     1 
ATOM   289  O O     . HIS A 1 18  ? -37.04073 -17.17071 -9.32656  1.000 23.96969  ? 18   HIS A O     1 
ATOM   290  C CB    . HIS A 1 18  ? -36.64800 -14.47602 -7.46078  1.000 31.35322  ? 18   HIS A CB    1 
ATOM   291  C CG    . HIS A 1 18  ? -35.51640 -14.39853 -8.43753  1.000 29.36317  ? 18   HIS A CG    1 
ATOM   292  N ND1   . HIS A 1 18  ? -34.46839 -15.29308 -8.43386  1.000 24.97203  ? 18   HIS A ND1   1 
ATOM   293  C CD2   . HIS A 1 18  ? -35.25739 -13.51974 -9.43448  1.000 24.93518  ? 18   HIS A CD2   1 
ATOM   294  C CE1   . HIS A 1 18  ? -33.61674 -14.97411 -9.39173  1.000 29.89382  ? 18   HIS A CE1   1 
ATOM   295  N NE2   . HIS A 1 18  ? -34.07247 -13.90216 -10.01429 1.000 30.05454  ? 18   HIS A NE2   1 
ATOM   296  H H     . HIS A 1 18  ? -38.61052 -15.00034 -6.14315  1.000 33.99222  ? 18   HIS A H     1 
ATOM   297  H HA    . HIS A 1 18  ? -38.15591 -15.04777 -8.72344  1.000 35.65532  ? 18   HIS A HA    1 
ATOM   298  H HB2   . HIS A 1 18  ? -36.99950 -13.57929 -7.34576  1.000 37.72357  ? 18   HIS A HB2   1 
ATOM   299  H HB3   . HIS A 1 18  ? -36.28971 -14.80222 -6.62047  1.000 37.72357  ? 18   HIS A HB3   1 
ATOM   300  H HD2   . HIS A 1 18  ? -35.78330 -12.79327 -9.68057  1.000 30.02193  ? 18   HIS A HD2   1 
ATOM   301  H HE1   . HIS A 1 18  ? -32.83004 -15.42723 -9.59346  1.000 35.97230  ? 18   HIS A HE1   1 
ATOM   302  H HE2   . HIS A 1 18  ? -33.68941 -13.50760 -10.67549 1.000 36.16516  ? 18   HIS A HE2   1 
ATOM   303  N N     . THR A 1 19  ? -37.11248 -17.61008 -7.12133  1.000 22.46672  ? 19   THR A N     1 
ATOM   304  C CA    . THR A 1 19  ? -36.67387 -18.98612 -7.31942  1.000 23.50709  ? 19   THR A CA    1 
ATOM   305  C C     . THR A 1 19  ? -37.70647 -19.77957 -8.10971  1.000 22.92641  ? 19   THR A C     1 
ATOM   306  O O     . THR A 1 19  ? -37.35211 -20.58790 -8.97638  1.000 28.26017  ? 19   THR A O     1 
ATOM   307  C CB    . THR A 1 19  ? -36.40860 -19.65243 -5.96863  1.000 23.38867  ? 19   THR A CB    1 
ATOM   308  O OG1   . THR A 1 19  ? -35.33647 -18.97892 -5.29443  1.000 26.75739  ? 19   THR A OG1   1 
ATOM   309  C CG2   . THR A 1 19  ? -36.04471 -21.11653 -6.15916  1.000 19.07605  ? 19   THR A CG2   1 
ATOM   310  H H     . THR A 1 19  ? -37.24590 -17.38811 -6.30125  1.000 27.05977  ? 19   THR A H     1 
ATOM   311  H HA    . THR A 1 19  ? -35.84356 -18.98202 -7.82087  1.000 28.30822  ? 19   THR A HA    1 
ATOM   312  H HB    . THR A 1 19  ? -37.20955 -19.60310 -5.42370  1.000 28.16612  ? 19   THR A HB    1 
ATOM   313  H HG1   . THR A 1 19  ? -35.55482 -18.18479 -5.12925  1.000 32.20858  ? 19   THR A HG1   1 
ATOM   314  H HG21  . THR A 1 19  ? -35.61474 -21.45828 -5.35964  1.000 22.39272  ? 19   THR A HG21  1 
ATOM   315  H HG22  . THR A 1 19  ? -36.84436 -21.63715 -6.33357  1.000 22.39272  ? 19   THR A HG22  1 
ATOM   316  H HG23  . THR A 1 19  ? -35.43686 -21.21245 -6.90897  1.000 22.39272  ? 19   THR A HG23  1 
ATOM   317  N N     . ALA A 1 20  ? -38.99212 -19.55685 -7.82610  1.000 31.88466  ? 20   ALA A N     1 
ATOM   318  C CA    . ALA A 1 20  ? -40.04733 -20.30477 -8.50030  1.000 22.97506  ? 20   ALA A CA    1 
ATOM   319  C C     . ALA A 1 20  ? -40.10903 -19.96102 -9.98165  1.000 29.85903  ? 20   ALA A C     1 
ATOM   320  O O     . ALA A 1 20  ? -40.32349 -20.84423 -10.82163 1.000 35.91272  ? 20   ALA A O     1 
ATOM   321  C CB    . ALA A 1 20  ? -41.39049 -20.02276 -7.83042  1.000 27.06202  ? 20   ALA A CB    1 
ATOM   322  H H     . ALA A 1 20  ? -39.27552 -18.98272 -7.25194  1.000 38.36130  ? 20   ALA A H     1 
ATOM   323  H HA    . ALA A 1 20  ? -39.85998 -21.25314 -8.42037  1.000 27.07153  ? 20   ALA A HA    1 
ATOM   324  H HB1   . ALA A 1 20  ? -42.08198 -20.53041 -8.28324  1.000 32.57414  ? 20   ALA A HB1   1 
ATOM   325  H HB2   . ALA A 1 20  ? -41.34093 -20.28904 -6.89900  1.000 32.57414  ? 20   ALA A HB2   1 
ATOM   326  H HB3   . ALA A 1 20  ? -41.58178 -19.07391 -7.89347  1.000 32.57414  ? 20   ALA A HB3   1 
ATOM   327  N N     . ARG A 1 21  ? -39.94267 -18.67946 -10.31785 1.000 29.11039  ? 21   ARG A N     1 
ATOM   328  C CA    . ARG A 1 21  ? -39.85606 -18.28013 -11.71886 1.000 30.25686  ? 21   ARG A CA    1 
ATOM   329  C C     . ARG A 1 21  ? -38.63357 -18.90025 -12.38433 1.000 27.32071  ? 21   ARG A C     1 
ATOM   330  O O     . ARG A 1 21  ? -38.71849 -19.44001 -13.49367 1.000 27.57528  ? 21   ARG A O     1 
ATOM   331  C CB    . ARG A 1 21  ? -39.80579 -16.75595 -11.82047 1.000 32.24427  ? 21   ARG A CB    1 
ATOM   332  C CG    . ARG A 1 21  ? -41.06709 -16.04837 -11.34386 1.000 39.61677  ? 21   ARG A CG    1 
ATOM   333  C CD    . ARG A 1 21  ? -42.21888 -16.20078 -12.33499 1.000 32.24939  ? 21   ARG A CD    1 
ATOM   334  N NE    . ARG A 1 21  ? -41.81561 -15.86221 -13.69486 1.000 36.77678  ? 21   ARG A NE    1 
ATOM   335  C CZ    . ARG A 1 21  ? -41.86978 -16.69257 -14.72861 1.000 41.99959  ? 21   ARG A CZ    1 
ATOM   336  N NH1   . ARG A 1 21  ? -42.38503 -17.90649 -14.61697 1.000 42.91575  ? 21   ARG A NH1   1 
ATOM   337  N NH2   . ARG A 1 21  ? -41.40318 -16.29069 -15.90705 1.000 52.35286  ? 21   ARG A NH2   1 
ATOM   338  H H     . ARG A 1 21  ? -39.87792 -18.02969 -9.75820  1.000 35.03218  ? 21   ARG A H     1 
ATOM   339  H HA    . ARG A 1 21  ? -40.64741 -18.59019 -12.18632 1.000 36.40794  ? 21   ARG A HA    1 
ATOM   340  H HB2   . ARG A 1 21  ? -39.06760 -16.43462 -11.27943 1.000 38.79283  ? 21   ARG A HB2   1 
ATOM   341  H HB3   . ARG A 1 21  ? -39.66686 -16.51284 -12.74918 1.000 38.79283  ? 21   ARG A HB3   1 
ATOM   342  H HG2   . ARG A 1 21  ? -41.34530 -16.42843 -10.49589 1.000 47.63983  ? 21   ARG A HG2   1 
ATOM   343  H HG3   . ARG A 1 21  ? -40.88182 -15.10208 -11.23846 1.000 47.63983  ? 21   ARG A HG3   1 
ATOM   344  H HD2   . ARG A 1 21  ? -42.52514 -17.12115 -12.32977 1.000 38.79897  ? 21   ARG A HD2   1 
ATOM   345  H HD3   . ARG A 1 21  ? -42.94271 -15.60881 -12.07707 1.000 38.79897  ? 21   ARG A HD3   1 
ATOM   346  H HE    . ARG A 1 21  ? -41.52134 -15.06676 -13.83723 1.000 44.23184  ? 21   ARG A HE    1 
ATOM   347  H HH11  . ARG A 1 21  ? -42.69519 -18.17411 -13.86080 1.000 51.59860  ? 21   ARG A HH11  1 
ATOM   348  H HH12  . ARG A 1 21  ? -42.40969 -18.42769 -15.30059 1.000 51.59860  ? 21   ARG A HH12  1 
ATOM   349  H HH21  . ARG A 1 21  ? -41.07176 -15.50167 -15.99192 1.000 62.92314  ? 21   ARG A HH21  1 
ATOM   350  H HH22  . ARG A 1 21  ? -41.43280 -16.81979 -16.58439 1.000 62.92314  ? 21   ARG A HH22  1 
ATOM   351  N N     . TRP A 1 22  ? -37.47973 -18.82092 -11.71824 1.000 25.03925  ? 22   TRP A N     1 
ATOM   352  C CA    . TRP A 1 22  ? -36.27584 -19.46419 -12.23009 1.000 23.70838  ? 22   TRP A CA    1 
ATOM   353  C C     . TRP A 1 22  ? -36.52253 -20.93699 -12.51803 1.000 22.70514  ? 22   TRP A C     1 
ATOM   354  O O     . TRP A 1 22  ? -36.08811 -21.45915 -13.54999 1.000 26.17636  ? 22   TRP A O     1 
ATOM   355  C CB    . TRP A 1 22  ? -35.14201 -19.30724 -11.21797 1.000 26.59326  ? 22   TRP A CB    1 
ATOM   356  C CG    . TRP A 1 22  ? -33.78756 -19.53750 -11.78291 1.000 22.82800  ? 22   TRP A CG    1 
ATOM   357  C CD1   . TRP A 1 22  ? -33.20780 -20.73864 -12.06500 1.000 22.40062  ? 22   TRP A CD1   1 
ATOM   358  C CD2   . TRP A 1 22  ? -32.82777 -18.53558 -12.12838 1.000 22.06745  ? 22   TRP A CD2   1 
ATOM   359  N NE1   . TRP A 1 22  ? -31.94370 -20.54685 -12.56820 1.000 19.11724  ? 22   TRP A NE1   1 
ATOM   360  C CE2   . TRP A 1 22  ? -31.68783 -19.20184 -12.62015 1.000 19.86223  ? 22   TRP A CE2   1 
ATOM   361  C CE3   . TRP A 1 22  ? -32.82164 -17.13873 -12.07024 1.000 22.93919  ? 22   TRP A CE3   1 
ATOM   362  C CZ2   . TRP A 1 22  ? -30.55247 -18.51935 -13.04886 1.000 25.11789  ? 22   TRP A CZ2   1 
ATOM   363  C CZ3   . TRP A 1 22  ? -31.69440 -16.46213 -12.50035 1.000 25.98303  ? 22   TRP A CZ3   1 
ATOM   364  C CH2   . TRP A 1 22  ? -30.57535 -17.15303 -12.98248 1.000 26.14710  ? 22   TRP A CH2   1 
ATOM   365  H H     . TRP A 1 22  ? -37.37047 -18.40372 -10.97419 1.000 30.14681  ? 22   TRP A H     1 
ATOM   366  H HA    . TRP A 1 22  ? -36.01168 -19.03307 -13.05789 1.000 28.54976  ? 22   TRP A HA    1 
ATOM   367  H HB2   . TRP A 1 22  ? -35.16399 -18.40415 -10.86463 1.000 32.01162  ? 22   TRP A HB2   1 
ATOM   368  H HB3   . TRP A 1 22  ? -35.27476 -19.94723 -10.50125 1.000 32.01162  ? 22   TRP A HB3   1 
ATOM   369  H HD1   . TRP A 1 22  ? -33.60949 -21.56738 -11.93566 1.000 26.98046  ? 22   TRP A HD1   1 
ATOM   370  H HE1   . TRP A 1 22  ? -31.40189 -21.16909 -12.81080 1.000 22.48168  ? 22   TRP A HE1   1 
ATOM   371  H HE3   . TRP A 1 22  ? -33.56032 -16.67393 -11.74897 1.000 27.62673  ? 22   TRP A HE3   1 
ATOM   372  H HZ2   . TRP A 1 22  ? -29.80713 -18.97482 -13.36810 1.000 30.24117  ? 22   TRP A HZ2   1 
ATOM   373  H HZ3   . TRP A 1 22  ? -31.67925 -15.53278 -12.46888 1.000 31.27935  ? 22   TRP A HZ3   1 
ATOM   374  H HH2   . TRP A 1 22  ? -29.83086 -16.67195 -13.26391 1.000 31.47623  ? 22   TRP A HH2   1 
ATOM   375  N N     . GLN A 1 23  ? -37.22186 -21.62283 -11.61127 1.000 23.52163  ? 23   GLN A N     1 
ATOM   376  C CA    . GLN A 1 23  ? -37.47464 -23.04867 -11.78658 1.000 26.82183  ? 23   GLN A CA    1 
ATOM   377  C C     . GLN A 1 23  ? -38.33208 -23.30347 -13.01708 1.000 32.69119  ? 23   GLN A C     1 
ATOM   378  O O     . GLN A 1 23  ? -38.14759 -24.30572 -13.71865 1.000 29.43018  ? 23   GLN A O     1 
ATOM   379  C CB    . GLN A 1 23  ? -38.15708 -23.61009 -10.53860 1.000 33.45757  ? 23   GLN A CB    1 
ATOM   380  C CG    . GLN A 1 23  ? -37.93947 -25.09599 -10.31058 1.000 44.63355  ? 23   GLN A CG    1 
ATOM   381  C CD    . GLN A 1 23  ? -38.94661 -25.69668 -9.33842  1.000 61.26643  ? 23   GLN A CD    1 
ATOM   382  O OE1   . GLN A 1 23  ? -40.15334 -25.46848 -9.45381  1.000 57.42002  ? 23   GLN A OE1   1 
ATOM   383  N NE2   . GLN A 1 23  ? -38.45299 -26.46866 -8.37575  1.000 58.78229  ? 23   GLN A NE2   1 
ATOM   384  H H     . GLN A 1 23  ? -37.55690 -21.28794 -10.89350 1.000 28.32567  ? 23   GLN A H     1 
ATOM   385  H HA    . GLN A 1 23  ? -36.62860 -23.50807 -11.90517 1.000 32.28590  ? 23   GLN A HA    1 
ATOM   386  H HB2   . GLN A 1 23  ? -37.81271 -23.14184 -9.76204  1.000 40.24879  ? 23   GLN A HB2   1 
ATOM   387  H HB3   . GLN A 1 23  ? -39.11268 -23.46351 -10.61762 1.000 40.24879  ? 23   GLN A HB3   1 
ATOM   388  H HG2   . GLN A 1 23  ? -38.02534 -25.56160 -11.15717 1.000 53.65997  ? 23   GLN A HG2   1 
ATOM   389  H HG3   . GLN A 1 23  ? -37.05143 -25.23299 -9.94518  1.000 53.65997  ? 23   GLN A HG3   1 
ATOM   390  H HE21  . GLN A 1 23  ? -37.60541 -26.60576 -8.32665  1.000 70.63846  ? 23   GLN A HE21  1 
ATOM   391  H HE22  . GLN A 1 23  ? -38.98116 -26.83110 -7.80193  1.000 70.63846  ? 23   GLN A HE22  1 
ATOM   392  N N     . HIS A 1 24  ? -39.27823 -22.40436 -13.29361 1.000 31.75394  ? 24   HIS A N     1 
ATOM   393  C CA    . HIS A 1 24  ? -40.16620 -22.59331 -14.43416 1.000 42.96080  ? 24   HIS A CA    1 
ATOM   394  C C     . HIS A 1 24  ? -39.43264 -22.36697 -15.75055 1.000 36.08419  ? 24   HIS A C     1 
ATOM   395  O O     . HIS A 1 24  ? -39.61062 -23.13292 -16.70485 1.000 33.03397  ? 24   HIS A O     1 
ATOM   396  C CB    . HIS A 1 24  ? -41.36672 -21.65401 -14.31779 1.000 40.15084  ? 24   HIS A CB    1 
ATOM   397  C CG    . HIS A 1 24  ? -42.40845 -21.87579 -15.36847 1.000 49.60507  ? 24   HIS A CG    1 
ATOM   398  N ND1   . HIS A 1 24  ? -42.85622 -20.87072 -16.19838 1.000 46.18226  ? 24   HIS A ND1   1 
ATOM   399  C CD2   . HIS A 1 24  ? -43.08346 -22.99190 -15.73094 1.000 49.75222  ? 24   HIS A CD2   1 
ATOM   400  C CE1   . HIS A 1 24  ? -43.76637 -21.35675 -17.02304 1.000 49.31384  ? 24   HIS A CE1   1 
ATOM   401  N NE2   . HIS A 1 24  ? -43.92284 -22.64162 -16.76003 1.000 60.58576  ? 24   HIS A NE2   1 
ATOM   402  H H     . HIS A 1 24  ? -39.42330 -21.68714 -12.84177 1.000 38.20443  ? 24   HIS A H     1 
ATOM   403  H HA    . HIS A 1 24  ? -40.49457 -23.50603 -14.42946 1.000 51.65267  ? 24   HIS A HA    1 
ATOM   404  H HB2   . HIS A 1 24  ? -41.78506 -21.78800 -13.45295 1.000 48.28072  ? 24   HIS A HB2   1 
ATOM   405  H HB3   . HIS A 1 24  ? -41.05566 -20.73872 -14.39762 1.000 48.28072  ? 24   HIS A HB3   1 
ATOM   406  H HD2   . HIS A 1 24  ? -42.99532 -23.83740 -15.35377 1.000 59.80238  ? 24   HIS A HD2   1 
ATOM   407  H HE1   . HIS A 1 24  ? -44.21982 -20.87609 -17.67745 1.000 59.27632  ? 24   HIS A HE1   1 
ATOM   408  H HE2   . HIS A 1 24  ? -44.46284 -23.17284 -17.16721 1.000 72.80262  ? 24   HIS A HE2   1 
ATOM   409  N N     . GLU A 1 25  ? -38.59951 -21.32607 -15.81989 1.000 31.39272  ? 25   GLU A N     1 
ATOM   410  C CA    . GLU A 1 25  ? -37.90055 -21.01264 -17.06123 1.000 32.73673  ? 25   GLU A CA    1 
ATOM   411  C C     . GLU A 1 25  ? -36.66794 -21.89186 -17.25672 1.000 33.27914  ? 25   GLU A C     1 
ATOM   412  O O     . GLU A 1 25  ? -36.35177 -22.27593 -18.38905 1.000 30.18207  ? 25   GLU A O     1 
ATOM   413  C CB    . GLU A 1 25  ? -37.50808 -19.53331 -17.07753 1.000 28.35508  ? 25   GLU A CB    1 
ATOM   414  C CG    . GLU A 1 25  ? -38.68300 -18.56992 -16.92120 1.000 40.56622  ? 25   GLU A CG    1 
ATOM   415  C CD    . GLU A 1 25  ? -39.64749 -18.60664 -18.09735 1.000 43.21108  ? 25   GLU A CD    1 
ATOM   416  O OE1   . GLU A 1 25  ? -39.20691 -18.90233 -19.22545 1.000 35.44385  ? 25   GLU A OE1   1 
ATOM   417  O OE2   . GLU A 1 25  ? -40.85054 -18.33911 -17.89186 1.000 47.68314  ? 25   GLU A OE2   1 
ATOM   418  H H     . GLU A 1 25  ? -38.42494 -20.79275 -15.16820 1.000 37.77097  ? 25   GLU A H     1 
ATOM   419  H HA    . GLU A 1 25  ? -38.50086 -21.17607 -17.80542 1.000 39.38379  ? 25   GLU A HA    1 
ATOM   420  H HB2   . GLU A 1 25  ? -36.89307 -19.36793 -16.34587 1.000 34.12580  ? 25   GLU A HB2   1 
ATOM   421  H HB3   . GLU A 1 25  ? -37.07724 -19.33646 -17.92401 1.000 34.12580  ? 25   GLU A HB3   1 
ATOM   422  H HG2   . GLU A 1 25  ? -39.17878 -18.80561 -16.12148 1.000 48.77917  ? 25   GLU A HG2   1 
ATOM   423  H HG3   . GLU A 1 25  ? -38.34031 -17.66570 -16.84466 1.000 48.77917  ? 25   GLU A HG3   1 
ATOM   424  N N     . LEU A 1 26  ? -35.96318 -22.22185 -16.17465 1.000 36.08023  ? 26   LEU A N     1 
ATOM   425  C CA    . LEU A 1 26  ? -34.72926 -23.00785 -16.22947 1.000 32.32494  ? 26   LEU A CA    1 
ATOM   426  C C     . LEU A 1 26  ? -34.85901 -24.19522 -15.28484 1.000 30.21384  ? 26   LEU A C     1 
ATOM   427  O O     . LEU A 1 26  ? -34.13976 -24.29629 -14.28240 1.000 32.69327  ? 26   LEU A O     1 
ATOM   428  C CB    . LEU A 1 26  ? -33.51628 -22.14977 -15.86703 1.000 23.52807  ? 26   LEU A CB    1 
ATOM   429  C CG    . LEU A 1 26  ? -33.20571 -20.99324 -16.81973 1.000 29.01009  ? 26   LEU A CG    1 
ATOM   430  C CD1   . LEU A 1 26  ? -32.26177 -19.98588 -16.17470 1.000 23.29931  ? 26   LEU A CD1   1 
ATOM   431  C CD2   . LEU A 1 26  ? -32.61701 -21.52023 -18.12295 1.000 30.75591  ? 26   LEU A CD2   1 
ATOM   432  H H     . LEU A 1 26  ? -36.18587 -21.99567 -15.37537 1.000 43.39599  ? 26   LEU A H     1 
ATOM   433  H HA    . LEU A 1 26  ? -34.60600 -23.34527 -17.13050 1.000 38.88963  ? 26   LEU A HA    1 
ATOM   434  H HB2   . LEU A 1 26  ? -33.66841 -21.76613 -14.98921 1.000 28.33339  ? 26   LEU A HB2   1 
ATOM   435  H HB3   . LEU A 1 26  ? -32.73458 -22.72375 -15.84730 1.000 28.33339  ? 26   LEU A HB3   1 
ATOM   436  H HG    . LEU A 1 26  ? -34.03328 -20.53006 -17.02346 1.000 34.91182  ? 26   LEU A HG    1 
ATOM   437  H HD11  . LEU A 1 26  ? -32.07846 -19.27441 -16.80804 1.000 28.05888  ? 26   LEU A HD11  1 
ATOM   438  H HD12  . LEU A 1 26  ? -32.68340 -19.62147 -15.38077 1.000 28.05888  ? 26   LEU A HD12  1 
ATOM   439  H HD13  . LEU A 1 26  ? -31.43655 -20.43542 -15.93425 1.000 28.05888  ? 26   LEU A HD13  1 
ATOM   440  H HD21  . LEU A 1 26  ? -32.40891 -20.77006 -18.70161 1.000 37.00680  ? 26   LEU A HD21  1 
ATOM   441  H HD22  . LEU A 1 26  ? -31.80926 -22.01965 -17.92542 1.000 37.00680  ? 26   LEU A HD22  1 
ATOM   442  H HD23  . LEU A 1 26  ? -33.26690 -22.09858 -18.55197 1.000 37.00680  ? 26   LEU A HD23  1 
ATOM   443  N N     . PRO A 1 27  ? -35.77271 -25.12109 -15.58072 1.000 29.07695  ? 27   PRO A N     1 
ATOM   444  C CA    . PRO A 1 27  ? -35.99925 -26.24702 -14.65862 1.000 33.38694  ? 27   PRO A CA    1 
ATOM   445  C C     . PRO A 1 27  ? -34.80054 -27.16325 -14.50823 1.000 32.26632  ? 27   PRO A C     1 
ATOM   446  O O     . PRO A 1 27  ? -34.73878 -27.91748 -13.52948 1.000 34.03281  ? 27   PRO A O     1 
ATOM   447  C CB    . PRO A 1 27  ? -37.19244 -26.98439 -15.28637 1.000 28.80393  ? 27   PRO A CB    1 
ATOM   448  C CG    . PRO A 1 27  ? -37.15865 -26.59785 -16.74042 1.000 27.99326  ? 27   PRO A CG    1 
ATOM   449  C CD    . PRO A 1 27  ? -36.63296 -25.18955 -16.77719 1.000 35.19788  ? 27   PRO A CD    1 
ATOM   450  H HA    . PRO A 1 27  ? -36.25441 -25.91099 -13.78519 1.000 40.16404  ? 27   PRO A HA    1 
ATOM   451  H HB2   . PRO A 1 27  ? -37.08413 -27.94222 -15.17814 1.000 34.66443  ? 27   PRO A HB2   1 
ATOM   452  H HB3   . PRO A 1 27  ? -38.01826 -26.69454 -14.86816 1.000 34.66443  ? 27   PRO A HB3   1 
ATOM   453  H HG2   . PRO A 1 27  ? -36.56985 -27.19735 -17.22499 1.000 33.69162  ? 27   PRO A HG2   1 
ATOM   454  H HG3   . PRO A 1 27  ? -38.05388 -26.64043 -17.11142 1.000 33.69162  ? 27   PRO A HG3   1 
ATOM   455  H HD2   . PRO A 1 27  ? -36.11675 -25.03410 -17.58358 1.000 42.33716  ? 27   PRO A HD2   1 
ATOM   456  H HD3   . PRO A 1 27  ? -37.35824 -24.54810 -16.71877 1.000 42.33716  ? 27   PRO A HD3   1 
ATOM   457  N N     . ASP A 1 28  ? -33.84718 -27.12404 -15.43726 1.000 32.00085  ? 28   ASP A N     1 
ATOM   458  C CA    . ASP A 1 28  ? -32.68655 -28.00310 -15.40357 1.000 37.29856  ? 28   ASP A CA    1 
ATOM   459  C C     . ASP A 1 28  ? -31.40776 -27.27762 -15.00085 1.000 33.21713  ? 28   ASP A C     1 
ATOM   460  O O     . ASP A 1 28  ? -30.31996 -27.85141 -15.11647 1.000 32.77888  ? 28   ASP A O     1 
ATOM   461  C CB    . ASP A 1 28  ? -32.49623 -28.67001 -16.76935 1.000 46.49272  ? 28   ASP A CB    1 
ATOM   462  C CG    . ASP A 1 28  ? -33.74006 -29.40163 -17.24199 1.000 50.54337  ? 28   ASP A CG    1 
ATOM   463  O OD1   . ASP A 1 28  ? -34.37078 -30.09998 -16.41990 1.000 45.71197  ? 28   ASP A OD1   1 
ATOM   464  O OD2   . ASP A 1 28  ? -34.08944 -29.27285 -18.43617 1.000 51.06690  ? 28   ASP A OD2   1 
ATOM   465  H H     . ASP A 1 28  ? -33.85289 -26.58600 -16.10814 1.000 38.50073  ? 28   ASP A H     1 
ATOM   466  H HA    . ASP A 1 28  ? -32.84936 -28.69668 -14.74528 1.000 44.85799  ? 28   ASP A HA    1 
ATOM   467  H HB2   . ASP A 1 28  ? -32.28014 -27.98980 -17.42625 1.000 55.89097  ? 28   ASP A HB2   1 
ATOM   468  H HB3   . ASP A 1 28  ? -31.77364 -29.31431 -16.70892 1.000 55.89097  ? 28   ASP A HB3   1 
ATOM   469  N N     . LEU A 1 29  ? -31.50595 -26.03253 -14.53404 1.000 30.80190  ? 29   LEU A N     1 
ATOM   470  C CA    . LEU A 1 29  ? -30.32174 -25.28322 -14.11498 1.000 29.50324  ? 29   LEU A CA    1 
ATOM   471  C C     . LEU A 1 29  ? -30.72525 -24.39787 -12.93945 1.000 26.22014  ? 29   LEU A C     1 
ATOM   472  O O     . LEU A 1 29  ? -31.31404 -23.33020 -13.13585 1.000 29.55014  ? 29   LEU A O     1 
ATOM   473  C CB    . LEU A 1 29  ? -29.75635 -24.46302 -15.26485 1.000 26.40452  ? 29   LEU A CB    1 
ATOM   474  C CG    . LEU A 1 29  ? -28.40150 -23.80112 -15.01825 1.000 22.73639  ? 29   LEU A CG    1 
ATOM   475  C CD1   . LEU A 1 29  ? -27.30361 -24.83768 -14.85270 1.000 26.78860  ? 29   LEU A CD1   1 
ATOM   476  C CD2   . LEU A 1 29  ? -28.06777 -22.84813 -16.15527 1.000 29.15292  ? 29   LEU A CD2   1 
ATOM   477  H H     . LEU A 1 29  ? -32.24509 -25.60091 -14.45055 1.000 37.06199  ? 29   LEU A H     1 
ATOM   478  H HA    . LEU A 1 29  ? -29.64021 -25.90380 -13.81282 1.000 35.50359  ? 29   LEU A HA    1 
ATOM   479  H HB2   . LEU A 1 29  ? -29.65378 -25.04862 -16.03131 1.000 31.78514  ? 29   LEU A HB2   1 
ATOM   480  H HB3   . LEU A 1 29  ? -30.38763 -23.75568 -15.46989 1.000 31.78514  ? 29   LEU A HB3   1 
ATOM   481  H HG    . LEU A 1 29  ? -28.44936 -23.29341 -14.19312 1.000 27.38338  ? 29   LEU A HG    1 
ATOM   482  H HD11  . LEU A 1 29  ? -26.44951 -24.38393 -14.77835 1.000 32.24603  ? 29   LEU A HD11  1 
ATOM   483  H HD12  . LEU A 1 29  ? -27.47504 -25.35374 -14.04946 1.000 32.24603  ? 29   LEU A HD12  1 
ATOM   484  H HD13  . LEU A 1 29  ? -27.30150 -25.42188 -15.62704 1.000 32.24603  ? 29   LEU A HD13  1 
ATOM   485  H HD21  . LEU A 1 29  ? -27.19765 -22.45236 -15.99051 1.000 35.08321  ? 29   LEU A HD21  1 
ATOM   486  H HD22  . LEU A 1 29  ? -28.05317 -23.34391 -16.98887 1.000 35.08321  ? 29   LEU A HD22  1 
ATOM   487  H HD23  . LEU A 1 29  ? -28.74457 -22.15439 -16.19482 1.000 35.08321  ? 29   LEU A HD23  1 
ATOM   488  N N     . THR A 1 30  ? -30.40355 -24.84656 -11.72903 1.000 29.29846  ? 30   THR A N     1 
ATOM   489  C CA    . THR A 1 30  ? -30.73042 -24.08559 -10.53608 1.000 24.20565  ? 30   THR A CA    1 
ATOM   490  C C     . THR A 1 30  ? -29.87219 -22.82635 -10.45560 1.000 21.12052  ? 30   THR A C     1 
ATOM   491  O O     . THR A 1 30  ? -28.87107 -22.67200 -11.15913 1.000 29.77472  ? 30   THR A O     1 
ATOM   492  C CB    . THR A 1 30  ? -30.51118 -24.92335 -9.27898  1.000 25.95997  ? 30   THR A CB    1 
ATOM   493  O OG1   . THR A 1 30  ? -29.10900 -25.16584 -9.10852  1.000 30.52471  ? 30   THR A OG1   1 
ATOM   494  C CG2   . THR A 1 30  ? -31.23826 -26.24761 -9.38301  1.000 30.12705  ? 30   THR A CG2   1 
ATOM   495  H H     . THR A 1 30  ? -29.99625 -25.58823 -11.57529 1.000 35.25787  ? 30   THR A H     1 
ATOM   496  H HA    . THR A 1 30  ? -31.66536 -23.83083 -10.57945 1.000 29.14649  ? 30   THR A HA    1 
ATOM   497  H HB    . THR A 1 30  ? -30.85769 -24.44684 -8.50842  1.000 31.25167  ? 30   THR A HB    1 
ATOM   498  H HG1   . THR A 1 30  ? -28.97949 -25.63253 -8.42221  1.000 36.72936  ? 30   THR A HG1   1 
ATOM   499  H HG21  . THR A 1 30  ? -31.20588 -26.71163 -8.53181  1.000 36.25217  ? 30   THR A HG21  1 
ATOM   500  H HG22  . THR A 1 30  ? -32.16563 -26.09878 -9.62533  1.000 36.25217  ? 30   THR A HG22  1 
ATOM   501  H HG23  . THR A 1 30  ? -30.82113 -26.80280 -10.06026 1.000 36.25217  ? 30   THR A HG23  1 
ATOM   502  N N     . LYS A 1 31  ? -30.27317 -21.91815 -9.57080  1.000 25.44464  ? 31   LYS A N     1 
ATOM   503  C CA    . LYS A 1 31  ? -29.48918 -20.70231 -9.36868  1.000 27.74868  ? 31   LYS A CA    1 
ATOM   504  C C     . LYS A 1 31  ? -28.09151 -21.00962 -8.85116  1.000 28.09012  ? 31   LYS A C     1 
ATOM   505  O O     . LYS A 1 31  ? -27.12117 -20.42374 -9.36519  1.000 24.51070  ? 31   LYS A O     1 
ATOM   506  C CB    . LYS A 1 31  ? -30.24670 -19.75792 -8.42986  1.000 23.40344  ? 31   LYS A CB    1 
ATOM   507  C CG    . LYS A 1 31  ? -30.97843 -18.62624 -9.15032  1.000 29.45197  ? 31   LYS A CG    1 
ATOM   508  C CD    . LYS A 1 31  ? -32.38908 -18.40248 -8.60902  1.000 28.93740  ? 31   LYS A CD    1 
ATOM   509  C CE    . LYS A 1 31  ? -32.38998 -18.14675 -7.11494  1.000 32.79375  ? 31   LYS A CE    1 
ATOM   510  N NZ    . LYS A 1 31  ? -33.57303 -17.35552 -6.69101  1.000 25.89177  ? 31   LYS A NZ    1 
ATOM   511  H H     . LYS A 1 31  ? -30.97982 -21.97886 -9.08442  1.000 30.63328  ? 31   LYS A H     1 
ATOM   512  H HA    . LYS A 1 31  ? -29.39452 -20.25410 -10.22369 1.000 33.39813  ? 31   LYS A HA    1 
ATOM   513  H HB2   . LYS A 1 31  ? -30.90685 -20.27106 -7.93814  1.000 28.18384  ? 31   LYS A HB2   1 
ATOM   514  H HB3   . LYS A 1 31  ? -29.61335 -19.35616 -7.81476  1.000 28.18384  ? 31   LYS A HB3   1 
ATOM   515  H HG2   . LYS A 1 31  ? -30.47894 -17.80254 -9.03668  1.000 35.44207  ? 31   LYS A HG2   1 
ATOM   516  H HG3   . LYS A 1 31  ? -31.04942 -18.84384 -10.09293 1.000 35.44207  ? 31   LYS A HG3   1 
ATOM   517  H HD2   . LYS A 1 31  ? -32.78123 -17.63168 -9.04833  1.000 34.82459  ? 31   LYS A HD2   1 
ATOM   518  H HD3   . LYS A 1 31  ? -32.92625 -19.19154 -8.78144  1.000 34.82459  ? 31   LYS A HD3   1 
ATOM   519  H HE2   . LYS A 1 31  ? -32.40792 -18.99523 -6.64518  1.000 39.45221  ? 31   LYS A HE2   1 
ATOM   520  H HE3   . LYS A 1 31  ? -31.59137 -17.65136 -6.87470  1.000 39.45221  ? 31   LYS A HE3   1 
ATOM   521  H HZ1   . LYS A 1 31  ? -33.38294 -16.48643 -6.71631  1.000 31.16984  ? 31   LYS A HZ1   1 
ATOM   522  H HZ2   . LYS A 1 31  ? -34.25834 -17.51726 -7.23533  1.000 31.16984  ? 31   LYS A HZ2   1 
ATOM   523  H HZ3   . LYS A 1 31  ? -33.80528 -17.57634 -5.86071  1.000 31.16984  ? 31   LYS A HZ3   1 
ATOM   524  N N     . PRO A 1 32  ? -27.90568 -21.88783 -7.86132  1.000 26.02740  ? 32   PRO A N     1 
ATOM   525  C CA    . PRO A 1 32  ? -26.53157 -22.23280 -7.45645  1.000 23.41588  ? 32   PRO A CA    1 
ATOM   526  C C     . PRO A 1 32  ? -25.72994 -22.87908 -8.57207  1.000 26.77772  ? 32   PRO A C     1 
ATOM   527  O O     . PRO A 1 32  ? -24.54079 -22.57703 -8.72851  1.000 30.53637  ? 32   PRO A O     1 
ATOM   528  C CB    . PRO A 1 32  ? -26.74145 -23.18749 -6.27053  1.000 23.50264  ? 32   PRO A CB    1 
ATOM   529  C CG    . PRO A 1 32  ? -28.11919 -22.87248 -5.76295  1.000 20.71953  ? 32   PRO A CG    1 
ATOM   530  C CD    . PRO A 1 32  ? -28.91803 -22.49074 -6.97436  1.000 23.92162  ? 32   PRO A CD    1 
ATOM   531  H HA    . PRO A 1 32  ? -26.06961 -21.43879 -7.14495  1.000 28.19876  ? 32   PRO A HA    1 
ATOM   532  H HB2   . PRO A 1 32  ? -26.68392 -24.10757 -6.57226  1.000 28.30288  ? 32   PRO A HB2   1 
ATOM   533  H HB3   . PRO A 1 32  ? -26.07267 -23.01965 -5.58829  1.000 28.30288  ? 32   PRO A HB3   1 
ATOM   534  H HG2   . PRO A 1 32  ? -28.49769 -23.65553 -5.33345  1.000 24.96315  ? 32   PRO A HG2   1 
ATOM   535  H HG3   . PRO A 1 32  ? -28.07637 -22.13646 -5.13260  1.000 24.96315  ? 32   PRO A HG3   1 
ATOM   536  H HD2   . PRO A 1 32  ? -29.31804 -23.27260 -7.38618  1.000 28.80566  ? 32   PRO A HD2   1 
ATOM   537  H HD3   . PRO A 1 32  ? -29.60674 -21.84680 -6.74651  1.000 28.80566  ? 32   PRO A HD3   1 
ATOM   538  N N     . GLN A 1 33  ? -26.34515 -23.76755 -9.35534  1.000 24.88658  ? 33   GLN A N     1 
ATOM   539  C CA    . GLN A 1 33  ? -25.64766 -24.34042 -10.50201 1.000 22.99411  ? 33   GLN A CA    1 
ATOM   540  C C     . GLN A 1 33  ? -25.27077 -23.25137 -11.49771 1.000 22.32802  ? 33   GLN A C     1 
ATOM   541  O O     . GLN A 1 33  ? -24.13709 -23.20079 -11.98817 1.000 24.77295  ? 33   GLN A O     1 
ATOM   542  C CB    . GLN A 1 33  ? -26.52103 -25.40287 -11.16976 1.000 28.86068  ? 33   GLN A CB    1 
ATOM   543  C CG    . GLN A 1 33  ? -26.69917 -26.67357 -10.35245 1.000 31.64505  ? 33   GLN A CG    1 
ATOM   544  C CD    . GLN A 1 33  ? -27.82137 -27.55236 -10.87738 1.000 37.33061  ? 33   GLN A CD    1 
ATOM   545  O OE1   . GLN A 1 33  ? -28.58200 -27.14941 -11.75716 1.000 34.14755  ? 33   GLN A OE1   1 
ATOM   546  N NE2   . GLN A 1 33  ? -27.93164 -28.75900 -10.33392 1.000 51.57969  ? 33   GLN A NE2   1 
ATOM   547  H H     . GLN A 1 33  ? -27.15037 -24.04885 -9.24536  1.000 29.96360  ? 33   GLN A H     1 
ATOM   548  H HA    . GLN A 1 33  ? -24.83455 -24.77196 -10.19619 1.000 27.69264  ? 33   GLN A HA    1 
ATOM   549  H HB2   . GLN A 1 33  ? -27.40192 -25.02712 -11.32387 1.000 34.73253  ? 33   GLN A HB2   1 
ATOM   550  H HB3   . GLN A 1 33  ? -26.11411 -25.65177 -12.01437 1.000 34.73253  ? 33   GLN A HB3   1 
ATOM   551  H HG2   . GLN A 1 33  ? -25.87662 -27.18687 -10.38163 1.000 38.07377  ? 33   GLN A HG2   1 
ATOM   552  H HG3   . GLN A 1 33  ? -26.90843 -26.43406 -9.43608  1.000 38.07377  ? 33   GLN A HG3   1 
ATOM   553  H HE21  . GLN A 1 33  ? -27.38347 -29.00526 -9.71872  1.000 61.99534  ? 33   GLN A HE21  1 
ATOM   554  H HE22  . GLN A 1 33  ? -28.55121 -29.29419 -10.59718 1.000 61.99534  ? 33   GLN A HE22  1 
ATOM   555  N N     . TYR A 1 34  ? -26.21784 -22.36157 -11.79812 1.000 29.75856  ? 34   TYR A N     1 
ATOM   556  C CA    . TYR A 1 34  ? -25.96419 -21.26684 -12.72913 1.000 25.34233  ? 34   TYR A CA    1 
ATOM   557  C C     . TYR A 1 34  ? -24.81096 -20.39438 -12.25057 1.000 27.01424  ? 34   TYR A C     1 
ATOM   558  O O     . TYR A 1 34  ? -23.89110 -20.08447 -13.01681 1.000 25.52467  ? 34   TYR A O     1 
ATOM   559  C CB    . TYR A 1 34  ? -27.24744 -20.45065 -12.89484 1.000 23.61052  ? 34   TYR A CB    1 
ATOM   560  C CG    . TYR A 1 34  ? -27.10767 -19.16835 -13.68010 1.000 30.63642  ? 34   TYR A CG    1 
ATOM   561  C CD1   . TYR A 1 34  ? -26.98620 -19.18525 -15.06191 1.000 26.70685  ? 34   TYR A CD1   1 
ATOM   562  C CD2   . TYR A 1 34  ? -27.12921 -17.93665 -13.03934 1.000 29.03324  ? 34   TYR A CD2   1 
ATOM   563  C CE1   . TYR A 1 34  ? -26.87192 -18.01044 -15.78317 1.000 30.18442  ? 34   TYR A CE1   1 
ATOM   564  C CE2   . TYR A 1 34  ? -27.01728 -16.75764 -13.75080 1.000 28.32394  ? 34   TYR A CE2   1 
ATOM   565  C CZ    . TYR A 1 34  ? -26.89256 -16.79800 -15.12230 1.000 31.68813  ? 34   TYR A CZ    1 
ATOM   566  O OH    . TYR A 1 34  ? -26.77699 -15.61979 -15.83189 1.000 27.25720  ? 34   TYR A OH    1 
ATOM   567  H H     . TYR A 1 34  ? -27.01520 -22.37028 -11.47603 1.000 35.80998  ? 34   TYR A H     1 
ATOM   568  H HA    . TYR A 1 34  ? -25.71333 -21.62437 -13.59524 1.000 30.51050  ? 34   TYR A HA    1 
ATOM   569  H HB2   . TYR A 1 34  ? -27.90109 -21.00044 -13.35460 1.000 28.43233  ? 34   TYR A HB2   1 
ATOM   570  H HB3   . TYR A 1 34  ? -27.57436 -20.21431 -12.01271 1.000 28.43233  ? 34   TYR A HB3   1 
ATOM   571  H HD1   . TYR A 1 34  ? -26.98151 -19.99978 -15.51071 1.000 32.14793  ? 34   TYR A HD1   1 
ATOM   572  H HD2   . TYR A 1 34  ? -27.22064 -17.90477 -12.11440 1.000 34.93960  ? 34   TYR A HD2   1 
ATOM   573  H HE1   . TYR A 1 34  ? -26.78166 -18.03695 -16.70840 1.000 36.32101  ? 34   TYR A HE1   1 
ATOM   574  H HE2   . TYR A 1 34  ? -27.02609 -15.94086 -13.30617 1.000 34.08844  ? 34   TYR A HE2   1 
ATOM   575  H HH    . TYR A 1 34  ? -26.81867 -14.96400 -15.30863 1.000 32.80835  ? 34   TYR A HH    1 
ATOM   576  N N     . ALA A 1 35  ? -24.83706 -19.99837 -10.97699 1.000 26.31864  ? 35   ALA A N     1 
ATOM   577  C CA    . ALA A 1 35  ? -23.78591 -19.13525 -10.45008 1.000 28.85346  ? 35   ALA A CA    1 
ATOM   578  C C     . ALA A 1 35  ? -22.42967 -19.82786 -10.48812 1.000 27.72834  ? 35   ALA A C     1 
ATOM   579  O O     . ALA A 1 35  ? -21.41956 -19.21532 -10.85289 1.000 28.04881  ? 35   ALA A O     1 
ATOM   580  C CB    . ALA A 1 35  ? -24.13060 -18.70919 -9.02280  1.000 30.32644  ? 35   ALA A CB    1 
ATOM   581  H H     . ALA A 1 35  ? -25.44392 -20.21295 -10.40666 1.000 31.68208  ? 35   ALA A H     1 
ATOM   582  H HA    . ALA A 1 35  ? -23.72966 -18.33809 -10.99987 1.000 34.72386  ? 35   ALA A HA    1 
ATOM   583  H HB1   . ALA A 1 35  ? -23.42099 -18.14220 -8.68240  1.000 36.49143  ? 35   ALA A HB1   1 
ATOM   584  H HB2   . ALA A 1 35  ? -24.96845 -18.22050 -9.03274  1.000 36.49143  ? 35   ALA A HB2   1 
ATOM   585  H HB3   . ALA A 1 35  ? -24.21597 -19.50084 -8.46882  1.000 36.49143  ? 35   ALA A HB3   1 
ATOM   586  N N     . VAL A 1 36  ? -22.38235 -21.10198 -10.10113 1.000 28.20769  ? 36   VAL A N     1 
ATOM   587  C CA    . VAL A 1 36  ? -21.13099 -21.84829 -10.17664 1.000 24.67182  ? 36   VAL A CA    1 
ATOM   588  C C     . VAL A 1 36  ? -20.59043 -21.82122 -11.60160 1.000 31.88835  ? 36   VAL A C     1 
ATOM   589  O O     . VAL A 1 36  ? -19.41778 -21.50376 -11.83404 1.000 29.51994  ? 36   VAL A O     1 
ATOM   590  C CB    . VAL A 1 36  ? -21.33801 -23.28834 -9.67382  1.000 31.19237  ? 36   VAL A CB    1 
ATOM   591  C CG1   . VAL A 1 36  ? -20.15091 -24.16421 -10.04417 1.000 31.94273  ? 36   VAL A CG1   1 
ATOM   592  C CG2   . VAL A 1 36  ? -21.55499 -23.29647 -8.16592  1.000 28.26426  ? 36   VAL A CG2   1 
ATOM   593  H H     . VAL A 1 36  ? -23.05031 -21.54963 -9.79610  1.000 33.94894  ? 36   VAL A H     1 
ATOM   594  H HA    . VAL A 1 36  ? -20.47668 -21.42269 -9.60075  1.000 29.70589  ? 36   VAL A HA    1 
ATOM   595  H HB    . VAL A 1 36  ? -22.12771 -23.65664 -10.10001 1.000 37.53055  ? 36   VAL A HB    1 
ATOM   596  H HG11  . VAL A 1 36  ? -20.15580 -24.95611 -9.48402  1.000 38.43099  ? 36   VAL A HG11  1 
ATOM   597  H HG12  . VAL A 1 36  ? -20.22508 -24.41862 -10.97727 1.000 38.43099  ? 36   VAL A HG12  1 
ATOM   598  H HG13  . VAL A 1 36  ? -19.33242 -23.66346 -9.90191  1.000 38.43099  ? 36   VAL A HG13  1 
ATOM   599  H HG21  . VAL A 1 36  ? -21.79400 -24.19395 -7.88609  1.000 34.01682  ? 36   VAL A HG21  1 
ATOM   600  H HG22  . VAL A 1 36  ? -20.73493 -23.02063 -7.72737  1.000 34.01682  ? 36   VAL A HG22  1 
ATOM   601  H HG23  . VAL A 1 36  ? -22.27095 -22.67989 -7.94655  1.000 34.01682  ? 36   VAL A HG23  1 
ATOM   602  N N     . MET A 1 37  ? -21.44736 -22.12971 -12.58026 1.000 26.02186  ? 37   MET A N     1 
ATOM   603  C CA    . MET A 1 37  ? -20.99399 -22.19415 -13.96668 1.000 35.84400  ? 37   MET A CA    1 
ATOM   604  C C     . MET A 1 37  ? -20.46032 -20.84740 -14.44283 1.000 30.97077  ? 37   MET A C     1 
ATOM   605  O O     . MET A 1 37  ? -19.47669 -20.79247 -15.19134 1.000 37.03744  ? 37   MET A O     1 
ATOM   606  C CB    . MET A 1 37  ? -22.13201 -22.67107 -14.87279 1.000 32.58384  ? 37   MET A CB    1 
ATOM   607  C CG    . MET A 1 37  ? -22.47776 -24.14662 -14.70998 1.000 31.87774  ? 37   MET A CG    1 
ATOM   608  S SD    . MET A 1 37  ? -23.71313 -24.73346 -15.88767 1.000 29.46354  ? 37   MET A SD    1 
ATOM   609  C CE    . MET A 1 37  ? -22.70553 -25.05029 -17.33686 1.000 28.99133  ? 37   MET A CE    1 
ATOM   610  H H     . MET A 1 37  ? -22.28222 -22.30281 -12.46778 1.000 31.32594  ? 37   MET A H     1 
ATOM   611  H HA    . MET A 1 37  ? -20.27829 -22.84658 -14.02148 1.000 43.11251  ? 37   MET A HA    1 
ATOM   612  H HB2   . MET A 1 37  ? -22.92867 -22.15701 -14.66789 1.000 39.20031  ? 37   MET A HB2   1 
ATOM   613  H HB3   . MET A 1 37  ? -21.87392 -22.52874 -15.79693 1.000 39.20031  ? 37   MET A HB3   1 
ATOM   614  H HG2   . MET A 1 37  ? -21.67282 -24.67251 -14.83807 1.000 38.35300  ? 37   MET A HG2   1 
ATOM   615  H HG3   . MET A 1 37  ? -22.82849 -24.28904 -13.81689 1.000 38.35300  ? 37   MET A HG3   1 
ATOM   616  H HE1   . MET A 1 37  ? -23.27547 -25.36857 -18.05433 1.000 34.88930  ? 37   MET A HE1   1 
ATOM   617  H HE2   . MET A 1 37  ? -22.26736 -24.22684 -17.60302 1.000 34.88930  ? 37   MET A HE2   1 
ATOM   618  H HE3   . MET A 1 37  ? -22.04142 -25.72285 -17.11885 1.000 34.88930  ? 37   MET A HE3   1 
ATOM   619  N N     . ARG A 1 38  ? -21.09452 -19.74804 -14.02811 1.000 25.54969  ? 38   ARG A N     1 
ATOM   620  C CA    . ARG A 1 38  ? -20.58852 -18.43618 -14.42107 1.000 35.38686  ? 38   ARG A CA    1 
ATOM   621  C C     . ARG A 1 38  ? -19.24916 -18.14145 -13.76091 1.000 32.02523  ? 38   ARG A C     1 
ATOM   622  O O     . ARG A 1 38  ? -18.38425 -17.50645 -14.37523 1.000 33.96931  ? 38   ARG A O     1 
ATOM   623  C CB    . ARG A 1 38  ? -21.60707 -17.34602 -14.08662 1.000 35.99538  ? 38   ARG A CB    1 
ATOM   624  C CG    . ARG A 1 38  ? -22.85435 -17.40648 -14.96104 1.000 35.28715  ? 38   ARG A CG    1 
ATOM   625  C CD    . ARG A 1 38  ? -23.50934 -16.04859 -15.13189 1.000 39.19751  ? 38   ARG A CD    1 
ATOM   626  N NE    . ARG A 1 38  ? -22.67601 -15.12881 -15.89695 1.000 40.66590  ? 38   ARG A NE    1 
ATOM   627  C CZ    . ARG A 1 38  ? -23.08738 -13.95766 -16.36194 1.000 44.88463  ? 38   ARG A CZ    1 
ATOM   628  N NH1   . ARG A 1 38  ? -24.32848 -13.53771 -16.17637 1.000 46.13741  ? 38   ARG A NH1   1 
ATOM   629  N NH2   . ARG A 1 38  ? -22.23438 -13.19153 -17.03576 1.000 52.19687  ? 38   ARG A NH2   1 
ATOM   630  H H     . ARG A 1 38  ? -21.79814 -19.73629 -13.53376 1.000 30.75934  ? 38   ARG A H     1 
ATOM   631  H HA    . ARG A 1 38  ? -20.46054 -18.42532 -15.38253 1.000 42.56394  ? 38   ARG A HA    1 
ATOM   632  H HB2   . ARG A 1 38  ? -21.88426 -17.44727 -13.16260 1.000 43.29416  ? 38   ARG A HB2   1 
ATOM   633  H HB3   . ARG A 1 38  ? -21.19300 -16.47837 -14.21560 1.000 43.29416  ? 38   ARG A HB3   1 
ATOM   634  H HG2   . ARG A 1 38  ? -22.61012 -17.73532 -15.84032 1.000 42.44429  ? 38   ARG A HG2   1 
ATOM   635  H HG3   . ARG A 1 38  ? -23.50066 -18.00274 -14.55158 1.000 42.44429  ? 38   ARG A HG3   1 
ATOM   636  H HD2   . ARG A 1 38  ? -24.35039 -16.15749 -15.60271 1.000 47.13672  ? 38   ARG A HD2   1 
ATOM   637  H HD3   . ARG A 1 38  ? -23.66654 -15.65842 -14.25784 1.000 47.13672  ? 38   ARG A HD3   1 
ATOM   638  H HE    . ARG A 1 38  ? -21.86374 -15.36154 -16.05715 1.000 48.89879  ? 38   ARG A HE    1 
ATOM   639  H HH11  . ARG A 1 38  ? -24.88852 -14.02813 -15.74574 1.000 55.46460  ? 38   ARG A HH11  1 
ATOM   640  H HH12  . ARG A 1 38  ? -24.57502 -12.77436 -16.48641 1.000 55.46460  ? 38   ARG A HH12  1 
ATOM   641  H HH21  . ARG A 1 38  ? -21.42697 -13.45789 -17.16516 1.000 62.73595  ? 38   ARG A HH21  1 
ATOM   642  H HH22  . ARG A 1 38  ? -22.49017 -12.42975 -17.34211 1.000 62.73595  ? 38   ARG A HH22  1 
ATOM   643  N N     . ALA A 1 39  ? -19.05443 -18.60428 -12.52302 1.000 33.43227  ? 39   ALA A N     1 
ATOM   644  C CA    . ALA A 1 39  ? -17.75465 -18.45887 -11.87704 1.000 31.00586  ? 39   ALA A CA    1 
ATOM   645  C C     . ALA A 1 39  ? -16.68663 -19.25777 -12.61241 1.000 37.96165  ? 39   ALA A C     1 
ATOM   646  O O     . ALA A 1 39  ? -15.54512 -18.80370 -12.75291 1.000 35.18415  ? 39   ALA A O     1 
ATOM   647  C CB    . ALA A 1 39  ? -17.84281 -18.90044 -10.41714 1.000 27.83831  ? 39   ALA A CB    1 
ATOM   648  H H     . ALA A 1 39  ? -19.65024 -18.99961 -12.04518 1.000 40.21844  ? 39   ALA A H     1 
ATOM   649  H HA    . ALA A 1 39  ? -17.49846 -17.52345 -11.89281 1.000 37.30674  ? 39   ALA A HA    1 
ATOM   650  H HB1   . ALA A 1 39  ? -16.97105 -18.80028 -10.00372 1.000 33.50569  ? 39   ALA A HB1   1 
ATOM   651  H HB2   . ALA A 1 39  ? -18.49238 -18.34534 -9.95798  1.000 33.50569  ? 39   ALA A HB2   1 
ATOM   652  H HB3   . ALA A 1 39  ? -18.11965 -19.82951 -10.38438 1.000 33.50569  ? 39   ALA A HB3   1 
ATOM   653  N N     . ILE A 1 40  ? -17.04058 -20.45266 -13.09195 1.000 39.20536  ? 40   ILE A N     1 
ATOM   654  C CA    . ILE A 1 40  ? -16.09199 -21.26151 -13.84931 1.000 28.69095  ? 40   ILE A CA    1 
ATOM   655  C C     . ILE A 1 40  ? -15.78062 -20.60165 -15.18647 1.000 35.82589  ? 40   ILE A C     1 
ATOM   656  O O     . ILE A 1 40  ? -14.62461 -20.57015 -15.62402 1.000 42.31770  ? 40   ILE A O     1 
ATOM   657  C CB    . ILE A 1 40  ? -16.64357 -22.68597 -14.04066 1.000 30.47029  ? 40   ILE A CB    1 
ATOM   658  C CG1   . ILE A 1 40  ? -16.87846 -23.35663 -12.68792 1.000 28.93623  ? 40   ILE A CG1   1 
ATOM   659  C CG2   . ILE A 1 40  ? -15.68659 -23.52589 -14.87487 1.000 35.87204  ? 40   ILE A CG2   1 
ATOM   660  C CD1   . ILE A 1 40  ? -17.68209 -24.63161 -12.77742 1.000 34.31435  ? 40   ILE A CD1   1 
ATOM   661  H H     . ILE A 1 40  ? -17.81561 -20.81193 -12.99262 1.000 47.14614  ? 40   ILE A H     1 
ATOM   662  H HA    . ILE A 1 40  ? -15.26606 -21.32226 -13.34427 1.000 33.93059  ? 40   ILE A HA    1 
ATOM   663  H HB    . ILE A 1 40  ? -17.49029 -22.61657 -14.50878 1.000 36.66406  ? 40   ILE A HB    1 
ATOM   664  H HG12  . ILE A 1 40  ? -16.01938 -23.57432 -12.29360 1.000 34.82318  ? 40   ILE A HG12  1 
ATOM   665  H HG13  . ILE A 1 40  ? -17.36078 -22.74146 -12.11361 1.000 34.82318  ? 40   ILE A HG13  1 
ATOM   666  H HG21  . ILE A 1 40  ? -16.03033 -24.43100 -14.93415 1.000 43.14615  ? 40   ILE A HG21  1 
ATOM   667  H HG22  . ILE A 1 40  ? -15.61817 -23.13929 -15.76187 1.000 43.14615  ? 40   ILE A HG22  1 
ATOM   668  H HG23  . ILE A 1 40  ? -14.81568 -23.53011 -14.44779 1.000 43.14615  ? 40   ILE A HG23  1 
ATOM   669  H HD11  . ILE A 1 40  ? -17.84609 -24.96509 -11.88143 1.000 41.27693  ? 40   ILE A HD11  1 
ATOM   670  H HD12  . ILE A 1 40  ? -18.52463 -24.44346 -13.21971 1.000 41.27693  ? 40   ILE A HD12  1 
ATOM   671  H HD13  . ILE A 1 40  ? -17.17983 -25.28635 -13.28728 1.000 41.27693  ? 40   ILE A HD13  1 
ATOM   672  N N     . ALA A 1 41  ? -16.80347 -20.07053 -15.86093 1.000 36.30019  ? 41   ALA A N     1 
ATOM   673  C CA    . ALA A 1 41  ? -16.57486 -19.42265 -17.14756 1.000 39.18042  ? 41   ALA A CA    1 
ATOM   674  C C     . ALA A 1 41  ? -15.71816 -18.17316 -16.99946 1.000 40.49319  ? 41   ALA A C     1 
ATOM   675  O O     . ALA A 1 41  ? -14.96357 -17.82995 -17.91650 1.000 45.85906  ? 41   ALA A O     1 
ATOM   676  C CB    . ALA A 1 41  ? -17.90858 -19.07377 -17.80717 1.000 31.84636  ? 41   ALA A CB    1 
ATOM   677  H H     . ALA A 1 41  ? -17.62256 -20.07303 -15.59885 1.000 43.65994  ? 41   ALA A H     1 
ATOM   678  H HA    . ALA A 1 41  ? -16.10719 -20.04254 -17.72888 1.000 47.11622  ? 41   ALA A HA    1 
ATOM   679  H HB1   . ALA A 1 41  ? -17.73665 -18.65661 -18.66584 1.000 38.31535  ? 41   ALA A HB1   1 
ATOM   680  H HB2   . ALA A 1 41  ? -18.42177 -19.88744 -17.93156 1.000 38.31535  ? 41   ALA A HB2   1 
ATOM   681  H HB3   . ALA A 1 41  ? -18.39411 -18.46099 -17.23301 1.000 38.31535  ? 41   ALA A HB3   1 
ATOM   682  N N     . ASP A 1 42  ? -15.81792 -17.48770 -15.85683 1.000 46.99332  ? 42   ASP A N     1 
ATOM   683  C CA    . ASP A 1 42  ? -15.00062 -16.30254 -15.61688 1.000 48.38776  ? 42   ASP A CA    1 
ATOM   684  C C     . ASP A 1 42  ? -13.56780 -16.66408 -15.24116 1.000 47.34836  ? 42   ASP A C     1 
ATOM   685  O O     . ASP A 1 42  ? -12.65453 -15.86349 -15.46424 1.000 52.79079  ? 42   ASP A O     1 
ATOM   686  C CB    . ASP A 1 42  ? -15.62665 -15.44851 -14.51168 1.000 53.41248  ? 42   ASP A CB    1 
ATOM   687  C CG    . ASP A 1 42  ? -15.02209 -14.05433 -14.43052 1.000 73.50283  ? 42   ASP A CG    1 
ATOM   688  O OD1   . ASP A 1 42  ? -14.41748 -13.60091 -15.42551 1.000 85.89164  ? 42   ASP A OD1   1 
ATOM   689  O OD2   . ASP A 1 42  ? -15.14967 -13.41026 -13.36745 1.000 81.07637  ? 42   ASP A OD2   1 
ATOM   690  H H     . ASP A 1 42  ? -16.34834 -17.68868 -15.21042 1.000 56.49169  ? 42   ASP A H     1 
ATOM   691  H HA    . ASP A 1 42  ? -14.97491 -15.77323 -16.42932 1.000 58.16502  ? 42   ASP A HA    1 
ATOM   692  H HB2   . ASP A 1 42  ? -16.57632 -15.35389 -14.68510 1.000 64.19469  ? 42   ASP A HB2   1 
ATOM   693  H HB3   . ASP A 1 42  ? -15.48741 -15.88592 -13.65717 1.000 64.19469  ? 42   ASP A HB3   1 
ATOM   694  N N     . LYS A 1 43  ? -13.34711 -17.85155 -14.67574 1.000 49.94321  ? 43   LYS A N     1 
ATOM   695  C CA    . LYS A 1 43  ? -12.01995 -18.28359 -14.23071 1.000 46.77114  ? 43   LYS A CA    1 
ATOM   696  C C     . LYS A 1 43  ? -11.86036 -19.76940 -14.51832 1.000 50.87374  ? 43   LYS A C     1 
ATOM   697  O O     . LYS A 1 43  ? -11.92195 -20.60891 -13.61235 1.000 45.11917  ? 43   LYS A O     1 
ATOM   698  C CB    . LYS A 1 43  ? -11.82417 -17.97843 -12.74352 1.000 43.19894  ? 43   LYS A CB    1 
ATOM   699  C CG    . LYS A 1 43  ? -10.43431 -18.29891 -12.21306 1.000 63.85851  ? 43   LYS A CG    1 
ATOM   700  C CD    . LYS A 1 43  ? -10.06157 -17.38420 -11.04786 1.000 66.24486  ? 43   LYS A CD    1 
ATOM   701  C CE    . LYS A 1 43  ? -8.62947  -17.61480 -10.57691 1.000 65.50884  ? 43   LYS A CE    1 
ATOM   702  N NZ    . LYS A 1 43  ? -8.44578  -18.96075 -9.96515  1.000 72.96844  ? 43   LYS A NZ    1 
ATOM   703  H H     . LYS A 1 43  ? -13.96226 -18.43614 -14.53630 1.000 60.03156  ? 43   LYS A H     1 
ATOM   704  H HA    . LYS A 1 43  ? -11.34199 -17.80605 -14.73393 1.000 56.22508  ? 43   LYS A HA    1 
ATOM   705  H HB2   . LYS A 1 43  ? -11.98253 -17.03250 -12.59851 1.000 51.93844  ? 43   LYS A HB2   1 
ATOM   706  H HB3   . LYS A 1 43  ? -12.46091 -18.50338 -12.23372 1.000 51.93844  ? 43   LYS A HB3   1 
ATOM   707  H HG2   . LYS A 1 43  ? -10.41254 -19.21686 -11.90036 1.000 76.72993  ? 43   LYS A HG2   1 
ATOM   708  H HG3   . LYS A 1 43  ? -9.78266  -18.17390 -12.92060 1.000 76.72993  ? 43   LYS A HG3   1 
ATOM   709  H HD2   . LYS A 1 43  ? -10.14271 -16.45940 -11.32904 1.000 79.59354  ? 43   LYS A HD2   1 
ATOM   710  H HD3   . LYS A 1 43  ? -10.65723 -17.55773 -10.30223 1.000 79.59354  ? 43   LYS A HD3   1 
ATOM   711  H HE2   . LYS A 1 43  ? -8.02968  -17.54396 -11.33594 1.000 78.71032  ? 43   LYS A HE2   1 
ATOM   712  H HE3   . LYS A 1 43  ? -8.40217  -16.94712 -9.91100  1.000 78.71032  ? 43   LYS A HE3   1 
ATOM   713  H HZ1   . LYS A 1 43  ? -7.60333  -19.06035 -9.69596  1.000 87.66184  ? 43   LYS A HZ1   1 
ATOM   714  H HZ2   . LYS A 1 43  ? -8.98590  -19.05261 -9.26377  1.000 87.66184  ? 43   LYS A HZ2   1 
ATOM   715  H HZ3   . LYS A 1 43  ? -8.63551  -19.59429 -10.56074 1.000 87.66184  ? 43   LYS A HZ3   1 
ATOM   716  N N     . PRO A 1 44  ? -11.65652 -20.13330 -15.78482 1.000 53.79492  ? 44   PRO A N     1 
ATOM   717  C CA    . PRO A 1 44  ? -11.45724 -21.55068 -16.11717 1.000 49.29491  ? 44   PRO A CA    1 
ATOM   718  C C     . PRO A 1 44  ? -10.30025 -22.14004 -15.32575 1.000 51.05919  ? 44   PRO A C     1 
ATOM   719  O O     . PRO A 1 44  ? -9.27500  -21.49085 -15.10870 1.000 52.09787  ? 44   PRO A O     1 
ATOM   720  C CB    . PRO A 1 44  ? -11.16371 -21.52973 -17.62199 1.000 43.59975  ? 44   PRO A CB    1 
ATOM   721  C CG    . PRO A 1 44  ? -11.78932 -20.26000 -18.11213 1.000 47.15146  ? 44   PRO A CG    1 
ATOM   722  C CD    . PRO A 1 44  ? -11.65127 -19.27179 -16.98241 1.000 46.46502  ? 44   PRO A CD    1 
ATOM   723  H HA    . PRO A 1 44  ? -12.26450 -22.06238 -15.95167 1.000 59.25360  ? 44   PRO A HA    1 
ATOM   724  H HB2   . PRO A 1 44  ? -10.20553 -21.52695 -17.77292 1.000 52.41941  ? 44   PRO A HB2   1 
ATOM   725  H HB3   . PRO A 1 44  ? -11.56455 -22.30306 -18.04882 1.000 52.41941  ? 44   PRO A HB3   1 
ATOM   726  H HG2   . PRO A 1 44  ? -11.32025 -19.94739 -18.90153 1.000 56.68146  ? 44   PRO A HG2   1 
ATOM   727  H HG3   . PRO A 1 44  ? -12.72380 -20.41487 -18.32108 1.000 56.68146  ? 44   PRO A HG3   1 
ATOM   728  H HD2   . PRO A 1 44  ? -10.81774 -18.78056 -17.05195 1.000 55.85773  ? 44   PRO A HD2   1 
ATOM   729  H HD3   . PRO A 1 44  ? -12.39973 -18.65493 -16.96852 1.000 55.85773  ? 44   PRO A HD3   1 
ATOM   730  N N     . GLY A 1 45  ? -10.47428 -23.38527 -14.89419 1.000 50.87020  ? 45   GLY A N     1 
ATOM   731  C CA    . GLY A 1 45  ? -9.51503  -24.00632 -14.00868 1.000 48.23642  ? 45   GLY A CA    1 
ATOM   732  C C     . GLY A 1 45  ? -9.59007  -23.53851 -12.57541 1.000 48.54145  ? 45   GLY A C     1 
ATOM   733  O O     . GLY A 1 45  ? -8.67962  -23.83845 -11.79333 1.000 46.74520  ? 45   GLY A O     1 
ATOM   734  H H     . GLY A 1 45  ? -11.14147 -23.88599 -15.10332 1.000 61.14395  ? 45   GLY A H     1 
ATOM   735  H HA2   . GLY A 1 45  ? -9.65925  -24.96551 -14.01617 1.000 57.98341  ? 45   GLY A HA2   1 
ATOM   736  H HA3   . GLY A 1 45  ? -8.62144  -23.81877 -14.33612 1.000 57.98341  ? 45   GLY A HA3   1 
ATOM   737  N N     . ILE A 1 46  ? -10.64595 -22.80788 -12.20785 1.000 49.63541  ? 46   ILE A N     1 
ATOM   738  C CA    . ILE A 1 46  ? -10.79940 -22.34911 -10.83528 1.000 39.52675  ? 46   ILE A CA    1 
ATOM   739  C C     . ILE A 1 46  ? -10.71275 -23.53225 -9.88783  1.000 39.53563  ? 46   ILE A C     1 
ATOM   740  O O     . ILE A 1 46  ? -11.18330 -24.63390 -10.19066 1.000 45.12437  ? 46   ILE A O     1 
ATOM   741  C CB    . ILE A 1 46  ? -12.13538 -21.60375 -10.66648 1.000 46.82052  ? 46   ILE A CB    1 
ATOM   742  C CG1   . ILE A 1 46  ? -12.26770 -21.06214 -9.24232  1.000 42.41345  ? 46   ILE A CG1   1 
ATOM   743  C CG2   . ILE A 1 46  ? -13.31130 -22.52663 -10.97796 1.000 33.67676  ? 46   ILE A CG2   1 
ATOM   744  C CD1   . ILE A 1 46  ? -13.19160 -19.87237 -9.13467  1.000 43.67165  ? 46   ILE A CD1   1 
ATOM   745  H H     . ILE A 1 46  ? -11.28211 -22.56757 -12.73429 1.000 59.66220  ? 46   ILE A H     1 
ATOM   746  H HA    . ILE A 1 46  ? -10.07677 -21.73576 -10.62910 1.000 47.53180  ? 46   ILE A HA    1 
ATOM   747  H HB    . ILE A 1 46  ? -12.14382 -20.86148 -11.29088 1.000 56.28433  ? 46   ILE A HB    1 
ATOM   748  H HG12  . ILE A 1 46  ? -12.61889 -21.76378 -8.67200  1.000 50.99585  ? 46   ILE A HG12  1 
ATOM   749  H HG13  . ILE A 1 46  ? -11.39165 -20.78751 -8.92925  1.000 50.99585  ? 46   ILE A HG13  1 
ATOM   750  H HG21  . ILE A 1 46  ? -14.13234 -22.01059 -10.95540 1.000 40.33803  ? 46   ILE A HG21  1 
ATOM   751  H HG22  . ILE A 1 46  ? -13.18624 -22.91086 -11.85979 1.000 40.33803  ? 46   ILE A HG22  1 
ATOM   752  H HG23  . ILE A 1 46  ? -13.34495 -23.23104 -10.31195 1.000 40.33803  ? 46   ILE A HG23  1 
ATOM   753  H HD11  . ILE A 1 46  ? -13.25545 -19.60528 -8.20435  1.000 52.50569  ? 46   ILE A HD11  1 
ATOM   754  H HD12  . ILE A 1 46  ? -12.83123 -19.14379 -9.66400  1.000 52.50569  ? 46   ILE A HD12  1 
ATOM   755  H HD13  . ILE A 1 46  ? -14.06770 -20.12168 -9.46811  1.000 52.50569  ? 46   ILE A HD13  1 
ATOM   756  N N     . GLU A 1 47  ? -10.10324 -23.30506 -8.73045  1.000 46.03637  ? 47   GLU A N     1 
ATOM   757  C CA    . GLU A 1 47  ? -10.02273 -24.34527 -7.71547  1.000 49.87631  ? 47   GLU A CA    1 
ATOM   758  C C     . GLU A 1 47  ? -11.41897 -24.62949 -7.17471  1.000 44.30417  ? 47   GLU A C     1 
ATOM   759  O O     . GLU A 1 47  ? -12.18566 -23.70422 -6.88969  1.000 45.75093  ? 47   GLU A O     1 
ATOM   760  C CB    . GLU A 1 47  ? -9.07721  -23.91441 -6.59846  1.000 53.01318  ? 47   GLU A CB    1 
ATOM   761  C CG    . GLU A 1 47  ? -8.53647  -25.06245 -5.76680  1.000 75.64286  ? 47   GLU A CG    1 
ATOM   762  C CD    . GLU A 1 47  ? -7.29183  -24.67813 -4.98787  1.000 89.30353  ? 47   GLU A CD    1 
ATOM   763  O OE1   . GLU A 1 47  ? -6.79266  -23.54872 -5.18135  1.000 74.86776  ? 47   GLU A OE1   1 
ATOM   764  O OE2   . GLU A 1 47  ? -6.81070  -25.50633 -4.18509  1.000 92.86835  ? 47   GLU A OE2   1 
ATOM   765  H H     . GLU A 1 47  ? -9.73078  -22.56191 -8.50999  1.000 55.34335  ? 47   GLU A H     1 
ATOM   766  H HA    . GLU A 1 47  ? -9.66929  -25.16427 -8.09656  1.000 59.95128  ? 47   GLU A HA    1 
ATOM   767  H HB2   . GLU A 1 47  ? -8.31996  -23.45419 -6.99303  1.000 63.71552  ? 47   GLU A HB2   1 
ATOM   768  H HB3   . GLU A 1 47  ? -9.55408  -23.31703 -6.00128  1.000 63.71552  ? 47   GLU A HB3   1 
ATOM   769  H HG2   . GLU A 1 47  ? -9.21484  -25.34145 -5.13208  1.000 90.87114  ? 47   GLU A HG2   1 
ATOM   770  H HG3   . GLU A 1 47  ? -8.30843  -25.79988 -6.35424  1.000 90.87114  ? 47   GLU A HG3   1 
ATOM   771  N N     . GLN A 1 48  ? -11.75257 -25.91647 -7.04725  1.000 44.26911  ? 48   GLN A N     1 
ATOM   772  C CA    . GLN A 1 48  ? -13.11479 -26.29735 -6.68552  1.000 41.35751  ? 48   GLN A CA    1 
ATOM   773  C C     . GLN A 1 48  ? -13.54977 -25.64984 -5.37738  1.000 39.01540  ? 48   GLN A C     1 
ATOM   774  O O     . GLN A 1 48  ? -14.70783 -25.24174 -5.23518  1.000 42.35811  ? 48   GLN A O     1 
ATOM   775  C CB    . GLN A 1 48  ? -13.22442 -27.81985 -6.59006  1.000 35.56504  ? 48   GLN A CB    1 
ATOM   776  C CG    . GLN A 1 48  ? -14.54076 -28.31124 -6.00943  1.000 37.33754  ? 48   GLN A CG    1 
ATOM   777  C CD    . GLN A 1 48  ? -14.83304 -29.76134 -6.35486  1.000 47.27336  ? 48   GLN A CD    1 
ATOM   778  O OE1   . GLN A 1 48  ? -14.52002 -30.22497 -7.45241  1.000 49.46332  ? 48   GLN A OE1   1 
ATOM   779  N NE2   . GLN A 1 48  ? -15.43822 -30.48460 -5.41723  1.000 39.49014  ? 48   GLN A NE2   1 
ATOM   780  H H     . GLN A 1 48  ? -11.21542 -26.57796 -7.16345  1.000 53.22264  ? 48   GLN A H     1 
ATOM   781  H HA    . GLN A 1 48  ? -13.71580 -25.99148 -7.38275  1.000 49.72872  ? 48   GLN A HA    1 
ATOM   782  H HB2   . GLN A 1 48  ? -13.13705 -28.19403 -7.48071  1.000 42.17950  ? 48   GLN A HB2   1 
ATOM   783  H HB3   . GLN A 1 48  ? -12.51052 -28.14762 -6.02101  1.000 42.17950  ? 48   GLN A HB3   1 
ATOM   784  H HG2   . GLN A 1 48  ? -14.50790 -28.23427 -5.04305  1.000 44.90476  ? 48   GLN A HG2   1 
ATOM   785  H HG3   . GLN A 1 48  ? -15.26334 -27.76802 -6.36113  1.000 44.90476  ? 48   GLN A HG3   1 
ATOM   786  H HE21  . GLN A 1 48  ? -15.64284 -30.12600 -4.66282  1.000 47.48788  ? 48   GLN A HE21  1 
ATOM   787  H HE22  . GLN A 1 48  ? -15.62497 -31.31092 -5.56529  1.000 47.48788  ? 48   GLN A HE22  1 
ATOM   788  N N     . VAL A 1 49  ? -12.63714 -25.54346 -4.40942  1.000 46.05453  ? 49   VAL A N     1 
ATOM   789  C CA    . VAL A 1 49  ? -13.00124 -24.98081 -3.11203  1.000 42.99824  ? 49   VAL A CA    1 
ATOM   790  C C     . VAL A 1 49  ? -13.41407 -23.52288 -3.24444  1.000 39.81435  ? 49   VAL A C     1 
ATOM   791  O O     . VAL A 1 49  ? -14.29723 -23.05279 -2.51685  1.000 36.26798  ? 49   VAL A O     1 
ATOM   792  C CB    . VAL A 1 49  ? -11.83579 -25.15224 -2.11732  1.000 50.63787  ? 49   VAL A CB    1 
ATOM   793  C CG1   . VAL A 1 49  ? -11.91178 -24.11753 -1.00437  1.000 53.68775  ? 49   VAL A CG1   1 
ATOM   794  C CG2   . VAL A 1 49  ? -11.85435 -26.55670 -1.53570  1.000 60.40502  ? 49   VAL A CG2   1 
ATOM   795  H H     . VAL A 1 49  ? -11.81487 -25.78581 -4.47826  1.000 55.36515  ? 49   VAL A H     1 
ATOM   796  H HA    . VAL A 1 49  ? -13.76583 -25.46965 -2.76948  1.000 51.69759  ? 49   VAL A HA    1 
ATOM   797  H HB    . VAL A 1 49  ? -10.99909 -25.01823 -2.58940  1.000 60.86515  ? 49   VAL A HB    1 
ATOM   798  H HG11  . VAL A 1 49  ? -11.33147 -24.39250 -0.27737  1.000 64.52500  ? 49   VAL A HG11  1 
ATOM   799  H HG12  . VAL A 1 49  ? -11.62326 -23.25885 -1.35124  1.000 64.52500  ? 49   VAL A HG12  1 
ATOM   800  H HG13  . VAL A 1 49  ? -12.82794 -24.05696 -0.69149  1.000 64.52500  ? 49   VAL A HG13  1 
ATOM   801  H HG21  . VAL A 1 49  ? -11.10001 -26.65959 -0.93463  1.000 72.58573  ? 49   VAL A HG21  1 
ATOM   802  H HG22  . VAL A 1 49  ? -12.68411 -26.68659 -1.05039  1.000 72.58573  ? 49   VAL A HG22  1 
ATOM   803  H HG23  . VAL A 1 49  ? -11.79050 -27.19917 -2.25961  1.000 72.58573  ? 49   VAL A HG23  1 
ATOM   804  N N     . ALA A 1 50  ? -12.79481 -22.78348 -4.16744  1.000 41.58671  ? 50   ALA A N     1 
ATOM   805  C CA    . ALA A 1 50  ? -13.13973 -21.37797 -4.34085  1.000 41.30828  ? 50   ALA A CA    1 
ATOM   806  C C     . ALA A 1 50  ? -14.58357 -21.18977 -4.78518  1.000 47.88586  ? 50   ALA A C     1 
ATOM   807  O O     . ALA A 1 50  ? -15.12804 -20.08944 -4.64195  1.000 50.33621  ? 50   ALA A O     1 
ATOM   808  C CB    . ALA A 1 50  ? -12.19680 -20.72876 -5.35590  1.000 43.58801  ? 50   ALA A CB    1 
ATOM   809  H H     . ALA A 1 50  ? -12.18072 -23.07005 -4.69694  1.000 50.00376  ? 50   ALA A H     1 
ATOM   810  H HA    . ALA A 1 50  ? -13.02698 -20.92440 -3.49088  1.000 49.66965  ? 50   ALA A HA    1 
ATOM   811  H HB1   . ALA A 1 50  ? -12.43930 -19.79537 -5.46020  1.000 52.40532  ? 50   ALA A HB1   1 
ATOM   812  H HB2   . ALA A 1 50  ? -11.28566 -20.79945 -5.03073  1.000 52.40532  ? 50   ALA A HB2   1 
ATOM   813  H HB3   . ALA A 1 50  ? -12.28155 -21.18945 -6.20530  1.000 52.40532  ? 50   ALA A HB3   1 
ATOM   814  N N     . LEU A 1 51  ? -15.21897 -22.23626 -5.30528  1.000 39.57731  ? 51   LEU A N     1 
ATOM   815  C CA    . LEU A 1 51  ? -16.55571 -22.11533 -5.86819  1.000 38.43403  ? 51   LEU A CA    1 
ATOM   816  C C     . LEU A 1 51  ? -17.65974 -22.11839 -4.82038  1.000 34.96911  ? 51   LEU A C     1 
ATOM   817  O O     . LEU A 1 51  ? -18.83115 -21.97954 -5.18667  1.000 35.78215  ? 51   LEU A O     1 
ATOM   818  C CB    . LEU A 1 51  ? -16.79948 -23.24596 -6.86962  1.000 38.41922  ? 51   LEU A CB    1 
ATOM   819  C CG    . LEU A 1 51  ? -16.14425 -23.05274 -8.23705  1.000 43.32674  ? 51   LEU A CG    1 
ATOM   820  C CD1   . LEU A 1 51  ? -16.14810 -24.35530 -9.02168  1.000 33.68096  ? 51   LEU A CD1   1 
ATOM   821  C CD2   . LEU A 1 51  ? -16.85177 -21.94622 -9.01858  1.000 47.71156  ? 51   LEU A CD2   1 
ATOM   822  H H     . LEU A 1 51  ? -14.89314 -23.03124 -5.34317  1.000 47.59248  ? 51   LEU A H     1 
ATOM   823  H HA    . LEU A 1 51  ? -16.60995 -21.27027 -6.34129  1.000 46.22055  ? 51   LEU A HA    1 
ATOM   824  H HB2   . LEU A 1 51  ? -16.45022 -24.06884 -6.49308  1.000 46.20278  ? 51   LEU A HB2   1 
ATOM   825  H HB3   . LEU A 1 51  ? -17.75536 -23.32645 -7.01355  1.000 46.20278  ? 51   LEU A HB3   1 
ATOM   826  H HG    . LEU A 1 51  ? -15.22058 -22.78518 -8.10994  1.000 52.09180  ? 51   LEU A HG    1 
ATOM   827  H HD11  . LEU A 1 51  ? -15.74736 -24.20121 -9.89149  1.000 40.51687  ? 51   LEU A HD11  1 
ATOM   828  H HD12  . LEU A 1 51  ? -15.63557 -25.01910 -8.53426  1.000 40.51687  ? 51   LEU A HD12  1 
ATOM   829  H HD13  . LEU A 1 51  ? -17.06378 -24.65713 -9.12815  1.000 40.51687  ? 51   LEU A HD13  1 
ATOM   830  H HD21  . LEU A 1 51  ? -16.51087 -21.93338 -9.92661  1.000 57.35358  ? 51   LEU A HD21  1 
ATOM   831  H HD22  . LEU A 1 51  ? -17.80519 -22.12469 -9.02569  1.000 57.35358  ? 51   LEU A HD22  1 
ATOM   832  H HD23  . LEU A 1 51  ? -16.67786 -21.09465 -8.58790  1.000 57.35358  ? 51   LEU A HD23  1 
ATOM   833  N N     . ILE A 1 52  ? -17.33696 -22.26708 -3.53440  1.000 32.44255  ? 52   ILE A N     1 
ATOM   834  C CA    . ILE A 1 52  ? -18.39558 -22.21142 -2.53630  1.000 40.87981  ? 52   ILE A CA    1 
ATOM   835  C C     . ILE A 1 52  ? -18.94322 -20.79640 -2.40555  1.000 37.91894  ? 52   ILE A C     1 
ATOM   836  O O     . ILE A 1 52  ? -20.08486 -20.61408 -1.96933  1.000 49.92736  ? 52   ILE A O     1 
ATOM   837  C CB    . ILE A 1 52  ? -17.91878 -22.72839 -1.16615  1.000 40.98645  ? 52   ILE A CB    1 
ATOM   838  C CG1   . ILE A 1 52  ? -16.87327 -21.79352 -0.56373  1.000 40.54423  ? 52   ILE A CG1   1 
ATOM   839  C CG2   . ILE A 1 52  ? -17.37010 -24.13942 -1.29446  1.000 44.74669  ? 52   ILE A CG2   1 
ATOM   840  C CD1   . ILE A 1 52  ? -17.43102 -20.87047 0.49494   1.000 53.95432  ? 52   ILE A CD1   1 
ATOM   841  H H     . ILE A 1 52  ? -16.54336 -22.39605 -3.22917  1.000 39.03077  ? 52   ILE A H     1 
ATOM   842  H HA    . ILE A 1 52  ? -19.10703 -22.80147 -2.83054  1.000 49.15549  ? 52   ILE A HA    1 
ATOM   843  H HB    . ILE A 1 52  ? -18.68249 -22.74652 -0.56838  1.000 49.28345  ? 52   ILE A HB    1 
ATOM   844  H HG12  . ILE A 1 52  ? -16.17444 -22.32747 -0.15456  1.000 48.75278  ? 52   ILE A HG12  1 
ATOM   845  H HG13  . ILE A 1 52  ? -16.50006 -21.24412 -1.27068  1.000 48.75278  ? 52   ILE A HG13  1 
ATOM   846  H HG21  . ILE A 1 52  ? -17.10960 -24.45805 -0.41610  1.000 53.79573  ? 52   ILE A HG21  1 
ATOM   847  H HG22  . ILE A 1 52  ? -18.05902 -24.71378 -1.66379  1.000 53.79573  ? 52   ILE A HG22  1 
ATOM   848  H HG23  . ILE A 1 52  ? -16.59954 -24.12628 -1.88350  1.000 53.79573  ? 52   ILE A HG23  1 
ATOM   849  H HD11  . ILE A 1 52  ? -16.70496 -20.35316 0.87722   1.000 64.84489  ? 52   ILE A HD11  1 
ATOM   850  H HD12  . ILE A 1 52  ? -18.08049 -20.27713 0.08625   1.000 64.84489  ? 52   ILE A HD12  1 
ATOM   851  H HD13  . ILE A 1 52  ? -17.85724 -21.40245 1.18503   1.000 64.84489  ? 52   ILE A HD13  1 
ATOM   852  N N     . GLU A 1 53  ? -18.15834 -19.78323 -2.77538  1.000 34.10741  ? 53   GLU A N     1 
ATOM   853  C CA    . GLU A 1 53  ? -18.65498 -18.41280 -2.72054  1.000 40.44356  ? 53   GLU A CA    1 
ATOM   854  C C     . GLU A 1 53  ? -19.75974 -18.19938 -3.74711  1.000 38.66416  ? 53   GLU A C     1 
ATOM   855  O O     . GLU A 1 53  ? -20.82790 -17.66421 -3.42688  1.000 36.52661  ? 53   GLU A O     1 
ATOM   856  C CB    . GLU A 1 53  ? -17.50636 -17.43176 -2.94761  1.000 44.15600  ? 53   GLU A CB    1 
ATOM   857  C CG    . GLU A 1 53  ? -17.83125 -15.99649 -2.57278  1.000 58.42676  ? 53   GLU A CG    1 
ATOM   858  C CD    . GLU A 1 53  ? -16.63723 -15.07477 -2.73109  1.000 82.27030  ? 53   GLU A CD    1 
ATOM   859  O OE1   . GLU A 1 53  ? -15.53394 -15.44499 -2.27425  1.000 85.55799  ? 53   GLU A OE1   1 
ATOM   860  O OE2   . GLU A 1 53  ? -16.79965 -13.98595 -3.32218  1.000 78.64526  ? 53   GLU A OE2   1 
ATOM   861  H H     . GLU A 1 53  ? -17.34945 -19.86254 -3.05646  1.000 41.02860  ? 53   GLU A H     1 
ATOM   862  H HA    . GLU A 1 53  ? -19.02225 -18.24215 -1.83913  1.000 48.63199  ? 53   GLU A HA    1 
ATOM   863  H HB2   . GLU A 1 53  ? -16.74851 -17.71185 -2.41085  1.000 53.08691  ? 53   GLU A HB2   1 
ATOM   864  H HB3   . GLU A 1 53  ? -17.26936 -17.44396 -3.88813  1.000 53.08691  ? 53   GLU A HB3   1 
ATOM   865  H HG2   . GLU A 1 53  ? -18.54179 -15.67115 -3.14741  1.000 70.21183  ? 53   GLU A HG2   1 
ATOM   866  H HG3   . GLU A 1 53  ? -18.11455 -15.96665 -1.64556  1.000 70.21183  ? 53   GLU A HG3   1 
ATOM   867  N N     . ALA A 1 54  ? -19.51958 -18.61671 -4.99097  1.000 31.22742  ? 54   ALA A N     1 
ATOM   868  C CA    . ALA A 1 54  ? -20.55729 -18.52376 -6.00996  1.000 29.29948  ? 54   ALA A CA    1 
ATOM   869  C C     . ALA A 1 54  ? -21.75113 -19.39630 -5.65146  1.000 32.71893  ? 54   ALA A C     1 
ATOM   870  O O     . ALA A 1 54  ? -22.90319 -19.01921 -5.89541  1.000 35.57577  ? 54   ALA A O     1 
ATOM   871  C CB    . ALA A 1 54  ? -19.99209 -18.92675 -7.37201  1.000 32.78789  ? 54   ALA A CB    1 
ATOM   872  H H     . ALA A 1 54  ? -18.77613 -18.95168 -5.26423  1.000 37.57261  ? 54   ALA A H     1 
ATOM   873  H HA    . ALA A 1 54  ? -20.85861 -17.60369 -6.06967  1.000 35.25908  ? 54   ALA A HA    1 
ATOM   874  H HB1   . ALA A 1 54  ? -20.69485 -18.86137 -8.03741  1.000 39.44517  ? 54   ALA A HB1   1 
ATOM   875  H HB2   . ALA A 1 54  ? -19.26323 -18.32901 -7.60086  1.000 39.44517  ? 54   ALA A HB2   1 
ATOM   876  H HB3   . ALA A 1 54  ? -19.66794 -19.83960 -7.32186  1.000 39.44517  ? 54   ALA A HB3   1 
ATOM   877  N N     . ALA A 1 55  ? -21.49454 -20.56685 -5.06643  1.000 35.03073  ? 55   ALA A N     1 
ATOM   878  C CA    . ALA A 1 55  ? -22.56016 -21.50091 -4.73398  1.000 30.46375  ? 55   ALA A CA    1 
ATOM   879  C C     . ALA A 1 55  ? -23.30828 -21.11927 -3.46510  1.000 31.03087  ? 55   ALA A C     1 
ATOM   880  O O     . ALA A 1 55  ? -24.41507 -21.62359 -3.24126  1.000 31.44396  ? 55   ALA A O     1 
ATOM   881  C CB    . ALA A 1 55  ? -21.98266 -22.90918 -4.57934  1.000 28.98824  ? 55   ALA A CB    1 
ATOM   882  H H     . ALA A 1 55  ? -20.70819 -20.84148 -4.85235  1.000 42.13659  ? 55   ALA A H     1 
ATOM   883  H HA    . ALA A 1 55  ? -23.20153 -21.51087 -5.46161  1.000 36.65621  ? 55   ALA A HA    1 
ATOM   884  H HB1   . ALA A 1 55  ? -22.70189 -23.52362 -4.36470  1.000 34.88560  ? 55   ALA A HB1   1 
ATOM   885  H HB2   . ALA A 1 55  ? -21.56157 -23.17111 -5.41299  1.000 34.88560  ? 55   ALA A HB2   1 
ATOM   886  H HB3   . ALA A 1 55  ? -21.32692 -22.90487 -3.86458  1.000 34.88560  ? 55   ALA A HB3   1 
ATOM   887  N N     . VAL A 1 56  ? -22.73543 -20.24101 -2.64216  1.000 34.88617  ? 56   VAL A N     1 
ATOM   888  C CA    . VAL A 1 56  ? -23.30451 -19.87845 -1.34868  1.000 32.05986  ? 56   VAL A CA    1 
ATOM   889  C C     . VAL A 1 56  ? -23.74683 -21.15649 -0.64988  1.000 27.22100  ? 56   VAL A C     1 
ATOM   890  O O     . VAL A 1 56  ? -24.89278 -21.27115 -0.20021  1.000 36.07589  ? 56   VAL A O     1 
ATOM   891  C CB    . VAL A 1 56  ? -24.47452 -18.88915 -1.49099  1.000 33.48332  ? 56   VAL A CB    1 
ATOM   892  C CG1   . VAL A 1 56  ? -24.78237 -18.25255 -0.13763  1.000 26.36790  ? 56   VAL A CG1   1 
ATOM   893  C CG2   . VAL A 1 56  ? -24.16246 -17.82221 -2.53530  1.000 29.69660  ? 56   VAL A CG2   1 
ATOM   894  H H     . VAL A 1 56  ? -21.99887 -19.83255 -2.81608  1.000 41.96311  ? 56   VAL A H     1 
ATOM   895  H HA    . VAL A 1 56  ? -22.62432 -19.44161 -0.81256  1.000 38.57155  ? 56   VAL A HA    1 
ATOM   896  H HB    . VAL A 1 56  ? -25.26137 -19.36947 -1.79275  1.000 40.27970  ? 56   VAL A HB    1 
ATOM   897  H HG11  . VAL A 1 56  ? -25.54623 -17.66231 -0.23271  1.000 31.74119  ? 56   VAL A HG11  1 
ATOM   898  H HG12  . VAL A 1 56  ? -24.98332 -18.95309 0.50250   1.000 31.74119  ? 56   VAL A HG12  1 
ATOM   899  H HG13  . VAL A 1 56  ? -24.00857 -17.74726 0.15702   1.000 31.74119  ? 56   VAL A HG13  1 
ATOM   900  H HG21  . VAL A 1 56  ? -24.83381 -17.12398 -2.48379  1.000 35.73563  ? 56   VAL A HG21  1 
ATOM   901  H HG22  . VAL A 1 56  ? -23.28463 -17.45101 -2.35497  1.000 35.73563  ? 56   VAL A HG22  1 
ATOM   902  H HG23  . VAL A 1 56  ? -24.17509 -18.22892 -3.41583  1.000 35.73563  ? 56   VAL A HG23  1 
ATOM   903  N N     . SER A 1 57  ? -22.84317 -22.12903 -0.56521  1.000 35.01898  ? 57   SER A N     1 
ATOM   904  C CA    . SER A 1 57  ? -23.17063 -23.43922 -0.03385  1.000 40.73852  ? 57   SER A CA    1 
ATOM   905  C C     . SER A 1 57  ? -22.01148 -23.93690 0.81590   1.000 41.28813  ? 57   SER A C     1 
ATOM   906  O O     . SER A 1 57  ? -20.99366 -23.25812 0.98403   1.000 41.94272  ? 57   SER A O     1 
ATOM   907  C CB    . SER A 1 57  ? -23.47336 -24.43521 -1.16115  1.000 43.13859  ? 57   SER A CB    1 
ATOM   908  O OG    . SER A 1 57  ? -22.28098 -24.82468 -1.82472  1.000 41.66289  ? 57   SER A OG    1 
ATOM   909  H H     . SER A 1 57  ? -22.02378 -22.04866 -0.81370  1.000 42.12248  ? 57   SER A H     1 
ATOM   910  H HA    . SER A 1 57  ? -23.95456 -23.35305 0.53088   1.000 48.98593  ? 57   SER A HA    1 
ATOM   911  H HB2   . SER A 1 57  ? -23.89533 -25.22217 -0.78229  1.000 51.86602  ? 57   SER A HB2   1 
ATOM   912  H HB3   . SER A 1 57  ? -24.06859 -24.01555 -1.80184  1.000 51.86602  ? 57   SER A HB3   1 
ATOM   913  H HG    . SER A 1 57  ? -21.80090 -25.28135 -1.30841  1.000 50.09518  ? 57   SER A HG    1 
ATOM   914  N N     . THR A 1 58  ? -22.17941 -25.13777 1.35582   1.000 36.92310  ? 58   THR A N     1 
ATOM   915  C CA    . THR A 1 58  ? -21.11590 -25.81414 2.07194   1.000 38.33243  ? 58   THR A CA    1 
ATOM   916  C C     . THR A 1 58  ? -20.21844 -26.56267 1.08799   1.000 43.89726  ? 58   THR A C     1 
ATOM   917  O O     . THR A 1 58  ? -20.53291 -26.71206 -0.09575  1.000 45.78743  ? 58   THR A O     1 
ATOM   918  C CB    . THR A 1 58  ? -21.70185 -26.78444 3.09324   1.000 39.67502  ? 58   THR A CB    1 
ATOM   919  O OG1   . THR A 1 58  ? -22.44340 -27.80164 2.40757   1.000 31.99754  ? 58   THR A OG1   1 
ATOM   920  C CG2   . THR A 1 58  ? -22.62429 -26.05387 4.06228   1.000 34.52935  ? 58   THR A CG2   1 
ATOM   921  H H     . THR A 1 58  ? -22.91236 -25.58613 1.31895   1.000 44.40743  ? 58   THR A H     1 
ATOM   922  H HA    . THR A 1 58  ? -20.57796 -25.16139 2.54675   1.000 46.09863  ? 58   THR A HA    1 
ATOM   923  H HB    . THR A 1 58  ? -20.98490 -27.19028 3.60527   1.000 47.70974  ? 58   THR A HB    1 
ATOM   924  H HG1   . THR A 1 58  ? -22.77034 -28.34169 2.96171   1.000 38.49676  ? 58   THR A HG1   1 
ATOM   925  H HG21  . THR A 1 58  ? -22.92785 -26.66240 4.75398   1.000 41.53493  ? 58   THR A HG21  1 
ATOM   926  H HG22  . THR A 1 58  ? -22.15153 -25.31574 4.47769   1.000 41.53493  ? 58   THR A HG22  1 
ATOM   927  H HG23  . THR A 1 58  ? -23.39575 -25.70646 3.58788   1.000 41.53493  ? 58   THR A HG23  1 
ATOM   928  N N     . LYS A 1 59  ? -19.08122 -27.04264 1.59260   1.000 48.36901  ? 59   LYS A N     1 
ATOM   929  C CA    . LYS A 1 59  ? -18.20618 -27.86081 0.76072   1.000 43.40287  ? 59   LYS A CA    1 
ATOM   930  C C     . LYS A 1 59  ? -18.92508 -29.12092 0.28920   1.000 41.73710  ? 59   LYS A C     1 
ATOM   931  O O     . LYS A 1 59  ? -18.72831 -29.57161 -0.84552  1.000 46.15460  ? 59   LYS A O     1 
ATOM   932  C CB    . LYS A 1 59  ? -16.93627 -28.22446 1.53134   1.000 49.85202  ? 59   LYS A CB    1 
ATOM   933  C CG    . LYS A 1 59  ? -16.19702 -27.03108 2.13356   1.000 68.75831  ? 59   LYS A CG    1 
ATOM   934  C CD    . LYS A 1 59  ? -14.79473 -27.41276 2.62387   1.000 65.93479  ? 59   LYS A CD    1 
ATOM   935  C CE    . LYS A 1 59  ? -14.82518 -28.36160 3.81895   1.000 65.42543  ? 59   LYS A CE    1 
ATOM   936  N NZ    . LYS A 1 59  ? -14.85260 -27.64476 5.12775   1.000 64.65225  ? 59   LYS A NZ    1 
ATOM   937  H H     . LYS A 1 59  ? -18.80090 -26.91153 2.39499   1.000 58.14252  ? 59   LYS A H     1 
ATOM   938  H HA    . LYS A 1 59  ? -17.94486 -27.34864 -0.02050  1.000 52.18315  ? 59   LYS A HA    1 
ATOM   939  H HB2   . LYS A 1 59  ? -17.17637 -28.81829 2.25977   1.000 59.92213  ? 59   LYS A HB2   1 
ATOM   940  H HB3   . LYS A 1 59  ? -16.32511 -28.67245 0.92580   1.000 59.92213  ? 59   LYS A HB3   1 
ATOM   941  H HG2   . LYS A 1 59  ? -16.10446 -26.33943 1.45980   1.000 82.60968  ? 59   LYS A HG2   1 
ATOM   942  H HG3   . LYS A 1 59  ? -16.70053 -26.69198 2.89013   1.000 82.60968  ? 59   LYS A HG3   1 
ATOM   943  H HD2   . LYS A 1 59  ? -14.31665 -27.85314 1.90386   1.000 79.22145  ? 59   LYS A HD2   1 
ATOM   944  H HD3   . LYS A 1 59  ? -14.32334 -26.60849 2.89189   1.000 79.22145  ? 59   LYS A HD3   1 
ATOM   945  H HE2   . LYS A 1 59  ? -15.62056 -28.91403 3.76355   1.000 78.61023  ? 59   LYS A HE2   1 
ATOM   946  H HE3   . LYS A 1 59  ? -14.03183 -28.91939 3.79978   1.000 78.61023  ? 59   LYS A HE3   1 
ATOM   947  H HZ1   . LYS A 1 59  ? -14.91703 -28.23077 5.79449   1.000 77.68241  ? 59   LYS A HZ1   1 
ATOM   948  H HZ2   . LYS A 1 59  ? -14.10641 -27.17077 5.23091   1.000 77.68241  ? 59   LYS A HZ2   1 
ATOM   949  H HZ3   . LYS A 1 59  ? -15.55113 -27.09413 5.15865   1.000 77.68241  ? 59   LYS A HZ3   1 
ATOM   950  N N     . ALA A 1 60  ? -19.77294 -29.69710 1.14421   1.000 35.59167  ? 60   ALA A N     1 
ATOM   951  C CA    . ALA A 1 60  ? -20.46290 -30.93266 0.78819   1.000 35.86575  ? 60   ALA A CA    1 
ATOM   952  C C     . ALA A 1 60  ? -21.49710 -30.69518 -0.30568  1.000 38.73341  ? 60   ALA A C     1 
ATOM   953  O O     . ALA A 1 60  ? -21.59175 -31.47024 -1.26470  1.000 35.03143  ? 60   ALA A O     1 
ATOM   954  C CB    . ALA A 1 60  ? -21.12702 -31.53557 2.02566   1.000 38.25497  ? 60   ALA A CB    1 
ATOM   955  H H     . ALA A 1 60  ? -19.96275 -29.39516 1.92677   1.000 42.80971  ? 60   ALA A H     1 
ATOM   956  H HA    . ALA A 1 60  ? -19.80891 -31.56550 0.45247   1.000 42.54035  ? 60   ALA A HA    1 
ATOM   957  H HB1   . ALA A 1 60  ? -21.59518 -32.34566 1.76976   1.000 45.40742  ? 60   ALA A HB1   1 
ATOM   958  H HB2   . ALA A 1 60  ? -20.44333 -31.74196 2.68206   1.000 45.40742  ? 60   ALA A HB2   1 
ATOM   959  H HB3   . ALA A 1 60  ? -21.75423 -30.89283 2.39224   1.000 45.40742  ? 60   ALA A HB3   1 
ATOM   960  N N     . THR A 1 61  ? -22.29813 -29.63655 -0.17161  1.000 33.23928  ? 61   THR A N     1 
ATOM   961  C CA    . THR A 1 61  ? -23.30740 -29.35955 -1.18669  1.000 32.12272  ? 61   THR A CA    1 
ATOM   962  C C     . THR A 1 61  ? -22.65711 -29.08670 -2.53625  1.000 32.04010  ? 61   THR A C     1 
ATOM   963  O O     . THR A 1 61  ? -23.17072 -29.50680 -3.57967  1.000 32.77000  ? 61   THR A O     1 
ATOM   964  C CB    . THR A 1 61  ? -24.17481 -28.17567 -0.76468  1.000 35.43977  ? 61   THR A CB    1 
ATOM   965  O OG1   . THR A 1 61  ? -24.64794 -28.37950 0.57129   1.000 43.36466  ? 61   THR A OG1   1 
ATOM   966  C CG2   . THR A 1 61  ? -25.36570 -28.03407 -1.69925  1.000 42.05904  ? 61   THR A CG2   1 
ATOM   967  H H     . THR A 1 61  ? -22.27679 -29.07811 0.48206   1.000 39.48467  ? 61   THR A H     1 
ATOM   968  H HA    . THR A 1 61  ? -23.88464 -30.13427 -1.27338  1.000 38.64697  ? 61   THR A HA    1 
ATOM   969  H HB    . THR A 1 61  ? -23.65147 -27.35983 -0.80250  1.000 42.62743  ? 61   THR A HB    1 
ATOM   970  H HG1   . THR A 1 61  ? -24.00422 -28.35769 1.11050   1.000 52.13730  ? 61   THR A HG1   1 
ATOM   971  H HG21  . THR A 1 61  ? -25.94407 -27.31791 -1.39347  1.000 50.57055  ? 61   THR A HG21  1 
ATOM   972  H HG22  . THR A 1 61  ? -25.06040 -27.83051 -2.59716  1.000 50.57055  ? 61   THR A HG22  1 
ATOM   973  H HG23  . THR A 1 61  ? -25.87218 -28.86111 -1.71889  1.000 50.57055  ? 61   THR A HG23  1 
ATOM   974  N N     . LEU A 1 62  ? -21.52265 -28.38362 -2.53500  1.000 29.83239  ? 62   LEU A N     1 
ATOM   975  C CA    . LEU A 1 62  ? -20.80711 -28.13961 -3.78221  1.000 33.18385  ? 62   LEU A CA    1 
ATOM   976  C C     . LEU A 1 62  ? -20.28891 -29.44331 -4.37627  1.000 40.16029  ? 62   LEU A C     1 
ATOM   977  O O     . LEU A 1 62  ? -20.37815 -29.65671 -5.59219  1.000 35.34127  ? 62   LEU A O     1 
ATOM   978  C CB    . LEU A 1 62  ? -19.65862 -27.16115 -3.54090  1.000 29.29582  ? 62   LEU A CB    1 
ATOM   979  C CG    . LEU A 1 62  ? -18.82554 -26.77410 -4.76371  1.000 34.64791  ? 62   LEU A CG    1 
ATOM   980  C CD1   . LEU A 1 62  ? -19.65526 -25.96101 -5.75105  1.000 36.22656  ? 62   LEU A CD1   1 
ATOM   981  C CD2   . LEU A 1 62  ? -17.58194 -26.00282 -4.34811  1.000 28.82178  ? 62   LEU A CD2   1 
ATOM   982  H H     . LEU A 1 62  ? -21.15382 -28.04349 -1.83652  1.000 35.30032  ? 62   LEU A H     1 
ATOM   983  H HA    . LEU A 1 62  ? -21.41319 -27.73599 -4.42304  1.000 39.92033  ? 62   LEU A HA    1 
ATOM   984  H HB2   . LEU A 1 62  ? -20.03224 -26.34223 -3.17939  1.000 35.25469  ? 62   LEU A HB2   1 
ATOM   985  H HB3   . LEU A 1 62  ? -19.05263 -27.56148 -2.89793  1.000 35.25469  ? 62   LEU A HB3   1 
ATOM   986  H HG    . LEU A 1 62  ? -18.53916 -27.58540 -5.21167  1.000 41.67721  ? 62   LEU A HG    1 
ATOM   987  H HD11  . LEU A 1 62  ? -19.08875 -25.68721 -6.48929  1.000 43.57158  ? 62   LEU A HD11  1 
ATOM   988  H HD12  . LEU A 1 62  ? -20.38372 -26.51096 -6.07941  1.000 43.57158  ? 62   LEU A HD12  1 
ATOM   989  H HD13  . LEU A 1 62  ? -20.00892 -25.17962 -5.29801  1.000 43.57158  ? 62   LEU A HD13  1 
ATOM   990  H HD21  . LEU A 1 62  ? -17.06082 -25.79397 -5.13913  1.000 34.68584  ? 62   LEU A HD21  1 
ATOM   991  H HD22  . LEU A 1 62  ? -17.85199 -25.18375 -3.90415  1.000 34.68584  ? 62   LEU A HD22  1 
ATOM   992  H HD23  . LEU A 1 62  ? -17.05852 -26.55039 -3.74223  1.000 34.68584  ? 62   LEU A HD23  1 
ATOM   993  N N     . ALA A 1 63  ? -19.74530 -30.32544 -3.53440  1.000 34.59529  ? 63   ALA A N     1 
ATOM   994  C CA    . ALA A 1 63  ? -19.28005 -31.62246 -4.01464  1.000 35.92526  ? 63   ALA A CA    1 
ATOM   995  C C     . ALA A 1 63  ? -20.39646 -32.36992 -4.73182  1.000 38.36103  ? 63   ALA A C     1 
ATOM   996  O O     . ALA A 1 63  ? -20.22256 -32.83589 -5.86373  1.000 40.68425  ? 63   ALA A O     1 
ATOM   997  C CB    . ALA A 1 63  ? -18.74685 -32.45240 -2.84654  1.000 33.83249  ? 63   ALA A CB    1 
ATOM   998  H H     . ALA A 1 63  ? -19.63652 -30.19728 -2.69099  1.000 41.61405  ? 63   ALA A H     1 
ATOM   999  H HA    . ALA A 1 63  ? -18.55441 -31.48147 -4.64271  1.000 43.21002  ? 63   ALA A HA    1 
ATOM   1000 H HB1   . ALA A 1 63  ? -18.44590 -33.31170 -3.18111  1.000 40.10044  ? 63   ALA A HB1   1 
ATOM   1001 H HB2   . ALA A 1 63  ? -18.00629 -31.97972 -2.43539  1.000 40.10044  ? 63   ALA A HB2   1 
ATOM   1002 H HB3   . ALA A 1 63  ? -19.45796 -32.58007 -2.19930  1.000 40.10044  ? 63   ALA A HB3   1 
ATOM   1003 N N     . GLU A 1 64  ? -21.55472 -32.49917 -4.08023  1.000 39.06044  ? 64   GLU A N     1 
ATOM   1004 C CA    . GLU A 1 64  ? -22.68647 -33.16683 -4.71363  1.000 41.70560  ? 64   GLU A CA    1 
ATOM   1005 C C     . GLU A 1 64  ? -23.10160 -32.43992 -5.98467  1.000 34.40105  ? 64   GLU A C     1 
ATOM   1006 O O     . GLU A 1 64  ? -23.41838 -33.07286 -6.99821  1.000 37.27468  ? 64   GLU A O     1 
ATOM   1007 C CB    . GLU A 1 64  ? -23.85857 -33.24880 -3.73524  1.000 34.21718  ? 64   GLU A CB    1 
ATOM   1008 C CG    . GLU A 1 64  ? -25.04454 -34.08232 -4.21980  1.000 52.44942  ? 64   GLU A CG    1 
ATOM   1009 C CD    . GLU A 1 64  ? -24.80383 -35.58249 -4.11529  1.000 73.67878  ? 64   GLU A CD    1 
ATOM   1010 O OE1   . GLU A 1 64  ? -23.70255 -36.04348 -4.48578  1.000 69.84741  ? 64   GLU A OE1   1 
ATOM   1011 O OE2   . GLU A 1 64  ? -25.71752 -36.30199 -3.65457  1.000 82.37608  ? 64   GLU A OE2   1 
ATOM   1012 H H     . GLU A 1 64  ? -21.70684 -32.21307 -3.28361  1.000 46.97224  ? 64   GLU A H     1 
ATOM   1013 H HA    . GLU A 1 64  ? -22.42977 -34.07180 -4.95035  1.000 50.14643  ? 64   GLU A HA    1 
ATOM   1014 H HB2   . GLU A 1 64  ? -23.54186 -33.64586 -2.90884  1.000 40.56207  ? 64   GLU A HB2   1 
ATOM   1015 H HB3   . GLU A 1 64  ? -24.18308 -32.35004 -3.56845  1.000 40.56207  ? 64   GLU A HB3   1 
ATOM   1016 H HG2   . GLU A 1 64  ? -25.82180 -33.86661 -3.68106  1.000 63.03901  ? 64   GLU A HG2   1 
ATOM   1017 H HG3   . GLU A 1 64  ? -25.21747 -33.87204 -5.15081  1.000 63.03901  ? 64   GLU A HG3   1 
ATOM   1018 N N     . MET A 1 65  ? -23.09827 -31.10727 -5.95102  1.000 33.85071  ? 65   MET A N     1 
ATOM   1019 C CA    . MET A 1 65  ? -23.50371 -30.33359 -7.11865  1.000 29.22702  ? 65   MET A CA    1 
ATOM   1020 C C     . MET A 1 65  ? -22.56891 -30.59311 -8.29353  1.000 34.29417  ? 65   MET A C     1 
ATOM   1021 O O     . MET A 1 65  ? -23.01500 -30.94161 -9.39250  1.000 31.90256  ? 65   MET A O     1 
ATOM   1022 C CB    . MET A 1 65  ? -23.52947 -28.84594 -6.76329  1.000 32.36981  ? 65   MET A CB    1 
ATOM   1023 C CG    . MET A 1 65  ? -24.23119 -27.95887 -7.78181  1.000 43.97560  ? 65   MET A CG    1 
ATOM   1024 S SD    . MET A 1 65  ? -23.98113 -26.19993 -7.45844  1.000 50.37499  ? 65   MET A SD    1 
ATOM   1025 C CE    . MET A 1 65  ? -24.21121 -26.14531 -5.67859  1.000 29.42158  ? 65   MET A CE    1 
ATOM   1026 H H     . MET A 1 65  ? -22.86797 -30.63337 -5.27133  1.000 40.72056  ? 65   MET A H     1 
ATOM   1027 H HA    . MET A 1 65  ? -24.40192 -30.59568 -7.37444  1.000 34.57387  ? 65   MET A HA    1 
ATOM   1028 H HB2   . MET A 1 65  ? -23.99093 -28.73962 -5.91673  1.000 38.94348  ? 65   MET A HB2   1 
ATOM   1029 H HB3   . MET A 1 65  ? -22.61494 -28.53244 -6.68428  1.000 38.94348  ? 65   MET A HB3   1 
ATOM   1030 H HG2   . MET A 1 65  ? -23.88280 -28.15463 -8.66567  1.000 52.87043  ? 65   MET A HG2   1 
ATOM   1031 H HG3   . MET A 1 65  ? -25.18424 -28.13724 -7.75388  1.000 52.87043  ? 65   MET A HG3   1 
ATOM   1032 H HE1   . MET A 1 65  ? -24.28560 -25.21975 -5.39803  1.000 35.40561  ? 65   MET A HE1   1 
ATOM   1033 H HE2   . MET A 1 65  ? -25.02190 -26.62640 -5.45005  1.000 35.40561  ? 65   MET A HE2   1 
ATOM   1034 H HE3   . MET A 1 65  ? -23.44754 -26.56095 -5.24854  1.000 35.40561  ? 65   MET A HE3   1 
ATOM   1035 N N     . LEU A 1 66  ? -21.26009 -30.44291 -8.07353  1.000 34.56524  ? 66   LEU A N     1 
ATOM   1036 C CA    . LEU A 1 66  ? -20.30361 -30.58946 -9.16658  1.000 33.65535  ? 66   LEU A CA    1 
ATOM   1037 C C     . LEU A 1 66  ? -20.28409 -32.01426 -9.70184  1.000 36.66339  ? 66   LEU A C     1 
ATOM   1038 O O     . LEU A 1 66  ? -20.10930 -32.22727 -10.90794 1.000 38.22623  ? 66   LEU A O     1 
ATOM   1039 C CB    . LEU A 1 66  ? -18.91127 -30.17353 -8.69786  1.000 31.36040  ? 66   LEU A CB    1 
ATOM   1040 C CG    . LEU A 1 66  ? -18.73705 -28.66663 -8.50506  1.000 32.05862  ? 66   LEU A CG    1 
ATOM   1041 C CD1   . LEU A 1 66  ? -17.44302 -28.36054 -7.78150  1.000 30.58804  ? 66   LEU A CD1   1 
ATOM   1042 C CD2   . LEU A 1 66  ? -18.78541 -27.95209 -9.84946  1.000 38.18825  ? 66   LEU A CD2   1 
ATOM   1043 H H     . LEU A 1 66  ? -20.90690 -30.25870 -7.31135  1.000 41.57800  ? 66   LEU A H     1 
ATOM   1044 H HA    . LEU A 1 66  ? -20.56728 -30.00266 -9.89256  1.000 40.48613  ? 66   LEU A HA    1 
ATOM   1045 H HB2   . LEU A 1 66  ? -18.73072 -30.60226 -7.84669  1.000 37.73219  ? 66   LEU A HB2   1 
ATOM   1046 H HB3   . LEU A 1 66  ? -18.26322 -30.46280 -9.35911  1.000 37.73219  ? 66   LEU A HB3   1 
ATOM   1047 H HG    . LEU A 1 66  ? -19.46525 -28.33315 -7.95787  1.000 38.57005  ? 66   LEU A HG    1 
ATOM   1048 H HD11  . LEU A 1 66  ? -17.36389 -27.40040 -7.66846  1.000 36.80535  ? 66   LEU A HD11  1 
ATOM   1049 H HD12  . LEU A 1 66  ? -17.45529 -28.79576 -6.91471  1.000 36.80535  ? 66   LEU A HD12  1 
ATOM   1050 H HD13  . LEU A 1 66  ? -16.70004 -28.69389 -8.30853  1.000 36.80535  ? 66   LEU A HD13  1 
ATOM   1051 H HD21  . LEU A 1 66  ? -18.48918 -27.03605 -9.73107  1.000 45.92561  ? 66   LEU A HD21  1 
ATOM   1052 H HD22  . LEU A 1 66  ? -18.20030 -28.41107 -10.47227 1.000 45.92561  ? 66   LEU A HD22  1 
ATOM   1053 H HD23  . LEU A 1 66  ? -19.69683 -27.96474 -10.18122 1.000 45.92561  ? 66   LEU A HD23  1 
ATOM   1054 N N     . ALA A 1 67  ? -20.45195 -33.00317 -8.82246  1.000 36.87059  ? 67   ALA A N     1 
ATOM   1055 C CA    . ALA A 1 67  ? -20.55159 -34.38373 -9.28026  1.000 31.57645  ? 67   ALA A CA    1 
ATOM   1056 C C     . ALA A 1 67  ? -21.74312 -34.55570 -10.21373 1.000 41.81943  ? 67   ALA A C     1 
ATOM   1057 O O     . ALA A 1 67  ? -21.62809 -35.16425 -11.28399 1.000 50.00266  ? 67   ALA A O     1 
ATOM   1058 C CB    . ALA A 1 67  ? -20.66308 -35.32630 -8.08346  1.000 35.04046  ? 67   ALA A CB    1 
ATOM   1059 H H     . ALA A 1 67  ? -20.50999 -32.90127 -7.97049  1.000 44.34442  ? 67   ALA A H     1 
ATOM   1060 H HA    . ALA A 1 67  ? -19.74531 -34.61484 -9.76749  1.000 37.39320  ? 67   ALA A HA    1 
ATOM   1061 H HB1   . ALA A 1 67  ? -20.73031 -36.23885 -8.40537  1.000 42.14827  ? 67   ALA A HB1   1 
ATOM   1062 H HB2   . ALA A 1 67  ? -19.87281 -35.22829 -7.52960  1.000 42.14827  ? 67   ALA A HB2   1 
ATOM   1063 H HB3   . ALA A 1 67  ? -21.45528 -35.09636 -7.57311  1.000 42.14827  ? 67   ALA A HB3   1 
ATOM   1064 N N     . ARG A 1 68  ? -22.90294 -34.02168 -9.82268  1.000 33.82457  ? 68   ARG A N     1 
ATOM   1065 C CA    . ARG A 1 68  ? -24.06861 -34.08753 -10.69625 1.000 35.99518  ? 68   ARG A CA    1 
ATOM   1066 C C     . ARG A 1 68  ? -23.80226 -33.36576 -12.00853 1.000 42.74583  ? 68   ARG A C     1 
ATOM   1067 O O     . ARG A 1 68  ? -24.21282 -33.83041 -13.07884 1.000 42.16971  ? 68   ARG A O     1 
ATOM   1068 C CB    . ARG A 1 68  ? -25.28907 -33.48714 -9.99816  1.000 39.35568  ? 68   ARG A CB    1 
ATOM   1069 C CG    . ARG A 1 68  ? -25.84825 -34.33861 -8.86870  1.000 46.92518  ? 68   ARG A CG    1 
ATOM   1070 C CD    . ARG A 1 68  ? -26.97334 -33.62162 -8.13474  1.000 55.04420  ? 68   ARG A CD    1 
ATOM   1071 N NE    . ARG A 1 68  ? -27.50122 -34.41991 -7.03447  1.000 76.70927  ? 68   ARG A NE    1 
ATOM   1072 C CZ    . ARG A 1 68  ? -28.50860 -34.05102 -6.25495  1.000 92.49690  ? 68   ARG A CZ    1 
ATOM   1073 N NH1   . ARG A 1 68  ? -29.12663 -32.89395 -6.42514  1.000 109.50317 ? 68   ARG A NH1   1 
ATOM   1074 N NH2   . ARG A 1 68  ? -28.90649 -34.86447 -5.28092  1.000 97.61512  ? 68   ARG A NH2   1 
ATOM   1075 H H     . ARG A 1 68  ? -23.03617 -33.62442 -9.07166  1.000 40.68919  ? 68   ARG A H     1 
ATOM   1076 H HA    . ARG A 1 68  ? -24.26308 -35.01801 -10.88937 1.000 43.29393  ? 68   ARG A HA    1 
ATOM   1077 H HB2   . ARG A 1 68  ? -25.03928 -32.62847 -9.62241  1.000 47.32653  ? 68   ARG A HB2   1 
ATOM   1078 H HB3   . ARG A 1 68  ? -25.99406 -33.36984 -10.65400 1.000 47.32653  ? 68   ARG A HB3   1 
ATOM   1079 H HG2   . ARG A 1 68  ? -26.20045 -35.16548 -9.23358  1.000 56.40993  ? 68   ARG A HG2   1 
ATOM   1080 H HG3   . ARG A 1 68  ? -25.14257 -34.53113 -8.23162  1.000 56.40993  ? 68   ARG A HG3   1 
ATOM   1081 H HD2   . ARG A 1 68  ? -26.63680 -32.78801 -7.77041  1.000 66.15275  ? 68   ARG A HD2   1 
ATOM   1082 H HD3   . ARG A 1 68  ? -27.69742 -33.44413 -8.75530  1.000 66.15275  ? 68   ARG A HD3   1 
ATOM   1083 H HE    . ARG A 1 68  ? -27.13405 -35.18220 -6.88056  1.000 92.15083  ? 68   ARG A HE    1 
ATOM   1084 H HH11  . ARG A 1 68  ? -28.87722 -32.36146 -7.05272  1.000 131.50351 ? 68   ARG A HH11  1 
ATOM   1085 H HH12  . ARG A 1 68  ? -29.77784 -32.67417 -5.90821  1.000 131.50351 ? 68   ARG A HH12  1 
ATOM   1086 H HH21  . ARG A 1 68  ? -28.51153 -35.61923 -5.16280  1.000 117.23786 ? 68   ARG A HH21  1 
ATOM   1087 H HH22  . ARG A 1 68  ? -29.55873 -34.63573 -4.76920  1.000 117.23786 ? 68   ARG A HH22  1 
ATOM   1088 N N     . MET A 1 69  ? -23.09749 -32.23353 -11.94535 1.000 41.98156  ? 69   MET A N     1 
ATOM   1089 C CA    . MET A 1 69  ? -22.90300 -31.41702 -13.13788 1.000 39.46206  ? 69   MET A CA    1 
ATOM   1090 C C     . MET A 1 69  ? -21.95297 -32.08784 -14.12141 1.000 40.08286  ? 69   MET A C     1 
ATOM   1091 O O     . MET A 1 69  ? -22.15714 -32.00340 -15.33721 1.000 39.67561  ? 69   MET A O     1 
ATOM   1092 C CB    . MET A 1 69  ? -22.39897 -30.02599 -12.74258 1.000 39.45582  ? 69   MET A CB    1 
ATOM   1093 C CG    . MET A 1 69  ? -23.50540 -29.10376 -12.22343 1.000 38.02197  ? 69   MET A CG    1 
ATOM   1094 S SD    . MET A 1 69  ? -22.94582 -27.59832 -11.39128 1.000 38.77886  ? 69   MET A SD    1 
ATOM   1095 C CE    . MET A 1 69  ? -22.03738 -26.77659 -12.69451 1.000 36.56361  ? 69   MET A CE    1 
ATOM   1096 H H     . MET A 1 69  ? -22.72790 -31.92235 -11.23389 1.000 50.47759  ? 69   MET A H     1 
ATOM   1097 H HA    . MET A 1 69  ? -23.75971 -31.30113 -13.57779 1.000 47.45418  ? 69   MET A HA    1 
ATOM   1098 H HB2   . MET A 1 69  ? -21.73644 -30.12070 -12.04045 1.000 47.44670  ? 69   MET A HB2   1 
ATOM   1099 H HB3   . MET A 1 69  ? -22.00047 -29.60455 -13.52007 1.000 47.44670  ? 69   MET A HB3   1 
ATOM   1100 H HG2   . MET A 1 69  ? -24.05184 -28.82962 -12.97652 1.000 45.72607  ? 69   MET A HG2   1 
ATOM   1101 H HG3   . MET A 1 69  ? -24.04285 -29.60095 -11.58715 1.000 45.72607  ? 69   MET A HG3   1 
ATOM   1102 H HE1   . MET A 1 69  ? -21.69618 -25.93314 -12.35825 1.000 43.97604  ? 69   MET A HE1   1 
ATOM   1103 H HE2   . MET A 1 69  ? -21.30134 -27.34390 -12.97255 1.000 43.97604  ? 69   MET A HE2   1 
ATOM   1104 H HE3   . MET A 1 69  ? -22.63342 -26.61746 -13.44306 1.000 43.97604  ? 69   MET A HE3   1 
ATOM   1105 N N     . GLU A 1 70  ? -20.91701 -32.76882 -13.62897 1.000 38.20670  ? 70   GLU A N     1 
ATOM   1106 C CA    . GLU A 1 70  ? -20.01596 -33.43568 -14.56173 1.000 47.35281  ? 70   GLU A CA    1 
ATOM   1107 C C     . GLU A 1 70  ? -20.61629 -34.74031 -15.06709 1.000 43.93652  ? 70   GLU A C     1 
ATOM   1108 O O     . GLU A 1 70  ? -20.30159 -35.17136 -16.18195 1.000 55.48546  ? 70   GLU A O     1 
ATOM   1109 C CB    . GLU A 1 70  ? -18.64488 -33.66777 -13.92313 1.000 42.35207  ? 70   GLU A CB    1 
ATOM   1110 C CG    . GLU A 1 70  ? -18.59195 -34.71760 -12.84082 1.000 55.39029  ? 70   GLU A CG    1 
ATOM   1111 C CD    . GLU A 1 70  ? -17.16594 -35.01025 -12.39173 1.000 55.97911  ? 70   GLU A CD    1 
ATOM   1112 O OE1   . GLU A 1 70  ? -16.22777 -34.37815 -12.92206 1.000 44.68875  ? 70   GLU A OE1   1 
ATOM   1113 O OE2   . GLU A 1 70  ? -16.98365 -35.87048 -11.50523 1.000 59.28890  ? 70   GLU A OE2   1 
ATOM   1114 H H     . GLU A 1 70  ? -20.72405 -32.85503 -12.79534 1.000 45.94775  ? 70   GLU A H     1 
ATOM   1115 H HA    . GLU A 1 70  ? -19.86428 -32.85904 -15.32683 1.000 56.92308  ? 70   GLU A HA    1 
ATOM   1116 H HB2   . GLU A 1 70  ? -18.02811 -33.94222 -14.61968 1.000 50.92220  ? 70   GLU A HB2   1 
ATOM   1117 H HB3   . GLU A 1 70  ? -18.34882 -32.83286 -13.52794 1.000 50.92220  ? 70   GLU A HB3   1 
ATOM   1118 H HG2   . GLU A 1 70  ? -19.09346 -34.40654 -12.07099 1.000 66.56806  ? 70   GLU A HG2   1 
ATOM   1119 H HG3   . GLU A 1 70  ? -18.97792 -35.54139 -13.17742 1.000 66.56806  ? 70   GLU A HG3   1 
ATOM   1120 N N     . ASN A 1 71  ? -21.49298 -35.36742 -14.27945 1.000 44.45455  ? 71   ASN A N     1 
ATOM   1121 C CA    . ASN A 1 71  ? -22.22273 -36.52499 -14.78292 1.000 49.06537  ? 71   ASN A CA    1 
ATOM   1122 C C     . ASN A 1 71  ? -23.16339 -36.13009 -15.91195 1.000 49.58765  ? 71   ASN A C     1 
ATOM   1123 O O     . ASN A 1 71  ? -23.46437 -36.95174 -16.78520 1.000 55.56857  ? 71   ASN A O     1 
ATOM   1124 C CB    . ASN A 1 71  ? -23.00234 -37.19656 -13.65381 1.000 50.25549  ? 71   ASN A CB    1 
ATOM   1125 C CG    . ASN A 1 71  ? -22.10914 -37.99828 -12.72707 1.000 57.90905  ? 71   ASN A CG    1 
ATOM   1126 O OD1   . ASN A 1 71  ? -21.08673 -38.54273 -13.14653 1.000 65.17184  ? 71   ASN A OD1   1 
ATOM   1127 N ND2   . ASN A 1 71  ? -22.49260 -38.07715 -11.45935 1.000 62.57322  ? 71   ASN A ND2   1 
ATOM   1128 H H     . ASN A 1 71  ? -21.67766 -35.14618 -13.46918 1.000 53.44517  ? 71   ASN A H     1 
ATOM   1129 H HA    . ASN A 1 71  ? -21.58649 -37.17254 -15.12464 1.000 58.97816  ? 71   ASN A HA    1 
ATOM   1130 H HB2   . ASN A 1 71  ? -23.44760 -36.51463 -13.12691 1.000 60.40629  ? 71   ASN A HB2   1 
ATOM   1131 H HB3   . ASN A 1 71  ? -23.65771 -37.80048 -14.03678 1.000 60.40629  ? 71   ASN A HB3   1 
ATOM   1132 H HD21  . ASN A 1 71  ? -22.01996 -38.52044 -10.89393 1.000 75.18758  ? 71   ASN A HD21  1 
ATOM   1133 H HD22  . ASN A 1 71  ? -23.21380 -37.68498 -11.20306 1.000 75.18758  ? 71   ASN A HD22  1 
ATOM   1134 N N     . ARG A 1 72  ? -23.63020 -34.88466 -15.91218 1.000 45.32579  ? 72   ARG A N     1 
ATOM   1135 C CA    . ARG A 1 72  ? -24.45644 -34.35158 -16.98351 1.000 46.44265  ? 72   ARG A CA    1 
ATOM   1136 C C     . ARG A 1 72  ? -23.63458 -33.72935 -18.10776 1.000 40.16003  ? 72   ARG A C     1 
ATOM   1137 O O     . ARG A 1 72  ? -24.21065 -33.11777 -19.01274 1.000 55.68237  ? 72   ARG A O     1 
ATOM   1138 C CB    . ARG A 1 72  ? -25.42543 -33.30998 -16.42308 1.000 40.64533  ? 72   ARG A CB    1 
ATOM   1139 C CG    . ARG A 1 72  ? -26.36816 -33.84664 -15.36394 1.000 49.89263  ? 72   ARG A CG    1 
ATOM   1140 C CD    . ARG A 1 72  ? -26.99387 -32.70941 -14.57417 1.000 45.95945  ? 72   ARG A CD    1 
ATOM   1141 N NE    . ARG A 1 72  ? -27.55500 -31.68640 -15.44908 1.000 62.92088  ? 72   ARG A NE    1 
ATOM   1142 C CZ    . ARG A 1 72  ? -27.99832 -30.50642 -15.03669 1.000 57.72843  ? 72   ARG A CZ    1 
ATOM   1143 N NH1   . ARG A 1 72  ? -27.95120 -30.15787 -13.76106 1.000 50.20393  ? 72   ARG A NH1   1 
ATOM   1144 N NH2   . ARG A 1 72  ? -28.49774 -29.65335 -15.92711 1.000 48.95894  ? 72   ARG A NH2   1 
ATOM   1145 H H     . ARG A 1 72  ? -23.47630 -34.31667 -15.28505 1.000 54.49065  ? 72   ARG A H     1 
ATOM   1146 H HA    . ARG A 1 72  ? -24.97631 -35.07808 -17.36145 1.000 55.83089  ? 72   ARG A HA    1 
ATOM   1147 H HB2   . ARG A 1 72  ? -24.91122 -32.59143 -16.02286 1.000 48.87411  ? 72   ARG A HB2   1 
ATOM   1148 H HB3   . ARG A 1 72  ? -25.96591 -32.96551 -17.15118 1.000 48.87411  ? 72   ARG A HB3   1 
ATOM   1149 H HG2   . ARG A 1 72  ? -27.07775 -34.35375 -15.78847 1.000 59.97086  ? 72   ARG A HG2   1 
ATOM   1150 H HG3   . ARG A 1 72  ? -25.87650 -34.41412 -14.74983 1.000 59.97086  ? 72   ARG A HG3   1 
ATOM   1151 H HD2   . ARG A 1 72  ? -27.70836 -33.06017 -14.01976 1.000 55.25105  ? 72   ARG A HD2   1 
ATOM   1152 H HD3   . ARG A 1 72  ? -26.31559 -32.29492 -14.01825 1.000 55.25105  ? 72   ARG A HD3   1 
ATOM   1153 H HE    . ARG A 1 72  ? -27.60163 -31.86019 -16.29004 1.000 75.60477  ? 72   ARG A HE    1 
ATOM   1154 H HH11  . ARG A 1 72  ? -27.62773 -30.70148 -13.17843 1.000 60.34443  ? 72   ARG A HH11  1 
ATOM   1155 H HH12  . ARG A 1 72  ? -28.24405 -29.38773 -13.51463 1.000 60.34443  ? 72   ARG A HH12  1 
ATOM   1156 H HH21  . ARG A 1 72  ? -28.53021 -29.86983 -16.75878 1.000 58.85044  ? 72   ARG A HH21  1 
ATOM   1157 H HH22  . ARG A 1 72  ? -28.78810 -28.88542 -15.67102 1.000 58.85044  ? 72   ARG A HH22  1 
ATOM   1158 N N     . GLY A 1 73  ? -22.30999 -33.85810 -18.06551 1.000 38.25251  ? 73   GLY A N     1 
ATOM   1159 C CA    . GLY A 1 73  ? -21.47097 -33.32705 -19.12162 1.000 40.79499  ? 73   GLY A CA    1 
ATOM   1160 C C     . GLY A 1 73  ? -21.37804 -31.81968 -19.18206 1.000 38.61746  ? 73   GLY A C     1 
ATOM   1161 O O     . GLY A 1 73  ? -21.06064 -31.27202 -20.24156 1.000 41.35094  ? 73   GLY A O     1 
ATOM   1162 H H     . GLY A 1 73  ? -21.87714 -34.24966 -17.43391 1.000 46.00273  ? 73   GLY A H     1 
ATOM   1163 H HA2   . GLY A 1 73  ? -20.57193 -33.67162 -19.00371 1.000 49.05370  ? 73   GLY A HA2   1 
ATOM   1164 H HA3   . GLY A 1 73  ? -21.81744 -33.63374 -19.97414 1.000 49.05370  ? 73   GLY A HA3   1 
ATOM   1165 N N     . LEU A 1 74  ? -21.63345 -31.12957 -18.07071 1.000 42.92198  ? 74   LEU A N     1 
ATOM   1166 C CA    . LEU A 1 74  ? -21.59583 -29.67314 -18.04468 1.000 32.98650  ? 74   LEU A CA    1 
ATOM   1167 C C     . LEU A 1 74  ? -20.24682 -29.11778 -17.60994 1.000 34.41456  ? 74   LEU A C     1 
ATOM   1168 O O     . LEU A 1 74  ? -19.89403 -27.99854 -18.00068 1.000 32.83359  ? 74   LEU A O     1 
ATOM   1169 C CB    . LEU A 1 74  ? -22.67880 -29.13853 -17.10397 1.000 36.05834  ? 74   LEU A CB    1 
ATOM   1170 C CG    . LEU A 1 74  ? -24.12232 -29.40729 -17.52372 1.000 32.88840  ? 74   LEU A CG    1 
ATOM   1171 C CD1   . LEU A 1 74  ? -25.08159 -28.84645 -16.49213 1.000 35.60760  ? 74   LEU A CD1   1 
ATOM   1172 C CD2   . LEU A 1 74  ? -24.40839 -28.81549 -18.89629 1.000 42.27061  ? 74   LEU A CD2   1 
ATOM   1173 H H     . LEU A 1 74  ? -21.83238 -31.48655 -17.31401 1.000 51.60609  ? 74   LEU A H     1 
ATOM   1174 H HA    . LEU A 1 74  ? -21.77745 -29.34696 -18.93995 1.000 39.19905  ? 74   LEU A HA    1 
ATOM   1175 H HB2   . LEU A 1 74  ? -22.55196 -29.54731 -16.23351 1.000 43.36972  ? 74   LEU A HB2   1 
ATOM   1176 H HB3   . LEU A 1 74  ? -22.57346 -28.17658 -17.03727 1.000 43.36972  ? 74   LEU A HB3   1 
ATOM   1177 H HG    . LEU A 1 74  ? -24.25970 -30.36580 -17.58114 1.000 38.96754  ? 74   LEU A HG    1 
ATOM   1178 H HD11  . LEU A 1 74  ? -25.99165 -29.00434 -16.78839 1.000 42.82883  ? 74   LEU A HD11  1 
ATOM   1179 H HD12  . LEU A 1 74  ? -24.92813 -29.29083 -15.64368 1.000 42.82883  ? 74   LEU A HD12  1 
ATOM   1180 H HD13  . LEU A 1 74  ? -24.92439 -27.89374 -16.39975 1.000 42.82883  ? 74   LEU A HD13  1 
ATOM   1181 H HD21  . LEU A 1 74  ? -25.36421 -28.84317 -19.05916 1.000 50.82445  ? 74   LEU A HD21  1 
ATOM   1182 H HD22  . LEU A 1 74  ? -24.09598 -27.89738 -18.91569 1.000 50.82445  ? 74   LEU A HD22  1 
ATOM   1183 H HD23  . LEU A 1 74  ? -23.94304 -29.33751 -19.56849 1.000 50.82445  ? 74   LEU A HD23  1 
ATOM   1184 N N     . VAL A 1 75  ? -19.49173 -29.86568 -16.79994 1.000 44.13235  ? 75   VAL A N     1 
ATOM   1185 C CA    . VAL A 1 75  ? -18.18653 -29.43654 -16.31778 1.000 35.00563  ? 75   VAL A CA    1 
ATOM   1186 C C     . VAL A 1 75  ? -17.24087 -30.62969 -16.32862 1.000 41.24742  ? 75   VAL A C     1 
ATOM   1187 O O     . VAL A 1 75  ? -17.66173 -31.78833 -16.31978 1.000 39.51060  ? 75   VAL A O     1 
ATOM   1188 C CB    . VAL A 1 75  ? -18.24123 -28.83648 -14.89221 1.000 37.06913  ? 75   VAL A CB    1 
ATOM   1189 C CG1   . VAL A 1 75  ? -19.27746 -27.73365 -14.80967 1.000 34.39843  ? 75   VAL A CG1   1 
ATOM   1190 C CG2   . VAL A 1 75  ? -18.52220 -29.92529 -13.86077 1.000 39.14720  ? 75   VAL A CG2   1 
ATOM   1191 H H     . VAL A 1 75  ? -19.72388 -30.64223 -16.51240 1.000 53.05853  ? 75   VAL A H     1 
ATOM   1192 H HA    . VAL A 1 75  ? -17.84416 -28.75897 -16.92158 1.000 42.10647  ? 75   VAL A HA    1 
ATOM   1193 H HB    . VAL A 1 75  ? -17.37721 -28.44590 -14.68772 1.000 44.58267  ? 75   VAL A HB    1 
ATOM   1194 H HG11  . VAL A 1 75  ? -19.20406 -27.29523 -13.94753 1.000 41.37783  ? 75   VAL A HG11  1 
ATOM   1195 H HG12  . VAL A 1 75  ? -19.11540 -27.09418 -15.52081 1.000 41.37783  ? 75   VAL A HG12  1 
ATOM   1196 H HG13  . VAL A 1 75  ? -20.16069 -28.12213 -14.90909 1.000 41.37783  ? 75   VAL A HG13  1 
ATOM   1197 H HG21  . VAL A 1 75  ? -18.83106 -29.51068 -13.04004 1.000 47.07635  ? 75   VAL A HG21  1 
ATOM   1198 H HG22  . VAL A 1 75  ? -19.20488 -30.52055 -14.20791 1.000 47.07635  ? 75   VAL A HG22  1 
ATOM   1199 H HG23  . VAL A 1 75  ? -17.70509 -30.42068 -13.69395 1.000 47.07635  ? 75   VAL A HG23  1 
ATOM   1200 N N     . ARG A 1 76  ? -15.94469 -30.32622 -16.34343 1.000 45.84222  ? 76   ARG A N     1 
ATOM   1201 C CA    . ARG A 1 76  ? -14.89295 -31.32003 -16.19388 1.000 45.84034  ? 76   ARG A CA    1 
ATOM   1202 C C     . ARG A 1 76  ? -13.96527 -30.87013 -15.07444 1.000 46.98484  ? 76   ARG A C     1 
ATOM   1203 O O     . ARG A 1 76  ? -13.91241 -29.68816 -14.72404 1.000 45.29671  ? 76   ARG A O     1 
ATOM   1204 C CB    . ARG A 1 76  ? -14.10596 -31.52305 -17.49572 1.000 40.56245  ? 76   ARG A CB    1 
ATOM   1205 C CG    . ARG A 1 76  ? -13.39593 -30.28470 -18.01256 1.000 46.10836  ? 76   ARG A CG    1 
ATOM   1206 C CD    . ARG A 1 76  ? -12.63627 -30.58345 -19.30646 1.000 61.57831  ? 76   ARG A CD    1 
ATOM   1207 N NE    . ARG A 1 76  ? -11.78555 -29.47072 -19.71429 1.000 61.10064  ? 76   ARG A NE    1 
ATOM   1208 C CZ    . ARG A 1 76  ? -10.52987 -29.29931 -19.32073 1.000 50.00876  ? 76   ARG A CZ    1 
ATOM   1209 N NH1   . ARG A 1 76  ? -9.92977  -30.16599 -18.52007 1.000 54.84658  ? 76   ARG A NH1   1 
ATOM   1210 N NH2   . ARG A 1 76  ? -9.86053  -28.22865 -19.73774 1.000 61.48172  ? 76   ARG A NH2   1 
ATOM   1211 H H     . ARG A 1 76  ? -15.64383 -29.52660 -16.44188 1.000 55.11037  ? 76   ARG A H     1 
ATOM   1212 H HA    . ARG A 1 76  ? -15.27742 -32.17807 -15.95543 1.000 55.10812  ? 76   ARG A HA    1 
ATOM   1213 H HB2   . ARG A 1 76  ? -13.43163 -32.20369 -17.34435 1.000 48.77465  ? 76   ARG A HB2   1 
ATOM   1214 H HB3   . ARG A 1 76  ? -14.72257 -31.81454 -18.18545 1.000 48.77465  ? 76   ARG A HB3   1 
ATOM   1215 H HG2   . ARG A 1 76  ? -14.04875 -29.59057 -18.19394 1.000 55.42974  ? 76   ARG A HG2   1 
ATOM   1216 H HG3   . ARG A 1 76  ? -12.75993 -29.97654 -17.34815 1.000 55.42974  ? 76   ARG A HG3   1 
ATOM   1217 H HD2   . ARG A 1 76  ? -12.07278 -31.36158 -19.17267 1.000 73.99368  ? 76   ARG A HD2   1 
ATOM   1218 H HD3   . ARG A 1 76  ? -13.27331 -30.75352 -20.01791 1.000 73.99368  ? 76   ARG A HD3   1 
ATOM   1219 H HE    . ARG A 1 76  ? -12.12125 -28.88493 -20.24697 1.000 73.42048  ? 76   ARG A HE    1 
ATOM   1220 H HH11  . ARG A 1 76  ? -10.35454 -30.86026 -18.24230 1.000 65.91561  ? 76   ARG A HH11  1 
ATOM   1221 H HH12  . ARG A 1 76  ? -9.11514  -30.03476 -18.27768 1.000 65.91561  ? 76   ARG A HH12  1 
ATOM   1222 H HH21  . ARG A 1 76  ? -10.24192 -27.65797 -20.25588 1.000 73.87777  ? 76   ARG A HH21  1 
ATOM   1223 H HH22  . ARG A 1 76  ? -9.04624  -28.10690 -19.48931 1.000 73.87777  ? 76   ARG A HH22  1 
ATOM   1224 N N     . ARG A 1 77  ? -13.23034 -31.82480 -14.50931 1.000 51.61928  ? 77   ARG A N     1 
ATOM   1225 C CA    . ARG A 1 77  ? -12.37789 -31.54146 -13.36492 1.000 46.38976  ? 77   ARG A CA    1 
ATOM   1226 C C     . ARG A 1 77  ? -11.06102 -32.29225 -13.48241 1.000 46.61550  ? 77   ARG A C     1 
ATOM   1227 O O     . ARG A 1 77  ? -10.99561 -33.39402 -14.03319 1.000 49.84738  ? 77   ARG A O     1 
ATOM   1228 C CB    . ARG A 1 77  ? -13.07934 -31.91292 -12.05012 1.000 46.39328  ? 77   ARG A CB    1 
ATOM   1229 C CG    . ARG A 1 77  ? -14.36037 -31.13284 -11.80449 1.000 46.47026  ? 77   ARG A CG    1 
ATOM   1230 C CD    . ARG A 1 77  ? -14.93284 -31.41179 -10.42742 1.000 43.28211  ? 77   ARG A CD    1 
ATOM   1231 N NE    . ARG A 1 77  ? -15.55920 -32.72469 -10.34197 1.000 40.07115  ? 77   ARG A NE    1 
ATOM   1232 C CZ    . ARG A 1 77  ? -16.04125 -33.24829 -9.22396  1.000 41.40609  ? 77   ARG A CZ    1 
ATOM   1233 N NH1   . ARG A 1 77  ? -15.96884 -32.60249 -8.07137  1.000 45.39808  ? 77   ARG A NH1   1 
ATOM   1234 N NH2   . ARG A 1 77  ? -16.60931 -34.45001 -9.26305  1.000 47.55546  ? 77   ARG A NH2   1 
ATOM   1235 H H     . ARG A 1 77  ? -13.21039 -32.64326 -14.77261 1.000 62.04284  ? 77   ARG A H     1 
ATOM   1236 H HA    . ARG A 1 77  ? -12.16600 -30.59496 -13.35313 1.000 55.76742  ? 77   ARG A HA    1 
ATOM   1237 H HB2   . ARG A 1 77  ? -13.30528 -32.85599 -12.07185 1.000 55.77165  ? 77   ARG A HB2   1 
ATOM   1238 H HB3   . ARG A 1 77  ? -12.47594 -31.73325 -11.31220 1.000 55.77165  ? 77   ARG A HB3   1 
ATOM   1239 H HG2   . ARG A 1 77  ? -14.17460 -30.18303 -11.86963 1.000 55.86402  ? 77   ARG A HG2   1 
ATOM   1240 H HG3   . ARG A 1 77  ? -15.02244 -31.38753 -12.46608 1.000 55.86402  ? 77   ARG A HG3   1 
ATOM   1241 H HD2   . ARG A 1 77  ? -14.21781 -31.37595 -9.77294  1.000 52.03825  ? 77   ARG A HD2   1 
ATOM   1242 H HD3   . ARG A 1 77  ? -15.60493 -30.74338 -10.22145 1.000 52.03825  ? 77   ARG A HD3   1 
ATOM   1243 H HE    . ARG A 1 77  ? -15.61993 -33.18945 -11.06302 1.000 47.58683  ? 77   ARG A HE    1 
ATOM   1244 H HH11  . ARG A 1 77  ? -15.60273 -31.82510 -8.03630  1.000 54.57741  ? 77   ARG A HH11  1 
ATOM   1245 H HH12  . ARG A 1 77  ? -16.28788 -32.96014 -7.35730  1.000 54.57741  ? 77   ARG A HH12  1 
ATOM   1246 H HH21  . ARG A 1 77  ? -16.66040 -34.87748 -10.00753 1.000 57.16626  ? 77   ARG A HH21  1 
ATOM   1247 H HH22  . ARG A 1 77  ? -16.92559 -34.79972 -8.54383  1.000 57.16626  ? 77   ARG A HH22  1 
ATOM   1248 N N     . GLU A 1 78  ? -10.00855 -31.66952 -12.95887 1.000 47.47314  ? 78   GLU A N     1 
ATOM   1249 C CA    . GLU A 1 78  ? -8.68624  -32.26982 -12.87014 1.000 60.15608  ? 78   GLU A CA    1 
ATOM   1250 C C     . GLU A 1 78  ? -8.18964  -32.12798 -11.43767 1.000 54.82695  ? 78   GLU A C     1 
ATOM   1251 O O     . GLU A 1 78  ? -8.61423  -31.23621 -10.69792 1.000 54.88319  ? 78   GLU A O     1 
ATOM   1252 C CB    . GLU A 1 78  ? -7.70447  -31.62128 -13.85816 1.000 49.56718  ? 78   GLU A CB    1 
ATOM   1253 C CG    . GLU A 1 78  ? -8.04486  -31.88728 -15.32307 1.000 55.39004  ? 78   GLU A CG    1 
ATOM   1254 C CD    . GLU A 1 78  ? -7.18154  -31.09550 -16.29222 1.000 62.30741  ? 78   GLU A CD    1 
ATOM   1255 O OE1   . GLU A 1 78  ? -6.10651  -30.60881 -15.87922 1.000 53.90618  ? 78   GLU A OE1   1 
ATOM   1256 O OE2   . GLU A 1 78  ? -7.58432  -30.95803 -17.46912 1.000 53.34805  ? 78   GLU A OE2   1 
ATOM   1257 H H     . GLU A 1 78  ? -10.03905 -30.87204 -12.63841 1.000 57.06748  ? 78   GLU A H     1 
ATOM   1258 H HA    . GLU A 1 78  ? -8.72785  -33.21448 -13.08647 1.000 72.28700  ? 78   GLU A HA    1 
ATOM   1259 H HB2   . GLU A 1 78  ? -7.71245  -30.66101 -13.72137 1.000 59.58033  ? 78   GLU A HB2   1 
ATOM   1260 H HB3   . GLU A 1 78  ? -6.81588  -31.97275 -13.69151 1.000 59.58033  ? 78   GLU A HB3   1 
ATOM   1261 H HG2   . GLU A 1 78  ? -7.91457  -32.83017 -15.50985 1.000 66.56776  ? 78   GLU A HG2   1 
ATOM   1262 H HG3   . GLU A 1 78  ? -8.97029  -31.64274 -15.48016 1.000 66.56776  ? 78   GLU A HG3   1 
ATOM   1263 N N     . HIS A 1 79  ? -7.28621  -33.02277 -11.05081 1.000 56.05708  ? 79   HIS A N     1 
ATOM   1264 C CA    . HIS A 1 79  ? -6.81547  -33.11925 -9.67860  1.000 58.26029  ? 79   HIS A CA    1 
ATOM   1265 C C     . HIS A 1 79  ? -5.37500  -32.63907 -9.56203  1.000 60.35199  ? 79   HIS A C     1 
ATOM   1266 O O     . HIS A 1 79  ? -4.60716  -32.65229 -10.52747 1.000 56.16964  ? 79   HIS A O     1 
ATOM   1267 C CB    . HIS A 1 79  ? -6.91239  -34.56286 -9.16882  1.000 50.80187  ? 79   HIS A CB    1 
ATOM   1268 C CG    . HIS A 1 79  ? -8.24617  -35.19850 -9.40446  1.000 66.41435  ? 79   HIS A CG    1 
ATOM   1269 N ND1   . HIS A 1 79  ? -8.68628  -35.56269 -10.65889 1.000 61.10353  ? 79   HIS A ND1   1 
ATOM   1270 C CD2   . HIS A 1 79  ? -9.23828  -35.53248 -8.54610  1.000 67.87512  ? 79   HIS A CD2   1 
ATOM   1271 C CE1   . HIS A 1 79  ? -9.89148  -36.09465 -10.56313 1.000 55.52599  ? 79   HIS A CE1   1 
ATOM   1272 N NE2   . HIS A 1 79  ? -10.24934 -36.08834 -9.29175  1.000 71.69993  ? 79   HIS A NE2   1 
ATOM   1273 H H     . HIS A 1 79  ? -6.92461  -33.59677 -11.57937 1.000 67.36820  ? 79   HIS A H     1 
ATOM   1274 H HA    . HIS A 1 79  ? -7.36812  -32.55058 -9.11995  1.000 70.01206  ? 79   HIS A HA    1 
ATOM   1275 H HB2   . HIS A 1 79  ? -6.24449  -35.09948 -9.62363  1.000 61.06196  ? 79   HIS A HB2   1 
ATOM   1276 H HB3   . HIS A 1 79  ? -6.74716  -34.56761 -8.21301  1.000 61.06196  ? 79   HIS A HB3   1 
ATOM   1277 H HD2   . HIS A 1 79  ? -9.23584  -35.40880 -7.62437  1.000 81.54985  ? 79   HIS A HD2   1 
ATOM   1278 H HE1   . HIS A 1 79  ? -10.40121 -36.41846 -11.27039 1.000 66.73090  ? 79   HIS A HE1   1 
ATOM   1279 H HE2   . HIS A 1 79  ? -10.99463 -36.38430 -8.98103  1.000 86.13963  ? 79   HIS A HE2   1 
ATOM   1280 N N     . ASP A 1 80  ? -5.01842  -32.20967 -8.35463  1.000 59.07467  ? 80   ASP A N     1 
ATOM   1281 C CA    . ASP A 1 80  ? -3.63446  -31.88792 -8.03238  1.000 67.98847  ? 80   ASP A CA    1 
ATOM   1282 C C     . ASP A 1 80  ? -2.86412  -33.19077 -7.85366  1.000 62.62398  ? 80   ASP A C     1 
ATOM   1283 O O     . ASP A 1 80  ? -3.23678  -34.02943 -7.02523  1.000 60.10008  ? 80   ASP A O     1 
ATOM   1284 C CB    . ASP A 1 80  ? -3.56499  -31.03416 -6.76776  1.000 58.05270  ? 80   ASP A CB    1 
ATOM   1285 C CG    . ASP A 1 80  ? -2.14832  -30.59880 -6.42606  1.000 62.76229  ? 80   ASP A CG    1 
ATOM   1286 O OD1   . ASP A 1 80  ? -1.18521  -31.28536 -6.82809  1.000 68.60912  ? 80   ASP A OD1   1 
ATOM   1287 O OD2   . ASP A 1 80  ? -1.99729  -29.56452 -5.74396  1.000 67.93611  ? 80   ASP A OD2   1 
ATOM   1288 H H     . ASP A 1 80  ? -5.56479  -32.09584 -7.70032  1.000 70.98932  ? 80   ASP A H     1 
ATOM   1289 H HA    . ASP A 1 80  ? -3.23324  -31.37895 -8.75409  1.000 81.68587  ? 80   ASP A HA    1 
ATOM   1290 H HB2   . ASP A 1 80  ? -4.10097  -30.23590 -6.89590  1.000 69.76294  ? 80   ASP A HB2   1 
ATOM   1291 H HB3   . ASP A 1 80  ? -3.90884  -31.54821 -6.02049  1.000 69.76294  ? 80   ASP A HB3   1 
ATOM   1292 N N     . ALA A 1 81  ? -1.79628  -33.36543 -8.63489  1.000 62.13526  ? 81   ALA A N     1 
ATOM   1293 C CA    . ALA A 1 81  ? -0.97379  -34.56031 -8.49031  1.000 63.84541  ? 81   ALA A CA    1 
ATOM   1294 C C     . ALA A 1 81  ? -0.48020  -34.72305 -7.05906  1.000 63.08397  ? 81   ALA A C     1 
ATOM   1295 O O     . ALA A 1 81  ? -0.24669  -35.84988 -6.60813  1.000 63.94256  ? 81   ALA A O     1 
ATOM   1296 C CB    . ALA A 1 81  ? 0.20515   -34.50370 -9.46085  1.000 65.92598  ? 81   ALA A CB    1 
ATOM   1297 H H     . ALA A 1 81  ? -1.53356  -32.81721 -9.24319  1.000 74.06376  ? 81   ALA A H     1 
ATOM   1298 H HA    . ALA A 1 81  ? -1.50579  -35.33987 -8.71427  1.000 76.11594  ? 81   ALA A HA    1 
ATOM   1299 H HB1   . ALA A 1 81  ? 0.74183   -35.30447 -9.35286  1.000 78.61263  ? 81   ALA A HB1   1 
ATOM   1300 H HB2   . ALA A 1 81  ? -0.13470  -34.45311 -10.36795 1.000 78.61263  ? 81   ALA A HB2   1 
ATOM   1301 H HB3   . ALA A 1 81  ? 0.73928   -33.71843 -9.26346  1.000 78.61263  ? 81   ALA A HB3   1 
ATOM   1302 N N     . ALA A 1 82  ? -0.33074  -33.61538 -6.32809  1.000 67.01590  ? 82   ALA A N     1 
ATOM   1303 C CA    . ALA A 1 82  ? 0.10747   -33.68112 -4.93810  1.000 66.83086  ? 82   ALA A CA    1 
ATOM   1304 C C     . ALA A 1 82  ? -1.04094  -34.05317 -4.00497  1.000 71.41640  ? 82   ALA A C     1 
ATOM   1305 O O     . ALA A 1 82  ? -0.93049  -35.00452 -3.22378  1.000 69.70712  ? 82   ALA A O     1 
ATOM   1306 C CB    . ALA A 1 82  ? 0.71988   -32.34148 -4.51967  1.000 60.04061  ? 82   ALA A CB    1 
ATOM   1307 H H     . ALA A 1 82  ? -0.47664  -32.81773 -6.61455  1.000 80.51879  ? 82   ALA A H     1 
ATOM   1308 H HA    . ALA A 1 82  ? 0.78977   -34.36624 -4.86084  1.000 80.29674  ? 82   ALA A HA    1 
ATOM   1309 H HB1   . ALA A 1 82  ? 1.00952   -32.40146 -3.59587  1.000 71.55019  ? 82   ALA A HB1   1 
ATOM   1310 H HB2   . ALA A 1 82  ? 1.47863   -32.14849 -5.09235  1.000 71.55019  ? 82   ALA A HB2   1 
ATOM   1311 H HB3   . ALA A 1 82  ? 0.05040   -31.64564 -4.61191  1.000 71.55019  ? 82   ALA A HB3   1 
ATOM   1312 N N     . ASP A 1 83  ? -2.15122  -33.31473 -4.07340  1.000 80.93596  ? 83   ASP A N     1 
ATOM   1313 C CA    . ASP A 1 83  ? -3.29606  -33.48486 -3.17417  1.000 77.02003  ? 83   ASP A CA    1 
ATOM   1314 C C     . ASP A 1 83  ? -4.54531  -33.65178 -4.03601  1.000 72.32333  ? 83   ASP A C     1 
ATOM   1315 O O     . ASP A 1 83  ? -5.19568  -32.66489 -4.39052  1.000 72.26988  ? 83   ASP A O     1 
ATOM   1316 C CB    . ASP A 1 83  ? -3.41382  -32.28759 -2.22847  1.000 77.52134  ? 83   ASP A CB    1 
ATOM   1317 C CG    . ASP A 1 83  ? -4.25449  -32.58408 -1.00297  1.000 71.14391  ? 83   ASP A CG    1 
ATOM   1318 O OD1   . ASP A 1 83  ? -5.16309  -33.43699 -1.08469  1.000 74.91825  ? 83   ASP A OD1   1 
ATOM   1319 O OD2   . ASP A 1 83  ? -4.00137  -31.95505 0.04493   1.000 79.14436  ? 83   ASP A OD2   1 
ATOM   1320 H H     . ASP A 1 83  ? -2.26819  -32.68872 -4.65135  1.000 97.22286  ? 83   ASP A H     1 
ATOM   1321 H HA    . ASP A 1 83  ? -3.18076  -34.29161 -2.64809  1.000 92.52374  ? 83   ASP A HA    1 
ATOM   1322 H HB2   . ASP A 1 83  ? -2.52687  -32.03389 -1.92872  1.000 93.12532  ? 83   ASP A HB2   1 
ATOM   1323 H HB3   . ASP A 1 83  ? -3.82713  -31.54977 -2.70354  1.000 93.12532  ? 83   ASP A HB3   1 
ATOM   1324 N N     . LYS A 1 84  ? -4.88739  -34.90475 -4.36191  1.000 57.89791  ? 84   LYS A N     1 
ATOM   1325 C CA    . LYS A 1 84  ? -5.97171  -35.16734 -5.30750  1.000 68.62312  ? 84   LYS A CA    1 
ATOM   1326 C C     . LYS A 1 84  ? -7.33753  -34.77166 -4.76815  1.000 71.14480  ? 84   LYS A C     1 
ATOM   1327 O O     . LYS A 1 84  ? -8.33398  -34.88901 -5.49785  1.000 74.00743  ? 84   LYS A O     1 
ATOM   1328 C CB    . LYS A 1 84  ? -5.97801  -36.64452 -5.70810  1.000 65.46857  ? 84   LYS A CB    1 
ATOM   1329 C CG    . LYS A 1 84  ? -4.94965  -37.01575 -6.77554  1.000 68.12480  ? 84   LYS A CG    1 
ATOM   1330 C CD    . LYS A 1 84  ? -5.54955  -37.97407 -7.80175  1.000 62.29358  ? 84   LYS A CD    1 
ATOM   1331 C CE    . LYS A 1 84  ? -4.48334  -38.61631 -8.67807  1.000 74.93646  ? 84   LYS A CE    1 
ATOM   1332 N NZ    . LYS A 1 84  ? -5.04508  -39.70948 -9.52730  1.000 86.69905  ? 84   LYS A NZ    1 
ATOM   1333 H HA    . LYS A 1 84  ? -5.81017  -34.64634 -6.10961  1.000 82.44745  ? 84   LYS A HA    1 
ATOM   1334 H HB2   . LYS A 1 84  ? -5.78918  -37.17891 -4.92090  1.000 78.66200  ? 84   LYS A HB2   1 
ATOM   1335 H HB3   . LYS A 1 84  ? -6.85553  -36.86628 -6.05694  1.000 78.66200  ? 84   LYS A HB3   1 
ATOM   1336 H HG2   . LYS A 1 84  ? -4.65899  -36.21378 -7.23735  1.000 81.84947  ? 84   LYS A HG2   1 
ATOM   1337 H HG3   . LYS A 1 84  ? -4.19074  -37.45055 -6.35613  1.000 81.84947  ? 84   LYS A HG3   1 
ATOM   1338 H HD2   . LYS A 1 84  ? -6.02564  -38.68068 -7.33813  1.000 74.25375  ? 84   LYS A HD2   1 
ATOM   1339 H HD3   . LYS A 1 84  ? -6.15902  -37.48517 -8.37658  1.000 74.25375  ? 84   LYS A HD3   1 
ATOM   1340 H HE2   . LYS A 1 84  ? -4.10220  -37.94299 -9.26312  1.000 90.02347  ? 84   LYS A HE2   1 
ATOM   1341 H HE3   . LYS A 1 84  ? -3.79152  -38.99552 -8.11374  1.000 90.02347  ? 84   LYS A HE3   1 
ATOM   1342 H HZ1   . LYS A 1 84  ? -4.39577  -40.09013 -10.00227 1.000 104.13857 ? 84   LYS A HZ1   1 
ATOM   1343 H HZ2   . LYS A 1 84  ? -5.42781  -40.32760 -9.01393  1.000 104.13857 ? 84   LYS A HZ2   1 
ATOM   1344 H HZ3   . LYS A 1 84  ? -5.65503  -39.37895 -10.08480 1.000 104.13857 ? 84   LYS A HZ3   1 
ATOM   1345 N N     . ARG A 1 85  ? -7.41870  -34.32846 -3.51655  1.000 82.31902  ? 85   ARG A N     1 
ATOM   1346 C CA    . ARG A 1 85  ? -8.63518  -33.68352 -3.04472  1.000 88.20346  ? 85   ARG A CA    1 
ATOM   1347 C C     . ARG A 1 85  ? -8.81539  -32.33801 -3.73406  1.000 81.24499  ? 85   ARG A C     1 
ATOM   1348 O O     . ARG A 1 85  ? -9.89920  -32.02029 -4.23759  1.000 88.85845  ? 85   ARG A O     1 
ATOM   1349 C CB    . ARG A 1 85  ? -8.58733  -33.50649 -1.52740  1.000 101.20157 ? 85   ARG A CB    1 
ATOM   1350 C CG    . ARG A 1 85  ? -8.78923  -34.78476 -0.72697  1.000 104.11090 ? 85   ARG A CG    1 
ATOM   1351 C CD    . ARG A 1 85  ? -7.47217  -35.32997 -0.20643  1.000 101.68368 ? 85   ARG A CD    1 
ATOM   1352 N NE    . ARG A 1 85  ? -7.66368  -36.42309 0.73959   1.000 101.60037 ? 85   ARG A NE    1 
ATOM   1353 C CZ    . ARG A 1 85  ? -7.83291  -36.26283 2.04454   1.000 103.85879 ? 85   ARG A CZ    1 
ATOM   1354 N NH1   . ARG A 1 85  ? -7.87808  -35.05968 2.59154   1.000 104.19598 ? 85   ARG A NH1   1 
ATOM   1355 N NH2   . ARG A 1 85  ? -7.95602  -37.33595 2.82044   1.000 106.12999 ? 85   ARG A NH2   1 
ATOM   1356 H H     . ARG A 1 85  ? -6.79239  -34.38856 -2.93028  1.000 98.88254  ? 85   ARG A H     1 
ATOM   1357 H HA    . ARG A 1 85  ? -9.39691  -34.24756 -3.25093  1.000 105.94386 ? 85   ARG A HA    1 
ATOM   1358 H HB2   . ARG A 1 85  ? -7.71931  -33.14634 -1.28714  1.000 121.54160 ? 85   ARG A HB2   1 
ATOM   1359 H HB3   . ARG A 1 85  ? -9.28700  -32.88675 -1.26799  1.000 121.54160 ? 85   ARG A HB3   1 
ATOM   1360 H HG2   . ARG A 1 85  ? -9.36424  -34.60084 0.03226   1.000 125.03279 ? 85   ARG A HG2   1 
ATOM   1361 H HG3   . ARG A 1 85  ? -9.19481  -35.45856 -1.29477  1.000 125.03279 ? 85   ARG A HG3   1 
ATOM   1362 H HD2   . ARG A 1 85  ? -6.94885  -35.66373 -0.95184  1.000 122.12013 ? 85   ARG A HD2   1 
ATOM   1363 H HD3   . ARG A 1 85  ? -6.99015  -34.62001 0.24582   1.000 122.12013 ? 85   ARG A HD3   1 
ATOM   1364 H HE    . ARG A 1 85  ? -7.66707  -37.22549 0.43016   1.000 122.02016 ? 85   ARG A HE    1 
ATOM   1365 H HH11  . ARG A 1 85  ? -7.79688  -34.35981 2.09841   1.000 125.13488 ? 85   ARG A HH11  1 
ATOM   1366 H HH12  . ARG A 1 85  ? -7.98865  -34.97713 3.44040   1.000 125.13488 ? 85   ARG A HH12  1 
ATOM   1367 H HH21  . ARG A 1 85  ? -7.92546  -38.12262 2.47431   1.000 127.45570 ? 85   ARG A HH21  1 
ATOM   1368 H HH22  . ARG A 1 85  ? -8.06619  -37.24319 3.66830   1.000 127.45570 ? 85   ARG A HH22  1 
ATOM   1369 N N     . ARG A 1 86  ? -7.75477  -31.53598 -3.76195  1.000 61.41746  ? 86   ARG A N     1 
ATOM   1370 C CA    . ARG A 1 86  ? -7.75475  -30.29916 -4.52881  1.000 58.51248  ? 86   ARG A CA    1 
ATOM   1371 C C     . ARG A 1 86  ? -8.09490  -30.60298 -5.98005  1.000 60.66776  ? 86   ARG A C     1 
ATOM   1372 O O     . ARG A 1 86  ? -7.49923  -31.48918 -6.59815  1.000 65.40645  ? 86   ARG A O     1 
ATOM   1373 C CB    . ARG A 1 86  ? -6.38453  -29.62894 -4.40039  1.000 78.63010  ? 86   ARG A CB    1 
ATOM   1374 C CG    . ARG A 1 86  ? -6.04525  -28.58024 -5.44962  1.000 84.67932  ? 86   ARG A CG    1 
ATOM   1375 C CD    . ARG A 1 86  ? -4.71904  -27.88994 -5.10906  1.000 87.75546  ? 86   ARG A CD    1 
ATOM   1376 N NE    . ARG A 1 86  ? -4.71642  -27.35145 -3.75301  1.000 91.84872  ? 86   ARG A NE    1 
ATOM   1377 C CZ    . ARG A 1 86  ? -3.68838  -26.73072 -3.19002  1.000 88.47007  ? 86   ARG A CZ    1 
ATOM   1378 N NH1   . ARG A 1 86  ? -2.54101  -26.57272 -3.82981  1.000 85.13769  ? 86   ARG A NH1   1 
ATOM   1379 N NH2   . ARG A 1 86  ? -3.81477  -26.25220 -1.95579  1.000 82.65771  ? 86   ARG A NH2   1 
ATOM   1380 H H     . ARG A 1 86  ? -7.01934  -31.68734 -3.34263  1.000 73.80066  ? 86   ARG A H     1 
ATOM   1381 H HA    . ARG A 1 86  ? -8.41982  -29.67905 -4.19109  1.000 70.31469  ? 86   ARG A HA    1 
ATOM   1382 H HB2   . ARG A 1 86  ? -6.34252  -29.19122 -3.53579  1.000 94.45583  ? 86   ARG A HB2   1 
ATOM   1383 H HB3   . ARG A 1 86  ? -5.70478  -30.31865 -4.45644  1.000 94.45583  ? 86   ARG A HB3   1 
ATOM   1384 H HG2   . ARG A 1 86  ? -5.95887  -29.00468 -6.31754  1.000 101.71489 ? 86   ARG A HG2   1 
ATOM   1385 H HG3   . ARG A 1 86  ? -6.74506  -27.90909 -5.47670  1.000 101.71489 ? 86   ARG A HG3   1 
ATOM   1386 H HD2   . ARG A 1 86  ? -3.99655  -28.53314 -5.18114  1.000 105.40626 ? 86   ARG A HD2   1 
ATOM   1387 H HD3   . ARG A 1 86  ? -4.57305  -27.15641 -5.72673  1.000 105.40626 ? 86   ARG A HD3   1 
ATOM   1388 H HE    . ARG A 1 86  ? -5.43242  -27.44305 -3.28551  1.000 110.31817 ? 86   ARG A HE    1 
ATOM   1389 H HH11  . ARG A 1 86  ? -2.44928  -26.87572 -4.62942  1.000 102.26494 ? 86   ARG A HH11  1 
ATOM   1390 H HH12  . ARG A 1 86  ? -1.88700  -26.16703 -3.44603  1.000 102.26494 ? 86   ARG A HH12  1 
ATOM   1391 H HH21  . ARG A 1 86  ? -4.55699  -26.34685 -1.53181  1.000 99.28896  ? 86   ARG A HH21  1 
ATOM   1392 H HH22  . ARG A 1 86  ? -3.15430  -25.84807 -1.58155  1.000 99.28896  ? 86   ARG A HH22  1 
ATOM   1393 N N     . ARG A 1 87  ? -9.07938  -29.88630 -6.51511  1.000 58.94951  ? 87   ARG A N     1 
ATOM   1394 C CA    . ARG A 1 87  ? -9.54716  -30.12115 -7.87273  1.000 50.16409  ? 87   ARG A CA    1 
ATOM   1395 C C     . ARG A 1 87  ? -9.76882  -28.78919 -8.57250  1.000 41.62869  ? 87   ARG A C     1 
ATOM   1396 O O     . ARG A 1 87  ? -10.06112 -27.77408 -7.93717  1.000 48.62336  ? 87   ARG A O     1 
ATOM   1397 C CB    . ARG A 1 87  ? -10.83398 -30.96100 -7.88229  1.000 51.80049  ? 87   ARG A CB    1 
ATOM   1398 C CG    . ARG A 1 87  ? -10.65179 -32.33847 -8.51001  1.000 69.02854  ? 87   ARG A CG    1 
ATOM   1399 C CD    . ARG A 1 87  ? -11.85208 -33.23053 -8.28652  1.000 63.10222  ? 87   ARG A CD    1 
ATOM   1400 N NE    . ARG A 1 87  ? -12.19893 -33.33938 -6.87676  1.000 71.73827  ? 87   ARG A NE    1 
ATOM   1401 C CZ    . ARG A 1 87  ? -13.11037 -34.17397 -6.40132  1.000 77.83716  ? 87   ARG A CZ    1 
ATOM   1402 N NH1   . ARG A 1 87  ? -13.74462 -35.02435 -7.19139  1.000 73.28253  ? 87   ARG A NH1   1 
ATOM   1403 N NH2   . ARG A 1 87  ? -13.39589 -34.15361 -5.10262  1.000 68.09509  ? 87   ARG A NH2   1 
ATOM   1404 H H     . ARG A 1 87  ? -9.49426  -29.25354 -6.10634  1.000 70.83912  ? 87   ARG A H     1 
ATOM   1405 H HA    . ARG A 1 87  ? -8.87133  -30.60290 -8.37479  1.000 60.29662  ? 87   ARG A HA    1 
ATOM   1406 H HB2   . ARG A 1 87  ? -11.13253 -31.08737 -6.96806  1.000 62.26029  ? 87   ARG A HB2   1 
ATOM   1407 H HB3   . ARG A 1 87  ? -11.51227 -30.48934 -8.39059  1.000 62.26029  ? 87   ARG A HB3   1 
ATOM   1408 H HG2   . ARG A 1 87  ? -10.52361 -32.23855 -9.46630  1.000 82.93396  ? 87   ARG A HG2   1 
ATOM   1409 H HG3   . ARG A 1 87  ? -9.87768  -32.76905 -8.11472  1.000 82.93396  ? 87   ARG A HG3   1 
ATOM   1410 H HD2   . ARG A 1 87  ? -12.61536 -32.86204 -8.75825  1.000 75.82238  ? 87   ARG A HD2   1 
ATOM   1411 H HD3   . ARG A 1 87  ? -11.65445 -34.12008 -8.61898  1.000 75.82238  ? 87   ARG A HD3   1 
ATOM   1412 H HE    . ARG A 1 87  ? -11.78686 -32.83079 -6.31896  1.000 86.18564  ? 87   ARG A HE    1 
ATOM   1413 H HH11  . ARG A 1 87  ? -13.56815 -35.04302 -8.03288  1.000 88.03875  ? 87   ARG A HH11  1 
ATOM   1414 H HH12  . ARG A 1 87  ? -14.33347 -35.55858 -6.86357  1.000 88.03875  ? 87   ARG A HH12  1 
ATOM   1415 H HH21  . ARG A 1 87  ? -12.99017 -33.60255 -4.58174  1.000 81.81382  ? 87   ARG A HH21  1 
ATOM   1416 H HH22  . ARG A 1 87  ? -13.98626 -34.69151 -4.78366  1.000 81.81382  ? 87   ARG A HH22  1 
ATOM   1417 N N     . PHE A 1 88  ? -9.60667  -28.80498 -9.89243  1.000 48.58095  ? 88   PHE A N     1 
ATOM   1418 C CA    . PHE A 1 88  ? -9.78936  -27.63655 -10.74095 1.000 43.91800  ? 88   PHE A CA    1 
ATOM   1419 C C     . PHE A 1 88  ? -10.93131 -27.91666 -11.70559 1.000 44.14695  ? 88   PHE A C     1 
ATOM   1420 O O     . PHE A 1 88  ? -11.13249 -29.05729 -12.13069 1.000 38.38796  ? 88   PHE A O     1 
ATOM   1421 C CB    . PHE A 1 88  ? -8.50276  -27.30800 -11.49740 1.000 40.31389  ? 88   PHE A CB    1 
ATOM   1422 C CG    . PHE A 1 88  ? -7.27400  -27.35895 -10.63476 1.000 49.58269  ? 88   PHE A CG    1 
ATOM   1423 C CD1   . PHE A 1 88  ? -6.89543  -26.26159 -9.87866  1.000 53.35938  ? 88   PHE A CD1   1 
ATOM   1424 C CD2   . PHE A 1 88  ? -6.50649  -28.51206 -10.56629 1.000 49.15106  ? 88   PHE A CD2   1 
ATOM   1425 C CE1   . PHE A 1 88  ? -5.76837  -26.30899 -9.07696  1.000 61.71080  ? 88   PHE A CE1   1 
ATOM   1426 C CE2   . PHE A 1 88  ? -5.37839  -28.56584 -9.76751  1.000 51.30536  ? 88   PHE A CE2   1 
ATOM   1427 C CZ    . PHE A 1 88  ? -5.00950  -27.46301 -9.02111  1.000 63.36480  ? 88   PHE A CZ    1 
ATOM   1428 H H     . PHE A 1 88  ? -9.38253  -29.50822 -10.33381 1.000 58.39685  ? 88   PHE A H     1 
ATOM   1429 H HA    . PHE A 1 88  ? -10.02062 -26.85502 -10.21498 1.000 52.80131  ? 88   PHE A HA    1 
ATOM   1430 H HB2   . PHE A 1 88  ? -8.38898  -27.94998 -12.21560 1.000 48.47638  ? 88   PHE A HB2   1 
ATOM   1431 H HB3   . PHE A 1 88  ? -8.57368  -26.41179 -11.86165 1.000 48.47638  ? 88   PHE A HB3   1 
ATOM   1432 H HD1   . PHE A 1 88  ? -7.40461  -25.48400 -9.91019  1.000 64.13096  ? 88   PHE A HD1   1 
ATOM   1433 H HD2   . PHE A 1 88  ? -6.75326  -29.25827 -11.06346 1.000 59.08098  ? 88   PHE A HD2   1 
ATOM   1434 H HE1   . PHE A 1 88  ? -5.52176  -25.56510 -8.57625  1.000 74.15267  ? 88   PHE A HE1   1 
ATOM   1435 H HE2   . PHE A 1 88  ? -4.86895  -29.34313 -9.73290  1.000 61.66615  ? 88   PHE A HE2   1 
ATOM   1436 H HZ    . PHE A 1 88  ? -4.25226  -27.49712 -8.48230  1.000 76.13746  ? 88   PHE A HZ    1 
ATOM   1437 N N     . VAL A 1 89  ? -11.68300 -26.87080 -12.04477 1.000 41.66410  ? 89   VAL A N     1 
ATOM   1438 C CA    . VAL A 1 89  ? -12.96463 -27.01974 -12.72347 1.000 44.12769  ? 89   VAL A CA    1 
ATOM   1439 C C     . VAL A 1 89  ? -12.97109 -26.17623 -13.98941 1.000 31.83838  ? 89   VAL A C     1 
ATOM   1440 O O     . VAL A 1 89  ? -12.60094 -24.99710 -13.95942 1.000 40.10130  ? 89   VAL A O     1 
ATOM   1441 C CB    . VAL A 1 89  ? -14.13752 -26.61747 -11.80443 1.000 44.45740  ? 89   VAL A CB    1 
ATOM   1442 C CG1   . VAL A 1 89  ? -15.45245 -27.14874 -12.34740 1.000 35.60289  ? 89   VAL A CG1   1 
ATOM   1443 C CG2   . VAL A 1 89  ? -13.90103 -27.11441 -10.38046 1.000 38.14160  ? 89   VAL A CG2   1 
ATOM   1444 H H     . VAL A 1 89  ? -11.46631 -26.05329 -11.88885 1.000 50.09663  ? 89   VAL A H     1 
ATOM   1445 H HA    . VAL A 1 89  ? -13.07105 -27.94653 -12.98926 1.000 53.05293  ? 89   VAL A HA    1 
ATOM   1446 H HB    . VAL A 1 89  ? -14.19340 -25.64941 -11.77933 1.000 53.44858  ? 89   VAL A HB    1 
ATOM   1447 H HG11  . VAL A 1 89  ? -16.18010 -26.80190 -11.80782 1.000 42.82317  ? 89   VAL A HG11  1 
ATOM   1448 H HG12  . VAL A 1 89  ? -15.55489 -26.85795 -13.26710 1.000 42.82317  ? 89   VAL A HG12  1 
ATOM   1449 H HG13  . VAL A 1 89  ? -15.44273 -28.11780 -12.30601 1.000 42.82317  ? 89   VAL A HG13  1 
ATOM   1450 H HG21  . VAL A 1 89  ? -14.72338 -27.02449 -9.87394  1.000 45.86963  ? 89   VAL A HG21  1 
ATOM   1451 H HG22  . VAL A 1 89  ? -13.63191 -28.04581 -10.41163 1.000 45.86963  ? 89   VAL A HG22  1 
ATOM   1452 H HG23  . VAL A 1 89  ? -13.20105 -26.58134 -9.97211  1.000 45.86963  ? 89   VAL A HG23  1 
ATOM   1453 N N     . TRP A 1 90  ? -13.39467 -26.78754 -15.09683 1.000 38.71037  ? 90   TRP A N     1 
ATOM   1454 C CA    . TRP A 1 90  ? -13.63491 -26.09616 -16.35302 1.000 39.11135  ? 90   TRP A CA    1 
ATOM   1455 C C     . TRP A 1 90  ? -15.05571 -26.38512 -16.82450 1.000 35.24021  ? 90   TRP A C     1 
ATOM   1456 O O     . TRP A 1 90  ? -15.66103 -27.39580 -16.45837 1.000 38.89432  ? 90   TRP A O     1 
ATOM   1457 C CB    . TRP A 1 90  ? -12.66668 -26.53826 -17.45918 1.000 40.50019  ? 90   TRP A CB    1 
ATOM   1458 C CG    . TRP A 1 90  ? -11.24180 -26.15649 -17.26095 1.000 50.50578  ? 90   TRP A CG    1 
ATOM   1459 C CD1   . TRP A 1 90  ? -10.58341 -25.11444 -17.84666 1.000 48.09023  ? 90   TRP A CD1   1 
ATOM   1460 C CD2   . TRP A 1 90  ? -10.28377 -26.82487 -16.43650 1.000 50.34211  ? 90   TRP A CD2   1 
ATOM   1461 N NE1   . TRP A 1 90  ? -9.27447  -25.08973 -17.43253 1.000 54.94583  ? 90   TRP A NE1   1 
ATOM   1462 C CE2   . TRP A 1 90  ? -9.06556  -26.12952 -16.56499 1.000 54.84406  ? 90   TRP A CE2   1 
ATOM   1463 C CE3   . TRP A 1 90  ? -10.33810 -27.94258 -15.59948 1.000 47.51442  ? 90   TRP A CE3   1 
ATOM   1464 C CZ2   . TRP A 1 90  ? -7.91426  -26.51336 -15.88590 1.000 54.45461  ? 90   TRP A CZ2   1 
ATOM   1465 C CZ3   . TRP A 1 90  ? -9.19512  -28.32149 -14.92684 1.000 52.86523  ? 90   TRP A CZ3   1 
ATOM   1466 C CH2   . TRP A 1 90  ? -7.99880  -27.61000 -15.07390 1.000 58.14848  ? 90   TRP A CH2   1 
ATOM   1467 H H     . TRP A 1 90  ? -13.55398 -27.63146 -15.14183 1.000 46.55216  ? 90   TRP A H     1 
ATOM   1468 H HA    . TRP A 1 90  ? -13.52361 -25.14450 -16.20185 1.000 47.03333  ? 90   TRP A HA    1 
ATOM   1469 H HB2   . TRP A 1 90  ? -12.69898 -27.50561 -17.52315 1.000 48.69994  ? 90   TRP A HB2   1 
ATOM   1470 H HB3   . TRP A 1 90  ? -12.95734 -26.14063 -18.29483 1.000 48.69994  ? 90   TRP A HB3   1 
ATOM   1471 H HD1   . TRP A 1 90  ? -10.96575 -24.50899 -18.44008 1.000 57.80799  ? 90   TRP A HD1   1 
ATOM   1472 H HE1   . TRP A 1 90  ? -8.68277  -24.51572 -17.67750 1.000 66.03470  ? 90   TRP A HE1   1 
ATOM   1473 H HE3   . TRP A 1 90  ? -11.12896 -28.42127 -15.49803 1.000 57.11701  ? 90   TRP A HE3   1 
ATOM   1474 H HZ2   . TRP A 1 90  ? -7.11790  -26.04244 -15.98044 1.000 65.44524  ? 90   TRP A HZ2   1 
ATOM   1475 H HZ3   . TRP A 1 90  ? -9.21978  -29.06273 -14.36574 1.000 63.53799  ? 90   TRP A HZ3   1 
ATOM   1476 H HH2   . TRP A 1 90  ? -7.24383  -27.88976 -14.60843 1.000 69.87788  ? 90   TRP A HH2   1 
ATOM   1477 N N     . LEU A 1 91  ? -15.57997 -25.49684 -17.66300 1.000 41.61910  ? 91   LEU A N     1 
ATOM   1478 C CA    . LEU A 1 91  ? -16.80283 -25.79659 -18.39107 1.000 35.78570  ? 91   LEU A CA    1 
ATOM   1479 C C     . LEU A 1 91  ? -16.47479 -26.68049 -19.58825 1.000 36.69618  ? 91   LEU A C     1 
ATOM   1480 O O     . LEU A 1 91  ? -15.42382 -26.53135 -20.21973 1.000 41.64559  ? 91   LEU A O     1 
ATOM   1481 C CB    . LEU A 1 91  ? -17.48820 -24.51845 -18.86761 1.000 38.95154  ? 91   LEU A CB    1 
ATOM   1482 C CG    . LEU A 1 91  ? -18.22764 -23.65324 -17.84771 1.000 32.45139  ? 91   LEU A CG    1 
ATOM   1483 C CD1   . LEU A 1 91  ? -18.95004 -22.52773 -18.57580 1.000 35.30355  ? 91   LEU A CD1   1 
ATOM   1484 C CD2   . LEU A 1 91  ? -19.20947 -24.45664 -17.02102 1.000 34.39307  ? 91   LEU A CD2   1 
ATOM   1485 H H     . LEU A 1 91  ? -15.24784 -24.72030 -17.82510 1.000 50.04263  ? 91   LEU A H     1 
ATOM   1486 H HA    . LEU A 1 91  ? -17.42297 -26.25987 -17.80651 1.000 43.04256  ? 91   LEU A HA    1 
ATOM   1487 H HB2   . LEU A 1 91  ? -16.80689 -23.95350 -19.26452 1.000 46.84155  ? 91   LEU A HB2   1 
ATOM   1488 H HB3   . LEU A 1 91  ? -18.14162 -24.77134 -19.53842 1.000 46.84155  ? 91   LEU A HB3   1 
ATOM   1489 H HG    . LEU A 1 91  ? -17.57995 -23.28209 -17.22832 1.000 39.04138  ? 91   LEU A HG    1 
ATOM   1490 H HD11  . LEU A 1 91  ? -19.41293 -21.97680 -17.92534 1.000 42.46397  ? 91   LEU A HD11  1 
ATOM   1491 H HD12  . LEU A 1 91  ? -18.29882 -21.99415 -19.05758 1.000 42.46397  ? 91   LEU A HD12  1 
ATOM   1492 H HD13  . LEU A 1 91  ? -19.58782 -22.91199 -19.19748 1.000 42.46397  ? 91   LEU A HD13  1 
ATOM   1493 H HD21  . LEU A 1 91  ? -19.76395 -23.84732 -16.50897 1.000 41.37139  ? 91   LEU A HD21  1 
ATOM   1494 H HD22  . LEU A 1 91  ? -19.76275 -24.98725 -17.61535 1.000 41.37139  ? 91   LEU A HD22  1 
ATOM   1495 H HD23  . LEU A 1 91  ? -18.71601 -25.03799 -16.42149 1.000 41.37139  ? 91   LEU A HD23  1 
ATOM   1496 N N     . THR A 1 92  ? -17.37047 -27.61411 -19.88758 1.000 36.30917  ? 92   THR A N     1 
ATOM   1497 C CA    . THR A 1 92  ? -17.27252 -28.36643 -21.12520 1.000 31.53373  ? 92   THR A CA    1 
ATOM   1498 C C     . THR A 1 92  ? -17.88557 -27.55816 -22.26592 1.000 34.67192  ? 92   THR A C     1 
ATOM   1499 O O     . THR A 1 92  ? -18.54883 -26.53889 -22.05611 1.000 37.96817  ? 92   THR A O     1 
ATOM   1500 C CB    . THR A 1 92  ? -17.97635 -29.71489 -20.99779 1.000 39.51590  ? 92   THR A CB    1 
ATOM   1501 O OG1   . THR A 1 92  ? -19.37597 -29.50832 -20.76685 1.000 41.77561  ? 92   THR A OG1   1 
ATOM   1502 C CG2   . THR A 1 92  ? -17.38682 -30.51651 -19.84624 1.000 43.61009  ? 92   THR A CG2   1 
ATOM   1503 H H     . THR A 1 92  ? -18.03973 -27.82763 -19.39150 1.000 43.67071  ? 92   THR A H     1 
ATOM   1504 H HA    . THR A 1 92  ? -16.33889 -28.53832 -21.32446 1.000 37.94019  ? 92   THR A HA    1 
ATOM   1505 H HB    . THR A 1 92  ? -17.85667 -30.22115 -21.81649 1.000 47.51880  ? 92   THR A HB    1 
ATOM   1506 H HG1   . THR A 1 92  ? -19.76922 -30.24801 -20.70519 1.000 50.23045  ? 92   THR A HG1   1 
ATOM   1507 H HG21  . THR A 1 92  ? -17.79133 -31.39755 -19.81400 1.000 52.43182  ? 92   THR A HG21  1 
ATOM   1508 H HG22  . THR A 1 92  ? -16.42918 -30.61399 -19.96589 1.000 52.43182  ? 92   THR A HG22  1 
ATOM   1509 H HG23  . THR A 1 92  ? -17.55442 -30.06222 -19.00574 1.000 52.43182  ? 92   THR A HG23  1 
ATOM   1510 N N     . ALA A 1 93  ? -17.65615 -28.02241 -23.49384 1.000 38.75445  ? 93   ALA A N     1 
ATOM   1511 C CA    . ALA A 1 93  ? -18.26988 -27.37109 -24.64528 1.000 42.51112  ? 93   ALA A CA    1 
ATOM   1512 C C     . ALA A 1 93  ? -19.77839 -27.27034 -24.46043 1.000 31.55235  ? 93   ALA A C     1 
ATOM   1513 O O     . ALA A 1 93  ? -20.37380 -26.20612 -24.65675 1.000 36.35081  ? 93   ALA A O     1 
ATOM   1514 C CB    . ALA A 1 93  ? -17.93124 -28.13444 -25.92563 1.000 39.71955  ? 93   ALA A CB    1 
ATOM   1515 H H     . ALA A 1 93  ? -17.15940 -28.69872 -23.68211 1.000 46.60505  ? 93   ALA A H     1 
ATOM   1516 H HA    . ALA A 1 93  ? -17.90955 -26.47479 -24.73307 1.000 51.11305  ? 93   ALA A HA    1 
ATOM   1517 H HB1   . ALA A 1 93  ? -18.34187 -27.68368 -26.68001 1.000 47.76317  ? 93   ALA A HB1   1 
ATOM   1518 H HB2   . ALA A 1 93  ? -16.96777 -28.15377 -26.03630 1.000 47.76317  ? 93   ALA A HB2   1 
ATOM   1519 H HB3   . ALA A 1 93  ? -18.27420 -29.03896 -25.85410 1.000 47.76317  ? 93   ALA A HB3   1 
ATOM   1520 N N     . GLU A 1 94  ? -20.41352 -28.37653 -24.07078 1.000 32.45299  ? 94   GLU A N     1 
ATOM   1521 C CA    . GLU A 1 94  ? -21.84245 -28.34089 -23.78010 1.000 36.66063  ? 94   GLU A CA    1 
ATOM   1522 C C     . GLU A 1 94  ? -22.13609 -27.34787 -22.66266 1.000 43.53731  ? 94   GLU A C     1 
ATOM   1523 O O     . GLU A 1 94  ? -23.03743 -26.51060 -22.78339 1.000 43.89840  ? 94   GLU A O     1 
ATOM   1524 C CB    . GLU A 1 94  ? -22.33556 -29.74537 -23.42228 1.000 37.63934  ? 94   GLU A CB    1 
ATOM   1525 C CG    . GLU A 1 94  ? -23.75964 -29.82258 -22.86093 1.000 53.01832  ? 94   GLU A CG    1 
ATOM   1526 C CD    . GLU A 1 94  ? -24.85429 -29.59983 -23.90061 1.000 59.56938  ? 94   GLU A CD    1 
ATOM   1527 O OE1   . GLU A 1 94  ? -24.55121 -29.13644 -25.01765 1.000 53.38396  ? 94   GLU A OE1   1 
ATOM   1528 O OE2   . GLU A 1 94  ? -26.03048 -29.89031 -23.59283 1.000 68.51133  ? 94   GLU A OE2   1 
ATOM   1529 H H     . GLU A 1 94  ? -20.04497 -29.14687 -23.96907 1.000 39.04329  ? 94   GLU A H     1 
ATOM   1530 H HA    . GLU A 1 94  ? -22.32698 -28.05354 -24.56977 1.000 44.09247  ? 94   GLU A HA    1 
ATOM   1531 H HB2   . GLU A 1 94  ? -22.31164 -30.29042 -24.22430 1.000 45.26691  ? 94   GLU A HB2   1 
ATOM   1532 H HB3   . GLU A 1 94  ? -21.74060 -30.11570 -22.75162 1.000 45.26691  ? 94   GLU A HB3   1 
ATOM   1533 H HG2   . GLU A 1 94  ? -23.89453 -30.70272 -22.47614 1.000 63.72169  ? 94   GLU A HG2   1 
ATOM   1534 H HG3   . GLU A 1 94  ? -23.86119 -29.14234 -22.17693 1.000 63.72169  ? 94   GLU A HG3   1 
ATOM   1535 N N     . GLY A 1 95  ? -21.37359 -27.41691 -21.56978 1.000 37.29780  ? 95   GLY A N     1 
ATOM   1536 C CA    . GLY A 1 95  ? -21.58159 -26.47775 -20.47819 1.000 33.41236  ? 95   GLY A CA    1 
ATOM   1537 C C     . GLY A 1 95  ? -21.58585 -25.03678 -20.94432 1.000 31.72283  ? 95   GLY A C     1 
ATOM   1538 O O     . GLY A 1 95  ? -22.44915 -24.24385 -20.56239 1.000 31.91720  ? 95   GLY A O     1 
ATOM   1539 H H     . GLY A 1 95  ? -20.74298 -27.98730 -21.44101 1.000 44.85707  ? 95   GLY A H     1 
ATOM   1540 H HA2   . GLY A 1 95  ? -22.43380 -26.66351 -20.05378 1.000 40.19454  ? 95   GLY A HA2   1 
ATOM   1541 H HA3   . GLY A 1 95  ? -20.87317 -26.58466 -19.82426 1.000 40.19454  ? 95   GLY A HA3   1 
ATOM   1542 N N     . GLU A 1 96  ? -20.61673 -24.67534 -21.78757 1.000 32.16791  ? 96   GLU A N     1 
ATOM   1543 C CA    . GLU A 1 96  ? -20.58144 -23.31536 -22.31354 1.000 36.58159  ? 96   GLU A CA    1 
ATOM   1544 C C     . GLU A 1 96  ? -21.84062 -23.01198 -23.11305 1.000 33.83501  ? 96   GLU A C     1 
ATOM   1545 O O     . GLU A 1 96  ? -22.39461 -21.90999 -23.01995 1.000 37.21178  ? 96   GLU A O     1 
ATOM   1546 C CB    . GLU A 1 96  ? -19.32929 -23.11163 -23.16690 1.000 37.38114  ? 96   GLU A CB    1 
ATOM   1547 C CG    . GLU A 1 96  ? -18.03912 -23.38591 -22.40677 1.000 42.12228  ? 96   GLU A CG    1 
ATOM   1548 C CD    . GLU A 1 96  ? -16.84726 -22.61766 -22.94303 1.000 50.10023  ? 96   GLU A CD    1 
ATOM   1549 O OE1   . GLU A 1 96  ? -16.79203 -22.36410 -24.16446 1.000 63.77884  ? 96   GLU A OE1   1 
ATOM   1550 O OE2   . GLU A 1 96  ? -15.96249 -22.26565 -22.13328 1.000 54.70804  ? 96   GLU A OE2   1 
ATOM   1551 H H     . GLU A 1 96  ? -19.98343 -25.18765 -22.06336 1.000 38.70121  ? 96   GLU A H     1 
ATOM   1552 H HA    . GLU A 1 96  ? -20.53584 -22.68946 -21.57389 1.000 43.99762  ? 96   GLU A HA    1 
ATOM   1553 H HB2   . GLU A 1 96  ? -19.36384 -23.71538 -23.92532 1.000 44.95708  ? 96   GLU A HB2   1 
ATOM   1554 H HB3   . GLU A 1 96  ? -19.30508 -22.19235 -23.47549 1.000 44.95708  ? 96   GLU A HB3   1 
ATOM   1555 H HG2   . GLU A 1 96  ? -18.16240 -23.13260 -21.47858 1.000 50.64645  ? 96   GLU A HG2   1 
ATOM   1556 H HG3   . GLU A 1 96  ? -17.83443 -24.33209 -22.46806 1.000 50.64645  ? 96   GLU A HG3   1 
ATOM   1557 N N     . LYS A 1 97  ? -22.32115 -23.98384 -23.89000 1.000 31.30380  ? 97   LYS A N     1 
ATOM   1558 C CA    . LYS A 1 97  ? -23.55329 -23.77978 -24.64370 1.000 30.41466  ? 97   LYS A CA    1 
ATOM   1559 C C     . LYS A 1 97  ? -24.74145 -23.60000 -23.70646 1.000 27.07788  ? 97   LYS A C     1 
ATOM   1560 O O     . LYS A 1 97  ? -25.56826 -22.70186 -23.89640 1.000 27.10694  ? 97   LYS A O     1 
ATOM   1561 C CB    . LYS A 1 97  ? -23.79040 -24.95022 -25.59561 1.000 35.50478  ? 97   LYS A CB    1 
ATOM   1562 C CG    . LYS A 1 97  ? -22.68880 -25.14221 -26.62167 1.000 38.95878  ? 97   LYS A CG    1 
ATOM   1563 C CD    . LYS A 1 97  ? -23.15589 -26.02653 -27.76551 1.000 45.28132  ? 97   LYS A CD    1 
ATOM   1564 C CE    . LYS A 1 97  ? -21.98401 -26.52731 -28.59087 1.000 46.43704  ? 97   LYS A CE    1 
ATOM   1565 N NZ    . LYS A 1 97  ? -22.43333 -27.28018 -29.79578 1.000 55.35301  ? 97   LYS A NZ    1 
ATOM   1566 H H     . LYS A 1 97  ? -21.95824 -24.75638 -23.99528 1.000 37.66427  ? 97   LYS A H     1 
ATOM   1567 H HA    . LYS A 1 97  ? -23.46242 -22.97504 -25.17760 1.000 36.59730  ? 97   LYS A HA    1 
ATOM   1568 H HB2   . LYS A 1 97  ? -23.85490 -25.76629 -25.07526 1.000 42.70545  ? 97   LYS A HB2   1 
ATOM   1569 H HB3   . LYS A 1 97  ? -24.61870 -24.79714 -26.07664 1.000 42.70545  ? 97   LYS A HB3   1 
ATOM   1570 H HG2   . LYS A 1 97  ? -22.43241 -24.28030 -26.98536 1.000 46.85024  ? 97   LYS A HG2   1 
ATOM   1571 H HG3   . LYS A 1 97  ? -21.92448 -25.56486 -26.19966 1.000 46.85024  ? 97   LYS A HG3   1 
ATOM   1572 H HD2   . LYS A 1 97  ? -23.62730 -26.79464 -27.40678 1.000 54.43729  ? 97   LYS A HD2   1 
ATOM   1573 H HD3   . LYS A 1 97  ? -23.74346 -25.51816 -28.34621 1.000 54.43729  ? 97   LYS A HD3   1 
ATOM   1574 H HE2   . LYS A 1 97  ? -21.45464 -25.77012 -28.88639 1.000 55.82416  ? 97   LYS A HE2   1 
ATOM   1575 H HE3   . LYS A 1 97  ? -21.44102 -27.12005 -28.04798 1.000 55.82416  ? 97   LYS A HE3   1 
ATOM   1576 H HZ1   . LYS A 1 97  ? -22.53961 -26.72240 -30.48112 1.000 66.52332  ? 97   LYS A HZ1   1 
ATOM   1577 H HZ2   . LYS A 1 97  ? -21.82742 -27.89430 -30.01446 1.000 66.52332  ? 97   LYS A HZ2   1 
ATOM   1578 H HZ3   . LYS A 1 97  ? -23.20833 -27.68521 -29.63015 1.000 66.52332  ? 97   LYS A HZ3   1 
ATOM   1579 N N     . VAL A 1 98  ? -24.84385 -24.45413 -22.68304 1.000 30.78608  ? 98   VAL A N     1 
ATOM   1580 C CA    . VAL A 1 98  ? -25.94019 -24.34088 -21.72429 1.000 23.90469  ? 98   VAL A CA    1 
ATOM   1581 C C     . VAL A 1 98  ? -25.88418 -23.00110 -21.00451 1.000 28.74306  ? 98   VAL A C     1 
ATOM   1582 O O     . VAL A 1 98  ? -26.91447 -22.34942 -20.79358 1.000 28.16493  ? 98   VAL A O     1 
ATOM   1583 C CB    . VAL A 1 98  ? -25.89860 -25.51008 -20.72331 1.000 26.72600  ? 98   VAL A CB    1 
ATOM   1584 C CG1   . VAL A 1 98  ? -26.85156 -25.24945 -19.57468 1.000 28.00384  ? 98   VAL A CG1   1 
ATOM   1585 C CG2   . VAL A 1 98  ? -26.23663 -26.81308 -21.41528 1.000 34.98428  ? 98   VAL A CG2   1 
ATOM   1586 H H     . VAL A 1 98  ? -24.29749 -25.09922 -22.52510 1.000 37.04300  ? 98   VAL A H     1 
ATOM   1587 H HA    . VAL A 1 98  ? -26.77668 -24.38732 -22.21319 1.000 28.78534  ? 98   VAL A HA    1 
ATOM   1588 H HB    . VAL A 1 98  ? -25.00146 -25.58728 -20.36265 1.000 32.17091  ? 98   VAL A HB    1 
ATOM   1589 H HG11  . VAL A 1 98  ? -27.04342 -26.08829 -19.12697 1.000 33.70432  ? 98   VAL A HG11  1 
ATOM   1590 H HG12  . VAL A 1 98  ? -26.43614 -24.63064 -18.95388 1.000 33.70432  ? 98   VAL A HG12  1 
ATOM   1591 H HG13  . VAL A 1 98  ? -27.67104 -24.86646 -19.92491 1.000 33.70432  ? 98   VAL A HG13  1 
ATOM   1592 H HG21  . VAL A 1 98  ? -26.21092 -27.53209 -20.76469 1.000 42.08085  ? 98   VAL A HG21  1 
ATOM   1593 H HG22  . VAL A 1 98  ? -27.12500 -26.74572 -21.79890 1.000 42.08085  ? 98   VAL A HG22  1 
ATOM   1594 H HG23  . VAL A 1 98  ? -25.58557 -26.97702 -22.11538 1.000 42.08085  ? 98   VAL A HG23  1 
ATOM   1595 N N     . LEU A 1 99  ? -24.68244 -22.57785 -20.59919 1.000 28.71700  ? 99   LEU A N     1 
ATOM   1596 C CA    . LEU A 1 99  ? -24.54268 -21.30842 -19.89323 1.000 26.78583  ? 99   LEU A CA    1 
ATOM   1597 C C     . LEU A 1 99  ? -24.89952 -20.13434 -20.79440 1.000 29.75443  ? 99   LEU A C     1 
ATOM   1598 O O     . LEU A 1 99  ? -25.58502 -19.19975 -20.36353 1.000 32.72482  ? 99   LEU A O     1 
ATOM   1599 C CB    . LEU A 1 99  ? -23.11807 -21.15494 -19.36649 1.000 28.65366  ? 99   LEU A CB    1 
ATOM   1600 C CG    . LEU A 1 99  ? -22.85911 -19.91698 -18.50627 1.000 29.62778  ? 99   LEU A CG    1 
ATOM   1601 C CD1   . LEU A 1 99  ? -23.83829 -19.88862 -17.33984 1.000 34.03426  ? 99   LEU A CD1   1 
ATOM   1602 C CD2   . LEU A 1 99  ? -21.42023 -19.87908 -18.00573 1.000 26.18234  ? 99   LEU A CD2   1 
ATOM   1603 H H     . LEU A 1 99  ? -23.94454 -23.00270 -20.72003 1.000 34.56011  ? 99   LEU A H     1 
ATOM   1604 H HA    . LEU A 1 99  ? -25.14853 -21.30662 -19.13571 1.000 32.24271  ? 99   LEU A HA    1 
ATOM   1605 H HB2   . LEU A 1 99  ? -22.90945 -21.93179 -18.82438 1.000 34.48410  ? 99   LEU A HB2   1 
ATOM   1606 H HB3   . LEU A 1 99  ? -22.51670 -21.10936 -20.12621 1.000 34.48410  ? 99   LEU A HB3   1 
ATOM   1607 H HG    . LEU A 1 99  ? -22.99287 -19.12239 -19.04630 1.000 35.65305  ? 99   LEU A HG    1 
ATOM   1608 H HD11  . LEU A 1 99  ? -23.36955 -19.60063 -16.54095 1.000 40.94082  ? 99   LEU A HD11  1 
ATOM   1609 H HD12  . LEU A 1 99  ? -24.55529 -19.26818 -17.54443 1.000 40.94082  ? 99   LEU A HD12  1 
ATOM   1610 H HD13  . LEU A 1 99  ? -24.19907 -20.77943 -17.20865 1.000 40.94082  ? 99   LEU A HD13  1 
ATOM   1611 H HD21  . LEU A 1 99  ? -21.27495 -19.04936 -17.52472 1.000 31.51851  ? 99   LEU A HD21  1 
ATOM   1612 H HD22  . LEU A 1 99  ? -21.27126 -20.63414 -17.41532 1.000 31.51851  ? 99   LEU A HD22  1 
ATOM   1613 H HD23  . LEU A 1 99  ? -20.81995 -19.93016 -18.76597 1.000 31.51851  ? 99   LEU A HD23  1 
ATOM   1614 N N     . ALA A 1 100 ? -24.43742 -20.16078 -22.04519 1.000 26.38532  ? 100  ALA A N     1 
ATOM   1615 C CA    . ALA A 1 100 ? -24.76968 -19.08696 -22.97296 1.000 27.10998  ? 100  ALA A CA    1 
ATOM   1616 C C     . ALA A 1 100 ? -26.27750 -18.91869 -23.10147 1.000 27.76674  ? 100  ALA A C     1 
ATOM   1617 O O     . ALA A 1 100 ? -26.78443 -17.79110 -23.12286 1.000 36.36463  ? 100  ALA A O     1 
ATOM   1618 C CB    . ALA A 1 100 ? -24.14385 -19.36491 -24.33867 1.000 31.57809  ? 100  ALA A CB    1 
ATOM   1619 H H     . ALA A 1 100 ? -23.93844 -20.77916 -22.37415 1.000 31.76209  ? 100  ALA A H     1 
ATOM   1620 H HA    . ALA A 1 100 ? -24.40126 -18.25543 -22.63573 1.000 32.63168  ? 100  ALA A HA    1 
ATOM   1621 H HB1   . ALA A 1 100 ? -24.37894 -18.64601 -24.94597 1.000 37.99341  ? 100  ALA A HB1   1 
ATOM   1622 H HB2   . ALA A 1 100 ? -23.18004 -19.41310 -24.24048 1.000 37.99341  ? 100  ALA A HB2   1 
ATOM   1623 H HB3   . ALA A 1 100 ? -24.48450 -20.20797 -24.67646 1.000 37.99341  ? 100  ALA A HB3   1 
ATOM   1624 N N     . ALA A 1 101 ? -27.01237 -20.03076 -23.17751 1.000 31.90609  ? 101  ALA A N     1 
ATOM   1625 C CA    . ALA A 1 101 ? -28.46024 -19.95346 -23.33051 1.000 29.51111  ? 101  ALA A CA    1 
ATOM   1626 C C     . ALA A 1 101 ? -29.14379 -19.46997 -22.05799 1.000 28.15529  ? 101  ALA A C     1 
ATOM   1627 O O     . ALA A 1 101 ? -30.16656 -18.77840 -22.13129 1.000 28.89304  ? 101  ALA A O     1 
ATOM   1628 C CB    . ALA A 1 101 ? -29.01594 -21.31909 -23.73256 1.000 30.12458  ? 101  ALA A CB    1 
ATOM   1629 H H     . ALA A 1 101 ? -26.69896 -20.83089 -23.14329 1.000 38.38701  ? 101  ALA A H     1 
ATOM   1630 H HA    . ALA A 1 101 ? -28.66009 -19.31940 -24.03685 1.000 35.51304  ? 101  ALA A HA    1 
ATOM   1631 H HB1   . ALA A 1 101 ? -29.97733 -21.24935 -23.84103 1.000 36.24921  ? 101  ALA A HB1   1 
ATOM   1632 H HB2   . ALA A 1 101 ? -28.60766 -21.59239 -24.56893 1.000 36.24921  ? 101  ALA A HB2   1 
ATOM   1633 H HB3   . ALA A 1 101 ? -28.80734 -21.96216 -23.03697 1.000 36.24921  ? 101  ALA A HB3   1 
ATOM   1634 N N     . ALA A 1 102 ? -28.59510 -19.80824 -20.89042 1.000 25.37004  ? 102  ALA A N     1 
ATOM   1635 C CA    . ALA A 1 102 ? -29.27328 -19.50898 -19.63318 1.000 26.93264  ? 102  ALA A CA    1 
ATOM   1636 C C     . ALA A 1 102 ? -29.13425 -18.04704 -19.21490 1.000 27.63941  ? 102  ALA A C     1 
ATOM   1637 O O     . ALA A 1 102 ? -30.05056 -17.50458 -18.58523 1.000 32.17833  ? 102  ALA A O     1 
ATOM   1638 C CB    . ALA A 1 102 ? -28.73019 -20.41730 -18.52662 1.000 26.77583  ? 102  ALA A CB    1 
ATOM   1639 H H     . ALA A 1 102 ? -27.83874 -20.20764 -20.80107 1.000 30.54376  ? 102  ALA A H     1 
ATOM   1640 H HA    . ALA A 1 102 ? -30.21969 -19.68774 -19.74829 1.000 32.41888  ? 102  ALA A HA    1 
ATOM   1641 H HB1   . ALA A 1 102 ? -29.19025 -20.21424 -17.69716 1.000 32.23070  ? 102  ALA A HB1   1 
ATOM   1642 H HB2   . ALA A 1 102 ? -28.88536 -21.34257 -18.77299 1.000 32.23070  ? 102  ALA A HB2   1 
ATOM   1643 H HB3   . ALA A 1 102 ? -27.77891 -20.25712 -18.42503 1.000 32.23070  ? 102  ALA A HB3   1 
ATOM   1644 N N     . ILE A 1 103 ? -27.99389 -17.40907 -19.55460 1.000 26.47337  ? 103  ILE A N     1 
ATOM   1645 C CA    . ILE A 1 103 ? -27.73803 -16.04462 -19.07641 1.000 29.48247  ? 103  ILE A CA    1 
ATOM   1646 C C     . ILE A 1 103 ? -28.87893 -15.10823 -19.40683 1.000 28.96593  ? 103  ILE A C     1 
ATOM   1647 O O     . ILE A 1 103 ? -29.37130 -14.43332 -18.49618 1.000 32.80303  ? 103  ILE A O     1 
ATOM   1648 C CB    . ILE A 1 103 ? -26.39252 -15.55173 -19.63217 1.000 30.57380  ? 103  ILE A CB    1 
ATOM   1649 C CG1   . ILE A 1 103 ? -25.22345 -16.22599 -18.93695 1.000 30.13528  ? 103  ILE A CG1   1 
ATOM   1650 C CG2   . ILE A 1 103 ? -26.30947 -14.02725 -19.48596 1.000 29.47646  ? 103  ILE A CG2   1 
ATOM   1651 C CD1   . ILE A 1 103 ? -23.87449 -15.98241 -19.59339 1.000 25.66683  ? 103  ILE A CD1   1 
ATOM   1652 H H     . ILE A 1 103 ? -27.37194 -17.73980 -20.04796 1.000 31.86775  ? 103  ILE A H     1 
ATOM   1653 H HA    . ILE A 1 103 ? -27.66241 -16.07564 -18.10986 1.000 35.47867  ? 103  ILE A HA    1 
ATOM   1654 H HB    . ILE A 1 103 ? -26.34214 -15.78917 -20.57131 1.000 36.78827  ? 103  ILE A HB    1 
ATOM   1655 H HG12  . ILE A 1 103 ? -25.17099 -15.89303 -18.02740 1.000 36.26205  ? 103  ILE A HG12  1 
ATOM   1656 H HG13  . ILE A 1 103 ? -25.37781 -17.18362 -18.93129 1.000 36.26205  ? 103  ILE A HG13  1 
ATOM   1657 H HG21  . ILE A 1 103 ? -25.38306 -13.75203 -19.56904 1.000 35.47146  ? 103  ILE A HG21  1 
ATOM   1658 H HG22  . ILE A 1 103 ? -26.84128 -13.61363 -20.18381 1.000 35.47146  ? 103  ILE A HG22  1 
ATOM   1659 H HG23  . ILE A 1 103 ? -26.65279 -13.77439 -18.61469 1.000 35.47146  ? 103  ILE A HG23  1 
ATOM   1660 H HD11  . ILE A 1 103 ? -23.23172 -16.61655 -19.23898 1.000 30.89990  ? 103  ILE A HD11  1 
ATOM   1661 H HD12  . ILE A 1 103 ? -23.96345 -16.10228 -20.55184 1.000 30.89990  ? 103  ILE A HD12  1 
ATOM   1662 H HD13  . ILE A 1 103 ? -23.58744 -15.07658 -19.39855 1.000 30.89990  ? 103  ILE A HD13  1 
ATOM   1663 N N     . PRO A 1 104 ? -29.29885 -14.96065 -20.66010 1.000 27.33272  ? 104  PRO A N     1 
ATOM   1664 C CA    . PRO A 1 104 ? -30.40925 -14.05190 -20.94783 1.000 26.53036  ? 104  PRO A CA    1 
ATOM   1665 C C     . PRO A 1 104 ? -31.70280 -14.49511 -20.30200 1.000 27.75697  ? 104  PRO A C     1 
ATOM   1666 O O     . PRO A 1 104 ? -32.54871 -13.65023 -19.98988 1.000 26.44470  ? 104  PRO A O     1 
ATOM   1667 C CB    . PRO A 1 104 ? -30.48722 -14.07068 -22.48089 1.000 25.04801  ? 104  PRO A CB    1 
ATOM   1668 C CG    . PRO A 1 104 ? -29.85047 -15.34773 -22.88940 1.000 27.42036  ? 104  PRO A CG    1 
ATOM   1669 C CD    . PRO A 1 104 ? -28.78091 -15.62760 -21.87066 1.000 23.25493  ? 104  PRO A CD    1 
ATOM   1670 H HA    . PRO A 1 104 ? -30.19874 -13.14964 -20.66058 1.000 31.93614  ? 104  PRO A HA    1 
ATOM   1671 H HB2   . PRO A 1 104 ? -31.41464 -14.04042 -22.76353 1.000 30.15733  ? 104  PRO A HB2   1 
ATOM   1672 H HB3   . PRO A 1 104 ? -30.00475 -13.31164 -22.84417 1.000 30.15733  ? 104  PRO A HB3   1 
ATOM   1673 H HG2   . PRO A 1 104 ? -30.51345 -16.05579 -22.89298 1.000 33.00414  ? 104  PRO A HG2   1 
ATOM   1674 H HG3   . PRO A 1 104 ? -29.46389 -15.25074 -23.77373 1.000 33.00414  ? 104  PRO A HG3   1 
ATOM   1675 H HD2   . PRO A 1 104 ? -28.68102 -16.58146 -21.72549 1.000 27.40737  ? 104  PRO A HD2   1 
ATOM   1676 H HD3   . PRO A 1 104 ? -27.93312 -15.24290 -22.14297 1.000 27.40737  ? 104  PRO A HD3   1 
ATOM   1677 N N     . ILE A 1 105 ? -31.88160 -15.79751 -20.08187 1.000 33.82191  ? 105  ILE A N     1 
ATOM   1678 C CA    . ILE A 1 105 ? -33.07228 -16.27217 -19.38626 1.000 26.98360  ? 105  ILE A CA    1 
ATOM   1679 C C     . ILE A 1 105 ? -33.04927 -15.80953 -17.93585 1.000 29.20844  ? 105  ILE A C     1 
ATOM   1680 O O     . ILE A 1 105 ? -34.01753 -15.22445 -17.43593 1.000 34.37661  ? 105  ILE A O     1 
ATOM   1681 C CB    . ILE A 1 105 ? -33.17764 -17.80478 -19.49088 1.000 24.60950  ? 105  ILE A CB    1 
ATOM   1682 C CG1   . ILE A 1 105 ? -33.21926 -18.23650 -20.96147 1.000 28.98740  ? 105  ILE A CG1   1 
ATOM   1683 C CG2   . ILE A 1 105 ? -34.40213 -18.31017 -18.73285 1.000 25.51109  ? 105  ILE A CG2   1 
ATOM   1684 C CD1   . ILE A 1 105 ? -34.41539 -17.70675 -21.74487 1.000 23.72495  ? 105  ILE A CD1   1 
ATOM   1685 H H     . ILE A 1 105 ? -31.33562 -16.41698 -20.32219 1.000 40.68601  ? 105  ILE A H     1 
ATOM   1686 H HA    . ILE A 1 105 ? -33.85601 -15.89048 -19.81167 1.000 32.48002  ? 105  ILE A HA    1 
ATOM   1687 H HB    . ILE A 1 105 ? -32.38977 -18.19742 -19.08346 1.000 29.63111  ? 105  ILE A HB    1 
ATOM   1688 H HG12  . ILE A 1 105 ? -32.41639 -17.91465 -21.40044 1.000 34.88459  ? 105  ILE A HG12  1 
ATOM   1689 H HG13  . ILE A 1 105 ? -33.25164 -19.20528 -20.99790 1.000 34.88459  ? 105  ILE A HG13  1 
ATOM   1690 H HG21  . ILE A 1 105 ? -34.57321 -19.23053 -18.98696 1.000 30.71301  ? 105  ILE A HG21  1 
ATOM   1691 H HG22  . ILE A 1 105 ? -34.22790 -18.25699 -17.78011 1.000 30.71301  ? 105  ILE A HG22  1 
ATOM   1692 H HG23  . ILE A 1 105 ? -35.16539 -17.75670 -18.96093 1.000 30.71301  ? 105  ILE A HG23  1 
ATOM   1693 H HD11  . ILE A 1 105 ? -34.36466 -18.03236 -22.65718 1.000 28.56965  ? 105  ILE A HD11  1 
ATOM   1694 H HD12  . ILE A 1 105 ? -35.23170 -18.02170 -21.32615 1.000 28.56965  ? 105  ILE A HD12  1 
ATOM   1695 H HD13  . ILE A 1 105 ? -34.39297 -16.73703 -21.73803 1.000 28.56965  ? 105  ILE A HD13  1 
ATOM   1696 N N     . GLY A 1 106 ? -31.93966 -16.05922 -17.23926 1.000 27.86343  ? 106  GLY A N     1 
ATOM   1697 C CA    . GLY A 1 106 ? -31.82723 -15.60131 -15.86590 1.000 25.27941  ? 106  GLY A CA    1 
ATOM   1698 C C     . GLY A 1 106 ? -31.92518 -14.09377 -15.74916 1.000 30.02692  ? 106  GLY A C     1 
ATOM   1699 O O     . GLY A 1 106 ? -32.61869 -13.57214 -14.87212 1.000 30.05341  ? 106  GLY A O     1 
ATOM   1700 H H     . GLY A 1 106 ? -31.25326 -16.48370 -17.53637 1.000 33.53583  ? 106  GLY A H     1 
ATOM   1701 H HA2   . GLY A 1 106 ? -32.53841 -15.99557 -15.33704 1.000 30.43500  ? 106  GLY A HA2   1 
ATOM   1702 H HA3   . GLY A 1 106 ? -30.97201 -15.88091 -15.50351 1.000 30.43500  ? 106  GLY A HA3   1 
ATOM   1703 N N     . ASP A 1 107 ? -31.23147 -13.37196 -16.63177 1.000 27.71889  ? 107  ASP A N     1 
ATOM   1704 C CA    . ASP A 1 107 ? -31.32895 -11.91736 -16.63126 1.000 27.42457  ? 107  ASP A CA    1 
ATOM   1705 C C     . ASP A 1 107 ? -32.78367 -11.46651 -16.69753 1.000 25.49595  ? 107  ASP A C     1 
ATOM   1706 O O     . ASP A 1 107 ? -33.19966 -10.57796 -15.94563 1.000 34.21351  ? 107  ASP A O     1 
ATOM   1707 C CB    . ASP A 1 107 ? -30.52271 -11.34153 -17.79826 1.000 33.02332  ? 107  ASP A CB    1 
ATOM   1708 C CG    . ASP A 1 107 ? -29.01861 -11.37153 -17.54448 1.000 27.29358  ? 107  ASP A CG    1 
ATOM   1709 O OD1   . ASP A 1 107 ? -28.60862 -11.65468 -16.40109 1.000 27.09877  ? 107  ASP A OD1   1 
ATOM   1710 O OD2   . ASP A 1 107 ? -28.24570 -11.10782 -18.48948 1.000 33.13726  ? 107  ASP A OD2   1 
ATOM   1711 H H     . ASP A 1 107 ? -30.70652 -13.69680 -17.23052 1.000 33.36237  ? 107  ASP A H     1 
ATOM   1712 H HA    . ASP A 1 107 ? -30.94762 -11.57085 -15.80942 1.000 33.00919  ? 107  ASP A HA    1 
ATOM   1713 H HB2   . ASP A 1 107 ? -30.70328 -11.86339 -18.59573 1.000 39.72769  ? 107  ASP A HB2   1 
ATOM   1714 H HB3   . ASP A 1 107 ? -30.78520 -10.41844 -17.93935 1.000 39.72769  ? 107  ASP A HB3   1 
ATOM   1715 N N     . SER A 1 108 ? -33.58287 -12.09174 -17.56919 1.000 28.51241  ? 108  SER A N     1 
ATOM   1716 C CA    . SER A 1 108 ? -34.97173 -11.67018 -17.73049 1.000 30.15935  ? 108  SER A CA    1 
ATOM   1717 C C     . SER A 1 108 ? -35.82733 -12.05038 -16.52750 1.000 34.23732  ? 108  SER A C     1 
ATOM   1718 O O     . SER A 1 108 ? -36.80533 -11.35718 -16.22433 1.000 37.77265  ? 108  SER A O     1 
ATOM   1719 C CB    . SER A 1 108 ? -35.57005 -12.27762 -18.99898 1.000 31.71798  ? 108  SER A CB    1 
ATOM   1720 O OG    . SER A 1 108 ? -36.16364 -13.53530 -18.72668 1.000 49.58855  ? 108  SER A OG    1 
ATOM   1721 H H     . SER A 1 108 ? -33.34735 -12.75070 -18.06908 1.000 34.31460  ? 108  SER A H     1 
ATOM   1722 H HA    . SER A 1 108 ? -34.98322 -10.70435 -17.81961 1.000 36.29093  ? 108  SER A HA    1 
ATOM   1723 H HB2   . SER A 1 108 ? -36.24817 -11.67743 -19.34658 1.000 38.16128  ? 108  SER A HB2   1 
ATOM   1724 H HB3   . SER A 1 108 ? -34.86504 -12.39688 -19.65445 1.000 38.16128  ? 108  SER A HB3   1 
ATOM   1725 H HG    . SER A 1 108 ? -35.60326 -14.04487 -18.36348 1.000 59.60597  ? 108  SER A HG    1 
ATOM   1726 N N     . VAL A 1 109 ? -35.49728 -13.15026 -15.84672 1.000 30.00802  ? 109  VAL A N     1 
ATOM   1727 C CA    . VAL A 1 109 ? -36.17272 -13.47139 -14.59224 1.000 27.81107  ? 109  VAL A CA    1 
ATOM   1728 C C     . VAL A 1 109 ? -35.84459 -12.42277 -13.53680 1.000 31.60301  ? 109  VAL A C     1 
ATOM   1729 O O     . VAL A 1 109 ? -36.73330 -11.91655 -12.84145 1.000 36.66921  ? 109  VAL A O     1 
ATOM   1730 C CB    . VAL A 1 109 ? -35.78947 -14.88452 -14.12146 1.000 28.60519  ? 109  VAL A CB    1 
ATOM   1731 C CG1   . VAL A 1 109 ? -36.31242 -15.14258 -12.71416 1.000 35.57100  ? 109  VAL A CG1   1 
ATOM   1732 C CG2   . VAL A 1 109 ? -36.33450 -15.91653 -15.08675 1.000 29.43329  ? 109  VAL A CG2   1 
ATOM   1733 H H     . VAL A 1 109 ? -34.89594 -13.71639 -16.08647 1.000 36.10933  ? 109  VAL A H     1 
ATOM   1734 H HA    . VAL A 1 109 ? -37.13072 -13.45826 -14.74381 1.000 33.47299  ? 109  VAL A HA    1 
ATOM   1735 H HB    . VAL A 1 109 ? -34.82264 -14.95980 -14.09947 1.000 34.42594  ? 109  VAL A HB    1 
ATOM   1736 H HG11  . VAL A 1 109 ? -36.28453 -16.09581 -12.53674 1.000 42.78491  ? 109  VAL A HG11  1 
ATOM   1737 H HG12  . VAL A 1 109 ? -35.75238 -14.67114 -12.07776 1.000 42.78491  ? 109  VAL A HG12  1 
ATOM   1738 H HG13  . VAL A 1 109 ? -37.22560 -14.82127 -12.65274 1.000 42.78491  ? 109  VAL A HG13  1 
ATOM   1739 H HG21  . VAL A 1 109 ? -36.08009 -16.80099 -14.78030 1.000 35.41966  ? 109  VAL A HG21  1 
ATOM   1740 H HG22  . VAL A 1 109 ? -37.30119 -15.84200 -15.11611 1.000 35.41966  ? 109  VAL A HG22  1 
ATOM   1741 H HG23  . VAL A 1 109 ? -35.96316 -15.75216 -15.96765 1.000 35.41966  ? 109  VAL A HG23  1 
ATOM   1742 N N     . ASP A 1 110 ? -34.56047 -12.08146 -13.40190 1.000 26.85070  ? 110  ASP A N     1 
ATOM   1743 C CA    . ASP A 1 110 ? -34.17872 -10.98213 -12.52474 1.000 26.72291  ? 110  ASP A CA    1 
ATOM   1744 C C     . ASP A 1 110 ? -34.94488 -9.71355  -12.87178 1.000 35.93473  ? 110  ASP A C     1 
ATOM   1745 O O     . ASP A 1 110 ? -35.32337 -8.94094  -11.98329 1.000 32.02512  ? 110  ASP A O     1 
ATOM   1746 C CB    . ASP A 1 110 ? -32.67565 -10.72074 -12.62662 1.000 31.88516  ? 110  ASP A CB    1 
ATOM   1747 C CG    . ASP A 1 110 ? -31.84778 -11.84690 -12.06009 1.000 32.62772  ? 110  ASP A CG    1 
ATOM   1748 O OD1   . ASP A 1 110 ? -32.43316 -12.78129 -11.47439 1.000 27.91179  ? 110  ASP A OD1   1 
ATOM   1749 O OD2   . ASP A 1 110 ? -30.60794 -11.79288 -12.20287 1.000 27.24659  ? 110  ASP A OD2   1 
ATOM   1750 H H     . ASP A 1 110 ? -33.90358 -12.46614 -13.80205 1.000 32.32055  ? 110  ASP A H     1 
ATOM   1751 H HA    . ASP A 1 110 ? -34.38427 -11.23167 -11.61020 1.000 32.16720  ? 110  ASP A HA    1 
ATOM   1752 H HB2   . ASP A 1 110 ? -32.43619 -10.61281 -13.56038 1.000 38.36190  ? 110  ASP A HB2   1 
ATOM   1753 H HB3   . ASP A 1 110 ? -32.46111 -9.91338  -12.13364 1.000 38.36190  ? 110  ASP A HB3   1 
ATOM   1754 N N     . GLU A 1 111 ? -35.17636 -9.47730  -14.16594 1.000 27.26526  ? 111  GLU A N     1 
ATOM   1755 C CA    . GLU A 1 111 ? -35.79572 -8.22367  -14.58127 1.000 42.83676  ? 111  GLU A CA    1 
ATOM   1756 C C     . GLU A 1 111 ? -37.27997 -8.19725  -14.24423 1.000 40.06401  ? 111  GLU A C     1 
ATOM   1757 O O     . GLU A 1 111 ? -37.82934 -7.12544  -13.96519 1.000 37.07977  ? 111  GLU A O     1 
ATOM   1758 C CB    . GLU A 1 111 ? -35.57670 -8.00383  -16.07788 1.000 46.88041  ? 111  GLU A CB    1 
ATOM   1759 C CG    . GLU A 1 111 ? -35.22078 -6.56769  -16.45865 1.000 64.34619  ? 111  GLU A CG    1 
ATOM   1760 C CD    . GLU A 1 111 ? -36.42764 -5.64351  -16.50956 1.000 74.54491  ? 111  GLU A CD    1 
ATOM   1761 O OE1   . GLU A 1 111 ? -37.57101 -6.14075  -16.42980 1.000 82.00574  ? 111  GLU A OE1   1 
ATOM   1762 O OE2   . GLU A 1 111 ? -36.22998 -4.41611  -16.63577 1.000 70.49465  ? 111  GLU A OE2   1 
ATOM   1763 H H     . GLU A 1 111 ? -34.98730 -10.01684 -14.80839 1.000 32.81802  ? 111  GLU A H     1 
ATOM   1764 H HA    . GLU A 1 111 ? -35.37199 -7.48939  -14.10990 1.000 51.50382  ? 111  GLU A HA    1 
ATOM   1765 H HB2   . GLU A 1 111 ? -34.84898 -8.57419  -16.37115 1.000 56.35620  ? 111  GLU A HB2   1 
ATOM   1766 H HB3   . GLU A 1 111 ? -36.39222 -8.23855  -16.54770 1.000 56.35620  ? 111  GLU A HB3   1 
ATOM   1767 H HG2   . GLU A 1 111 ? -34.60136 -6.21281  -15.80194 1.000 77.31514  ? 111  GLU A HG2   1 
ATOM   1768 H HG3   . GLU A 1 111 ? -34.80887 -6.56834  -17.33685 1.000 77.31514  ? 111  GLU A HG3   1 
ATOM   1769 N N     . GLU A 1 112 ? -37.94088 -9.35858  -14.25471 1.000 30.68888  ? 112  GLU A N     1 
ATOM   1770 C CA    . GLU A 1 112 ? -39.33549 -9.41682  -13.83247 1.000 30.90505  ? 112  GLU A CA    1 
ATOM   1771 C C     . GLU A 1 112 ? -39.53720 -8.73532  -12.48705 1.000 34.50388  ? 112  GLU A C     1 
ATOM   1772 O O     . GLU A 1 112 ? -40.58784 -8.13121  -12.24529 1.000 39.24203  ? 112  GLU A O     1 
ATOM   1773 C CB    . GLU A 1 112 ? -39.80431 -10.87116 -13.75175 1.000 36.40555  ? 112  GLU A CB    1 
ATOM   1774 C CG    . GLU A 1 112 ? -40.02092 -11.54024 -15.09858 1.000 35.40780  ? 112  GLU A CG    1 
ATOM   1775 C CD    . GLU A 1 112 ? -40.43473 -12.99525 -14.96777 1.000 44.34469  ? 112  GLU A CD    1 
ATOM   1776 O OE1   . GLU A 1 112 ? -41.01736 -13.36095 -13.92545 1.000 48.86926  ? 112  GLU A OE1   1 
ATOM   1777 O OE2   . GLU A 1 112 ? -40.17050 -13.77715 -15.90515 1.000 47.19974  ? 112  GLU A OE2   1 
ATOM   1778 H H     . GLU A 1 112 ? -37.60775 -10.11309 -14.49829 1.000 36.92637  ? 112  GLU A H     1 
ATOM   1779 H HA    . GLU A 1 112 ? -39.87936 -8.96130  -14.49400 1.000 37.18577  ? 112  GLU A HA    1 
ATOM   1780 H HB2   . GLU A 1 112 ? -39.13487 -11.38525 -13.27376 1.000 43.78637  ? 112  GLU A HB2   1 
ATOM   1781 H HB3   . GLU A 1 112 ? -40.64736 -10.89763 -13.27274 1.000 43.78637  ? 112  GLU A HB3   1 
ATOM   1782 H HG2   . GLU A 1 112 ? -40.72198 -11.07019 -15.57657 1.000 42.58907  ? 112  GLU A HG2   1 
ATOM   1783 H HG3   . GLU A 1 112 ? -39.19436 -11.50722 -15.60515 1.000 42.58907  ? 112  GLU A HG3   1 
ATOM   1784 N N     . PHE A 1 113 ? -38.54603 -8.82144  -11.60159 1.000 35.08806  ? 113  PHE A N     1 
ATOM   1785 C CA    . PHE A 1 113 ? -38.60758 -8.20300  -10.28469 1.000 35.10789  ? 113  PHE A CA    1 
ATOM   1786 C C     . PHE A 1 113 ? -37.87546 -6.86886  -10.23367 1.000 38.05779  ? 113  PHE A C     1 
ATOM   1787 O O     . PHE A 1 113 ? -38.44847 -5.86535  -9.80182  1.000 39.31454  ? 113  PHE A O     1 
ATOM   1788 C CB    . PHE A 1 113 ? -38.02333 -9.15584  -9.23792  1.000 30.97952  ? 113  PHE A CB    1 
ATOM   1789 C CG    . PHE A 1 113 ? -38.73687 -10.46821 -9.15878  1.000 30.39926  ? 113  PHE A CG    1 
ATOM   1790 C CD1   . PHE A 1 113 ? -38.38117 -11.51317 -9.99087  1.000 30.15189  ? 113  PHE A CD1   1 
ATOM   1791 C CD2   . PHE A 1 113 ? -39.76928 -10.65503 -8.25687  1.000 27.85588  ? 113  PHE A CD2   1 
ATOM   1792 C CE1   . PHE A 1 113 ? -39.03995 -12.72252 -9.92477  1.000 28.08826  ? 113  PHE A CE1   1 
ATOM   1793 C CE2   . PHE A 1 113 ? -40.43007 -11.86056 -8.18473  1.000 27.50920  ? 113  PHE A CE2   1 
ATOM   1794 C CZ    . PHE A 1 113 ? -40.06443 -12.89724 -9.01894  1.000 27.18418  ? 113  PHE A CZ    1 
ATOM   1795 H H     . PHE A 1 113 ? -37.81097 -9.24363  -11.74669 1.000 42.20539  ? 113  PHE A H     1 
ATOM   1796 H HA    . PHE A 1 113 ? -39.53672 -8.03923  -10.05936 1.000 42.22918  ? 113  PHE A HA    1 
ATOM   1797 H HB2   . PHE A 1 113 ? -37.09648 -9.33493  -9.46101  1.000 37.27514  ? 113  PHE A HB2   1 
ATOM   1798 H HB3   . PHE A 1 113 ? -38.07926 -8.73455  -8.36598  1.000 37.27514  ? 113  PHE A HB3   1 
ATOM   1799 H HD1   . PHE A 1 113 ? -37.68966 -11.39915 -10.60218 1.000 36.28197  ? 113  PHE A HD1   1 
ATOM   1800 H HD2   . PHE A 1 113 ? -40.01951 -9.95879  -7.69336  1.000 33.52676  ? 113  PHE A HD2   1 
ATOM   1801 H HE1   . PHE A 1 113 ? -38.79379 -13.41883 -10.48998 1.000 33.80562  ? 113  PHE A HE1   1 
ATOM   1802 H HE2   . PHE A 1 113 ? -41.12219 -11.97620 -7.57440  1.000 33.11075  ? 113  PHE A HE2   1 
ATOM   1803 H HZ    . PHE A 1 113 ? -40.50861 -13.71285 -8.97013  1.000 32.72073  ? 113  PHE A HZ    1 
ATOM   1804 N N     . LEU A 1 114 ? -36.61179 -6.83653  -10.66084 1.000 34.43868  ? 114  LEU A N     1 
ATOM   1805 C CA    . LEU A 1 114 ? -35.86672 -5.58334  -10.63370 1.000 36.18258  ? 114  LEU A CA    1 
ATOM   1806 C C     . LEU A 1 114 ? -36.52243 -4.53356  -11.51941 1.000 41.75415  ? 114  LEU A C     1 
ATOM   1807 O O     . LEU A 1 114 ? -36.43324 -3.33409  -11.23110 1.000 37.00591  ? 114  LEU A O     1 
ATOM   1808 C CB    . LEU A 1 114 ? -34.42084 -5.82437  -11.06538 1.000 38.05272  ? 114  LEU A CB    1 
ATOM   1809 C CG    . LEU A 1 114 ? -33.59515 -6.72476  -10.14387 1.000 34.31891  ? 114  LEU A CG    1 
ATOM   1810 C CD1   . LEU A 1 114 ? -32.26475 -7.07318  -10.78631 1.000 36.36033  ? 114  LEU A CD1   1 
ATOM   1811 C CD2   . LEU A 1 114 ? -33.36580 -6.06414  -8.79613  1.000 27.91269  ? 114  LEU A CD2   1 
ATOM   1812 H H     . LEU A 1 114 ? -36.17415 -7.51193  -10.96399 1.000 41.42612  ? 114  LEU A H     1 
ATOM   1813 H HA    . LEU A 1 114 ? -35.85068 -5.24271  -9.72562  1.000 43.51881  ? 114  LEU A HA    1 
ATOM   1814 H HB2   . LEU A 1 114 ? -34.43084 -6.24001  -11.94176 1.000 45.76298  ? 114  LEU A HB2   1 
ATOM   1815 H HB3   . LEU A 1 114 ? -33.97027 -4.96654  -11.11017 1.000 45.76298  ? 114  LEU A HB3   1 
ATOM   1816 H HG    . LEU A 1 114 ? -34.09026 -7.54570  -9.99615  1.000 41.28240  ? 114  LEU A HG    1 
ATOM   1817 H HD11  . LEU A 1 114 ? -31.76387 -7.64589  -10.18462 1.000 43.73211  ? 114  LEU A HD11  1 
ATOM   1818 H HD12  . LEU A 1 114 ? -32.42953 -7.53586  -11.62278 1.000 43.73211  ? 114  LEU A HD12  1 
ATOM   1819 H HD13  . LEU A 1 114 ? -31.77048 -6.25527  -10.95251 1.000 43.73211  ? 114  LEU A HD13  1 
ATOM   1820 H HD21  . LEU A 1 114 ? -32.77049 -6.61991  -8.26923  1.000 33.59494  ? 114  LEU A HD21  1 
ATOM   1821 H HD22  . LEU A 1 114 ? -32.96615 -5.19145  -8.93612  1.000 33.59494  ? 114  LEU A HD22  1 
ATOM   1822 H HD23  . LEU A 1 114 ? -34.21766 -5.96885  -8.34209  1.000 33.59494  ? 114  LEU A HD23  1 
ATOM   1823 N N     . GLY A 1 115 ? -37.19770 -4.96333  -12.58803 1.000 43.04845  ? 115  GLY A N     1 
ATOM   1824 C CA    . GLY A 1 115 ? -37.86114 -4.02997  -13.48027 1.000 55.87203  ? 115  GLY A CA    1 
ATOM   1825 C C     . GLY A 1 115 ? -38.89355 -3.15647  -12.80138 1.000 45.64661  ? 115  GLY A C     1 
ATOM   1826 O O     . GLY A 1 115 ? -39.21704 -2.07855  -13.31338 1.000 39.47206  ? 115  GLY A O     1 
ATOM   1827 H H     . GLY A 1 115 ? -37.28310 -5.78901  -12.81290 1.000 51.75785  ? 115  GLY A H     1 
ATOM   1828 H HA2   . GLY A 1 115 ? -37.19459 -3.44957  -13.87996 1.000 67.14615  ? 115  GLY A HA2   1 
ATOM   1829 H HA3   . GLY A 1 115 ? -38.30692 -4.52927  -14.18233 1.000 67.14615  ? 115  GLY A HA3   1 
ATOM   1830 N N     . ARG A 1 116 ? -39.42479 -3.59817  -11.66542 1.000 37.00051  ? 116  ARG A N     1 
ATOM   1831 C CA    . ARG A 1 116 ? -40.36981 -2.80836  -10.88971 1.000 40.47196  ? 116  ARG A CA    1 
ATOM   1832 C C     . ARG A 1 116 ? -39.68816 -1.74610  -10.03750 1.000 37.53385  ? 116  ARG A C     1 
ATOM   1833 O O     . ARG A 1 116 ? -40.37221 -1.06394  -9.26643  1.000 42.45916  ? 116  ARG A O     1 
ATOM   1834 C CB    . ARG A 1 116 ? -41.20667 -3.73487  -10.00068 1.000 41.01709  ? 116  ARG A CB    1 
ATOM   1835 C CG    . ARG A 1 116 ? -42.15076 -4.65058  -10.77587 1.000 34.40916  ? 116  ARG A CG    1 
ATOM   1836 C CD    . ARG A 1 116 ? -42.48729 -5.91713  -9.99753  1.000 39.28586  ? 116  ARG A CD    1 
ATOM   1837 N NE    . ARG A 1 116 ? -43.49133 -6.72698  -10.67996 1.000 58.21983  ? 116  ARG A NE    1 
ATOM   1838 C CZ    . ARG A 1 116 ? -43.66396 -8.03032  -10.49655 1.000 62.15470  ? 116  ARG A CZ    1 
ATOM   1839 N NH1   . ARG A 1 116 ? -42.88550 -8.72487  -9.68250  1.000 51.63739  ? 116  ARG A NH1   1 
ATOM   1840 N NH2   . ARG A 1 116 ? -44.63908 -8.65387  -11.15179 1.000 89.13833  ? 116  ARG A NH2   1 
ATOM   1841 H H     . ARG A 1 116 ? -39.24971 -4.36536  -11.31849 1.000 44.50032  ? 116  ARG A H     1 
ATOM   1842 H HA    . ARG A 1 116 ? -40.97413 -2.35222  -11.49604 1.000 48.66607  ? 116  ARG A HA    1 
ATOM   1843 H HB2   . ARG A 1 116 ? -40.60695 -4.29685  -9.48548  1.000 49.32021  ? 116  ARG A HB2   1 
ATOM   1844 H HB3   . ARG A 1 116 ? -41.74554 -3.19116  -9.40494  1.000 49.32021  ? 116  ARG A HB3   1 
ATOM   1845 H HG2   . ARG A 1 116 ? -42.97814 -4.17732  -10.95581 1.000 41.39071  ? 116  ARG A HG2   1 
ATOM   1846 H HG3   . ARG A 1 116 ? -41.72943 -4.91105  -11.60986 1.000 41.39071  ? 116  ARG A HG3   1 
ATOM   1847 H HD2   . ARG A 1 116 ? -41.68456 -6.45206  -9.89571  1.000 47.24274  ? 116  ARG A HD2   1 
ATOM   1848 H HD3   . ARG A 1 116 ? -42.83609 -5.67305  -9.12595  1.000 47.24274  ? 116  ARG A HD3   1 
ATOM   1849 H HE    . ARG A 1 116 ? -44.00859 -6.33122  -11.24157 1.000 69.96351  ? 116  ARG A HE    1 
ATOM   1850 H HH11  . ARG A 1 116 ? -42.24940 -8.33250  -9.25704  1.000 62.06457  ? 116  ARG A HH11  1 
ATOM   1851 H HH12  . ARG A 1 116 ? -43.01568 -9.56862  -9.57892  1.000 62.06457  ? 116  ARG A HH12  1 
ATOM   1852 H HH21  . ARG A 1 116 ? -45.14833 -8.21290  -11.68640 1.000 107.06571 ? 116  ARG A HH21  1 
ATOM   1853 H HH22  . ARG A 1 116 ? -44.76033 -9.49802  -11.04086 1.000 107.06571 ? 116  ARG A HH22  1 
ATOM   1854 N N     . LEU A 1 117 ? -38.37096 -1.58780  -10.16093 1.000 39.56040  ? 117  LEU A N     1 
ATOM   1855 C CA    . LEU A 1 117 ? -37.61523 -0.59236  -9.41740  1.000 33.08789  ? 117  LEU A CA    1 
ATOM   1856 C C     . LEU A 1 117 ? -36.85282 0.30596   -10.38005 1.000 33.75299  ? 117  LEU A C     1 
ATOM   1857 O O     . LEU A 1 117 ? -36.35613 -0.15265  -11.41331 1.000 44.35869  ? 117  LEU A O     1 
ATOM   1858 C CB    . LEU A 1 117 ? -36.61380 -1.24171  -8.45866  1.000 38.69384  ? 117  LEU A CB    1 
ATOM   1859 C CG    . LEU A 1 117 ? -37.14243 -2.17828  -7.37708  1.000 36.62188  ? 117  LEU A CG    1 
ATOM   1860 C CD1   . LEU A 1 117 ? -35.98002 -2.70169  -6.54114  1.000 38.72183  ? 117  LEU A CD1   1 
ATOM   1861 C CD2   . LEU A 1 117 ? -38.16548 -1.48531  -6.49918  1.000 41.83981  ? 117  LEU A CD2   1 
ATOM   1862 H H     . LEU A 1 117 ? -37.88214 -2.06178  -10.68628 1.000 47.57219  ? 117  LEU A H     1 
ATOM   1863 H HA    . LEU A 1 117 ? -38.23721 -0.05394  -8.90345  1.000 39.80518  ? 117  LEU A HA    1 
ATOM   1864 H HB2   . LEU A 1 117 ? -35.99161 -1.75993  -8.99273  1.000 46.53232  ? 117  LEU A HB2   1 
ATOM   1865 H HB3   . LEU A 1 117 ? -36.14315 -0.52815  -8.00017  1.000 46.53232  ? 117  LEU A HB3   1 
ATOM   1866 H HG    . LEU A 1 117 ? -37.59004 -2.92907  -7.79762  1.000 44.04597  ? 117  LEU A HG    1 
ATOM   1867 H HD11  . LEU A 1 117 ? -36.32490 -3.30124  -5.86107  1.000 46.56591  ? 117  LEU A HD11  1 
ATOM   1868 H HD12  . LEU A 1 117 ? -35.36388 -3.17742  -7.11988  1.000 46.56591  ? 117  LEU A HD12  1 
ATOM   1869 H HD13  . LEU A 1 117 ? -35.52889 -1.95169  -6.12296  1.000 46.56591  ? 117  LEU A HD13  1 
ATOM   1870 H HD21  . LEU A 1 117 ? -38.41755 -2.08170  -5.77691  1.000 50.30749  ? 117  LEU A HD21  1 
ATOM   1871 H HD22  . LEU A 1 117 ? -37.77406 -0.67480  -6.13755  1.000 50.30749  ? 117  LEU A HD22  1 
ATOM   1872 H HD23  . LEU A 1 117 ? -38.94427 -1.26629  -7.03436  1.000 50.30749  ? 117  LEU A HD23  1 
ATOM   1873 N N     . SER A 1 118 ? -36.74704 1.58188   -10.03011 1.000 43.64197  ? 118  SER A N     1 
ATOM   1874 C CA    . SER A 1 118 ? -35.88942 2.47610   -10.78442 1.000 41.73666  ? 118  SER A CA    1 
ATOM   1875 C C     . SER A 1 118 ? -34.43127 2.05671   -10.61246 1.000 45.09493  ? 118  SER A C     1 
ATOM   1876 O O     . SER A 1 118 ? -34.09385 1.19095   -9.80047  1.000 44.21490  ? 118  SER A O     1 
ATOM   1877 C CB    . SER A 1 118 ? -36.08702 3.91892   -10.32876 1.000 43.65750  ? 118  SER A CB    1 
ATOM   1878 O OG    . SER A 1 118 ? -35.62054 4.10219   -9.00526  1.000 44.35102  ? 118  SER A OG    1 
ATOM   1879 H H     . SER A 1 118 ? -37.15706 1.94710   -9.36822  1.000 52.47007  ? 118  SER A H     1 
ATOM   1880 H HA    . SER A 1 118 ? -36.11652 2.43022   -11.72634 1.000 50.18370  ? 118  SER A HA    1 
ATOM   1881 H HB2   . SER A 1 118 ? -35.59273 4.50682   -10.92118 1.000 52.48871  ? 118  SER A HB2   1 
ATOM   1882 H HB3   . SER A 1 118 ? -37.03251 4.13303   -10.36196 1.000 52.48871  ? 118  SER A HB3   1 
ATOM   1883 H HG    . SER A 1 118 ? -35.66263 4.91454   -8.79570  1.000 53.32093  ? 118  SER A HG    1 
ATOM   1884 N N     . ALA A 1 119 ? -33.55541 2.68292   -11.39818 1.000 55.60888  ? 119  ALA A N     1 
ATOM   1885 C CA    . ALA A 1 119 ? -32.12960 2.41630   -11.25161 1.000 41.68138  ? 119  ALA A CA    1 
ATOM   1886 C C     . ALA A 1 119 ? -31.64474 2.80416   -9.86070  1.000 44.13032  ? 119  ALA A C     1 
ATOM   1887 O O     . ALA A 1 119 ? -30.89087 2.05716   -9.22572  1.000 42.94677  ? 119  ALA A O     1 
ATOM   1888 C CB    . ALA A 1 119 ? -31.34276 3.16526   -12.32589 1.000 42.21895  ? 119  ALA A CB    1 
ATOM   1889 H H     . ALA A 1 119 ? -33.75729 3.25328   -12.00936 1.000 66.83037  ? 119  ALA A H     1 
ATOM   1890 H HA    . ALA A 1 119 ? -31.97048 1.46733   -11.37422 1.000 50.11737  ? 119  ALA A HA    1 
ATOM   1891 H HB1   . ALA A 1 119 ? -30.39787 2.97627   -12.21469 1.000 50.76245  ? 119  ALA A HB1   1 
ATOM   1892 H HB2   . ALA A 1 119 ? -31.63912 2.86698   -13.20002 1.000 50.76245  ? 119  ALA A HB2   1 
ATOM   1893 H HB3   . ALA A 1 119 ? -31.50337 4.11697   -12.22914 1.000 50.76245  ? 119  ALA A HB3   1 
ATOM   1894 N N     . GLU A 1 120 ? -32.07520 3.96742   -9.36569  1.000 44.50715  ? 120  GLU A N     1 
ATOM   1895 C CA    . GLU A 1 120 ? -31.64829 4.40579   -8.04174  1.000 38.66893  ? 120  GLU A CA    1 
ATOM   1896 C C     . GLU A 1 120 ? -32.10274 3.42898   -6.96483  1.000 44.47731  ? 120  GLU A C     1 
ATOM   1897 O O     . GLU A 1 120 ? -31.38775 3.19688   -5.98232  1.000 45.45735  ? 120  GLU A O     1 
ATOM   1898 C CB    . GLU A 1 120 ? -32.18854 5.80556   -7.75307  1.000 42.32866  ? 120  GLU A CB    1 
ATOM   1899 C CG    . GLU A 1 120 ? -31.49015 6.92265   -8.51764  1.000 50.10851  ? 120  GLU A CG    1 
ATOM   1900 C CD    . GLU A 1 120 ? -31.91946 7.01369   -9.96856  1.000 48.79787  ? 120  GLU A CD    1 
ATOM   1901 O OE1   . GLU A 1 120 ? -32.72345 6.16590   -10.41310 1.000 44.43466  ? 120  GLU A OE1   1 
ATOM   1902 O OE2   . GLU A 1 120 ? -31.45196 7.94236   -10.66291 1.000 46.46949  ? 120  GLU A OE2   1 
ATOM   1903 H H     . GLU A 1 120 ? -32.60539 4.51011   -9.77065  1.000 53.50829  ? 120  GLU A H     1 
ATOM   1904 H HA    . GLU A 1 120 ? -30.67930 4.44630   -8.02429  1.000 46.50243  ? 120  GLU A HA    1 
ATOM   1905 H HB2   . GLU A 1 120 ? -33.12813 5.82949   -7.99283  1.000 50.89410  ? 120  GLU A HB2   1 
ATOM   1906 H HB3   . GLU A 1 120 ? -32.08299 5.98818   -6.80629  1.000 50.89410  ? 120  GLU A HB3   1 
ATOM   1907 H HG2   . GLU A 1 120 ? -31.69510 7.77015   -8.09262  1.000 60.22992  ? 120  GLU A HG2   1 
ATOM   1908 H HG3   . GLU A 1 120 ? -30.53317 6.76526   -8.49948  1.000 60.22992  ? 120  GLU A HG3   1 
ATOM   1909 N N     . GLU A 1 121 ? -33.28991 2.84407   -7.13295  1.000 40.09069  ? 121  GLU A N     1 
ATOM   1910 C CA    . GLU A 1 121 ? -33.80424 1.91864   -6.13023  1.000 35.85433  ? 121  GLU A CA    1 
ATOM   1911 C C     . GLU A 1 121 ? -33.07488 0.58411   -6.18065  1.000 47.59813  ? 121  GLU A C     1 
ATOM   1912 O O     . GLU A 1 121 ? -32.83333 -0.03718  -5.13908  1.000 42.79360  ? 121  GLU A O     1 
ATOM   1913 C CB    . GLU A 1 121 ? -35.30138 1.71183   -6.33278  1.000 37.19476  ? 121  GLU A CB    1 
ATOM   1914 C CG    . GLU A 1 121 ? -36.12485 2.94761   -6.05296  1.000 34.82426  ? 121  GLU A CG    1 
ATOM   1915 C CD    . GLU A 1 121 ? -37.59250 2.73306   -6.33393  1.000 36.69946  ? 121  GLU A CD    1 
ATOM   1916 O OE1   . GLU A 1 121 ? -37.92247 2.23810   -7.43295  1.000 41.76022  ? 121  GLU A OE1   1 
ATOM   1917 O OE2   . GLU A 1 121 ? -38.41934 3.04790   -5.45209  1.000 44.11208  ? 121  GLU A OE2   1 
ATOM   1918 H H     . GLU A 1 121 ? -33.80790 2.96522   -7.80867  1.000 48.20854  ? 121  GLU A H     1 
ATOM   1919 H HA    . GLU A 1 121 ? -33.66544 2.30449   -5.25117  1.000 43.12490  ? 121  GLU A HA    1 
ATOM   1920 H HB2   . GLU A 1 121 ? -35.45926 1.45198   -7.25389  1.000 44.73342  ? 121  GLU A HB2   1 
ATOM   1921 H HB3   . GLU A 1 121 ? -35.60402 1.01135   -5.73392  1.000 44.73342  ? 121  GLU A HB3   1 
ATOM   1922 H HG2   . GLU A 1 121 ? -36.02844 3.18904   -5.11845  1.000 41.88883  ? 121  GLU A HG2   1 
ATOM   1923 H HG3   . GLU A 1 121 ? -35.81225 3.67237   -6.61680  1.000 41.88883  ? 121  GLU A HG3   1 
ATOM   1924 N N     . GLN A 1 122 ? -32.72911 0.11885   -7.38085  1.000 40.48716  ? 122  GLN A N     1 
ATOM   1925 C CA    . GLN A 1 122 ? -31.93862 -1.10015  -7.49588  1.000 36.15877  ? 122  GLN A CA    1 
ATOM   1926 C C     . GLN A 1 122 ? -30.59345 -0.93254  -6.80109  1.000 37.89789  ? 122  GLN A C     1 
ATOM   1927 O O     . GLN A 1 122 ? -30.23931 -1.70744  -5.90573  1.000 35.51718  ? 122  GLN A O     1 
ATOM   1928 C CB    . GLN A 1 122 ? -31.74886 -1.46453  -8.96818  1.000 35.83714  ? 122  GLN A CB    1 
ATOM   1929 C CG    . GLN A 1 122 ? -33.02549 -1.89402  -9.66859  1.000 34.84764  ? 122  GLN A CG    1 
ATOM   1930 C CD    . GLN A 1 122 ? -32.77856 -2.33525  -11.09305 1.000 34.21137  ? 122  GLN A CD    1 
ATOM   1931 O OE1   . GLN A 1 122 ? -31.67658 -2.75675  -11.44054 1.000 42.72112  ? 122  GLN A OE1   1 
ATOM   1932 N NE2   . GLN A 1 122 ? -33.80295 -2.23364  -11.93025 1.000 35.36556  ? 122  GLN A NE2   1 
ATOM   1933 H H     . GLN A 1 122 ? -32.93701 0.48552   -8.13047  1.000 48.68430  ? 122  GLN A H     1 
ATOM   1934 H HA    . GLN A 1 122 ? -32.41532 -1.82895  -7.06867  1.000 43.49024  ? 122  GLN A HA    1 
ATOM   1935 H HB2   . GLN A 1 122 ? -31.40114 -0.69015  -9.43757  1.000 43.10428  ? 122  GLN A HB2   1 
ATOM   1936 H HB3   . GLN A 1 122 ? -31.11835 -2.19926  -9.02763  1.000 43.10428  ? 122  GLN A HB3   1 
ATOM   1937 H HG2   . GLN A 1 122 ? -33.41777 -2.63832  -9.18586  1.000 41.91688  ? 122  GLN A HG2   1 
ATOM   1938 H HG3   . GLN A 1 122 ? -33.64443 -1.14737  -9.68698  1.000 41.91688  ? 122  GLN A HG3   1 
ATOM   1939 H HE21  . GLN A 1 122 ? -34.55750 -1.92936  -11.65157 1.000 42.53838  ? 122  GLN A HE21  1 
ATOM   1940 H HE22  . GLN A 1 122 ? -33.71234 -2.47207  -12.75156 1.000 42.53838  ? 122  GLN A HE22  1 
ATOM   1941 N N     . GLU A 1 123 ? -29.83011 0.08984   -7.20186  1.000 39.91191  ? 123  GLU A N     1 
ATOM   1942 C CA    . GLU A 1 123 ? -28.54334 0.35693   -6.56724  1.000 46.56742  ? 123  GLU A CA    1 
ATOM   1943 C C     . GLU A 1 123 ? -28.68695 0.46832   -5.05740  1.000 53.13906  ? 123  GLU A C     1 
ATOM   1944 O O     . GLU A 1 123 ? -27.78833 0.06649   -4.30968  1.000 47.98559  ? 123  GLU A O     1 
ATOM   1945 C CB    . GLU A 1 123 ? -27.93938 1.64124   -7.14489  1.000 45.15202  ? 123  GLU A CB    1 
ATOM   1946 C CG    . GLU A 1 123 ? -26.69581 2.15120   -6.42385  1.000 58.67873  ? 123  GLU A CG    1 
ATOM   1947 C CD    . GLU A 1 123 ? -25.54487 1.16139   -6.44918  1.000 78.05723  ? 123  GLU A CD    1 
ATOM   1948 O OE1   . GLU A 1 123 ? -25.58449 0.21766   -7.26787  1.000 76.39996  ? 123  GLU A OE1   1 
ATOM   1949 O OE2   . GLU A 1 123 ? -24.60098 1.32688   -5.64523  1.000 79.08143  ? 123  GLU A OE2   1 
ATOM   1950 H H     . GLU A 1 123 ? -30.03483 0.63681   -7.83313  1.000 47.99400  ? 123  GLU A H     1 
ATOM   1951 H HA    . GLU A 1 123 ? -27.93239 -0.37208  -6.75747  1.000 55.98062  ? 123  GLU A HA    1 
ATOM   1952 H HB2   . GLU A 1 123 ? -27.69261 1.47588   -8.06829  1.000 54.28213  ? 123  GLU A HB2   1 
ATOM   1953 H HB3   . GLU A 1 123 ? -28.60874 2.34188   -7.10073  1.000 54.28213  ? 123  GLU A HB3   1 
ATOM   1954 H HG2   . GLU A 1 123 ? -26.39633 2.96828   -6.85232  1.000 70.51418  ? 123  GLU A HG2   1 
ATOM   1955 H HG3   . GLU A 1 123 ? -26.91912 2.32567   -5.49617  1.000 70.51418  ? 123  GLU A HG3   1 
ATOM   1956 N N     . LEU A 1 124 ? -29.81494 0.99411   -4.59221  1.000 50.64544  ? 124  LEU A N     1 
ATOM   1957 C CA    . LEU A 1 124 ? -30.01557 1.21781   -3.16611  1.000 51.90704  ? 124  LEU A CA    1 
ATOM   1958 C C     . LEU A 1 124 ? -30.48856 -0.04558  -2.45865  1.000 53.62773  ? 124  LEU A C     1 
ATOM   1959 O O     . LEU A 1 124 ? -30.18004 -0.23889  -1.27730  1.000 44.06766  ? 124  LEU A O     1 
ATOM   1960 C CB    . LEU A 1 124 ? -30.99120 2.38248   -2.99757  1.000 48.26656  ? 124  LEU A CB    1 
ATOM   1961 C CG    . LEU A 1 124 ? -31.43672 2.85228   -1.61848  1.000 55.40491  ? 124  LEU A CG    1 
ATOM   1962 C CD1   . LEU A 1 124 ? -32.58181 1.96763   -1.18256  1.000 61.45736  ? 124  LEU A CD1   1 
ATOM   1963 C CD2   . LEU A 1 124 ? -30.31333 2.84522   -0.60124  1.000 63.42791  ? 124  LEU A CD2   1 
ATOM   1964 H H     . LEU A 1 124 ? -30.48114 1.23056   -5.08199  1.000 60.87424  ? 124  LEU A H     1 
ATOM   1965 H HA    . LEU A 1 124 ? -29.18523 1.46885   -2.73205  1.000 62.38815  ? 124  LEU A HA    1 
ATOM   1966 H HB2   . LEU A 1 124 ? -30.58260 3.15442   -3.41954  1.000 58.01958  ? 124  LEU A HB2   1 
ATOM   1967 H HB3   . LEU A 1 124 ? -31.80369 2.13853   -3.46795  1.000 58.01958  ? 124  LEU A HB3   1 
ATOM   1968 H HG    . LEU A 1 124 ? -31.72311 3.77787   -1.66493  1.000 66.58560  ? 124  LEU A HG    1 
ATOM   1969 H HD11  . LEU A 1 124 ? -32.37137 1.58187   -0.31780  1.000 73.84855  ? 124  LEU A HD11  1 
ATOM   1970 H HD12  . LEU A 1 124 ? -33.38798 2.50324   -1.11848  1.000 73.84855  ? 124  LEU A HD12  1 
ATOM   1971 H HD13  . LEU A 1 124 ? -32.70393 1.26319   -1.83811  1.000 73.84855  ? 124  LEU A HD13  1 
ATOM   1972 H HD21  . LEU A 1 124 ? -30.60221 3.32362   0.19159   1.000 76.21320  ? 124  LEU A HD21  1 
ATOM   1973 H HD22  . LEU A 1 124 ? -30.09904 1.92694   -0.37376  1.000 76.21320  ? 124  LEU A HD22  1 
ATOM   1974 H HD23  . LEU A 1 124 ? -29.53648 3.28069   -0.98564  1.000 76.21320  ? 124  LEU A HD23  1 
ATOM   1975 N N     . PHE A 1 125 ? -31.20969 -0.92499  -3.15665  1.000 44.97186  ? 125  PHE A N     1 
ATOM   1976 C CA    . PHE A 1 125 ? -31.50067 -2.23788  -2.59152  1.000 31.85908  ? 125  PHE A CA    1 
ATOM   1977 C C     . PHE A 1 125 ? -30.21720 -3.02951  -2.37888  1.000 40.32074  ? 125  PHE A C     1 
ATOM   1978 O O     . PHE A 1 125 ? -30.08202 -3.76126  -1.39048  1.000 39.89689  ? 125  PHE A O     1 
ATOM   1979 C CB    . PHE A 1 125 ? -32.45464 -3.00443  -3.50500  1.000 33.24299  ? 125  PHE A CB    1 
ATOM   1980 C CG    . PHE A 1 125 ? -32.69451 -4.42271  -3.07626  1.000 32.18012  ? 125  PHE A CG    1 
ATOM   1981 C CD1   . PHE A 1 125 ? -33.60171 -4.71210  -2.07276  1.000 33.94889  ? 125  PHE A CD1   1 
ATOM   1982 C CD2   . PHE A 1 125 ? -32.01232 -5.46716  -3.67729  1.000 34.11415  ? 125  PHE A CD2   1 
ATOM   1983 C CE1   . PHE A 1 125 ? -33.82313 -6.01837  -1.67650  1.000 36.19786  ? 125  PHE A CE1   1 
ATOM   1984 C CE2   . PHE A 1 125 ? -32.22965 -6.77250  -3.28577  1.000 29.50241  ? 125  PHE A CE2   1 
ATOM   1985 C CZ    . PHE A 1 125 ? -33.13617 -7.04869  -2.28472  1.000 28.11588  ? 125  PHE A CZ    1 
ATOM   1986 H H     . PHE A 1 125 ? -31.53398 -0.78786  -3.94127  1.000 54.06594  ? 125  PHE A H     1 
ATOM   1987 H HA    . PHE A 1 125 ? -31.93760 -2.12296  -1.73316  1.000 38.33061  ? 125  PHE A HA    1 
ATOM   1988 H HB2   . PHE A 1 125 ? -33.31108 -2.54909  -3.51391  1.000 39.99129  ? 125  PHE A HB2   1 
ATOM   1989 H HB3   . PHE A 1 125 ? -32.08050 -3.02498  -4.39970  1.000 39.99129  ? 125  PHE A HB3   1 
ATOM   1990 H HD1   . PHE A 1 125 ? -34.06758 -4.02091  -1.66030  1.000 40.83838  ? 125  PHE A HD1   1 
ATOM   1991 H HD2   . PHE A 1 125 ? -31.39985 -5.28663  -4.35345  1.000 41.03668  ? 125  PHE A HD2   1 
ATOM   1992 H HE1   . PHE A 1 125 ? -34.43473 -6.20220  -1.00044  1.000 43.53714  ? 125  PHE A HE1   1 
ATOM   1993 H HE2   . PHE A 1 125 ? -31.76493 -7.46523  -3.69694  1.000 35.50260  ? 125  PHE A HE2   1 
ATOM   1994 H HZ    . PHE A 1 125 ? -33.28438 -7.92778  -2.01988  1.000 33.83877  ? 125  PHE A HZ    1 
ATOM   1995 N N     . MET A 1 126 ? -29.25930 -2.88836  -3.29796  1.000 41.20376  ? 126  MET A N     1 
ATOM   1996 C CA    . MET A 1 126 ? -27.98599 -3.58461  -3.15945  1.000 34.21757  ? 126  MET A CA    1 
ATOM   1997 C C     . MET A 1 126 ? -27.16309 -3.01826  -2.01004  1.000 39.36856  ? 126  MET A C     1 
ATOM   1998 O O     . MET A 1 126 ? -26.53214 -3.77345  -1.26173  1.000 43.19502  ? 126  MET A O     1 
ATOM   1999 C CB    . MET A 1 126 ? -27.19930 -3.49631  -4.46454  1.000 33.78583  ? 126  MET A CB    1 
ATOM   2000 C CG    . MET A 1 126 ? -27.78655 -4.32682  -5.58024  1.000 41.61116  ? 126  MET A CG    1 
ATOM   2001 S SD    . MET A 1 126 ? -26.51182 -5.10143  -6.59009  1.000 62.26592  ? 126  MET A SD    1 
ATOM   2002 C CE    . MET A 1 126 ? -25.64417 -6.07884  -5.36317  1.000 42.69259  ? 126  MET A CE    1 
ATOM   2003 H H     . MET A 1 126 ? -29.32302 -2.39993  -4.00292  1.000 49.54422  ? 126  MET A H     1 
ATOM   2004 H HA    . MET A 1 126 ? -28.16918 -4.52004  -2.97966  1.000 41.16079  ? 126  MET A HA    1 
ATOM   2005 H HB2   . MET A 1 126 ? -27.18424 -2.57205  -4.75853  1.000 40.64270  ? 126  MET A HB2   1 
ATOM   2006 H HB3   . MET A 1 126 ? -26.29479 -3.80882  -4.30607  1.000 40.64270  ? 126  MET A HB3   1 
ATOM   2007 H HG2   . MET A 1 126 ? -28.33866 -5.02753  -5.19935  1.000 50.03310  ? 126  MET A HG2   1 
ATOM   2008 H HG3   . MET A 1 126 ? -28.32256 -3.75692  -6.15366  1.000 50.03310  ? 126  MET A HG3   1 
ATOM   2009 H HE1   . MET A 1 126 ? -25.14736 -6.78062  -5.81216  1.000 51.33082  ? 126  MET A HE1   1 
ATOM   2010 H HE2   . MET A 1 126 ? -25.03532 -5.50356  -4.87403  1.000 51.33082  ? 126  MET A HE2   1 
ATOM   2011 H HE3   . MET A 1 126 ? -26.29127 -6.46891  -4.75489  1.000 51.33082  ? 126  MET A HE3   1 
ATOM   2012 N N     . GLN A 1 127 ? -27.14024 -1.69264  -1.86097  1.000 31.25756  ? 127  GLN A N     1 
ATOM   2013 C CA    . GLN A 1 127 ? -26.40800 -1.10302  -0.74705  1.000 31.55059  ? 127  GLN A CA    1 
ATOM   2014 C C     . GLN A 1 127 ? -26.94454 -1.61620  0.58143   1.000 39.37965  ? 127  GLN A C     1 
ATOM   2015 O O     . GLN A 1 127 ? -26.17586 -1.86945  1.51640   1.000 35.79993  ? 127  GLN A O     1 
ATOM   2016 C CB    . GLN A 1 127 ? -26.48699 0.42090   -0.81306  1.000 37.14985  ? 127  GLN A CB    1 
ATOM   2017 C CG    . GLN A 1 127 ? -25.65872 1.02941   -1.93723  1.000 53.18172  ? 127  GLN A CG    1 
ATOM   2018 C CD    . GLN A 1 127 ? -25.80575 2.53732   -2.02744  1.000 60.30108  ? 127  GLN A CD    1 
ATOM   2019 O OE1   . GLN A 1 127 ? -26.37320 3.17300   -1.13784  1.000 59.26500  ? 127  GLN A OE1   1 
ATOM   2020 N NE2   . GLN A 1 127 ? -25.29691 3.11730   -3.10975  1.000 62.12971  ? 127  GLN A NE2   1 
ATOM   2021 H H     . GLN A 1 127 ? -27.53126 -1.12837  -2.37894  1.000 37.60879  ? 127  GLN A H     1 
ATOM   2022 H HA    . GLN A 1 127 ? -25.47267 -1.35141  -0.81308  1.000 37.49081  ? 127  GLN A HA    1 
ATOM   2023 H HB2   . GLN A 1 127 ? -27.41138 0.67956   -0.95270  1.000 44.67953  ? 127  GLN A HB2   1 
ATOM   2024 H HB3   . GLN A 1 127 ? -26.16312 0.78661   0.02495   1.000 44.67953  ? 127  GLN A HB3   1 
ATOM   2025 H HG2   . GLN A 1 127 ? -24.72225 0.82834   -1.78397  1.000 63.91777  ? 127  GLN A HG2   1 
ATOM   2026 H HG3   . GLN A 1 127 ? -25.94567 0.64932   -2.78227  1.000 63.91777  ? 127  GLN A HG3   1 
ATOM   2027 H HE21  . GLN A 1 127 ? -24.91012 2.64014   -3.71168  1.000 74.65536  ? 127  GLN A HE21  1 
ATOM   2028 H HE22  . GLN A 1 127 ? -25.35447 3.96972   -3.20811  1.000 74.65536  ? 127  GLN A HE22  1 
ATOM   2029 N N     . LEU A 1 128 ? -28.26236 -1.79814  0.67523   1.000 37.80918  ? 128  LEU A N     1 
ATOM   2030 C CA    . LEU A 1 128 ? -28.85764 -2.27177  1.91897   1.000 35.30881  ? 128  LEU A CA    1 
ATOM   2031 C C     . LEU A 1 128 ? -28.47589 -3.71917  2.19262   1.000 43.65094  ? 128  LEU A C     1 
ATOM   2032 O O     . LEU A 1 128 ? -28.10343 -4.07174  3.31819   1.000 45.64858  ? 128  LEU A O     1 
ATOM   2033 C CB    . LEU A 1 128 ? -30.37468 -2.12117  1.85736   1.000 28.85085  ? 128  LEU A CB    1 
ATOM   2034 C CG    . LEU A 1 128 ? -30.87626 -0.68001  1.86296   1.000 32.68844  ? 128  LEU A CG    1 
ATOM   2035 C CD1   . LEU A 1 128 ? -32.34681 -0.64224  1.50944   1.000 35.90934  ? 128  LEU A CD1   1 
ATOM   2036 C CD2   . LEU A 1 128 ? -30.63760 -0.03608  3.21909   1.000 35.87525  ? 128  LEU A CD2   1 
ATOM   2037 H H     . LEU A 1 128 ? -28.82509 -1.65600  0.04062   1.000 45.47073  ? 128  LEU A H     1 
ATOM   2038 H HA    . LEU A 1 128 ? -28.52708 -1.72906  2.65184   1.000 42.47028  ? 128  LEU A HA    1 
ATOM   2039 H HB2   . LEU A 1 128 ? -30.69162 -2.53773  1.04070   1.000 34.72073  ? 128  LEU A HB2   1 
ATOM   2040 H HB3   . LEU A 1 128 ? -30.75903 -2.56735  2.62815   1.000 34.72073  ? 128  LEU A HB3   1 
ATOM   2041 H HG    . LEU A 1 128 ? -30.38718 -0.16813  1.19988   1.000 39.32584  ? 128  LEU A HG    1 
ATOM   2042 H HD11  . LEU A 1 128 ? -32.60773 0.27680   1.34150   1.000 43.19091  ? 128  LEU A HD11  1 
ATOM   2043 H HD12  . LEU A 1 128 ? -32.49444 -1.17848  0.71474   1.000 43.19091  ? 128  LEU A HD12  1 
ATOM   2044 H HD13  . LEU A 1 128 ? -32.85913 -1.00136  2.25068   1.000 43.19091  ? 128  LEU A HD13  1 
ATOM   2045 H HD21  . LEU A 1 128 ? -31.08747 0.82292   3.24437   1.000 43.15000  ? 128  LEU A HD21  1 
ATOM   2046 H HD22  . LEU A 1 128 ? -30.99270 -0.61592  3.91090   1.000 43.15000  ? 128  LEU A HD22  1 
ATOM   2047 H HD23  . LEU A 1 128 ? -29.68390 0.08609   3.34723   1.000 43.15000  ? 128  LEU A HD23  1 
ATOM   2048 N N     . VAL A 1 129 ? -28.57085 -4.57491  1.17278   1.000 32.66758  ? 129  VAL A N     1 
ATOM   2049 C CA    . VAL A 1 129 ? -28.21652 -5.97958  1.34582   1.000 32.74180  ? 129  VAL A CA    1 
ATOM   2050 C C     . VAL A 1 129 ? -26.76357 -6.10999  1.78337   1.000 42.27335  ? 129  VAL A C     1 
ATOM   2051 O O     . VAL A 1 129 ? -26.44219 -6.87508  2.70103   1.000 40.20279  ? 129  VAL A O     1 
ATOM   2052 C CB    . VAL A 1 129 ? -28.49241 -6.75876  0.04592   1.000 30.94317  ? 129  VAL A CB    1 
ATOM   2053 C CG1   . VAL A 1 129 ? -27.89244 -8.15559  0.11678   1.000 34.19014  ? 129  VAL A CG1   1 
ATOM   2054 C CG2   . VAL A 1 129 ? -29.98964 -6.82914  -0.22015  1.000 31.98925  ? 129  VAL A CG2   1 
ATOM   2055 H H     . VAL A 1 129 ? -28.83470 -4.36831  0.38076   1.000 39.30081  ? 129  VAL A H     1 
ATOM   2056 H HA    . VAL A 1 129 ? -28.77200 -6.35711  2.04568   1.000 39.38986  ? 129  VAL A HA    1 
ATOM   2057 H HB    . VAL A 1 129 ? -28.07297 -6.29233  -0.69395  1.000 37.23151  ? 129  VAL A HB    1 
ATOM   2058 H HG11  . VAL A 1 129 ? -28.29786 -8.70862  -0.56929  1.000 41.12787  ? 129  VAL A HG11  1 
ATOM   2059 H HG12  . VAL A 1 129 ? -26.93534 -8.09597  -0.02919  1.000 41.12787  ? 129  VAL A HG12  1 
ATOM   2060 H HG13  . VAL A 1 129 ? -28.07061 -8.53175  0.99295   1.000 41.12787  ? 129  VAL A HG13  1 
ATOM   2061 H HG21  . VAL A 1 129 ? -30.13889 -7.27240  -1.06994  1.000 38.48681  ? 129  VAL A HG21  1 
ATOM   2062 H HG22  . VAL A 1 129 ? -30.41398 -7.33064  0.49353   1.000 38.48681  ? 129  VAL A HG22  1 
ATOM   2063 H HG23  . VAL A 1 129 ? -30.34785 -5.92819  -0.24962  1.000 38.48681  ? 129  VAL A HG23  1 
ATOM   2064 N N     . ARG A 1 130 ? -25.86274 -5.36377  1.14014   1.000 40.96739  ? 130  ARG A N     1 
ATOM   2065 C CA    . ARG A 1 130 ? -24.45562 -5.43056  1.51789   1.000 42.34144  ? 130  ARG A CA    1 
ATOM   2066 C C     . ARG A 1 130 ? -24.23939 -4.88827  2.92514   1.000 38.92541  ? 130  ARG A C     1 
ATOM   2067 O O     . ARG A 1 130 ? -23.41717 -5.41653  3.68246   1.000 40.86170  ? 130  ARG A O     1 
ATOM   2068 C CB    . ARG A 1 130 ? -23.60231 -4.65461  0.51648   1.000 52.51938  ? 130  ARG A CB    1 
ATOM   2069 C CG    . ARG A 1 130 ? -23.52373 -5.26005  -0.87519  1.000 52.27922  ? 130  ARG A CG    1 
ATOM   2070 C CD    . ARG A 1 130 ? -22.41975 -4.57597  -1.66650  1.000 63.57789  ? 130  ARG A CD    1 
ATOM   2071 N NE    . ARG A 1 130 ? -22.18615 -5.18341  -2.97091  1.000 93.74586  ? 130  ARG A NE    1 
ATOM   2072 C CZ    . ARG A 1 130 ? -22.52384 -4.63530  -4.13154  1.000 91.37423  ? 130  ARG A CZ    1 
ATOM   2073 N NH1   . ARG A 1 130 ? -23.15357 -3.47162  -4.19209  1.000 74.39437  ? 130  ARG A NH1   1 
ATOM   2074 N NH2   . ARG A 1 130 ? -22.21351 -5.26695  -5.26048  1.000 71.62435  ? 130  ARG A NH2   1 
ATOM   2075 H H     . ARG A 1 130 ? -26.03859 -4.82265  0.49527   1.000 49.26058  ? 130  ARG A H     1 
ATOM   2076 H HA    . ARG A 1 130 ? -24.17332 -6.35839  1.49945   1.000 50.90944  ? 130  ARG A HA    1 
ATOM   2077 H HB2   . ARG A 1 130 ? -23.97369 -3.76330  0.42406   1.000 63.12297  ? 130  ARG A HB2   1 
ATOM   2078 H HB3   . ARG A 1 130 ? -22.69717 -4.60276  0.86134   1.000 63.12297  ? 130  ARG A HB3   1 
ATOM   2079 H HG2   . ARG A 1 130 ? -23.32218 -6.20669  -0.81087  1.000 62.83477  ? 130  ARG A HG2   1 
ATOM   2080 H HG3   . ARG A 1 130 ? -24.36646 -5.13096  -1.33782  1.000 62.83477  ? 130  ARG A HG3   1 
ATOM   2081 H HD2   . ARG A 1 130 ? -22.66401 -3.64819  -1.80958  1.000 76.39318  ? 130  ARG A HD2   1 
ATOM   2082 H HD3   . ARG A 1 130 ? -21.59298 -4.62732  -1.16181  1.000 76.39318  ? 130  ARG A HD3   1 
ATOM   2083 H HE    . ARG A 1 130 ? -21.80176 -5.95250  -2.98975  1.000 112.59474 ? 130  ARG A HE    1 
ATOM   2084 H HH11  . ARG A 1 130 ? -23.35327 -3.05258  -3.46812  1.000 89.37295  ? 130  ARG A HH11  1 
ATOM   2085 H HH12  . ARG A 1 130 ? -23.36273 -3.13509  -4.95537  1.000 89.37295  ? 130  ARG A HH12  1 
ATOM   2086 H HH21  . ARG A 1 130 ? -21.79950 -6.02020  -5.23194  1.000 86.04892  ? 130  ARG A HH21  1 
ATOM   2087 H HH22  . ARG A 1 130 ? -22.42690 -4.92204  -6.01883  1.000 86.04892  ? 130  ARG A HH22  1 
ATOM   2088 N N     . LYS A 1 131 ? -24.96582 -3.83002  3.28908   1.000 35.13863  ? 131  LYS A N     1 
ATOM   2089 C CA    . LYS A 1 131 ? -24.81099 -3.24791  4.61709   1.000 38.76646  ? 131  LYS A CA    1 
ATOM   2090 C C     . LYS A 1 131 ? -25.21108 -4.23122  5.70796   1.000 46.94548  ? 131  LYS A C     1 
ATOM   2091 O O     . LYS A 1 131 ? -24.61546 -4.22872  6.79244   1.000 44.29916  ? 131  LYS A O     1 
ATOM   2092 C CB    . LYS A 1 131 ? -25.64345 -1.97223  4.71797   1.000 43.43376  ? 131  LYS A CB    1 
ATOM   2093 C CG    . LYS A 1 131 ? -25.18089 -0.99852  5.78515   1.000 47.52564  ? 131  LYS A CG    1 
ATOM   2094 C CD    . LYS A 1 131 ? -25.83492 0.35495   5.57889   1.000 38.96204  ? 131  LYS A CD    1 
ATOM   2095 C CE    . LYS A 1 131 ? -25.66912 1.25113   6.78594   1.000 47.57508  ? 131  LYS A CE    1 
ATOM   2096 N NZ    . LYS A 1 131 ? -26.67264 2.34703   6.75674   1.000 59.74127  ? 131  LYS A NZ    1 
ATOM   2097 H H     . LYS A 1 131 ? -25.54675 -3.43687  2.79154   1.000 42.26607  ? 131  LYS A H     1 
ATOM   2098 H HA    . LYS A 1 131 ? -23.87969 -3.01445  4.75523   1.000 46.61946  ? 131  LYS A HA    1 
ATOM   2099 H HB2   . LYS A 1 131 ? -25.60591 -1.51120  3.86536   1.000 52.22022  ? 131  LYS A HB2   1 
ATOM   2100 H HB3   . LYS A 1 131 ? -26.55945 -2.21706  4.92269   1.000 52.22022  ? 131  LYS A HB3   1 
ATOM   2101 H HG2   . LYS A 1 131 ? -25.42905 -1.33273  6.66129   1.000 57.13047  ? 131  LYS A HG2   1 
ATOM   2102 H HG3   . LYS A 1 131 ? -24.21851 -0.88937  5.73207   1.000 57.13047  ? 131  LYS A HG3   1 
ATOM   2103 H HD2   . LYS A 1 131 ? -25.42684 0.79450   4.81655   1.000 46.85416  ? 131  LYS A HD2   1 
ATOM   2104 H HD3   . LYS A 1 131 ? -26.78398 0.23087   5.42145   1.000 46.85416  ? 131  LYS A HD3   1 
ATOM   2105 H HE2   . LYS A 1 131 ? -25.79876 0.73358   7.59602   1.000 57.18980  ? 131  LYS A HE2   1 
ATOM   2106 H HE3   . LYS A 1 131 ? -24.78184 1.64307   6.78108   1.000 57.18980  ? 131  LYS A HE3   1 
ATOM   2107 H HZ1   . LYS A 1 131 ? -26.27691 3.12666   6.92309   1.000 71.78923  ? 131  LYS A HZ1   1 
ATOM   2108 H HZ2   . LYS A 1 131 ? -27.05931 2.38443   5.95599   1.000 71.78923  ? 131  LYS A HZ2   1 
ATOM   2109 H HZ3   . LYS A 1 131 ? -27.29831 2.20335   7.37318   1.000 71.78923  ? 131  LYS A HZ3   1 
ATOM   2110 N N     . MET A 1 132 ? -26.21260 -5.07651  5.44210   1.000 44.79403  ? 132  MET A N     1 
ATOM   2111 C CA    . MET A 1 132 ? -26.63958 -6.09853  6.38944   1.000 34.81969  ? 132  MET A CA    1 
ATOM   2112 C C     . MET A 1 132 ? -25.69891 -7.29445  6.44419   1.000 40.98024  ? 132  MET A C     1 
ATOM   2113 O O     . MET A 1 132 ? -25.81390 -8.10752  7.36763   1.000 47.57268  ? 132  MET A O     1 
ATOM   2114 C CB    . MET A 1 132 ? -28.04565 -6.58690  6.03764   1.000 27.81983  ? 132  MET A CB    1 
ATOM   2115 C CG    . MET A 1 132 ? -29.15676 -5.66585  6.50679   1.000 33.23475  ? 132  MET A CG    1 
ATOM   2116 S SD    . MET A 1 132 ? -30.79903 -6.36808  6.24662   1.000 33.15754  ? 132  MET A SD    1 
ATOM   2117 C CE    . MET A 1 132 ? -30.96914 -6.16779  4.47565   1.000 35.12486  ? 132  MET A CE    1 
ATOM   2118 H H     . MET A 1 132 ? -26.66342 -5.07481  4.70973   1.000 53.85254  ? 132  MET A H     1 
ATOM   2119 H HA    . MET A 1 132 ? -26.67435 -5.69269  7.26978   1.000 41.88333  ? 132  MET A HA    1 
ATOM   2120 H HB2   . MET A 1 132 ? -28.11500 -6.66494  5.07328   1.000 33.48351  ? 132  MET A HB2   1 
ATOM   2121 H HB3   . MET A 1 132 ? -28.18618 -7.45284  6.45153   1.000 33.48351  ? 132  MET A HB3   1 
ATOM   2122 H HG2   . MET A 1 132 ? -29.04888 -5.49792  7.45604   1.000 39.98141  ? 132  MET A HG2   1 
ATOM   2123 H HG3   . MET A 1 132 ? -29.10536 -4.83171  6.01437   1.000 39.98141  ? 132  MET A HG3   1 
ATOM   2124 H HE1   . MET A 1 132 ? -31.83913 -6.49860  4.20255   1.000 42.24955  ? 132  MET A HE1   1 
ATOM   2125 H HE2   . MET A 1 132 ? -30.88899 -5.22660  4.25514   1.000 42.24955  ? 132  MET A HE2   1 
ATOM   2126 H HE3   . MET A 1 132 ? -30.26931 -6.67220  4.03213   1.000 42.24955  ? 132  MET A HE3   1 
ATOM   2127 N N     . MET A 1 133 ? -24.78710 -7.42879  5.48417   1.000 43.39158  ? 133  MET A N     1 
ATOM   2128 C CA    . MET A 1 133 ? -23.78603 -8.48545  5.49552   1.000 39.76838  ? 133  MET A CA    1 
ATOM   2129 C C     . MET A 1 133 ? -22.42743 -8.00288  5.98206   1.000 43.91410  ? 133  MET A C     1 
ATOM   2130 O O     . MET A 1 133 ? -21.51037 -8.81863  6.12215   1.000 62.42722  ? 133  MET A O     1 
ATOM   2131 C CB    . MET A 1 133 ? -23.64391 -9.08569  4.09597   1.000 38.23294  ? 133  MET A CB    1 
ATOM   2132 C CG    . MET A 1 133 ? -24.88258 -9.81001  3.61595   1.000 46.91736  ? 133  MET A CG    1 
ATOM   2133 S SD    . MET A 1 133 ? -24.64792 -10.57238 2.00163   1.000 44.14185  ? 133  MET A SD    1 
ATOM   2134 C CE    . MET A 1 133 ? -24.37446 -9.14011  0.96767   1.000 33.29599  ? 133  MET A CE    1 
ATOM   2135 H H     . MET A 1 133 ? -24.72890 -6.90782  4.80241   1.000 52.16960  ? 133  MET A H     1 
ATOM   2136 H HA    . MET A 1 133 ? -24.09169 -9.18973  6.08837   1.000 47.82176  ? 133  MET A HA    1 
ATOM   2137 H HB2   . MET A 1 133 ? -23.45634 -8.37097  3.46756   1.000 45.97924  ? 133  MET A HB2   1 
ATOM   2138 H HB3   . MET A 1 133 ? -22.91212 -9.72235  4.10239   1.000 45.97924  ? 133  MET A HB3   1 
ATOM   2139 H HG2   . MET A 1 133 ? -25.10745 -10.50898 4.24981   1.000 56.40055  ? 133  MET A HG2   1 
ATOM   2140 H HG3   . MET A 1 133 ? -25.61412 -9.17677  3.54702   1.000 56.40055  ? 133  MET A HG3   1 
ATOM   2141 H HE1   . MET A 1 133 ? -24.47512 -9.39790  0.03799   1.000 40.05489  ? 133  MET A HE1   1 
ATOM   2142 H HE2   . MET A 1 133 ? -25.02592 -8.45806  1.19420   1.000 40.05489  ? 133  MET A HE2   1 
ATOM   2143 H HE3   . MET A 1 133 ? -23.47741 -8.80525  1.12282   1.000 40.05489  ? 133  MET A HE3   1 
ATOM   2144 N N     . ASN A 1 134 ? -22.27817 -6.70544  6.23914   1.000 53.83992  ? 134  ASN A N     1 
ATOM   2145 C CA    . ASN A 1 134 ? -21.01618 -6.14083  6.70790   1.000 65.37194  ? 134  ASN A CA    1 
ATOM   2146 C C     . ASN A 1 134 ? -19.92920 -6.28541  5.64508   1.000 62.50836  ? 134  ASN A C     1 
ATOM   2147 O O     . ASN A 1 134 ? -19.97809 -5.63648  4.59840   1.000 61.06825  ? 134  ASN A O     1 
ATOM   2148 C CB    . ASN A 1 134 ? -20.58085 -6.81789  8.00876   1.000 72.47931  ? 134  ASN A CB    1 
ATOM   2149 C CG    . ASN A 1 134 ? -19.49838 -6.04597  8.73472   1.000 82.26996  ? 134  ASN A CG    1 
ATOM   2150 O OD1   . ASN A 1 134 ? -19.44307 -4.81726  8.67014   1.000 80.21477  ? 134  ASN A OD1   1 
ATOM   2151 N ND2   . ASN A 1 134 ? -18.62961 -6.76560  9.43473   1.000 90.73980  ? 134  ASN A ND2   1 
ATOM   2152 H H     . ASN A 1 134 ? -22.90334 -6.12190  6.14837   1.000 64.70761  ? 134  ASN A H     1 
ATOM   2153 H HA    . ASN A 1 134 ? -21.13500 -5.19520  6.88838   1.000 78.54604  ? 134  ASN A HA    1 
ATOM   2154 H HB2   . ASN A 1 134 ? -21.34657 -6.88940  8.59991   1.000 87.07488  ? 134  ASN A HB2   1 
ATOM   2155 H HB3   . ASN A 1 134 ? -20.23502 -7.70105  7.80550   1.000 87.07488  ? 134  ASN A HB3   1 
ATOM   2156 H HD21  . ASN A 1 134 ? -17.99578 -6.37501  9.86519   1.000 108.98747 ? 134  ASN A HD21  1 
ATOM   2157 H HD22  . ASN A 1 134 ? -18.70069 -7.62235  9.45771   1.000 108.98747 ? 134  ASN A HD22  1 
HETATM 2158 C "C1'" . PHB B 2 .   ? -27.89129 -16.46738 -7.71514  1.000 23.09475  ? 1001 PHB A "C1'" 1 
HETATM 2159 O "O1'" . PHB B 2 .   ? -26.72183 -16.84663 -7.50109  1.000 18.40814  ? 1001 PHB A "O1'" 1 
HETATM 2160 O "O2'" . PHB B 2 .   ? -28.90409 -16.74831 -7.03900  1.000 20.68138  ? 1001 PHB A "O2'" 1 
HETATM 2161 C C1    . PHB B 2 .   ? -28.09298 -15.55595 -8.91285  1.000 20.73084  ? 1001 PHB A C1    1 
HETATM 2162 C C2    . PHB B 2 .   ? -27.04366 -15.29189 -9.79086  1.000 27.79901  ? 1001 PHB A C2    1 
HETATM 2163 C C3    . PHB B 2 .   ? -27.20432 -14.45708 -10.88515 1.000 21.40208  ? 1001 PHB A C3    1 
HETATM 2164 C C4    . PHB B 2 .   ? -28.43621 -13.86115 -11.12158 1.000 19.92203  ? 1001 PHB A C4    1 
HETATM 2165 C C5    . PHB B 2 .   ? -29.49974 -14.10690 -10.25496 1.000 25.67411  ? 1001 PHB A C5    1 
HETATM 2166 C C6    . PHB B 2 .   ? -29.32082 -14.94719 -9.16455  1.000 28.07960  ? 1001 PHB A C6    1 
HETATM 2167 O O4    . PHB B 2 .   ? -28.55911 -13.05013 -12.20140 1.000 30.08902  ? 1001 PHB A O4    1 
HETATM 2168 H H2    . PHB B 2 .   ? -26.21530 -15.68604 -9.63801  1.000 33.45852  ? 1001 PHB A H2    1 
HETATM 2169 H H3    . PHB B 2 .   ? -26.49503 -14.29160 -11.46345 1.000 25.78221  ? 1001 PHB A H3    1 
HETATM 2170 H H5    . PHB B 2 .   ? -30.32623 -13.70875 -10.40757 1.000 30.90864  ? 1001 PHB A H5    1 
HETATM 2171 H H6    . PHB B 2 .   ? -30.03407 -15.10781 -8.58977  1.000 33.79522  ? 1001 PHB A H6    1 
HETATM 2172 H HO4   . PHB B 2 .   ? -28.91982 -13.47288 -12.84504 1.000 36.20653  ? 1001 PHB A HO4   1 
HETATM 2173 C C1    . PEG C 3 .   ? -22.77772 -29.61481 -27.27432 1.000 56.46007  ? 1002 PEG A C1    1 
HETATM 2174 O O1    . PEG C 3 .   ? -23.64575 -30.71840 -27.19830 1.000 55.95187  ? 1002 PEG A O1    1 
HETATM 2175 C C2    . PEG C 3 .   ? -21.37908 -30.05861 -27.62771 1.000 46.65563  ? 1002 PEG A C2    1 
HETATM 2176 O O2    . PEG C 3 .   ? -20.94085 -29.39448 -28.79029 1.000 58.71384  ? 1002 PEG A O2    1 
HETATM 2177 C C3    . PEG C 3 .   ? -19.55871 -29.50836 -29.00555 1.000 48.45727  ? 1002 PEG A C3    1 
HETATM 2178 C C4    . PEG C 3 .   ? -19.16233 -28.82026 -30.28766 1.000 47.79679  ? 1002 PEG A C4    1 
HETATM 2179 O O4    . PEG C 3 .   ? -19.80338 -27.56440 -30.39250 1.000 51.83692  ? 1002 PEG A O4    1 
HETATM 2180 H H11   . PEG C 3 .   ? -22.74806 -29.13812 -26.43005 1.000 67.85180  ? 1002 PEG A H11   1 
HETATM 2181 H H12   . PEG C 3 .   ? -23.08048 -28.98088 -27.94317 1.000 67.85180  ? 1002 PEG A H12   1 
HETATM 2182 H HO1   . PEG C 3 .   ? -24.44308 -30.42216 -27.22054 1.000 67.24195  ? 1002 PEG A HO1   1 
HETATM 2183 H H21   . PEG C 3 .   ? -21.38211 -31.02102 -27.74878 1.000 56.08647  ? 1002 PEG A H21   1 
HETATM 2184 H H22   . PEG C 3 .   ? -20.79730 -29.87486 -26.87360 1.000 56.08647  ? 1002 PEG A H22   1 
HETATM 2185 H H31   . PEG C 3 .   ? -19.29952 -30.44214 -29.04771 1.000 58.24843  ? 1002 PEG A H31   1 
HETATM 2186 H H32   . PEG C 3 .   ? -19.06853 -29.11751 -28.26537 1.000 58.24843  ? 1002 PEG A H32   1 
HETATM 2187 H H41   . PEG C 3 .   ? -18.19554 -28.74142 -30.28689 1.000 57.45586  ? 1002 PEG A H41   1 
HETATM 2188 H H42   . PEG C 3 .   ? -19.39410 -29.41432 -31.01859 1.000 57.45586  ? 1002 PEG A H42   1 
HETATM 2189 H HO4   . PEG C 3 .   ? -19.55986 -27.19962 -31.12032 1.000 62.30401  ? 1002 PEG A HO4   1 
HETATM 2190 C C1    . PEG D 3 .   ? -49.52219 -13.95407 11.45829  1.000 59.09248  ? 1003 PEG A C1    1 
HETATM 2191 O O1    . PEG D 3 .   ? -49.21769 -14.06548 10.08711  1.000 56.73470  ? 1003 PEG A O1    1 
HETATM 2192 C C2    . PEG D 3 .   ? -48.32453 -14.35903 12.28388  1.000 62.70655  ? 1003 PEG A C2    1 
HETATM 2193 O O2    . PEG D 3 .   ? -48.03426 -13.37613 13.25678  1.000 60.42793  ? 1003 PEG A O2    1 
HETATM 2194 C C3    . PEG D 3 .   ? -46.66303 -13.23889 13.52709  1.000 52.52335  ? 1003 PEG A C3    1 
HETATM 2195 C C4    . PEG D 3 .   ? -46.39761 -11.92437 14.21613  1.000 62.40055  ? 1003 PEG A C4    1 
HETATM 2196 O O4    . PEG D 3 .   ? -45.43698 -11.17648 13.49393  1.000 47.50207  ? 1003 PEG A O4    1 
HETATM 2197 H H11   . PEG D 3 .   ? -49.77035 -13.04519 11.68906  1.000 71.01069  ? 1003 PEG A H11   1 
HETATM 2198 H H12   . PEG D 3 .   ? -50.27400 -14.51864 11.69694  1.000 71.01069  ? 1003 PEG A H12   1 
HETATM 2199 H HO1   . PEG D 3 .   ? -49.88206 -13.76621 9.64778   1.000 68.18135  ? 1003 PEG A HO1   1 
HETATM 2200 H H21   . PEG D 3 .   ? -48.51276 -15.21721 12.69498  1.000 75.34757  ? 1003 PEG A H21   1 
HETATM 2201 H H22   . PEG D 3 .   ? -47.57318 -14.49580 11.68583  1.000 75.34757  ? 1003 PEG A H22   1 
HETATM 2202 H H31   . PEG D 3 .   ? -46.14918 -13.28364 12.70560  1.000 63.12772  ? 1003 PEG A H31   1 
HETATM 2203 H H32   . PEG D 3 .   ? -46.35331 -13.96708 14.08809  1.000 63.12772  ? 1003 PEG A H32   1 
HETATM 2204 H H41   . PEG D 3 .   ? -47.24585 -11.45995 14.29166  1.000 74.98037  ? 1003 PEG A H41   1 
HETATM 2205 H H42   . PEG D 3 .   ? -46.10641 -12.12400 15.11959  1.000 74.98037  ? 1003 PEG A H42   1 
HETATM 2206 H HO4   . PEG D 3 .   ? -45.15750 -10.54821 13.99403  1.000 57.10219  ? 1003 PEG A HO4   1 
HETATM 2207 O O     . HOH E 4 .   ? -37.66106 -19.94255 -20.09672 1.000 36.49758  ? 1101 HOH A O     1 
HETATM 2208 O O     . HOH E 4 .   ? -21.03208 -26.43850 -32.05204 1.000 34.69729  ? 1102 HOH A O     1 
HETATM 2209 O O     . HOH E 4 .   ? -30.81456 -15.72087 -5.95552  1.000 24.64297  ? 1103 HOH A O     1 
HETATM 2210 O O     . HOH E 4 .   ? -42.59641 -18.55006 -19.61142 1.000 41.50810  ? 1104 HOH A O     1 
HETATM 2211 O O     . HOH E 4 .   ? -23.95016 -29.01636 3.94974   1.000 32.49959  ? 1105 HOH A O     1 
HETATM 2212 O O     . HOH E 4 .   ? -28.28434 -13.90886 -14.84706 1.000 30.58582  ? 1106 HOH A O     1 
HETATM 2213 O O     . HOH E 4 .   ? -14.57217 -16.98050 -11.36418 1.000 43.08605  ? 1107 HOH A O     1 
HETATM 2214 O O     . HOH E 4 .   ? -40.79341 -25.47335 -16.96648 1.000 27.58468  ? 1108 HOH A O     1 
HETATM 2215 O O     . HOH E 4 .   ? -10.610   -37.295   2.895     1.000 38.73593  ? 1109 HOH A O     1 
HETATM 2216 O O     . HOH E 4 .   ? -16.29737 -30.22455 -24.09087 1.000 45.86211  ? 1110 HOH A O     1 
HETATM 2217 O O     . HOH E 4 .   ? -17.23998 -33.97047 -6.12953  1.000 43.29049  ? 1111 HOH A O     1 
HETATM 2218 O O     . HOH E 4 .   ? -13.71480 -36.75761 -9.27616  1.000 49.12660  ? 1112 HOH A O     1 
HETATM 2219 O O     . HOH E 4 .   ? -15.01112 -20.81809 -20.00985 1.000 41.83397  ? 1113 HOH A O     1 
HETATM 2220 O O     . HOH E 4 .   ? -23.97382 -26.37945 -31.91038 1.000 43.65187  ? 1114 HOH A O     1 
HETATM 2221 O O     . HOH E 4 .   ? -26.28094 -29.90031 -27.47481 1.000 49.13007  ? 1115 HOH A O     1 
HETATM 2222 O O     . HOH E 4 .   ? -32.65113 -11.06037 -21.02638 1.000 40.75422  ? 1116 HOH A O     1 
HETATM 2223 O O     . HOH E 4 .   ? -29.68135 -9.90729  -14.06401 1.000 40.52190  ? 1117 HOH A O     1 
HETATM 2224 O O     . HOH E 4 .   ? -32.50320 -22.20773 -7.88859  1.000 26.41653  ? 1118 HOH A O     1 
HETATM 2225 O O     . HOH E 4 .   ? -32.17124 -18.75751 -24.15160 1.000 29.29806  ? 1119 HOH A O     1 
HETATM 2226 O O     . HOH E 4 .   ? -33.27616 -25.80138 -17.89236 1.000 30.69790  ? 1120 HOH A O     1 
HETATM 2227 O O     . HOH E 4 .   ? -38.386   -7.174    10.729    1.000 34.25609  ? 1121 HOH A O     1 
HETATM 2228 O O     . HOH E 4 .   ? -28.52659 -26.75810 -6.80467  1.000 30.37915  ? 1122 HOH A O     1 
HETATM 2229 O O     . HOH E 4 .   ? -38.76358 3.12298   -2.60834  1.000 36.83008  ? 1123 HOH A O     1 
HETATM 2230 O O     . HOH E 4 .   ? -20.92733 -36.23711 -3.65725  1.000 37.54451  ? 1124 HOH A O     1 
HETATM 2231 O O     . HOH E 4 .   ? -29.94417 -9.80651  -10.17384 1.000 28.35724  ? 1125 HOH A O     1 
HETATM 2232 O O     . HOH E 4 .   ? -38.32125 -9.65202  -18.04727 1.000 40.55606  ? 1126 HOH A O     1 
HETATM 2233 O O     . HOH E 4 .   ? -43.88018 -19.37062 -12.57601 1.000 39.64785  ? 1127 HOH A O     1 
HETATM 2234 O O     . HOH E 4 .   ? -14.40244 -22.86286 -18.23608 1.000 40.37266  ? 1128 HOH A O     1 
HETATM 2235 O O     . HOH E 4 .   ? -34.27986 -24.69556 -11.36313 1.000 29.94808  ? 1129 HOH A O     1 
HETATM 2236 O O     . HOH E 4 .   ? -25.53215 -10.66646 -17.37210 1.000 21.47108  ? 1130 HOH A O     1 
HETATM 2237 O O     . HOH E 4 .   ? -25.36479 -25.58841 1.32019   1.000 32.68463  ? 1131 HOH A O     1 
HETATM 2238 O O     . HOH E 4 .   ? -13.09682 -27.71873 -21.75396 1.000 45.47339  ? 1132 HOH A O     1 
HETATM 2239 O O     . HOH E 4 .   ? -38.47726 -21.20635 1.76806   1.000 34.45312  ? 1133 HOH A O     1 
HETATM 2240 O O     . HOH E 4 .   ? -47.27740 -14.30037 5.19017   1.000 42.30742  ? 1134 HOH A O     1 
HETATM 2241 O O     . HOH E 4 .   ? -19.83805 -15.71664 -16.87641 1.000 39.91388  ? 1135 HOH A O     1 
HETATM 2242 O O     . HOH E 4 .   ? -42.22231 -23.49025 -10.63616 1.000 47.50551  ? 1136 HOH A O     1 
HETATM 2243 O O     . HOH E 4 .   ? -25.615   -38.604   -1.515    1.000 42.38565  ? 1137 HOH A O     1 
HETATM 2244 O O     . HOH E 4 .   ? -21.21115 -34.60428 -1.18466  1.000 45.75245  ? 1138 HOH A O     1 
HETATM 2245 O O     . HOH E 4 .   ? -10.33020 -27.82458 -4.25311  1.000 35.94604  ? 1139 HOH A O     1 
HETATM 2246 O O     . HOH E 4 .   ? -27.39793 -27.77552 -25.83960 1.000 50.23257  ? 1140 HOH A O     1 
HETATM 2247 O O     . HOH E 4 .   ? -35.62259 -24.93320 -7.50384  1.000 35.50683  ? 1141 HOH A O     1 
HETATM 2248 O O     . HOH E 4 .   ? -27.209   -23.449   -1.422    1.000 44.55841  ? 1142 HOH A O     1 
HETATM 2249 O O     . HOH E 4 .   ? -44.04523 -17.36630 -18.72455 1.000 41.35225  ? 1143 HOH A O     1 
HETATM 2250 O O     . HOH E 4 .   ? -34.68428 -22.94889 -9.05475  1.000 31.91865  ? 1144 HOH A O     1 
HETATM 2251 O O     . HOH E 4 .   ? -20.09634 -19.66526 1.50903   1.000 43.52104  ? 1145 HOH A O     1 
HETATM 2252 O O     . HOH E 4 .   ? -43.84527 -16.73649 -8.90793  1.000 41.94897  ? 1146 HOH A O     1 
HETATM 2253 O O     . HOH E 4 .   ? -20.23995 -15.28834 -19.42331 1.000 44.51970  ? 1147 HOH A O     1 
HETATM 2254 O O     . HOH E 4 .   ? -30.54855 -23.80918 -20.87774 1.000 31.09425  ? 1148 HOH A O     1 
HETATM 2255 O O     . HOH E 4 .   ? -32.01733 -21.58395 -4.52115  1.000 40.06306  ? 1149 HOH A O     1 
HETATM 2256 O O     . HOH E 4 .   ? -44.43403 -19.63565 -10.44941 1.000 43.25198  ? 1150 HOH A O     1 
HETATM 2257 O O     . HOH E 4 .   ? -31.02326 -25.32978 -19.07103 1.000 35.37939  ? 1151 HOH A O     1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N N   . ALA A 2   ? 0.64732 0.56178 0.62420 0.15342  0.07355  -0.09849 2   ALA A N   
2    C CA  . ALA A 2   ? 0.69130 0.64212 0.70021 0.14252  0.06944  -0.09739 2   ALA A CA  
3    C C   . ALA A 2   ? 0.71663 0.63094 0.70646 0.13228  0.05304  -0.07662 2   ALA A C   
4    O O   . ALA A 2   ? 0.60971 0.47915 0.56796 0.13812  0.04150  -0.06566 2   ALA A O   
5    C CB  . ALA A 2   ? 0.67281 0.67421 0.71884 0.16749  0.06032  -0.11179 2   ALA A CB  
10   N N   . LEU A 3   ? 0.73887 0.67362 0.74775 0.11530  0.05380  -0.07324 3   LEU A N   
11   C CA  . LEU A 3   ? 0.64632 0.55132 0.63969 0.10562  0.04047  -0.05500 3   LEU A CA  
12   C C   . LEU A 3   ? 0.65447 0.54869 0.64549 0.12435  0.01858  -0.04978 3   LEU A C   
13   O O   . LEU A 3   ? 0.71408 0.57313 0.68216 0.11939  0.00750  -0.03549 3   LEU A O   
14   C CB  . LEU A 3   ? 0.63196 0.55879 0.64478 0.08520  0.04834  -0.05467 3   LEU A CB  
15   C CG  . LEU A 3   ? 0.46742 0.37313 0.45973 0.06322  0.06765  -0.04886 3   LEU A CG  
16   C CD1 . LEU A 3   ? 0.48704 0.41822 0.50058 0.04319  0.08385  -0.05696 3   LEU A CD1 
17   C CD2 . LEU A 3   ? 0.60624 0.46825 0.56576 0.06009  0.05699  -0.02846 3   LEU A CD2 
29   N N   . ARG A 4   ? 0.59594 0.52025 0.60793 0.14666  0.01266  -0.06164 4   ARG A N   
30   C CA  . ARG A 4   ? 0.66561 0.57130 0.66626 0.16742  -0.00695 -0.05543 4   ARG A CA  
31   C C   . ARG A 4   ? 0.70933 0.55450 0.66649 0.17478  -0.01120 -0.04680 4   ARG A C   
32   O O   . ARG A 4   ? 0.73069 0.54247 0.66588 0.18258  -0.02446 -0.03764 4   ARG A O   
33   C CB  . ARG A 4   ? 0.82230 0.77177 0.84832 0.19671  -0.01277 -0.07036 4   ARG A CB  
34   C CG  . ARG A 4   ? 0.93015 0.88567 0.95463 0.21843  -0.00363 -0.08382 4   ARG A CG  
35   C CD  . ARG A 4   ? 0.99512 0.97775 1.03075 0.25869  -0.01611 -0.09385 4   ARG A CD  
36   N NE  . ARG A 4   ? 1.11433 1.16852 1.19407 0.25929  -0.02206 -0.10499 4   ARG A NE  
37   C CZ  . ARG A 4   ? 0.98748 1.11603 1.11132 0.25969  -0.01161 -0.12726 4   ARG A CZ  
38   N NH1 . ARG A 4   ? 1.02958 1.17114 1.16013 0.26150  0.00611  -0.14027 4   ARG A NH1 
39   N NH2 . ARG A 4   ? 0.94643 1.14023 1.10832 0.25600  -0.01796 -0.13867 4   ARG A NH2 
53   N N   . ASN A 5   ? 0.66993 0.49872 0.61131 0.17044  0.00128  -0.05086 5   ASN A N   
54   C CA  . ASN A 5   ? 0.57770 0.35053 0.47649 0.17329  -0.00016 -0.04648 5   ASN A CA  
55   C C   . ASN A 5   ? 0.62612 0.37094 0.50213 0.14626  -0.00185 -0.03436 5   ASN A C   
56   O O   . ASN A 5   ? 0.58919 0.29205 0.43005 0.14203  -0.00249 -0.03283 5   ASN A O   
57   C CB  . ASN A 5   ? 0.66146 0.43290 0.55292 0.18313  0.01419  -0.05940 5   ASN A CB  
58   C CG  . ASN A 5   ? 0.85383 0.66413 0.77264 0.21262  0.01665  -0.07434 5   ASN A CG  
59   O OD1 . ASN A 5   ? 0.83172 0.63333 0.74594 0.23929  0.00494  -0.07439 5   ASN A OD1 
60   N ND2 . ASN A 5   ? 0.83268 0.68777 0.77859 0.20870  0.03238  -0.08776 5   ASN A ND2 
67   N N   . LYS A 6   ? 0.59631 0.36448 0.49033 0.12854  -0.00207 -0.02731 6   LYS A N   
68   C CA  . LYS A 6   ? 0.54555 0.29579 0.42134 0.10812  -0.00574 -0.01612 6   LYS A CA  
69   C C   . LYS A 6   ? 0.60030 0.34049 0.47497 0.10528  -0.01979 -0.00734 6   LYS A C   
70   O O   . LYS A 6   ? 0.51938 0.28270 0.41835 0.10801  -0.02390 -0.00539 6   LYS A O   
71   C CB  . LYS A 6   ? 0.55673 0.33001 0.44519 0.09422  0.00371  -0.01258 6   LYS A CB  
72   C CG  . LYS A 6   ? 0.56690 0.34126 0.44537 0.09210  0.01962  -0.01937 6   LYS A CG  
73   C CD  . LYS A 6   ? 0.58141 0.32628 0.42276 0.08599  0.01766  -0.01662 6   LYS A CD  
74   C CE  . LYS A 6   ? 0.66867 0.41216 0.49559 0.08471  0.03389  -0.02375 6   LYS A CE  
75   N NZ  . LYS A 6   ? 0.84808 0.56550 0.63712 0.07915  0.03091  -0.02377 6   LYS A NZ  
89   N N   . ALA A 7   ? 0.57512 0.28174 0.42031 0.09735  -0.02572 -0.00384 7   ALA A N   
90   C CA  . ALA A 7   ? 0.49428 0.18718 0.33352 0.09227  -0.03624 0.00296  7   ALA A CA  
91   C C   . ALA A 7   ? 0.52851 0.25055 0.39105 0.08139  -0.03993 0.01091  7   ALA A C   
92   O O   . ALA A 7   ? 0.49116 0.21822 0.36428 0.08376  -0.04639 0.01472  7   ALA A O   
93   C CB  . ALA A 7   ? 0.62709 0.28378 0.43090 0.07778  -0.03799 0.00231  7   ALA A CB  
99   N N   . PHE A 8   ? 0.44729 0.18517 0.31364 0.07118  -0.03556 0.01373  8   PHE A N   
100  C CA  . PHE A 8   ? 0.57112 0.32913 0.45356 0.06364  -0.03774 0.02157  8   PHE A CA  
101  C C   . PHE A 8   ? 0.44874 0.22938 0.35804 0.06857  -0.03115 0.02051  8   PHE A C   
102  O O   . PHE A 8   ? 0.36845 0.16046 0.29074 0.06364  -0.03261 0.02556  8   PHE A O   
103  C CB  . PHE A 8   ? 0.46847 0.23114 0.33866 0.05542  -0.03640 0.02597  8   PHE A CB  
104  C CG  . PHE A 8   ? 0.55090 0.30925 0.40585 0.04500  -0.04584 0.02668  8   PHE A CG  
105  C CD1 . PHE A 8   ? 0.51454 0.28467 0.37960 0.03926  -0.05234 0.03156  8   PHE A CD1 
106  C CD2 . PHE A 8   ? 0.57538 0.32021 0.40619 0.03875  -0.04680 0.02001  8   PHE A CD2 
107  C CE1 . PHE A 8   ? 0.54905 0.32261 0.40333 0.02681  -0.05920 0.02905  8   PHE A CE1 
108  C CE2 . PHE A 8   ? 0.52666 0.27335 0.34509 0.02439  -0.05389 0.01689  8   PHE A CE2 
109  C CZ  . PHE A 8   ? 0.53245 0.29599 0.36412 0.01808  -0.05989 0.02103  8   PHE A CZ  
119  N N   . HIS A 9   ? 0.42388 0.21336 0.34208 0.07671  -0.02276 0.01195  9   HIS A N   
120  C CA  . HIS A 9   ? 0.48098 0.29879 0.42763 0.07813  -0.01649 0.00641  9   HIS A CA  
121  C C   . HIS A 9   ? 0.37031 0.19749 0.32999 0.08740  -0.02810 0.00420  9   HIS A C   
122  O O   . HIS A 9   ? 0.35283 0.19650 0.32892 0.08190  -0.03005 0.00538  9   HIS A O   
123  C CB  . HIS A 9   ? 0.44161 0.27521 0.39740 0.08286  -0.00315 -0.00531 9   HIS A CB  
124  C CG  . HIS A 9   ? 0.40592 0.27676 0.39354 0.08025  0.00486  -0.01551 9   HIS A CG  
125  N ND1 . HIS A 9   ? 0.44740 0.32537 0.44172 0.06326  0.01813  -0.01476 9   HIS A ND1 
126  C CD2 . HIS A 9   ? 0.39357 0.29787 0.40651 0.09208  0.00165  -0.02819 9   HIS A CD2 
127  C CE1 . HIS A 9   ? 0.39943 0.31477 0.42332 0.05990  0.02432  -0.02839 9   HIS A CE1 
128  N NE2 . HIS A 9   ? 0.43394 0.37146 0.47221 0.07830  0.01308  -0.03716 9   HIS A NE2 
136  N N   . GLN A 10  ? 0.42717 0.23980 0.37480 0.10273  -0.03536 0.00103  10  GLN A N   
137  C CA  . GLN A 10  ? 0.46752 0.27987 0.41647 0.11514  -0.04763 0.00146  10  GLN A CA  
138  C C   . GLN A 10  ? 0.42049 0.21813 0.36028 0.10222  -0.05508 0.01212  10  GLN A C   
139  O O   . GLN A 10  ? 0.45617 0.26460 0.40432 0.10581  -0.06260 0.01298  10  GLN A O   
140  C CB  . GLN A 10  ? 0.49139 0.27262 0.41451 0.13490  -0.05255 -0.00059 10  GLN A CB  
141  C CG  . GLN A 10  ? 0.59484 0.39623 0.52993 0.15441  -0.04647 -0.01321 10  GLN A CG  
142  C CD  . GLN A 10  ? 0.71638 0.57278 0.68900 0.16530  -0.04851 -0.02344 10  GLN A CD  
143  O OE1 . GLN A 10  ? 0.83636 0.73226 0.83764 0.15506  -0.03718 -0.03267 10  GLN A OE1 
144  N NE2 . GLN A 10  ? 0.79836 0.65750 0.76810 0.18499  -0.06220 -0.02289 10  GLN A NE2 
153  N N   . LEU A 11  ? 0.44316 0.22105 0.36646 0.08745  -0.05319 0.01885  11  LEU A N   
154  C CA  . LEU A 11  ? 0.37946 0.15097 0.29778 0.07484  -0.05866 0.02672  11  LEU A CA  
155  C C   . LEU A 11  ? 0.41886 0.21833 0.36226 0.06849  -0.05580 0.02813  11  LEU A C   
156  O O   . LEU A 11  ? 0.44945 0.25203 0.39672 0.06575  -0.06134 0.03080  11  LEU A O   
157  C CB  . LEU A 11  ? 0.48770 0.24498 0.38790 0.06157  -0.05743 0.03020  11  LEU A CB  
158  C CG  . LEU A 11  ? 0.46667 0.22332 0.36300 0.04835  -0.06227 0.03556  11  LEU A CG  
159  C CD1 . LEU A 11  ? 0.66507 0.39982 0.54559 0.04853  -0.06691 0.03557  11  LEU A CD1 
160  C CD2 . LEU A 11  ? 0.48679 0.24324 0.37018 0.03618  -0.06201 0.03539  11  LEU A CD2 
172  N N   . ARG A 12  ? 0.38683 0.20158 0.34264 0.06493  -0.04530 0.02602  12  ARG A N   
173  C CA  . ARG A 12  ? 0.39218 0.22475 0.36608 0.05748  -0.03893 0.02587  12  ARG A CA  
174  C C   . ARG A 12  ? 0.38176 0.23831 0.37629 0.06184  -0.04135 0.01683  12  ARG A C   
175  O O   . ARG A 12  ? 0.36411 0.23138 0.36920 0.05483  -0.04137 0.01633  12  ARG A O   
176  C CB  . ARG A 12  ? 0.37691 0.21064 0.35079 0.05209  -0.02388 0.02530  12  ARG A CB  
177  C CG  . ARG A 12  ? 0.41477 0.25166 0.39593 0.04235  -0.01376 0.02681  12  ARG A CG  
178  C CD  . ARG A 12  ? 0.38611 0.20601 0.35038 0.03896  0.00062  0.03191  12  ARG A CD  
179  N NE  . ARG A 12  ? 0.40557 0.22999 0.37075 0.03730  0.01285  0.02375  12  ARG A NE  
180  C CZ  . ARG A 12  ? 0.39102 0.22671 0.36865 0.02685  0.02906  0.01360  12  ARG A CZ  
181  N NH1 . ARG A 12  ? 0.49115 0.33244 0.48001 0.01650  0.03478  0.00994  12  ARG A NH1 
182  N NH2 . ARG A 12  ? 0.36974 0.21231 0.34798 0.02447  0.04142  0.00499  12  ARG A NH2 
196  N N   . GLN A 13  ? 0.35565 0.22372 0.35573 0.07474  -0.04375 0.00833  13  GLN A N   
197  C CA  . GLN A 13  ? 0.39360 0.29299 0.41340 0.08340  -0.04971 -0.00175 13  GLN A CA  
198  C C   . GLN A 13  ? 0.39492 0.28294 0.40336 0.08766  -0.06401 0.00475  13  GLN A C   
199  O O   . GLN A 13  ? 0.46359 0.37379 0.48592 0.08296  -0.06677 0.00058  13  GLN A O   
200  C CB  . GLN A 13  ? 0.41496 0.32813 0.43904 0.10333  -0.05200 -0.01134 13  GLN A CB  
201  C CG  . GLN A 13  ? 0.53385 0.46102 0.56894 0.09865  -0.03602 -0.01993 13  GLN A CG  
202  C CD  . GLN A 13  ? 0.57109 0.55051 0.64072 0.09260  -0.02666 -0.03726 13  GLN A CD  
203  O OE1 . GLN A 13  ? 0.64778 0.64913 0.73273 0.08246  -0.02808 -0.04141 13  GLN A OE1 
204  N NE2 . GLN A 13  ? 0.66195 0.66360 0.74385 0.09670  -0.01566 -0.04961 13  GLN A NE2 
213  N N   . LEU A 14  ? 0.47533 0.32637 0.45509 0.09408  -0.07151 0.01394  14  LEU A N   
214  C CA  . LEU A 14  ? 0.44737 0.27981 0.40889 0.09589  -0.08222 0.02067  14  LEU A CA  
215  C C   . LEU A 14  ? 0.44175 0.27728 0.40923 0.07661  -0.07898 0.02548  14  LEU A C   
216  O O   . LEU A 14  ? 0.43541 0.28178 0.40677 0.07525  -0.08415 0.02456  14  LEU A O   
217  C CB  . LEU A 14  ? 0.42575 0.21345 0.35141 0.09902  -0.08459 0.02781  14  LEU A CB  
218  C CG  . LEU A 14  ? 0.53743 0.30807 0.44072 0.09133  -0.08671 0.03349  14  LEU A CG  
219  C CD1 . LEU A 14  ? 0.56463 0.34263 0.46293 0.11011  -0.09627 0.03145  14  LEU A CD1 
220  C CD2 . LEU A 14  ? 0.43899 0.17595 0.31231 0.08311  -0.08058 0.03594  14  LEU A CD2 
232  N N   . PHE A 15  ? 0.37527 0.20212 0.34165 0.06374  -0.07077 0.03015  15  PHE A N   
233  C CA  . PHE A 15  ? 0.36673 0.19569 0.33706 0.05008  -0.06723 0.03466  15  PHE A CA  
234  C C   . PHE A 15  ? 0.44799 0.30157 0.43999 0.04540  -0.06194 0.02839  15  PHE A C   
235  O O   . PHE A 15  ? 0.34678 0.20207 0.33980 0.03834  -0.06256 0.02959  15  PHE A O   
236  C CB  . PHE A 15  ? 0.38534 0.20772 0.35170 0.04354  -0.06013 0.03941  15  PHE A CB  
237  C CG  . PHE A 15  ? 0.37735 0.20336 0.34696 0.03526  -0.05647 0.04380  15  PHE A CG  
238  C CD1 . PHE A 15  ? 0.42961 0.25019 0.38993 0.02941  -0.06166 0.04714  15  PHE A CD1 
239  C CD2 . PHE A 15  ? 0.41082 0.24296 0.38984 0.03351  -0.04589 0.04382  15  PHE A CD2 
240  C CE1 . PHE A 15  ? 0.44399 0.27257 0.40939 0.02469  -0.05787 0.04966  15  PHE A CE1 
241  C CE2 . PHE A 15  ? 0.52451 0.35597 0.50313 0.03057  -0.04191 0.04796  15  PHE A CE2 
242  C CZ  . PHE A 15  ? 0.45676 0.29015 0.43109 0.02756  -0.04868 0.05050  15  PHE A CZ  
252  N N   . GLN A 16  ? 0.46382 0.33668 0.47222 0.04677  -0.05479 0.01979  16  GLN A N   
253  C CA  . GLN A 16  ? 0.42286 0.31881 0.45035 0.03687  -0.04658 0.01042  16  GLN A CA  
254  C C   . GLN A 16  ? 0.38692 0.30794 0.42352 0.04201  -0.05791 0.00184  16  GLN A C   
255  O O   . GLN A 16  ? 0.31891 0.25245 0.36339 0.03134  -0.05544 -0.00369 16  GLN A O   
256  C CB  . GLN A 16  ? 0.41442 0.32407 0.45485 0.03203  -0.03216 0.00154  16  GLN A CB  
257  C CG  . GLN A 16  ? 0.55497 0.43809 0.58195 0.02507  -0.01806 0.00984  16  GLN A CG  
258  C CD  . GLN A 16  ? 0.61364 0.48032 0.63358 0.01550  -0.01068 0.01513  16  GLN A CD  
259  O OE1 . GLN A 16  ? 0.83526 0.67888 0.83864 0.01892  -0.00944 0.02668  16  GLN A OE1 
260  N NE2 . GLN A 16  ? 0.60130 0.48221 0.63333 0.00461  -0.00590 0.00524  16  GLN A NE2 
269  N N   . GLN A 17  ? 0.39166 0.31877 0.42397 0.06002  -0.07037 0.00026  17  GLN A N   
270  C CA  . GLN A 17  ? 0.43953 0.38858 0.47354 0.07091  -0.08428 -0.00593 17  GLN A CA  
271  C C   . GLN A 17  ? 0.40715 0.33280 0.42068 0.06580  -0.09075 0.00344  17  GLN A C   
272  O O   . GLN A 17  ? 0.40999 0.35596 0.42932 0.06119  -0.09479 -0.00298 17  GLN A O   
273  C CB  . GLN A 17  ? 0.43441 0.38261 0.45780 0.09734  -0.09642 -0.00620 17  GLN A CB  
274  C CG  . GLN A 17  ? 0.45347 0.44457 0.50398 0.10672  -0.09312 -0.02158 17  GLN A CG  
275  C CD  . GLN A 17  ? 0.57164 0.56075 0.60903 0.13894  -0.10594 -0.02203 17  GLN A CD  
276  O OE1 . GLN A 17  ? 0.58440 0.54952 0.59362 0.15624  -0.11998 -0.01383 17  GLN A OE1 
277  N NE2 . GLN A 17  ? 0.70092 0.71077 0.75440 0.14812  -0.09961 -0.03149 17  GLN A NE2 
286  N N   . HIS A 18  ? 0.39954 0.28496 0.38864 0.06461  -0.09084 0.01677  18  HIS A N   
287  C CA  . HIS A 18  ? 0.43055 0.29484 0.40040 0.05668  -0.09373 0.02441  18  HIS A CA  
288  C C   . HIS A 18  ? 0.37571 0.25106 0.36095 0.03860  -0.08319 0.02182  18  HIS A C   
289  O O   . HIS A 18  ? 0.35082 0.22873 0.33119 0.03271  -0.08551 0.02056  18  HIS A O   
290  C CB  . HIS A 18  ? 0.47394 0.29944 0.41790 0.05467  -0.09291 0.03533  18  HIS A CB  
291  C CG  . HIS A 18  ? 0.46181 0.26767 0.38619 0.04346  -0.09293 0.04140  18  HIS A CG  
292  N ND1 . HIS A 18  ? 0.40109 0.21230 0.33544 0.02795  -0.08408 0.04260  18  HIS A ND1 
293  C CD2 . HIS A 18  ? 0.42515 0.20453 0.31774 0.04614  -0.09927 0.04624  18  HIS A CD2 
294  C CE1 . HIS A 18  ? 0.47534 0.27056 0.38993 0.01979  -0.08462 0.04621  18  HIS A CE1 
295  N NE2 . HIS A 18  ? 0.49401 0.26692 0.38101 0.02884  -0.09301 0.04889  18  HIS A NE2 
303  N N   . THR A 19  ? 0.32557 0.20325 0.32482 0.03107  -0.07069 0.02114  19  THR A N   
304  C CA  . THR A 19  ? 0.33530 0.21481 0.34305 0.01752  -0.05857 0.01911  19  THR A CA  
305  C C   . THR A 19  ? 0.31444 0.21972 0.33694 0.01017  -0.05617 0.00549  19  THR A C   
306  O O   . THR A 19  ? 0.38292 0.28682 0.40401 -0.00009 -0.05149 0.00259  19  THR A O   
307  C CB  . THR A 19  ? 0.33566 0.20580 0.34720 0.01501  -0.04537 0.02216  19  THR A CB  
308  O OG1 . THR A 19  ? 0.38838 0.24153 0.38675 0.02029  -0.04882 0.03267  19  THR A OG1 
309  C CG2 . THR A 19  ? 0.28286 0.14577 0.29618 0.00473  -0.03085 0.02047  19  THR A CG2 
317  N N   . ALA A 20  ? 0.41381 0.34644 0.45122 0.01453  -0.05875 -0.00514 20  ALA A N   
318  C CA  . ALA A 20  ? 0.28333 0.25107 0.33855 0.00451  -0.05613 -0.02247 20  ALA A CA  
319  C C   . ALA A 20  ? 0.36883 0.34955 0.41612 0.00885  -0.07135 -0.02525 20  ALA A C   
320  O O   . ALA A 20  ? 0.43855 0.43458 0.49139 -0.00550 -0.06712 -0.03624 20  ALA A O   
321  C CB  . ALA A 20  ? 0.31603 0.31999 0.39221 0.00964  -0.05627 -0.03545 20  ALA A CB  
327  N N   . ARG A 21  ? 0.36872 0.33928 0.39806 0.02812  -0.08800 -0.01582 21  ARG A N   
328  C CA  . ARG A 21  ? 0.38905 0.36063 0.39994 0.03409  -0.10195 -0.01486 21  ARG A CA  
329  C C   . ARG A 21  ? 0.36566 0.31001 0.36240 0.01843  -0.09399 -0.00822 21  ARG A C   
330  O O   . ARG A 21  ? 0.36594 0.32230 0.35949 0.01022  -0.09573 -0.01555 21  ARG A O   
331  C CB  . ARG A 21  ? 0.43058 0.38014 0.41441 0.05797  -0.11724 -0.00342 21  ARG A CB  
332  C CG  . ARG A 21  ? 0.51085 0.48890 0.50551 0.08021  -0.12722 -0.01080 21  ARG A CG  
333  C CD  . ARG A 21  ? 0.39708 0.42608 0.40218 0.09012  -0.14101 -0.02605 21  ARG A CD  
334  N NE  . ARG A 21  ? 0.47134 0.48261 0.44339 0.09614  -0.15319 -0.01926 21  ARG A NE  
335  C CZ  . ARG A 21  ? 0.52860 0.56289 0.50430 0.08197  -0.15444 -0.02862 21  ARG A CZ  
336  N NH1 . ARG A 21  ? 0.51432 0.59108 0.52521 0.06050  -0.14436 -0.04683 21  ARG A NH1 
337  N NH2 . ARG A 21  ? 0.67985 0.69029 0.61902 0.08781  -0.16432 -0.02031 21  ARG A NH2 
351  N N   . TRP A 22  ? 0.35049 0.26196 0.33892 0.01477  -0.08537 0.00416  22  TRP A N   
352  C CA  . TRP A 22  ? 0.34292 0.23526 0.32263 0.00206  -0.07624 0.00872  22  TRP A CA  
353  C C   . TRP A 22  ? 0.32078 0.22625 0.31566 -0.01290 -0.06338 -0.00292 22  TRP A C   
354  O O   . TRP A 22  ? 0.36873 0.27063 0.35522 -0.02166 -0.06051 -0.00598 22  TRP A O   
355  C CB  . TRP A 22  ? 0.38801 0.25751 0.36491 0.00187  -0.06859 0.01972  22  TRP A CB  
356  C CG  . TRP A 22  ? 0.34895 0.20364 0.31477 -0.00586 -0.06295 0.02492  22  TRP A CG  
357  C CD1 . TRP A 22  ? 0.34125 0.19620 0.31368 -0.01404 -0.05075 0.02165  22  TRP A CD1 
358  C CD2 . TRP A 22  ? 0.35199 0.18944 0.29703 -0.00668 -0.06716 0.03270  22  TRP A CD2 
359  N NE1 . TRP A 22  ? 0.30626 0.15237 0.26774 -0.01776 -0.04837 0.02635  22  TRP A NE1 
360  C CE2 . TRP A 22  ? 0.32432 0.16091 0.26944 -0.01593 -0.05766 0.03249  22  TRP A CE2 
361  C CE3 . TRP A 22  ? 0.37619 0.19572 0.29967 -0.00139 -0.07597 0.03877  22  TRP A CE3 
362  C CZ2 . TRP A 22  ? 0.39979 0.22599 0.32859 -0.02286 -0.05644 0.03651  22  TRP A CZ2 
363  C CZ3 . TRP A 22  ? 0.42835 0.22871 0.33018 -0.01024 -0.07348 0.04360  22  TRP A CZ3 
364  C CH2 . TRP A 22  ? 0.42636 0.23396 0.33315 -0.02226 -0.06369 0.04167  22  TRP A CH2 
375  N N   . GLN A 23  ? 0.32127 0.23770 0.33475 -0.01761 -0.05327 -0.01032 23  GLN A N   
376  C CA  . GLN A 23  ? 0.35963 0.27827 0.38121 -0.03488 -0.03665 -0.02221 23  GLN A CA  
377  C C   . GLN A 23  ? 0.42262 0.37136 0.44814 -0.04420 -0.04273 -0.03855 23  GLN A C   
378  O O   . GLN A 23  ? 0.38471 0.32745 0.40605 -0.05953 -0.03184 -0.04708 23  GLN A O   
379  C CB  . GLN A 23  ? 0.43865 0.35906 0.47352 -0.04022 -0.02282 -0.02749 23  GLN A CB  
380  C CG  . GLN A 23  ? 0.59022 0.48562 0.62004 -0.05614 0.00103  -0.03244 23  GLN A CG  
381  C CD  . GLN A 23  ? 0.79634 0.69606 0.83544 -0.06803 0.01703  -0.04295 23  GLN A CD  
382  O OE1 . GLN A 23  ? 0.72814 0.66775 0.78581 -0.07549 0.01304  -0.05862 23  GLN A OE1 
383  N NE2 . GLN A 23  ? 0.78308 0.64294 0.80745 -0.06903 0.03575  -0.03503 23  GLN A NE2 
392  N N   . HIS A 24  ? 0.39760 0.37963 0.42927 -0.03339 -0.06042 -0.04396 24  HIS A N   
393  C CA  . HIS A 24  ? 0.52524 0.54584 0.56124 -0.03922 -0.06960 -0.06115 24  HIS A CA  
394  C C   . HIS A 24  ? 0.45168 0.45726 0.46209 -0.03727 -0.07855 -0.05520 24  HIS A C   
395  O O   . HIS A 24  ? 0.40943 0.42809 0.41762 -0.05228 -0.07536 -0.06857 24  HIS A O   
396  C CB  . HIS A 24  ? 0.47086 0.53517 0.51952 -0.02147 -0.08782 -0.06825 24  HIS A CB  
397  C CG  . HIS A 24  ? 0.56979 0.68748 0.62749 -0.02534 -0.09915 -0.08923 24  HIS A CG  
398  N ND1 . HIS A 24  ? 0.52303 0.66415 0.56754 -0.00137 -0.12415 -0.08818 24  HIS A ND1 
399  C CD2 . HIS A 24  ? 0.55414 0.70647 0.62975 -0.05059 -0.08876 -0.11294 24  HIS A CD2 
400  C CE1 . HIS A 24  ? 0.54043 0.73585 0.59742 -0.00966 -0.13120 -0.11062 24  HIS A CE1 
401  N NE2 . HIS A 24  ? 0.67326 0.87794 0.75078 -0.04203 -0.10937 -0.12724 24  HIS A NE2 
409  N N   . GLU A 25  ? 0.40941 0.38569 0.39768 -0.02155 -0.08780 -0.03658 25  GLU A N   
410  C CA  . GLU A 25  ? 0.44186 0.40077 0.40121 -0.02093 -0.09445 -0.03062 25  GLU A CA  
411  C C   . GLU A 25  ? 0.46004 0.39033 0.41409 -0.03683 -0.07638 -0.02735 25  GLU A C   
412  O O   . GLU A 25  ? 0.42675 0.35425 0.36577 -0.04573 -0.07497 -0.03213 25  GLU A O   
413  C CB  . GLU A 25  ? 0.40379 0.33743 0.33614 -0.00134 -0.10787 -0.01361 25  GLU A CB  
414  C CG  . GLU A 25  ? 0.55137 0.50719 0.48278 0.02142  -0.12630 -0.01532 25  GLU A CG  
415  C CD  . GLU A 25  ? 0.57501 0.56743 0.49938 0.02832  -0.14222 -0.02784 25  GLU A CD  
416  O OE1 . GLU A 25  ? 0.48667 0.47039 0.38964 0.01935  -0.14266 -0.02869 25  GLU A OE1 
417  O OE2 . GLU A 25  ? 0.61240 0.64643 0.55290 0.04344  -0.15459 -0.03812 25  GLU A OE2 
424  N N   . LEU A 26  ? 0.49855 0.40910 0.46324 -0.03835 -0.06281 -0.01984 26  LEU A N   
425  C CA  . LEU A 26  ? 0.46042 0.34678 0.42100 -0.04658 -0.04651 -0.01603 26  LEU A CA  
426  C C   . LEU A 26  ? 0.43012 0.31052 0.40735 -0.05288 -0.02877 -0.02118 26  LEU A C   
427  O O   . LEU A 26  ? 0.46611 0.32958 0.44651 -0.04605 -0.02115 -0.01134 26  LEU A O   
428  C CB  . LEU A 26  ? 0.35915 0.22563 0.30918 -0.03846 -0.04815 -0.00048 26  LEU A CB  
429  C CG  . LEU A 26  ? 0.44017 0.29837 0.36371 -0.03576 -0.06020 0.00573  26  LEU A CG  
430  C CD1 . LEU A 26  ? 0.37669 0.21712 0.29146 -0.03126 -0.06088 0.01827  26  LEU A CD1 
431  C CD2 . LEU A 26  ? 0.46893 0.32232 0.37734 -0.04678 -0.05386 0.00070  26  LEU A CD2 
443  N N   . PRO A 27  ? 0.40931 0.30181 0.39368 -0.06669 -0.02102 -0.03741 27  PRO A N   
444  C CA  . PRO A 27  ? 0.46639 0.34358 0.45859 -0.07509 -0.00076 -0.04264 27  PRO A CA  
445  C C   . PRO A 27  ? 0.46904 0.30817 0.44876 -0.07333 0.01729  -0.03598 27  PRO A C   
446  O O   . PRO A 27  ? 0.50010 0.31503 0.47796 -0.07237 0.03322  -0.03365 27  PRO A O   
447  C CB  . PRO A 27  ? 0.39881 0.29840 0.39721 -0.09584 0.00467  -0.06521 27  PRO A CB  
448  C CG  . PRO A 27  ? 0.38558 0.30372 0.37431 -0.09759 -0.00953 -0.07058 27  PRO A CG  
449  C CD  . PRO A 27  ? 0.47853 0.39839 0.46044 -0.07672 -0.02947 -0.05297 27  PRO A CD  
457  N N   . ASP A 28  ? 0.47163 0.30403 0.44023 -0.07103 0.01598  -0.03297 28  ASP A N   
458  C CA  . ASP A 28  ? 0.55211 0.35469 0.51037 -0.06563 0.03270  -0.02874 28  ASP A CA  
459  C C   . ASP A 28  ? 0.49950 0.30350 0.45909 -0.04798 0.02586  -0.01328 28  ASP A C   
460  O O   . ASP A 28  ? 0.50032 0.29098 0.45416 -0.03991 0.03650  -0.01068 28  ASP A O   
461  C CB  . ASP A 28  ? 0.67466 0.47144 0.62041 -0.07791 0.04070  -0.04078 28  ASP A CB  
462  C CG  . ASP A 28  ? 0.72519 0.52588 0.66936 -0.09969 0.04782  -0.06006 28  ASP A CG  
463  O OD1 . ASP A 28  ? 0.66813 0.45430 0.61441 -0.10651 0.06127  -0.06515 28  ASP A OD1 
464  O OD2 . ASP A 28  ? 0.72736 0.54665 0.66629 -0.11151 0.04062  -0.07129 28  ASP A OD2 
469  N N   . LEU A 29  ? 0.46074 0.28221 0.42737 -0.04201 0.00925  -0.00481 29  LEU A N   
470  C CA  . LEU A 29  ? 0.44232 0.26850 0.41017 -0.03052 0.00373  0.00662  29  LEU A CA  
471  C C   . LEU A 29  ? 0.39620 0.22883 0.37121 -0.02355 -0.00681 0.01441  29  LEU A C   
472  O O   . LEU A 29  ? 0.43587 0.27785 0.40906 -0.02605 -0.02037 0.01530  29  LEU A O   
473  C CB  . LEU A 29  ? 0.40301 0.23862 0.36162 -0.03681 -0.00390 0.00642  29  LEU A CB  
474  C CG  . LEU A 29  ? 0.35346 0.19733 0.31309 -0.03174 -0.00494 0.01339  29  LEU A CG  
475  C CD1 . LEU A 29  ? 0.40219 0.24728 0.36838 -0.02256 0.00928  0.01178  29  LEU A CD1 
476  C CD2 . LEU A 29  ? 0.43928 0.28548 0.38292 -0.04292 -0.01069 0.01276  29  LEU A CD2 
488  N N   . THR A 30  ? 0.43652 0.26115 0.41554 -0.01277 -0.00022 0.02014  30  THR A N   
489  C CA  . THR A 30  ? 0.36892 0.19813 0.35265 -0.00637 -0.00838 0.02674  30  THR A CA  
490  C C   . THR A 30  ? 0.32573 0.16805 0.30870 -0.00401 -0.02011 0.03269  30  THR A C   
491  O O   . THR A 30  ? 0.43384 0.28324 0.41422 -0.00670 -0.01949 0.03211  30  THR A O   
492  C CB  . THR A 30  ? 0.39673 0.21120 0.37843 0.00536  0.00212  0.03192  30  THR A CB  
493  O OG1 . THR A 30  ? 0.45388 0.27220 0.43372 0.01828  0.00431  0.03712  30  THR A OG1 
494  C CG2 . THR A 30  ? 0.45972 0.25049 0.43448 -0.00039 0.01899  0.02535  30  THR A CG2 
502  N N   . LYS A 31  ? 0.38586 0.24684 0.33408 -0.00591 -0.01434 0.03250  31  LYS A N   
503  C CA  . LYS A 31  ? 0.41979 0.28088 0.35366 -0.01577 -0.02524 0.03610  31  LYS A CA  
504  C C   . LYS A 31  ? 0.41519 0.30185 0.35025 -0.01763 -0.02246 0.04312  31  LYS A C   
505  O O   . LYS A 31  ? 0.36765 0.26606 0.29758 -0.03018 -0.02744 0.04625  31  LYS A O   
506  C CB  . LYS A 31  ? 0.37396 0.21671 0.29856 -0.01391 -0.03236 0.03165  31  LYS A CB  
507  C CG  . LYS A 31  ? 0.46314 0.28123 0.37468 -0.01730 -0.04340 0.02697  31  LYS A CG  
508  C CD  . LYS A 31  ? 0.45989 0.26513 0.37447 -0.00517 -0.04450 0.01875  31  LYS A CD  
509  C CE  . LYS A 31  ? 0.51117 0.31433 0.42052 -0.00087 -0.04286 0.01794  31  LYS A CE  
510  N NZ  . LYS A 31  ? 0.43196 0.21708 0.33473 0.00911  -0.04773 0.00974  31  LYS A NZ  
524  N N   . PRO A 32  ? 0.38351 0.28128 0.32413 -0.00555 -0.01454 0.04593  32  PRO A N   
525  C CA  . PRO A 32  ? 0.33960 0.26812 0.28197 -0.00321 -0.01354 0.05222  32  PRO A CA  
526  C C   . PRO A 32  ? 0.37292 0.32116 0.32335 -0.00324 -0.00778 0.05536  32  PRO A C   
527  O O   . PRO A 32  ? 0.40963 0.38798 0.36263 -0.01020 -0.01130 0.05833  32  PRO A O   
528  C CB  . PRO A 32  ? 0.34134 0.26883 0.28282 0.01498  -0.00471 0.05536  32  PRO A CB  
529  C CG  . PRO A 32  ? 0.31701 0.21574 0.25450 0.01577  -0.00379 0.04996  32  PRO A CG  
530  C CD  . PRO A 32  ? 0.36080 0.24440 0.30371 0.00656  -0.00650 0.04378  32  PRO A CD  
538  N N   . GLN A 33  ? 0.35217 0.28640 0.30700 0.00368  0.00148  0.05349  33  GLN A N   
539  C CA  . GLN A 33  ? 0.32188 0.27109 0.28071 0.00445  0.00726  0.05492  33  GLN A CA  
540  C C   . GLN A 33  ? 0.31318 0.26806 0.26712 -0.01403 -0.00089 0.05436  33  GLN A C   
541  O O   . GLN A 33  ? 0.33368 0.31724 0.29034 -0.01897 0.00083  0.05793  33  GLN A O   
542  C CB  . GLN A 33  ? 0.40304 0.32968 0.36385 0.01263  0.01737  0.05017  33  GLN A CB  
543  C CG  . GLN A 33  ? 0.44140 0.35804 0.40292 0.02985  0.03000  0.05235  33  GLN A CG  
544  C CD  . GLN A 33  ? 0.52252 0.41011 0.48577 0.03111  0.03944  0.04480  33  GLN A CD  
545  O OE1 . GLN A 33  ? 0.48408 0.36318 0.45019 0.02042  0.03401  0.03674  33  GLN A OE1 
546  N NE2 . GLN A 33  ? 0.70962 0.58090 0.66928 0.04398  0.05350  0.04700  33  GLN A NE2 
555  N N   . TYR A 34  ? 0.41932 0.34687 0.36450 -0.02357 -0.00899 0.05018  34  TYR A N   
556  C CA  . TYR A 34  ? 0.36950 0.29121 0.30218 -0.04033 -0.01612 0.05116  34  TYR A CA  
557  C C   . TYR A 34  ? 0.38482 0.32690 0.31470 -0.05550 -0.02080 0.05551  34  TYR A C   
558  O O   . TYR A 34  ? 0.36082 0.32064 0.28836 -0.06847 -0.01861 0.05902  34  TYR A O   
559  C CB  . TYR A 34  ? 0.36366 0.24927 0.28417 -0.04224 -0.02527 0.04621  34  TYR A CB  
560  C CG  . TYR A 34  ? 0.46610 0.33296 0.36499 -0.05746 -0.03353 0.04864  34  TYR A CG  
561  C CD1 . TYR A 34  ? 0.42104 0.28423 0.30947 -0.06135 -0.03161 0.05040  34  TYR A CD1 
562  C CD2 . TYR A 34  ? 0.45730 0.30447 0.34137 -0.06737 -0.04257 0.04915  34  TYR A CD2 
563  C CE1 . TYR A 34  ? 0.48165 0.32112 0.34410 -0.07471 -0.03763 0.05452  34  TYR A CE1 
564  C CE2 . TYR A 34  ? 0.46589 0.28613 0.32416 -0.08145 -0.04865 0.05233  34  TYR A CE2 
565  C CZ  . TYR A 34  ? 0.51383 0.32954 0.36064 -0.08497 -0.04577 0.05593  34  TYR A CZ  
566  O OH  . TYR A 34  ? 0.47918 0.26209 0.29438 -0.09860 -0.05031 0.06101  34  TYR A OH  
576  N N   . ALA A 35  ? 0.37611 0.31783 0.30605 -0.05541 -0.02662 0.05436  35  ALA A N   
577  C CA  . ALA A 35  ? 0.40238 0.36410 0.32981 -0.07245 -0.03276 0.05560  35  ALA A CA  
578  C C   . ALA A 35  ? 0.36484 0.37903 0.30969 -0.07106 -0.02648 0.05908  35  ALA A C   
579  O O   . ALA A 35  ? 0.35993 0.39919 0.30661 -0.09064 -0.02746 0.06024  35  ALA A O   
580  C CB  . ALA A 35  ? 0.42612 0.37772 0.34843 -0.06931 -0.04049 0.05186  35  ALA A CB  
586  N N   . VAL A 36  ? 0.36111 0.39256 0.31809 -0.04774 -0.01921 0.06064  36  VAL A N   
587  C CA  . VAL A 36  ? 0.29437 0.37619 0.26685 -0.03974 -0.01307 0.06384  36  VAL A CA  
588  C C   . VAL A 36  ? 0.38024 0.47603 0.35534 -0.05019 -0.00596 0.06535  36  VAL A C   
589  O O   . VAL A 36  ? 0.33238 0.47171 0.31753 -0.06262 -0.00502 0.06638  36  VAL A O   
590  C CB  . VAL A 36  ? 0.37519 0.45780 0.35218 -0.00931 -0.00458 0.06626  36  VAL A CB  
591  C CG1 . VAL A 36  ? 0.36512 0.49364 0.35492 0.00463  0.00345  0.06948  36  VAL A CG1 
592  C CG2 . VAL A 36  ? 0.34073 0.41997 0.31322 0.00086  -0.01048 0.06651  36  VAL A CG2 
602  N N   . MET A 37  ? 0.32044 0.38198 0.28629 -0.04626 -0.00075 0.06465  37  MET A N   
603  C CA  . MET A 37  ? 0.44221 0.51394 0.40576 -0.05316 0.00699  0.06602  37  MET A CA  
604  C C   . MET A 37  ? 0.38204 0.45790 0.33681 -0.08293 0.00293  0.06802  37  MET A C   
605  O O   . MET A 37  ? 0.44619 0.55533 0.40573 -0.09300 0.01065  0.07051  37  MET A O   
606  C CB  . MET A 37  ? 0.41845 0.44955 0.37003 -0.04448 0.01027  0.06298  37  MET A CB  
607  C CG  . MET A 37  ? 0.40842 0.43566 0.36713 -0.01905 0.01894  0.06039  37  MET A CG  
608  S SD  . MET A 37  ? 0.39522 0.38217 0.34209 -0.01354 0.02239  0.05328  37  MET A SD  
609  C CE  . MET A 37  ? 0.38291 0.39438 0.32424 -0.01419 0.03256  0.05432  37  MET A CE  
619  N N   . ARG A 38  ? 0.33026 0.37042 0.27009 -0.09749 -0.00769 0.06691  38  ARG A N   
620  C CA  . ARG A 38  ? 0.46152 0.49564 0.38737 -0.12750 -0.01047 0.06918  38  ARG A CA  
621  C C   . ARG A 38  ? 0.39550 0.48212 0.33920 -0.14360 -0.01061 0.06849  38  ARG A C   
622  O O   . ARG A 38  ? 0.41424 0.52008 0.35636 -0.16862 -0.00549 0.07075  38  ARG A O   
623  C CB  . ARG A 38  ? 0.49623 0.47363 0.39780 -0.13572 -0.02184 0.06745  38  ARG A CB  
624  C CG  . ARG A 38  ? 0.50879 0.44030 0.39166 -0.12362 -0.02303 0.06758  38  ARG A CG  
625  C CD  . ARG A 38  ? 0.58673 0.46462 0.43798 -0.13641 -0.03212 0.06848  38  ARG A CD  
626  N NE  . ARG A 38  ? 0.61411 0.48538 0.44563 -0.16333 -0.02790 0.07472  38  ARG A NE  
627  C CZ  . ARG A 38  ? 0.69306 0.51831 0.49404 -0.16951 -0.03268 0.07451  38  ARG A CZ  
628  N NH1 . ARG A 38  ? 0.72709 0.51225 0.51367 -0.15157 -0.04263 0.06949  38  ARG A NH1 
629  N NH2 . ARG A 38  ? 0.78990 0.61566 0.57768 -0.18940 -0.02632 0.07716  38  ARG A NH2 
643  N N   . ALA A 39  ? 0.39916 0.51172 0.35940 -0.13004 -0.01607 0.06509  39  ALA A N   
644  C CA  . ALA A 39  ? 0.34146 0.51452 0.32209 -0.14140 -0.01807 0.06266  39  ALA A CA  
645  C C   . ALA A 39  ? 0.40261 0.63486 0.40490 -0.13494 -0.00578 0.06512  39  ALA A C   
646  O O   . ALA A 39  ? 0.34586 0.62820 0.36277 -0.15667 -0.00334 0.06366  39  ALA A O   
647  C CB  . ALA A 39  ? 0.29392 0.48072 0.28309 -0.12200 -0.02714 0.05908  39  ALA A CB  
653  N N   . ILE A 40  ? 0.41902 0.64700 0.42360 -0.10573 0.00283  0.06776  40  ILE A N   
654  C CA  . ILE A 40  ? 0.26331 0.54220 0.28462 -0.09511 0.01569  0.06941  40  ILE A CA  
655  C C   . ILE A 40  ? 0.35744 0.63436 0.36942 -0.12074 0.02509  0.07193  40  ILE A C   
656  O O   . ILE A 40  ? 0.41495 0.74913 0.44380 -0.13130 0.03395  0.07208  40  ILE A O   
657  C CB  . ILE A 40  ? 0.29227 0.55402 0.31145 -0.05814 0.02299  0.07048  40  ILE A CB  
658  C CG1 . ILE A 40  ? 0.27117 0.53286 0.29542 -0.03318 0.01625  0.06997  40  ILE A CG1 
659  C CG2 . ILE A 40  ? 0.34055 0.64969 0.37274 -0.04403 0.03707  0.07124  40  ILE A CG2 
660  C CD1 . ILE A 40  ? 0.35458 0.57961 0.36960 -0.00244 0.02373  0.07101  40  ILE A CD1 
672  N N   . ALA A 41  ? 0.39402 0.60716 0.37806 -0.12997 0.02384  0.07408  41  ALA A N   
673  C CA  . ALA A 41  ? 0.43958 0.64244 0.40666 -0.15259 0.03300  0.07819  41  ALA A CA  
674  C C   . ALA A 41  ? 0.44914 0.67206 0.41736 -0.19127 0.03258  0.07907  41  ALA A C   
675  O O   . ALA A 41  ? 0.51033 0.75577 0.47634 -0.21166 0.04515  0.08256  41  ALA A O   
676  C CB  . ALA A 41  ? 0.38246 0.51144 0.31612 -0.15089 0.02870  0.08017  41  ALA A CB  
682  N N   . ASP A 42  ? 0.53376 0.74790 0.50387 -0.20322 0.01937  0.07524  42  ASP A N   
683  C CA  . ASP A 42  ? 0.54559 0.77646 0.51646 -0.24306 0.01822  0.07358  42  ASP A CA  
684  C C   . ASP A 42  ? 0.48934 0.81072 0.49897 -0.24738 0.02234  0.06825  42  ASP A C   
685  O O   . ASP A 42  ? 0.55292 0.88981 0.56308 -0.27098 0.02505  0.06351  42  ASP A O   
686  C CB  . ASP A 42  ? 0.62889 0.81552 0.58502 -0.25262 0.00178  0.06891  42  ASP A CB  
687  C CG  . ASP A 42  ? 0.89382 1.06410 0.83486 -0.28430 -0.00075 0.06335  42  ASP A CG  
688  O OD1 . ASP A 42  ? 1.05336 1.22417 0.98596 -0.29874 0.01017  0.06505  42  ASP A OD1 
689  O OD2 . ASP A 42  ? 0.99694 1.15114 0.93246 -0.29244 -0.01298 0.05658  42  ASP A OD2 
694  N N   . LYS A 43  ? 0.49730 0.86665 0.53367 -0.21436 0.02080  0.06609  43  LYS A N   
695  C CA  . LYS A 43  ? 0.41295 0.87609 0.48805 -0.21204 0.02266  0.06090  43  LYS A CA  
696  C C   . LYS A 43  ? 0.44907 0.94482 0.53908 -0.16834 0.03109  0.06308  43  LYS A C   
697  O O   . LYS A 43  ? 0.36730 0.87903 0.46799 -0.13576 0.02337  0.06120  43  LYS A O   
698  C CB  . LYS A 43  ? 0.35641 0.84123 0.44372 -0.21454 0.00484  0.05304  43  LYS A CB  
699  C CG  . LYS A 43  ? 0.57904 1.14921 0.69808 -0.20698 0.00251  0.04479  43  LYS A CG  
700  C CD  . LYS A 43  ? 0.60748 1.18348 0.72604 -0.22745 -0.01315 0.03445  43  LYS A CD  
701  C CE  . LYS A 43  ? 0.56110 1.21971 0.70822 -0.22164 -0.01525 0.02521  43  LYS A CE  
702  N NZ  . LYS A 43  ? 0.63306 1.34027 0.79914 -0.17501 -0.01952 0.02665  43  LYS A NZ  
716  N N   . PRO A 44  ? 0.48524 0.98685 0.57187 -0.16567 0.04782  0.06721  44  PRO A N   
717  C CA  . PRO A 44  ? 0.41557 0.94448 0.51293 -0.12381 0.05717  0.06795  44  PRO A CA  
718  C C   . PRO A 44  ? 0.39786 1.01176 0.53040 -0.10450 0.05407  0.06270  44  PRO A C   
719  O O   . PRO A 44  ? 0.39222 1.04800 0.53926 -0.12529 0.04956  0.05619  44  PRO A O   
720  C CB  . PRO A 44  ? 0.34714 0.87518 0.43428 -0.13304 0.07489  0.07064  44  PRO A CB  
721  C CG  . PRO A 44  ? 0.42320 0.88799 0.48035 -0.17002 0.07262  0.07411  44  PRO A CG  
722  C CD  . PRO A 44  ? 0.41191 0.87805 0.47550 -0.19502 0.05729  0.07007  44  PRO A CD  
730  N N   . GLY A 45  ? 0.39297 1.01107 0.52879 -0.05992 0.05365  0.06368  45  GLY A N   
731  C CA  . GLY A 45  ? 0.33000 1.01313 0.48963 -0.03339 0.04686  0.05941  45  GLY A CA  
732  C C   . GLY A 45  ? 0.32797 1.02200 0.49438 -0.03892 0.02791  0.05661  45  GLY A C   
733  O O   . GLY A 45  ? 0.28459 1.02750 0.46401 -0.02213 0.01927  0.05137  45  GLY A O   
737  N N   . ILE A 46  ? 0.37191 0.99790 0.51611 -0.05937 0.01898  0.05799  46  ILE A N   
738  C CA  . ILE A 46  ? 0.24486 0.86895 0.38803 -0.06352 0.00050  0.05417  46  ILE A CA  
739  C C   . ILE A 46  ? 0.23848 0.87993 0.38376 -0.01551 -0.00480 0.05615  46  ILE A C   
740  O O   . ILE A 46  ? 0.32479 0.93275 0.45698 0.01900  0.00476  0.06218  46  ILE A O   
741  C CB  . ILE A 46  ? 0.37825 0.91098 0.48973 -0.08212 -0.00584 0.05584  46  ILE A CB  
742  C CG1 . ILE A 46  ? 0.32433 0.85504 0.43215 -0.08744 -0.02417 0.05062  46  ILE A CG1 
743  C CG2 . ILE A 46  ? 0.24250 0.70615 0.33092 -0.05211 0.00116  0.06234  46  ILE A CG2 
744  C CD1 . ILE A 46  ? 0.37173 0.83319 0.45440 -0.11895 -0.03095 0.04874  46  ILE A CD1 
756  N N   . GLU A 47  ? 0.29971 0.99113 0.45833 -0.01342 -0.02013 0.05076  47  GLU A N   
757  C CA  . GLU A 47  ? 0.34720 1.04803 0.49984 0.03296  -0.02649 0.05370  47  GLU A CA  
758  C C   . GLU A 47  ? 0.31816 0.92850 0.43670 0.04676  -0.02811 0.06023  47  GLU A C   
759  O O   . GLU A 47  ? 0.35719 0.91993 0.46121 0.01846  -0.03509 0.05774  47  GLU A O   
760  C CB  . GLU A 47  ? 0.37052 1.11533 0.52840 0.02810  -0.04089 0.04383  47  GLU A CB  
761  C CG  . GLU A 47  ? 0.65386 1.41695 0.80328 0.07624  -0.04288 0.04559  47  GLU A CG  
762  C CD  . GLU A 47  ? 0.80134 1.62770 0.96409 0.07037  -0.05372 0.03407  47  GLU A CD  
763  O OE1 . GLU A 47  ? 0.60276 1.45901 0.78287 0.02812  -0.05784 0.02430  47  GLU A OE1 
764  O OE2 . GLU A 47  ? 0.84396 1.68694 0.99767 0.10757  -0.05738 0.03464  47  GLU A OE2 
771  N N   . GLN A 48  ? 0.33191 0.91469 0.43542 0.09009  -0.02010 0.06809  48  GLN A N   
772  C CA  . GLN A 48  ? 0.33517 0.82936 0.40687 0.10102  -0.01680 0.07411  48  GLN A CA  
773  C C   . GLN A 48  ? 0.31559 0.79273 0.37408 0.09268  -0.03223 0.07202  48  GLN A C   
774  O O   . GLN A 48  ? 0.38642 0.79733 0.42567 0.07841  -0.03198 0.07254  48  GLN A O   
775  C CB  . GLN A 48  ? 0.27423 0.74655 0.33053 0.14872  -0.00555 0.08247  48  GLN A CB  
776  C CG  . GLN A 48  ? 0.33530 0.72357 0.35978 0.16076  -0.00120 0.08859  48  GLN A CG  
777  C CD  . GLN A 48  ? 0.48086 0.82815 0.48716 0.19679  0.01559  0.09582  48  GLN A CD  
778  O OE1 . GLN A 48  ? 0.50357 0.85842 0.51740 0.20188  0.02683  0.09455  48  GLN A OE1 
779  N NE2 . GLN A 48  ? 0.40708 0.70719 0.38618 0.22123  0.01856  0.10318  48  GLN A NE2 
788  N N   . VAL A 49  ? 0.38084 0.91995 0.44908 0.10265  -0.04621 0.06857  49  VAL A N   
789  C CA  . VAL A 49  ? 0.35253 0.87687 0.40434 0.09779  -0.06135 0.06561  49  VAL A CA  
790  C C   . VAL A 49  ? 0.31906 0.82204 0.37166 0.04949  -0.06873 0.05660  49  VAL A C   
791  O O   . VAL A 49  ? 0.29862 0.75088 0.32851 0.04248  -0.07446 0.05541  49  VAL A O   
792  C CB  . VAL A 49  ? 0.42731 1.01135 0.48535 0.11449  -0.07155 0.05960  49  VAL A CB  
793  C CG1 . VAL A 49  ? 0.46895 1.05235 0.51859 0.09251  -0.08859 0.05010  49  VAL A CG1 
794  C CG2 . VAL A 49  ? 0.56730 1.12591 0.60191 0.16287  -0.06233 0.06849  49  VAL A CG2 
804  N N   . ALA A 50  ? 0.32220 0.86008 0.39782 0.01630  -0.06740 0.05042  50  ALA A N   
805  C CA  . ALA A 50  ? 0.32935 0.83979 0.40039 -0.02958 -0.07320 0.04273  50  ALA A CA  
806  C C   . ALA A 50  ? 0.45166 0.87066 0.49713 -0.03551 -0.06494 0.04766  50  ALA A C   
807  O O   . ALA A 50  ? 0.50040 0.88026 0.53189 -0.06393 -0.07136 0.04232  50  ALA A O   
808  C CB  . ALA A 50  ? 0.33287 0.89323 0.43004 -0.06355 -0.06911 0.03746  50  ALA A CB  
814  N N   . LEU A 51  ? 0.36026 0.74486 0.39864 -0.00875 -0.05131 0.05658  51  LEU A N   
815  C CA  . LEU A 51  ? 0.37739 0.68593 0.39699 -0.01470 -0.04349 0.05962  51  LEU A CA  
816  C C   . LEU A 51  ? 0.35844 0.61512 0.35510 -0.00338 -0.04774 0.06018  51  LEU A C   
817  O O   . LEU A 51  ? 0.39249 0.59116 0.37591 -0.00770 -0.04241 0.06115  51  LEU A O   
818  C CB  . LEU A 51  ? 0.38125 0.67552 0.40299 0.00638  -0.02728 0.06636  51  LEU A CB  
819  C CG  . LEU A 51  ? 0.42922 0.75104 0.46596 -0.01052 -0.01938 0.06569  51  LEU A CG  
820  C CD1 . LEU A 51  ? 0.30758 0.62634 0.34580 0.01754  -0.00437 0.07071  51  LEU A CD1 
821  C CD2 . LEU A 51  ? 0.50374 0.78033 0.52875 -0.04365 -0.01986 0.06350  51  LEU A CD2 
833  N N   . ILE A 52  ? 0.32110 0.59939 0.31218 0.01172  -0.05705 0.05915  52  ILE A N   
834  C CA  . ILE A 52  ? 0.45244 0.68139 0.41942 0.02104  -0.05922 0.05962  52  ILE A CA  
835  C C   . ILE A 52  ? 0.42891 0.62653 0.38531 -0.01026 -0.06850 0.05083  52  ILE A C   
836  O O   . ILE A 52  ? 0.60430 0.75065 0.54206 -0.00679 -0.06680 0.05046  52  ILE A O   
837  C CB  . ILE A 52  ? 0.44772 0.70457 0.40501 0.04727  -0.06669 0.06141  52  ILE A CB  
838  C CG1 . ILE A 52  ? 0.42101 0.73288 0.38660 0.02885  -0.08532 0.05097  52  ILE A CG1 
839  C CG2 . ILE A 52  ? 0.48547 0.76689 0.44781 0.08249  -0.05718 0.07110  52  ILE A CG2 
840  C CD1 . ILE A 52  ? 0.60810 0.89091 0.55100 0.01681  -0.09690 0.04307  52  ILE A CD1 
852  N N   . GLU A 53  ? 0.36778 0.59372 0.33442 -0.04092 -0.07719 0.04341  53  GLU A N   
853  C CA  . GLU A 53  ? 0.46622 0.65311 0.41734 -0.07068 -0.08498 0.03526  53  GLU A CA  
854  C C   . GLU A 53  ? 0.46610 0.59454 0.40842 -0.07664 -0.07546 0.03889  53  GLU A C   
855  O O   . GLU A 53  ? 0.46290 0.53953 0.38541 -0.07740 -0.07743 0.03610  53  GLU A O   
856  C CB  . GLU A 53  ? 0.49582 0.72352 0.45838 -0.10522 -0.09404 0.02682  53  GLU A CB  
857  C CG  . GLU A 53  ? 0.69728 0.88482 0.63785 -0.13514 -0.10435 0.01654  53  GLU A CG  
858  C CD  . GLU A 53  ? 0.98200 1.21030 0.93360 -0.17320 -0.11207 0.00710  53  GLU A CD  
859  O OE1 . GLU A 53  ? 0.99217 1.29282 0.96582 -0.17120 -0.11838 0.00296  53  GLU A OE1 
860  O OE2 . GLU A 53  ? 0.95410 1.14243 0.89164 -0.20508 -0.11142 0.00372  53  GLU A OE2 
867  N N   . ALA A 54  ? 0.36389 0.50257 0.32004 -0.07897 -0.06548 0.04437  54  ALA A N   
868  C CA  . ALA A 54  ? 0.35929 0.44745 0.30651 -0.08115 -0.05769 0.04746  54  ALA A CA  
869  C C   . ALA A 54  ? 0.41586 0.47043 0.35688 -0.05373 -0.05106 0.05055  54  ALA A C   
870  O O   . ALA A 54  ? 0.47168 0.47948 0.40056 -0.05500 -0.05032 0.04886  54  ALA A O   
871  C CB  . ALA A 54  ? 0.39145 0.50165 0.35269 -0.08620 -0.04790 0.05226  54  ALA A CB  
877  N N   . ALA A 55  ? 0.43485 0.51293 0.38323 -0.02855 -0.04564 0.05497  55  ALA A N   
878  C CA  . ALA A 55  ? 0.38982 0.43577 0.33189 -0.00528 -0.03605 0.05853  55  ALA A CA  
879  C C   . ALA A 55  ? 0.41085 0.43183 0.33635 -0.00004 -0.04082 0.05539  55  ALA A C   
880  O O   . ALA A 55  ? 0.42893 0.41726 0.34853 0.01249  -0.03207 0.05670  55  ALA A O   
881  C CB  . ALA A 55  ? 0.36019 0.43175 0.30948 0.02056  -0.02661 0.06571  55  ALA A CB  
887  N N   . VAL A 56  ? 0.45698 0.49378 0.37475 -0.01059 -0.05376 0.05012  56  VAL A N   
888  C CA  . VAL A 56  ? 0.43417 0.45117 0.33279 -0.00387 -0.05870 0.04620  56  VAL A CA  
889  C C   . VAL A 56  ? 0.37656 0.38768 0.27004 0.02523  -0.04677 0.05400  56  VAL A C   
890  O O   . VAL A 56  ? 0.50425 0.47980 0.38667 0.03327  -0.03944 0.05379  56  VAL A O   
891  C CB  . VAL A 56  ? 0.47249 0.44131 0.35841 -0.01552 -0.06066 0.03960  56  VAL A CB  
892  C CG1 . VAL A 56  ? 0.39433 0.34916 0.25838 -0.01247 -0.06827 0.03290  56  VAL A CG1 
893  C CG2 . VAL A 56  ? 0.42629 0.38813 0.31391 -0.04225 -0.06773 0.03544  56  VAL A CG2 
903  N N   . SER A 57  ? 0.46169 0.50693 0.36194 0.04165  -0.04359 0.06107  57  SER A N   
904  C CA  . SER A 57  ? 0.54135 0.57424 0.43228 0.06994  -0.03004 0.07056  57  SER A CA  
905  C C   . SER A 57  ? 0.53673 0.61089 0.42114 0.08988  -0.03647 0.07529  57  SER A C   
906  O O   . SER A 57  ? 0.52802 0.64597 0.41965 0.07980  -0.05203 0.06939  57  SER A O   
907  C CB  . SER A 57  ? 0.57244 0.59090 0.47573 0.07587  -0.01469 0.07598  57  SER A CB  
908  O OG  . SER A 57  ? 0.53557 0.59432 0.45312 0.07989  -0.01658 0.07862  57  SER A OG  
914  N N   . THR A 58  ? 0.49131 0.55092 0.36068 0.11836  -0.02422 0.08573  58  THR A N   
915  C CA  . THR A 58  ? 0.50041 0.59589 0.36016 0.14508  -0.02889 0.09251  58  THR A CA  
916  C C   . THR A 58  ? 0.55423 0.68047 0.43320 0.15519  -0.02486 0.09666  58  THR A C   
917  O O   . THR A 58  ? 0.57779 0.68914 0.47278 0.14329  -0.01567 0.09552  58  THR A O   
918  C CB  . THR A 58  ? 0.54003 0.59742 0.37001 0.17145  -0.01516 0.10216  58  THR A CB  
919  O OG1 . THR A 58  ? 0.45640 0.47100 0.28836 0.17565  0.00661  0.10754  58  THR A OG1 
920  C CG2 . THR A 58  ? 0.49109 0.52025 0.30061 0.16341  -0.01721 0.09833  58  THR A CG2 
928  N N   . LYS A 59  ? 0.55464 0.65520 0.62796 0.17741  0.09069  0.19542  59  LYS A N   
929  C CA  . LYS A 59  ? 0.48997 0.59513 0.56401 0.19019  0.08899  0.20558  59  LYS A CA  
930  C C   . LYS A 59  ? 0.48849 0.54768 0.54965 0.18866  0.11716  0.21085  59  LYS A C   
931  O O   . LYS A 59  ? 0.53657 0.59971 0.61738 0.18585  0.11827  0.21178  59  LYS A O   
932  C CB  . LYS A 59  ? 0.57993 0.69453 0.61970 0.21498  0.07608  0.20963  59  LYS A CB  
933  C CG  . LYS A 59  ? 0.79992 0.95935 0.85322 0.21588  0.04859  0.19875  59  LYS A CG  
934  C CD  . LYS A 59  ? 0.76560 0.94096 0.79867 0.23629  0.03132  0.19308  59  LYS A CD  
935  C CE  . LYS A 59  ? 0.79534 0.92755 0.76298 0.26417  0.03929  0.20223  59  LYS A CE  
936  N NZ  . LYS A 59  ? 0.79284 0.92970 0.73395 0.27628  0.02607  0.19834  59  LYS A NZ  
950  N N   . ALA A 60  ? 0.43709 0.45029 0.46494 0.18903  0.14258  0.21265  60  ALA A N   
951  C CA  . ALA A 60  ? 0.46021 0.42562 0.47691 0.18559  0.17375  0.21534  60  ALA A CA  
952  C C   . ALA A 60  ? 0.47573 0.45004 0.54592 0.15825  0.17833  0.19690  60  ALA A C   
953  O O   . ALA A 60  ? 0.42833 0.39123 0.51147 0.15598  0.18686  0.19578  60  ALA A O   
954  C CB  . ALA A 60  ? 0.52612 0.43540 0.49199 0.18957  0.20501  0.22039  60  ALA A CB  
960  N N   . THR A 61  ? 0.38941 0.38318 0.49035 0.13947  0.17104  0.18016  61  THR A N   
961  C CA  . THR A 61  ? 0.35553 0.35846 0.50653 0.11823  0.16973  0.15935  61  THR A CA  
962  C C   . THR A 61  ? 0.33771 0.36888 0.51079 0.11956  0.14499  0.16098  61  THR A C   
963  O O   . THR A 61  ? 0.34160 0.36628 0.53724 0.11205  0.14785  0.15049  61  THR A O   
964  C CB  . THR A 61  ? 0.38212 0.40311 0.56132 0.10264  0.16131  0.14045  61  THR A CB  
965  O OG1 . THR A 61  ? 0.50043 0.49507 0.65216 0.10215  0.18642  0.14003  61  THR A OG1 
966  C CG2 . THR A 61  ? 0.44771 0.47299 0.67736 0.08495  0.16059  0.11469  61  THR A CG2 
974  N N   . LEU A 62  ? 0.30176 0.36353 0.46821 0.12859  0.12193  0.17198  62  LEU A N   
975  C CA  . LEU A 62  ? 0.33180 0.41580 0.51323 0.12867  0.10456  0.17465  62  LEU A CA  
976  C C   . LEU A 62  ? 0.43071 0.49795 0.59724 0.14088  0.11805  0.18437  62  LEU A C   
977  O O   . LEU A 62  ? 0.36520 0.43202 0.54559 0.13593  0.11555  0.17939  62  LEU A O   
978  C CB  . LEU A 62  ? 0.27051 0.39061 0.45198 0.13332  0.08328  0.18153  62  LEU A CB  
979  C CG  . LEU A 62  ? 0.32815 0.46824 0.52007 0.12783  0.07001  0.18185  62  LEU A CG  
980  C CD1 . LEU A 62  ? 0.34186 0.47856 0.55602 0.11306  0.05985  0.17208  62  LEU A CD1 
981  C CD2 . LEU A 62  ? 0.24425 0.41622 0.43464 0.12832  0.05575  0.18253  62  LEU A CD2 
993  N N   . ALA A 63  ? 0.37692 0.42665 0.51089 0.15901  0.13146  0.19776  63  ALA A N   
994  C CA  . ALA A 63  ? 0.40668 0.43575 0.52256 0.16993  0.14467  0.20406  63  ALA A CA  
995  C C   . ALA A 63  ? 0.44301 0.44005 0.57448 0.15968  0.16455  0.19466  63  ALA A C   
996  O O   . ALA A 63  ? 0.46852 0.46645 0.61084 0.15948  0.16381  0.19156  63  ALA A O   
997  C CB  . ALA A 63  ? 0.40336 0.40872 0.47340 0.18894  0.15559  0.21438  63  ALA A CB  
1003 N N   . GLU A 64  ? 0.46021 0.43056 0.59335 0.14780  0.18304  0.18475  64  GLU A N   
1004 C CA  . GLU A 64  ? 0.49390 0.43996 0.65076 0.13281  0.20157  0.16655  64  GLU A CA  
1005 C C   . GLU A 64  ? 0.37819 0.35369 0.57521 0.12027  0.17818  0.14825  64  GLU A C   
1006 O O   . GLU A 64  ? 0.41274 0.37920 0.62433 0.11720  0.18157  0.13703  64  GLU A O   
1007 C CB  . GLU A 64  ? 0.40688 0.32632 0.56690 0.11899  0.22681  0.15445  64  GLU A CB  
1008 C CG  . GLU A 64  ? 0.63665 0.52963 0.82657 0.10221  0.25238  0.13119  64  GLU A CG  
1009 C CD  . GLU A 64  ? 0.93280 0.77562 1.09103 0.11076  0.28449  0.14258  64  GLU A CD  
1010 O OE1 . GLU A 64  ? 0.89368 0.73520 1.02500 0.13052  0.27526  0.16201  64  GLU A OE1 
1011 O OE2 . GLU A 64  ? 1.05527 0.85812 1.21652 0.09729  0.32096  0.13072  64  GLU A OE2 
1018 N N   . MET A 65  ? 0.35628 0.36294 0.56696 0.11460  0.15353  0.14465  65  MET A N   
1019 C CA  . MET A 65  ? 0.28252 0.30781 0.52016 0.10602  0.12953  0.12903  65  MET A CA  
1020 C C   . MET A 65  ? 0.34899 0.38019 0.57384 0.11464  0.11979  0.13879  65  MET A C   
1021 O O   . MET A 65  ? 0.31801 0.34116 0.55298 0.11224  0.11603  0.12537  65  MET A O   
1022 C CB  . MET A 65  ? 0.31123 0.36115 0.55752 0.10048  0.10680  0.12721  65  MET A CB  
1023 C CG  . MET A 65  ? 0.44781 0.50584 0.71722 0.09301  0.08205  0.10858  65  MET A CG  
1024 S SD  . MET A 65  ? 0.52121 0.60081 0.79200 0.08888  0.05562  0.11153  65  MET A SD  
1025 C CE  . MET A 65  ? 0.25392 0.33756 0.52641 0.08628  0.07269  0.11265  65  MET A CE  
1035 N N   . LEU A 66  ? 0.35430 0.40092 0.55811 0.12526  0.11603  0.15936  66  LEU A N   
1036 C CA  . LEU A 66  ? 0.34276 0.39871 0.53729 0.13162  0.10982  0.16685  66  LEU A CA  
1037 C C   . LEU A 66  ? 0.39097 0.42389 0.57818 0.13974  0.12786  0.16602  66  LEU A C   
1038 O O   . LEU A 66  ? 0.41191 0.44325 0.59726 0.14025  0.12385  0.16149  66  LEU A O   
1039 C CB  . LEU A 66  ? 0.30954 0.39168 0.49034 0.13775  0.10399  0.18142  66  LEU A CB  
1040 C CG  . LEU A 66  ? 0.30699 0.41335 0.49774 0.12824  0.08533  0.18097  66  LEU A CG  
1041 C CD1 . LEU A 66  ? 0.28193 0.41516 0.46512 0.13260  0.08154  0.18824  66  LEU A CD1 
1042 C CD2 . LEU A 66  ? 0.38357 0.48981 0.57760 0.12025  0.07370  0.17735  66  LEU A CD2 
1054 N N   . ALA A 67  ? 0.40433 0.41418 0.58241 0.14663  0.14913  0.17046  67  ALA A N   
1055 C CA  . ALA A 67  ? 0.34914 0.32985 0.52077 0.15265  0.16873  0.16776  67  ALA A CA  
1056 C C   . ALA A 67  ? 0.47446 0.44340 0.67109 0.13883  0.16841  0.14293  67  ALA A C   
1057 O O   . ALA A 67  ? 0.58042 0.54255 0.77690 0.14195  0.16900  0.13614  67  ALA A O   
1058 C CB  . ALA A 67  ? 0.41139 0.35876 0.56123 0.15934  0.19349  0.17615  67  ALA A CB  
1064 N N   . ARG A 68  ? 0.36547 0.33407 0.58564 0.12447  0.16611  0.12582  68  ARG A N   
1065 C CA  . ARG A 68  ? 0.38396 0.34869 0.63501 0.11332  0.15995  0.09608  68  ARG A CA  
1066 C C   . ARG A 68  ? 0.46510 0.44728 0.71177 0.11649  0.13037  0.09166  68  ARG A C   
1067 O O   . ARG A 68  ? 0.45825 0.43217 0.71184 0.11710  0.12508  0.07365  68  ARG A O   
1068 C CB  . ARG A 68  ? 0.41450 0.38359 0.69725 0.09899  0.15985  0.07587  68  ARG A CB  
1069 C CG  . ARG A 68  ? 0.51785 0.45943 0.80566 0.09148  0.19629  0.07287  68  ARG A CG  
1070 C CD  . ARG A 68  ? 0.60665 0.55753 0.92725 0.07643  0.19799  0.05204  68  ARG A CD  
1071 N NE  . ARG A 68  ? 0.89215 0.81079 1.21166 0.06698  0.23897  0.04957  68  ARG A NE  
1072 C CZ  . ARG A 68  ? 1.08241 1.00224 1.42981 0.05165  0.25280  0.02996  68  ARG A CZ  
1073 N NH1 . ARG A 68  ? 1.27432 1.22894 1.65736 0.04591  0.22582  0.00970  68  ARG A NH1 
1074 N NH2 . ARG A 68  ? 1.16355 1.04501 1.50037 0.04235  0.29647  0.03024  68  ARG A NH2 
1088 N N   . MET A 69  ? 0.45377 0.45623 0.68511 0.11865  0.11219  0.10738  69  MET A N   
1089 C CA  . MET A 69  ? 0.42385 0.43298 0.64255 0.12006  0.08723  0.10459  69  MET A CA  
1090 C C   . MET A 69  ? 0.44212 0.44540 0.63545 0.12911  0.09339  0.11415  69  MET A C   
1091 O O   . MET A 69  ? 0.44425 0.43810 0.62515 0.13129  0.08019  0.10310  69  MET A O   
1092 C CB  . MET A 69  ? 0.42085 0.44769 0.63060 0.11691  0.07167  0.11828  69  MET A CB  
1093 C CG  . MET A 69  ? 0.39354 0.42427 0.62685 0.10886  0.05651  0.10218  69  MET A CG  
1094 S SD  . MET A 69  ? 0.39861 0.44827 0.62654 0.10396  0.04413  0.11743  69  MET A SD  
1095 C CE  . MET A 69  ? 0.38386 0.42787 0.57751 0.10572  0.02845  0.12929  69  MET A CE  
1105 N N   . GLU A 70  ? 0.42036 0.42778 0.60354 0.13665  0.11239  0.13291  70  GLU A N   
1106 C CA  . GLU A 70  ? 0.54361 0.54802 0.70756 0.14580  0.11981  0.13894  70  GLU A CA  
1107 C C   . GLU A 70  ? 0.50644 0.48656 0.67639 0.14915  0.13243  0.12304  70  GLU A C   
1108 O O   . GLU A 70  ? 0.65997 0.63303 0.81520 0.15445  0.13236  0.11805  70  GLU A O   
1109 C CB  . GLU A 70  ? 0.47713 0.49900 0.63306 0.15585  0.13201  0.16047  70  GLU A CB  
1110 C CG  . GLU A 70  ? 0.64543 0.65508 0.80406 0.16554  0.15053  0.16702  70  GLU A CG  
1111 C CD  . GLU A 70  ? 0.65229 0.67964 0.79502 0.17511  0.15410  0.18071  70  GLU A CD  
1112 O OE1 . GLU A 70  ? 0.49989 0.55435 0.64373 0.17696  0.14731  0.18582  70  GLU A OE1 
1113 O OE2 . GLU A 70  ? 0.70322 0.71613 0.83337 0.18236  0.16461  0.18531  70  GLU A OE2 
1120 N N   . ASN A 71  ? 0.51103 0.47607 0.70196 0.14475  0.14548  0.11318  71  ASN A N   
1121 C CA  . ASN A 71  ? 0.57318 0.51393 0.77715 0.14362  0.15818  0.09230  71  ASN A CA  
1122 C C   . ASN A 71  ? 0.57541 0.51745 0.79124 0.13821  0.13547  0.06403  71  ASN A C   
1123 O O   . ASN A 71  ? 0.65478 0.58289 0.87368 0.14076  0.13805  0.04550  71  ASN A O   
1124 C CB  . ASN A 71  ? 0.58817 0.50859 0.81272 0.13620  0.18192  0.08617  71  ASN A CB  
1125 C CG  . ASN A 71  ? 0.69885 0.60163 0.89980 0.14795  0.20644  0.11158  71  ASN A CG  
1126 O OD1 . ASN A 71  ? 0.79855 0.70052 0.97716 0.16078  0.20885  0.12415  71  ASN A OD1 
1127 N ND2 . ASN A 71  ? 0.76303 0.65029 0.96418 0.14365  0.22315  0.11756  71  ASN A ND2 
1134 N N   . ARG A 72  ? 0.42548 0.65515 0.64154 0.12397  0.16911  0.02454  72  ARG A N   
1135 C CA  . ARG A 72  ? 0.43725 0.65890 0.66846 0.11700  0.15837  0.00238  72  ARG A CA  
1136 C C   . ARG A 72  ? 0.35640 0.59441 0.57509 0.11913  0.14190  -0.00171 72  ARG A C   
1137 O O   . ARG A 72  ? 0.55098 0.78731 0.77740 0.11377  0.13059  -0.01692 72  ARG A O   
1138 C CB  . ARG A 72  ? 0.36194 0.58471 0.59768 0.10429  0.15611  -0.00744 72  ARG A CB  
1139 C CG  . ARG A 72  ? 0.47834 0.68965 0.72770 0.10079  0.17360  -0.00483 72  ARG A CG  
1140 C CD  . ARG A 72  ? 0.42539 0.64843 0.67243 0.09044  0.17145  -0.01283 72  ARG A CD  
1141 N NE  . ARG A 72  ? 0.63714 0.85839 0.89519 0.08321  0.15456  -0.03343 72  ARG A NE  
1142 C CZ  . ARG A 72  ? 0.56748 0.79860 0.82734 0.07495  0.14675  -0.04439 72  ARG A CZ  
1143 N NH1 . ARG A 72  ? 0.47018 0.71720 0.72014 0.07278  0.15419  -0.04001 72  ARG A NH1 
1144 N NH2 . ARG A 72  ? 0.45365 0.68020 0.72636 0.06973  0.13033  -0.06066 72  ARG A NH2 
1158 N N   . GLY A 73  ? 0.33243 0.58844 0.53256 0.12693  0.14042  0.01263  73  GLY A N   
1159 C CA  . GLY A 73  ? 0.36178 0.63733 0.55092 0.12873  0.12723  0.01129  73  GLY A CA  
1160 C C   . GLY A 73  ? 0.33196 0.62276 0.51257 0.11705  0.11388  0.01097  73  GLY A C   
1161 O O   . GLY A 73  ? 0.36366 0.66668 0.54081 0.11554  0.10247  0.00852  73  GLY A O   
1165 N N   . LEU A 74  ? 0.38672 0.67880 0.56532 0.10909  0.11486  0.01359  74  LEU A N   
1166 C CA  . LEU A 74  ? 0.25730 0.56120 0.43484 0.09779  0.10122  0.01101  74  LEU A CA  
1167 C C   . LEU A 74  ? 0.27149 0.60183 0.43427 0.09776  0.09621  0.02447  74  LEU A C   
1168 O O   . LEU A 74  ? 0.24667 0.58928 0.41158 0.08950  0.08296  0.02504  74  LEU A O   
1169 C CB  . LEU A 74  ? 0.29602 0.58966 0.48437 0.08933  0.10330  0.00062  74  LEU A CB  
1170 C CG  . LEU A 74  ? 0.25701 0.52711 0.46548 0.08644  0.10576  -0.01552 74  LEU A CG  
1171 C CD1 . LEU A 74  ? 0.28920 0.55536 0.50837 0.07858  0.10897  -0.02579 74  LEU A CD1 
1172 C CD2 . LEU A 74  ? 0.37413 0.64134 0.59062 0.08320  0.09043  -0.02397 74  LEU A CD2 
1184 N N   . VAL A 75  ? 0.39553 0.73517 0.54613 0.10677  0.10595  0.03594  75  VAL A N   
1185 C CA  . VAL A 75  ? 0.27484 0.64220 0.41301 0.10818  0.10122  0.04729  75  VAL A CA  
1186 C C   . VAL A 75  ? 0.35482 0.72993 0.48246 0.12294  0.10988  0.06004  75  VAL A C   
1187 O O   . VAL A 75  ? 0.33794 0.69480 0.46849 0.13182  0.12113  0.06114  75  VAL A O   
1188 C CB  . VAL A 75  ? 0.29877 0.67685 0.43284 0.10402  0.10129  0.04603  75  VAL A CB  
1189 C CG1 . VAL A 75  ? 0.26305 0.63191 0.41203 0.09099  0.09325  0.03007  75  VAL A CG1 
1190 C CG2 . VAL A 75  ? 0.33023 0.70188 0.45531 0.11368  0.11720  0.05303  75  VAL A CG2 
1200 N N   . ARG A 76  ? 0.40661 0.80924 0.52594 0.12545  0.10401  0.06925  76  ARG A N   
1201 C CA  . ARG A 76  ? 0.40527 0.82087 0.51559 0.14023  0.11024  0.08132  76  ARG A CA  
1202 C C   . ARG A 76  ? 0.41420 0.85673 0.51428 0.14134  0.10665  0.08975  76  ARG A C   
1203 O O   . ARG A 76  ? 0.38759 0.84322 0.49025 0.12980  0.09702  0.08456  76  ARG A O   
1204 C CB  . ARG A 76  ? 0.33365 0.76217 0.44537 0.14457  0.10629  0.08222  76  ARG A CB  
1205 C CG  . ARG A 76  ? 0.39429 0.85002 0.50759 0.13376  0.09445  0.08412  76  ARG A CG  
1206 C CD  . ARG A 76  ? 0.58760 1.05443 0.69766 0.13740  0.09156  0.08576  76  ARG A CD  
1207 N NE  . ARG A 76  ? 0.57114 1.06697 0.68344 0.12702  0.08214  0.09254  76  ARG A NE  
1208 C CZ  . ARG A 76  ? 0.42482 0.94282 0.53247 0.12744  0.07836  0.10060  76  ARG A CZ  
1209 N NH1 . ARG A 76  ? 0.48954 1.00654 0.58784 0.13923  0.08213  0.10352  76  ARG A NH1 
1210 N NH2 . ARG A 76  ? 0.55915 1.10240 0.67447 0.11586  0.07048  0.10694  76  ARG A NH2 
1224 N N   . ARG A 77  ? 0.47488 0.92212 0.56429 0.15489  0.11195  0.10130  77  ARG A N   
1225 C CA  . ARG A 77  ? 0.40391 0.87719 0.48150 0.15845  0.10796  0.10892  77  ARG A CA  
1226 C C   . ARG A 77  ? 0.40441 0.89174 0.47502 0.17154  0.10613  0.12002  77  ARG A C   
1227 O O   . ARG A 77  ? 0.44985 0.92119 0.52293 0.18210  0.11255  0.12426  77  ARG A O   
1228 C CB  . ARG A 77  ? 0.40912 0.87600 0.47761 0.16302  0.11741  0.11368  77  ARG A CB  
1229 C CG  . ARG A 77  ? 0.41189 0.86662 0.48715 0.14970  0.11835  0.10012  77  ARG A CG  
1230 C CD  . ARG A 77  ? 0.37508 0.83115 0.43829 0.15358  0.12758  0.10489  77  ARG A CD  
1231 N NE  . ARG A 77  ? 0.34302 0.77275 0.40675 0.16232  0.14358  0.11713  77  ARG A NE  
1232 C CZ  . ARG A 77  ? 0.36364 0.79257 0.41704 0.16742  0.15528  0.12811  77  ARG A CZ  
1233 N NH1 . ARG A 77  ? 0.41114 0.86527 0.44852 0.16572  0.15173  0.12617  77  ARG A NH1 
1234 N NH2 . ARG A 77  ? 0.44808 0.85017 0.50865 0.17389  0.17002  0.14086  77  ARG A NH2 
1248 N N   . GLU A 78  ? 0.40613 0.92598 0.47166 0.17125  0.09686  0.12264  78  GLU A N   
1249 C CA  . GLU A 78  ? 0.56210 1.10193 0.62164 0.18420  0.09396  0.13257  78  GLU A CA  
1250 C C   . GLU A 78  ? 0.48928 1.05663 0.53726 0.19174  0.09122  0.13924  78  GLU A C   
1251 O O   . GLU A 78  ? 0.48645 1.06573 0.53313 0.18328  0.08777  0.13179  78  GLU A O   
1252 C CB  . GLU A 78  ? 0.41891 0.97818 0.48624 0.17628  0.08414  0.12814  78  GLU A CB  
1253 C CG  . GLU A 78  ? 0.49687 1.03640 0.57130 0.17238  0.08683  0.12295  78  GLU A CG  
1254 C CD  . GLU A 78  ? 0.57493 1.13678 0.65569 0.16239  0.07860  0.12096  78  GLU A CD  
1255 O OE1 . GLU A 78  ? 0.45857 1.04953 0.54009 0.16099  0.07175  0.12445  78  GLU A OE1 
1256 O OE2 . GLU A 78  ? 0.46298 1.01545 0.54855 0.15609  0.07934  0.11640  78  GLU A OE2 
1263 N N   . HIS A 79  ? 0.50299 1.08348 0.54344 0.20915  0.09238  0.15219  79  HIS A N   
1264 C CA  . HIS A 79  ? 0.52590 1.13509 0.55264 0.22118  0.09076  0.16167  79  HIS A CA  
1265 C C   . HIS A 79  ? 0.53859 1.18792 0.56659 0.22356  0.07776  0.15964  79  HIS A C   
1266 O O   . HIS A 79  ? 0.48211 1.13290 0.51917 0.22061  0.07354  0.15675  79  HIS A O   
1267 C CB  . HIS A 79  ? 0.43814 1.03523 0.45687 0.24236  0.10285  0.18206  79  HIS A CB  
1268 C CG  . HIS A 79  ? 0.64823 1.20379 0.67142 0.24022  0.11727  0.18503  79  HIS A CG  
1269 N ND1 . HIS A 79  ? 0.58600 1.11049 0.62517 0.23501  0.12112  0.17707  79  HIS A ND1 
1270 C CD2 . HIS A 79  ? 0.67417 1.21606 0.68871 0.24204  0.12888  0.19430  79  HIS A CD2 
1271 C CE1 . HIS A 79  ? 0.52399 1.01784 0.56791 0.23428  0.13416  0.18026  79  HIS A CE1 
1272 N NE2 . HIS A 79  ? 0.73074 1.23340 0.76013 0.23769  0.13988  0.19181  79  HIS A NE2 
1280 N N   . ASP A 80  ? 0.55151 1.22399 0.46907 0.28189  0.13927  0.06549  80  ASP A N   
1281 C CA  . ASP A 80  ? 0.65098 1.34442 0.58785 0.28702  0.14008  0.08171  80  ASP A CA  
1282 C C   . ASP A 80  ? 0.58497 1.26510 0.52935 0.30482  0.15307  0.07404  80  ASP A C   
1283 O O   . ASP A 80  ? 0.55976 1.21449 0.50929 0.31271  0.15534  0.06778  80  ASP A O   
1284 C CB  . ASP A 80  ? 0.51729 1.21655 0.47190 0.28042  0.12875  0.10096  80  ASP A CB  
1285 C CG  . ASP A 80  ? 0.56271 1.28596 0.53601 0.28331  0.12755  0.11914  80  ASP A CG  
1286 O OD1 . ASP A 80  ? 0.63335 1.36220 0.61129 0.29526  0.13746  0.11687  80  ASP A OD1 
1287 O OD2 . ASP A 80  ? 0.62076 1.35642 0.60407 0.27301  0.11710  0.13609  80  ASP A OD2 
1292 N N   . ALA A 81  ? 0.57299 1.26884 0.51902 0.31108  0.16216  0.07507  81  ALA A N   
1293 C CA  . ALA A 81  ? 0.59525 1.27938 0.55121 0.32757  0.17591  0.07014  81  ALA A CA  
1294 C C   . ALA A 81  ? 0.57851 1.25943 0.55896 0.33386  0.17148  0.08488  81  ALA A C   
1295 O O   . ALA A 81  ? 0.59328 1.25396 0.58229 0.34646  0.18032  0.07919  81  ALA A O   
1296 C CB  . ALA A 81  ? 0.61382 1.31949 0.57157 0.33214  0.18591  0.07385  81  ALA A CB  
1302 N N   . ALA A 82  ? 0.61853 1.31794 0.60984 0.32426  0.15785  0.10393  82  ALA A N   
1303 C CA  . ALA A 82  ? 0.61000 1.30740 0.62187 0.32775  0.15211  0.11883  82  ALA A CA  
1304 C C   . ALA A 82  ? 0.67893 1.34678 0.68779 0.32684  0.14712  0.11161  82  ALA A C   
1305 O O   . ALA A 82  ? 0.66058 1.30843 0.67954 0.33736  0.15099  0.10992  82  ALA A O   
1306 C CB  . ALA A 82  ? 0.51063 1.23758 0.53307 0.31619  0.13989  0.14130  82  ALA A CB  
1312 N N   . ASP A 83  ? 0.80504 1.46906 0.80109 0.31424  0.13884  0.10811  83  ASP A N   
1313 C CA  . ASP A 83  ? 0.76510 1.40229 0.75903 0.31183  0.13352  0.10327  83  ASP A CA  
1314 C C   . ASP A 83  ? 0.71933 1.33741 0.69122 0.30573  0.13447  0.08421  83  ASP A C   
1315 O O   . ASP A 83  ? 0.72033 1.34315 0.68245 0.28970  0.12510  0.08716  83  ASP A O   
1316 C CB  . ASP A 83  ? 0.76679 1.41084 0.76783 0.29719  0.11904  0.12147  83  ASP A CB  
1317 C CG  . ASP A 83  ? 0.69876 1.30415 0.70023 0.29343  0.11130  0.12022  83  ASP A CG  
1318 O OD1 . ASP A 83  ? 0.76036 1.33349 0.75271 0.29739  0.11465  0.10361  83  ASP A OD1 
1319 O OD2 . ASP A 83  ? 0.79669 1.40354 0.80690 0.28589  0.10202  0.13593  83  ASP A OD2 
1324 N N   . LYS A 84  ? 0.54719 1.14116 0.51151 0.31699  0.14487  0.06525  84  LYS A N   
1325 C CA  . LYS A 84  ? 0.69664 1.27244 0.63829 0.31024  0.14549  0.04615  84  LYS A CA  
1326 C C   . LYS A 84  ? 0.73987 1.28732 0.67599 0.29525  0.13144  0.04501  84  LYS A C   
1327 O O   . LYS A 84  ? 0.78656 1.31977 0.70562 0.28719  0.12924  0.03154  84  LYS A O   
1328 C CB  . LYS A 84  ? 0.66607 1.22027 0.60116 0.32545  0.16068  0.02575  84  LYS A CB  
1329 C CG  . LYS A 84  ? 0.69566 1.26640 0.62637 0.33248  0.17341  0.02107  84  LYS A CG  
1330 C CD  . LYS A 84  ? 0.63676 1.18570 0.54441 0.33467  0.18400  -0.00416 84  LYS A CD  
1331 C CE  . LYS A 84  ? 0.79582 1.34998 0.70144 0.34320  0.19943  -0.01013 84  LYS A CE  
1332 N NZ  . LYS A 84  ? 0.96145 1.48796 0.84475 0.34560  0.21142  -0.03602 84  LYS A NZ  
1345 N N   . ARG A 85  ? 0.87992 1.41815 0.82968 0.29099  0.12229  0.05891  85  ARG A N   
1346 C CA  . ARG A 85  ? 0.96313 1.47932 0.90889 0.27510  0.10969  0.06155  85  ARG A CA  
1347 C C   . ARG A 85  ? 0.86852 1.41013 0.80828 0.25907  0.10211  0.07112  85  ARG A C   
1348 O O   . ARG A 85  ? 0.97203 1.50299 0.90120 0.24727  0.09632  0.06576  85  ARG A O   
1349 C CB  . ARG A 85  ? 1.12851 1.62846 1.08823 0.27426  0.10342  0.07444  85  ARG A CB  
1350 C CG  . ARG A 85  ? 1.17463 1.64146 1.13965 0.28713  0.10853  0.06530  85  ARG A CG  
1351 C CD  . ARG A 85  ? 1.13375 1.61600 1.11376 0.30272  0.11574  0.07309  85  ARG A CD  
1352 N NE  . ARG A 85  ? 1.14062 1.59154 1.12820 0.31391  0.11931  0.06830  85  ARG A NE  
1353 C CZ  . ARG A 85  ? 1.17265 1.60598 1.16753 0.31051  0.11191  0.07905  85  ARG A CZ  
1354 N NH1 . ARG A 85  ? 1.17450 1.61547 1.16899 0.29552  0.10086  0.09413  85  ARG A NH1 
1355 N NH2 . ARG A 85  ? 1.20800 1.61453 1.20993 0.32215  0.11641  0.07453  85  ARG A NH2 
1369 N N   . ARG A 86  ? 0.60311 1.17930 0.55117 0.25839  0.10202  0.08642  86  ARG A N   
1370 C CA  . ARG A 86  ? 0.55834 1.16299 0.50188 0.24511  0.09703  0.09582  86  ARG A CA  
1371 C C   . ARG A 86  ? 0.58869 1.20178 0.51463 0.24497  0.10202  0.08154  86  ARG A C   
1372 O O   . ARG A 86  ? 0.64847 1.26787 0.56881 0.25807  0.11332  0.07022  86  ARG A O   
1373 C CB  . ARG A 86  ? 0.79657 1.43823 0.75279 0.24775  0.09868  0.11257  86  ARG A CB  
1374 C CG  . ARG A 86  ? 0.86232 1.54066 0.81444 0.23923  0.09806  0.12054  86  ARG A CG  
1375 C CD  . ARG A 86  ? 0.88475 1.59677 0.85279 0.24083  0.09844  0.13889  86  ARG A CD  
1376 N NE  . ARG A 86  ? 0.93666 1.63677 0.91640 0.23326  0.08947  0.15231  86  ARG A NE  
1377 C CZ  . ARG A 86  ? 0.88143 1.60477 0.87525 0.23165  0.08692  0.16919  86  ARG A CZ  
1378 N NH1 . ARG A 86  ? 0.82884 1.57823 0.82777 0.23544  0.08861  0.17489  86  ARG A NH1 
1379 N NH2 . ARG A 86  ? 0.81092 1.51880 0.81089 0.22257  0.07836  0.17962  86  ARG A NH2 
1393 N N   . ARG A 87  ? 0.51323 1.07577 0.65081 0.17177  0.03344  0.15236  87  ARG A N   
1394 C CA  . ARG A 87  ? 0.40827 0.94786 0.54987 0.16770  0.04437  0.14754  87  ARG A CA  
1395 C C   . ARG A 87  ? 0.29614 0.84738 0.43818 0.13819  0.04529  0.14070  87  ARG A C   
1396 O O   . ARG A 87  ? 0.38471 0.94378 0.51898 0.12225  0.03847  0.14308  87  ARG A O   
1397 C CB  . ARG A 87  ? 0.45262 0.93421 0.58135 0.18018  0.05104  0.15580  87  ARG A CB  
1398 C CG  . ARG A 87  ? 0.67679 1.13767 0.80830 0.20027  0.05960  0.15453  87  ARG A CG  
1399 C CD  . ARG A 87  ? 0.62604 1.03000 0.74156 0.21141  0.06575  0.16239  87  ARG A CD  
1400 N NE  . ARG A 87  ? 0.74420 1.13575 0.84578 0.21828  0.05996  0.17153  87  ARG A NE  
1401 C CZ  . ARG A 87  ? 0.84232 1.18728 0.92786 0.22789  0.06524  0.17798  87  ARG A CZ  
1402 N NH1 . ARG A 87  ? 0.79861 1.10572 0.88007 0.23247  0.07574  0.17663  87  ARG A NH1 
1403 N NH2 . ARG A 87  ? 0.72648 1.06208 0.79874 0.23139  0.06048  0.18500  87  ARG A NH2 
1417 N N   . PHE A 88  ? 0.38232 0.93256 0.53097 0.13006  0.05435  0.13165  88  PHE A N   
1418 C CA  . PHE A 88  ? 0.32377 0.87731 0.46761 0.10069  0.05773  0.12368  88  PHE A CA  
1419 C C   . PHE A 88  ? 0.34486 0.85182 0.48071 0.09995  0.06742  0.12456  88  PHE A C   
1420 O O   . PHE A 88  ? 0.27805 0.76248 0.41803 0.11935  0.07405  0.12607  88  PHE A O   
1421 C CB  . PHE A 88  ? 0.26136 0.85441 0.41597 0.08757  0.06101  0.11015  88  PHE A CB  
1422 C CG  . PHE A 88  ? 0.35880 0.99934 0.52578 0.09445  0.05268  0.10802  88  PHE A CG  
1423 C CD1 . PHE A 88  ? 0.39886 1.06793 0.56062 0.07538  0.04363  0.10633  88  PHE A CD1 
1424 C CD2 . PHE A 88  ? 0.34342 0.99850 0.52560 0.11989  0.05378  0.10735  88  PHE A CD2 
1425 C CE1 . PHE A 88  ? 0.48615 1.19974 0.65883 0.08151  0.03577  0.10367  88  PHE A CE1 
1426 C CE2 . PHE A 88  ? 0.35219 1.05144 0.54574 0.12717  0.04561  0.10490  88  PHE A CE2 
1427 C CZ  . PHE A 88  ? 0.49623 1.22576 0.68558 0.10799  0.03653  0.10293  88  PHE A CZ  
1437 N N   . VAL A 89  ? 0.32597 0.81168 0.44540 0.07616  0.06721  0.12259  89  VAL A N   
1438 C CA  . VAL A 89  ? 0.38266 0.80847 0.48552 0.07363  0.07039  0.12263  89  VAL A CA  
1439 C C   . VAL A 89  ? 0.23718 0.64836 0.32417 0.04761  0.07407  0.11186  89  VAL A C   
1440 O O   . VAL A 89  ? 0.34176 0.76543 0.41647 0.02380  0.06970  0.10687  89  VAL A O   
1441 C CB  . VAL A 89  ? 0.40400 0.79364 0.49154 0.07164  0.06170  0.12941  89  VAL A CB  
1442 C CG1 . VAL A 89  ? 0.31277 0.64812 0.39185 0.07718  0.06542  0.13000  89  VAL A CG1 
1443 C CG2 . VAL A 89  ? 0.31377 0.72443 0.41101 0.09073  0.05655  0.13955  89  VAL A CG2 
1453 N N   . TRP A 90  ? 0.33512 0.71667 0.41904 0.05159  0.08224  0.10826  90  TRP A N   
1454 C CA  . TRP A 90  ? 0.35632 0.71071 0.41903 0.02902  0.08505  0.09910  90  TRP A CA  
1455 C C   . TRP A 90  ? 0.33141 0.62765 0.37990 0.03268  0.08316  0.10031  90  TRP A C   
1456 O O   . TRP A 90  ? 0.37896 0.66046 0.43839 0.05349  0.08479  0.10630  90  TRP A O   
1457 C CB  . TRP A 90  ? 0.36349 0.74068 0.43465 0.02761  0.09782  0.09081  90  TRP A CB  
1458 C CG  . TRP A 90  ? 0.46531 0.90260 0.55108 0.01941  0.10120  0.08568  90  TRP A CG  
1459 C CD1 . TRP A 90  ? 0.43446 0.88617 0.50658 -0.00922 0.10413  0.07599  90  TRP A CD1 
1460 C CD2 . TRP A 90  ? 0.43678 0.92413 0.55186 0.03944  0.10068  0.08823  90  TRP A CD2 
1461 N NE1 . TRP A 90  ? 0.49684 1.00111 0.58974 -0.00915 0.10405  0.07044  90  TRP A NE1 
1462 C CE2 . TRP A 90  ? 0.47989 1.00527 0.59867 0.02119  0.10031  0.07759  90  TRP A CE2 
1463 C CE3 . TRP A 90  ? 0.39415 0.88474 0.52644 0.07024  0.09726  0.09683  90  TRP A CE3 
1464 C CZ2 . TRP A 90  ? 0.45184 1.02323 0.59396 0.03385  0.09615  0.07538  90  TRP A CZ2 
1465 C CZ3 . TRP A 90  ? 0.44219 0.97357 0.59288 0.08276  0.09246  0.09535  90  TRP A CZ3 
1466 C CH2 . TRP A 90  ? 0.49279 1.06659 0.65000 0.06526  0.09171  0.08466  90  TRP A CH2 
1477 N N   . LEU A 91  ? 0.43205 0.69462 0.45466 0.01195  0.07966  0.09395  91  LEU A N   
1478 C CA  . LEU A 91  ? 0.37914 0.59123 0.38933 0.01446  0.07802  0.09226  91  LEU A CA  
1479 C C   . LEU A 91  ? 0.39123 0.59870 0.40436 0.01938  0.08974  0.08703  91  LEU A C   
1480 O O   . LEU A 91  ? 0.44619 0.67783 0.45832 0.01001  0.09776  0.08129  91  LEU A O   
1481 C CB  . LEU A 91  ? 0.44182 0.61750 0.42067 -0.00706 0.06810  0.08731  91  LEU A CB  
1482 C CG  . LEU A 91  ? 0.36630 0.52957 0.33713 -0.01070 0.05577  0.09119  91  LEU A CG  
1483 C CD1 . LEU A 91  ? 0.42800 0.54814 0.36523 -0.02836 0.04640  0.08518  91  LEU A CD1 
1484 C CD2 . LEU A 91  ? 0.38835 0.54126 0.37717 0.00946  0.05365  0.09744  91  LEU A CD2 
1496 N N   . THR A 92  ? 0.39530 0.57230 0.41199 0.03321  0.09174  0.08819  92  THR A N   
1497 C CA  . THR A 92  ? 0.34112 0.50286 0.35415 0.03539  0.10179  0.08224  92  THR A CA  
1498 C C   . THR A 92  ? 0.40441 0.52641 0.38656 0.01518  0.09595  0.07448  92  THR A C   
1499 O O   . THR A 92  ? 0.45846 0.56051 0.42365 0.00344  0.08343  0.07433  92  THR A O   
1500 C CB  . THR A 92  ? 0.44406 0.58685 0.47052 0.05683  0.10675  0.08595  92  THR A CB  
1501 O OG1 . THR A 92  ? 0.48731 0.59398 0.50599 0.05500  0.09658  0.08682  92  THR A OG1 
1502 C CG2 . THR A 92  ? 0.47670 0.65241 0.52788 0.07832  0.11163  0.09454  92  THR A CG2 
1510 N N   . ALA A 93  ? 0.46384 0.57222 0.43643 0.01202  0.10492  0.06781  93  ALA A N   
1511 C CA  . ALA A 93  ? 0.53657 0.60245 0.47621 -0.00535 0.09881  0.06065  93  ALA A CA  
1512 C C   . ALA A 93  ? 0.41237 0.44042 0.34606 -0.00133 0.08477  0.06196  93  ALA A C   
1513 O O   . ALA A 93  ? 0.48962 0.49213 0.39942 -0.01437 0.07175  0.05954  93  ALA A O   
1514 C CB  . ALA A 93  ? 0.50789 0.56160 0.43967 -0.00579 0.11136  0.05378  93  ALA A CB  
1520 N N   . GLU A 94  ? 0.41809 0.44200 0.37297 0.01689  0.08756  0.06517  94  GLU A N   
1521 C CA  . GLU A 94  ? 0.48080 0.47617 0.43597 0.02074  0.07568  0.06520  94  GLU A CA  
1522 C C   . GLU A 94  ? 0.56408 0.56886 0.52129 0.01778  0.06435  0.06974  94  GLU A C   
1523 O O   . GLU A 94  ? 0.58219 0.56167 0.52408 0.01033  0.05066  0.06642  94  GLU A O   
1524 C CB  . GLU A 94  ? 0.48637 0.47939 0.46437 0.03900  0.08383  0.06787  94  GLU A CB  
1525 C CG  . GLU A 94  ? 0.68517 0.65827 0.67101 0.04357  0.07441  0.06774  94  GLU A CG  
1526 C CD  . GLU A 94  ? 0.78580 0.72236 0.75520 0.03524  0.06406  0.05838  94  GLU A CD  
1527 O OE1 . GLU A 94  ? 0.72029 0.64220 0.66586 0.02394  0.06125  0.05292  94  GLU A OE1 
1528 O OE2 . GLU A 94  ? 0.90013 0.82299 0.88000 0.03973  0.05859  0.05594  94  GLU A OE2 
1535 N N   . GLY A 95  ? 0.46717 0.50789 0.44209 0.02428  0.06935  0.07695  95  GLY A N   
1536 C CA  . GLY A 95  ? 0.41493 0.46469 0.38989 0.02061  0.05960  0.08110  95  GLY A CA  
1537 C C   . GLY A 95  ? 0.40877 0.44239 0.35416 0.00094  0.04902  0.07641  95  GLY A C   
1538 O O   . GLY A 95  ? 0.42077 0.43524 0.35670 -0.00238 0.03685  0.07577  95  GLY A O   
1542 N N   . GLU A 96  ? 0.41817 0.45742 0.34665 -0.01252 0.05429  0.07253  96  GLU A N   
1543 C CA  . GLU A 96  ? 0.49315 0.51023 0.38656 -0.03300 0.04556  0.06794  96  GLU A CA  
1544 C C   . GLU A 96  ? 0.48206 0.45012 0.35339 -0.03448 0.03316  0.06272  96  GLU A C   
1545 O O   . GLU A 96  ? 0.54065 0.48419 0.38904 -0.04243 0.02007  0.06123  96  GLU A O   
1546 C CB  . GLU A 96  ? 0.50404 0.53406 0.38222 -0.04856 0.05622  0.06351  96  GLU A CB  
1547 C CG  . GLU A 96  ? 0.53757 0.62228 0.44061 -0.04662 0.06739  0.06693  96  GLU A CG  
1548 C CD  . GLU A 96  ? 0.63964 0.74035 0.52359 -0.06923 0.07459  0.06126  96  GLU A CD  
1549 O OE1 . GLU A 96  ? 0.83168 0.90426 0.68737 -0.08301 0.07764  0.05448  96  GLU A OE1 
1550 O OE2 . GLU A 96  ? 0.68029 0.82187 0.57649 -0.07426 0.07742  0.06305  96  GLU A OE2 
1557 N N   . LYS A 97  ? 0.45300 0.40593 0.33047 -0.02602 0.03643  0.05946  97  LYS A N   
1558 C CA  . LYS A 97  ? 0.46188 0.37217 0.32156 -0.02598 0.02319  0.05363  97  LYS A CA  
1559 C C   . LYS A 97  ? 0.41589 0.32143 0.29151 -0.01531 0.01150  0.05504  97  LYS A C   
1560 O O   . LYS A 97  ? 0.43230 0.30951 0.28813 -0.01875 -0.00398 0.05113  97  LYS A O   
1561 C CB  . LYS A 97  ? 0.52835 0.42703 0.39364 -0.01966 0.03009  0.04938  97  LYS A CB  
1562 C CG  . LYS A 97  ? 0.57740 0.47759 0.42528 -0.03020 0.04255  0.04639  97  LYS A CG  
1563 C CD  . LYS A 97  ? 0.66823 0.54272 0.50953 -0.02719 0.04516  0.04027  97  LYS A CD  
1564 C CE  . LYS A 97  ? 0.68221 0.56638 0.51580 -0.03356 0.06255  0.03767  97  LYS A CE  
1565 N NZ  . LYS A 97  ? 0.80981 0.66336 0.63000 -0.03316 0.06469  0.03091  97  LYS A NZ  
1579 N N   . VAL A 98  ? 0.44251 0.37450 0.35271 -0.00173 0.01910  0.06022  98  VAL A N   
1580 C CA  . VAL A 98  ? 0.35043 0.28054 0.27729 0.00732  0.01095  0.06092  98  VAL A CA  
1581 C C   . VAL A 98  ? 0.41640 0.34676 0.32895 0.00008  0.00144  0.06291  98  VAL A C   
1582 O O   . VAL A 98  ? 0.41702 0.32838 0.32474 0.00203  -0.01142 0.05914  98  VAL A O   
1583 C CB  . VAL A 98  ? 0.36614 0.32233 0.32699 0.02127  0.02328  0.06699  98  VAL A CB  
1584 C CG1 . VAL A 98  ? 0.37686 0.33470 0.35246 0.02760  0.01723  0.06810  98  VAL A CG1 
1585 C CG2 . VAL A 98  ? 0.47001 0.41701 0.44222 0.02875  0.03141  0.06373  98  VAL A CG2 
1595 N N   . LEU A 99  ? 0.41061 0.36363 0.31687 -0.00816 0.00780  0.06805  99  LEU A N   
1596 C CA  . LEU A 99  ? 0.39175 0.34426 0.28173 -0.01708 0.00006  0.06976  99  LEU A CA  
1597 C C   . LEU A 99  ? 0.45589 0.36846 0.30619 -0.02928 -0.01294 0.06352  99  LEU A C   
1598 O O   . LEU A 99  ? 0.50399 0.39785 0.34155 -0.02963 -0.02477 0.06202  99  LEU A O   
1599 C CB  . LEU A 99  ? 0.40312 0.39087 0.29472 -0.02536 0.00988  0.07515  99  LEU A CB  
1600 C CG  . LEU A 99  ? 0.41960 0.41074 0.29537 -0.03605 0.00373  0.07716  99  LEU A CG  
1601 C CD1 . LEU A 99  ? 0.47018 0.46047 0.36250 -0.02391 -0.00205 0.07980  99  LEU A CD1 
1602 C CD2 . LEU A 99  ? 0.36036 0.39259 0.24186 -0.04455 0.01344  0.08123  99  LEU A CD2 
1614 N N   . ALA A 100 ? 0.42606 0.32264 0.25382 -0.03888 -0.01070 0.05971  100 ALA A N   
1615 C CA  . ALA A 100 ? 0.46460 0.31697 0.24849 -0.05018 -0.02332 0.05419  100 ALA A CA  
1616 C C   . ALA A 100 ? 0.48308 0.30537 0.26656 -0.03785 -0.03992 0.04936  100 ALA A C   
1617 O O   . ALA A 100 ? 0.61153 0.40343 0.36672 -0.04085 -0.05396 0.04680  100 ALA A O   
1618 C CB  . ALA A 100 ? 0.53336 0.37177 0.29470 -0.06087 -0.01692 0.05045  100 ALA A CB  
1624 N N   . ALA A 101 ? 0.52235 0.35297 0.33696 -0.02372 -0.03843 0.04732  101 ALA A N   
1625 C CA  . ALA A 101 ? 0.49771 0.30633 0.31725 -0.01229 -0.05382 0.04074  101 ALA A CA  
1626 C C   . ALA A 101 ? 0.47112 0.29002 0.30864 -0.00379 -0.05938 0.04174  101 ALA A C   
1627 O O   . ALA A 101 ? 0.49125 0.28696 0.31959 0.00218  -0.07536 0.03573  101 ALA A O   
1628 C CB  . ALA A 101 ? 0.49301 0.31006 0.34153 -0.00242 -0.04867 0.03724  101 ALA A CB  
1634 N N   . ALA A 102 ? 0.41643 0.26925 0.27826 -0.00240 -0.04683 0.04881  102 ALA A N   
1635 C CA  . ALA A 102 ? 0.42623 0.28990 0.30718 0.00583  -0.04967 0.04954  102 ALA A CA  
1636 C C   . ALA A 102 ? 0.45058 0.29784 0.30176 -0.00155 -0.05888 0.05012  102 ALA A C   
1637 O O   . ALA A 102 ? 0.50900 0.34853 0.36510 0.00620  -0.06755 0.04659  102 ALA A O   
1638 C CB  . ALA A 102 ? 0.40088 0.30275 0.31373 0.01012  -0.03342 0.05736  102 ALA A CB  
1644 N N   . ILE A 103 ? 0.44809 0.28978 0.26799 -0.01716 -0.05602 0.05371  103 ILE A N   
1645 C CA  . ILE A 103 ? 0.50188 0.32753 0.29078 -0.02685 -0.06232 0.05468  103 ILE A CA  
1646 C C   . ILE A 103 ? 0.51684 0.30111 0.28262 -0.02036 -0.08057 0.04758  103 ILE A C   
1647 O O   . ILE A 103 ? 0.56635 0.34724 0.33277 -0.01554 -0.08562 0.04693  103 ILE A O   
1648 C CB  . ILE A 103 ? 0.52781 0.35012 0.28374 -0.04733 -0.05603 0.05734  103 ILE A CB  
1649 C CG1 . ILE A 103 ? 0.49789 0.36811 0.27900 -0.05228 -0.03953 0.06406  103 ILE A CG1 
1650 C CG2 . ILE A 103 ? 0.53960 0.32904 0.25133 -0.05940 -0.06513 0.05606  103 ILE A CG2 
1651 C CD1 . ILE A 103 ? 0.44698 0.32347 0.20477 -0.07202 -0.03080 0.06460  103 ILE A CD1 
1663 N N   . PRO A 104 ? 0.51532 0.26591 0.25729 -0.01967 -0.09147 0.04197  104 PRO A N   
1664 C CA  . PRO A 104 ? 0.52563 0.23703 0.24537 -0.01027 -0.11108 0.03491  104 PRO A CA  
1665 C C   . PRO A 104 ? 0.52179 0.24959 0.28327 0.00951  -0.11645 0.02943  104 PRO A C   
1666 O O   . PRO A 104 ? 0.51465 0.22275 0.26737 0.01902  -0.12959 0.02423  104 PRO A O   
1667 C CB  . PRO A 104 ? 0.52862 0.20571 0.21738 -0.01335 -0.12030 0.03068  104 PRO A CB  
1668 C CG  . PRO A 104 ? 0.54073 0.24711 0.25401 -0.01793 -0.10513 0.03340  104 PRO A CG  
1669 C CD  . PRO A 104 ? 0.46810 0.21425 0.20123 -0.02645 -0.08672 0.04145  104 PRO A CD  
1677 N N   . ILE A 105 ? 0.57218 0.33483 0.37806 0.01575  -0.10577 0.02977  105 ILE A N   
1678 C CA  . ILE A 105 ? 0.46568 0.24694 0.31264 0.03145  -0.10758 0.02386  105 ILE A CA  
1679 C C   . ILE A 105 ? 0.48474 0.28224 0.34281 0.03269  -0.10140 0.02736  105 ILE A C   
1680 O O   . ILE A 105 ? 0.55051 0.34096 0.41469 0.04312  -0.11043 0.02076  105 ILE A O   
1681 C CB  . ILE A 105 ? 0.41288 0.22310 0.29907 0.03489  -0.09525 0.02386  105 ILE A CB  
1682 C CG1 . ILE A 105 ? 0.47922 0.27071 0.35146 0.03293  -0.10160 0.01958  105 ILE A CG1 
1683 C CG2 . ILE A 105 ? 0.40387 0.23367 0.33176 0.04799  -0.09473 0.01682  105 ILE A CG2 
1684 C CD1 . ILE A 105 ? 0.42536 0.18923 0.28685 0.04269  -0.12343 0.00818  105 ILE A CD1 
1696 N N   . GLY A 106 ? 0.45930 0.27947 0.31991 0.02258  -0.08623 0.03717  106 GLY A N   
1697 C CA  . GLY A 106 ? 0.41997 0.25403 0.28650 0.02209  -0.08061 0.04098  106 GLY A CA  
1698 C C   . GLY A 106 ? 0.50348 0.30545 0.33196 0.01864  -0.09257 0.03854  106 GLY A C   
1699 O O   . GLY A 106 ? 0.50220 0.30245 0.33725 0.02624  -0.09556 0.03504  106 GLY A O   
1703 N N   . ASP A 107 ? 0.49795 0.27154 0.28371 0.00662  -0.09854 0.03994  107 ASP A N   
1704 C CA  . ASP A 107 ? 0.52185 0.25623 0.26392 0.00275  -0.11018 0.03745  107 ASP A CA  
1705 C C   . ASP A 107 ? 0.50350 0.21557 0.24965 0.02188  -0.12604 0.02744  107 ASP A C   
1706 O O   . ASP A 107 ? 0.62190 0.32053 0.35753 0.02662  -0.13069 0.02484  107 ASP A O   
1707 C CB  . ASP A 107 ? 0.62013 0.32118 0.31342 -0.01274 -0.11451 0.03893  107 ASP A CB  
1708 C CG  . ASP A 107 ? 0.54434 0.26585 0.22684 -0.03418 -0.09945 0.04702  107 ASP A CG  
1709 O OD1 . ASP A 107 ? 0.52173 0.27883 0.22908 -0.03609 -0.08855 0.05188  107 ASP A OD1 
1710 O OD2 . ASP A 107 ? 0.63144 0.33909 0.28854 -0.04882 -0.09645 0.04592  107 ASP A OD2 
1715 N N   . SER A 108 ? 0.53667 0.24682 0.29985 0.03357  -0.13437 0.02084  108 SER A N   
1716 C CA  . SER A 108 ? 0.56131 0.25407 0.33054 0.05283  -0.15137 0.00964  108 SER A CA  
1717 C C   . SER A 108 ? 0.58607 0.31216 0.40263 0.06514  -0.14491 0.00489  108 SER A C   
1718 O O   . SER A 108 ? 0.63446 0.34822 0.45251 0.07936  -0.15603 -0.00391 108 SER A O   
1719 C CB  . SER A 108 ? 0.58136 0.26669 0.35708 0.06065  -0.16258 0.00302  108 SER A CB  
1720 O OG  . SER A 108 ? 0.77608 0.50184 0.60623 0.06805  -0.15427 -0.00087 108 SER A OG  
1726 N N   . VAL A 109 ? 0.50646 0.27315 0.36056 0.06057  -0.12684 0.00998  109 VAL A N   
1727 C CA  . VAL A 109 ? 0.45632 0.25149 0.34888 0.06862  -0.11763 0.00669  109 VAL A CA  
1728 C C   . VAL A 109 ? 0.51492 0.30028 0.38558 0.06455  -0.11511 0.01022  109 VAL A C   
1729 O O   . VAL A 109 ? 0.57616 0.35995 0.45715 0.07558  -0.11838 0.00250  109 VAL A O   
1730 C CB  . VAL A 109 ? 0.44138 0.27507 0.37042 0.06370  -0.09856 0.01284  109 VAL A CB  
1731 C CG1 . VAL A 109 ? 0.51112 0.36947 0.47095 0.06850  -0.08668 0.01130  109 VAL A CG1 
1732 C CG2 . VAL A 109 ? 0.44139 0.28289 0.39406 0.06891  -0.10085 0.00692  109 VAL A CG2 
1742 N N   . ASP A 110 ? 0.46664 0.24645 0.30712 0.04806  -0.10877 0.02096  110 ASP A N   
1743 C CA  . ASP A 110 ? 0.47928 0.24455 0.29151 0.04148  -0.10785 0.02380  110 ASP A CA  
1744 C C   . ASP A 110 ? 0.62070 0.34300 0.40166 0.05116  -0.12521 0.01503  110 ASP A C   
1745 O O   . ASP A 110 ? 0.57663 0.28964 0.35054 0.05566  -0.12564 0.01179  110 ASP A O   
1746 C CB  . ASP A 110 ? 0.55628 0.31898 0.33624 0.02041  -0.10141 0.03445  110 ASP A CB  
1747 C CG  . ASP A 110 ? 0.54141 0.34775 0.35054 0.01305  -0.08470 0.04337  110 ASP A CG  
1748 O OD1 . ASP A 110 ? 0.45906 0.29272 0.30874 0.02332  -0.07707 0.04234  110 ASP A OD1 
1749 O OD2 . ASP A 110 ? 0.47734 0.29012 0.26779 -0.00297 -0.07909 0.05089  110 ASP A OD2 
1754 N N   . GLU A 111 ? 0.52790 0.22101 0.28704 0.05523  -0.13995 0.01104  111 GLU A N   
1755 C CA  . GLU A 111 ? 0.75365 0.39927 0.47468 0.06524  -0.15818 0.00381  111 GLU A CA  
1756 C C   . GLU A 111 ? 0.70483 0.35822 0.45920 0.08945  -0.16686 -0.00901 111 GLU A C   
1757 O O   . GLU A 111 ? 0.68019 0.31258 0.41609 0.09721  -0.17384 -0.01650 111 GLU A O   
1758 C CB  . GLU A 111 ? 0.82460 0.44233 0.51431 0.05997  -0.16812 0.00124  111 GLU A CB  
1759 C CG  . GLU A 111 ? 1.07968 0.65121 0.71397 0.05074  -0.17331 -0.00231 111 GLU A CG  
1760 C CD  . GLU A 111 ? 1.21944 0.76896 0.84397 0.06972  -0.18854 -0.01524 111 GLU A CD  
1761 O OE1 . GLU A 111 ? 1.29201 0.86702 0.95682 0.08888  -0.19509 -0.02276 111 GLU A OE1 
1762 O OE2 . GLU A 111 ? 1.19716 0.70608 0.77523 0.06473  -0.19293 -0.01862 111 GLU A OE2 
1769 N N   . GLU A 112 ? 0.55541 0.24803 0.36260 0.09795  -0.16238 -0.01406 112 GLU A N   
1770 C CA  . GLU A 112 ? 0.53894 0.25012 0.38520 0.11747  -0.16656 -0.02796 112 GLU A CA  
1771 C C   . GLU A 112 ? 0.58448 0.29528 0.43123 0.12135  -0.15963 -0.02954 112 GLU A C   
1772 O O   . GLU A 112 ? 0.64126 0.35197 0.49779 0.13575  -0.16610 -0.04169 112 GLU A O   
1773 C CB  . GLU A 112 ? 0.57479 0.33076 0.47769 0.12030  -0.15673 -0.03136 112 GLU A CB  
1774 C CG  . GLU A 112 ? 0.55939 0.31726 0.46869 0.12111  -0.16580 -0.03485 112 GLU A CG  
1775 C CD  . GLU A 112 ? 0.64138 0.43992 0.60360 0.12212  -0.15459 -0.03818 112 GLU A CD  
1776 O OE1 . GLU A 112 ? 0.67650 0.50439 0.67592 0.12584  -0.14248 -0.04328 112 GLU A OE1 
1777 O OE2 . GLU A 112 ? 0.67600 0.47702 0.64035 0.11680  -0.15562 -0.03604 112 GLU A OE2 
1784 N N   . PHE A 113 ? 0.59104 0.31245 0.42969 0.10410  -0.14270 -0.01823 113 PHE A N   
1785 C CA  . PHE A 113 ? 0.59220 0.31423 0.42751 0.10364  -0.13376 -0.01870 113 PHE A CA  
1786 C C   . PHE A 113 ? 0.66431 0.34175 0.43996 0.09448  -0.13957 -0.01344 113 PHE A C   
1787 O O   . PHE A 113 ? 0.69445 0.34667 0.45266 0.10497  -0.14584 -0.02065 113 PHE A O   
1788 C CB  . PHE A 113 ? 0.51731 0.27933 0.38044 0.09074  -0.11189 -0.01008 113 PHE A CB  
1789 C CG  . PHE A 113 ? 0.47861 0.28019 0.39623 0.09769  -0.10336 -0.01514 113 PHE A CG  
1790 C CD1 . PHE A 113 ? 0.46567 0.28225 0.39771 0.09272  -0.10179 -0.01054 113 PHE A CD1 
1791 C CD2 . PHE A 113 ? 0.42782 0.24998 0.38060 0.10810  -0.09572 -0.02532 113 PHE A CD2 
1792 C CE1 . PHE A 113 ? 0.41321 0.26221 0.39180 0.09754  -0.09315 -0.01561 113 PHE A CE1 
1793 C CE2 . PHE A 113 ? 0.39611 0.25262 0.39650 0.11179  -0.08639 -0.03083 113 PHE A CE2 
1794 C CZ  . PHE A 113 ? 0.38392 0.25267 0.39628 0.10627  -0.08529 -0.02576 113 PHE A CZ  
1804 N N   . LEU A 114 ? 0.63268 0.29973 0.37611 0.07444  -0.13668 -0.00180 114 LEU A N   
1805 C CA  . LEU A 114 ? 0.68877 0.31283 0.37317 0.06187  -0.14064 0.00258  114 LEU A CA  
1806 C C   . LEU A 114 ? 0.79003 0.36078 0.43566 0.07570  -0.16108 -0.00537 114 LEU A C   
1807 O O   . LEU A 114 ? 0.75647 0.28994 0.35965 0.07304  -0.16447 -0.00739 114 LEU A O   
1808 C CB  . LEU A 114 ? 0.71909 0.34650 0.38025 0.03709  -0.13355 0.01451  114 LEU A CB  
1809 C CG  . LEU A 114 ? 0.64552 0.32174 0.33670 0.02347  -0.11483 0.02343  114 LEU A CG  
1810 C CD1 . LEU A 114 ? 0.67391 0.35843 0.34918 0.00292  -0.10969 0.03283  114 LEU A CD1 
1811 C CD2 . LEU A 114 ? 0.56852 0.24459 0.24745 0.01653  -0.10675 0.02500  114 LEU A CD2 
1823 N N   . GLY A 115 ? 0.79790 0.37548 0.46227 0.08747  -0.17133 -0.01278 115 GLY A N   
1824 C CA  . GLY A 115 ? 0.97879 0.52798 0.61612 0.09685  -0.18663 -0.02342 115 GLY A CA  
1825 C C   . GLY A 115 ? 0.85098 0.39331 0.49008 0.11471  -0.19226 -0.03306 115 GLY A C   
1826 O O   . GLY A 115 ? 0.79626 0.30607 0.39743 0.12014  -0.20430 -0.03843 115 GLY A O   
1830 N N   . ARG A 116 ? 0.71745 0.28935 0.39906 0.12418  -0.18316 -0.03576 116 ARG A N   
1831 C CA  . ARG A 116 ? 0.76051 0.32954 0.44771 0.14008  -0.18501 -0.04541 116 ARG A CA  
1832 C C   . ARG A 116 ? 0.75164 0.28348 0.39100 0.13013  -0.17948 -0.03998 116 ARG A C   
1833 O O   . ARG A 116 ? 0.81506 0.34207 0.45613 0.14208  -0.17865 -0.04715 116 ARG A O   
1834 C CB  . ARG A 116 ? 0.73009 0.34626 0.48211 0.15197  -0.17461 -0.05261 116 ARG A CB  
1835 C CG  . ARG A 116 ? 0.61746 0.27157 0.41837 0.16274  -0.18030 -0.06144 116 ARG A CG  
1836 C CD  . ARG A 116 ? 0.64367 0.34478 0.50423 0.16445  -0.16497 -0.06418 116 ARG A CD  
1837 N NE  . ARG A 116 ? 0.85633 0.59325 0.76251 0.17302  -0.16949 -0.07436 116 ARG A NE  
1838 C CZ  . ARG A 116 ? 0.87755 0.65325 0.83080 0.17032  -0.15821 -0.07562 116 ARG A CZ  
1839 N NH1 . ARG A 116 ? 0.73829 0.52304 0.70065 0.16114  -0.14245 -0.06679 116 ARG A NH1 
1840 N NH2 . ARG A 116 ? 1.19760 1.00197 1.18728 0.17674  -0.16326 -0.08619 116 ARG A NH2 
1854 N N   . LEU A 117 ? 0.75019 0.36409 0.38884 0.18565  0.05161  -0.01809 117 LEU A N   
1855 C CA  . LEU A 117 ? 0.66930 0.26607 0.32182 0.17492  0.06324  -0.01155 117 LEU A CA  
1856 C C   . LEU A 117 ? 0.68683 0.26781 0.32782 0.18111  0.08497  -0.00266 117 LEU A C   
1857 O O   . LEU A 117 ? 0.82174 0.40554 0.45815 0.18831  0.09129  -0.00538 117 LEU A O   
1858 C CB  . LEU A 117 ? 0.72698 0.32579 0.41741 0.15263  0.05545  -0.01972 117 LEU A CB  
1859 C CG  . LEU A 117 ? 0.69051 0.30289 0.39807 0.14354  0.03409  -0.02714 117 LEU A CG  
1860 C CD1 . LEU A 117 ? 0.70360 0.31851 0.44914 0.12291  0.03036  -0.03249 117 LEU A CD1 
1861 C CD2 . LEU A 117 ? 0.76023 0.37413 0.45537 0.14846  0.02964  -0.02096 117 LEU A CD2 
1873 N N   . SER A 118 ? 0.82016 0.38320 0.45484 0.17899  0.09617  0.00770  118 SER A N   
1874 C CA  . SER A 118 ? 0.80582 0.34775 0.43224 0.18151  0.11642  0.01791  118 SER A CA  
1875 C C   . SER A 118 ? 0.84079 0.37749 0.49512 0.16519  0.12004  0.01373  118 SER A C   
1876 O O   . SER A 118 ? 0.81669 0.36556 0.49772 0.15094  0.10690  0.00316  118 SER A O   
1877 C CB  . SER A 118 ? 0.84196 0.36116 0.45567 0.17991  0.12495  0.02818  118 SER A CB  
1878 O OG  . SER A 118 ? 0.84539 0.35804 0.48171 0.15872  0.11698  0.02206  118 SER A OG  
1884 N N   . ALA A 119 ? 0.98232 0.50077 0.62978 0.16899  0.13928  0.02457  119 ALA A N   
1885 C CA  . ALA A 119 ? 0.79994 0.31209 0.47167 0.15537  0.14604  0.02515  119 ALA A CA  
1886 C C   . ALA A 119 ? 0.82690 0.32842 0.52143 0.12959  0.13853  0.02347  119 ALA A C   
1887 O O   . ALA A 119 ? 0.79977 0.31029 0.52173 0.11559  0.13212  0.01673  119 ALA A O   
1888 C CB  . ALA A 119 ? 0.81050 0.31883 0.47480 0.15975  0.16654  0.04227  119 ALA A CB  
1894 N N   . GLU A 120 ? 0.84131 0.32567 0.52409 0.12412  0.13880  0.02878  120 GLU A N   
1895 C CA  . GLU A 120 ? 0.76403 0.24016 0.46506 0.10072  0.13031  0.02496  120 GLU A CA  
1896 C C   . GLU A 120 ? 0.82229 0.32427 0.54338 0.09443  0.11056  0.01061  120 GLU A C   
1897 O O   . GLU A 120 ? 0.82523 0.33058 0.57137 0.07491  0.10332  0.00601  120 GLU A O   
1898 C CB  . GLU A 120 ? 0.82534 0.27796 0.50499 0.10127  0.13291  0.03005  120 GLU A CB  
1899 C CG  . GLU A 120 ? 0.93802 0.36064 0.60523 0.09868  0.15013  0.04566  120 GLU A CG  
1900 C CD  . GLU A 120 ? 0.92952 0.35186 0.57272 0.12313  0.16490  0.05711  120 GLU A CD  
1901 O OE1 . GLU A 120 ? 0.86917 0.31469 0.50445 0.14159  0.16095  0.05145  120 GLU A OE1 
1902 O OE2 . GLU A 120 ? 0.91086 0.31133 0.54344 0.12313  0.17946  0.07268  120 GLU A OE2 
1909 N N   . GLU A 121 ? 0.76393 0.28502 0.47431 0.11011  0.10158  0.00532  121 GLU A N   
1910 C CA  . GLU A 121 ? 0.69642 0.24096 0.42493 0.10449  0.08291  -0.00528 121 GLU A CA  
1911 C C   . GLU A 121 ? 0.83056 0.39197 0.58598 0.09763  0.07672  -0.01223 121 GLU A C   
1912 O O   . GLU A 121 ? 0.75705 0.33091 0.53800 0.08399  0.06452  -0.01853 121 GLU A O   
1913 C CB  . GLU A 121 ? 0.71637 0.27380 0.42306 0.12274  0.07545  -0.00587 121 GLU A CB  
1914 C CG  . GLU A 121 ? 0.69974 0.24305 0.38037 0.13189  0.08017  0.00055  121 GLU A CG  
1915 C CD  . GLU A 121 ? 0.72674 0.28448 0.38319 0.15293  0.07459  0.00308  121 GLU A CD  
1916 O OE1 . GLU A 121 ? 0.79212 0.35834 0.43624 0.16612  0.07668  0.00527  121 GLU A OE1 
1917 O OE2 . GLU A 121 ? 0.82240 0.38354 0.47012 0.15787  0.06804  0.00315  121 GLU A OE2 
1924 N N   . GLN A 122 ? 0.74265 0.30448 0.49119 0.10897  0.08538  -0.01116 122 GLN A N   
1925 C CA  . GLN A 122 ? 0.67617 0.25033 0.44736 0.10566  0.08169  -0.01812 122 GLN A CA  
1926 C C   . GLN A 122 ? 0.69248 0.25839 0.48907 0.08721  0.08780  -0.01449 122 GLN A C   
1927 O O   . GLN A 122 ? 0.64903 0.22780 0.47266 0.07494  0.07658  -0.02028 122 GLN A O   
1928 C CB  . GLN A 122 ? 0.67793 0.25204 0.43167 0.12478  0.09286  -0.01789 122 GLN A CB  
1929 C CG  . GLN A 122 ? 0.66943 0.25514 0.39949 0.14091  0.08382  -0.02325 122 GLN A CG  
1930 C CD  . GLN A 122 ? 0.66589 0.25553 0.37845 0.15933  0.09312  -0.02570 122 GLN A CD  
1931 O OE1 . GLN A 122 ? 0.76741 0.36210 0.49369 0.15945  0.10098  -0.02675 122 GLN A OE1 
1932 N NE2 . GLN A 122 ? 0.68882 0.28312 0.37178 0.17503  0.09197  -0.02559 122 GLN A NE2 
1941 N N   . GLU A 123 ? 0.72711 0.27320 0.51616 0.08351  0.10539  -0.00268 123 GLU A N   
1942 C CA  . GLU A 123 ? 0.80176 0.35005 0.61754 0.06085  0.10961  0.00409  123 GLU A CA  
1943 C C   . GLU A 123 ? 0.88255 0.42503 0.71146 0.04220  0.09608  -0.00192 123 GLU A C   
1944 O O   . GLU A 123 ? 0.80135 0.36097 0.66091 0.02394  0.09162  -0.00149 123 GLU A O   
1945 C CB  . GLU A 123 ? 0.79539 0.32224 0.59794 0.05580  0.12720  0.02003  123 GLU A CB  
1946 C CG  . GLU A 123 ? 0.95928 0.48471 0.78554 0.02750  0.13008  0.02941  123 GLU A CG  
1947 C CD  . GLU A 123 ? 1.17917 0.74539 1.04126 0.02079  0.13076  0.03230  123 GLU A CD  
1948 O OE1 . GLU A 123 ? 1.14991 0.73918 1.01376 0.04075  0.13300  0.02842  123 GLU A OE1 
1949 O OE2 . GLU A 123 ? 1.18087 0.75604 1.06782 -0.00376 0.12883  0.03840  123 GLU A OE2 
1956 N N   . LEU A 124 ? 0.85613 0.39846 0.66970 0.04616  0.08600  -0.00653 124 LEU A N   
1957 C CA  . LEU A 124 ? 0.86607 0.41441 0.69175 0.03117  0.07234  -0.01200 124 LEU A CA  
1958 C C   . LEU A 124 ? 0.87197 0.44776 0.71788 0.03163  0.05571  -0.02109 124 LEU A C   
1959 O O   . LEU A 124 ? 0.74090 0.32613 0.60733 0.01594  0.04615  -0.02425 124 LEU A O   
1960 C CB  . LEU A 124 ? 0.83433 0.36742 0.63216 0.03899  0.07232  -0.01147 124 LEU A CB  
1961 C CG  . LEU A 124 ? 0.92454 0.45766 0.72294 0.03101  0.06111  -0.01762 124 LEU A CG  
1962 C CD1 . LEU A 124 ? 0.99277 0.54978 0.79255 0.04274  0.04838  -0.02399 124 LEU A CD1 
1963 C CD2 . LEU A 124 ? 1.01717 0.55186 0.84094 0.00588  0.05623  -0.01941 124 LEU A CD2 
1975 N N   . PHE A 125 ? 0.76007 0.34835 0.60031 0.04806  0.05137  -0.02472 125 PHE A N   
1976 C CA  . PHE A 125 ? 0.57947 0.19007 0.44097 0.04617  0.03527  -0.03163 125 PHE A CA  
1977 C C   . PHE A 125 ? 0.67499 0.29087 0.56614 0.03446  0.03662  -0.03164 125 PHE A C   
1978 O O   . PHE A 125 ? 0.65554 0.28813 0.57223 0.02333  0.02400  -0.03425 125 PHE A O   
1979 C CB  . PHE A 125 ? 0.59927 0.21789 0.44592 0.06394  0.02961  -0.03537 125 PHE A CB  
1980 C CG  . PHE A 125 ? 0.57312 0.20935 0.44023 0.06095  0.01200  -0.04162 125 PHE A CG  
1981 C CD1 . PHE A 125 ? 0.59045 0.23790 0.46155 0.05670  -0.00454 -0.04259 125 PHE A CD1 
1982 C CD2 . PHE A 125 ? 0.59224 0.23153 0.47241 0.06369  0.01154  -0.04578 125 PHE A CD2 
1983 C CE1 . PHE A 125 ? 0.60664 0.27045 0.49827 0.05176  -0.02289 -0.04588 125 PHE A CE1 
1984 C CE2 . PHE A 125 ? 0.52316 0.17554 0.42226 0.06018  -0.00609 -0.05092 125 PHE A CE2 
1985 C CZ  . PHE A 125 ? 0.49918 0.16380 0.40529 0.05267  -0.02395 -0.05019 125 PHE A CZ  
1995 N N   . MET A 126 ? 0.68844 0.29786 0.57925 0.03734  0.05228  -0.02645 126 MET A N   
1996 C CA  . MET A 126 ? 0.58167 0.21269 0.50576 0.02790  0.05461  -0.02309 126 MET A CA  
1997 C C   . MET A 126 ? 0.63792 0.27418 0.58373 0.00314  0.05435  -0.01707 126 MET A C   
1998 O O   . MET A 126 ? 0.66713 0.32864 0.64545 -0.00797 0.04700  -0.01624 126 MET A O   
1999 C CB  . MET A 126 ? 0.57810 0.20991 0.49570 0.03925  0.07214  -0.01665 126 MET A CB  
2000 C CG  . MET A 126 ? 0.68279 0.31525 0.58299 0.06305  0.07091  -0.02469 126 MET A CG  
2001 S SD  . MET A 126 ? 0.93352 0.58583 0.84647 0.07594  0.08400  -0.02136 126 MET A SD  
2002 C CE  . MET A 126 ? 0.66244 0.33922 0.62047 0.06083  0.07365  -0.02077 126 MET A CE  
2012 N N   . GLN A 127 ? 0.54963 0.16113 0.47689 -0.00610 0.06188  -0.01253 127 GLN A N   
2013 C CA  . GLN A 127 ? 0.54771 0.16017 0.49090 -0.03203 0.05950  -0.00869 127 GLN A CA  
2014 C C   . GLN A 127 ? 0.63732 0.26455 0.59437 -0.03957 0.04154  -0.01708 127 GLN A C   
2015 O O   . GLN A 127 ? 0.57495 0.22459 0.56069 -0.05887 0.03574  -0.01453 127 GLN A O   
2016 C CB  . GLN A 127 ? 0.64128 0.21512 0.55512 -0.03923 0.06788  -0.00490 127 GLN A CB  
2017 C CG  . GLN A 127 ? 0.84978 0.41342 0.75746 -0.03995 0.08587  0.00860  127 GLN A CG  
2018 C CD  . GLN A 127 ? 0.96105 0.48924 0.84087 -0.04617 0.09087  0.01330  127 GLN A CD  
2019 O OE1 . GLN A 127 ? 0.95280 0.47536 0.82364 -0.05029 0.07866  0.00543  127 GLN A OE1 
2020 N NE2 . GLN A 127 ? 0.99396 0.50449 0.86220 -0.04461 0.10807  0.02708  127 GLN A NE2 
2029 N N   . LEU A 128 ? 0.62599 0.24645 0.56414 -0.02443 0.03244  -0.02516 128 LEU A N   
2030 C CA  . LEU A 128 ? 0.58390 0.22314 0.53454 -0.03012 0.01534  -0.03073 128 LEU A CA  
2031 C C   . LEU A 128 ? 0.66463 0.34083 0.65308 -0.03296 0.00524  -0.02957 128 LEU A C   
2032 O O   . LEU A 128 ? 0.67300 0.37333 0.68811 -0.04835 -0.00437 -0.02831 128 LEU A O   
2033 C CB  . LEU A 128 ? 0.51183 0.14764 0.43673 -0.01167 0.00834  -0.03563 128 LEU A CB  
2034 C CG  . LEU A 128 ? 0.57772 0.19233 0.47197 -0.00626 0.01524  -0.03588 128 LEU A CG  
2035 C CD1 . LEU A 128 ? 0.62771 0.24135 0.49533 0.01553  0.01211  -0.03745 128 LEU A CD1 
2036 C CD2 . LEU A 128 ? 0.61767 0.23047 0.51495 -0.02216 0.00976  -0.03927 128 LEU A CD2 
2048 N N   . VAL A 129 ? 0.52404 0.20362 0.51355 -0.01746 0.00698  -0.03012 129 VAL A N   
2049 C CA  . VAL A 129 ? 0.50541 0.21165 0.52697 -0.01744 -0.00244 -0.02957 129 VAL A CA  
2050 C C   . VAL A 129 ? 0.60840 0.33532 0.66247 -0.03258 0.00363  -0.02164 129 VAL A C   
2051 O O   . VAL A 129 ? 0.56262 0.31667 0.64824 -0.04225 -0.00687 -0.01871 129 VAL A O   
2052 C CB  . VAL A 129 ? 0.48958 0.18710 0.49902 0.00300  -0.00020 -0.03373 129 VAL A CB  
2053 C CG1 . VAL A 129 ? 0.51430 0.23059 0.55418 0.00465  -0.00709 -0.03333 129 VAL A CG1 
2054 C CG2 . VAL A 129 ? 0.51516 0.20220 0.49809 0.01454  -0.01071 -0.03983 129 VAL A CG2 
2064 N N   . ARG A 130 ? 0.59669 0.31508 0.64480 -0.03534 0.02047  -0.01568 130 ARG A N   
2065 C CA  . ARG A 130 ? 0.59507 0.33931 0.67441 -0.05084 0.02665  -0.00504 130 ARG A CA  
2066 C C   . ARG A 130 ? 0.54331 0.29927 0.63641 -0.07614 0.01830  -0.00302 130 ARG A C   
2067 O O   . ARG A 130 ? 0.54516 0.33489 0.67251 -0.08925 0.01412  0.00406  130 ARG A O   
2068 C CB  . ARG A 130 ? 0.73030 0.46604 0.79915 -0.05028 0.04584  0.00379  130 ARG A CB  
2069 C CG  . ARG A 130 ? 0.73119 0.46483 0.79035 -0.02490 0.05604  0.00340  130 ARG A CG  
2070 C CD  . ARG A 130 ? 0.87207 0.61241 0.93119 -0.02760 0.07507  0.01729  130 ARG A CD  
2071 N NE  . ARG A 130 ? 1.25509 1.00055 1.30628 -0.00179 0.08621  0.01784  130 ARG A NE  
2072 C CZ  . ARG A 130 ? 1.24176 0.96762 1.26243 0.01286  0.09740  0.01773  130 ARG A CZ  
2073 N NH1 . ARG A 130 ? 1.04502 0.74170 1.03993 0.00562  0.09934  0.01787  130 ARG A NH1 
2074 N NH2 . ARG A 130 ? 0.99039 0.72615 1.00486 0.03692  0.10723  0.01772  130 ARG A NH2 
2088 N N   . LYS A 131 ? 0.51382 0.24249 0.57880 -0.08189 0.01594  -0.00923 131 LYS A N   
2089 C CA  . LYS A 131 ? 0.55555 0.29070 0.62669 -0.10456 0.00753  -0.01024 131 LYS A CA  
2090 C C   . LYS A 131 ? 0.63972 0.40799 0.73601 -0.10648 -0.00937 -0.01251 131 LYS A C   
2091 O O   . LYS A 131 ? 0.59028 0.38547 0.70742 -0.12577 -0.01563 -0.00898 131 LYS A O   
2092 C CB  . LYS A 131 ? 0.64253 0.33560 0.67215 -0.10388 0.00851  -0.01848 131 LYS A CB  
2093 C CG  . LYS A 131 ? 0.69449 0.38848 0.72278 -0.12538 0.00273  -0.01897 131 LYS A CG  
2094 C CD  . LYS A 131 ? 0.61174 0.26748 0.60117 -0.11661 0.00657  -0.02516 131 LYS A CD  
2095 C CE  . LYS A 131 ? 0.72263 0.37733 0.70767 -0.13165 -0.00050 -0.03107 131 LYS A CE  
2096 N NZ  . LYS A 131 ? 0.90346 0.51966 0.84677 -0.11704 0.00132  -0.04008 131 LYS A NZ  
2110 N N   . MET A 132 ? 0.61299 0.38285 0.70612 -0.08754 -0.01739 -0.01700 132 MET A N   
2111 C CA  . MET A 132 ? 0.46741 0.26950 0.58607 -0.08906 -0.03417 -0.01612 132 MET A CA  
2112 C C   . MET A 132 ? 0.52118 0.35524 0.68064 -0.09139 -0.03562 -0.00708 132 MET A C   
2113 O O   . MET A 132 ? 0.58600 0.45245 0.76909 -0.09532 -0.04809 -0.00300 132 MET A O   
2114 C CB  . MET A 132 ? 0.38775 0.18052 0.48876 -0.07052 -0.04357 -0.02161 132 MET A CB  
2115 C CG  . MET A 132 ? 0.47138 0.25036 0.54103 -0.06752 -0.04790 -0.02776 132 MET A CG  
2116 S SD  . MET A 132 ? 0.47318 0.25721 0.52945 -0.04879 -0.06161 -0.02914 132 MET A SD  
2117 C CE  . MET A 132 ? 0.52044 0.26763 0.54651 -0.03019 -0.04776 -0.03309 132 MET A CE  
2127 N N   . MET A 133 ? 0.55164 0.38132 0.71572 -0.08565 -0.02181 -0.00255 133 MET A N   
2128 C CA  . MET A 133 ? 0.48365 0.34327 0.68410 -0.08439 -0.02038 0.00710  133 MET A CA  
2129 C C   . MET A 133 ? 0.51931 0.40662 0.74261 -0.10425 -0.01207 0.01875  133 MET A C   
2130 O O   . MET A 133 ? 0.73203 0.65166 0.98826 -0.10371 -0.01012 0.02960  133 MET A O   
2131 C CB  . MET A 133 ? 0.47327 0.31562 0.66379 -0.06103 -0.01052 0.00521  133 MET A CB  
2132 C CG  . MET A 133 ? 0.59674 0.41665 0.76926 -0.04346 -0.02143 -0.00519 133 MET A CG  
2133 S SD  . MET A 133 ? 0.57359 0.37230 0.73130 -0.01604 -0.01120 -0.01009 133 MET A SD  
2134 C CE  . MET A 133 ? 0.45364 0.23267 0.57879 -0.01339 0.00957  -0.01027 133 MET A CE  
2144 N N   . ASN A 134 ? 0.65499 0.52991 0.86077 -0.12178 -0.00767 0.01753  134 ASN A N   
2145 C CA  . ASN A 134 ? 0.78632 0.68644 1.01108 -0.14567 -0.00179 0.02907  134 ASN A CA  
2146 C C   . ASN A 134 ? 0.74308 0.65401 0.97794 -0.13850 0.01502  0.04133  134 ASN A C   
2147 O O   . ASN A 134 ? 0.74322 0.62517 0.95193 -0.13075 0.02696  0.04001  134 ASN A O   
2148 C CB  . ASN A 134 ? 0.85226 0.80141 1.10022 -0.15423 -0.01228 0.03409  134 ASN A CB  
2149 C CG  . ASN A 134 ? 0.96881 0.94327 1.21381 -0.17700 -0.00815 0.03907  134 ASN A CG  
2150 O OD1 . ASN A 134 ? 0.96027 0.90914 1.17839 -0.19109 -0.00331 0.03381  134 ASN A OD1 
2151 N ND2 . ASN A 134 ? 1.05146 1.07342 1.32282 -0.17984 -0.00962 0.04811  134 ASN A ND2 
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