data_9DAL
# 
_entry.id   9DAL 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_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   9DAL         pdb_00009dal 10.2210/pdb9dal/pdb 
WWPDB D_1000287719 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-02-19 ? 
2 'Structure model' 1 1 2025-03-12 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
_pdbx_audit_revision_item.ordinal             1 
_pdbx_audit_revision_item.revision_ordinal    2 
_pdbx_audit_revision_item.data_content_type   'Structure model' 
_pdbx_audit_revision_item.item                '_citation.journal_volume' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9DAL 
_pdbx_database_status.recvd_initial_deposition_date   2024-08-22 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              vprasad@bcm.edu 
_pdbx_contact_author.name_first         B.V.V 
_pdbx_contact_author.name_last          Prasad 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-1172-2071 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Pham, S.H.'     1 0000-0001-6642-8796 
'Neetu, N.'      2 ?                   
'Sankaran, B.'   3 0000-0002-3266-8131 
'Prasad, B.V.V.' 4 0000-0002-1172-2071 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            J.Virol. 
_citation.journal_id_ASTM           JOVIAM 
_citation.journal_id_CSD            0825 
_citation.journal_id_ISSN           1098-5514 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            99 
_citation.language                  ? 
_citation.page_first                e0175724 
_citation.page_last                 e0175724 
_citation.title                     
'Conformational flexibility is a critical factor in designing broad-spectrum human norovirus protease inhibitors.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1128/jvi.01757-24 
_citation.pdbx_database_id_PubMed   39873493 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Pham, S.'       1  ?                   
primary 'Zhao, B.'       2  ?                   
primary 'Neetu, N.'      3  ?                   
primary 'Sankaran, B.'   4  ?                   
primary 'Patil, K.'      5  ?                   
primary 'Ramani, S.'     6  0000-0001-5631-8534 
primary 'Song, Y.'       7  ?                   
primary 'Estes, M.K.'    8  0000-0002-4813-4249 
primary 'Palzkill, T.'   9  ?                   
primary 'Prasad, B.V.V.' 10 0000-0002-1172-2071 
# 
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 'Peptidase C37' 19415.340 1 ? R112A ? ? 
2 non-polymer syn 
;4-{2-(4-FLUORO-BENZYL)-6-METHYL-5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-AMINO]-4-OXO-HEPTANOYLAMINO}-5-(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER
;
600.678   1 ? ?     ? ? 
# 
_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       
;GPAPPSIWSRIVNFGSGWGFWVSPSLFITSTHVIPQGTQEFFGVPTKQIQIHKSGEFCRLRFPKPIRTDVTGMILEEGAP
EGTVATLLIKRPTGELMPLAARMGTHATMKIQGATVGGQMGMLLTGSNAKSMDLGTTPGDCGCPYIYKRGNDYVVIGVHT
AAARGGNTVICATQGSEGEAMLE
;
_entity_poly.pdbx_seq_one_letter_code_can   
;GPAPPSIWSRIVNFGSGWGFWVSPSLFITSTHVIPQGTQEFFGVPTKQIQIHKSGEFCRLRFPKPIRTDVTGMILEEGAP
EGTVATLLIKRPTGELMPLAARMGTHATMKIQGATVGGQMGMLLTGSNAKSMDLGTTPGDCGCPYIYKRGNDYVVIGVHT
AAARGGNTVICATQGSEGEAMLE
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
_pdbx_entity_nonpoly.entity_id   2 
_pdbx_entity_nonpoly.name        
;4-{2-(4-FLUORO-BENZYL)-6-METHYL-5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-AMINO]-4-OXO-HEPTANOYLAMINO}-5-(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER
;
_pdbx_entity_nonpoly.comp_id     AG7 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   GLY n 
1 2   PRO n 
1 3   ALA n 
1 4   PRO n 
1 5   PRO n 
1 6   SER n 
1 7   ILE n 
1 8   TRP n 
1 9   SER n 
1 10  ARG n 
1 11  ILE n 
1 12  VAL n 
1 13  ASN n 
1 14  PHE n 
1 15  GLY n 
1 16  SER n 
1 17  GLY n 
1 18  TRP n 
1 19  GLY n 
1 20  PHE n 
1 21  TRP n 
1 22  VAL n 
1 23  SER n 
1 24  PRO n 
1 25  SER n 
1 26  LEU n 
1 27  PHE n 
1 28  ILE n 
1 29  THR n 
1 30  SER n 
1 31  THR n 
1 32  HIS n 
1 33  VAL n 
1 34  ILE n 
1 35  PRO n 
1 36  GLN n 
1 37  GLY n 
1 38  THR n 
1 39  GLN n 
1 40  GLU n 
1 41  PHE n 
1 42  PHE n 
1 43  GLY n 
1 44  VAL n 
1 45  PRO n 
1 46  THR n 
1 47  LYS n 
1 48  GLN n 
1 49  ILE n 
1 50  GLN n 
1 51  ILE n 
1 52  HIS n 
1 53  LYS n 
1 54  SER n 
1 55  GLY n 
1 56  GLU n 
1 57  PHE n 
1 58  CYS n 
1 59  ARG n 
1 60  LEU n 
1 61  ARG n 
1 62  PHE n 
1 63  PRO n 
1 64  LYS n 
1 65  PRO n 
1 66  ILE n 
1 67  ARG n 
1 68  THR n 
1 69  ASP n 
1 70  VAL n 
1 71  THR n 
1 72  GLY n 
1 73  MET n 
1 74  ILE n 
1 75  LEU n 
1 76  GLU n 
1 77  GLU n 
1 78  GLY n 
1 79  ALA n 
1 80  PRO n 
1 81  GLU n 
1 82  GLY n 
1 83  THR n 
1 84  VAL n 
1 85  ALA n 
1 86  THR n 
1 87  LEU n 
1 88  LEU n 
1 89  ILE n 
1 90  LYS n 
1 91  ARG n 
1 92  PRO n 
1 93  THR n 
1 94  GLY n 
1 95  GLU n 
1 96  LEU n 
1 97  MET n 
1 98  PRO n 
1 99  LEU n 
1 100 ALA n 
1 101 ALA n 
1 102 ARG n 
1 103 MET n 
1 104 GLY n 
1 105 THR n 
1 106 HIS n 
1 107 ALA n 
1 108 THR n 
1 109 MET n 
1 110 LYS n 
1 111 ILE n 
1 112 GLN n 
1 113 GLY n 
1 114 ALA n 
1 115 THR n 
1 116 VAL n 
1 117 GLY n 
1 118 GLY n 
1 119 GLN n 
1 120 MET n 
1 121 GLY n 
1 122 MET n 
1 123 LEU n 
1 124 LEU n 
1 125 THR n 
1 126 GLY n 
1 127 SER n 
1 128 ASN n 
1 129 ALA n 
1 130 LYS n 
1 131 SER n 
1 132 MET n 
1 133 ASP n 
1 134 LEU n 
1 135 GLY n 
1 136 THR n 
1 137 THR n 
1 138 PRO n 
1 139 GLY n 
1 140 ASP n 
1 141 CYS n 
1 142 GLY n 
1 143 CYS n 
1 144 PRO n 
1 145 TYR n 
1 146 ILE n 
1 147 TYR n 
1 148 LYS n 
1 149 ARG n 
1 150 GLY n 
1 151 ASN n 
1 152 ASP n 
1 153 TYR n 
1 154 VAL n 
1 155 VAL n 
1 156 ILE n 
1 157 GLY n 
1 158 VAL n 
1 159 HIS n 
1 160 THR n 
1 161 ALA n 
1 162 ALA n 
1 163 ALA n 
1 164 ARG n 
1 165 GLY n 
1 166 GLY n 
1 167 ASN n 
1 168 THR n 
1 169 VAL n 
1 170 ILE n 
1 171 CYS n 
1 172 ALA n 
1 173 THR n 
1 174 GLN n 
1 175 GLY n 
1 176 SER n 
1 177 GLU n 
1 178 GLY n 
1 179 GLU n 
1 180 ALA n 
1 181 MET n 
1 182 LEU n 
1 183 GLU 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                   183 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      Norovirus 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     142786 
_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 B' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     37762 
_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 
AG7 non-polymer         . 
;4-{2-(4-FLUORO-BENZYL)-6-METHYL-5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-AMINO]-4-OXO-HEPTANOYLAMINO}-5-(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER
;
'RUPINTRIVIR, bound form' 'C31 H41 F N4 O7' 600.678 
ALA 'L-peptide linking' y ALANINE ?                         'C3 H7 N O2'      89.093  
ARG 'L-peptide linking' y ARGININE ?                         'C6 H15 N4 O2 1'  175.209 
ASN 'L-peptide linking' y ASPARAGINE ?                         'C4 H8 N2 O3'     132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                         'C4 H7 N O4'      133.103 
CYS 'L-peptide linking' y CYSTEINE ?                         'C3 H7 N O2 S'    121.158 
GLN 'L-peptide linking' y GLUTAMINE ?                         'C5 H10 N2 O3'    146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ?                         'C5 H9 N O4'      147.129 
GLY 'peptide linking'   y GLYCINE ?                         'C2 H5 N O2'      75.067  
HIS 'L-peptide linking' y HISTIDINE ?                         'C6 H10 N3 O2 1'  156.162 
ILE 'L-peptide linking' y ISOLEUCINE ?                         'C6 H13 N O2'     131.173 
LEU 'L-peptide linking' y LEUCINE ?                         'C6 H13 N O2'     131.173 
LYS 'L-peptide linking' y LYSINE ?                         'C6 H15 N2 O2 1'  147.195 
MET 'L-peptide linking' y METHIONINE ?                         'C5 H11 N O2 S'   149.211 
PHE 'L-peptide linking' y PHENYLALANINE ?                         'C9 H11 N O2'     165.189 
PRO 'L-peptide linking' y PROLINE ?                         'C5 H9 N O2'      115.130 
SER 'L-peptide linking' y SERINE ?                         'C3 H7 N O3'      105.093 
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   GLY 1   -1  ?   ?   ?   A . n 
A 1 2   PRO 2   0   0   PRO PRO A . n 
A 1 3   ALA 3   1   1   ALA ALA A . n 
A 1 4   PRO 4   2   2   PRO PRO A . n 
A 1 5   PRO 5   3   3   PRO PRO A . n 
A 1 6   SER 6   4   4   SER SER A . n 
A 1 7   ILE 7   5   5   ILE ILE A . n 
A 1 8   TRP 8   6   6   TRP TRP A . n 
A 1 9   SER 9   7   7   SER SER A . n 
A 1 10  ARG 10  8   8   ARG ARG A . n 
A 1 11  ILE 11  9   9   ILE ILE A . n 
A 1 12  VAL 12  10  10  VAL VAL A . n 
A 1 13  ASN 13  11  11  ASN ASN A . n 
A 1 14  PHE 14  12  12  PHE PHE A . n 
A 1 15  GLY 15  13  13  GLY GLY A . n 
A 1 16  SER 16  14  14  SER SER A . n 
A 1 17  GLY 17  15  15  GLY GLY A . n 
A 1 18  TRP 18  16  16  TRP TRP A . n 
A 1 19  GLY 19  17  17  GLY GLY A . n 
A 1 20  PHE 20  18  18  PHE PHE A . n 
A 1 21  TRP 21  19  19  TRP TRP A . n 
A 1 22  VAL 22  20  20  VAL VAL A . n 
A 1 23  SER 23  21  21  SER SER A . n 
A 1 24  PRO 24  22  22  PRO PRO A . n 
A 1 25  SER 25  23  23  SER SER A . n 
A 1 26  LEU 26  24  24  LEU LEU A . n 
A 1 27  PHE 27  25  25  PHE PHE A . n 
A 1 28  ILE 28  26  26  ILE ILE A . n 
A 1 29  THR 29  27  27  THR THR A . n 
A 1 30  SER 30  28  28  SER SER A . n 
A 1 31  THR 31  29  29  THR THR A . n 
A 1 32  HIS 32  30  30  HIS HIS A . n 
A 1 33  VAL 33  31  31  VAL VAL A . n 
A 1 34  ILE 34  32  32  ILE ILE A . n 
A 1 35  PRO 35  33  33  PRO PRO A . n 
A 1 36  GLN 36  34  34  GLN GLN A . n 
A 1 37  GLY 37  35  35  GLY GLY A . n 
A 1 38  THR 38  36  36  THR THR A . n 
A 1 39  GLN 39  37  37  GLN GLN A . n 
A 1 40  GLU 40  38  38  GLU GLU A . n 
A 1 41  PHE 41  39  39  PHE PHE A . n 
A 1 42  PHE 42  40  40  PHE PHE A . n 
A 1 43  GLY 43  41  41  GLY GLY A . n 
A 1 44  VAL 44  42  42  VAL VAL A . n 
A 1 45  PRO 45  43  43  PRO PRO A . n 
A 1 46  THR 46  44  44  THR THR A . n 
A 1 47  LYS 47  45  45  LYS LYS A . n 
A 1 48  GLN 48  46  46  GLN GLN A . n 
A 1 49  ILE 49  47  47  ILE ILE A . n 
A 1 50  GLN 50  48  48  GLN GLN A . n 
A 1 51  ILE 51  49  49  ILE ILE A . n 
A 1 52  HIS 52  50  50  HIS HIS A . n 
A 1 53  LYS 53  51  51  LYS LYS A . n 
A 1 54  SER 54  52  52  SER SER A . n 
A 1 55  GLY 55  53  53  GLY GLY A . n 
A 1 56  GLU 56  54  54  GLU GLU A . n 
A 1 57  PHE 57  55  55  PHE PHE A . n 
A 1 58  CYS 58  56  56  CYS CYS A . n 
A 1 59  ARG 59  57  57  ARG ARG A . n 
A 1 60  LEU 60  58  58  LEU LEU A . n 
A 1 61  ARG 61  59  59  ARG ARG A . n 
A 1 62  PHE 62  60  60  PHE PHE A . n 
A 1 63  PRO 63  61  61  PRO PRO A . n 
A 1 64  LYS 64  62  62  LYS LYS A . n 
A 1 65  PRO 65  63  63  PRO PRO A . n 
A 1 66  ILE 66  64  64  ILE ILE A . n 
A 1 67  ARG 67  65  65  ARG ARG A . n 
A 1 68  THR 68  66  66  THR THR A . n 
A 1 69  ASP 69  67  67  ASP ASP A . n 
A 1 70  VAL 70  68  68  VAL VAL A . n 
A 1 71  THR 71  69  69  THR THR A . n 
A 1 72  GLY 72  70  70  GLY GLY A . n 
A 1 73  MET 73  71  71  MET MET A . n 
A 1 74  ILE 74  72  72  ILE ILE A . n 
A 1 75  LEU 75  73  73  LEU LEU A . n 
A 1 76  GLU 76  74  74  GLU GLU A . n 
A 1 77  GLU 77  75  75  GLU GLU A . n 
A 1 78  GLY 78  76  76  GLY GLY A . n 
A 1 79  ALA 79  77  77  ALA ALA A . n 
A 1 80  PRO 80  78  78  PRO PRO A . n 
A 1 81  GLU 81  79  79  GLU GLU A . n 
A 1 82  GLY 82  80  80  GLY GLY A . n 
A 1 83  THR 83  81  81  THR THR A . n 
A 1 84  VAL 84  82  82  VAL VAL A . n 
A 1 85  ALA 85  83  83  ALA ALA A . n 
A 1 86  THR 86  84  84  THR THR A . n 
A 1 87  LEU 87  85  85  LEU LEU A . n 
A 1 88  LEU 88  86  86  LEU LEU A . n 
A 1 89  ILE 89  87  87  ILE ILE A . n 
A 1 90  LYS 90  88  88  LYS LYS A . n 
A 1 91  ARG 91  89  89  ARG ARG A . n 
A 1 92  PRO 92  90  90  PRO PRO A . n 
A 1 93  THR 93  91  91  THR THR A . n 
A 1 94  GLY 94  92  92  GLY GLY A . n 
A 1 95  GLU 95  93  93  GLU GLU A . n 
A 1 96  LEU 96  94  94  LEU LEU A . n 
A 1 97  MET 97  95  95  MET MET A . n 
A 1 98  PRO 98  96  96  PRO PRO A . n 
A 1 99  LEU 99  97  97  LEU LEU A . n 
A 1 100 ALA 100 98  98  ALA ALA A . n 
A 1 101 ALA 101 99  99  ALA ALA A . n 
A 1 102 ARG 102 100 100 ARG ARG A . n 
A 1 103 MET 103 101 101 MET MET A . n 
A 1 104 GLY 104 102 102 GLY GLY A . n 
A 1 105 THR 105 103 103 THR THR A . n 
A 1 106 HIS 106 104 104 HIS HIS A . n 
A 1 107 ALA 107 105 105 ALA ALA A . n 
A 1 108 THR 108 106 106 THR THR A . n 
A 1 109 MET 109 107 107 MET MET A . n 
A 1 110 LYS 110 108 108 LYS LYS A . n 
A 1 111 ILE 111 109 109 ILE ILE A . n 
A 1 112 GLN 112 110 110 GLN GLN A . n 
A 1 113 GLY 113 111 111 GLY GLY A . n 
A 1 114 ALA 114 112 112 ALA ALA A . n 
A 1 115 THR 115 113 113 THR THR A . n 
A 1 116 VAL 116 114 114 VAL VAL A . n 
A 1 117 GLY 117 115 115 GLY GLY A . n 
A 1 118 GLY 118 116 116 GLY GLY A . n 
A 1 119 GLN 119 117 117 GLN GLN A . n 
A 1 120 MET 120 118 118 MET MET A . n 
A 1 121 GLY 121 119 119 GLY GLY A . n 
A 1 122 MET 122 120 120 MET MET A . n 
A 1 123 LEU 123 121 121 LEU LEU A . n 
A 1 124 LEU 124 122 122 LEU LEU A . n 
A 1 125 THR 125 123 123 THR THR A . n 
A 1 126 GLY 126 124 ?   ?   ?   A . n 
A 1 127 SER 127 125 ?   ?   ?   A . n 
A 1 128 ASN 128 126 ?   ?   ?   A . n 
A 1 129 ALA 129 127 ?   ?   ?   A . n 
A 1 130 LYS 130 128 ?   ?   ?   A . n 
A 1 131 SER 131 129 ?   ?   ?   A . n 
A 1 132 MET 132 130 ?   ?   ?   A . n 
A 1 133 ASP 133 131 ?   ?   ?   A . n 
A 1 134 LEU 134 132 132 LEU LEU A . n 
A 1 135 GLY 135 133 133 GLY GLY A . n 
A 1 136 THR 136 134 134 THR THR A . n 
A 1 137 THR 137 135 135 THR THR A . n 
A 1 138 PRO 138 136 136 PRO PRO A . n 
A 1 139 GLY 139 137 137 GLY GLY A . n 
A 1 140 ASP 140 138 138 ASP ASP A . n 
A 1 141 CYS 141 139 139 CYS CYS A . n 
A 1 142 GLY 142 140 140 GLY GLY A . n 
A 1 143 CYS 143 141 141 CYS CYS A . n 
A 1 144 PRO 144 142 142 PRO PRO A . n 
A 1 145 TYR 145 143 143 TYR TYR A . n 
A 1 146 ILE 146 144 144 ILE ILE A . n 
A 1 147 TYR 147 145 145 TYR TYR A . n 
A 1 148 LYS 148 146 146 LYS LYS A . n 
A 1 149 ARG 149 147 147 ARG ARG A . n 
A 1 150 GLY 150 148 148 GLY GLY A . n 
A 1 151 ASN 151 149 149 ASN ASN A . n 
A 1 152 ASP 152 150 150 ASP ASP A . n 
A 1 153 TYR 153 151 151 TYR TYR A . n 
A 1 154 VAL 154 152 152 VAL VAL A . n 
A 1 155 VAL 155 153 153 VAL VAL A . n 
A 1 156 ILE 156 154 154 ILE ILE A . n 
A 1 157 GLY 157 155 155 GLY GLY A . n 
A 1 158 VAL 158 156 156 VAL VAL A . n 
A 1 159 HIS 159 157 157 HIS HIS A . n 
A 1 160 THR 160 158 158 THR THR A . n 
A 1 161 ALA 161 159 159 ALA ALA A . n 
A 1 162 ALA 162 160 160 ALA ALA A . n 
A 1 163 ALA 163 161 161 ALA ALA A . n 
A 1 164 ARG 164 162 162 ARG ARG A . n 
A 1 165 GLY 165 163 163 GLY GLY A . n 
A 1 166 GLY 166 164 164 GLY GLY A . n 
A 1 167 ASN 167 165 165 ASN ASN A . n 
A 1 168 THR 168 166 166 THR THR A . n 
A 1 169 VAL 169 167 167 VAL VAL A . n 
A 1 170 ILE 170 168 168 ILE ILE A . n 
A 1 171 CYS 171 169 169 CYS CYS A . n 
A 1 172 ALA 172 170 170 ALA ALA A . n 
A 1 173 THR 173 171 171 THR THR A . n 
A 1 174 GLN 174 172 172 GLN GLN A . n 
A 1 175 GLY 175 173 ?   ?   ?   A . n 
A 1 176 SER 176 174 ?   ?   ?   A . n 
A 1 177 GLU 177 175 ?   ?   ?   A . n 
A 1 178 GLY 178 176 ?   ?   ?   A . n 
A 1 179 GLU 179 177 ?   ?   ?   A . n 
A 1 180 ALA 180 178 ?   ?   ?   A . n 
A 1 181 MET 181 179 ?   ?   ?   A . n 
A 1 182 LEU 182 180 ?   ?   ?   A . n 
A 1 183 GLU 183 181 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        AG7 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   AG7 
_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        ? 
# 
_pdbx_nonpoly_scheme.asym_id         B 
_pdbx_nonpoly_scheme.entity_id       2 
_pdbx_nonpoly_scheme.mon_id          AG7 
_pdbx_nonpoly_scheme.ndb_seq_num     1 
_pdbx_nonpoly_scheme.pdb_seq_num     201 
_pdbx_nonpoly_scheme.auth_seq_num    201 
_pdbx_nonpoly_scheme.pdb_mon_id      AG7 
_pdbx_nonpoly_scheme.auth_mon_id     AG7 
_pdbx_nonpoly_scheme.pdb_strand_id   A 
_pdbx_nonpoly_scheme.pdb_ins_code    . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.21rc1_5156 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .            2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .            3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .            4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9DAL 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     95.050 
_cell.length_a_esd                 ? 
_cell.length_b                     95.050 
_cell.length_b_esd                 ? 
_cell.length_c                     46.180 
_cell.length_c_esd                 ? 
_cell.volume                       361317.339 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_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                         9DAL 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                154 
_symmetry.space_group_name_Hall            
;P 32 2"
;
_symmetry.space_group_name_H-M             'P 32 2 1' 
_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                   9DAL 
_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             3.10 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          60.34 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              9 
_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    '0.1 M BICINE pH 9.0, 10% (w/v) PEG 20000; 2%(v/v) 1,4-Dioxane' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            298 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 2M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-05-18 
_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   0.97741 
_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                        'ALS BEAMLINE 5.0.1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97741 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   5.0.1 
_diffrn_source.pdbx_synchrotron_site       ALS 
# 
_reflns.B_iso_Wilson_estimate                          71.56 
_reflns.entry_id                                       9DAL 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.6 
_reflns.d_resolution_low                               41.16 
_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                                     7621 
_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                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                18.0 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          26.5 
_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                                0.081 
_reflns.pdbx_Rpim_I_all                                0.019 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   1 
_reflns.pdbx_CC_star                                   1 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.079 
_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                                    2.6 
_reflns_shell.d_res_low                                     2.64 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.8 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             378 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.352 
_reflns_shell.pdbx_CC_star                                  0.722 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          100 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_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                               77.35 
_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                                 9DAL 
_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                            2.60 
_refine.ls_d_res_low                             41.16 
_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                     7618 
_refine.ls_number_reflns_R_free                  768 
_refine.ls_number_reflns_R_work                  6850 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.96 
_refine.ls_percent_reflns_R_free                 10.08 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2255 
_refine.ls_R_factor_R_free                       0.2470 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2230 
_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                          1.34 
_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                 29.8946 
_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                            0.3203 
_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                       2.60 
_refine_hist.d_res_low                        41.16 
_refine_hist.number_atoms_solvent             0 
_refine_hist.number_atoms_total               1280 
_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        1237 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         43 
_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' ? 0.0109 ? 1313 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.9378 ? 1783 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0472 ? 199  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0056 ? 226  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 8.6162 ? 182  ? 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' 2.60 2.80  . . 151 1350 100.00 . . . . 0.2867 . . . . . . . . . . . 0.3265 
'X-RAY DIFFRACTION' 2.80 3.08  . . 151 1358 100.00 . . . . 0.3177 . . . . . . . . . . . 0.3552 
'X-RAY DIFFRACTION' 3.08 3.53  . . 151 1353 100.00 . . . . 0.2666 . . . . . . . . . . . 0.3158 
'X-RAY DIFFRACTION' 3.53 4.44  . . 155 1360 100.00 . . . . 0.2126 . . . . . . . . . . . 0.2378 
'X-RAY DIFFRACTION' 4.45 41.16 . . 160 1429 99.81  . . . . 0.1895 . . . . . . . . . . . 0.1985 
# 
_struct.entry_id                     9DAL 
_struct.title                        'Human norovirus GII.3 R112A mutant protease in complex with rupintrivir' 
_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        9DAL 
_struct_keywords.text            'Viral protease with inhibitor, VIRAL PROTEIN' 
_struct_keywords.pdbx_keywords   'VIRAL 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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    B2DD26_9CALI 
_struct_ref.pdbx_db_accession          B2DD26 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;APPSIWSRIVNFGSGWGFWVSPSLFITSTHVIPQGTQEFFGVPTKQIQIHKSGEFCRLRFPKPIRTDVTGMILEEGAPEG
TVATLLIKRPTGELMPLAARMGTHATMKIQGRTVGGQMGMLLTGSNAKSMDLGTTPGDCGCPYIYKRGNDYVVIGVHTAA
ARGGNTVICATQGSEGEAMLE
;
_struct_ref.pdbx_align_begin           1009 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9DAL 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 3 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 183 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             B2DD26 
_struct_ref_seq.db_align_beg                  1009 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  1189 
_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       181 
# 
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 9DAL GLY A 1   ? UNP B2DD26 ?   ?    'expression tag'      -1  1 
1 9DAL PRO A 2   ? UNP B2DD26 ?   ?    'expression tag'      0   2 
1 9DAL ALA A 114 ? UNP B2DD26 ARG 1120 'engineered mutation' 112 3 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
_struct_conf.conf_type_id            HELX_P 
_struct_conf.id                      HELX_P1 
_struct_conf.pdbx_PDB_helix_id       AA1 
_struct_conf.beg_label_comp_id       PRO 
_struct_conf.beg_label_asym_id       A 
_struct_conf.beg_label_seq_id        4 
_struct_conf.pdbx_beg_PDB_ins_code   ? 
_struct_conf.end_label_comp_id       ARG 
_struct_conf.end_label_asym_id       A 
_struct_conf.end_label_seq_id        10 
_struct_conf.pdbx_end_PDB_ins_code   ? 
_struct_conf.beg_auth_comp_id        PRO 
_struct_conf.beg_auth_asym_id        A 
_struct_conf.beg_auth_seq_id         2 
_struct_conf.end_auth_comp_id        ARG 
_struct_conf.end_auth_asym_id        A 
_struct_conf.end_auth_seq_id         8 
_struct_conf.pdbx_PDB_helix_class    1 
_struct_conf.details                 ? 
_struct_conf.pdbx_PDB_helix_length   7 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 2 ? 
AA3 ? 8 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? parallel      
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA3 4 5 ? anti-parallel 
AA3 5 6 ? anti-parallel 
AA3 6 7 ? anti-parallel 
AA3 7 8 ? 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 11  ? PHE A 14  ? ILE A 9   PHE A 12  
AA1 2 GLY A 17  ? TRP A 21  ? GLY A 15  TRP A 19  
AA1 3 LEU A 26  ? SER A 30  ? LEU A 24  SER A 28  
AA1 4 PHE A 57  ? ARG A 61  ? PHE A 55  ARG A 59  
AA1 5 GLN A 50  ? SER A 54  ? GLN A 48  SER A 52  
AA2 1 GLU A 40  ? PHE A 41  ? GLU A 38  PHE A 39  
AA2 2 VAL A 44  ? PRO A 45  ? VAL A 42  PRO A 43  
AA3 1 ILE A 74  ? LEU A 75  ? ILE A 72  LEU A 73  
AA3 2 ASP A 152 ? ALA A 162 ? ASP A 150 ALA A 160 
AA3 3 THR A 168 ? ALA A 172 ? THR A 166 ALA A 170 
AA3 4 ALA A 114 ? LEU A 123 ? ALA A 112 LEU A 121 
AA3 5 LEU A 96  ? ILE A 111 ? LEU A 94  ILE A 109 
AA3 6 VAL A 84  ? LYS A 90  ? VAL A 82  LYS A 88  
AA3 7 PRO A 144 ? ARG A 149 ? PRO A 142 ARG A 147 
AA3 8 ASP A 152 ? ALA A 162 ? ASP A 150 ALA A 160 
# 
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 VAL A 12  ? N VAL A 10  O GLY A 19  ? O GLY A 17  
AA1 2 3 N PHE A 20  ? N PHE A 18  O ILE A 28  ? O ILE A 26  
AA1 3 4 N PHE A 27  ? N PHE A 25  O LEU A 60  ? O LEU A 58  
AA1 4 5 O ARG A 61  ? O ARG A 59  N GLN A 50  ? N GLN A 48  
AA2 1 2 N PHE A 41  ? N PHE A 39  O VAL A 44  ? O VAL A 42  
AA3 1 2 N ILE A 74  ? N ILE A 72  O VAL A 155 ? O VAL A 153 
AA3 2 3 N ALA A 161 ? N ALA A 159 O ILE A 170 ? O ILE A 168 
AA3 3 4 O VAL A 169 ? O VAL A 167 N GLY A 121 ? N GLY A 119 
AA3 4 5 O MET A 120 ? O MET A 118 N GLY A 104 ? N GLY A 102 
AA3 5 6 O LEU A 99  ? O LEU A 97  N LEU A 87  ? N LEU A 85  
AA3 6 7 N THR A 86  ? N THR A 84  O ILE A 146 ? O ILE A 144 
AA3 7 8 N ARG A 149 ? N ARG A 147 O ASP A 152 ? O ASP A 150 
# 
_pdbx_entry_details.entry_id                   9DAL 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 ARG A 65  ? ? -109.75 77.57  
2 1 THR A 158 ? ? -137.89 -41.79 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z          
2 -y,x-y,z+2/3   
3 -x+y,-x,z+1/3  
4 x-y,-y,-z+1/3  
5 -x,-x+y,-z+2/3 
6 y,x,-z         
# 
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 GLY -1  ? A GLY 1   
2  1 Y 1 A GLY 124 ? A GLY 126 
3  1 Y 1 A SER 125 ? A SER 127 
4  1 Y 1 A ASN 126 ? A ASN 128 
5  1 Y 1 A ALA 127 ? A ALA 129 
6  1 Y 1 A LYS 128 ? A LYS 130 
7  1 Y 1 A SER 129 ? A SER 131 
8  1 Y 1 A MET 130 ? A MET 132 
9  1 Y 1 A ASP 131 ? A ASP 133 
10 1 Y 1 A GLY 173 ? A GLY 175 
11 1 Y 1 A SER 174 ? A SER 176 
12 1 Y 1 A GLU 175 ? A GLU 177 
13 1 Y 1 A GLY 176 ? A GLY 178 
14 1 Y 1 A GLU 177 ? A GLU 179 
15 1 Y 1 A ALA 178 ? A ALA 180 
16 1 Y 1 A MET 179 ? A MET 181 
17 1 Y 1 A LEU 180 ? A LEU 182 
18 1 Y 1 A GLU 181 ? A GLU 183 
# 
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 
AG7 C01  C N N 1   
AG7 C02  C N N 2   
AG7 O03  O N N 3   
AG7 C04  C N R 4   
AG7 C05  C N N 5   
AG7 C06  C Y N 6   
AG7 C07  C Y N 7   
AG7 C08  C Y N 8   
AG7 C09  C Y N 9   
AG7 C10  C Y N 10  
AG7 C11  C Y N 11  
AG7 N12  N N N 12  
AG7 C13  C N R 13  
AG7 C14  C N N 14  
AG7 C15  C N S 15  
AG7 C16  C N N 16  
AG7 N17  N N N 17  
AG7 O18  O N N 18  
AG7 C19  C N N 19  
AG7 C20  C N N 20  
AG7 C21  C N N 21  
AG7 O22  O N N 22  
AG7 O23  O N N 23  
AG7 C47  C N N 24  
AG7 O48  O N N 25  
AG7 C50  C N N 26  
AG7 C53  C N N 27  
AG7 C57  C N S 28  
AG7 N58  N N N 29  
AG7 C59  C N N 30  
AG7 O60  O N N 31  
AG7 C78  C N N 32  
AG7 C81  C N N 33  
AG7 F1   F N N 34  
AG7 C82  C N N 35  
AG7 C83  C N N 36  
AG7 C84  C N N 37  
AG7 C1   C Y N 38  
AG7 C2   C Y N 39  
AG7 C3   C Y N 40  
AG7 O4   O Y N 41  
AG7 N5   N Y N 42  
AG7 C4   C N N 43  
AG7 H2   H N N 44  
AG7 H3   H N N 45  
AG7 H27  H N N 46  
AG7 H28  H N N 47  
AG7 H29  H N N 48  
AG7 H30  H N N 49  
AG7 H31  H N N 50  
AG7 H33  H N N 51  
AG7 H34  H N N 52  
AG7 H49  H N N 53  
AG7 H91  H N N 54  
AG7 H35  H N N 55  
AG7 H36  H N N 56  
AG7 H94  H N N 57  
AG7 H39  H N N 58  
AG7 H191 H N N 59  
AG7 H192 H N N 60  
AG7 H41  H N N 61  
AG7 H42  H N N 62  
AG7 H51  H N N 63  
AG7 H52  H N N 64  
AG7 H53  H N N 65  
AG7 H54  H N N 66  
AG7 H56  H N N 67  
AG7 H77  H N N 68  
AG7 H61  H N N 69  
AG7 H79  H N N 70  
AG7 H82  H N N 71  
AG7 H84  H N N 72  
AG7 H85  H N N 73  
AG7 H86  H N N 74  
AG7 H87  H N N 75  
AG7 H88  H N N 76  
AG7 H89  H N N 77  
AG7 H90  H N N 78  
AG7 H92  H N N 79  
AG7 H93  H N N 80  
AG7 H8   H N N 81  
AG7 H5   H N N 82  
AG7 H6   H N N 83  
AG7 H7   H N N 84  
ALA N    N N N 85  
ALA CA   C N S 86  
ALA C    C N N 87  
ALA O    O N N 88  
ALA CB   C N N 89  
ALA OXT  O N N 90  
ALA H    H N N 91  
ALA H2   H N N 92  
ALA HA   H N N 93  
ALA HB1  H N N 94  
ALA HB2  H N N 95  
ALA HB3  H N N 96  
ALA HXT  H N N 97  
ARG N    N N N 98  
ARG CA   C N S 99  
ARG C    C N N 100 
ARG O    O N N 101 
ARG CB   C N N 102 
ARG CG   C N N 103 
ARG CD   C N N 104 
ARG NE   N N N 105 
ARG CZ   C N N 106 
ARG NH1  N N N 107 
ARG NH2  N N N 108 
ARG OXT  O N N 109 
ARG H    H N N 110 
ARG H2   H N N 111 
ARG HA   H N N 112 
ARG HB2  H N N 113 
ARG HB3  H N N 114 
ARG HG2  H N N 115 
ARG HG3  H N N 116 
ARG HD2  H N N 117 
ARG HD3  H N N 118 
ARG HE   H N N 119 
ARG HH11 H N N 120 
ARG HH12 H N N 121 
ARG HH21 H N N 122 
ARG HH22 H N N 123 
ARG HXT  H N N 124 
ASN N    N N N 125 
ASN CA   C N S 126 
ASN C    C N N 127 
ASN O    O N N 128 
ASN CB   C N N 129 
ASN CG   C N N 130 
ASN OD1  O N N 131 
ASN ND2  N N N 132 
ASN OXT  O N N 133 
ASN H    H N N 134 
ASN H2   H N N 135 
ASN HA   H N N 136 
ASN HB2  H N N 137 
ASN HB3  H N N 138 
ASN HD21 H N N 139 
ASN HD22 H N N 140 
ASN HXT  H N N 141 
ASP N    N N N 142 
ASP CA   C N S 143 
ASP C    C N N 144 
ASP O    O N N 145 
ASP CB   C N N 146 
ASP CG   C N N 147 
ASP OD1  O N N 148 
ASP OD2  O N N 149 
ASP OXT  O N N 150 
ASP H    H N N 151 
ASP H2   H N N 152 
ASP HA   H N N 153 
ASP HB2  H N N 154 
ASP HB3  H N N 155 
ASP HD2  H N N 156 
ASP HXT  H N N 157 
CYS N    N N N 158 
CYS CA   C N R 159 
CYS C    C N N 160 
CYS O    O N N 161 
CYS CB   C N N 162 
CYS SG   S N N 163 
CYS OXT  O N N 164 
CYS H    H N N 165 
CYS H2   H N N 166 
CYS HA   H N N 167 
CYS HB2  H N N 168 
CYS HB3  H N N 169 
CYS HG   H N N 170 
CYS HXT  H N N 171 
GLN N    N N N 172 
GLN CA   C N S 173 
GLN C    C N N 174 
GLN O    O N N 175 
GLN CB   C N N 176 
GLN CG   C N N 177 
GLN CD   C N N 178 
GLN OE1  O N N 179 
GLN NE2  N N N 180 
GLN OXT  O N N 181 
GLN H    H N N 182 
GLN H2   H N N 183 
GLN HA   H N N 184 
GLN HB2  H N N 185 
GLN HB3  H N N 186 
GLN HG2  H N N 187 
GLN HG3  H N N 188 
GLN HE21 H N N 189 
GLN HE22 H N N 190 
GLN HXT  H N N 191 
GLU N    N N N 192 
GLU CA   C N S 193 
GLU C    C N N 194 
GLU O    O N N 195 
GLU CB   C N N 196 
GLU CG   C N N 197 
GLU CD   C N N 198 
GLU OE1  O N N 199 
GLU OE2  O N N 200 
GLU OXT  O N N 201 
GLU H    H N N 202 
GLU H2   H N N 203 
GLU HA   H N N 204 
GLU HB2  H N N 205 
GLU HB3  H N N 206 
GLU HG2  H N N 207 
GLU HG3  H N N 208 
GLU HE2  H N N 209 
GLU HXT  H N N 210 
GLY N    N N N 211 
GLY CA   C N N 212 
GLY C    C N N 213 
GLY O    O N N 214 
GLY OXT  O N N 215 
GLY H    H N N 216 
GLY H2   H N N 217 
GLY HA2  H N N 218 
GLY HA3  H N N 219 
GLY HXT  H N N 220 
HIS N    N N N 221 
HIS CA   C N S 222 
HIS C    C N N 223 
HIS O    O N N 224 
HIS CB   C N N 225 
HIS CG   C Y N 226 
HIS ND1  N Y N 227 
HIS CD2  C Y N 228 
HIS CE1  C Y N 229 
HIS NE2  N Y N 230 
HIS OXT  O N N 231 
HIS H    H N N 232 
HIS H2   H N N 233 
HIS HA   H N N 234 
HIS HB2  H N N 235 
HIS HB3  H N N 236 
HIS HD1  H N N 237 
HIS HD2  H N N 238 
HIS HE1  H N N 239 
HIS HE2  H N N 240 
HIS HXT  H N N 241 
ILE N    N N N 242 
ILE CA   C N S 243 
ILE C    C N N 244 
ILE O    O N N 245 
ILE CB   C N S 246 
ILE CG1  C N N 247 
ILE CG2  C N N 248 
ILE CD1  C N N 249 
ILE OXT  O N N 250 
ILE H    H N N 251 
ILE H2   H N N 252 
ILE HA   H N N 253 
ILE HB   H N N 254 
ILE HG12 H N N 255 
ILE HG13 H N N 256 
ILE HG21 H N N 257 
ILE HG22 H N N 258 
ILE HG23 H N N 259 
ILE HD11 H N N 260 
ILE HD12 H N N 261 
ILE HD13 H N N 262 
ILE HXT  H N N 263 
LEU N    N N N 264 
LEU CA   C N S 265 
LEU C    C N N 266 
LEU O    O N N 267 
LEU CB   C N N 268 
LEU CG   C N N 269 
LEU CD1  C N N 270 
LEU CD2  C N N 271 
LEU OXT  O N N 272 
LEU H    H N N 273 
LEU H2   H N N 274 
LEU HA   H N N 275 
LEU HB2  H N N 276 
LEU HB3  H N N 277 
LEU HG   H N N 278 
LEU HD11 H N N 279 
LEU HD12 H N N 280 
LEU HD13 H N N 281 
LEU HD21 H N N 282 
LEU HD22 H N N 283 
LEU HD23 H N N 284 
LEU HXT  H N N 285 
LYS N    N N N 286 
LYS CA   C N S 287 
LYS C    C N N 288 
LYS O    O N N 289 
LYS CB   C N N 290 
LYS CG   C N N 291 
LYS CD   C N N 292 
LYS CE   C N N 293 
LYS NZ   N N N 294 
LYS OXT  O N N 295 
LYS H    H N N 296 
LYS H2   H N N 297 
LYS HA   H N N 298 
LYS HB2  H N N 299 
LYS HB3  H N N 300 
LYS HG2  H N N 301 
LYS HG3  H N N 302 
LYS HD2  H N N 303 
LYS HD3  H N N 304 
LYS HE2  H N N 305 
LYS HE3  H N N 306 
LYS HZ1  H N N 307 
LYS HZ2  H N N 308 
LYS HZ3  H N N 309 
LYS HXT  H N N 310 
MET N    N N N 311 
MET CA   C N S 312 
MET C    C N N 313 
MET O    O N N 314 
MET CB   C N N 315 
MET CG   C N N 316 
MET SD   S N N 317 
MET CE   C N N 318 
MET OXT  O N N 319 
MET H    H N N 320 
MET H2   H N N 321 
MET HA   H N N 322 
MET HB2  H N N 323 
MET HB3  H N N 324 
MET HG2  H N N 325 
MET HG3  H N N 326 
MET HE1  H N N 327 
MET HE2  H N N 328 
MET HE3  H N N 329 
MET HXT  H N N 330 
PHE N    N N N 331 
PHE CA   C N S 332 
PHE C    C N N 333 
PHE O    O N N 334 
PHE CB   C N N 335 
PHE CG   C Y N 336 
PHE CD1  C Y N 337 
PHE CD2  C Y N 338 
PHE CE1  C Y N 339 
PHE CE2  C Y N 340 
PHE CZ   C Y N 341 
PHE OXT  O N N 342 
PHE H    H N N 343 
PHE H2   H N N 344 
PHE HA   H N N 345 
PHE HB2  H N N 346 
PHE HB3  H N N 347 
PHE HD1  H N N 348 
PHE HD2  H N N 349 
PHE HE1  H N N 350 
PHE HE2  H N N 351 
PHE HZ   H N N 352 
PHE HXT  H N N 353 
PRO N    N N N 354 
PRO CA   C N S 355 
PRO C    C N N 356 
PRO O    O N N 357 
PRO CB   C N N 358 
PRO CG   C N N 359 
PRO CD   C N N 360 
PRO OXT  O N N 361 
PRO H    H N N 362 
PRO HA   H N N 363 
PRO HB2  H N N 364 
PRO HB3  H N N 365 
PRO HG2  H N N 366 
PRO HG3  H N N 367 
PRO HD2  H N N 368 
PRO HD3  H N N 369 
PRO HXT  H N N 370 
SER N    N N N 371 
SER CA   C N S 372 
SER C    C N N 373 
SER O    O N N 374 
SER CB   C N N 375 
SER OG   O N N 376 
SER OXT  O N N 377 
SER H    H N N 378 
SER H2   H N N 379 
SER HA   H N N 380 
SER HB2  H N N 381 
SER HB3  H N N 382 
SER HG   H N N 383 
SER HXT  H N N 384 
THR N    N N N 385 
THR CA   C N S 386 
THR C    C N N 387 
THR O    O N N 388 
THR CB   C N R 389 
THR OG1  O N N 390 
THR CG2  C N N 391 
THR OXT  O N N 392 
THR H    H N N 393 
THR H2   H N N 394 
THR HA   H N N 395 
THR HB   H N N 396 
THR HG1  H N N 397 
THR HG21 H N N 398 
THR HG22 H N N 399 
THR HG23 H N N 400 
THR HXT  H N N 401 
TRP N    N N N 402 
TRP CA   C N S 403 
TRP C    C N N 404 
TRP O    O N N 405 
TRP CB   C N N 406 
TRP CG   C Y N 407 
TRP CD1  C Y N 408 
TRP CD2  C Y N 409 
TRP NE1  N Y N 410 
TRP CE2  C Y N 411 
TRP CE3  C Y N 412 
TRP CZ2  C Y N 413 
TRP CZ3  C Y N 414 
TRP CH2  C Y N 415 
TRP OXT  O N N 416 
TRP H    H N N 417 
TRP H2   H N N 418 
TRP HA   H N N 419 
TRP HB2  H N N 420 
TRP HB3  H N N 421 
TRP HD1  H N N 422 
TRP HE1  H N N 423 
TRP HE3  H N N 424 
TRP HZ2  H N N 425 
TRP HZ3  H N N 426 
TRP HH2  H N N 427 
TRP HXT  H N N 428 
TYR N    N N N 429 
TYR CA   C N S 430 
TYR C    C N N 431 
TYR O    O N N 432 
TYR CB   C N N 433 
TYR CG   C Y N 434 
TYR CD1  C Y N 435 
TYR CD2  C Y N 436 
TYR CE1  C Y N 437 
TYR CE2  C Y N 438 
TYR CZ   C Y N 439 
TYR OH   O N N 440 
TYR OXT  O N N 441 
TYR H    H N N 442 
TYR H2   H N N 443 
TYR HA   H N N 444 
TYR HB2  H N N 445 
TYR HB3  H N N 446 
TYR HD1  H N N 447 
TYR HD2  H N N 448 
TYR HE1  H N N 449 
TYR HE2  H N N 450 
TYR HH   H N N 451 
TYR HXT  H N N 452 
VAL N    N N N 453 
VAL CA   C N S 454 
VAL C    C N N 455 
VAL O    O N N 456 
VAL CB   C N N 457 
VAL CG1  C N N 458 
VAL CG2  C N N 459 
VAL OXT  O N N 460 
VAL H    H N N 461 
VAL H2   H N N 462 
VAL HA   H N N 463 
VAL HB   H N N 464 
VAL HG11 H N N 465 
VAL HG12 H N N 466 
VAL HG13 H N N 467 
VAL HG21 H N N 468 
VAL HG22 H N N 469 
VAL HG23 H N N 470 
VAL HXT  H N N 471 
# 
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 
AG7 C01 C02  sing N N 1   
AG7 C01 O03  doub N N 2   
AG7 C01 C57  sing N N 3   
AG7 C02 C04  sing N N 4   
AG7 C02 H2   sing N N 5   
AG7 C02 H3   sing N N 6   
AG7 C04 C05  sing N N 7   
AG7 C04 C47  sing N N 8   
AG7 C04 H27  sing N N 9   
AG7 C05 C06  sing N N 10  
AG7 C05 H28  sing N N 11  
AG7 C05 H29  sing N N 12  
AG7 C06 C07  doub Y N 13  
AG7 C06 C11  sing Y N 14  
AG7 C07 C08  sing Y N 15  
AG7 C07 H30  sing N N 16  
AG7 C08 C09  doub Y N 17  
AG7 C08 H31  sing N N 18  
AG7 C09 C10  sing Y N 19  
AG7 C09 F1   sing N N 20  
AG7 C10 C11  doub Y N 21  
AG7 C10 H33  sing N N 22  
AG7 C11 H34  sing N N 23  
AG7 N12 C13  sing N N 24  
AG7 N12 C47  sing N N 25  
AG7 N12 H49  sing N N 26  
AG7 C13 C14  sing N N 27  
AG7 C13 C19  sing N N 28  
AG7 C13 H91  sing N N 29  
AG7 C14 C15  sing N N 30  
AG7 C14 H35  sing N N 31  
AG7 C14 H36  sing N N 32  
AG7 C15 C16  sing N N 33  
AG7 C15 C84  sing N N 34  
AG7 C15 H94  sing N N 35  
AG7 C16 N17  sing N N 36  
AG7 C16 O18  doub N N 37  
AG7 N17 C83  sing N N 38  
AG7 N17 H39  sing N N 39  
AG7 C19 C20  sing N N 40  
AG7 C19 H191 sing N N 41  
AG7 C19 H192 sing N N 42  
AG7 C20 C21  sing N N 43  
AG7 C20 H41  sing N N 44  
AG7 C20 H42  sing N N 45  
AG7 C21 O22  sing N N 46  
AG7 C21 O23  doub N N 47  
AG7 O22 C50  sing N N 48  
AG7 C47 O48  doub N N 49  
AG7 C50 C53  sing N N 50  
AG7 C50 H51  sing N N 51  
AG7 C50 H52  sing N N 52  
AG7 C53 H53  sing N N 53  
AG7 C53 H54  sing N N 54  
AG7 C53 H56  sing N N 55  
AG7 C57 N58  sing N N 56  
AG7 C57 C78  sing N N 57  
AG7 C57 H77  sing N N 58  
AG7 N58 C59  sing N N 59  
AG7 N58 H61  sing N N 60  
AG7 C59 O60  doub N N 61  
AG7 C59 C1   sing N N 62  
AG7 C78 C81  sing N N 63  
AG7 C78 C82  sing N N 64  
AG7 C78 H79  sing N N 65  
AG7 C81 H82  sing N N 66  
AG7 C81 H84  sing N N 67  
AG7 C81 H85  sing N N 68  
AG7 C82 H86  sing N N 69  
AG7 C82 H87  sing N N 70  
AG7 C82 H88  sing N N 71  
AG7 C83 C84  sing N N 72  
AG7 C83 H89  sing N N 73  
AG7 C83 H90  sing N N 74  
AG7 C84 H92  sing N N 75  
AG7 C84 H93  sing N N 76  
AG7 C1  C2   sing Y N 77  
AG7 C1  N5   doub Y N 78  
AG7 C2  C3   doub Y N 79  
AG7 C2  H8   sing N N 80  
AG7 C3  O4   sing Y N 81  
AG7 C3  C4   sing N N 82  
AG7 O4  N5   sing Y N 83  
AG7 C4  H5   sing N N 84  
AG7 C4  H6   sing N N 85  
AG7 C4  H7   sing N N 86  
ALA N   CA   sing N N 87  
ALA N   H    sing N N 88  
ALA N   H2   sing N N 89  
ALA CA  C    sing N N 90  
ALA CA  CB   sing N N 91  
ALA CA  HA   sing N N 92  
ALA C   O    doub N N 93  
ALA C   OXT  sing N N 94  
ALA CB  HB1  sing N N 95  
ALA CB  HB2  sing N N 96  
ALA CB  HB3  sing N N 97  
ALA OXT HXT  sing N N 98  
ARG N   CA   sing N N 99  
ARG N   H    sing N N 100 
ARG N   H2   sing N N 101 
ARG CA  C    sing N N 102 
ARG CA  CB   sing N N 103 
ARG CA  HA   sing N N 104 
ARG C   O    doub N N 105 
ARG C   OXT  sing N N 106 
ARG CB  CG   sing N N 107 
ARG CB  HB2  sing N N 108 
ARG CB  HB3  sing N N 109 
ARG CG  CD   sing N N 110 
ARG CG  HG2  sing N N 111 
ARG CG  HG3  sing N N 112 
ARG CD  NE   sing N N 113 
ARG CD  HD2  sing N N 114 
ARG CD  HD3  sing N N 115 
ARG NE  CZ   sing N N 116 
ARG NE  HE   sing N N 117 
ARG CZ  NH1  sing N N 118 
ARG CZ  NH2  doub N N 119 
ARG NH1 HH11 sing N N 120 
ARG NH1 HH12 sing N N 121 
ARG NH2 HH21 sing N N 122 
ARG NH2 HH22 sing N N 123 
ARG OXT HXT  sing N N 124 
ASN N   CA   sing N N 125 
ASN N   H    sing N N 126 
ASN N   H2   sing N N 127 
ASN CA  C    sing N N 128 
ASN CA  CB   sing N N 129 
ASN CA  HA   sing N N 130 
ASN C   O    doub N N 131 
ASN C   OXT  sing N N 132 
ASN CB  CG   sing N N 133 
ASN CB  HB2  sing N N 134 
ASN CB  HB3  sing N N 135 
ASN CG  OD1  doub N N 136 
ASN CG  ND2  sing N N 137 
ASN ND2 HD21 sing N N 138 
ASN ND2 HD22 sing N N 139 
ASN OXT HXT  sing N N 140 
ASP N   CA   sing N N 141 
ASP N   H    sing N N 142 
ASP N   H2   sing N N 143 
ASP CA  C    sing N N 144 
ASP CA  CB   sing N N 145 
ASP CA  HA   sing N N 146 
ASP C   O    doub N N 147 
ASP C   OXT  sing N N 148 
ASP CB  CG   sing N N 149 
ASP CB  HB2  sing N N 150 
ASP CB  HB3  sing N N 151 
ASP CG  OD1  doub N N 152 
ASP CG  OD2  sing N N 153 
ASP OD2 HD2  sing N N 154 
ASP OXT HXT  sing N N 155 
CYS N   CA   sing N N 156 
CYS N   H    sing N N 157 
CYS N   H2   sing N N 158 
CYS CA  C    sing N N 159 
CYS CA  CB   sing N N 160 
CYS CA  HA   sing N N 161 
CYS C   O    doub N N 162 
CYS C   OXT  sing N N 163 
CYS CB  SG   sing N N 164 
CYS CB  HB2  sing N N 165 
CYS CB  HB3  sing N N 166 
CYS SG  HG   sing N N 167 
CYS OXT HXT  sing N N 168 
GLN N   CA   sing N N 169 
GLN N   H    sing N N 170 
GLN N   H2   sing N N 171 
GLN CA  C    sing N N 172 
GLN CA  CB   sing N N 173 
GLN CA  HA   sing N N 174 
GLN C   O    doub N N 175 
GLN C   OXT  sing N N 176 
GLN CB  CG   sing N N 177 
GLN CB  HB2  sing N N 178 
GLN CB  HB3  sing N N 179 
GLN CG  CD   sing N N 180 
GLN CG  HG2  sing N N 181 
GLN CG  HG3  sing N N 182 
GLN CD  OE1  doub N N 183 
GLN CD  NE2  sing N N 184 
GLN NE2 HE21 sing N N 185 
GLN NE2 HE22 sing N N 186 
GLN OXT HXT  sing N N 187 
GLU N   CA   sing N N 188 
GLU N   H    sing N N 189 
GLU N   H2   sing N N 190 
GLU CA  C    sing N N 191 
GLU CA  CB   sing N N 192 
GLU CA  HA   sing N N 193 
GLU C   O    doub N N 194 
GLU C   OXT  sing N N 195 
GLU CB  CG   sing N N 196 
GLU CB  HB2  sing N N 197 
GLU CB  HB3  sing N N 198 
GLU CG  CD   sing N N 199 
GLU CG  HG2  sing N N 200 
GLU CG  HG3  sing N N 201 
GLU CD  OE1  doub N N 202 
GLU CD  OE2  sing N N 203 
GLU OE2 HE2  sing N N 204 
GLU OXT HXT  sing N N 205 
GLY N   CA   sing N N 206 
GLY N   H    sing N N 207 
GLY N   H2   sing N N 208 
GLY CA  C    sing N N 209 
GLY CA  HA2  sing N N 210 
GLY CA  HA3  sing N N 211 
GLY C   O    doub N N 212 
GLY C   OXT  sing N N 213 
GLY OXT HXT  sing N N 214 
HIS N   CA   sing N N 215 
HIS N   H    sing N N 216 
HIS N   H2   sing N N 217 
HIS CA  C    sing N N 218 
HIS CA  CB   sing N N 219 
HIS CA  HA   sing N N 220 
HIS C   O    doub N N 221 
HIS C   OXT  sing N N 222 
HIS CB  CG   sing N N 223 
HIS CB  HB2  sing N N 224 
HIS CB  HB3  sing N N 225 
HIS CG  ND1  sing Y N 226 
HIS CG  CD2  doub Y N 227 
HIS ND1 CE1  doub Y N 228 
HIS ND1 HD1  sing N N 229 
HIS CD2 NE2  sing Y N 230 
HIS CD2 HD2  sing N N 231 
HIS CE1 NE2  sing Y N 232 
HIS CE1 HE1  sing N N 233 
HIS NE2 HE2  sing N N 234 
HIS OXT HXT  sing N N 235 
ILE N   CA   sing N N 236 
ILE N   H    sing N N 237 
ILE N   H2   sing N N 238 
ILE CA  C    sing N N 239 
ILE CA  CB   sing N N 240 
ILE CA  HA   sing N N 241 
ILE C   O    doub N N 242 
ILE C   OXT  sing N N 243 
ILE CB  CG1  sing N N 244 
ILE CB  CG2  sing N N 245 
ILE CB  HB   sing N N 246 
ILE CG1 CD1  sing N N 247 
ILE CG1 HG12 sing N N 248 
ILE CG1 HG13 sing N N 249 
ILE CG2 HG21 sing N N 250 
ILE CG2 HG22 sing N N 251 
ILE CG2 HG23 sing N N 252 
ILE CD1 HD11 sing N N 253 
ILE CD1 HD12 sing N N 254 
ILE CD1 HD13 sing N N 255 
ILE OXT HXT  sing N N 256 
LEU N   CA   sing N N 257 
LEU N   H    sing N N 258 
LEU N   H2   sing N N 259 
LEU CA  C    sing N N 260 
LEU CA  CB   sing N N 261 
LEU CA  HA   sing N N 262 
LEU C   O    doub N N 263 
LEU C   OXT  sing N N 264 
LEU CB  CG   sing N N 265 
LEU CB  HB2  sing N N 266 
LEU CB  HB3  sing N N 267 
LEU CG  CD1  sing N N 268 
LEU CG  CD2  sing N N 269 
LEU CG  HG   sing N N 270 
LEU CD1 HD11 sing N N 271 
LEU CD1 HD12 sing N N 272 
LEU CD1 HD13 sing N N 273 
LEU CD2 HD21 sing N N 274 
LEU CD2 HD22 sing N N 275 
LEU CD2 HD23 sing N N 276 
LEU OXT HXT  sing N N 277 
LYS N   CA   sing N N 278 
LYS N   H    sing N N 279 
LYS N   H2   sing N N 280 
LYS CA  C    sing N N 281 
LYS CA  CB   sing N N 282 
LYS CA  HA   sing N N 283 
LYS C   O    doub N N 284 
LYS C   OXT  sing N N 285 
LYS CB  CG   sing N N 286 
LYS CB  HB2  sing N N 287 
LYS CB  HB3  sing N N 288 
LYS CG  CD   sing N N 289 
LYS CG  HG2  sing N N 290 
LYS CG  HG3  sing N N 291 
LYS CD  CE   sing N N 292 
LYS CD  HD2  sing N N 293 
LYS CD  HD3  sing N N 294 
LYS CE  NZ   sing N N 295 
LYS CE  HE2  sing N N 296 
LYS CE  HE3  sing N N 297 
LYS NZ  HZ1  sing N N 298 
LYS NZ  HZ2  sing N N 299 
LYS NZ  HZ3  sing N N 300 
LYS OXT HXT  sing N N 301 
MET N   CA   sing N N 302 
MET N   H    sing N N 303 
MET N   H2   sing N N 304 
MET CA  C    sing N N 305 
MET CA  CB   sing N N 306 
MET CA  HA   sing N N 307 
MET C   O    doub N N 308 
MET C   OXT  sing N N 309 
MET CB  CG   sing N N 310 
MET CB  HB2  sing N N 311 
MET CB  HB3  sing N N 312 
MET CG  SD   sing N N 313 
MET CG  HG2  sing N N 314 
MET CG  HG3  sing N N 315 
MET SD  CE   sing N N 316 
MET CE  HE1  sing N N 317 
MET CE  HE2  sing N N 318 
MET CE  HE3  sing N N 319 
MET OXT HXT  sing N N 320 
PHE N   CA   sing N N 321 
PHE N   H    sing N N 322 
PHE N   H2   sing N N 323 
PHE CA  C    sing N N 324 
PHE CA  CB   sing N N 325 
PHE CA  HA   sing N N 326 
PHE C   O    doub N N 327 
PHE C   OXT  sing N N 328 
PHE CB  CG   sing N N 329 
PHE CB  HB2  sing N N 330 
PHE CB  HB3  sing N N 331 
PHE CG  CD1  doub Y N 332 
PHE CG  CD2  sing Y N 333 
PHE CD1 CE1  sing Y N 334 
PHE CD1 HD1  sing N N 335 
PHE CD2 CE2  doub Y N 336 
PHE CD2 HD2  sing N N 337 
PHE CE1 CZ   doub Y N 338 
PHE CE1 HE1  sing N N 339 
PHE CE2 CZ   sing Y N 340 
PHE CE2 HE2  sing N N 341 
PHE CZ  HZ   sing N N 342 
PHE OXT HXT  sing N N 343 
PRO N   CA   sing N N 344 
PRO N   CD   sing N N 345 
PRO N   H    sing N N 346 
PRO CA  C    sing N N 347 
PRO CA  CB   sing N N 348 
PRO CA  HA   sing N N 349 
PRO C   O    doub N N 350 
PRO C   OXT  sing N N 351 
PRO CB  CG   sing N N 352 
PRO CB  HB2  sing N N 353 
PRO CB  HB3  sing N N 354 
PRO CG  CD   sing N N 355 
PRO CG  HG2  sing N N 356 
PRO CG  HG3  sing N N 357 
PRO CD  HD2  sing N N 358 
PRO CD  HD3  sing N N 359 
PRO OXT HXT  sing N N 360 
SER N   CA   sing N N 361 
SER N   H    sing N N 362 
SER N   H2   sing N N 363 
SER CA  C    sing N N 364 
SER CA  CB   sing N N 365 
SER CA  HA   sing N N 366 
SER C   O    doub N N 367 
SER C   OXT  sing N N 368 
SER CB  OG   sing N N 369 
SER CB  HB2  sing N N 370 
SER CB  HB3  sing N N 371 
SER OG  HG   sing N N 372 
SER OXT HXT  sing N N 373 
THR N   CA   sing N N 374 
THR N   H    sing N N 375 
THR N   H2   sing N N 376 
THR CA  C    sing N N 377 
THR CA  CB   sing N N 378 
THR CA  HA   sing N N 379 
THR C   O    doub N N 380 
THR C   OXT  sing N N 381 
THR CB  OG1  sing N N 382 
THR CB  CG2  sing N N 383 
THR CB  HB   sing N N 384 
THR OG1 HG1  sing N N 385 
THR CG2 HG21 sing N N 386 
THR CG2 HG22 sing N N 387 
THR CG2 HG23 sing N N 388 
THR OXT HXT  sing N N 389 
TRP N   CA   sing N N 390 
TRP N   H    sing N N 391 
TRP N   H2   sing N N 392 
TRP CA  C    sing N N 393 
TRP CA  CB   sing N N 394 
TRP CA  HA   sing N N 395 
TRP C   O    doub N N 396 
TRP C   OXT  sing N N 397 
TRP CB  CG   sing N N 398 
TRP CB  HB2  sing N N 399 
TRP CB  HB3  sing N N 400 
TRP CG  CD1  doub Y N 401 
TRP CG  CD2  sing Y N 402 
TRP CD1 NE1  sing Y N 403 
TRP CD1 HD1  sing N N 404 
TRP CD2 CE2  doub Y N 405 
TRP CD2 CE3  sing Y N 406 
TRP NE1 CE2  sing Y N 407 
TRP NE1 HE1  sing N N 408 
TRP CE2 CZ2  sing Y N 409 
TRP CE3 CZ3  doub Y N 410 
TRP CE3 HE3  sing N N 411 
TRP CZ2 CH2  doub Y N 412 
TRP CZ2 HZ2  sing N N 413 
TRP CZ3 CH2  sing Y N 414 
TRP CZ3 HZ3  sing N N 415 
TRP CH2 HH2  sing N N 416 
TRP OXT HXT  sing N N 417 
TYR N   CA   sing N N 418 
TYR N   H    sing N N 419 
TYR N   H2   sing N N 420 
TYR CA  C    sing N N 421 
TYR CA  CB   sing N N 422 
TYR CA  HA   sing N N 423 
TYR C   O    doub N N 424 
TYR C   OXT  sing N N 425 
TYR CB  CG   sing N N 426 
TYR CB  HB2  sing N N 427 
TYR CB  HB3  sing N N 428 
TYR CG  CD1  doub Y N 429 
TYR CG  CD2  sing Y N 430 
TYR CD1 CE1  sing Y N 431 
TYR CD1 HD1  sing N N 432 
TYR CD2 CE2  doub Y N 433 
TYR CD2 HD2  sing N N 434 
TYR CE1 CZ   doub Y N 435 
TYR CE1 HE1  sing N N 436 
TYR CE2 CZ   sing Y N 437 
TYR CE2 HE2  sing N N 438 
TYR CZ  OH   sing N N 439 
TYR OH  HH   sing N N 440 
TYR OXT HXT  sing N N 441 
VAL N   CA   sing N N 442 
VAL N   H    sing N N 443 
VAL N   H2   sing N N 444 
VAL CA  C    sing N N 445 
VAL CA  CB   sing N N 446 
VAL CA  HA   sing N N 447 
VAL C   O    doub N N 448 
VAL C   OXT  sing N N 449 
VAL CB  CG1  sing N N 450 
VAL CB  CG2  sing N N 451 
VAL CB  HB   sing N N 452 
VAL CG1 HG11 sing N N 453 
VAL CG1 HG12 sing N N 454 
VAL CG1 HG13 sing N N 455 
VAL CG2 HG21 sing N N 456 
VAL CG2 HG22 sing N N 457 
VAL CG2 HG23 sing N N 458 
VAL OXT HXT  sing N N 459 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID)' 'United States' 'P01 AI057788' 1 
'Robert A. Welch Foundation'                                                                      'United States' Q-1279         2 
# 
_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   6NIR 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 32 2 1' 
_space_group.name_Hall        
;P 32 2"
;
_space_group.IT_number        154 
_space_group.crystal_system   trigonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    9DAL 
_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]   0.010521 
_atom_sites.fract_transf_matrix[1][2]   0.006074 
_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]   0.012148 
_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]   0.021654 
_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.
;
? 
F ? ? 8.95735 ?       ? ? 7.27484  ?        ? ? 0.0 
;1-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    . PRO A 1 2   ? 0.76200   -24.83900 -14.59300 1.000 105.60214 ? 0   PRO A N    1 
ATOM   2    C CA   . PRO A 1 2   ? 1.83400   -24.14800 -13.86800 1.000 127.01786 ? 0   PRO A CA   1 
ATOM   3    C C    . PRO A 1 2   ? 1.77100   -24.43700 -12.37700 1.000 112.09239 ? 0   PRO A C    1 
ATOM   4    O O    . PRO A 1 2   ? 0.87400   -25.16600 -11.94600 1.000 119.45643 ? 0   PRO A O    1 
ATOM   5    C CB   . PRO A 1 2   ? 1.55400   -22.67100 -14.15000 1.000 112.49244 ? 0   PRO A CB   1 
ATOM   6    C CG   . PRO A 1 2   ? 0.81700   -22.66100 -15.42900 1.000 121.88830 ? 0   PRO A CG   1 
ATOM   7    C CD   . PRO A 1 2   ? -0.01600  -23.91200 -15.43300 1.000 125.45188 ? 0   PRO A CD   1 
ATOM   8    H HA   . PRO A 1 2   ? 2.70500   -24.39300 -14.21800 1.000 127.02000 ? 0   PRO A HA   1 
ATOM   9    H HB2  . PRO A 1 2   ? 1.01100   -22.29900 -13.43800 1.000 112.49000 ? 0   PRO A HB2  1 
ATOM   10   H HB3  . PRO A 1 2   ? 2.39200   -22.18900 -14.23200 1.000 112.49000 ? 0   PRO A HB3  1 
ATOM   11   H HG2  . PRO A 1 2   ? 0.25100   -21.87400 -15.47100 1.000 121.89000 ? 0   PRO A HG2  1 
ATOM   12   H HG3  . PRO A 1 2   ? 1.44700   -22.66800 -16.16700 1.000 121.89000 ? 0   PRO A HG3  1 
ATOM   13   H HD2  . PRO A 1 2   ? -0.88400  -23.74200 -15.03500 1.000 125.45000 ? 0   PRO A HD2  1 
ATOM   14   H HD3  . PRO A 1 2   ? -0.09900  -24.26100 -16.33400 1.000 125.45000 ? 0   PRO A HD3  1 
ATOM   15   N N    . ALA A 1 3   ? 2.68200   -23.87100 -11.59100 1.000 167.22268 ? 1   ALA A N    1 
ATOM   16   C CA   . ALA A 1 3   ? 2.67600   -24.11600 -10.15700 1.000 146.41756 ? 1   ALA A CA   1 
ATOM   17   C C    . ALA A 1 3   ? 3.53700   -23.06700 -9.47100  1.000 136.80851 ? 1   ALA A C    1 
ATOM   18   O O    . ALA A 1 3   ? 4.41900   -22.48000 -10.10700 1.000 123.67009 ? 1   ALA A O    1 
ATOM   19   C CB   . ALA A 1 3   ? 3.19800   -25.52100 -9.83800  1.000 121.17505 ? 1   ALA A CB   1 
ATOM   20   H H    . ALA A 1 3   ? 3.30800   -23.34700 -11.86200 1.000 201.73000 ? 1   ALA A H    1 
ATOM   21   H HA   . ALA A 1 3   ? 1.76600   -24.04300 -9.83200  1.000 176.76000 ? 1   ALA A HA   1 
ATOM   22   H HB1  . ALA A 1 3   ? 2.62800   -26.17500 -10.27200 1.000 146.47000 ? 1   ALA A HB1  1 
ATOM   23   H HB2  . ALA A 1 3   ? 4.10600   -25.60200 -10.16800 1.000 146.47000 ? 1   ALA A HB2  1 
ATOM   24   H HB3  . ALA A 1 3   ? 3.18200   -25.65300 -8.87700  1.000 146.47000 ? 1   ALA A HB3  1 
ATOM   25   N N    . PRO A 1 4   ? 3.32800   -22.83100 -8.17400  1.000 113.68468 ? 2   PRO A N    1 
ATOM   26   C CA   . PRO A 1 4   ? 4.14000   -21.83900 -7.45000  1.000 106.89440 ? 2   PRO A CA   1 
ATOM   27   C C    . PRO A 1 4   ? 5.55900   -22.34900 -7.24400  1.000 107.78661 ? 2   PRO A C    1 
ATOM   28   O O    . PRO A 1 4   ? 5.81600   -23.55600 -7.37600  1.000 108.58934 ? 2   PRO A O    1 
ATOM   29   C CB   . PRO A 1 4   ? 3.41300   -21.66900 -6.10400  1.000 108.91832 ? 2   PRO A CB   1 
ATOM   30   C CG   . PRO A 1 4   ? 2.14800   -22.48300 -6.19400  1.000 112.45559 ? 2   PRO A CG   1 
ATOM   31   C CD   . PRO A 1 4   ? 2.35100   -23.48800 -7.28500  1.000 114.61901 ? 2   PRO A CD   1 
ATOM   32   H HA   . PRO A 1 4   ? 4.15600   -20.99400 -7.92600  1.000 129.33000 ? 2   PRO A HA   1 
ATOM   33   H HB2  . PRO A 1 4   ? 3.97800   -21.99900 -5.38800  1.000 131.76000 ? 2   PRO A HB2  1 
ATOM   34   H HB3  . PRO A 1 4   ? 3.20400   -20.73200 -5.96600  1.000 131.76000 ? 2   PRO A HB3  1 
ATOM   35   H HG2  . PRO A 1 4   ? 1.99300   -22.93100 -5.34800  1.000 136.00000 ? 2   PRO A HG2  1 
ATOM   36   H HG3  . PRO A 1 4   ? 1.40400   -21.89800 -6.40800  1.000 136.00000 ? 2   PRO A HG3  1 
ATOM   37   H HD2  . PRO A 1 4   ? 2.72500   -24.30700 -6.92600  1.000 138.60000 ? 2   PRO A HD2  1 
ATOM   38   H HD3  . PRO A 1 4   ? 1.51300   -23.64900 -7.74500  1.000 138.60000 ? 2   PRO A HD3  1 
ATOM   39   N N    . PRO A 1 5   ? 6.51800   -21.47700 -6.86800  1.000 122.31203 ? 3   PRO A N    1 
ATOM   40   C CA   . PRO A 1 5   ? 7.90000   -21.89900 -6.72800  1.000 122.58838 ? 3   PRO A CA   1 
ATOM   41   C C    . PRO A 1 5   ? 8.11300   -22.71100 -5.47800  1.000 121.45930 ? 3   PRO A C    1 
ATOM   42   O O    . PRO A 1 5   ? 9.10400   -23.44900 -5.42400  1.000 110.48167 ? 3   PRO A O    1 
ATOM   43   C CB   . PRO A 1 5   ? 8.62900   -20.56200 -6.66900  1.000 103.60190 ? 3   PRO A CB   1 
ATOM   44   C CG   . PRO A 1 5   ? 7.66200   -19.66400 -5.95300  1.000 115.23750 ? 3   PRO A CG   1 
ATOM   45   C CD   . PRO A 1 5   ? 6.32300   -20.07200 -6.52600  1.000 107.09442 ? 3   PRO A CD   1 
ATOM   46   H HA   . PRO A 1 5   ? 8.19100   -22.40100 -7.50500  1.000 148.16000 ? 3   PRO A HA   1 
ATOM   47   H HB2  . PRO A 1 5   ? 9.45300   -20.65600 -6.16600  1.000 125.38000 ? 3   PRO A HB2  1 
ATOM   48   H HB3  . PRO A 1 5   ? 8.80300   -20.24000 -7.56700  1.000 125.38000 ? 3   PRO A HB3  1 
ATOM   49   H HG2  . PRO A 1 5   ? 7.69800   -19.83100 -4.99800  1.000 139.34000 ? 3   PRO A HG2  1 
ATOM   50   H HG3  . PRO A 1 5   ? 7.85900   -18.73600 -6.15400  1.000 139.34000 ? 3   PRO A HG3  1 
ATOM   51   H HD2  . PRO A 1 5   ? 5.62700   -19.98000 -5.85700  1.000 129.57000 ? 3   PRO A HD2  1 
ATOM   52   H HD3  . PRO A 1 5   ? 6.12400   -19.55400 -7.32200  1.000 129.57000 ? 3   PRO A HD3  1 
ATOM   53   N N    . SER A 1 6   ? 7.22800   -22.56600 -4.49500  1.000 102.77285 ? 4   SER A N    1 
ATOM   54   C CA   . SER A 1 6   ? 7.34400   -23.28600 -3.20600  1.000 101.36215 ? 4   SER A CA   1 
ATOM   55   C C    . SER A 1 6   ? 7.06700   -24.77200 -3.43400  1.000 98.86975  ? 4   SER A C    1 
ATOM   56   O O    . SER A 1 6   ? 7.81800   -25.59600 -2.89000  1.000 101.42005 ? 4   SER A O    1 
ATOM   57   C CB   . SER A 1 6   ? 6.40100   -22.71300 -2.19600  1.000 100.90947 ? 4   SER A CB   1 
ATOM   58   O OG   . SER A 1 6   ? 5.04900   -22.98200 -2.53800  1.000 100.36730 ? 4   SER A OG   1 
ATOM   59   H H    . SER A 1 6   ? 6.54000   -22.05200 -4.54000  1.000 124.39000 ? 4   SER A H    1 
ATOM   60   H HA   . SER A 1 6   ? 8.24800   -23.19300 -2.86600  1.000 122.69000 ? 4   SER A HA   1 
ATOM   61   H HB2  . SER A 1 6   ? 6.59000   -23.10800 -1.33000  1.000 122.15000 ? 4   SER A HB2  1 
ATOM   62   H HB3  . SER A 1 6   ? 6.53000   -21.75200 -2.15600  1.000 122.15000 ? 4   SER A HB3  1 
ATOM   63   H HG   . SER A 1 6   ? 4.86900   -22.64500 -3.28600  1.000 121.50000 ? 4   SER A HG   1 
ATOM   64   N N    . ILE A 1 7   ? 6.03600   -25.08900 -4.21500  1.000 105.27578 ? 5   ILE A N    1 
ATOM   65   C CA   . ILE A 1 7   ? 5.66100   -26.50600 -4.47600  1.000 104.55727 ? 5   ILE A CA   1 
ATOM   66   C C    . ILE A 1 7   ? 6.83700   -27.13700 -5.22100  1.000 95.41407  ? 5   ILE A C    1 
ATOM   67   O O    . ILE A 1 7   ? 7.19000   -28.28100 -4.90500  1.000 91.20567  ? 5   ILE A O    1 
ATOM   68   C CB   . ILE A 1 7   ? 4.33900   -26.62200 -5.25600  1.000 105.83637 ? 5   ILE A CB   1 
ATOM   69   C CG1  . ILE A 1 7   ? 3.22000   -25.84800 -4.55900  1.000 104.73098 ? 5   ILE A CG1  1 
ATOM   70   C CG2  . ILE A 1 7   ? 3.96100   -28.08800 -5.48300  1.000 95.46934  ? 5   ILE A CG2  1 
ATOM   71   C CD1  . ILE A 1 7   ? 1.83100   -26.09300 -5.11900  1.000 108.65776 ? 5   ILE A CD1  1 
ATOM   72   H H    . ILE A 1 7   ? 5.53200   -24.51500 -4.61000  1.000 127.39000 ? 5   ILE A H    1 
ATOM   73   H HA   . ILE A 1 7   ? 5.55300   -26.96600 -3.63000  1.000 126.53000 ? 5   ILE A HA   1 
ATOM   74   H HB   . ILE A 1 7   ? 4.47600   -26.21700 -6.12700  1.000 128.06000 ? 5   ILE A HB   1 
ATOM   75   H HG12 . ILE A 1 7   ? 3.20700   -26.10000 -3.62200  1.000 126.74000 ? 5   ILE A HG12 1 
ATOM   76   H HG13 . ILE A 1 7   ? 3.40400   -24.89900 -4.63900  1.000 126.74000 ? 5   ILE A HG13 1 
ATOM   77   H HG21 . ILE A 1 7   ? 3.21300   -28.13400 -6.09900  1.000 115.62000 ? 5   ILE A HG21 1 
ATOM   78   H HG22 . ILE A 1 7   ? 4.71900   -28.56100 -5.85900  1.000 115.62000 ? 5   ILE A HG22 1 
ATOM   79   H HG23 . ILE A 1 7   ? 3.71500   -28.48500 -4.63300  1.000 115.62000 ? 5   ILE A HG23 1 
ATOM   80   H HD11 . ILE A 1 7   ? 1.27500   -25.32200 -4.92700  1.000 131.45000 ? 5   ILE A HD11 1 
ATOM   81   H HD12 . ILE A 1 7   ? 1.89500   -26.22400 -6.07800  1.000 131.45000 ? 5   ILE A HD12 1 
ATOM   82   H HD13 . ILE A 1 7   ? 1.45800   -26.88600 -4.70300  1.000 131.45000 ? 5   ILE A HD13 1 
ATOM   83   N N    . TRP A 1 8   ? 7.42700   -26.40200 -6.15700  1.000 96.53263  ? 6   TRP A N    1 
ATOM   84   C CA   . TRP A 1 8   ? 8.51900   -26.96900 -6.97800  1.000 88.71590  ? 6   TRP A CA   1 
ATOM   85   C C    . TRP A 1 8   ? 9.70000   -27.28000 -6.07100  1.000 79.24634  ? 6   TRP A C    1 
ATOM   86   O O    . TRP A 1 8   ? 10.20600  -28.33100 -6.25100  1.000 74.40366  ? 6   TRP A O    1 
ATOM   87   C CB   . TRP A 1 8   ? 8.90600   -26.02800 -8.12400  1.000 80.84654  ? 6   TRP A CB   1 
ATOM   88   C CG   . TRP A 1 8   ? 8.11100   -26.23800 -9.38600  1.000 88.49219  ? 6   TRP A CG   1 
ATOM   89   C CD1  . TRP A 1 8   ? 7.22600   -25.36000 -9.93700  1.000 85.91030  ? 6   TRP A CD1  1 
ATOM   90   C CD2  . TRP A 1 8   ? 8.13200   -27.38600 -10.26500 1.000 77.97514  ? 6   TRP A CD2  1 
ATOM   91   N NE1  . TRP A 1 8   ? 6.69400   -25.87600 -11.08700 1.000 83.73636  ? 6   TRP A NE1  1 
ATOM   92   C CE2  . TRP A 1 8   ? 7.22900   -27.11500 -11.31500 1.000 79.54112  ? 6   TRP A CE2  1 
ATOM   93   C CE3  . TRP A 1 8   ? 8.81200   -28.60800 -10.26800 1.000 81.93088  ? 6   TRP A CE3  1 
ATOM   94   C CZ2  . TRP A 1 8   ? 6.99600   -28.01600 -12.35100 1.000 75.84857  ? 6   TRP A CZ2  1 
ATOM   95   C CZ3  . TRP A 1 8   ? 8.58400   -29.49600 -11.29700 1.000 83.48633  ? 6   TRP A CZ3  1 
ATOM   96   C CH2  . TRP A 1 8   ? 7.69200   -29.20100 -12.32600 1.000 81.43871  ? 6   TRP A CH2  1 
ATOM   97   H H    . TRP A 1 8   ? 7.22600   -25.58700 -6.34200  1.000 116.90000 ? 6   TRP A H    1 
ATOM   98   H HA   . TRP A 1 8   ? 8.21600   -27.80400 -7.36900  1.000 107.52000 ? 6   TRP A HA   1 
ATOM   99   H HB2  . TRP A 1 8   ? 8.76700   -25.11200 -7.83600  1.000 98.08000  ? 6   TRP A HB2  1 
ATOM   100  H HB3  . TRP A 1 8   ? 9.84200   -26.16600 -8.33800  1.000 98.08000  ? 6   TRP A HB3  1 
ATOM   101  H HD1  . TRP A 1 8   ? 7.01300   -24.52800 -9.58100  1.000 104.15000 ? 6   TRP A HD1  1 
ATOM   102  H HE1  . TRP A 1 8   ? 6.11600   -25.48300 -11.58800 1.000 101.54000 ? 6   TRP A HE1  1 
ATOM   103  H HE3  . TRP A 1 8   ? 9.41700   -28.81400 -9.59200  1.000 99.38000  ? 6   TRP A HE3  1 
ATOM   104  H HZ2  . TRP A 1 8   ? 6.39800   -27.82100 -13.03600 1.000 92.07000  ? 6   TRP A HZ2  1 
ATOM   105  H HZ3  . TRP A 1 8   ? 9.03600   -30.30900 -11.30500 1.000 101.24000 ? 6   TRP A HZ3  1 
ATOM   106  H HH2  . TRP A 1 8   ? 7.55300   -29.82500 -13.00100 1.000 98.79000  ? 6   TRP A HH2  1 
ATOM   107  N N    . SER A 1 9   ? 10.04000  -26.45800 -5.08500  1.000 82.72308  ? 7   SER A N    1 
ATOM   108  C CA   . SER A 1 9   ? 11.21500  -26.62500 -4.23600  1.000 78.54363  ? 7   SER A CA   1 
ATOM   109  C C    . SER A 1 9   ? 11.16800  -27.93700 -3.46500  1.000 79.20950  ? 7   SER A C    1 
ATOM   110  O O    . SER A 1 9   ? 12.21800  -28.48000 -3.10000  1.000 73.14561  ? 7   SER A O    1 
ATOM   111  C CB   . SER A 1 9   ? 11.33000  -25.45700 -3.25600  1.000 70.27948  ? 7   SER A CB   1 
ATOM   112  O OG   . SER A 1 9   ? 10.73800  -25.79000 -2.01200  1.000 82.15722  ? 7   SER A OG   1 
ATOM   113  H H    . SER A 1 9   ? 9.58000   -25.76100 -4.88000  1.000 100.33000 ? 7   SER A H    1 
ATOM   114  H HA   . SER A 1 9   ? 12.01000  -26.63100 -4.79200  1.000 95.31000  ? 7   SER A HA   1 
ATOM   115  H HB2  . SER A 1 9   ? 12.26800  -25.25400 -3.11500  1.000 85.39000  ? 7   SER A HB2  1 
ATOM   116  H HB3  . SER A 1 9   ? 10.87600  -24.68400 -3.62700  1.000 85.39000  ? 7   SER A HB3  1 
ATOM   117  H HG   . SER A 1 9   ? 10.80500  -25.14400 -1.48000  1.000 99.65000  ? 7   SER A HG   1 
ATOM   118  N N    . ARG A 1 10  ? 9.96500   -28.45300 -3.19700  1.000 73.76937  ? 8   ARG A N    1 
ATOM   119  C CA   . ARG A 1 10  ? 9.84100   -29.69600 -2.44500  1.000 78.61995  ? 8   ARG A CA   1 
ATOM   120  C C    . ARG A 1 10  ? 10.37100  -30.88400 -3.23500  1.000 77.63562  ? 8   ARG A C    1 
ATOM   121  O O    . ARG A 1 10  ? 10.86700  -31.84800 -2.64100  1.000 69.65309  ? 8   ARG A O    1 
ATOM   122  C CB   . ARG A 1 10  ? 8.38100   -29.94600 -2.06600  1.000 80.06749  ? 8   ARG A CB   1 
ATOM   123  C CG   . ARG A 1 10  ? 7.73500   -28.85400 -1.21700  1.000 80.39385  ? 8   ARG A CG   1 
ATOM   124  C CD   . ARG A 1 10  ? 6.24200   -28.80500 -1.47800  1.000 77.21189  ? 8   ARG A CD   1 
ATOM   125  N NE   . ARG A 1 10  ? 5.57300   -27.70200 -0.80000  1.000 78.39624  ? 8   ARG A NE   1 
ATOM   126  C CZ   . ARG A 1 10  ? 5.08200   -27.76500 0.43000   1.000 75.38799  ? 8   ARG A CZ   1 
ATOM   127  N NH1  . ARG A 1 10  ? 5.27100   -28.82800 1.19700   1.000 76.38811  ? 8   ARG A NH1  1 
ATOM   128  N NH2  . ARG A 1 10  ? 4.38300   -26.73800 0.90300   1.000 75.18007  ? 8   ARG A NH2  1 
ATOM   129  H H    . ARG A 1 10  ? 9.21600   -28.10500 -3.43700  1.000 89.58000  ? 8   ARG A H    1 
ATOM   130  H HA   . ARG A 1 10  ? 10.35700  -29.62400 -1.62700  1.000 95.40000  ? 8   ARG A HA   1 
ATOM   131  H HB2  . ARG A 1 10  ? 7.87000   -30.01800 -2.88500  1.000 97.14000  ? 8   ARG A HB2  1 
ATOM   132  H HB3  . ARG A 1 10  ? 8.32500   -30.77700 -1.57000  1.000 97.14000  ? 8   ARG A HB3  1 
ATOM   133  H HG2  . ARG A 1 10  ? 7.87500   -29.05100 -0.27800  1.000 97.53000  ? 8   ARG A HG2  1 
ATOM   134  H HG3  . ARG A 1 10  ? 8.11700   -27.99200 -1.44500  1.000 97.53000  ? 8   ARG A HG3  1 
ATOM   135  H HD2  . ARG A 1 10  ? 6.09400   -28.70400 -2.43000  1.000 93.71000  ? 8   ARG A HD2  1 
ATOM   136  H HD3  . ARG A 1 10  ? 5.84200   -29.63400 -1.17200  1.000 93.71000  ? 8   ARG A HD3  1 
ATOM   137  H HE   . ARG A 1 10  ? 5.49100   -26.96000 -1.22700  1.000 95.14000  ? 8   ARG A HE   1 
ATOM   138  H HH11 . ARG A 1 10  ? 5.71700   -29.50100 0.90300   1.000 92.72000  ? 8   ARG A HH11 1 
ATOM   139  H HH12 . ARG A 1 10  ? 4.94500   -28.84500 1.99300   1.000 92.72000  ? 8   ARG A HH12 1 
ATOM   140  H HH21 . ARG A 1 10  ? 4.25700   -26.04100 0.41500   1.000 91.28000  ? 8   ARG A HH21 1 
ATOM   141  H HH22 . ARG A 1 10  ? 4.06700   -26.76600 1.70200   1.000 91.28000  ? 8   ARG A HH22 1 
ATOM   142  N N    . ILE A 1 11  ? 10.26400  -30.84400 -4.56200  1.000 75.91700  ? 9   ILE A N    1 
ATOM   143  C CA   . ILE A 1 11  ? 10.73200  -31.95600 -5.37800  1.000 78.79629  ? 9   ILE A CA   1 
ATOM   144  C C    . ILE A 1 11  ? 12.24900  -32.02000 -5.30600  1.000 75.47221  ? 9   ILE A C    1 
ATOM   145  O O    . ILE A 1 11  ? 12.94000  -31.01900 -5.54200  1.000 71.31381  ? 9   ILE A O    1 
ATOM   146  C CB   . ILE A 1 11  ? 10.24200  -31.80800 -6.82600  1.000 77.63299  ? 9   ILE A CB   1 
ATOM   147  C CG1  . ILE A 1 11  ? 8.71400   -31.73600 -6.85400  1.000 72.59028  ? 9   ILE A CG1  1 
ATOM   148  C CG2  . ILE A 1 11  ? 10.72900  -32.97800 -7.68100  1.000 67.96078  ? 9   ILE A CG2  1 
ATOM   149  C CD1  . ILE A 1 11  ? 8.12400   -31.88300 -8.22700  1.000 77.84881  ? 9   ILE A CD1  1 
ATOM   150  H H    . ILE A 1 11  ? 9.92700   -30.19000 -5.00800  1.000 92.16000  ? 9   ILE A H    1 
ATOM   151  H HA   . ILE A 1 11  ? 10.37200  -32.78100 -5.02300  1.000 95.62000  ? 9   ILE A HA   1 
ATOM   152  H HB   . ILE A 1 11  ? 10.59900  -30.98500 -7.19300  1.000 94.22000  ? 9   ILE A HB   1 
ATOM   153  H HG12 . ILE A 1 11  ? 8.35800   -32.44800 -6.30000  1.000 88.17000  ? 9   ILE A HG12 1 
ATOM   154  H HG13 . ILE A 1 11  ? 8.43500   -30.87600 -6.50300  1.000 88.17000  ? 9   ILE A HG13 1 
ATOM   155  H HG21 . ILE A 1 11  ? 10.55100  -32.78700 -8.61500  1.000 82.61000  ? 9   ILE A HG21 1 
ATOM   156  H HG22 . ILE A 1 11  ? 11.68200  -33.10000 -7.55700  1.000 82.61000  ? 9   ILE A HG22 1 
ATOM   157  H HG23 . ILE A 1 11  ? 10.25700  -33.78100 -7.41200  1.000 82.61000  ? 9   ILE A HG23 1 
ATOM   158  H HD11 . ILE A 1 11  ? 7.17800   -31.68600 -8.17200  1.000 94.48000  ? 9   ILE A HD11 1 
ATOM   159  H HD12 . ILE A 1 11  ? 8.55900   -31.25700 -8.82700  1.000 94.48000  ? 9   ILE A HD12 1 
ATOM   160  H HD13 . ILE A 1 11  ? 8.25600   -32.79100 -8.54000  1.000 94.48000  ? 9   ILE A HD13 1 
ATOM   161  N N    . VAL A 1 12  ? 12.77900  -33.19600 -4.96800  1.000 69.01617  ? 10  VAL A N    1 
ATOM   162  C CA   . VAL A 1 12  ? 14.21600  -33.39400 -4.83900  1.000 71.56121  ? 10  VAL A CA   1 
ATOM   163  C C    . VAL A 1 12  ? 14.59800  -34.75200 -5.41200  1.000 66.85275  ? 10  VAL A C    1 
ATOM   164  O O    . VAL A 1 12  ? 13.83800  -35.72300 -5.32600  1.000 70.25053  ? 10  VAL A O    1 
ATOM   165  C CB   . VAL A 1 12  ? 14.67600  -33.27700 -3.36700  1.000 73.07192  ? 10  VAL A CB   1 
ATOM   166  C CG1  . VAL A 1 12  ? 14.28200  -31.92100 -2.78900  1.000 75.69592  ? 10  VAL A CG1  1 
ATOM   167  C CG2  . VAL A 1 12  ? 14.08900  -34.40400 -2.53300  1.000 75.01163  ? 10  VAL A CG2  1 
ATOM   168  H H    . VAL A 1 12  ? 12.31700  -33.90300 -4.80700  1.000 83.88000  ? 10  VAL A H    1 
ATOM   169  H HA   . VAL A 1 12  ? 14.67800  -32.71300 -5.35200  1.000 86.93000  ? 10  VAL A HA   1 
ATOM   170  H HB   . VAL A 1 12  ? 15.64300  -33.34900 -3.33100  1.000 88.75000  ? 10  VAL A HB   1 
ATOM   171  H HG11 . VAL A 1 12  ? 14.67800  -31.82900 -1.90900  1.000 91.89000  ? 10  VAL A HG11 1 
ATOM   172  H HG12 . VAL A 1 12  ? 14.61000  -31.22100 -3.37500  1.000 91.89000  ? 10  VAL A HG12 1 
ATOM   173  H HG13 . VAL A 1 12  ? 13.31600  -31.87300 -2.72500  1.000 91.89000  ? 10  VAL A HG13 1 
ATOM   174  H HG21 . VAL A 1 12  ? 13.36300  -34.82000 -3.02300  1.000 91.07000  ? 10  VAL A HG21 1 
ATOM   175  H HG22 . VAL A 1 12  ? 14.78300  -35.05700 -2.35100  1.000 91.07000  ? 10  VAL A HG22 1 
ATOM   176  H HG23 . VAL A 1 12  ? 13.75400  -34.03600 -1.70000  1.000 91.07000  ? 10  VAL A HG23 1 
ATOM   177  N N    . ASN A 1 13  ? 15.78700  -34.80900 -6.00700  1.000 70.06893  ? 11  ASN A N    1 
ATOM   178  C CA   . ASN A 1 13  ? 16.30200  -36.06000 -6.54500  1.000 70.02155  ? 11  ASN A CA   1 
ATOM   179  C C    . ASN A 1 13  ? 16.39700  -37.11800 -5.44900  1.000 70.89534  ? 11  ASN A C    1 
ATOM   180  O O    . ASN A 1 13  ? 16.87500  -36.85000 -4.34200  1.000 63.35496  ? 11  ASN A O    1 
ATOM   181  C CB   . ASN A 1 13  ? 17.67000  -35.78500 -7.18000  1.000 63.08651  ? 11  ASN A CB   1 
ATOM   182  C CG   . ASN A 1 13  ? 18.73700  -35.39800 -6.16000  1.000 85.81818  ? 11  ASN A CG   1 
ATOM   183  O OD1  . ASN A 1 13  ? 18.64200  -34.34400 -5.53000  1.000 88.58957  ? 11  ASN A OD1  1 
ATOM   184  N ND2  . ASN A 1 13  ? 19.76800  -36.23000 -6.01400  1.000 95.30616  ? 11  ASN A ND2  1 
ATOM   185  H H    . ASN A 1 13  ? 16.31300  -34.13700 -6.11100  1.000 85.14000  ? 11  ASN A H    1 
ATOM   186  H HA   . ASN A 1 13  ? 15.70300  -36.38600 -7.23500  1.000 85.08000  ? 11  ASN A HA   1 
ATOM   187  H HB2  . ASN A 1 13  ? 17.97100  -36.58500 -7.63800  1.000 76.76000  ? 11  ASN A HB2  1 
ATOM   188  H HB3  . ASN A 1 13  ? 17.58200  -35.05500 -7.81200  1.000 76.76000  ? 11  ASN A HB3  1 
ATOM   189  H HD21 . ASN A 1 13  ? 19.80400  -36.95500 -6.47500  1.000 115.42000 ? 11  ASN A HD21 1 
ATOM   190  H HD22 . ASN A 1 13  ? 20.39200  -36.04700 -5.45100  1.000 115.42000 ? 11  ASN A HD22 1 
ATOM   191  N N    . PHE A 1 14  ? 15.89100  -38.31900 -5.74400  1.000 65.09201  ? 12  PHE A N    1 
ATOM   192  C CA   . PHE A 1 14  ? 15.89700  -39.45200 -4.78600  1.000 67.53704  ? 12  PHE A CA   1 
ATOM   193  C C    . PHE A 1 14  ? 16.18500  -40.71700 -5.56900  1.000 59.46239  ? 12  PHE A C    1 
ATOM   194  O O    . PHE A 1 14  ? 15.27800  -41.25500 -6.22600  1.000 59.98877  ? 12  PHE A O    1 
ATOM   195  C CB   . PHE A 1 14  ? 14.56400  -39.47400 -4.03500  1.000 71.96389  ? 12  PHE A CB   1 
ATOM   196  C CG   . PHE A 1 14  ? 14.54700  -40.34100 -2.78600  1.000 74.84055  ? 12  PHE A CG   1 
ATOM   197  C CD1  . PHE A 1 14  ? 15.21800  -39.94800 -1.63500  1.000 68.27924  ? 12  PHE A CD1  1 
ATOM   198  C CD2  . PHE A 1 14  ? 13.84900  -41.54000 -2.76400  1.000 70.17420  ? 12  PHE A CD2  1 
ATOM   199  C CE1  . PHE A 1 14  ? 15.19400  -40.73800 -0.49800  1.000 68.18712  ? 12  PHE A CE1  1 
ATOM   200  C CE2  . PHE A 1 14  ? 13.83100  -42.32400 -1.62500  1.000 68.31345  ? 12  PHE A CE2  1 
ATOM   201  C CZ   . PHE A 1 14  ? 14.50100  -41.92300 -0.49600  1.000 69.42411  ? 12  PHE A CZ   1 
ATOM   202  H H    . PHE A 1 14  ? 15.53200  -38.51300 -6.50100  1.000 79.17000  ? 12  PHE A H    1 
ATOM   203  H HA   . PHE A 1 14  ? 16.60900  -39.32400 -4.14000  1.000 82.10000  ? 12  PHE A HA   1 
ATOM   204  H HB2  . PHE A 1 14  ? 14.34700  -38.56800 -3.76500  1.000 87.41000  ? 12  PHE A HB2  1 
ATOM   205  H HB3  . PHE A 1 14  ? 13.87800  -39.80900 -4.63300  1.000 87.41000  ? 12  PHE A HB3  1 
ATOM   206  H HD1  . PHE A 1 14  ? 15.68900  -39.14600 -1.62800  1.000 85.27000  ? 12  PHE A HD1  1 
ATOM   207  H HD2  . PHE A 1 14  ? 13.39200  -41.82100 -3.52400  1.000 82.99000  ? 12  PHE A HD2  1 
ATOM   208  H HE1  . PHE A 1 14  ? 15.64900  -40.46600 0.26600   1.000 83.03000  ? 12  PHE A HE1  1 
ATOM   209  H HE2  . PHE A 1 14  ? 13.36100  -43.12700 -1.62300  1.000 82.88000  ? 12  PHE A HE2  1 
ATOM   210  H HZ   . PHE A 1 14  ? 14.48700  -42.45300 0.26800   1.000 84.37000  ? 12  PHE A HZ   1 
ATOM   211  N N    . GLY A 1 15  ? 17.43600  -41.16600 -5.53700  1.000 62.81806  ? 13  GLY A N    1 
ATOM   212  C CA   . GLY A 1 15  ? 17.84800  -42.40000 -6.22300  1.000 63.89187  ? 13  GLY A CA   1 
ATOM   213  C C    . GLY A 1 15  ? 17.59700  -42.34600 -7.70900  1.000 62.60751  ? 13  GLY A C    1 
ATOM   214  O O    . GLY A 1 15  ? 18.06400  -41.38700 -8.34500  1.000 68.53190  ? 13  GLY A O    1 
ATOM   215  H H    . GLY A 1 15  ? 18.07700  -40.77200 -5.12100  1.000 76.44000  ? 13  GLY A H    1 
ATOM   216  H HA2  . GLY A 1 15  ? 18.79500  -42.55000 -6.07700  1.000 77.73000  ? 13  GLY A HA2  1 
ATOM   217  H HA3  . GLY A 1 15  ? 17.35800  -43.15200 -5.85600  1.000 77.73000  ? 13  GLY A HA3  1 
ATOM   218  N N    . SER A 1 16  ? 16.87600  -43.32700 -8.24700  1.000 58.82021  ? 14  SER A N    1 
ATOM   219  C CA   . SER A 1 16  ? 16.61200  -43.43100 -9.70200  1.000 64.06294  ? 14  SER A CA   1 
ATOM   220  C C    . SER A 1 16  ? 15.67600  -42.31700 -10.15900 1.000 64.10769  ? 14  SER A C    1 
ATOM   221  O O    . SER A 1 16  ? 15.65000  -42.06200 -11.37300 1.000 58.22277  ? 14  SER A O    1 
ATOM   222  C CB   . SER A 1 16  ? 16.00600  -44.76300 -10.02700 1.000 57.26476  ? 14  SER A CB   1 
ATOM   223  O OG   . SER A 1 16  ? 16.44500  -45.76400 -9.12000  1.000 70.63478  ? 14  SER A OG   1 
ATOM   224  H H    . SER A 1 16  ? 16.51800  -43.96100 -7.79000  1.000 71.64000  ? 14  SER A H    1 
ATOM   225  H HA   . SER A 1 16  ? 17.44700  -43.34800 -10.18800 1.000 77.93000  ? 14  SER A HA   1 
ATOM   226  H HB2  . SER A 1 16  ? 15.04000  -44.69100 -9.97200  1.000 64.80000  ? 14  SER A HB2  1 
ATOM   227  H HB3  . SER A 1 16  ? 16.26800  -45.01700 -10.92600 1.000 64.80000  ? 14  SER A HB3  1 
ATOM   228  H HG   . SER A 1 16  ? 16.09600  -46.50300 -9.31600  1.000 85.82000  ? 14  SER A HG   1 
ATOM   229  N N    . GLY A 1 17  ? 14.94000  -41.69800 -9.23700  1.000 62.26799  ? 15  GLY A N    1 
ATOM   230  C CA   . GLY A 1 17  ? 13.92500  -40.69800 -9.59700  1.000 64.06031  ? 15  GLY A CA   1 
ATOM   231  C C    . GLY A 1 17  ? 13.91500  -39.51200 -8.67400  1.000 60.83361  ? 15  GLY A C    1 
ATOM   232  O O    . GLY A 1 17  ? 15.00600  -38.99100 -8.39700  1.000 59.18078  ? 15  GLY A O    1 
ATOM   233  H H    . GLY A 1 17  ? 15.00700  -41.83500 -8.39100  1.000 75.78000  ? 15  GLY A H    1 
ATOM   234  H HA2  . GLY A 1 17  ? 14.09000  -40.38100 -10.49800 1.000 77.93000  ? 15  GLY A HA2  1 
ATOM   235  H HA3  . GLY A 1 17  ? 13.04700  -41.11000 -9.57400  1.000 77.93000  ? 15  GLY A HA3  1 
ATOM   236  N N    . TRP A 1 18  ? 12.73100  -39.09400 -8.23300  1.000 64.68144  ? 16  TRP A N    1 
ATOM   237  C CA   . TRP A 1 18  ? 12.57100  -37.87200 -7.41600  1.000 67.38966  ? 16  TRP A CA   1 
ATOM   238  C C    . TRP A 1 18  ? 11.69200  -38.14800 -6.20800  1.000 71.16380  ? 16  TRP A C    1 
ATOM   239  O O    . TRP A 1 18  ? 11.20200  -39.25600 -6.14800  1.000 64.49194  ? 16  TRP A O    1 
ATOM   240  C CB   . TRP A 1 18  ? 11.94300  -36.78100 -8.28500  1.000 59.74137  ? 16  TRP A CB   1 
ATOM   241  C CG   . TRP A 1 18  ? 12.71300  -36.49900 -9.54300  1.000 66.22373  ? 16  TRP A CG   1 
ATOM   242  C CD1  . TRP A 1 18  ? 12.68300  -37.20600 -10.70600 1.000 63.36023  ? 16  TRP A CD1  1 
ATOM   243  C CD2  . TRP A 1 18  ? 13.64100  -35.41700 -9.74800  1.000 68.17660  ? 16  TRP A CD2  1 
ATOM   244  N NE1  . TRP A 1 18  ? 13.52600  -36.64000 -11.62400 1.000 62.66541  ? 16  TRP A NE1  1 
ATOM   245  C CE2  . TRP A 1 18  ? 14.12600  -35.54300 -11.06600 1.000 70.49003  ? 16  TRP A CE2  1 
ATOM   246  C CE3  . TRP A 1 18  ? 14.10200  -34.36600 -8.95200  1.000 61.86531  ? 16  TRP A CE3  1 
ATOM   247  C CZ2  . TRP A 1 18  ? 15.05100  -34.65300 -11.60100 1.000 63.90503  ? 16  TRP A CZ2  1 
ATOM   248  C CZ3  . TRP A 1 18  ? 15.01600  -33.48700 -9.48300  1.000 68.11869  ? 16  TRP A CZ3  1 
ATOM   249  C CH2  . TRP A 1 18  ? 15.48500  -33.63200 -10.78800 1.000 69.31884  ? 16  TRP A CH2  1 
ATOM   250  H H    . TRP A 1 18  ? 11.99000  -39.50100 -8.39100  1.000 78.68000  ? 16  TRP A H    1 
ATOM   251  H HA   . TRP A 1 18  ? 13.43800  -37.56600 -7.10800  1.000 81.92000  ? 16  TRP A HA   1 
ATOM   252  H HB2  . TRP A 1 18  ? 11.04900  -37.05900 -8.53900  1.000 72.75000  ? 16  TRP A HB2  1 
ATOM   253  H HB3  . TRP A 1 18  ? 11.89900  -35.95900 -7.77300  1.000 72.75000  ? 16  TRP A HB3  1 
ATOM   254  H HD1  . TRP A 1 18  ? 12.16400  -37.96300 -10.85600 1.000 77.09000  ? 16  TRP A HD1  1 
ATOM   255  H HE1  . TRP A 1 18  ? 13.65700  -36.92700 -12.42400 1.000 76.25000  ? 16  TRP A HE1  1 
ATOM   256  H HE3  . TRP A 1 18  ? 13.79700  -34.26300 -8.08000  1.000 75.29000  ? 16  TRP A HE3  1 
ATOM   257  H HZ2  . TRP A 1 18  ? 15.36500  -34.74600 -12.47200 1.000 77.75000  ? 16  TRP A HZ2  1 
ATOM   258  H HZ3  . TRP A 1 18  ? 15.33000  -32.78400 -8.96100  1.000 82.80000  ? 16  TRP A HZ3  1 
ATOM   259  H HH2  . TRP A 1 18  ? 16.10200  -33.02000 -11.11900 1.000 84.24000  ? 16  TRP A HH2  1 
ATOM   260  N N    . GLY A 1 19  ? 11.50500  -37.18300 -5.30200  1.000 72.95085  ? 17  GLY A N    1 
ATOM   261  C CA   . GLY A 1 19  ? 10.65300  -37.28400 -4.13200  1.000 67.62916  ? 17  GLY A CA   1 
ATOM   262  C C    . GLY A 1 19  ? 10.14400  -35.91300 -3.75300  1.000 70.91640  ? 17  GLY A C    1 
ATOM   263  O O    . GLY A 1 19  ? 10.69000  -34.88700 -4.17100  1.000 70.81112  ? 17  GLY A O    1 
ATOM   264  H H    . GLY A 1 19  ? 11.89100  -36.41600 -5.35800  1.000 88.60000  ? 17  GLY A H    1 
ATOM   265  H HA2  . GLY A 1 19  ? 9.89400   -37.85600 -4.32700  1.000 82.21000  ? 17  GLY A HA2  1 
ATOM   266  H HA3  . GLY A 1 19  ? 11.14800  -37.66400 -3.39300  1.000 82.21000  ? 17  GLY A HA3  1 
ATOM   267  N N    . PHE A 1 20  ? 9.09000   -35.90200 -2.93800  1.000 70.09788  ? 18  PHE A N    1 
ATOM   268  C CA   . PHE A 1 20  ? 8.30900   -34.69800 -2.67700  1.000 73.46934  ? 18  PHE A CA   1 
ATOM   269  C C    . PHE A 1 20  ? 8.12500   -34.51800 -1.18100  1.000 72.11391  ? 18  PHE A C    1 
ATOM   270  O O    . PHE A 1 20  ? 7.59200   -35.40700 -0.50900  1.000 67.42124  ? 18  PHE A O    1 
ATOM   271  C CB   . PHE A 1 20  ? 6.95000   -34.79500 -3.37500  1.000 68.92932  ? 18  PHE A CB   1 
ATOM   272  C CG   . PHE A 1 20  ? 6.10100   -33.56600 -3.24600  1.000 70.35317  ? 18  PHE A CG   1 
ATOM   273  C CD1  . PHE A 1 20  ? 6.48600   -32.38200 -3.84400  1.000 67.31597  ? 18  PHE A CD1  1 
ATOM   274  C CD2  . PHE A 1 20  ? 4.90000   -33.60500 -2.55600  1.000 65.97107  ? 18  PHE A CD2  1 
ATOM   275  C CE1  . PHE A 1 20  ? 5.69900   -31.25500 -3.74800  1.000 67.02909  ? 18  PHE A CE1  1 
ATOM   276  C CE2  . PHE A 1 20  ? 4.10900   -32.47600 -2.45300  1.000 66.45534  ? 18  PHE A CE2  1 
ATOM   277  C CZ   . PHE A 1 20  ? 4.51100   -31.30000 -3.05000  1.000 71.96389  ? 18  PHE A CZ   1 
ATOM   278  H H    . PHE A 1 20  ? 8.80300   -36.59500 -2.51700  1.000 85.17000  ? 18  PHE A H    1 
ATOM   279  H HA   . PHE A 1 20  ? 8.77800   -33.92300 -3.02400  1.000 89.22000  ? 18  PHE A HA   1 
ATOM   280  H HB2  . PHE A 1 20  ? 7.09700   -34.95400 -4.32100  1.000 83.77000  ? 18  PHE A HB2  1 
ATOM   281  H HB3  . PHE A 1 20  ? 6.45600   -35.53600 -2.99200  1.000 83.77000  ? 18  PHE A HB3  1 
ATOM   282  H HD1  . PHE A 1 20  ? 7.28600   -32.34500 -4.31700  1.000 81.84000  ? 18  PHE A HD1  1 
ATOM   283  H HD2  . PHE A 1 20  ? 4.62600   -34.39700 -2.15300  1.000 80.22000  ? 18  PHE A HD2  1 
ATOM   284  H HE1  . PHE A 1 20  ? 5.97300   -30.46200 -4.14900  1.000 81.49000  ? 18  PHE A HE1  1 
ATOM   285  H HE2  . PHE A 1 20  ? 3.30800   -32.51000 -1.98200  1.000 80.80000  ? 18  PHE A HE2  1 
ATOM   286  H HZ   . PHE A 1 20  ? 3.98200   -30.53800 -2.98200  1.000 87.42000  ? 18  PHE A HZ   1 
ATOM   287  N N    . TRP A 1 21  ? 8.54800   -33.36800 -0.66400  1.000 68.27924  ? 19  TRP A N    1 
ATOM   288  C CA   . TRP A 1 21  ? 8.35200   -33.03800 0.74500   1.000 74.61421  ? 19  TRP A CA   1 
ATOM   289  C C    . TRP A 1 21  ? 6.92500   -32.54000 0.93100   1.000 74.51946  ? 19  TRP A C    1 
ATOM   290  O O    . TRP A 1 21  ? 6.62400   -31.37200 0.67800   1.000 78.74892  ? 19  TRP A O    1 
ATOM   291  C CB   . TRP A 1 21  ? 9.35600   -31.98600 1.20000   1.000 69.28989  ? 19  TRP A CB   1 
ATOM   292  C CG   . TRP A 1 21  ? 10.74800  -32.50200 1.38200   1.000 75.92226  ? 19  TRP A CG   1 
ATOM   293  C CD1  . TRP A 1 21  ? 11.79900  -32.33400 0.53100   1.000 73.37459  ? 19  TRP A CD1  1 
ATOM   294  C CD2  . TRP A 1 21  ? 11.24400  -33.26400 2.48800   1.000 74.20363  ? 19  TRP A CD2  1 
ATOM   295  N NE1  . TRP A 1 21  ? 12.92000  -32.94500 1.03800   1.000 73.68778  ? 19  TRP A NE1  1 
ATOM   296  C CE2  . TRP A 1 21  ? 12.60500  -33.52400 2.23900   1.000 71.76387  ? 19  TRP A CE2  1 
ATOM   297  C CE3  . TRP A 1 21  ? 10.66800  -33.75400 3.66400   1.000 77.99619  ? 19  TRP A CE3  1 
ATOM   298  C CZ2  . TRP A 1 21  ? 13.40000  -34.25200 3.12200   1.000 68.77140  ? 19  TRP A CZ2  1 
ATOM   299  C CZ3  . TRP A 1 21  ? 11.45900  -34.47600 4.53900   1.000 79.74904  ? 19  TRP A CZ3  1 
ATOM   300  C CH2  . TRP A 1 21  ? 12.81000  -34.71800 4.26400   1.000 74.19574  ? 19  TRP A CH2  1 
ATOM   301  H H    . TRP A 1 21  ? 8.95600   -32.75800 -1.11200  1.000 82.99000  ? 19  TRP A H    1 
ATOM   302  H HA   . TRP A 1 21  ? 8.47400   -33.83400 1.28500   1.000 90.59000  ? 19  TRP A HA   1 
ATOM   303  H HB2  . TRP A 1 21  ? 9.38800   -31.27900 0.53600   1.000 84.21000  ? 19  TRP A HB2  1 
ATOM   304  H HB3  . TRP A 1 21  ? 9.06200   -31.62300 2.05000   1.000 84.21000  ? 19  TRP A HB3  1 
ATOM   305  H HD1  . TRP A 1 21  ? 11.76300  -31.87100 -0.27500  1.000 89.11000  ? 19  TRP A HD1  1 
ATOM   306  H HE1  . TRP A 1 21  ? 13.69300  -32.96200 0.66200   1.000 89.48000  ? 19  TRP A HE1  1 
ATOM   307  H HE3  . TRP A 1 21  ? 9.77100   -33.59700 3.85400   1.000 94.65000  ? 19  TRP A HE3  1 
ATOM   308  H HZ2  . TRP A 1 21  ? 14.29800  -34.41500 2.94100   1.000 83.58000  ? 19  TRP A HZ2  1 
ATOM   309  H HZ3  . TRP A 1 21  ? 11.08700  -34.80600 5.32500   1.000 96.76000  ? 19  TRP A HZ3  1 
ATOM   310  H HH2  . TRP A 1 21  ? 13.31700  -35.20700 4.87100   1.000 90.09000  ? 19  TRP A HH2  1 
ATOM   311  N N    . VAL A 1 22  ? 6.03200   -33.43000 1.37200   1.000 64.50773  ? 20  VAL A N    1 
ATOM   312  C CA   . VAL A 1 22  ? 4.67600   -33.00300 1.69700   1.000 68.58191  ? 20  VAL A CA   1 
ATOM   313  C C    . VAL A 1 22  ? 4.68700   -32.06900 2.89900   1.000 73.27721  ? 20  VAL A C    1 
ATOM   314  O O    . VAL A 1 22  ? 3.79600   -31.22300 3.04700   1.000 71.30329  ? 20  VAL A O    1 
ATOM   315  C CB   . VAL A 1 22  ? 3.77800   -34.22800 1.94500   1.000 73.22194  ? 20  VAL A CB   1 
ATOM   316  C CG1  . VAL A 1 22  ? 2.40300   -33.78900 2.41100   1.000 66.76327  ? 20  VAL A CG1  1 
ATOM   317  C CG2  . VAL A 1 22  ? 3.68500   -35.07100 0.68200   1.000 65.19466  ? 20  VAL A CG2  1 
ATOM   318  H H    . VAL A 1 22  ? 6.18500   -34.26800 1.48900   1.000 78.47000  ? 20  VAL A H    1 
ATOM   319  H HA   . VAL A 1 22  ? 4.31100   -32.51400 0.94300   1.000 83.36000  ? 20  VAL A HA   1 
ATOM   320  H HB   . VAL A 1 22  ? 4.17200   -34.77400 2.64300   1.000 88.92000  ? 20  VAL A HB   1 
ATOM   321  H HG11 . VAL A 1 22  ? 1.78800   -34.53400 2.31900   1.000 81.17000  ? 20  VAL A HG11 1 
ATOM   322  H HG12 . VAL A 1 22  ? 2.45300   -33.51600 3.34100   1.000 81.17000  ? 20  VAL A HG12 1 
ATOM   323  H HG13 . VAL A 1 22  ? 2.10600   -33.04700 1.86100   1.000 81.17000  ? 20  VAL A HG13 1 
ATOM   324  H HG21 . VAL A 1 22  ? 3.08700   -35.81700 0.84400   1.000 79.29000  ? 20  VAL A HG21 1 
ATOM   325  H HG22 . VAL A 1 22  ? 3.34100   -34.52100 -0.03900  1.000 79.29000  ? 20  VAL A HG22 1 
ATOM   326  H HG23 . VAL A 1 22  ? 4.56900   -35.39900 0.45500   1.000 79.29000  ? 20  VAL A HG23 1 
ATOM   327  N N    . SER A 1 23  ? 5.68300   -32.19900 3.76500   1.000 66.33427  ? 21  SER A N    1 
ATOM   328  C CA   . SER A 1 23  ? 5.78800   -31.37200 4.96300   1.000 71.26381  ? 21  SER A CA   1 
ATOM   329  C C    . SER A 1 23  ? 7.23400   -31.42100 5.43200   1.000 71.99811  ? 21  SER A C    1 
ATOM   330  O O    . SER A 1 23  ? 8.04400   -32.18600 4.89500   1.000 67.32123  ? 21  SER A O    1 
ATOM   331  C CB   . SER A 1 23  ? 4.83300   -31.86100 6.06300   1.000 74.54578  ? 21  SER A CB   1 
ATOM   332  O OG   . SER A 1 23  ? 5.39700   -32.94200 6.78600   1.000 63.29443  ? 21  SER A OG   1 
ATOM   333  H H    . SER A 1 23  ? 6.32200   -32.76800 3.68200   1.000 80.66000  ? 21  SER A H    1 
ATOM   334  H HA   . SER A 1 23  ? 5.56400   -30.45400 4.74400   1.000 86.57000  ? 21  SER A HA   1 
ATOM   335  H HB2  . SER A 1 23  ? 4.64100   -31.13300 6.67300   1.000 90.51000  ? 21  SER A HB2  1 
ATOM   336  H HB3  . SER A 1 23  ? 4.01000   -32.16300 5.64700   1.000 90.51000  ? 21  SER A HB3  1 
ATOM   337  H HG   . SER A 1 23  ? 5.94300   -32.65200 7.35400   1.000 75.19000  ? 21  SER A HG   1 
ATOM   338  N N    . PRO A 1 24  ? 7.59100   -30.61000 6.43500   1.000 73.78779  ? 22  PRO A N    1 
ATOM   339  C CA   . PRO A 1 24  ? 8.98300   -30.60400 6.91200   1.000 75.67486  ? 22  PRO A CA   1 
ATOM   340  C C    . PRO A 1 24  ? 9.52800   -31.98100 7.26200   1.000 72.62187  ? 22  PRO A C    1 
ATOM   341  O O    . PRO A 1 24  ? 10.74700  -32.18300 7.25300   1.000 76.03543  ? 22  PRO A O    1 
ATOM   342  C CB   . PRO A 1 24  ? 8.91500   -29.70100 8.15200   1.000 73.29563  ? 22  PRO A CB   1 
ATOM   343  C CG   . PRO A 1 24  ? 7.80300   -28.75700 7.85300   1.000 69.50570  ? 22  PRO A CG   1 
ATOM   344  C CD   . PRO A 1 24  ? 6.78400   -29.55800 7.08000   1.000 69.94786  ? 22  PRO A CD   1 
ATOM   345  H HA   . PRO A 1 24  ? 9.56000   -30.19400 6.25000   1.000 91.87000  ? 22  PRO A HA   1 
ATOM   346  H HB2  . PRO A 1 24  ? 8.71500   -30.23400 8.93700   1.000 89.01000  ? 22  PRO A HB2  1 
ATOM   347  H HB3  . PRO A 1 24  ? 9.75300   -29.22500 8.26000   1.000 89.01000  ? 22  PRO A HB3  1 
ATOM   348  H HG2  . PRO A 1 24  ? 7.42200   -28.43000 8.68300   1.000 81.72000  ? 22  PRO A HG2  1 
ATOM   349  H HG3  . PRO A 1 24  ? 8.13700   -28.02100 7.31700   1.000 81.72000  ? 22  PRO A HG3  1 
ATOM   350  H HD2  . PRO A 1 24  ? 6.14000   -29.95000 7.69000   1.000 85.00000  ? 22  PRO A HD2  1 
ATOM   351  H HD3  . PRO A 1 24  ? 6.35200   -29.00300 6.41200   1.000 85.00000  ? 22  PRO A HD3  1 
ATOM   352  N N    . SER A 1 25  ? 8.64700   -32.93700 7.56900   1.000 70.79007  ? 23  SER A N    1 
ATOM   353  C CA   . SER A 1 25  ? 9.07400   -34.26500 7.98100   1.000 78.39361  ? 23  SER A CA   1 
ATOM   354  C C    . SER A 1 25  ? 8.45100   -35.40100 7.17900   1.000 78.11200  ? 23  SER A C    1 
ATOM   355  O O    . SER A 1 25  ? 8.78500   -36.56300 7.43500   1.000 74.70106  ? 23  SER A O    1 
ATOM   356  C CB   . SER A 1 25  ? 8.75700   -34.48600 9.46800   1.000 79.90169  ? 23  SER A CB   1 
ATOM   357  O OG   . SER A 1 25  ? 7.38800   -34.23600 9.73200   1.000 83.99165  ? 23  SER A OG   1 
ATOM   358  H H    . SER A 1 25  ? 7.79400   -32.83600 7.54700   1.000 86.01000  ? 23  SER A H    1 
ATOM   359  H HA   . SER A 1 25  ? 10.03600  -34.33200 7.87600   1.000 95.13000  ? 23  SER A HA   1 
ATOM   360  H HB2  . SER A 1 25  ? 8.96100   -35.40500 9.70200   1.000 96.94000  ? 23  SER A HB2  1 
ATOM   361  H HB3  . SER A 1 25  ? 9.29700   -33.88100 10.00000  1.000 96.94000  ? 23  SER A HB3  1 
ATOM   362  H HG   . SER A 1 25  ? 7.22500   -34.36000 10.54700  1.000 101.85000 ? 23  SER A HG   1 
ATOM   363  N N    . LEU A 1 26  ? 7.56800   -35.11100 6.22600   1.000 69.97681  ? 24  LEU A N    1 
ATOM   364  C CA   . LEU A 1 26  ? 6.86900   -36.14000 5.46400   1.000 72.17444  ? 24  LEU A CA   1 
ATOM   365  C C    . LEU A 1 26  ? 7.37400   -36.12600 4.02700   1.000 69.42675  ? 24  LEU A C    1 
ATOM   366  O O    . LEU A 1 26  ? 7.16700   -35.14900 3.29900   1.000 58.28857  ? 24  LEU A O    1 
ATOM   367  C CB   . LEU A 1 26  ? 5.35600   -35.92400 5.51200   1.000 74.38260  ? 24  LEU A CB   1 
ATOM   368  C CG   . LEU A 1 26  ? 4.44800   -37.06400 5.03800   1.000 67.45809  ? 24  LEU A CG   1 
ATOM   369  C CD1  . LEU A 1 26  ? 4.93400   -38.42500 5.50700   1.000 79.84642  ? 24  LEU A CD1  1 
ATOM   370  C CD2  . LEU A 1 26  ? 3.02900   -36.82400 5.53600   1.000 76.71446  ? 24  LEU A CD2  1 
ATOM   371  H H    . LEU A 1 26  ? 7.35300   -34.31000 5.99900   1.000 85.03000  ? 24  LEU A H    1 
ATOM   372  H HA   . LEU A 1 26  ? 7.07200   -37.00600 5.84700   1.000 87.66000  ? 24  LEU A HA   1 
ATOM   373  H HB2  . LEU A 1 26  ? 5.11200   -35.73300 6.43100   1.000 90.32000  ? 24  LEU A HB2  1 
ATOM   374  H HB3  . LEU A 1 26  ? 5.14800   -35.15200 4.96300   1.000 90.32000  ? 24  LEU A HB3  1 
ATOM   375  H HG   . LEU A 1 26  ? 4.42900   -37.07000 4.06800   1.000 82.01000  ? 24  LEU A HG   1 
ATOM   376  H HD11 . LEU A 1 26  ? 4.24200   -39.08200 5.33400   1.000 96.87000  ? 24  LEU A HD11 1 
ATOM   377  H HD12 . LEU A 1 26  ? 5.74000   -38.65900 5.02100   1.000 96.87000  ? 24  LEU A HD12 1 
ATOM   378  H HD13 . LEU A 1 26  ? 5.12000   -38.38300 6.45800   1.000 96.87000  ? 24  LEU A HD13 1 
ATOM   379  H HD21 . LEU A 1 26  ? 2.45700   -37.53700 5.21300   1.000 93.11000  ? 24  LEU A HD21 1 
ATOM   380  H HD22 . LEU A 1 26  ? 3.03200   -36.81600 6.50600   1.000 93.11000  ? 24  LEU A HD22 1 
ATOM   381  H HD23 . LEU A 1 26  ? 2.71700   -35.97000 5.19800   1.000 93.11000  ? 24  LEU A HD23 1 
ATOM   382  N N    . PHE A 1 27  ? 8.01600   -37.21900 3.62500   1.000 71.92178  ? 25  PHE A N    1 
ATOM   383  C CA   . PHE A 1 27  ? 8.63800   -37.35300 2.31300   1.000 73.89307  ? 25  PHE A CA   1 
ATOM   384  C C    . PHE A 1 27  ? 8.01000   -38.54600 1.60900   1.000 68.69245  ? 25  PHE A C    1 
ATOM   385  O O    . PHE A 1 27  ? 7.99900   -39.65500 2.15400   1.000 63.09704  ? 25  PHE A O    1 
ATOM   386  C CB   . PHE A 1 27  ? 10.15100  -37.53300 2.45900   1.000 79.49901  ? 25  PHE A CB   1 
ATOM   387  C CG   . PHE A 1 27  ? 10.91800  -37.35000 1.18200   1.000 75.98016  ? 25  PHE A CG   1 
ATOM   388  C CD1  . PHE A 1 27  ? 11.09600  -36.08900 0.64100   1.000 72.27182  ? 25  PHE A CD1  1 
ATOM   389  C CD2  . PHE A 1 27  ? 11.48400  -38.43600 0.53600   1.000 71.33224  ? 25  PHE A CD2  1 
ATOM   390  C CE1  . PHE A 1 27  ? 11.80800  -35.91500 -0.52800  1.000 74.01940  ? 25  PHE A CE1  1 
ATOM   391  C CE2  . PHE A 1 27  ? 12.19800  -38.26800 -0.63400  1.000 74.05625  ? 25  PHE A CE2  1 
ATOM   392  C CZ   . PHE A 1 27  ? 12.36200  -37.00400 -1.16400  1.000 77.31190  ? 25  PHE A CZ   1 
ATOM   393  H H    . PHE A 1 27  ? 8.10700   -37.92100 4.11400   1.000 87.36000  ? 25  PHE A H    1 
ATOM   394  H HA   . PHE A 1 27  ? 8.46900   -36.55700 1.78600   1.000 89.73000  ? 25  PHE A HA   1 
ATOM   395  H HB2  . PHE A 1 27  ? 10.48100  -36.88000 3.09600   1.000 96.46000  ? 25  PHE A HB2  1 
ATOM   396  H HB3  . PHE A 1 27  ? 10.33100  -38.42700 2.78500   1.000 96.46000  ? 25  PHE A HB3  1 
ATOM   397  H HD1  . PHE A 1 27  ? 10.72400  -35.35100 1.06600   1.000 87.78000  ? 25  PHE A HD1  1 
ATOM   398  H HD2  . PHE A 1 27  ? 11.37600  -39.28900 0.89000   1.000 86.66000  ? 25  PHE A HD2  1 
ATOM   399  H HE1  . PHE A 1 27  ? 11.91700  -35.06300 -0.88400  1.000 89.88000  ? 25  PHE A HE1  1 
ATOM   400  H HE2  . PHE A 1 27  ? 12.57100  -39.00500 -1.06200  1.000 89.93000  ? 25  PHE A HE2  1 
ATOM   401  H HZ   . PHE A 1 27  ? 12.84100  -36.88800 -1.95300  1.000 93.83000  ? 25  PHE A HZ   1 
ATOM   402  N N    . ILE A 1 28  ? 7.48100   -38.31900 0.40900   1.000 68.48453  ? 26  ILE A N    1 
ATOM   403  C CA   . ILE A 1 28  ? 6.85700   -39.37600 -0.37700  1.000 68.75035  ? 26  ILE A CA   1 
ATOM   404  C C    . ILE A 1 28  ? 7.63800   -39.54800 -1.67100  1.000 69.16356  ? 26  ILE A C    1 
ATOM   405  O O    . ILE A 1 28  ? 8.18700   -38.58800 -2.22300  1.000 60.82308  ? 26  ILE A O    1 
ATOM   406  C CB   . ILE A 1 28  ? 5.36800   -39.08100 -0.66700  1.000 65.19992  ? 26  ILE A CB   1 
ATOM   407  C CG1  . ILE A 1 28  ? 5.22500   -38.01000 -1.75300  1.000 64.56037  ? 26  ILE A CG1  1 
ATOM   408  C CG2  . ILE A 1 28  ? 4.66000   -38.64500 0.61100   1.000 65.03675  ? 26  ILE A CG2  1 
ATOM   409  C CD1  . ILE A 1 28  ? 3.80100   -37.51500 -1.94600  1.000 68.71613  ? 26  ILE A CD1  1 
ATOM   410  H H    . ILE A 1 28  ? 7.47200   -37.55000 0.02400   1.000 83.24000  ? 26  ILE A H    1 
ATOM   411  H HA   . ILE A 1 28  ? 6.90600   -40.20900 0.11500   1.000 83.56000  ? 26  ILE A HA   1 
ATOM   412  H HB   . ILE A 1 28  ? 4.95100   -39.89700 -0.98500  1.000 79.30000  ? 26  ILE A HB   1 
ATOM   413  H HG12 . ILE A 1 28  ? 5.77600   -37.24800 -1.51600  1.000 78.53000  ? 26  ILE A HG12 1 
ATOM   414  H HG13 . ILE A 1 28  ? 5.51600   -38.37700 -2.60200  1.000 78.53000  ? 26  ILE A HG13 1 
ATOM   415  H HG21 . ILE A 1 28  ? 3.70100   -38.71300 0.48300   1.000 79.10000  ? 26  ILE A HG21 1 
ATOM   416  H HG22 . ILE A 1 28  ? 4.93800   -39.22500 1.33700   1.000 79.10000  ? 26  ILE A HG22 1 
ATOM   417  H HG23 . ILE A 1 28  ? 4.90500   -37.72800 0.81000   1.000 79.10000  ? 26  ILE A HG23 1 
ATOM   418  H HD11 . ILE A 1 28  ? 3.76500   -36.96500 -2.74400  1.000 83.52000  ? 26  ILE A HD11 1 
ATOM   419  H HD12 . ILE A 1 28  ? 3.21300   -38.28000 -2.04500  1.000 83.52000  ? 26  ILE A HD12 1 
ATOM   420  H HD13 . ILE A 1 28  ? 3.53600   -36.99300 -1.17400  1.000 83.52000  ? 26  ILE A HD13 1 
ATOM   421  N N    . THR A 1 29  ? 7.68600   -40.78500 -2.15500  1.000 73.93255  ? 27  THR A N    1 
ATOM   422  C CA   . THR A 1 29  ? 8.42900   -41.11200 -3.36400  1.000 75.79856  ? 27  THR A CA   1 
ATOM   423  C C    . THR A 1 29  ? 7.86700   -42.40900 -3.93800  1.000 66.83433  ? 27  THR A C    1 
ATOM   424  O O    . THR A 1 29  ? 6.82600   -42.90400 -3.49500  1.000 63.18652  ? 27  THR A O    1 
ATOM   425  C CB   . THR A 1 29  ? 9.93000   -41.22100 -3.06800  1.000 73.57461  ? 27  THR A CB   1 
ATOM   426  O OG1  . THR A 1 29  ? 10.63300  -41.56800 -4.26800  1.000 73.76148  ? 27  THR A OG1  1 
ATOM   427  C CG2  . THR A 1 29  ? 10.19400  -42.27700 -1.99800  1.000 67.31333  ? 27  THR A CG2  1 
ATOM   428  H H    . THR A 1 29  ? 7.29100   -41.46000 -1.79600  1.000 89.78000  ? 27  THR A H    1 
ATOM   429  H HA   . THR A 1 29  ? 8.29900   -40.40900 -4.01900  1.000 92.01000  ? 27  THR A HA   1 
ATOM   430  H HB   . THR A 1 29  ? 10.25500  -40.36800 -2.74100  1.000 89.35000  ? 27  THR A HB   1 
ATOM   431  H HG1  . THR A 1 29  ? 10.51000  -40.97900 -4.85400  1.000 89.57000  ? 27  THR A HG1  1 
ATOM   432  H HG21 . THR A 1 29  ? 11.13100  -42.27100 -1.75200  1.000 81.83000  ? 27  THR A HG21 1 
ATOM   433  H HG22 . THR A 1 29  ? 9.66200   -42.09200 -1.20800  1.000 81.83000  ? 27  THR A HG22 1 
ATOM   434  H HG23 . THR A 1 29  ? 9.96300   -43.15700 -2.33500  1.000 81.83000  ? 27  THR A HG23 1 
ATOM   435  N N    . SER A 1 30  ? 8.56000   -42.95700 -4.93200  1.000 73.39301  ? 28  SER A N    1 
ATOM   436  C CA   . SER A 1 30  ? 8.16800   -44.20100 -5.57900  1.000 67.67127  ? 28  SER A CA   1 
ATOM   437  C C    . SER A 1 30  ? 9.01200   -45.35400 -5.05100  1.000 65.32889  ? 28  SER A C    1 
ATOM   438  O O    . SER A 1 30  ? 10.19800  -45.18600 -4.75500  1.000 63.92609  ? 28  SER A O    1 
ATOM   439  C CB   . SER A 1 30  ? 8.32500   -44.09200 -7.09700  1.000 67.35808  ? 28  SER A CB   1 
ATOM   440  O OG   . SER A 1 30  ? 8.21300   -45.36100 -7.71600  1.000 75.32482  ? 28  SER A OG   1 
ATOM   441  H H    . SER A 1 30  ? 9.28000   -42.61600 -5.25600  1.000 89.13000  ? 28  SER A H    1 
ATOM   442  H HA   . SER A 1 30  ? 7.23800   -44.38500 -5.38200  1.000 82.27000  ? 28  SER A HA   1 
ATOM   443  H HB2  . SER A 1 30  ? 7.63100   -43.51000 -7.44400  1.000 81.88000  ? 28  SER A HB2  1 
ATOM   444  H HB3  . SER A 1 30  ? 9.19800   -43.72000 -7.29700  1.000 81.88000  ? 28  SER A HB3  1 
ATOM   445  H HG   . SER A 1 30  ? 8.95500   -45.75200 -7.69900  1.000 91.45000  ? 28  SER A HG   1 
ATOM   446  N N    . THR A 1 31  ? 8.39000   -46.52900 -4.93500  1.000 70.41897  ? 29  THR A N    1 
ATOM   447  C CA   . THR A 1 31  ? 9.11600   -47.69900 -4.45500  1.000 65.07359  ? 29  THR A CA   1 
ATOM   448  C C    . THR A 1 31  ? 10.19700  -48.12500 -5.43800  1.000 65.83421  ? 29  THR A C    1 
ATOM   449  O O    . THR A 1 31  ? 11.21400  -48.69900 -5.03300  1.000 65.96580  ? 29  THR A O    1 
ATOM   450  C CB   . THR A 1 31  ? 8.14500   -48.85400 -4.20600  1.000 72.77188  ? 29  THR A CB   1 
ATOM   451  O OG1  . THR A 1 31  ? 7.18700   -48.46800 -3.21100  1.000 74.14310  ? 29  THR A OG1  1 
ATOM   452  C CG2  . THR A 1 31  ? 8.89100   -50.09900 -3.73900  1.000 71.67438  ? 29  THR A CG2  1 
ATOM   453  H H    . THR A 1 31  ? 7.56300   -46.67100 -5.12500  1.000 85.56000  ? 29  THR A H    1 
ATOM   454  H HA   . THR A 1 31  ? 9.54500   -47.48100 -3.61300  1.000 79.15000  ? 29  THR A HA   1 
ATOM   455  H HB   . THR A 1 31  ? 7.68200   -49.06800 -5.03100  1.000 88.38000  ? 29  THR A HB   1 
ATOM   456  H HG1  . THR A 1 31  ? 6.65000   -49.09800 -3.06900  1.000 90.03000  ? 29  THR A HG1  1 
ATOM   457  H HG21 . THR A 1 31  ? 9.28600   -50.55200 -4.50000  1.000 87.07000  ? 29  THR A HG21 1 
ATOM   458  H HG22 . THR A 1 31  ? 9.59500   -49.85400 -3.11900  1.000 87.07000  ? 29  THR A HG22 1 
ATOM   459  H HG23 . THR A 1 31  ? 8.27700   -50.70600 -3.29800  1.000 87.07000  ? 29  THR A HG23 1 
ATOM   460  N N    . HIS A 1 32  ? 10.00100  -47.84600 -6.72800  1.000 63.00229  ? 30  HIS A N    1 
ATOM   461  C CA   . HIS A 1 32  ? 10.98800  -48.23700 -7.72600  1.000 65.46311  ? 30  HIS A CA   1 
ATOM   462  C C    . HIS A 1 32  ? 12.28200  -47.44400 -7.59100  1.000 63.31022  ? 30  HIS A C    1 
ATOM   463  O O    . HIS A 1 32  ? 13.35400  -47.95900 -7.92700  1.000 58.14381  ? 30  HIS A O    1 
ATOM   464  C CB   . HIS A 1 32  ? 10.41000  -48.05600 -9.13200  1.000 61.68634  ? 30  HIS A CB   1 
ATOM   465  C CG   . HIS A 1 32  ? 10.03800  -49.34100 -9.80400  1.000 63.51288  ? 30  HIS A CG   1 
ATOM   466  N ND1  . HIS A 1 32  ? 10.90600  -50.03000 -10.62200 1.000 71.70070  ? 30  HIS A ND1  1 
ATOM   467  C CD2  . HIS A 1 32  ? 8.89200   -50.06200 -9.78000  1.000 72.02969  ? 30  HIS A CD2  1 
ATOM   468  C CE1  . HIS A 1 32  ? 10.31200  -51.12100 -11.07300 1.000 72.69293  ? 30  HIS A CE1  1 
ATOM   469  N NE2  . HIS A 1 32  ? 9.08900   -51.16400 -10.57700 1.000 72.83242  ? 30  HIS A NE2  1 
ATOM   470  H H    . HIS A 1 32  ? 9.31100   -47.44200 -7.04300  1.000 76.66000  ? 30  HIS A H    1 
ATOM   471  H HA   . HIS A 1 32  ? 11.20000  -49.17600 -7.60800  1.000 79.61000  ? 30  HIS A HA   1 
ATOM   472  H HB2  . HIS A 1 32  ? 9.61100   -47.50900 -9.07700  1.000 75.08000  ? 30  HIS A HB2  1 
ATOM   473  H HB3  . HIS A 1 32  ? 11.07200  -47.61400 -9.68600  1.000 75.08000  ? 30  HIS A HB3  1 
ATOM   474  H HD1  . HIS A 1 32  ? 11.71000  -49.78800 -10.80900 1.000 87.10000  ? 30  HIS A HD1  1 
ATOM   475  H HD2  . HIS A 1 32  ? 8.11700   -49.85200 -9.31300  1.000 87.49000  ? 30  HIS A HD2  1 
ATOM   476  H HE1  . HIS A 1 32  ? 10.69100  -51.75100 -11.64300 1.000 88.29000  ? 30  HIS A HE1  1 
ATOM   477  N N    . VAL A 1 33  ? 12.21200  -46.20500 -7.10000  1.000 63.55236  ? 31  VAL A N    1 
ATOM   478  C CA   . VAL A 1 33  ? 13.35900  -45.30400 -7.15500  1.000 69.32410  ? 31  VAL A CA   1 
ATOM   479  C C    . VAL A 1 33  ? 14.13900  -45.22500 -5.84500  1.000 62.13903  ? 31  VAL A C    1 
ATOM   480  O O    . VAL A 1 33  ? 15.29000  -44.76200 -5.85500  1.000 64.34193  ? 31  VAL A O    1 
ATOM   481  C CB   . VAL A 1 33  ? 12.92000  -43.88300 -7.57500  1.000 68.36609  ? 31  VAL A CB   1 
ATOM   482  C CG1  . VAL A 1 33  ? 12.04000  -43.93300 -8.82200  1.000 67.64758  ? 31  VAL A CG1  1 
ATOM   483  C CG2  . VAL A 1 33  ? 12.20500  -43.18300 -6.42500  1.000 69.83469  ? 31  VAL A CG2  1 
ATOM   484  H H    . VAL A 1 33  ? 11.51300  -45.86500 -6.73200  1.000 77.32000  ? 31  VAL A H    1 
ATOM   485  H HA   . VAL A 1 33  ? 13.97000  -45.62800 -7.83500  1.000 84.25000  ? 31  VAL A HA   1 
ATOM   486  H HB   . VAL A 1 33  ? 13.71100  -43.36600 -7.78900  1.000 83.10000  ? 31  VAL A HB   1 
ATOM   487  H HG11 . VAL A 1 33  ? 11.27300  -44.50200 -8.65400  1.000 82.24000  ? 31  VAL A HG11 1 
ATOM   488  H HG12 . VAL A 1 33  ? 11.74200  -43.03400 -9.03000  1.000 82.24000  ? 31  VAL A HG12 1 
ATOM   489  H HG13 . VAL A 1 33  ? 12.56100  -44.28400 -9.56100  1.000 82.24000  ? 31  VAL A HG13 1 
ATOM   490  H HG21 . VAL A 1 33  ? 12.84900  -42.65200 -5.93100  1.000 84.86000  ? 31  VAL A HG21 1 
ATOM   491  H HG22 . VAL A 1 33  ? 11.51100  -42.61000 -6.78600  1.000 84.86000  ? 31  VAL A HG22 1 
ATOM   492  H HG23 . VAL A 1 33  ? 11.81200  -43.85000 -5.84300  1.000 84.86000  ? 31  VAL A HG23 1 
ATOM   493  N N    . ILE A 1 34  ? 13.55600  -45.64700 -4.72700  1.000 64.03399  ? 32  ILE A N    1 
ATOM   494  C CA   . ILE A 1 34  ? 14.26200  -45.50700 -3.44800  1.000 65.79999  ? 32  ILE A CA   1 
ATOM   495  C C    . ILE A 1 34  ? 15.54500  -46.32900 -3.48400  1.000 69.66888  ? 32  ILE A C    1 
ATOM   496  O O    . ILE A 1 34  ? 15.53300  -47.47000 -3.98900  1.000 69.28989  ? 32  ILE A O    1 
ATOM   497  C CB   . ILE A 1 34  ? 13.36100  -45.94300 -2.28100  1.000 67.60547  ? 32  ILE A CB   1 
ATOM   498  C CG1  . ILE A 1 34  ? 14.09800  -45.75700 -0.95200  1.000 73.97729  ? 32  ILE A CG1  1 
ATOM   499  C CG2  . ILE A 1 34  ? 12.93500  -47.39600 -2.44900  1.000 69.74784  ? 32  ILE A CG2  1 
ATOM   500  C CD1  . ILE A 1 34  ? 13.19700  -45.79100 0.26600   1.000 73.87202  ? 32  ILE A CD1  1 
ATOM   501  H H    . ILE A 1 34  ? 12.77600  -46.00400 -4.67800  1.000 77.90000  ? 32  ILE A H    1 
ATOM   502  H HA   . ILE A 1 34  ? 14.47800  -44.57300 -3.32100  1.000 80.02000  ? 32  ILE A HA   1 
ATOM   503  H HB   . ILE A 1 34  ? 12.56700  -45.38500 -2.27700  1.000 82.19000  ? 32  ILE A HB   1 
ATOM   504  H HG12 . ILE A 1 34  ? 14.74900  -46.47000 -0.85500  1.000 89.83000  ? 32  ILE A HG12 1 
ATOM   505  H HG13 . ILE A 1 34  ? 14.55100  -44.90000 -0.96200  1.000 89.83000  ? 32  ILE A HG13 1 
ATOM   506  H HG21 . ILE A 1 34  ? 12.32600  -47.63000 -1.73300  1.000 84.76000  ? 32  ILE A HG21 1 
ATOM   507  H HG22 . ILE A 1 34  ? 12.49100  -47.50300 -3.30400  1.000 84.76000  ? 32  ILE A HG22 1 
ATOM   508  H HG23 . ILE A 1 34  ? 13.71900  -47.96500 -2.41000  1.000 84.76000  ? 32  ILE A HG23 1 
ATOM   509  H HD11 . ILE A 1 34  ? 13.74700  -45.78300 1.06500   1.000 89.70000  ? 32  ILE A HD11 1 
ATOM   510  H HD12 . ILE A 1 34  ? 12.62100  -45.01100 0.25300   1.000 89.70000  ? 32  ILE A HD12 1 
ATOM   511  H HD13 . ILE A 1 34  ? 12.66000  -46.59800 0.24200   1.000 89.70000  ? 32  ILE A HD13 1 
ATOM   512  N N    . PRO A 1 35  ? 16.67200  -45.82200 -2.97500  1.000 67.07646  ? 33  PRO A N    1 
ATOM   513  C CA   . PRO A 1 35  ? 17.89600  -46.63800 -2.93700  1.000 72.26393  ? 33  PRO A CA   1 
ATOM   514  C C    . PRO A 1 35  ? 17.80700  -47.71600 -1.86500  1.000 69.94260  ? 33  PRO A C    1 
ATOM   515  O O    . PRO A 1 35  ? 17.52700  -47.43200 -0.69900  1.000 70.71111  ? 33  PRO A O    1 
ATOM   516  C CB   . PRO A 1 35  ? 19.00200  -45.62000 -2.61900  1.000 71.65333  ? 33  PRO A CB   1 
ATOM   517  C CG   . PRO A 1 35  ? 18.37400  -44.26100 -2.78600  1.000 68.73456  ? 33  PRO A CG   1 
ATOM   518  C CD   . PRO A 1 35  ? 16.91900  -44.44700 -2.50800  1.000 70.35844  ? 33  PRO A CD   1 
ATOM   519  H HA   . PRO A 1 35  ? 18.06400  -47.04600 -3.80100  1.000 87.77000  ? 33  PRO A HA   1 
ATOM   520  H HB2  . PRO A 1 35  ? 19.30600  -45.74500 -1.70600  1.000 87.04000  ? 33  PRO A HB2  1 
ATOM   521  H HB3  . PRO A 1 35  ? 19.73700  -45.73400 -3.24100  1.000 87.04000  ? 33  PRO A HB3  1 
ATOM   522  H HG2  . PRO A 1 35  ? 18.76600  -43.64200 -2.15100  1.000 83.54000  ? 33  PRO A HG2  1 
ATOM   523  H HG3  . PRO A 1 35  ? 18.51000  -43.95000 -3.69400  1.000 83.54000  ? 33  PRO A HG3  1 
ATOM   524  H HD2  . PRO A 1 35  ? 16.74200  -44.37200 -1.55700  1.000 85.49000  ? 33  PRO A HD2  1 
ATOM   525  H HD3  . PRO A 1 35  ? 16.40500  -43.80500 -3.02000  1.000 85.49000  ? 33  PRO A HD3  1 
ATOM   526  N N    . GLN A 1 36  ? 18.06700  -48.95700 -2.26800  1.000 68.58454  ? 34  GLN A N    1 
ATOM   527  C CA   . GLN A 1 36  ? 17.93700  -50.10900 -1.38600  1.000 74.74580  ? 34  GLN A CA   1 
ATOM   528  C C    . GLN A 1 36  ? 19.22400  -50.44900 -0.64700  1.000 72.49290  ? 34  GLN A C    1 
ATOM   529  O O    . GLN A 1 36  ? 19.26200  -51.46200 0.06000   1.000 67.08699  ? 34  GLN A O    1 
ATOM   530  C CB   . GLN A 1 36  ? 17.48200  -51.33400 -2.19000  1.000 73.40880  ? 34  GLN A CB   1 
ATOM   531  C CG   . GLN A 1 36  ? 16.08400  -51.21800 -2.76900  1.000 81.44924  ? 34  GLN A CG   1 
ATOM   532  C CD   . GLN A 1 36  ? 15.00500  -51.32300 -1.71000  1.000 80.25436  ? 34  GLN A CD   1 
ATOM   533  O OE1  . GLN A 1 36  ? 14.63500  -50.32900 -1.08500  1.000 80.35963  ? 34  GLN A OE1  1 
ATOM   534  N NE2  . GLN A 1 36  ? 14.49600  -52.53200 -1.50100  1.000 75.63275  ? 34  GLN A NE2  1 
ATOM   535  H H    . GLN A 1 36  ? 18.32500  -49.15900 -3.06300  1.000 83.36000  ? 34  GLN A H    1 
ATOM   536  H HA   . GLN A 1 36  ? 17.25600  -49.91900 -0.72200  1.000 90.75000  ? 34  GLN A HA   1 
ATOM   537  H HB2  . GLN A 1 36  ? 18.09700  -51.46700 -2.92800  1.000 89.15000  ? 34  GLN A HB2  1 
ATOM   538  H HB3  . GLN A 1 36  ? 17.49600  -52.11000 -1.60900  1.000 89.15000  ? 34  GLN A HB3  1 
ATOM   539  H HG2  . GLN A 1 36  ? 15.99300  -50.35700 -3.20700  1.000 98.80000  ? 34  GLN A HG2  1 
ATOM   540  H HG3  . GLN A 1 36  ? 15.94700  -51.93300 -3.41000  1.000 98.80000  ? 34  GLN A HG3  1 
ATOM   541  H HE21 . GLN A 1 36  ? 14.78100  -53.20300 -1.95700  1.000 91.82000  ? 34  GLN A HE21 1 
ATOM   542  H HE22 . GLN A 1 36  ? 13.88100  -52.64300 -0.91000  1.000 91.82000  ? 34  GLN A HE22 1 
ATOM   543  N N    . GLY A 1 37  ? 20.27100  -49.63700 -0.78600  1.000 71.75334  ? 35  GLY A N    1 
ATOM   544  C CA   . GLY A 1 37  ? 21.55700  -49.96700 -0.20300  1.000 70.11104  ? 35  GLY A CA   1 
ATOM   545  C C    . GLY A 1 37  ? 22.08500  -48.94400 0.78100   1.000 77.77511  ? 35  GLY A C    1 
ATOM   546  O O    . GLY A 1 37  ? 23.19900  -49.09300 1.29400   1.000 68.63718  ? 35  GLY A O    1 
ATOM   547  H H    . GLY A 1 37  ? 20.25800  -48.89100 -1.21300  1.000 87.16000  ? 35  GLY A H    1 
ATOM   548  H HA2  . GLY A 1 37  ? 21.49600  -50.81800 0.25700   1.000 85.19000  ? 35  GLY A HA2  1 
ATOM   549  H HA3  . GLY A 1 37  ? 22.20900  -50.05900 -0.91500  1.000 85.19000  ? 35  GLY A HA3  1 
ATOM   550  N N    . THR A 1 38  ? 21.30300  -47.90600 1.06000   1.000 82.57832  ? 36  THR A N    1 
ATOM   551  C CA   . THR A 1 38  ? 21.73200  -46.81500 1.92400   1.000 81.13341  ? 36  THR A CA   1 
ATOM   552  C C    . THR A 1 38  ? 21.12100  -46.96600 3.31100   1.000 79.91748  ? 36  THR A C    1 
ATOM   553  O O    . THR A 1 38  ? 19.93200  -47.27000 3.44600   1.000 81.94404  ? 36  THR A O    1 
ATOM   554  C CB   . THR A 1 38  ? 21.33000  -45.46200 1.33200   1.000 80.97287  ? 36  THR A CB   1 
ATOM   555  O OG1  . THR A 1 38  ? 21.49200  -45.49500 -0.09200  1.000 84.57067  ? 36  THR A OG1  1 
ATOM   556  C CG2  . THR A 1 38  ? 22.19200  -44.34500 1.90900   1.000 81.70980  ? 36  THR A CG2  1 
ATOM   557  H H    . THR A 1 38  ? 20.50500  -47.80900 0.75600   1.000 100.15000 ? 36  THR A H    1 
ATOM   558  H HA   . THR A 1 38  ? 22.69800  -46.83300 2.01200   1.000 98.42000  ? 36  THR A HA   1 
ATOM   559  H HB   . THR A 1 38  ? 20.40300  -45.27700 1.54800   1.000 98.23000  ? 36  THR A HB   1 
ATOM   560  H HG1  . THR A 1 38  ? 21.27300  -44.75500 -0.42300  1.000 102.54000 ? 36  THR A HG1  1 
ATOM   561  H HG21 . THR A 1 38  ? 21.80900  -43.48200 1.68700   1.000 99.11000  ? 36  THR A HG21 1 
ATOM   562  H HG22 . THR A 1 38  ? 22.24500  -44.42900 2.87300   1.000 99.11000  ? 36  THR A HG22 1 
ATOM   563  H HG23 . THR A 1 38  ? 23.08800  -44.39600 1.54100   1.000 99.11000  ? 36  THR A HG23 1 
ATOM   564  N N    . GLN A 1 39  ? 21.94000  -46.74700 4.34100   1.000 83.15471  ? 37  GLN A N    1 
ATOM   565  C CA   . GLN A 1 39  ? 21.47900  -46.74000 5.72300   1.000 81.71243  ? 37  GLN A CA   1 
ATOM   566  C C    . GLN A 1 39  ? 21.23600  -45.32500 6.23800   1.000 85.91293  ? 37  GLN A C    1 
ATOM   567  O O    . GLN A 1 39  ? 21.19000  -45.11100 7.45500   1.000 87.37627  ? 37  GLN A O    1 
ATOM   568  C CB   . GLN A 1 39  ? 22.48700  -47.45500 6.62300   1.000 81.74928  ? 37  GLN A CB   1 
ATOM   569  C CG   . GLN A 1 39  ? 22.83900  -48.86100 6.17300   1.000 83.83637  ? 37  GLN A CG   1 
ATOM   570  C CD   . GLN A 1 39  ? 23.60800  -49.63100 7.22900   1.000 93.45331  ? 37  GLN A CD   1 
ATOM   571  O OE1  . GLN A 1 39  ? 23.28800  -49.56600 8.41800   1.000 90.39505  ? 37  GLN A OE1  1 
ATOM   572  N NE2  . GLN A 1 39  ? 24.63200  -50.36100 6.80200   1.000 98.35127  ? 37  GLN A NE2  1 
ATOM   573  H H    . GLN A 1 39  ? 22.78300  -46.59700 4.25900   1.000 100.84000 ? 37  GLN A H    1 
ATOM   574  H HA   . GLN A 1 39  ? 20.66000  -47.24800 5.77800   1.000 99.11000  ? 37  GLN A HA   1 
ATOM   575  H HB2  . GLN A 1 39  ? 23.30700  -46.93800 6.64300   1.000 99.16000  ? 37  GLN A HB2  1 
ATOM   576  H HB3  . GLN A 1 39  ? 22.11700  -47.51600 7.51700   1.000 99.16000  ? 37  GLN A HB3  1 
ATOM   577  H HG2  . GLN A 1 39  ? 22.02100  -49.34700 5.98200   1.000 101.66000 ? 37  GLN A HG2  1 
ATOM   578  H HG3  . GLN A 1 39  ? 23.39000  -48.81000 5.37600   1.000 101.66000 ? 37  GLN A HG3  1 
ATOM   579  H HE21 . GLN A 1 39  ? 24.82600  -50.38100 5.96400   1.000 119.08000 ? 37  GLN A HE21 1 
ATOM   580  H HE22 . GLN A 1 39  ? 25.10000  -50.81500 7.36300   1.000 119.08000 ? 37  GLN A HE22 1 
ATOM   581  N N    . GLU A 1 40  ? 21.05300  -44.36300 5.33500   1.000 74.44577  ? 38  GLU A N    1 
ATOM   582  C CA   . GLU A 1 40  ? 20.87100  -42.96700 5.70200   1.000 83.98112  ? 38  GLU A CA   1 
ATOM   583  C C    . GLU A 1 40  ? 20.09400  -42.26200 4.60100   1.000 76.61971  ? 38  GLU A C    1 
ATOM   584  O O    . GLU A 1 40  ? 20.25900  -42.56600 3.41600   1.000 72.27182  ? 38  GLU A O    1 
ATOM   585  C CB   . GLU A 1 40  ? 22.20900  -42.24800 5.91800   1.000 79.31740  ? 38  GLU A CB   1 
ATOM   586  C CG   . GLU A 1 40  ? 22.92700  -42.61400 7.20200   1.000 83.62055  ? 38  GLU A CG   1 
ATOM   587  C CD   . GLU A 1 40  ? 24.05700  -41.65400 7.52800   1.000 93.06642  ? 38  GLU A CD   1 
ATOM   588  O OE1  . GLU A 1 40  ? 24.21700  -40.65300 6.79700   1.000 93.19538  ? 38  GLU A OE1  1 
ATOM   589  O OE2  . GLU A 1 40  ? 24.78400  -41.90100 8.51300   1.000 96.27733  ? 38  GLU A OE2  1 
ATOM   590  H H    . GLU A 1 40  ? 21.02500  -44.50100 4.48800   1.000 90.40000  ? 38  GLU A H    1 
ATOM   591  H HA   . GLU A 1 40  ? 20.35700  -42.91300 6.52300   1.000 101.83000 ? 38  GLU A HA   1 
ATOM   592  H HB2  . GLU A 1 40  ? 22.80000  -42.46400 5.17900   1.000 96.24000  ? 38  GLU A HB2  1 
ATOM   593  H HB3  . GLU A 1 40  ? 22.04400  -41.29200 5.93500   1.000 96.24000  ? 38  GLU A HB3  1 
ATOM   594  H HG2  . GLU A 1 40  ? 22.29400  -42.59400 7.93600   1.000 101.40000 ? 38  GLU A HG2  1 
ATOM   595  H HG3  . GLU A 1 40  ? 23.30400  -43.50300 7.11200   1.000 101.40000 ? 38  GLU A HG3  1 
ATOM   596  N N    . PHE A 1 41  ? 19.25200  -41.31600 5.00500   1.000 79.16475  ? 39  PHE A N    1 
ATOM   597  C CA   . PHE A 1 41  ? 18.52400  -40.46100 4.07600   1.000 79.71745  ? 39  PHE A CA   1 
ATOM   598  C C    . PHE A 1 41  ? 18.55500  -39.04500 4.62900   1.000 75.83541  ? 39  PHE A C    1 
ATOM   599  O O    . PHE A 1 41  ? 18.03900  -38.79400 5.72300   1.000 72.40605  ? 39  PHE A O    1 
ATOM   600  C CB   . PHE A 1 41  ? 17.08100  -40.94000 3.88200   1.000 73.60619  ? 39  PHE A CB   1 
ATOM   601  C CG   . PHE A 1 41  ? 16.95700  -42.18600 3.04100   1.000 65.65787  ? 39  PHE A CG   1 
ATOM   602  C CD1  . PHE A 1 41  ? 17.69300  -42.33400 1.87500   1.000 63.75238  ? 39  PHE A CD1  1 
ATOM   603  C CD2  . PHE A 1 41  ? 16.10300  -43.20900 3.41800   1.000 67.89761  ? 39  PHE A CD2  1 
ATOM   604  C CE1  . PHE A 1 41  ? 17.57800  -43.47500 1.10400   1.000 74.80897  ? 39  PHE A CE1  1 
ATOM   605  C CE2  . PHE A 1 41  ? 15.98500  -44.35400 2.65000   1.000 65.64998  ? 39  PHE A CE2  1 
ATOM   606  C CZ   . PHE A 1 41  ? 16.72400  -44.48600 1.49200   1.000 63.87871  ? 39  PHE A CZ   1 
ATOM   607  H H    . PHE A 1 41  ? 19.08300  -41.14700 5.83100   1.000 96.06000  ? 39  PHE A H    1 
ATOM   608  H HA   . PHE A 1 41  ? 18.97500  -40.45500 3.21800   1.000 96.72000  ? 39  PHE A HA   1 
ATOM   609  H HB2  . PHE A 1 41  ? 16.69600  -41.13000 4.75200   1.000 89.38000  ? 39  PHE A HB2  1 
ATOM   610  H HB3  . PHE A 1 41  ? 16.57500  -40.23700 3.44600   1.000 89.38000  ? 39  PHE A HB3  1 
ATOM   611  H HD1  . PHE A 1 41  ? 18.27100  -41.65600 1.60700   1.000 77.56000  ? 39  PHE A HD1  1 
ATOM   612  H HD2  . PHE A 1 41  ? 15.60200  -43.12500 4.19700   1.000 82.53000  ? 39  PHE A HD2  1 
ATOM   613  H HE1  . PHE A 1 41  ? 18.07700  -43.56200 0.32400   1.000 90.83000  ? 39  PHE A HE1  1 
ATOM   614  H HE2  . PHE A 1 41  ? 15.40800  -45.03400 2.91400   1.000 79.84000  ? 39  PHE A HE2  1 
ATOM   615  H HZ   . PHE A 1 41  ? 16.64600  -45.25500 0.97400   1.000 77.71000  ? 39  PHE A HZ   1 
ATOM   616  N N    . PHE A 1 42  ? 19.17100  -38.12900 3.88300   1.000 73.88254  ? 40  PHE A N    1 
ATOM   617  C CA   . PHE A 1 42  ? 19.30600  -36.73800 4.31400   1.000 68.24239  ? 40  PHE A CA   1 
ATOM   618  C C    . PHE A 1 42  ? 19.98000  -36.65500 5.68200   1.000 72.61660  ? 40  PHE A C    1 
ATOM   619  O O    . PHE A 1 42  ? 19.61100  -35.84000 6.53000   1.000 67.10278  ? 40  PHE A O    1 
ATOM   620  C CB   . PHE A 1 42  ? 17.94600  -36.03800 4.33000   1.000 71.77966  ? 40  PHE A CB   1 
ATOM   621  C CG   . PHE A 1 42  ? 17.18000  -36.17600 3.04400   1.000 71.18485  ? 40  PHE A CG   1 
ATOM   622  C CD1  . PHE A 1 42  ? 17.72000  -35.72800 1.84900   1.000 72.51922  ? 40  PHE A CD1  1 
ATOM   623  C CD2  . PHE A 1 42  ? 15.91900  -36.74800 3.02900   1.000 68.19502  ? 40  PHE A CD2  1 
ATOM   624  C CE1  . PHE A 1 42  ? 17.02000  -35.85200 0.66400   1.000 70.22158  ? 40  PHE A CE1  1 
ATOM   625  C CE2  . PHE A 1 42  ? 15.21300  -36.87400 1.84600   1.000 74.20627  ? 40  PHE A CE2  1 
ATOM   626  C CZ   . PHE A 1 42  ? 15.76400  -36.42500 0.66300   1.000 73.67462  ? 40  PHE A CZ   1 
ATOM   627  H H    . PHE A 1 42  ? 19.52300  -38.29000 3.11500   1.000 89.72000  ? 40  PHE A H    1 
ATOM   628  H HA   . PHE A 1 42  ? 19.87100  -36.27000 3.67900   1.000 82.95000  ? 40  PHE A HA   1 
ATOM   629  H HB2  . PHE A 1 42  ? 17.40600  -36.42000 5.04000   1.000 87.19000  ? 40  PHE A HB2  1 
ATOM   630  H HB3  . PHE A 1 42  ? 18.08300  -35.09200 4.49400   1.000 87.19000  ? 40  PHE A HB3  1 
ATOM   631  H HD1  . PHE A 1 42  ? 18.56600  -35.34100 1.84400   1.000 88.08000  ? 40  PHE A HD1  1 
ATOM   632  H HD2  . PHE A 1 42  ? 15.54300  -37.05200 3.82300   1.000 82.89000  ? 40  PHE A HD2  1 
ATOM   633  H HE1  . PHE A 1 42  ? 17.39400  -35.54800 -0.13200  1.000 85.32000  ? 40  PHE A HE1  1 
ATOM   634  H HE2  . PHE A 1 42  ? 14.36700  -37.26100 1.84800   1.000 90.10000  ? 40  PHE A HE2  1 
ATOM   635  H HZ   . PHE A 1 42  ? 15.29100  -36.50900 -0.13300  1.000 89.47000  ? 40  PHE A HZ   1 
ATOM   636  N N    . GLY A 1 43  ? 20.98100  -37.50800 5.90000   1.000 79.38583  ? 41  GLY A N    1 
ATOM   637  C CA   . GLY A 1 43  ? 21.71000  -37.53300 7.14900   1.000 75.42746  ? 41  GLY A CA   1 
ATOM   638  C C    . GLY A 1 43  ? 21.01400  -38.24600 8.28500   1.000 80.71231  ? 41  GLY A C    1 
ATOM   639  O O    . GLY A 1 43  ? 21.64200  -38.47300 9.32800   1.000 81.86245  ? 41  GLY A O    1 
ATOM   640  H H    . GLY A 1 43  ? 21.25500  -38.08700 5.32600   1.000 96.32000  ? 41  GLY A H    1 
ATOM   641  H HA2  . GLY A 1 43  ? 22.56500  -37.96700 7.00400   1.000 91.57000  ? 41  GLY A HA2  1 
ATOM   642  H HA3  . GLY A 1 43  ? 21.88100  -36.62100 7.43000   1.000 91.57000  ? 41  GLY A HA3  1 
ATOM   643  N N    . VAL A 1 44  ? 19.74400  -38.60600 8.12600   1.000 75.58011  ? 42  VAL A N    1 
ATOM   644  C CA   . VAL A 1 44  ? 18.97100  -39.26400 9.17800   1.000 79.33320  ? 42  VAL A CA   1 
ATOM   645  C C    . VAL A 1 44  ? 19.10200  -40.77200 9.00000   1.000 79.90169  ? 42  VAL A C    1 
ATOM   646  O O    . VAL A 1 44  ? 18.88600  -41.28200 7.89200   1.000 76.92501  ? 42  VAL A O    1 
ATOM   647  C CB   . VAL A 1 44  ? 17.49900  -38.81900 9.13800   1.000 75.88278  ? 42  VAL A CB   1 
ATOM   648  C CG1  . VAL A 1 44  ? 16.69600  -39.48600 10.24700  1.000 80.42017  ? 42  VAL A CG1  1 
ATOM   649  C CG2  . VAL A 1 44  ? 17.40400  -37.30600 9.25100   1.000 74.22995  ? 42  VAL A CG2  1 
ATOM   650  H H    . VAL A 1 44  ? 19.29700  -38.47800 7.40300   1.000 91.75000  ? 42  VAL A H    1 
ATOM   651  H HA   . VAL A 1 44  ? 19.33300  -39.00200 10.03600  1.000 96.26000  ? 42  VAL A HA   1 
ATOM   652  H HB   . VAL A 1 44  ? 17.11200  -39.08100 8.28800   1.000 92.12000  ? 42  VAL A HB   1 
ATOM   653  H HG11 . VAL A 1 44  ? 15.81300  -39.08600 10.28000  1.000 97.56000  ? 42  VAL A HG11 1 
ATOM   654  H HG12 . VAL A 1 44  ? 16.62100  -40.43500 10.05900  1.000 97.56000  ? 42  VAL A HG12 1 
ATOM   655  H HG13 . VAL A 1 44  ? 17.15200  -39.35000 11.09200  1.000 97.56000  ? 42  VAL A HG13 1 
ATOM   656  H HG21 . VAL A 1 44  ? 16.47200  -37.05500 9.34600   1.000 90.14000  ? 42  VAL A HG21 1 
ATOM   657  H HG22 . VAL A 1 44  ? 17.90600  -37.01600 10.02900  1.000 90.14000  ? 42  VAL A HG22 1 
ATOM   658  H HG23 . VAL A 1 44  ? 17.77500  -36.90500 8.45000   1.000 90.14000  ? 42  VAL A HG23 1 
ATOM   659  N N    . PRO A 1 45  ? 19.45400  -41.52500 10.04300  1.000 77.69616  ? 43  PRO A N    1 
ATOM   660  C CA   . PRO A 1 45  ? 19.54600  -42.98200 9.89100   1.000 78.45151  ? 43  PRO A CA   1 
ATOM   661  C C    . PRO A 1 45  ? 18.20400  -43.58100 9.49300   1.000 82.92047  ? 43  PRO A C    1 
ATOM   662  O O    . PRO A 1 45  ? 17.15100  -43.16600 9.98100   1.000 77.73564  ? 43  PRO A O    1 
ATOM   663  C CB   . PRO A 1 45  ? 19.98700  -43.45900 11.28100  1.000 68.66613  ? 43  PRO A CB   1 
ATOM   664  C CG   . PRO A 1 45  ? 20.56100  -42.24800 11.95300  1.000 89.04752  ? 43  PRO A CG   1 
ATOM   665  C CD   . PRO A 1 45  ? 19.80400  -41.08400 11.40500  1.000 84.31800  ? 43  PRO A CD   1 
ATOM   666  H HA   . PRO A 1 45  ? 20.22000  -43.21800 9.23400   1.000 95.20000  ? 43  PRO A HA   1 
ATOM   667  H HB2  . PRO A 1 45  ? 19.21800  -43.79000 11.77100  1.000 77.11000  ? 43  PRO A HB2  1 
ATOM   668  H HB3  . PRO A 1 45  ? 20.66000  -44.15100 11.19000  1.000 77.11000  ? 43  PRO A HB3  1 
ATOM   669  H HG2  . PRO A 1 45  ? 20.43300  -42.31700 12.91200  1.000 107.92000 ? 43  PRO A HG2  1 
ATOM   670  H HG3  . PRO A 1 45  ? 21.50400  -42.17300 11.73800  1.000 107.92000 ? 43  PRO A HG3  1 
ATOM   671  H HD2  . PRO A 1 45  ? 19.00300  -40.92300 11.92700  1.000 102.24000 ? 43  PRO A HD2  1 
ATOM   672  H HD3  . PRO A 1 45  ? 20.37700  -40.30200 11.37800  1.000 102.24000 ? 43  PRO A HD3  1 
ATOM   673  N N    . THR A 1 46  ? 18.24900  -44.56900 8.59200   1.000 78.84366  ? 44  THR A N    1 
ATOM   674  C CA   . THR A 1 46  ? 17.02800  -45.27000 8.20700   1.000 91.54782  ? 44  THR A CA   1 
ATOM   675  C C    . THR A 1 46  ? 16.35700  -45.93900 9.39900   1.000 85.77081  ? 44  THR A C    1 
ATOM   676  O O    . THR A 1 46  ? 15.14800  -46.18900 9.35600   1.000 77.06450  ? 44  THR A O    1 
ATOM   677  C CB   . THR A 1 46  ? 17.32200  -46.32400 7.13700   1.000 88.33164  ? 44  THR A CB   1 
ATOM   678  O OG1  . THR A 1 46  ? 17.90100  -47.48300 7.75000   1.000 86.58143  ? 44  THR A OG1  1 
ATOM   679  C CG2  . THR A 1 46  ? 18.27200  -45.76300 6.09100   1.000 98.05649  ? 44  THR A CG2  1 
ATOM   680  H H    . THR A 1 46  ? 18.97200  -44.85800 8.23300   1.000 95.67000  ? 44  THR A H    1 
ATOM   681  H HA   . THR A 1 46  ? 16.40100  -44.63300 7.83200   1.000 110.92000 ? 44  THR A HA   1 
ATOM   682  H HB   . THR A 1 46  ? 16.49500  -46.57300 6.69600   1.000 107.05000 ? 44  THR A HB   1 
ATOM   683  H HG1  . THR A 1 46  ? 18.63300  -47.28200 8.11000   1.000 104.96000 ? 44  THR A HG1  1 
ATOM   684  H HG21 . THR A 1 46  ? 18.86700  -46.45900 5.80200   1.000 118.73000 ? 44  THR A HG21 1 
ATOM   685  H HG22 . THR A 1 46  ? 17.75200  -45.48400 5.32100   1.000 118.73000 ? 44  THR A HG22 1 
ATOM   686  H HG23 . THR A 1 46  ? 18.77100  -44.99900 6.39600   1.000 118.73000 ? 44  THR A HG23 1 
ATOM   687  N N    . LYS A 1 47  ? 17.11500  -46.22800 10.46000  1.000 86.07348  ? 45  LYS A N    1 
ATOM   688  C CA   . LYS A 1 47  ? 16.54900  -46.83400 11.65900  1.000 85.75502  ? 45  LYS A CA   1 
ATOM   689  C C    . LYS A 1 47  ? 15.63100  -45.87100 12.39700  1.000 85.48657  ? 45  LYS A C    1 
ATOM   690  O O    . LYS A 1 47  ? 14.75000  -46.32000 13.13700  1.000 82.33619  ? 45  LYS A O    1 
ATOM   691  C CB   . LYS A 1 47  ? 17.67100  -47.31200 12.58600  1.000 89.02910  ? 45  LYS A CB   1 
ATOM   692  C CG   . LYS A 1 47  ? 18.42800  -48.55300 12.09200  1.000 96.87214  ? 45  LYS A CG   1 
ATOM   693  C CD   . LYS A 1 47  ? 19.02000  -48.38800 10.69600  1.000 98.92502  ? 45  LYS A CD   1 
ATOM   694  C CE   . LYS A 1 47  ? 19.51400  -49.70900 10.15300  1.000 93.81125  ? 45  LYS A CE   1 
ATOM   695  N NZ   . LYS A 1 47  ? 18.39100  -50.64600 9.85600   1.000 88.36849  ? 45  LYS A NZ   1 
ATOM   696  H H    . LYS A 1 47  ? 17.96000  -46.07600 10.50900  1.000 104.35000 ? 45  LYS A H    1 
ATOM   697  H HA   . LYS A 1 47  ? 16.02400  -47.60800 11.40200  1.000 103.97000 ? 45  LYS A HA   1 
ATOM   698  H HB2  . LYS A 1 47  ? 18.31700  -46.59500 12.68500  1.000 107.89000 ? 45  LYS A HB2  1 
ATOM   699  H HB3  . LYS A 1 47  ? 17.28700  -47.52700 13.45000  1.000 107.89000 ? 45  LYS A HB3  1 
ATOM   700  H HG2  . LYS A 1 47  ? 19.15700  -48.74000 12.70400  1.000 117.30000 ? 45  LYS A HG2  1 
ATOM   701  H HG3  . LYS A 1 47  ? 17.81500  -49.30500 12.07000  1.000 117.30000 ? 45  LYS A HG3  1 
ATOM   702  H HD2  . LYS A 1 47  ? 18.34100  -48.09400 10.07800  1.000 119.77000 ? 45  LYS A HD2  1 
ATOM   703  H HD3  . LYS A 1 47  ? 19.76000  -47.76200 10.72200  1.000 119.77000 ? 45  LYS A HD3  1 
ATOM   704  H HE2  . LYS A 1 47  ? 20.00300  -49.55200 9.33000   1.000 113.63000 ? 45  LYS A HE2  1 
ATOM   705  H HE3  . LYS A 1 47  ? 20.09100  -50.12800 10.81000  1.000 113.63000 ? 45  LYS A HE3  1 
ATOM   706  H HZ1  . LYS A 1 47  ? 18.70900  -51.39900 9.50300   1.000 107.10000 ? 45  LYS A HZ1  1 
ATOM   707  H HZ2  . LYS A 1 47  ? 17.95100  -50.84100 10.60400  1.000 107.10000 ? 45  LYS A HZ2  1 
ATOM   708  H HZ3  . LYS A 1 47  ? 17.82800  -50.27100 9.27800   1.000 107.10000 ? 45  LYS A HZ3  1 
ATOM   709  N N    . GLN A 1 48  ? 15.80100  -44.56400 12.19500  1.000 81.30975  ? 46  GLN A N    1 
ATOM   710  C CA   . GLN A 1 48  ? 14.92900  -43.56000 12.78700  1.000 81.80455  ? 46  GLN A CA   1 
ATOM   711  C C    . GLN A 1 48  ? 13.75700  -43.18600 11.89200  1.000 79.00947  ? 46  GLN A C    1 
ATOM   712  O O    . GLN A 1 48  ? 12.80900  -42.55200 12.37000  1.000 78.30413  ? 46  GLN A O    1 
ATOM   713  C CB   . GLN A 1 48  ? 15.72600  -42.29400 13.10500  1.000 85.72607  ? 46  GLN A CB   1 
ATOM   714  C CG   . GLN A 1 48  ? 16.86600  -42.51800 14.07500  1.000 97.68013  ? 46  GLN A CG   1 
ATOM   715  C CD   . GLN A 1 48  ? 17.11600  -41.31300 14.95800  1.000 100.50416 ? 46  GLN A CD   1 
ATOM   716  O OE1  . GLN A 1 48  ? 18.13900  -40.63900 14.84000  1.000 103.12026 ? 46  GLN A OE1  1 
ATOM   717  N NE2  . GLN A 1 48  ? 16.17600  -41.03700 15.85600  1.000 101.50428 ? 46  GLN A NE2  1 
ATOM   718  H H    . GLN A 1 48  ? 16.42800  -44.23100 11.70900  1.000 98.63000  ? 46  GLN A H    1 
ATOM   719  H HA   . GLN A 1 48  ? 14.57100  -43.90500 13.62000  1.000 99.22000  ? 46  GLN A HA   1 
ATOM   720  H HB2  . GLN A 1 48  ? 16.09800  -41.94000 12.28200  1.000 103.93000 ? 46  GLN A HB2  1 
ATOM   721  H HB3  . GLN A 1 48  ? 15.13000  -41.64600 13.50500  1.000 103.93000 ? 46  GLN A HB3  1 
ATOM   722  H HG2  . GLN A 1 48  ? 16.65200  -43.27200 14.64700  1.000 118.27000 ? 46  GLN A HG2  1 
ATOM   723  H HG3  . GLN A 1 48  ? 17.67700  -42.69900 13.57500  1.000 118.27000 ? 46  GLN A HG3  1 
ATOM   724  H HE21 . GLN A 1 48  ? 15.47400  -41.53100 15.91000  1.000 122.86000 ? 46  GLN A HE21 1 
ATOM   725  H HE22 . GLN A 1 48  ? 16.26900  -40.36300 16.38300  1.000 122.86000 ? 46  GLN A HE22 1 
ATOM   726  N N    . ILE A 1 49  ? 13.80100  -43.55300 10.62000  1.000 73.72726  ? 47  ILE A N    1 
ATOM   727  C CA   . ILE A 1 49  ? 12.77700  -43.17500 9.65600   1.000 73.44565  ? 47  ILE A CA   1 
ATOM   728  C C    . ILE A 1 49  ? 11.71100  -44.25900 9.61300   1.000 77.80933  ? 47  ILE A C    1 
ATOM   729  O O    . ILE A 1 49  ? 12.01500  -45.45900 9.60500   1.000 74.25890  ? 47  ILE A O    1 
ATOM   730  C CB   . ILE A 1 49  ? 13.39600  -42.94200 8.26600   1.000 70.66637  ? 47  ILE A CB   1 
ATOM   731  C CG1  . ILE A 1 49  ? 14.37900  -41.77100 8.31400   1.000 73.72989  ? 47  ILE A CG1  1 
ATOM   732  C CG2  . ILE A 1 49  ? 12.31000  -42.65600 7.23700   1.000 63.03914  ? 47  ILE A CG2  1 
ATOM   733  C CD1  . ILE A 1 49  ? 15.43000  -41.80700 7.22500   1.000 70.41371  ? 47  ILE A CD1  1 
ATOM   734  H H    . ILE A 1 49  ? 14.42900  -44.03300 10.28100  1.000 89.53000  ? 47  ILE A H    1 
ATOM   735  H HA   . ILE A 1 49  ? 12.35700  -42.34900 9.94200   1.000 89.19000  ? 47  ILE A HA   1 
ATOM   736  H HB   . ILE A 1 49  ? 13.87600  -43.74200 8.00000   1.000 85.86000  ? 47  ILE A HB   1 
ATOM   737  H HG12 . ILE A 1 49  ? 13.88000  -40.94600 8.21700   1.000 89.53000  ? 47  ILE A HG12 1 
ATOM   738  H HG13 . ILE A 1 49  ? 14.83900  -41.77700 9.16700   1.000 89.53000  ? 47  ILE A HG13 1 
ATOM   739  H HG21 . ILE A 1 49  ? 11.94600  -43.49600 6.92400   1.000 76.70000  ? 47  ILE A HG21 1 
ATOM   740  H HG22 . ILE A 1 49  ? 11.61200  -42.12600 7.65300   1.000 76.70000  ? 47  ILE A HG22 1 
ATOM   741  H HG23 . ILE A 1 49  ? 12.70100  -42.16700 6.49700   1.000 76.70000  ? 47  ILE A HG23 1 
ATOM   742  H HD11 . ILE A 1 49  ? 16.06500  -42.51200 7.42200   1.000 85.56000  ? 47  ILE A HD11 1 
ATOM   743  H HD12 . ILE A 1 49  ? 14.99800  -41.97800 6.37300   1.000 85.56000  ? 47  ILE A HD12 1 
ATOM   744  H HD13 . ILE A 1 49  ? 15.88600  -40.95200 7.20000   1.000 85.56000  ? 47  ILE A HD13 1 
ATOM   745  N N    . GLN A 1 50  ? 10.45500  -43.82900 9.58400   1.000 74.52736  ? 48  GLN A N    1 
ATOM   746  C CA   . GLN A 1 50  ? 9.29900   -44.72200 9.57500   1.000 78.84103  ? 48  GLN A CA   1 
ATOM   747  C C    . GLN A 1 50  ? 8.77000   -44.77700 8.14800   1.000 76.57234  ? 48  GLN A C    1 
ATOM   748  O O    . GLN A 1 50  ? 8.11900   -43.83900 7.67900   1.000 82.04142  ? 48  GLN A O    1 
ATOM   749  C CB   . GLN A 1 50  ? 8.28200   -44.22000 10.59600  1.000 77.02766  ? 48  GLN A CB   1 
ATOM   750  C CG   . GLN A 1 50  ? 6.87300   -44.76600 10.43000  1.000 94.73767  ? 48  GLN A CG   1 
ATOM   751  C CD   . GLN A 1 50  ? 5.89500   -44.17600 11.43500  1.000 103.01235 ? 48  GLN A CD   1 
ATOM   752  O OE1  . GLN A 1 50  ? 6.27400   -43.82600 12.55300  1.000 102.76758 ? 48  GLN A OE1  1 
ATOM   753  N NE2  . GLN A 1 50  ? 4.62900   -44.06700 11.04100  1.000 98.49339  ? 48  GLN A NE2  1 
ATOM   754  H H    . GLN A 1 50  ? 10.23900  -42.99700 9.56900   1.000 90.49000  ? 48  GLN A H    1 
ATOM   755  H HA   . GLN A 1 50  ? 9.57600   -45.61500 9.83400   1.000 95.67000  ? 48  GLN A HA   1 
ATOM   756  H HB2  . GLN A 1 50  ? 8.58800   -44.46800 11.48200  1.000 93.49000  ? 48  GLN A HB2  1 
ATOM   757  H HB3  . GLN A 1 50  ? 8.23000   -43.25400 10.52900  1.000 93.49000  ? 48  GLN A HB3  1 
ATOM   758  H HG2  . GLN A 1 50  ? 6.54700   -44.55100 9.54300   1.000 114.74000 ? 48  GLN A HG2  1 
ATOM   759  H HG3  . GLN A 1 50  ? 6.88900   -45.72800 10.55500  1.000 114.74000 ? 48  GLN A HG3  1 
ATOM   760  H HE21 . GLN A 1 50  ? 4.40100   -44.32300 10.25200  1.000 119.25000 ? 48  GLN A HE21 1 
ATOM   761  H HE22 . GLN A 1 50  ? 4.03900   -43.74000 11.57500  1.000 119.25000 ? 48  GLN A HE22 1 
ATOM   762  N N    . ILE A 1 51  ? 9.05200   -45.87800 7.45400   1.000 76.10123  ? 49  ILE A N    1 
ATOM   763  C CA   . ILE A 1 51  ? 8.66500   -46.05100 6.05700   1.000 73.76937  ? 49  ILE A CA   1 
ATOM   764  C C    . ILE A 1 51  ? 7.41800   -46.92200 6.00200   1.000 75.11164  ? 49  ILE A C    1 
ATOM   765  O O    . ILE A 1 51  ? 7.36200   -47.98600 6.63100   1.000 61.13365  ? 49  ILE A O    1 
ATOM   766  C CB   . ILE A 1 51  ? 9.80900   -46.66600 5.23200   1.000 69.55834  ? 49  ILE A CB   1 
ATOM   767  C CG1  . ILE A 1 51  ? 10.96600  -45.67200 5.11000   1.000 73.28510  ? 49  ILE A CG1  1 
ATOM   768  C CG2  . ILE A 1 51  ? 9.33200   -47.03300 3.83100   1.000 71.77703  ? 49  ILE A CG2  1 
ATOM   769  C CD1  . ILE A 1 51  ? 12.32300  -46.31200 4.93200   1.000 71.93494  ? 49  ILE A CD1  1 
ATOM   770  H H    . ILE A 1 51  ? 9.47600   -46.55200 7.77800   1.000 92.38000  ? 49  ILE A H    1 
ATOM   771  H HA   . ILE A 1 51  ? 8.45400   -45.18600 5.68100   1.000 89.58000  ? 49  ILE A HA   1 
ATOM   772  H HB   . ILE A 1 51  ? 10.12600  -47.46700 5.67800   1.000 84.53000  ? 49  ILE A HB   1 
ATOM   773  H HG12 . ILE A 1 51  ? 10.80700  -45.10600 4.34000   1.000 89.00000  ? 49  ILE A HG12 1 
ATOM   774  H HG13 . ILE A 1 51  ? 10.99600  -45.13300 5.91400   1.000 89.00000  ? 49  ILE A HG13 1 
ATOM   775  H HG21 . ILE A 1 51  ? 10.08000  -47.39900 3.33300   1.000 87.19000  ? 49  ILE A HG21 1 
ATOM   776  H HG22 . ILE A 1 51  ? 8.62100   -47.68700 3.87900   1.000 87.19000  ? 49  ILE A HG22 1 
ATOM   777  H HG23 . ILE A 1 51  ? 9.00800   -46.23100 3.39200   1.000 87.19000  ? 49  ILE A HG23 1 
ATOM   778  H HD11 . ILE A 1 51  ? 12.99400  -45.61500 4.86400   1.000 87.38000  ? 49  ILE A HD11 1 
ATOM   779  H HD12 . ILE A 1 51  ? 12.50900  -46.87600 5.69900   1.000 87.38000  ? 49  ILE A HD12 1 
ATOM   780  H HD13 . ILE A 1 51  ? 12.31600  -46.84600 4.12200   1.000 87.38000  ? 49  ILE A HD13 1 
ATOM   781  N N    . HIS A 1 52  ? 6.41500   -46.46400 5.25500   1.000 80.28594  ? 50  HIS A N    1 
ATOM   782  C CA   . HIS A 1 52  ? 5.20900   -47.23700 4.98500   1.000 80.21751  ? 50  HIS A CA   1 
ATOM   783  C C    . HIS A 1 52  ? 4.99000   -47.26000 3.48000   1.000 79.86484  ? 50  HIS A C    1 
ATOM   784  O O    . HIS A 1 52  ? 4.86500   -46.20100 2.85500   1.000 79.80431  ? 50  HIS A O    1 
ATOM   785  C CB   . HIS A 1 52  ? 3.98700   -46.64700 5.69400   1.000 81.54925  ? 50  HIS A CB   1 
ATOM   786  C CG   . HIS A 1 52  ? 2.72800   -47.42300 5.46200   1.000 87.38153  ? 50  HIS A CG   1 
ATOM   787  N ND1  . HIS A 1 52  ? 1.96900   -47.28800 4.31900   1.000 88.51061  ? 50  HIS A ND1  1 
ATOM   788  C CD2  . HIS A 1 52  ? 2.10000   -48.35200 6.22200   1.000 88.70011  ? 50  HIS A CD2  1 
ATOM   789  C CE1  . HIS A 1 52  ? 0.92600   -48.09600 4.38700   1.000 89.36861  ? 50  HIS A CE1  1 
ATOM   790  N NE2  . HIS A 1 52  ? 0.98200   -48.75300 5.53200   1.000 91.30568  ? 50  HIS A NE2  1 
ATOM   791  H H    . HIS A 1 52  ? 6.41200   -45.68800 4.88500   1.000 97.40000  ? 50  HIS A H    1 
ATOM   792  H HA   . HIS A 1 52  ? 5.33100   -48.14900 5.29100   1.000 97.32000  ? 50  HIS A HA   1 
ATOM   793  H HB2  . HIS A 1 52  ? 4.15600   -46.63300 6.64900   1.000 98.92000  ? 50  HIS A HB2  1 
ATOM   794  H HB3  . HIS A 1 52  ? 3.84300   -45.74400 5.37100   1.000 98.92000  ? 50  HIS A HB3  1 
ATOM   795  H HD2  . HIS A 1 52  ? 2.37300   -48.65900 7.05600   1.000 107.50000 ? 50  HIS A HD2  1 
ATOM   796  H HE1  . HIS A 1 52  ? 0.26500   -48.18700 3.73900   1.000 108.30000 ? 50  HIS A HE1  1 
ATOM   797  H HE2  . HIS A 1 52  ? 0.41100   -49.33700 5.80200   1.000 110.62000 ? 50  HIS A HE2  1 
ATOM   798  N N    . LYS A 1 53  ? 4.94500   -48.45600 2.90200   1.000 73.76937  ? 51  LYS A N    1 
ATOM   799  C CA   . LYS A 1 53  ? 4.80300   -48.62700 1.46300   1.000 76.77236  ? 51  LYS A CA   1 
ATOM   800  C C    . LYS A 1 53  ? 3.45000   -49.24700 1.15300   1.000 72.33762  ? 51  LYS A C    1 
ATOM   801  O O    . LYS A 1 53  ? 3.06100   -50.24600 1.76700   1.000 72.89295  ? 51  LYS A O    1 
ATOM   802  C CB   . LYS A 1 53  ? 5.93100   -49.49500 0.89700   1.000 73.01665  ? 51  LYS A CB   1 
ATOM   803  C CG   . LYS A 1 53  ? 7.25500   -48.76300 0.76800   1.000 83.48633  ? 51  LYS A CG   1 
ATOM   804  C CD   . LYS A 1 53  ? 8.38300   -49.70200 0.37500   1.000 73.45618  ? 51  LYS A CD   1 
ATOM   805  C CE   . LYS A 1 53  ? 9.71500   -48.97300 0.34800   1.000 78.75155  ? 51  LYS A CE   1 
ATOM   806  N NZ   . LYS A 1 53  ? 9.87600   -48.11900 -0.86000  1.000 77.73037  ? 51  LYS A NZ   1 
ATOM   807  H H    . LYS A 1 53  ? 4.99600   -49.19900 3.33300   1.000 89.58000  ? 51  LYS A H    1 
ATOM   808  H HA   . LYS A 1 53  ? 4.84400   -47.76000 1.03000   1.000 93.18000  ? 51  LYS A HA   1 
ATOM   809  H HB2  . LYS A 1 53  ? 6.06700   -50.25400 1.48500   1.000 88.68000  ? 51  LYS A HB2  1 
ATOM   810  H HB3  . LYS A 1 53  ? 5.67500   -49.80400 0.01400   1.000 88.68000  ? 51  LYS A HB3  1 
ATOM   811  H HG2  . LYS A 1 53  ? 7.17700   -48.08000 0.08400   1.000 101.24000 ? 51  LYS A HG2  1 
ATOM   812  H HG3  . LYS A 1 53  ? 7.48000   -48.35900 1.62000   1.000 101.24000 ? 51  LYS A HG3  1 
ATOM   813  H HD2  . LYS A 1 53  ? 8.44200   -50.42200 1.02200   1.000 89.21000  ? 51  LYS A HD2  1 
ATOM   814  H HD3  . LYS A 1 53  ? 8.21100   -50.05800 -0.51100  1.000 89.21000  ? 51  LYS A HD3  1 
ATOM   815  H HE2  . LYS A 1 53  ? 9.78000   -48.40300 1.13000   1.000 95.56000  ? 51  LYS A HE2  1 
ATOM   816  H HE3  . LYS A 1 53  ? 10.43200  -49.62600 0.35200   1.000 95.56000  ? 51  LYS A HE3  1 
ATOM   817  H HZ1  . LYS A 1 53  ? 10.54800  -47.54900 -0.73900  1.000 94.33000  ? 51  LYS A HZ1  1 
ATOM   818  H HZ2  . LYS A 1 53  ? 10.05100  -48.62500 -1.57000  1.000 94.33000  ? 51  LYS A HZ2  1 
ATOM   819  H HZ3  . LYS A 1 53  ? 9.13000   -47.65700 -1.00800  1.000 94.33000  ? 51  LYS A HZ3  1 
ATOM   820  N N    . SER A 1 54  ? 2.73400   -48.64000 0.20900   1.000 67.67654  ? 52  SER A N    1 
ATOM   821  C CA   . SER A 1 54  ? 1.45500   -49.14200 -0.29100  1.000 73.78516  ? 52  SER A CA   1 
ATOM   822  C C    . SER A 1 54  ? 1.59900   -49.23800 -1.80700  1.000 65.26046  ? 52  SER A C    1 
ATOM   823  O O    . SER A 1 54  ? 1.30000   -48.28600 -2.53300  1.000 63.54709  ? 52  SER A O    1 
ATOM   824  C CB   . SER A 1 54  ? 0.30300   -48.23300 0.12300   1.000 73.40354  ? 52  SER A CB   1 
ATOM   825  O OG   . SER A 1 54  ? -0.79700  -48.36500 -0.75900  1.000 83.22050  ? 52  SER A OG   1 
ATOM   826  H H    . SER A 1 54  ? 2.97900   -47.90800 -0.17100  1.000 82.27000  ? 52  SER A H    1 
ATOM   827  H HA   . SER A 1 54  ? 1.29100   -50.03100 0.06200   1.000 89.60000  ? 52  SER A HA   1 
ATOM   828  H HB2  . SER A 1 54  ? 0.01900   -48.47400 1.01900   1.000 89.14000  ? 52  SER A HB2  1 
ATOM   829  H HB3  . SER A 1 54  ? 0.60900   -47.31300 0.10900   1.000 89.14000  ? 52  SER A HB3  1 
ATOM   830  H HG   . SER A 1 54  ? -1.46700  -47.97000 -0.44300  1.000 100.92000 ? 52  SER A HG   1 
ATOM   831  N N    . GLY A 1 55  ? 2.07000   -50.38800 -2.28200  1.000 67.58442  ? 53  GLY A N    1 
ATOM   832  C CA   . GLY A 1 55  ? 2.34800   -50.55900 -3.69200  1.000 66.13688  ? 53  GLY A CA   1 
ATOM   833  C C    . GLY A 1 55  ? 3.60500   -49.81700 -4.09100  1.000 63.32075  ? 53  GLY A C    1 
ATOM   834  O O    . GLY A 1 55  ? 4.68200   -50.06800 -3.54200  1.000 61.15733  ? 53  GLY A O    1 
ATOM   835  H H    . GLY A 1 55  ? 2.23500   -51.08300 -1.80300  1.000 82.16000  ? 53  GLY A H    1 
ATOM   836  H HA2  . GLY A 1 55  ? 2.46500   -51.50100 -3.89100  1.000 80.42000  ? 53  GLY A HA2  1 
ATOM   837  H HA3  . GLY A 1 55  ? 1.60600   -50.21900 -4.21600  1.000 80.42000  ? 53  GLY A HA3  1 
ATOM   838  N N    . GLU A 1 56  ? 3.47900   -48.89700 -5.04100  1.000 63.05230  ? 54  GLU A N    1 
ATOM   839  C CA   . GLU A 1 56  ? 4.58600   -48.04700 -5.45200  1.000 63.24443  ? 54  GLU A CA   1 
ATOM   840  C C    . GLU A 1 56  ? 4.59600   -46.70800 -4.72900  1.000 69.19777  ? 54  GLU A C    1 
ATOM   841  O O    . GLU A 1 56  ? 5.50000   -45.90000 -4.96400  1.000 67.43440  ? 54  GLU A O    1 
ATOM   842  C CB   . GLU A 1 56  ? 4.53400   -47.82200 -6.96400  1.000 66.97908  ? 54  GLU A CB   1 
ATOM   843  C CG   . GLU A 1 56  ? 4.71700   -49.10000 -7.76200  1.000 70.20579  ? 54  GLU A CG   1 
ATOM   844  C CD   . GLU A 1 56  ? 6.11000   -49.67500 -7.62600  1.000 71.61911  ? 54  GLU A CD   1 
ATOM   845  O OE1  . GLU A 1 56  ? 7.07600   -48.88400 -7.59600  1.000 74.94320  ? 54  GLU A OE1  1 
ATOM   846  O OE2  . GLU A 1 56  ? 6.23700   -50.91500 -7.54100  1.000 75.68276  ? 54  GLU A OE2  1 
ATOM   847  H H    . GLU A 1 56  ? 2.74900   -48.74500 -5.46900  1.000 76.72000  ? 54  GLU A H    1 
ATOM   848  H HA   . GLU A 1 56  ? 5.42000   -48.49800 -5.24800  1.000 76.95000  ? 54  GLU A HA   1 
ATOM   849  H HB2  . GLU A 1 56  ? 3.67100   -47.44600 -7.19700  1.000 81.43000  ? 54  GLU A HB2  1 
ATOM   850  H HB3  . GLU A 1 56  ? 5.24100   -47.20800 -7.21600  1.000 81.43000  ? 54  GLU A HB3  1 
ATOM   851  H HG2  . GLU A 1 56  ? 4.09400   -49.76400 -7.43200  1.000 85.31000  ? 54  GLU A HG2  1 
ATOM   852  H HG3  . GLU A 1 56  ? 4.55400   -48.92400 -8.70000  1.000 85.31000  ? 54  GLU A HG3  1 
ATOM   853  N N    . PHE A 1 57  ? 3.61900   -46.45300 -3.86400  1.000 65.03148  ? 55  PHE A N    1 
ATOM   854  C CA   . PHE A 1 57  ? 3.59900   -45.24900 -3.04400  1.000 68.21344  ? 55  PHE A CA   1 
ATOM   855  C C    . PHE A 1 57  ? 4.42700   -45.50600 -1.79200  1.000 66.42902  ? 55  PHE A C    1 
ATOM   856  O O    . PHE A 1 57  ? 4.08800   -46.38000 -0.98700  1.000 59.41765  ? 55  PHE A O    1 
ATOM   857  C CB   . PHE A 1 57  ? 2.16600   -44.86700 -2.67800  1.000 69.95049  ? 55  PHE A CB   1 
ATOM   858  C CG   . PHE A 1 57  ? 2.05900   -43.57400 -1.92000  1.000 66.57640  ? 55  PHE A CG   1 
ATOM   859  C CD1  . PHE A 1 57  ? 2.32800   -43.52600 -0.56200  1.000 66.25005  ? 55  PHE A CD1  1 
ATOM   860  C CD2  . PHE A 1 57  ? 1.68200   -42.40900 -2.56500  1.000 62.49434  ? 55  PHE A CD2  1 
ATOM   861  C CE1  . PHE A 1 57  ? 2.22900   -42.34000 0.13700   1.000 63.71027  ? 55  PHE A CE1  1 
ATOM   862  C CE2  . PHE A 1 57  ? 1.58100   -41.22100 -1.87100  1.000 68.31082  ? 55  PHE A CE2  1 
ATOM   863  C CZ   . PHE A 1 57  ? 1.85400   -41.18600 -0.51900  1.000 65.28151  ? 55  PHE A CZ   1 
ATOM   864  H H    . PHE A 1 57  ? 2.94500   -46.97000 -3.73200  1.000 79.10000  ? 55  PHE A H    1 
ATOM   865  H HA   . PHE A 1 57  ? 3.99900   -44.51400 -3.53400  1.000 82.92000  ? 55  PHE A HA   1 
ATOM   866  H HB2  . PHE A 1 57  ? 1.64900   -44.77700 -3.49300  1.000 85.00000  ? 55  PHE A HB2  1 
ATOM   867  H HB3  . PHE A 1 57  ? 1.78700   -45.56800 -2.12400  1.000 85.00000  ? 55  PHE A HB3  1 
ATOM   868  H HD1  . PHE A 1 57  ? 2.58200   -44.30200 -0.11600  1.000 80.56000  ? 55  PHE A HD1  1 
ATOM   869  H HD2  . PHE A 1 57  ? 1.49700   -42.42700 -3.47600  1.000 76.05000  ? 55  PHE A HD2  1 
ATOM   870  H HE1  . PHE A 1 57  ? 2.41300   -42.31900 1.04800   1.000 77.51000  ? 55  PHE A HE1  1 
ATOM   871  H HE2  . PHE A 1 57  ? 1.32800   -40.44400 -2.31400  1.000 83.03000  ? 55  PHE A HE2  1 
ATOM   872  H HZ   . PHE A 1 57  ? 1.78600   -40.38500 -0.05100  1.000 79.40000  ? 55  PHE A HZ   1 
ATOM   873  N N    . CYS A 1 58  ? 5.51100   -44.75400 -1.63300  1.000 70.72690  ? 56  CYS A N    1 
ATOM   874  C CA   . CYS A 1 58  ? 6.41700   -44.90400 -0.50400  1.000 70.67953  ? 56  CYS A CA   1 
ATOM   875  C C    . CYS A 1 58  ? 6.33500   -43.66300 0.37300   1.000 70.33212  ? 56  CYS A C    1 
ATOM   876  O O    . CYS A 1 58  ? 6.46600   -42.53700 -0.11900  1.000 65.42363  ? 56  CYS A O    1 
ATOM   877  C CB   . CYS A 1 58  ? 7.85300   -45.12800 -0.98100  1.000 73.78253  ? 56  CYS A CB   1 
ATOM   878  S SG   . CYS A 1 58  ? 8.99600   -45.63100 0.32700   1.000 76.69341  ? 56  CYS A SG   1 
ATOM   879  H H    . CYS A 1 58  ? 5.74700   -44.13500 -2.18100  1.000 85.93000  ? 56  CYS A H    1 
ATOM   880  H HA   . CYS A 1 58  ? 6.15000   -45.67000 0.02700   1.000 85.87000  ? 56  CYS A HA   1 
ATOM   881  H HB2  . CYS A 1 58  ? 7.85200   -45.82400 -1.65600  1.000 89.60000  ? 56  CYS A HB2  1 
ATOM   882  H HB3  . CYS A 1 58  ? 8.18600   -44.30100 -1.36300  1.000 89.60000  ? 56  CYS A HB3  1 
ATOM   883  H HG   . CYS A 1 58  ? 10.11300  -45.63200 -0.11100  1.000 93.09000  ? 56  CYS A HG   1 
ATOM   884  N N    . ARG A 1 59  ? 6.11700   -43.87600 1.66700   1.000 69.02143  ? 57  ARG A N    1 
ATOM   885  C CA   . ARG A 1 59  ? 5.93200   -42.80800 2.64000   1.000 63.65500  ? 57  ARG A CA   1 
ATOM   886  C C    . ARG A 1 59  ? 7.10100   -42.82500 3.61500   1.000 70.37423  ? 57  ARG A C    1 
ATOM   887  O O    . ARG A 1 59  ? 7.38100   -43.85900 4.22800   1.000 72.73504  ? 57  ARG A O    1 
ATOM   888  C CB   . ARG A 1 59  ? 4.61200   -42.99900 3.39100   1.000 73.44302  ? 57  ARG A CB   1 
ATOM   889  C CG   . ARG A 1 59  ? 3.98400   -41.73000 3.92700   1.000 77.91460  ? 57  ARG A CG   1 
ATOM   890  C CD   . ARG A 1 59  ? 2.86900   -42.06100 4.91300   1.000 77.99883  ? 57  ARG A CD   1 
ATOM   891  N NE   . ARG A 1 59  ? 2.07200   -40.89200 5.27100   1.000 102.51229 ? 57  ARG A NE   1 
ATOM   892  C CZ   . ARG A 1 59  ? 0.80900   -40.68900 4.91200   1.000 106.66016 ? 57  ARG A CZ   1 
ATOM   893  N NH1  . ARG A 1 59  ? 0.14200   -41.57100 4.18300   1.000 105.19682 ? 57  ARG A NH1  1 
ATOM   894  N NH2  . ARG A 1 59  ? 0.19700   -39.57400 5.30000   1.000 91.54255  ? 57  ARG A NH2  1 
ATOM   895  H H    . ARG A 1 59  ? 6.07100   -44.66100 2.01600   1.000 83.88000  ? 57  ARG A H    1 
ATOM   896  H HA   . ARG A 1 59  ? 5.91300   -41.94900 2.18900   1.000 77.44000  ? 57  ARG A HA   1 
ATOM   897  H HB2  . ARG A 1 59  ? 3.97200   -43.40900 2.78800   1.000 89.19000  ? 57  ARG A HB2  1 
ATOM   898  H HB3  . ARG A 1 59  ? 4.77000   -43.58700 4.14600   1.000 89.19000  ? 57  ARG A HB3  1 
ATOM   899  H HG2  . ARG A 1 59  ? 4.65700   -41.20600 4.38900   1.000 94.55000  ? 57  ARG A HG2  1 
ATOM   900  H HG3  . ARG A 1 59  ? 3.60400   -41.22200 3.19300   1.000 94.55000  ? 57  ARG A HG3  1 
ATOM   901  H HD2  . ARG A 1 59  ? 2.29600   -42.73800 4.52500   1.000 94.66000  ? 57  ARG A HD2  1 
ATOM   902  H HD3  . ARG A 1 59  ? 3.26900   -42.40300 5.72800   1.000 94.66000  ? 57  ARG A HD3  1 
ATOM   903  H HE   . ARG A 1 59  ? 2.44700   -40.29100 5.75900   1.000 124.07000 ? 57  ARG A HE   1 
ATOM   904  H HH11 . ARG A 1 59  ? 0.51700   -42.29700 3.92100   1.000 127.29000 ? 57  ARG A HH11 1 
ATOM   905  H HH12 . ARG A 1 59  ? -0.67500  -41.41300 3.96600   1.000 127.29000 ? 57  ARG A HH12 1 
ATOM   906  H HH21 . ARG A 1 59  ? 0.61900   -38.99500 5.77500   1.000 110.91000 ? 57  ARG A HH21 1 
ATOM   907  H HH22 . ARG A 1 59  ? -0.62100  -39.43200 5.07500   1.000 110.91000 ? 57  ARG A HH22 1 
ATOM   908  N N    . LEU A 1 60  ? 7.78100   -41.68800 3.75600   1.000 69.43201  ? 58  LEU A N    1 
ATOM   909  C CA   . LEU A 1 60  ? 8.91000   -41.55700 4.67200   1.000 74.98004  ? 58  LEU A CA   1 
ATOM   910  C C    . LEU A 1 60  ? 8.58200   -40.50500 5.72300   1.000 76.17492  ? 58  LEU A C    1 
ATOM   911  O O    . LEU A 1 60  ? 8.34700   -39.33900 5.38700   1.000 74.70369  ? 58  LEU A O    1 
ATOM   912  C CB   . LEU A 1 60  ? 10.19500  -41.18400 3.92700   1.000 68.09764  ? 58  LEU A CB   1 
ATOM   913  C CG   . LEU A 1 60  ? 10.87600  -42.32500 3.16600   1.000 63.94714  ? 58  LEU A CG   1 
ATOM   914  C CD1  . LEU A 1 60  ? 10.67600  -42.19000 1.66800   1.000 70.77954  ? 58  LEU A CD1  1 
ATOM   915  C CD2  . LEU A 1 60  ? 12.35800  -42.39500 3.50300   1.000 65.28414  ? 58  LEU A CD2  1 
ATOM   916  H H    . LEU A 1 60  ? 7.60300   -40.96600 3.32400   1.000 84.38000  ? 58  LEU A H    1 
ATOM   917  H HA   . LEU A 1 60  ? 9.05800   -42.40100 5.12600   1.000 91.03000  ? 58  LEU A HA   1 
ATOM   918  H HB2  . LEU A 1 60  ? 9.98200   -40.49700 3.28000   1.000 82.77000  ? 58  LEU A HB2  1 
ATOM   919  H HB3  . LEU A 1 60  ? 10.83400  -40.83800 4.57000   1.000 82.77000  ? 58  LEU A HB3  1 
ATOM   920  H HG   . LEU A 1 60  ? 10.47100  -43.16100 3.43900   1.000 77.79000  ? 58  LEU A HG   1 
ATOM   921  H HD11 . LEU A 1 60  ? 11.09200  -42.94600 1.22500   1.000 85.99000  ? 58  LEU A HD11 1 
ATOM   922  H HD12 . LEU A 1 60  ? 9.72500   -42.17600 1.47700   1.000 85.99000  ? 58  LEU A HD12 1 
ATOM   923  H HD13 . LEU A 1 60  ? 11.08600  -41.36400 1.36800   1.000 85.99000  ? 58  LEU A HD13 1 
ATOM   924  H HD21 . LEU A 1 60  ? 12.80100  -42.96600 2.85600   1.000 79.40000  ? 58  LEU A HD21 1 
ATOM   925  H HD22 . LEU A 1 60  ? 12.73300  -41.50100 3.46700   1.000 79.40000  ? 58  LEU A HD22 1 
ATOM   926  H HD23 . LEU A 1 60  ? 12.46100  -42.76300 4.39400   1.000 79.40000  ? 58  LEU A HD23 1 
ATOM   927  N N    . ARG A 1 61  ? 8.56800   -40.91900 6.98800   1.000 77.83038  ? 59  ARG A N    1 
ATOM   928  C CA   . ARG A 1 61  ? 8.32700   -40.03100 8.11900   1.000 80.86233  ? 59  ARG A CA   1 
ATOM   929  C C    . ARG A 1 61  ? 9.60300   -39.94500 8.94600   1.000 79.19107  ? 59  ARG A C    1 
ATOM   930  O O    . ARG A 1 61  ? 10.08400  -40.96200 9.45800   1.000 77.73037  ? 59  ARG A O    1 
ATOM   931  C CB   . ARG A 1 61  ? 7.16100   -40.53300 8.97300   1.000 81.05972  ? 59  ARG A CB   1 
ATOM   932  C CG   . ARG A 1 61  ? 6.85100   -39.67400 10.20200  1.000 89.80287  ? 59  ARG A CG   1 
ATOM   933  C CD   . ARG A 1 61  ? 6.36500   -38.27900 9.82700   1.000 86.97622  ? 59  ARG A CD   1 
ATOM   934  N NE   . ARG A 1 61  ? 4.91200   -38.21200 9.71600   1.000 88.19215  ? 59  ARG A NE   1 
ATOM   935  C CZ   . ARG A 1 61  ? 4.23200   -37.12000 9.39200   1.000 91.53729  ? 59  ARG A CZ   1 
ATOM   936  N NH1  . ARG A 1 61  ? 4.84400   -35.97500 9.13100   1.000 86.11032  ? 59  ARG A NH1  1 
ATOM   937  N NH2  . ARG A 1 61  ? 2.90500   -37.17700 9.32600   1.000 79.81483  ? 59  ARG A NH2  1 
ATOM   938  H H    . ARG A 1 61  ? 8.70000   -41.73600 7.22100   1.000 94.45000  ? 59  ARG A H    1 
ATOM   939  H HA   . ARG A 1 61  ? 8.11600   -39.14500 7.78900   1.000 98.09000  ? 59  ARG A HA   1 
ATOM   940  H HB2  . ARG A 1 61  ? 6.36200   -40.55700 8.42300   1.000 98.33000  ? 59  ARG A HB2  1 
ATOM   941  H HB3  . ARG A 1 61  ? 7.36900   -41.42800 9.28500   1.000 98.33000  ? 59  ARG A HB3  1 
ATOM   942  H HG2  . ARG A 1 61  ? 6.15300   -40.10500 10.71900  1.000 108.82000 ? 59  ARG A HG2  1 
ATOM   943  H HG3  . ARG A 1 61  ? 7.65200   -39.58000 10.74100  1.000 108.82000 ? 59  ARG A HG3  1 
ATOM   944  H HD2  . ARG A 1 61  ? 6.64100   -37.65400 10.51500  1.000 105.43000 ? 59  ARG A HD2  1 
ATOM   945  H HD3  . ARG A 1 61  ? 6.74100   -38.01700 8.97400   1.000 105.43000 ? 59  ARG A HD3  1 
ATOM   946  H HE   . ARG A 1 61  ? 4.46500   -38.93100 9.86900   1.000 106.89000 ? 59  ARG A HE   1 
ATOM   947  H HH11 . ARG A 1 61  ? 5.70100   -35.92400 9.17000   1.000 104.39000 ? 59  ARG A HH11 1 
ATOM   948  H HH12 . ARG A 1 61  ? 4.38300   -35.28000 8.92300   1.000 104.39000 ? 59  ARG A HH12 1 
ATOM   949  H HH21 . ARG A 1 61  ? 2.49700   -37.91600 9.49300   1.000 96.84000  ? 59  ARG A HH21 1 
ATOM   950  H HH22 . ARG A 1 61  ? 2.45400   -36.47500 9.11600   1.000 96.84000  ? 59  ARG A HH22 1 
ATOM   951  N N    . PHE A 1 62  ? 10.14600  -38.74200 9.07100   1.000 84.96808  ? 60  PHE A N    1 
ATOM   952  C CA   . PHE A 1 62  ? 11.37000  -38.53300 9.82700   1.000 90.53454  ? 60  PHE A CA   1 
ATOM   953  C C    . PHE A 1 62  ? 11.05400  -38.16100 11.26700  1.000 91.17672  ? 60  PHE A C    1 
ATOM   954  O O    . PHE A 1 62  ? 9.96100   -37.67300 11.57200  1.000 88.37902  ? 60  PHE A O    1 
ATOM   955  C CB   . PHE A 1 62  ? 12.20400  -37.43300 9.17700   1.000 81.23079  ? 60  PHE A CB   1 
ATOM   956  C CG   . PHE A 1 62  ? 12.72000  -37.78900 7.81200   1.000 77.89618  ? 60  PHE A CG   1 
ATOM   957  C CD1  . PHE A 1 62  ? 11.92600  -37.62200 6.69000   1.000 76.64077  ? 60  PHE A CD1  1 
ATOM   958  C CD2  . PHE A 1 62  ? 14.00100  -38.28800 7.65100   1.000 73.84043  ? 60  PHE A CD2  1 
ATOM   959  C CE1  . PHE A 1 62  ? 12.40000  -37.94600 5.43400   1.000 68.34240  ? 60  PHE A CE1  1 
ATOM   960  C CE2  . PHE A 1 62  ? 14.48100  -38.61100 6.39700   1.000 75.92489  ? 60  PHE A CE2  1 
ATOM   961  C CZ   . PHE A 1 62  ? 13.68000  -38.44200 5.28800   1.000 73.74042  ? 60  PHE A CZ   1 
ATOM   962  H H    . PHE A 1 62  ? 9.82200   -38.02500 8.72400   1.000 103.02000 ? 60  PHE A H    1 
ATOM   963  H HA   . PHE A 1 62  ? 11.88600  -39.35300 9.82000   1.000 109.70000 ? 60  PHE A HA   1 
ATOM   964  H HB2  . PHE A 1 62  ? 11.65700  -36.63700 9.08900   1.000 98.54000  ? 60  PHE A HB2  1 
ATOM   965  H HB3  . PHE A 1 62  ? 12.96900  -37.24500 9.74300   1.000 98.54000  ? 60  PHE A HB3  1 
ATOM   966  H HD1  . PHE A 1 62  ? 11.06300  -37.28800 6.78300   1.000 93.03000  ? 60  PHE A HD1  1 
ATOM   967  H HD2  . PHE A 1 62  ? 14.54600  -38.40300 8.39600   1.000 89.67000  ? 60  PHE A HD2  1 
ATOM   968  H HE1  . PHE A 1 62  ? 11.85800  -37.83000 4.68700   1.000 83.07000  ? 60  PHE A HE1  1 
ATOM   969  H HE2  . PHE A 1 62  ? 15.34300  -38.94600 6.30100   1.000 92.17000  ? 60  PHE A HE2  1 
ATOM   970  H HZ   . PHE A 1 62  ? 14.00100  -38.66100 4.44300   1.000 89.54000  ? 60  PHE A HZ   1 
ATOM   971  N N    . PRO A 1 63  ? 11.99800  -38.37600 12.19000  1.000 87.87106  ? 61  PRO A N    1 
ATOM   972  C CA   . PRO A 1 63  ? 11.73800  -38.02900 13.59300  1.000 95.45618  ? 61  PRO A CA   1 
ATOM   973  C C    . PRO A 1 63  ? 11.62700  -36.52800 13.78000  1.000 94.32973  ? 61  PRO A C    1 
ATOM   974  O O    . PRO A 1 63  ? 10.69000  -36.02900 14.41100  1.000 97.80120  ? 61  PRO A O    1 
ATOM   975  C CB   . PRO A 1 63  ? 12.95400  -38.59700 14.34000  1.000 85.90504  ? 61  PRO A CB   1 
ATOM   976  C CG   . PRO A 1 63  ? 13.69200  -39.43500 13.35000  1.000 82.69413  ? 61  PRO A CG   1 
ATOM   977  C CD   . PRO A 1 63  ? 13.36200  -38.89700 12.00100  1.000 80.97287  ? 61  PRO A CD   1 
ATOM   978  H HA   . PRO A 1 63  ? 10.92900  -38.46000 13.90900  1.000 115.61000 ? 61  PRO A HA   1 
ATOM   979  H HB2  . PRO A 1 63  ? 13.51300  -37.86800 14.65200  1.000 104.14000 ? 61  PRO A HB2  1 
ATOM   980  H HB3  . PRO A 1 63  ? 12.65200  -39.13800 15.08600  1.000 104.14000 ? 61  PRO A HB3  1 
ATOM   981  H HG2  . PRO A 1 63  ? 14.64500  -39.37300 13.51800  1.000 100.29000 ? 61  PRO A HG2  1 
ATOM   982  H HG3  . PRO A 1 63  ? 13.39000  -40.35300 13.42700  1.000 100.29000 ? 61  PRO A HG3  1 
ATOM   983  H HD2  . PRO A 1 63  ? 13.97000  -38.18000 11.76200  1.000 98.23000  ? 61  PRO A HD2  1 
ATOM   984  H HD3  . PRO A 1 63  ? 13.37500  -39.61200 11.34600  1.000 98.23000  ? 61  PRO A HD3  1 
ATOM   985  N N    . LYS A 1 64  ? 12.60000  -35.80000 13.22700  1.000 88.95277  ? 62  LYS A N    1 
ATOM   986  C CA   . LYS A 1 64  ? 12.68000  -34.35200 13.31000  1.000 90.04764  ? 62  LYS A CA   1 
ATOM   987  C C    . LYS A 1 64  ? 12.26200  -33.71100 11.99800  1.000 89.20017  ? 62  LYS A C    1 
ATOM   988  O O    . LYS A 1 64  ? 12.38000  -34.32700 10.93500  1.000 85.96294  ? 62  LYS A O    1 
ATOM   989  C CB   . LYS A 1 64  ? 14.10700  -33.90900 13.65600  1.000 85.13389  ? 62  LYS A CB   1 
ATOM   990  C CG   . LYS A 1 64  ? 14.60900  -34.35100 15.02700  1.000 94.07181  ? 62  LYS A CG   1 
ATOM   991  C CD   . LYS A 1 64  ? 13.47700  -34.76400 15.95800  1.000 105.36790 ? 62  LYS A CD   1 
ATOM   992  C CE   . LYS A 1 64  ? 13.08900  -33.62700 16.89600  1.000 110.71854 ? 62  LYS A CE   1 
ATOM   993  N NZ   . LYS A 1 64  ? 11.87400  -33.94400 17.70300  1.000 101.44637 ? 62  LYS A NZ   1 
ATOM   994  H H    . LYS A 1 64  ? 13.24900  -36.14500 12.78100  1.000 107.80000 ? 62  LYS A H    1 
ATOM   995  H HA   . LYS A 1 64  ? 12.06300  -34.02700 13.98000  1.000 109.12000 ? 62  LYS A HA   1 
ATOM   996  H HB2  . LYS A 1 64  ? 14.71200  -34.27400 12.99200  1.000 103.22000 ? 62  LYS A HB2  1 
ATOM   997  H HB3  . LYS A 1 64  ? 14.14300  -32.94000 13.63000  1.000 103.22000 ? 62  LYS A HB3  1 
ATOM   998  H HG2  . LYS A 1 64  ? 15.20100  -35.11200 14.91700  1.000 113.94000 ? 62  LYS A HG2  1 
ATOM   999  H HG3  . LYS A 1 64  ? 15.08600  -33.61500 15.44200  1.000 113.94000 ? 62  LYS A HG3  1 
ATOM   1000 H HD2  . LYS A 1 64  ? 12.68400  -35.09900 15.54300  1.000 127.50000 ? 62  LYS A HD2  1 
ATOM   1001 H HD3  . LYS A 1 64  ? 13.83000  -35.46600 16.52700  1.000 127.50000 ? 62  LYS A HD3  1 
ATOM   1002 H HE2  . LYS A 1 64  ? 13.82200  -33.45700 17.50900  1.000 133.92000 ? 62  LYS A HE2  1 
ATOM   1003 H HE3  . LYS A 1 64  ? 12.90300  -32.83300 16.37100  1.000 133.92000 ? 62  LYS A HE3  1 
ATOM   1004 H HZ1  . LYS A 1 64  ? 11.76400  -33.32400 18.33100  1.000 122.79000 ? 62  LYS A HZ1  1 
ATOM   1005 H HZ2  . LYS A 1 64  ? 11.15400  -33.95900 17.18000  1.000 122.79000 ? 62  LYS A HZ2  1 
ATOM   1006 H HZ3  . LYS A 1 64  ? 11.96600  -34.73800 18.09400  1.000 122.79000 ? 62  LYS A HZ3  1 
ATOM   1007 N N    . PRO A 1 65  ? 11.76200  -32.47600 12.03600  1.000 87.84737  ? 63  PRO A N    1 
ATOM   1008 C CA   . PRO A 1 65  ? 11.52600  -31.74700 10.78500  1.000 85.72344  ? 63  PRO A CA   1 
ATOM   1009 C C    . PRO A 1 65  ? 12.84000  -31.43500 10.09100  1.000 84.96019  ? 63  PRO A C    1 
ATOM   1010 O O    . PRO A 1 65  ? 13.82800  -31.06100 10.72800  1.000 82.33619  ? 63  PRO A O    1 
ATOM   1011 C CB   . PRO A 1 65  ? 10.81100  -30.46900 11.24100  1.000 79.65429  ? 63  PRO A CB   1 
ATOM   1012 C CG   . PRO A 1 65  ? 11.18700  -30.31300 12.67100  1.000 81.53083  ? 63  PRO A CG   1 
ATOM   1013 C CD   . PRO A 1 65  ? 11.33400  -31.70200 13.21300  1.000 79.73061  ? 63  PRO A CD   1 
ATOM   1014 H HA   . PRO A 1 65  ? 10.95000  -32.25400 10.19200  1.000 103.92000 ? 63  PRO A HA   1 
ATOM   1015 H HB2  . PRO A 1 65  ? 11.12400  -29.71400 10.71900  1.000 96.64000  ? 63  PRO A HB2  1 
ATOM   1016 H HB3  . PRO A 1 65  ? 9.85200   -30.57900 11.14800  1.000 96.64000  ? 63  PRO A HB3  1 
ATOM   1017 H HG2  . PRO A 1 65  ? 12.02700  -29.83200 12.73500  1.000 98.89000  ? 63  PRO A HG2  1 
ATOM   1018 H HG3  . PRO A 1 65  ? 10.48500  -29.83700 13.14100  1.000 98.89000  ? 63  PRO A HG3  1 
ATOM   1019 H HD2  . PRO A 1 65  ? 12.01700  -31.72500 13.90200  1.000 96.73000  ? 63  PRO A HD2  1 
ATOM   1020 H HD3  . PRO A 1 65  ? 10.48300  -32.02900 13.54300  1.000 96.73000  ? 63  PRO A HD3  1 
ATOM   1021 N N    . ILE A 1 66  ? 12.84400  -31.59400 8.77200   1.000 80.30173  ? 64  ILE A N    1 
ATOM   1022 C CA   . ILE A 1 66  ? 14.04400  -31.43700 7.97000   1.000 76.55128  ? 64  ILE A CA   1 
ATOM   1023 C C    . ILE A 1 66  ? 13.95300  -30.22900 7.05000   1.000 79.02526  ? 64  ILE A C    1 
ATOM   1024 O O    . ILE A 1 66  ? 14.91400  -29.46700 6.92500   1.000 82.75729  ? 64  ILE A O    1 
ATOM   1025 C CB   . ILE A 1 66  ? 14.32400  -32.72800 7.16700   1.000 74.61947  ? 64  ILE A CB   1 
ATOM   1026 C CG1  . ILE A 1 66  ? 14.24100  -33.92900 8.11700   1.000 75.88278  ? 64  ILE A CG1  1 
ATOM   1027 C CG2  . ILE A 1 66  ? 15.66800  -32.62200 6.46100   1.000 80.48860  ? 64  ILE A CG2  1 
ATOM   1028 C CD1  . ILE A 1 66  ? 14.95200  -35.17500 7.65100   1.000 83.22050  ? 64  ILE A CD1  1 
ATOM   1029 H H    . ILE A 1 66  ? 12.14700  -31.79700 8.31200   1.000 97.42000  ? 64  ILE A H    1 
ATOM   1030 H HA   . ILE A 1 66  ? 14.79900  -31.29500 8.56200   1.000 92.92000  ? 64  ILE A HA   1 
ATOM   1031 H HB   . ILE A 1 66  ? 13.63300  -32.82400 6.49300   1.000 90.60000  ? 64  ILE A HB   1 
ATOM   1032 H HG12 . ILE A 1 66  ? 14.62900  -33.67400 8.96900   1.000 92.12000  ? 64  ILE A HG12 1 
ATOM   1033 H HG13 . ILE A 1 66  ? 13.30700  -34.15700 8.24200   1.000 92.12000  ? 64  ILE A HG13 1 
ATOM   1034 H HG21 . ILE A 1 66  ? 15.78300  -33.38900 5.87900   1.000 97.65000  ? 64  ILE A HG21 1 
ATOM   1035 H HG22 . ILE A 1 66  ? 15.69300  -31.81000 5.93200   1.000 97.65000  ? 64  ILE A HG22 1 
ATOM   1036 H HG23 . ILE A 1 66  ? 16.37300  -32.60300 7.12700   1.000 97.65000  ? 64  ILE A HG23 1 
ATOM   1037 H HD11 . ILE A 1 66  ? 14.82700  -35.86300 8.32100   1.000 100.92000 ? 64  ILE A HD11 1 
ATOM   1038 H HD12 . ILE A 1 66  ? 14.57400  -35.46000 6.80400   1.000 100.92000 ? 64  ILE A HD12 1 
ATOM   1039 H HD13 . ILE A 1 66  ? 15.89800  -34.98900 7.55000   1.000 100.92000 ? 64  ILE A HD13 1 
ATOM   1040 N N    . ARG A 1 67  ? 12.80800  -30.03300 6.40700   1.000 80.49123  ? 65  ARG A N    1 
ATOM   1041 C CA   . ARG A 1 67  ? 12.57500  -28.89800 5.52200   1.000 75.64591  ? 65  ARG A CA   1 
ATOM   1042 C C    . ARG A 1 67  ? 11.57600  -27.97600 6.21600   1.000 80.75705  ? 65  ARG A C    1 
ATOM   1043 O O    . ARG A 1 67  ? 10.38600  -27.95800 5.90100   1.000 80.35437  ? 65  ARG A O    1 
ATOM   1044 C CB   . ARG A 1 67  ? 12.07300  -29.37000 4.16300   1.000 78.88577  ? 65  ARG A CB   1 
ATOM   1045 C CG   . ARG A 1 67  ? 13.15100  -29.99300 3.28700   1.000 76.99607  ? 65  ARG A CG   1 
ATOM   1046 C CD   . ARG A 1 67  ? 14.09800  -28.94000 2.72500   1.000 78.57784  ? 65  ARG A CD   1 
ATOM   1047 N NE   . ARG A 1 67  ? 13.38000  -27.92200 1.96600   1.000 71.60332  ? 65  ARG A NE   1 
ATOM   1048 C CZ   . ARG A 1 67  ? 12.92100  -28.09000 0.73300   1.000 81.34660  ? 65  ARG A CZ   1 
ATOM   1049 N NH1  . ARG A 1 67  ? 13.10900  -29.22000 0.07200   1.000 84.75490  ? 65  ARG A NH1  1 
ATOM   1050 N NH2  . ARG A 1 67  ? 12.25100  -27.10000 0.15100   1.000 77.37243  ? 65  ARG A NH2  1 
ATOM   1051 H H    . ARG A 1 67  ? 12.13100  -30.56000 6.46900   1.000 97.65000  ? 65  ARG A H    1 
ATOM   1052 H HA   . ARG A 1 67  ? 13.40200  -28.40900 5.39200   1.000 91.83000  ? 65  ARG A HA   1 
ATOM   1053 H HB2  . ARG A 1 67  ? 11.37900  -30.03400 4.29900   1.000 95.72000  ? 65  ARG A HB2  1 
ATOM   1054 H HB3  . ARG A 1 67  ? 11.71100  -28.60900 3.68700   1.000 95.72000  ? 65  ARG A HB3  1 
ATOM   1055 H HG2  . ARG A 1 67  ? 13.67100  -30.61800 3.81600   1.000 93.45000  ? 65  ARG A HG2  1 
ATOM   1056 H HG3  . ARG A 1 67  ? 12.73200  -30.45200 2.54300   1.000 93.45000  ? 65  ARG A HG3  1 
ATOM   1057 H HD2  . ARG A 1 67  ? 14.56000  -28.50200 3.45600   1.000 95.35000  ? 65  ARG A HD2  1 
ATOM   1058 H HD3  . ARG A 1 67  ? 14.73800  -29.36600 2.13500   1.000 95.35000  ? 65  ARG A HD3  1 
ATOM   1059 H HE   . ARG A 1 67  ? 13.33700  -27.13200 2.30200   1.000 86.98000  ? 65  ARG A HE   1 
ATOM   1060 H HH11 . ARG A 1 67  ? 13.53900  -29.86900 0.43800   1.000 102.76000 ? 65  ARG A HH11 1 
ATOM   1061 H HH12 . ARG A 1 67  ? 12.80200  -29.30600 -0.72700  1.000 102.76000 ? 65  ARG A HH12 1 
ATOM   1062 H HH21 . ARG A 1 67  ? 12.12400  -26.36100 0.57200   1.000 93.90000  ? 65  ARG A HH21 1 
ATOM   1063 H HH22 . ARG A 1 67  ? 11.95000  -27.19700 -0.64900  1.000 93.90000  ? 65  ARG A HH22 1 
ATOM   1064 N N    . THR A 1 68  ? 12.07400  -27.21100 7.18800   1.000 82.70202  ? 66  THR A N    1 
ATOM   1065 C CA   . THR A 1 68  ? 11.22100  -26.27900 7.91200   1.000 75.86173  ? 66  THR A CA   1 
ATOM   1066 C C    . THR A 1 68  ? 10.73800  -25.12700 7.04200   1.000 79.85958  ? 66  THR A C    1 
ATOM   1067 O O    . THR A 1 68  ? 9.85500   -24.37700 7.47400   1.000 78.98579  ? 66  THR A O    1 
ATOM   1068 C CB   . THR A 1 68  ? 11.96500  -25.72300 9.12600   1.000 81.44398  ? 66  THR A CB   1 
ATOM   1069 O OG1  . THR A 1 68  ? 13.23700  -25.20500 8.71700   1.000 99.23032  ? 66  THR A OG1  1 
ATOM   1070 C CG2  . THR A 1 68  ? 12.17000  -26.81100 10.16800  1.000 81.39923  ? 66  THR A CG2  1 
ATOM   1071 H H    . THR A 1 68  ? 12.89500  -27.21500 7.44300   1.000 100.30000 ? 66  THR A H    1 
ATOM   1072 H HA   . THR A 1 68  ? 10.44000  -26.75500 8.23400   1.000 92.10000  ? 66  THR A HA   1 
ATOM   1073 H HB   . THR A 1 68  ? 11.44100  -25.01100 9.52600   1.000 98.79000  ? 66  THR A HB   1 
ATOM   1074 H HG1  . THR A 1 68  ? 13.64900  -24.89800 9.38100   1.000 120.13000 ? 66  THR A HG1  1 
ATOM   1075 H HG21 . THR A 1 68  ? 12.63800  -26.44900 10.93700  1.000 98.74000  ? 66  THR A HG21 1 
ATOM   1076 H HG22 . THR A 1 68  ? 11.31200  -27.15900 10.45600  1.000 98.74000  ? 66  THR A HG22 1 
ATOM   1077 H HG23 . THR A 1 68  ? 12.69400  -27.53500 9.79200   1.000 98.74000  ? 66  THR A HG23 1 
ATOM   1078 N N    . ASP A 1 69  ? 11.28400  -24.96900 5.83500   1.000 78.64101  ? 67  ASP A N    1 
ATOM   1079 C CA   . ASP A 1 69  ? 10.86000  -23.88900 4.95600   1.000 77.97251  ? 67  ASP A CA   1 
ATOM   1080 C C    . ASP A 1 69  ? 9.50900   -24.15500 4.30900   1.000 81.82297  ? 67  ASP A C    1 
ATOM   1081 O O    . ASP A 1 69  ? 8.84600   -23.20400 3.87700   1.000 79.96485  ? 67  ASP A O    1 
ATOM   1082 C CB   . ASP A 1 69  ? 11.90400  -23.65500 3.86100   1.000 77.77248  ? 67  ASP A CB   1 
ATOM   1083 C CG   . ASP A 1 69  ? 12.29500  -24.93600 3.14900   1.000 80.19646  ? 67  ASP A CG   1 
ATOM   1084 O OD1  . ASP A 1 69  ? 12.80000  -25.85800 3.82600   1.000 79.67008  ? 67  ASP A OD1  1 
ATOM   1085 O OD2  . ASP A 1 69  ? 12.08300  -25.03000 1.92200   1.000 82.69413  ? 67  ASP A OD2  1 
ATOM   1086 H H    . ASP A 1 69  ? 11.90000  -25.47300 5.51100   1.000 95.43000  ? 67  ASP A H    1 
ATOM   1087 H HA   . ASP A 1 69  ? 10.78500  -23.07300 5.47600   1.000 94.62000  ? 67  ASP A HA   1 
ATOM   1088 H HB2  . ASP A 1 69  ? 11.54000  -23.04300 3.20200   1.000 94.39000  ? 67  ASP A HB2  1 
ATOM   1089 H HB3  . ASP A 1 69  ? 12.70300  -23.27700 4.26100   1.000 94.39000  ? 67  ASP A HB3  1 
ATOM   1090 N N    . VAL A 1 70  ? 9.07900   -25.41100 4.23100   1.000 73.69568  ? 68  VAL A N    1 
ATOM   1091 C CA   . VAL A 1 70  ? 7.87000   -25.76300 3.49900   1.000 76.77499  ? 68  VAL A CA   1 
ATOM   1092 C C    . VAL A 1 70  ? 6.69700   -25.86200 4.46100   1.000 77.65931  ? 68  VAL A C    1 
ATOM   1093 O O    . VAL A 1 70  ? 6.82100   -26.39600 5.57200   1.000 72.81926  ? 68  VAL A O    1 
ATOM   1094 C CB   . VAL A 1 70  ? 8.04400   -27.07300 2.70400   1.000 81.04130  ? 68  VAL A CB   1 
ATOM   1095 C CG1  . VAL A 1 70  ? 8.74800   -26.79700 1.38800   1.000 86.14454  ? 68  VAL A CG1  1 
ATOM   1096 C CG2  . VAL A 1 70  ? 8.81100   -28.12200 3.50300   1.000 78.22780  ? 68  VAL A CG2  1 
ATOM   1097 H H    . VAL A 1 70  ? 9.47300   -26.07500 4.60700   1.000 89.49000  ? 68  VAL A H    1 
ATOM   1098 H HA   . VAL A 1 70  ? 7.67200   -25.05800 2.86300   1.000 93.18000  ? 68  VAL A HA   1 
ATOM   1099 H HB   . VAL A 1 70  ? 7.16700   -27.43600 2.50200   1.000 98.31000  ? 68  VAL A HB   1 
ATOM   1100 H HG11 . VAL A 1 70  ? 9.04300   -27.63800 1.00700   1.000 104.43000 ? 68  VAL A HG11 1 
ATOM   1101 H HG12 . VAL A 1 70  ? 8.12900   -26.35700 0.78400   1.000 104.43000 ? 68  VAL A HG12 1 
ATOM   1102 H HG13 . VAL A 1 70  ? 9.51300   -26.22500 1.55500   1.000 104.43000 ? 68  VAL A HG13 1 
ATOM   1103 H HG21 . VAL A 1 70  ? 8.75800   -28.97300 3.04000   1.000 94.93000  ? 68  VAL A HG21 1 
ATOM   1104 H HG22 . VAL A 1 70  ? 9.73400   -27.84200 3.57500   1.000 94.93000  ? 68  VAL A HG22 1 
ATOM   1105 H HG23 . VAL A 1 70  ? 8.41500   -28.20000 4.38500   1.000 94.93000  ? 68  VAL A HG23 1 
ATOM   1106 N N    . THR A 1 71  ? 5.55900   -25.32300 4.03700   1.000 84.55487  ? 69  THR A N    1 
ATOM   1107 C CA   . THR A 1 71  ? 4.30700   -25.54300 4.74100   1.000 82.06247  ? 69  THR A CA   1 
ATOM   1108 C C    . THR A 1 71  ? 3.81700   -26.96300 4.47900   1.000 79.06737  ? 69  THR A C    1 
ATOM   1109 O O    . THR A 1 71  ? 4.16000   -27.58500 3.47000   1.000 74.14310  ? 69  THR A O    1 
ATOM   1110 C CB   . THR A 1 71  ? 3.25800   -24.52300 4.28900   1.000 79.00684  ? 69  THR A CB   1 
ATOM   1111 O OG1  . THR A 1 71  ? 2.04200   -24.71800 5.02100   1.000 90.48717  ? 69  THR A OG1  1 
ATOM   1112 C CG2  . THR A 1 71  ? 2.97300   -24.65500 2.79100   1.000 84.28905  ? 69  THR A CG2  1 
ATOM   1113 H H    . THR A 1 71  ? 5.49100   -24.82200 3.34300   1.000 102.52000 ? 69  THR A H    1 
ATOM   1114 H HA   . THR A 1 71  ? 4.44900   -25.43700 5.69500   1.000 99.53000  ? 69  THR A HA   1 
ATOM   1115 H HB   . THR A 1 71  ? 3.59100   -23.62700 4.45600   1.000 95.86000  ? 69  THR A HB   1 
ATOM   1116 H HG1  . THR A 1 71  ? 1.46500   -24.15900 4.77400   1.000 109.64000 ? 69  THR A HG1  1 
ATOM   1117 H HG21 . THR A 1 71  ? 2.35300   -23.96300 2.51400   1.000 102.20000 ? 69  THR A HG21 1 
ATOM   1118 H HG22 . THR A 1 71  ? 3.79300   -24.56100 2.28200   1.000 102.20000 ? 69  THR A HG22 1 
ATOM   1119 H HG23 . THR A 1 71  ? 2.58000   -25.52000 2.59900   1.000 102.20000 ? 69  THR A HG23 1 
ATOM   1120 N N    . GLY A 1 72  ? 3.02400   -27.48500 5.41000   1.000 72.87190  ? 70  GLY A N    1 
ATOM   1121 C CA   . GLY A 1 72  ? 2.45600   -28.80900 5.24500   1.000 78.16727  ? 70  GLY A CA   1 
ATOM   1122 C C    . GLY A 1 72  ? 1.22900   -28.80300 4.35600   1.000 77.52508  ? 70  GLY A C    1 
ATOM   1123 O O    . GLY A 1 72  ? 0.23200   -28.15200 4.68200   1.000 90.72140  ? 70  GLY A O    1 
ATOM   1124 H H    . GLY A 1 72  ? 2.80300   -27.09200 6.14200   1.000 88.51000  ? 70  GLY A H    1 
ATOM   1125 H HA2  . GLY A 1 72  ? 3.11800   -29.39900 4.85200   1.000 94.86000  ? 70  GLY A HA2  1 
ATOM   1126 H HA3  . GLY A 1 72  ? 2.20500   -29.16300 6.11200   1.000 94.86000  ? 70  GLY A HA3  1 
ATOM   1127 N N    . MET A 1 73  ? 1.28000   -29.51900 3.23400   1.000 72.50080  ? 71  MET A N    1 
ATOM   1128 C CA   . MET A 1 73  ? 0.17100   -29.52000 2.29600   1.000 74.27206  ? 71  MET A CA   1 
ATOM   1129 C C    . MET A 1 73  ? -0.85600  -30.58600 2.66500   1.000 76.25651  ? 71  MET A C    1 
ATOM   1130 O O    . MET A 1 73  ? -0.73500  -31.29600 3.66600   1.000 73.61146  ? 71  MET A O    1 
ATOM   1131 C CB   . MET A 1 73  ? 0.64500   -29.78200 0.86700   1.000 74.22469  ? 71  MET A CB   1 
ATOM   1132 C CG   . MET A 1 73  ? 1.85400   -28.99800 0.42000   1.000 83.71530  ? 71  MET A CG   1 
ATOM   1133 S SD   . MET A 1 73  ? 2.26400   -29.32000 -1.31500  1.000 85.61816  ? 71  MET A SD   1 
ATOM   1134 C CE   . MET A 1 73  ? 0.69700   -29.86700 -2.00500  1.000 68.12922  ? 71  MET A CE   1 
ATOM   1135 H H    . MET A 1 73  ? 1.94500   -30.01000 2.99700   1.000 88.06000  ? 71  MET A H    1 
ATOM   1136 H HA   . MET A 1 73  ? -0.25800  -28.65000 2.31300   1.000 90.19000  ? 71  MET A HA   1 
ATOM   1137 H HB2  . MET A 1 73  ? 0.84700   -30.72600 0.76900   1.000 90.13000  ? 71  MET A HB2  1 
ATOM   1138 H HB3  . MET A 1 73  ? -0.09800  -29.54200 0.29700   1.000 90.13000  ? 71  MET A HB3  1 
ATOM   1139 H HG2  . MET A 1 73  ? 1.67300   -28.05000 0.51800   1.000 101.52000 ? 71  MET A HG2  1 
ATOM   1140 H HG3  . MET A 1 73  ? 2.61700   -29.25100 0.96300   1.000 101.52000 ? 71  MET A HG3  1 
ATOM   1141 H HE1  . MET A 1 73  ? 0.80600   -29.99100 -2.96100  1.000 82.82000  ? 71  MET A HE1  1 
ATOM   1142 H HE2  . MET A 1 73  ? 0.44000   -30.70800 -1.59500  1.000 82.82000  ? 71  MET A HE2  1 
ATOM   1143 H HE3  . MET A 1 73  ? 0.02200   -29.19000 -1.83900  1.000 82.82000  ? 71  MET A HE3  1 
ATOM   1144 N N    . ILE A 1 74  ? -1.87100  -30.70800 1.81700   1.000 76.16703  ? 72  ILE A N    1 
ATOM   1145 C CA   . ILE A 1 74  ? -2.88900  -31.74100 1.94800   1.000 73.41407  ? 72  ILE A CA   1 
ATOM   1146 C C    . ILE A 1 74  ? -2.49000  -32.91900 1.07100   1.000 71.92178  ? 72  ILE A C    1 
ATOM   1147 O O    . ILE A 1 74  ? -2.16200  -32.74600 -0.10900  1.000 71.33224  ? 72  ILE A O    1 
ATOM   1148 C CB   . ILE A 1 74  ? -4.27600  -31.20000 1.55900   1.000 76.06175  ? 72  ILE A CB   1 
ATOM   1149 C CG1  . ILE A 1 74  ? -4.64400  -30.02300 2.47200   1.000 78.14884  ? 72  ILE A CG1  1 
ATOM   1150 C CG2  . ILE A 1 74  ? -5.32000  -32.31700 1.61200   1.000 75.63012  ? 72  ILE A CG2  1 
ATOM   1151 C CD1  . ILE A 1 74  ? -6.10200  -29.59800 2.41100   1.000 83.54686  ? 72  ILE A CD1  1 
ATOM   1152 H H    . ILE A 1 74  ? -1.99400  -30.19100 1.14100   1.000 92.46000  ? 72  ILE A H    1 
ATOM   1153 H HA   . ILE A 1 74  ? -2.92700  -32.04400 2.86900   1.000 89.16000  ? 72  ILE A HA   1 
ATOM   1154 H HB   . ILE A 1 74  ? -4.22900  -30.87300 0.64700   1.000 92.33000  ? 72  ILE A HB   1 
ATOM   1155 H HG12 . ILE A 1 74  ? -4.44900  -30.27100 3.38900   1.000 94.83000  ? 72  ILE A HG12 1 
ATOM   1156 H HG13 . ILE A 1 74  ? -4.10500  -29.25700 2.22100   1.000 94.83000  ? 72  ILE A HG13 1 
ATOM   1157 H HG21 . ILE A 1 74  ? -6.18300  -31.96400 1.34600   1.000 91.82000  ? 72  ILE A HG21 1 
ATOM   1158 H HG22 . ILE A 1 74  ? -5.06400  -33.02600 1.00300   1.000 91.82000  ? 72  ILE A HG22 1 
ATOM   1159 H HG23 . ILE A 1 74  ? -5.36800  -32.66000 2.51800   1.000 91.82000  ? 72  ILE A HG23 1 
ATOM   1160 H HD11 . ILE A 1 74  ? -6.20000  -28.74300 2.85800   1.000 101.32000 ? 72  ILE A HD11 1 
ATOM   1161 H HD12 . ILE A 1 74  ? -6.36800  -29.51800 1.48200   1.000 101.32000 ? 72  ILE A HD12 1 
ATOM   1162 H HD13 . ILE A 1 74  ? -6.64600  -30.26700 2.85400   1.000 101.32000 ? 72  ILE A HD13 1 
ATOM   1163 N N    . LEU A 1 75  ? -2.50800  -34.11500 1.65200   1.000 67.82392  ? 73  LEU A N    1 
ATOM   1164 C CA   . LEU A 1 75  ? -2.21600  -35.35400 0.94400   1.000 75.32745  ? 73  LEU A CA   1 
ATOM   1165 C C    . LEU A 1 75  ? -3.45400  -36.23500 0.98700   1.000 71.38487  ? 73  LEU A C    1 
ATOM   1166 O O    . LEU A 1 75  ? -3.98600  -36.51300 2.06800   1.000 69.55834  ? 73  LEU A O    1 
ATOM   1167 C CB   . LEU A 1 75  ? -1.01900  -36.07500 1.56900   1.000 73.29037  ? 73  LEU A CB   1 
ATOM   1168 C CG   . LEU A 1 75  ? -0.70600  -37.48600 1.06600   1.000 60.17564  ? 73  LEU A CG   1 
ATOM   1169 C CD1  . LEU A 1 75  ? -0.18800  -37.45900 -0.35900  1.000 68.81878  ? 73  LEU A CD1  1 
ATOM   1170 C CD2  . LEU A 1 75  ? 0.29700   -38.15700 1.98900   1.000 67.38176  ? 73  LEU A CD2  1 
ATOM   1171 H H    . LEU A 1 75  ? -2.69300  -34.23600 2.48300   1.000 82.44000  ? 73  LEU A H    1 
ATOM   1172 H HA   . LEU A 1 75  ? -2.00900  -35.16000 0.01700   1.000 91.45000  ? 73  LEU A HA   1 
ATOM   1173 H HB2  . LEU A 1 75  ? -0.22800  -35.53500 1.41200   1.000 89.00000  ? 73  LEU A HB2  1 
ATOM   1174 H HB3  . LEU A 1 75  ? -1.17400  -36.14200 2.52400   1.000 89.00000  ? 73  LEU A HB3  1 
ATOM   1175 H HG   . LEU A 1 75  ? -1.51600  -38.01800 1.07800   1.000 73.27000  ? 73  LEU A HG   1 
ATOM   1176 H HD11 . LEU A 1 75  ? -0.00000  -38.36700 -0.64300  1.000 83.64000  ? 73  LEU A HD11 1 
ATOM   1177 H HD12 . LEU A 1 75  ? -0.86400  -37.06600 -0.93300  1.000 83.64000  ? 73  LEU A HD12 1 
ATOM   1178 H HD13 . LEU A 1 75  ? 0.62300   -36.92700 -0.39000  1.000 83.64000  ? 73  LEU A HD13 1 
ATOM   1179 H HD21 . LEU A 1 75  ? 0.48900   -39.04600 1.65300   1.000 81.91000  ? 73  LEU A HD21 1 
ATOM   1180 H HD22 . LEU A 1 75  ? 1.11000   -37.62800 2.00900   1.000 81.91000  ? 73  LEU A HD22 1 
ATOM   1181 H HD23 . LEU A 1 75  ? -0.08300  -38.21400 2.88000   1.000 81.91000  ? 73  LEU A HD23 1 
ATOM   1182 N N    . GLU A 1 76  ? -3.91400  -36.66800 -0.18500  1.000 78.05936  ? 74  GLU A N    1 
ATOM   1183 C CA   . GLU A 1 76  ? -5.13300  -37.45400 -0.28600  1.000 77.46981  ? 74  GLU A CA   1 
ATOM   1184 C C    . GLU A 1 76  ? -4.93900  -38.56400 -1.30600  1.000 74.95109  ? 74  GLU A C    1 
ATOM   1185 O O    . GLU A 1 76  ? -4.03300  -38.52200 -2.14200  1.000 75.33008  ? 74  GLU A O    1 
ATOM   1186 C CB   . GLU A 1 76  ? -6.33300  -36.58200 -0.67400  1.000 67.12384  ? 74  GLU A CB   1 
ATOM   1187 C CG   . GLU A 1 76  ? -6.72600  -35.58900 0.40200   1.000 71.84546  ? 74  GLU A CG   1 
ATOM   1188 C CD   . GLU A 1 76  ? -7.81300  -34.63400 -0.04600  1.000 71.89283  ? 74  GLU A CD   1 
ATOM   1189 O OE1  . GLU A 1 76  ? -8.10400  -34.58400 -1.25900  1.000 70.22158  ? 74  GLU A OE1  1 
ATOM   1190 O OE2  . GLU A 1 76  ? -8.37700  -33.93200 0.81800   1.000 75.52484  ? 74  GLU A OE2  1 
ATOM   1191 H H    . GLU A 1 76  ? -3.53200  -36.51700 -0.94100  1.000 94.73000  ? 74  GLU A H    1 
ATOM   1192 H HA   . GLU A 1 76  ? -5.32300  -37.86400 0.57200   1.000 94.02000  ? 74  GLU A HA   1 
ATOM   1193 H HB2  . GLU A 1 76  ? -6.11100  -36.08200 -1.47500  1.000 81.61000  ? 74  GLU A HB2  1 
ATOM   1194 H HB3  . GLU A 1 76  ? -7.09700  -37.15600 -0.84400  1.000 81.61000  ? 74  GLU A HB3  1 
ATOM   1195 H HG2  . GLU A 1 76  ? -7.05400  -36.07500 1.17500   1.000 87.27000  ? 74  GLU A HG2  1 
ATOM   1196 H HG3  . GLU A 1 76  ? -5.94800  -35.06500 0.64600   1.000 87.27000  ? 74  GLU A HG3  1 
ATOM   1197 N N    . GLU A 1 77  ? -5.81500  -39.56300 -1.22500  1.000 62.27062  ? 75  GLU A N    1 
ATOM   1198 C CA   . GLU A 1 77  ? -5.75400  -40.73900 -2.09000  1.000 75.64328  ? 75  GLU A CA   1 
ATOM   1199 C C    . GLU A 1 77  ? -6.44000  -40.40200 -3.40900  1.000 77.41718  ? 75  GLU A C    1 
ATOM   1200 O O    . GLU A 1 77  ? -7.65100  -40.56100 -3.56700  1.000 74.15363  ? 75  GLU A O    1 
ATOM   1201 C CB   . GLU A 1 77  ? -6.40200  -41.93500 -1.40100  1.000 89.15016  ? 75  GLU A CB   1 
ATOM   1202 C CG   . GLU A 1 77  ? -6.56000  -43.17000 -2.28000  1.000 88.25269  ? 75  GLU A CG   1 
ATOM   1203 C CD   . GLU A 1 77  ? -7.06600  -44.37800 -1.50900  1.000 94.94559  ? 75  GLU A CD   1 
ATOM   1204 O OE1  . GLU A 1 77  ? -7.75600  -44.18400 -0.48600  1.000 134.36874 ? 75  GLU A OE1  1 
ATOM   1205 O OE2  . GLU A 1 77  ? -6.77500  -45.52100 -1.92500  1.000 100.97263 ? 75  GLU A OE2  1 
ATOM   1206 H H    . GLU A 1 77  ? -6.46700  -39.58300 -0.66500  1.000 75.78000  ? 75  GLU A H    1 
ATOM   1207 H HA   . GLU A 1 77  ? -4.82700  -40.95700 -2.27400  1.000 91.83000  ? 75  GLU A HA   1 
ATOM   1208 H HB2  . GLU A 1 77  ? -5.85700  -42.18500 -0.63900  1.000 108.04000 ? 75  GLU A HB2  1 
ATOM   1209 H HB3  . GLU A 1 77  ? -7.28600  -41.67600 -1.09800  1.000 108.04000 ? 75  GLU A HB3  1 
ATOM   1210 H HG2  . GLU A 1 77  ? -7.19800  -42.97900 -2.98500  1.000 106.96000 ? 75  GLU A HG2  1 
ATOM   1211 H HG3  . GLU A 1 77  ? -5.69900  -43.39800 -2.66300  1.000 106.96000 ? 75  GLU A HG3  1 
ATOM   1212 N N    . GLY A 1 78  ? -5.65300  -39.92700 -4.36900  1.000 69.71099  ? 76  GLY A N    1 
ATOM   1213 C CA   . GLY A 1 78  ? -6.17500  -39.61000 -5.68400  1.000 76.90133  ? 76  GLY A CA   1 
ATOM   1214 C C    . GLY A 1 78  ? -7.03000  -38.35400 -5.67500  1.000 70.40055  ? 76  GLY A C    1 
ATOM   1215 O O    . GLY A 1 78  ? -7.18300  -37.66300 -4.66800  1.000 74.50367  ? 76  GLY A O    1 
ATOM   1216 H H    . GLY A 1 78  ? -4.81000  -39.78000 -4.28000  1.000 84.71000  ? 76  GLY A H    1 
ATOM   1217 H HA2  . GLY A 1 78  ? -5.44100  -39.48200 -6.30500  1.000 93.34000  ? 76  GLY A HA2  1 
ATOM   1218 H HA3  . GLY A 1 78  ? -6.71900  -40.34800 -6.00100  1.000 93.34000  ? 76  GLY A HA3  1 
ATOM   1219 N N    . ALA A 1 79  ? -7.59900  -38.06400 -6.84100  1.000 70.25579  ? 77  ALA A N    1 
ATOM   1220 C CA   . ALA A 1 79  ? -8.47500  -36.92300 -7.03700  1.000 69.58203  ? 77  ALA A CA   1 
ATOM   1221 C C    . ALA A 1 79  ? -9.79700  -37.38400 -7.64000  1.000 68.88457  ? 77  ALA A C    1 
ATOM   1222 O O    . ALA A 1 79  ? -9.84600  -38.42300 -8.30300  1.000 62.89965  ? 77  ALA A O    1 
ATOM   1223 C CB   . ALA A 1 79  ? -7.83300  -35.88000 -7.96200  1.000 79.51216  ? 77  ALA A CB   1 
ATOM   1224 H H    . ALA A 1 79  ? -7.48600  -38.53200 -7.55400  1.000 85.37000  ? 77  ALA A H    1 
ATOM   1225 H HA   . ALA A 1 79  ? -8.64400  -36.50700 -6.17900  1.000 84.56000  ? 77  ALA A HA   1 
ATOM   1226 H HB1  . ALA A 1 79  ? -8.45000  -35.14000 -8.07800  1.000 96.47000  ? 77  ALA A HB1  1 
ATOM   1227 H HB2  . ALA A 1 79  ? -7.00900  -35.56400 -7.56100  1.000 96.47000  ? 77  ALA A HB2  1 
ATOM   1228 H HB3  . ALA A 1 79  ? -7.64600  -36.29200 -8.82000  1.000 96.47000  ? 77  ALA A HB3  1 
ATOM   1229 N N    . PRO A 1 80  ? -10.87600 -36.63700 -7.40800  1.000 68.25818  ? 78  PRO A N    1 
ATOM   1230 C CA   . PRO A 1 80  ? -12.15700 -36.98700 -8.03900  1.000 69.49781  ? 78  PRO A CA   1 
ATOM   1231 C C    . PRO A 1 80  ? -11.99500 -37.24400 -9.53000  1.000 66.52903  ? 78  PRO A C    1 
ATOM   1232 O O    . PRO A 1 80  ? -11.25000 -36.54800 -10.22400 1.000 62.70225  ? 78  PRO A O    1 
ATOM   1233 C CB   . PRO A 1 80  ? -13.03100 -35.75500 -7.77400  1.000 74.82476  ? 78  PRO A CB   1 
ATOM   1234 C CG   . PRO A 1 80  ? -12.37900 -35.01200 -6.64400  1.000 76.06965  ? 78  PRO A CG   1 
ATOM   1235 C CD   . PRO A 1 80  ? -11.03300 -35.61400 -6.36200  1.000 70.04787  ? 78  PRO A CD   1 
ATOM   1236 H HA   . PRO A 1 80  ? -12.54900 -37.76500 -7.61200  1.000 84.46000  ? 78  PRO A HA   1 
ATOM   1237 H HB2  . PRO A 1 80  ? -13.06500 -35.20300 -8.57100  1.000 90.85000  ? 78  PRO A HB2  1 
ATOM   1238 H HB3  . PRO A 1 80  ? -13.92100 -36.04100 -7.51800  1.000 90.85000  ? 78  PRO A HB3  1 
ATOM   1239 H HG2  . PRO A 1 80  ? -12.27800 -34.08100 -6.89700  1.000 92.34000  ? 78  PRO A HG2  1 
ATOM   1240 H HG3  . PRO A 1 80  ? -12.94200 -35.08000 -5.85700  1.000 92.34000  ? 78  PRO A HG3  1 
ATOM   1241 H HD2  . PRO A 1 80  ? -10.34000 -34.94000 -6.44300  1.000 85.11000  ? 78  PRO A HD2  1 
ATOM   1242 H HD3  . PRO A 1 80  ? -11.02600 -36.02600 -5.48400  1.000 85.11000  ? 78  PRO A HD3  1 
ATOM   1243 N N    . GLU A 1 81  ? -12.70900 -38.25300 -10.02300 1.000 72.40342  ? 79  GLU A N    1 
ATOM   1244 C CA   . GLU A 1 81  ? -12.62700 -38.60800 -11.43400 1.000 75.21428  ? 79  GLU A CA   1 
ATOM   1245 C C    . GLU A 1 81  ? -12.96400 -37.40500 -12.30700 1.000 70.47161  ? 79  GLU A C    1 
ATOM   1246 O O    . GLU A 1 81  ? -14.01800 -36.78100 -12.14900 1.000 77.24610  ? 79  GLU A O    1 
ATOM   1247 C CB   . GLU A 1 81  ? -13.57400 -39.76700 -11.74500 1.000 77.50140  ? 79  GLU A CB   1 
ATOM   1248 C CG   . GLU A 1 81  ? -13.14900 -41.11000 -11.16300 1.000 71.56121  ? 79  GLU A CG   1 
ATOM   1249 C CD   . GLU A 1 81  ? -13.54600 -41.28300 -9.70800  1.000 75.27745  ? 79  GLU A CD   1 
ATOM   1250 O OE1  . GLU A 1 81  ? -13.90100 -40.27900 -9.05700  1.000 78.20411  ? 79  GLU A OE1  1 
ATOM   1251 O OE2  . GLU A 1 81  ? -13.50700 -42.43000 -9.21500  1.000 79.88589  ? 79  GLU A OE2  1 
ATOM   1252 H H    . GLU A 1 81  ? -13.24600 -38.74200 -9.56300  1.000 87.94000  ? 79  GLU A H    1 
ATOM   1253 H HA   . GLU A 1 81  ? -11.72200 -38.89000 -11.64100 1.000 91.31000  ? 79  GLU A HA   1 
ATOM   1254 H HB2  . GLU A 1 81  ? -14.45000 -39.55600 -11.38700 1.000 94.06000  ? 79  GLU A HB2  1 
ATOM   1255 H HB3  . GLU A 1 81  ? -13.63100 -39.87000 -12.70800 1.000 94.06000  ? 79  GLU A HB3  1 
ATOM   1256 H HG2  . GLU A 1 81  ? -13.56800 -41.82100 -11.67300 1.000 86.93000  ? 79  GLU A HG2  1 
ATOM   1257 H HG3  . GLU A 1 81  ? -12.18400 -41.18700 -11.22000 1.000 86.93000  ? 79  GLU A HG3  1 
ATOM   1258 N N    . GLY A 1 82  ? -12.06500 -37.08600 -13.23700 1.000 77.27769  ? 80  GLY A N    1 
ATOM   1259 C CA   . GLY A 1 82  ? -12.20500 -35.94200 -14.10600 1.000 69.89259  ? 80  GLY A CA   1 
ATOM   1260 C C    . GLY A 1 82  ? -11.35000 -34.75500 -13.71700 1.000 74.51157  ? 80  GLY A C    1 
ATOM   1261 O O    . GLY A 1 82  ? -11.14900 -33.85500 -14.54200 1.000 67.21859  ? 80  GLY A O    1 
ATOM   1262 H H    . GLY A 1 82  ? -11.34700 -37.53700 -13.38000 1.000 93.79000  ? 80  GLY A H    1 
ATOM   1263 H HA2  . GLY A 1 82  ? -11.96500 -36.20100 -15.01000 1.000 84.93000  ? 80  GLY A HA2  1 
ATOM   1264 H HA3  . GLY A 1 82  ? -13.13200 -35.65600 -14.11100 1.000 84.93000  ? 80  GLY A HA3  1 
ATOM   1265 N N    . THR A 1 83  ? -10.84500 -34.73000 -12.48600 1.000 74.19311  ? 81  THR A N    1 
ATOM   1266 C CA   . THR A 1 83  ? -9.99000  -33.63800 -12.04400 1.000 66.48692  ? 81  THR A CA   1 
ATOM   1267 C C    . THR A 1 83  ? -8.77800  -33.51100 -12.95700 1.000 69.47938  ? 81  THR A C    1 
ATOM   1268 O O    . THR A 1 83  ? -8.10500  -34.50100 -13.25900 1.000 67.32123  ? 81  THR A O    1 
ATOM   1269 C CB   . THR A 1 83  ? -9.53800  -33.87600 -10.60200 1.000 70.01103  ? 81  THR A CB   1 
ATOM   1270 O OG1  . THR A 1 83  ? -10.68200 -33.92100 -9.73900  1.000 69.45570  ? 81  THR A OG1  1 
ATOM   1271 C CG2  . THR A 1 83  ? -8.59600  -32.77200 -10.14400 1.000 72.10338  ? 81  THR A CG2  1 
ATOM   1272 H H    . THR A 1 83  ? -10.98300 -35.33300 -11.88900 1.000 90.09000  ? 81  THR A H    1 
ATOM   1273 H HA   . THR A 1 83  ? -10.48700 -32.80600 -12.07600 1.000 80.84000  ? 81  THR A HA   1 
ATOM   1274 H HB   . THR A 1 83  ? -9.06400  -34.72100 -10.55000 1.000 85.07000  ? 81  THR A HB   1 
ATOM   1275 H HG1  . THR A 1 83  ? -11.19300 -34.54600 -9.97200  1.000 84.40000  ? 81  THR A HG1  1 
ATOM   1276 H HG21 . THR A 1 83  ? -8.50300  -32.79800 -9.17900  1.000 87.58000  ? 81  THR A HG21 1 
ATOM   1277 H HG22 . THR A 1 83  ? -7.72100  -32.89000 -10.54700 1.000 87.58000  ? 81  THR A HG22 1 
ATOM   1278 H HG23 . THR A 1 83  ? -8.95000  -31.90600 -10.40100 1.000 87.58000  ? 81  THR A HG23 1 
ATOM   1279 N N    . VAL A 1 84  ? -8.50400  -32.28800 -13.40100 1.000 68.75561  ? 82  VAL A N    1 
ATOM   1280 C CA   . VAL A 1 84  ? -7.33000  -32.00000 -14.21700 1.000 72.75083  ? 82  VAL A CA   1 
ATOM   1281 C C    . VAL A 1 84  ? -6.20500  -31.63900 -13.25300 1.000 74.49841  ? 82  VAL A C    1 
ATOM   1282 O O    . VAL A 1 84  ? -6.15600  -30.52800 -12.72200 1.000 71.80335  ? 82  VAL A O    1 
ATOM   1283 C CB   . VAL A 1 84  ? -7.59500  -30.88300 -15.22800 1.000 72.44816  ? 82  VAL A CB   1 
ATOM   1284 C CG1  . VAL A 1 84  ? -6.34700  -30.62200 -16.06300 1.000 78.69891  ? 82  VAL A CG1  1 
ATOM   1285 C CG2  . VAL A 1 84  ? -8.77700  -31.23700 -16.12200 1.000 63.55499  ? 82  VAL A CG2  1 
ATOM   1286 H H    . VAL A 1 84  ? -8.99100  -31.59800 -13.24000 1.000 83.56000  ? 82  VAL A H    1 
ATOM   1287 H HA   . VAL A 1 84  ? -7.07100  -32.79700 -14.70400 1.000 88.36000  ? 82  VAL A HA   1 
ATOM   1288 H HB   . VAL A 1 84  ? -7.81300  -30.06800 -14.75000 1.000 88.00000  ? 82  VAL A HB   1 
ATOM   1289 H HG11 . VAL A 1 84  ? -6.57700  -30.02700 -16.79400 1.000 95.50000  ? 82  VAL A HG11 1 
ATOM   1290 H HG12 . VAL A 1 84  ? -5.67000  -30.21100 -15.50300 1.000 95.50000  ? 82  VAL A HG12 1 
ATOM   1291 H HG13 . VAL A 1 84  ? -6.02100  -31.46500 -16.41400 1.000 95.50000  ? 82  VAL A HG13 1 
ATOM   1292 H HG21 . VAL A 1 84  ? -8.88800  -30.54100 -16.78800 1.000 77.24000  ? 82  VAL A HG21 1 
ATOM   1293 H HG22 . VAL A 1 84  ? -8.60000  -32.08600 -16.55700 1.000 77.24000  ? 82  VAL A HG22 1 
ATOM   1294 H HG23 . VAL A 1 84  ? -9.57700  -31.30500 -15.57700 1.000 77.24000  ? 82  VAL A HG23 1 
ATOM   1295 N N    . ALA A 1 85  ? -5.30700  -32.58700 -13.01600 1.000 70.53214  ? 83  ALA A N    1 
ATOM   1296 C CA   . ALA A 1 85  ? -4.15900  -32.38100 -12.14800 1.000 64.46562  ? 83  ALA A CA   1 
ATOM   1297 C C    . ALA A 1 85  ? -2.93100  -32.02900 -12.97700 1.000 66.66326  ? 83  ALA A C    1 
ATOM   1298 O O    . ALA A 1 85  ? -2.93400  -32.09700 -14.20900 1.000 63.30759  ? 83  ALA A O    1 
ATOM   1299 C CB   . ALA A 1 85  ? -3.89000  -33.62700 -11.30000 1.000 73.57987  ? 83  ALA A CB   1 
ATOM   1300 H H    . ALA A 1 85  ? -5.34300  -33.37600 -13.35500 1.000 85.69000  ? 83  ALA A H    1 
ATOM   1301 H HA   . ALA A 1 85  ? -4.34000  -31.64100 -11.54700 1.000 78.42000  ? 83  ALA A HA   1 
ATOM   1302 H HB1  . ALA A 1 85  ? -3.12200  -33.46100 -10.73100 1.000 89.35000  ? 83  ALA A HB1  1 
ATOM   1303 H HB2  . ALA A 1 85  ? -4.67100  -33.81300 -10.75600 1.000 89.35000  ? 83  ALA A HB2  1 
ATOM   1304 H HB3  . ALA A 1 85  ? -3.71000  -34.37600 -11.88900 1.000 89.35000  ? 83  ALA A HB3  1 
ATOM   1305 N N    . THR A 1 86  ? -1.86500  -31.65300 -12.27800 1.000 61.91269  ? 84  THR A N    1 
ATOM   1306 C CA   . THR A 1 86  ? -0.60300  -31.28200 -12.90100 1.000 67.61074  ? 84  THR A CA   1 
ATOM   1307 C C    . THR A 1 86  ? 0.49100   -32.18200 -12.34500 1.000 62.97071  ? 84  THR A C    1 
ATOM   1308 O O    . THR A 1 86  ? 0.63500   -32.31000 -11.12500 1.000 62.41275  ? 84  THR A O    1 
ATOM   1309 C CB   . THR A 1 86  ? -0.27700  -29.80500 -12.65200 1.000 70.61110  ? 84  THR A CB   1 
ATOM   1310 O OG1  . THR A 1 86  ? -1.33600  -28.98900 -13.17000 1.000 73.84833  ? 84  THR A OG1  1 
ATOM   1311 C CG2  . THR A 1 86  ? 1.02300   -29.41000 -13.33600 1.000 67.78971  ? 84  THR A CG2  1 
ATOM   1312 H H    . THR A 1 86  ? -1.85000  -31.60400 -11.42000 1.000 75.35000  ? 84  THR A H    1 
ATOM   1313 H HA   . THR A 1 86  ? -0.66000  -31.42400 -13.85800 1.000 82.19000  ? 84  THR A HA   1 
ATOM   1314 H HB   . THR A 1 86  ? -0.18400  -29.64900 -11.69900 1.000 85.79000  ? 84  THR A HB   1 
ATOM   1315 H HG1  . THR A 1 86  ? -1.16500  -28.17700 -13.03700 1.000 89.68000  ? 84  THR A HG1  1 
ATOM   1316 H HG21 . THR A 1 86  ? 0.86200   -29.25200 -14.27900 1.000 82.41000  ? 84  THR A HG21 1 
ATOM   1317 H HG22 . THR A 1 86  ? 1.36800   -28.59600 -12.93800 1.000 82.41000  ? 84  THR A HG22 1 
ATOM   1318 H HG23 . THR A 1 86  ? 1.69000   -30.10600 -13.24700 1.000 82.41000  ? 84  THR A HG23 1 
ATOM   1319 N N    . LEU A 1 87  ? 1.24100   -32.81700 -13.24300 1.000 65.89474  ? 85  LEU A N    1 
ATOM   1320 C CA   . LEU A 1 87  ? 2.34700   -33.69200 -12.87000 1.000 69.97155  ? 85  LEU A CA   1 
ATOM   1321 C C    . LEU A 1 87  ? 3.62800   -32.87000 -12.90700 1.000 66.93171  ? 85  LEU A C    1 
ATOM   1322 O O    . LEU A 1 87  ? 4.12100   -32.52300 -13.98500 1.000 71.30329  ? 85  LEU A O    1 
ATOM   1323 C CB   . LEU A 1 87  ? 2.43100   -34.89200 -13.80900 1.000 72.69819  ? 85  LEU A CB   1 
ATOM   1324 C CG   . LEU A 1 87  ? 3.63700   -35.81600 -13.61800 1.000 74.14573  ? 85  LEU A CG   1 
ATOM   1325 C CD1  . LEU A 1 87  ? 3.74900   -36.27300 -12.17300 1.000 73.76148  ? 85  LEU A CD1  1 
ATOM   1326 C CD2  . LEU A 1 87  ? 3.53800   -37.00800 -14.55800 1.000 63.82871  ? 85  LEU A CD2  1 
ATOM   1327 H H    . LEU A 1 87  ? 1.12500   -32.75500 -14.09300 1.000 80.13000  ? 85  LEU A H    1 
ATOM   1328 H HA   . LEU A 1 87  ? 2.21400   -34.01600 -11.96500 1.000 85.02000  ? 85  LEU A HA   1 
ATOM   1329 H HB2  . LEU A 1 87  ? 1.63300   -35.43000 -13.68700 1.000 88.30000  ? 85  LEU A HB2  1 
ATOM   1330 H HB3  . LEU A 1 87  ? 2.46100   -34.56300 -14.72100 1.000 88.30000  ? 85  LEU A HB3  1 
ATOM   1331 H HG   . LEU A 1 87  ? 4.44500   -35.32800 -13.84100 1.000 90.03000  ? 85  LEU A HG   1 
ATOM   1332 H HD11 . LEU A 1 87  ? 4.35700   -37.02700 -12.12700 1.000 89.57000  ? 85  LEU A HD11 1 
ATOM   1333 H HD12 . LEU A 1 87  ? 4.08900   -35.54000 -11.63600 1.000 89.57000  ? 85  LEU A HD12 1 
ATOM   1334 H HD13 . LEU A 1 87  ? 2.87100   -36.53500 -11.85700 1.000 89.57000  ? 85  LEU A HD13 1 
ATOM   1335 H HD21 . LEU A 1 87  ? 4.29300   -37.59700 -14.40200 1.000 77.65000  ? 85  LEU A HD21 1 
ATOM   1336 H HD22 . LEU A 1 87  ? 2.70900   -37.47900 -14.38300 1.000 77.65000  ? 85  LEU A HD22 1 
ATOM   1337 H HD23 . LEU A 1 87  ? 3.55000   -36.68900 -15.47400 1.000 77.65000  ? 85  LEU A HD23 1 
ATOM   1338 N N    . LEU A 1 88  ? 4.15900   -32.55200 -11.72900 1.000 67.34755  ? 86  LEU A N    1 
ATOM   1339 C CA   . LEU A 1 88  ? 5.35100   -31.71500 -11.61100 1.000 75.14585  ? 86  LEU A CA   1 
ATOM   1340 C C    . LEU A 1 88  ? 6.57700   -32.61100 -11.73200 1.000 69.07407  ? 86  LEU A C    1 
ATOM   1341 O O    . LEU A 1 88  ? 7.10700   -33.11200 -10.74000 1.000 64.68934  ? 86  LEU A O    1 
ATOM   1342 C CB   . LEU A 1 88  ? 5.35500   -30.95700 -10.29000 1.000 67.11857  ? 86  LEU A CB   1 
ATOM   1343 C CG   . LEU A 1 88  ? 4.04700   -30.34000 -9.78900  1.000 71.36645  ? 86  LEU A CG   1 
ATOM   1344 C CD1  . LEU A 1 88  ? 4.35900   -29.32600 -8.69900  1.000 72.22182  ? 86  LEU A CD1  1 
ATOM   1345 C CD2  . LEU A 1 88  ? 3.24300   -29.70500 -10.90800 1.000 71.96126  ? 86  LEU A CD2  1 
ATOM   1346 H H    . LEU A 1 88  ? 3.84300   -32.81200 -10.97300 1.000 81.88000  ? 86  LEU A H    1 
ATOM   1347 H HA   . LEU A 1 88  ? 5.36800   -31.07000 -12.33600 1.000 91.23000  ? 86  LEU A HA   1 
ATOM   1348 H HB2  . LEU A 1 88  ? 5.63800   -31.57700 -9.60400  1.000 81.60000  ? 86  LEU A HB2  1 
ATOM   1349 H HB3  . LEU A 1 88  ? 6.00200   -30.23800 -10.35600 1.000 81.60000  ? 86  LEU A HB3  1 
ATOM   1350 H HG   . LEU A 1 88  ? 3.50300   -31.04000 -9.39500  1.000 86.70000  ? 86  LEU A HG   1 
ATOM   1351 H HD11 . LEU A 1 88  ? 3.52800   -28.94900 -8.37100  1.000 87.72000  ? 86  LEU A HD11 1 
ATOM   1352 H HD12 . LEU A 1 88  ? 4.82700   -29.77400 -7.97700  1.000 87.72000  ? 86  LEU A HD12 1 
ATOM   1353 H HD13 . LEU A 1 88  ? 4.91700   -28.62500 -9.07100  1.000 87.72000  ? 86  LEU A HD13 1 
ATOM   1354 H HD21 . LEU A 1 88  ? 2.58600   -29.10400 -10.52400 1.000 87.41000  ? 86  LEU A HD21 1 
ATOM   1355 H HD22 . LEU A 1 88  ? 3.84400   -29.21300 -11.48900 1.000 87.41000  ? 86  LEU A HD22 1 
ATOM   1356 H HD23 . LEU A 1 88  ? 2.79900   -30.40600 -11.40800 1.000 87.41000  ? 86  LEU A HD23 1 
ATOM   1357 N N    . ILE A 1 89  ? 7.04600   -32.81200 -12.95900 1.000 71.23486  ? 87  ILE A N    1 
ATOM   1358 C CA   . ILE A 1 89  ? 8.21200   -33.64900 -13.21200 1.000 72.86926  ? 87  ILE A CA   1 
ATOM   1359 C C    . ILE A 1 89  ? 9.41000   -32.74500 -13.45700 1.000 66.70010  ? 87  ILE A C    1 
ATOM   1360 O O    . ILE A 1 89  ? 9.38600   -31.89300 -14.35300 1.000 66.24215  ? 87  ILE A O    1 
ATOM   1361 C CB   . ILE A 1 89  ? 7.99300   -34.61000 -14.39400 1.000 77.23294  ? 87  ILE A CB   1 
ATOM   1362 C CG1  . ILE A 1 89  ? 7.13000   -33.96800 -15.48100 1.000 77.22768  ? 87  ILE A CG1  1 
ATOM   1363 C CG2  . ILE A 1 89  ? 7.39600   -35.93000 -13.90300 1.000 70.57162  ? 87  ILE A CG2  1 
ATOM   1364 C CD1  . ILE A 1 89  ? 6.95400   -34.83600 -16.71000 1.000 86.56301  ? 87  ILE A CD1  1 
ATOM   1365 H H    . ILE A 1 89  ? 6.70700   -32.45400 -13.66200 1.000 86.54000  ? 87  ILE A H    1 
ATOM   1366 H HA   . ILE A 1 89  ? 8.39400   -34.17800 -12.42500 1.000 88.50000  ? 87  ILE A HA   1 
ATOM   1367 H HB   . ILE A 1 89  ? 8.86100   -34.80400 -14.78200 1.000 93.74000  ? 87  ILE A HB   1 
ATOM   1368 H HG12 . ILE A 1 89  ? 6.24700   -33.78200 -15.12600 1.000 93.73000  ? 87  ILE A HG12 1 
ATOM   1369 H HG13 . ILE A 1 89  ? 7.56100   -33.14800 -15.76100 1.000 93.73000  ? 87  ILE A HG13 1 
ATOM   1370 H HG21 . ILE A 1 89  ? 7.14500   -36.47500 -14.66400 1.000 85.74000  ? 87  ILE A HG21 1 
ATOM   1371 H HG22 . ILE A 1 89  ? 8.06000   -36.39700 -13.37400 1.000 85.74000  ? 87  ILE A HG22 1 
ATOM   1372 H HG23 . ILE A 1 89  ? 6.61500   -35.74000 -13.36100 1.000 85.74000  ? 87  ILE A HG23 1 
ATOM   1373 H HD11 . ILE A 1 89  ? 6.73200   -34.26600 -17.46100 1.000 104.94000 ? 87  ILE A HD11 1 
ATOM   1374 H HD12 . ILE A 1 89  ? 7.78700   -35.30200 -16.88600 1.000 104.94000 ? 87  ILE A HD12 1 
ATOM   1375 H HD13 . ILE A 1 89  ? 6.24700   -35.47800 -16.54600 1.000 104.94000 ? 87  ILE A HD13 1 
ATOM   1376 N N    . LYS A 1 90  ? 10.44700  -32.92600 -12.64900 1.000 63.18126  ? 88  LYS A N    1 
ATOM   1377 C CA   . LYS A 1 90  ? 11.72200  -32.26000 -12.84500 1.000 70.16368  ? 88  LYS A CA   1 
ATOM   1378 C C    . LYS A 1 90  ? 12.63800  -33.14700 -13.67600 1.000 68.49242  ? 88  LYS A C    1 
ATOM   1379 O O    . LYS A 1 90  ? 12.56000  -34.37700 -13.62400 1.000 69.14513  ? 88  LYS A O    1 
ATOM   1380 C CB   . LYS A 1 90  ? 12.37800  -31.94600 -11.50000 1.000 70.72690  ? 88  LYS A CB   1 
ATOM   1381 C CG   . LYS A 1 90  ? 12.23300  -30.50500 -11.04600 1.000 69.19251  ? 88  LYS A CG   1 
ATOM   1382 C CD   . LYS A 1 90  ? 12.68700  -30.34600 -9.60200  1.000 73.82727  ? 88  LYS A CD   1 
ATOM   1383 C CE   . LYS A 1 90  ? 12.50500  -28.91800 -9.10500  1.000 79.76219  ? 88  LYS A CE   1 
ATOM   1384 N NZ   . LYS A 1 90  ? 12.54100  -28.83800 -7.61600  1.000 72.62450  ? 88  LYS A NZ   1 
ATOM   1385 H H    . LYS A 1 90  ? 10.43300  -33.44500 -11.96300 1.000 76.88000  ? 88  LYS A H    1 
ATOM   1386 H HA   . LYS A 1 90  ? 11.58400  -31.42700 -13.32200 1.000 85.26000  ? 88  LYS A HA   1 
ATOM   1387 H HB2  . LYS A 1 90  ? 11.98000  -32.51100 -10.81900 1.000 85.93000  ? 88  LYS A HB2  1 
ATOM   1388 H HB3  . LYS A 1 90  ? 13.32600  -32.13600 -11.56900 1.000 85.93000  ? 88  LYS A HB3  1 
ATOM   1389 H HG2  . LYS A 1 90  ? 12.78900  -29.93900 -11.60300 1.000 84.09000  ? 88  LYS A HG2  1 
ATOM   1390 H HG3  . LYS A 1 90  ? 11.30300  -30.23700 -11.10800 1.000 84.09000  ? 88  LYS A HG3  1 
ATOM   1391 H HD2  . LYS A 1 90  ? 12.16200  -30.93300 -9.03600  1.000 89.65000  ? 88  LYS A HD2  1 
ATOM   1392 H HD3  . LYS A 1 90  ? 13.62800  -30.57200 -9.53700  1.000 89.65000  ? 88  LYS A HD3  1 
ATOM   1393 H HE2  . LYS A 1 90  ? 13.22100  -28.36500 -9.45500  1.000 96.77000  ? 88  LYS A HE2  1 
ATOM   1394 H HE3  . LYS A 1 90  ? 11.64600  -28.58300 -9.40500  1.000 96.77000  ? 88  LYS A HE3  1 
ATOM   1395 H HZ1  . LYS A 1 90  ? 13.31000  -29.16800 -7.31200  1.000 88.21000  ? 88  LYS A HZ1  1 
ATOM   1396 H HZ2  . LYS A 1 90  ? 11.86800  -29.30600 -7.27000  1.000 88.21000  ? 88  LYS A HZ2  1 
ATOM   1397 H HZ3  . LYS A 1 90  ? 12.46700  -27.99000 -7.35600  1.000 88.21000  ? 88  LYS A HZ3  1 
ATOM   1398 N N    . ARG A 1 91  ? 13.50600  -32.51300 -14.44800 1.000 68.10553  ? 89  ARG A N    1 
ATOM   1399 C CA   . ARG A 1 91  ? 14.48300  -33.21500 -15.25800 1.000 71.68491  ? 89  ARG A CA   1 
ATOM   1400 C C    . ARG A 1 91  ? 15.88800  -33.00500 -14.70700 1.000 73.65883  ? 89  ARG A C    1 
ATOM   1401 O O    . ARG A 1 91  ? 16.14900  -32.03800 -13.98300 1.000 69.43990  ? 89  ARG A O    1 
ATOM   1402 C CB   . ARG A 1 91  ? 14.41800  -32.73500 -16.71200 1.000 76.21966  ? 89  ARG A CB   1 
ATOM   1403 C CG   . ARG A 1 91  ? 13.23000  -33.28300 -17.48600 1.000 80.13592  ? 89  ARG A CG   1 
ATOM   1404 C CD   . ARG A 1 91  ? 13.37600  -34.77700 -17.74300 1.000 81.21237  ? 89  ARG A CD   1 
ATOM   1405 N NE   . ARG A 1 91  ? 12.51500  -35.22500 -18.83100 1.000 81.79665  ? 89  ARG A NE   1 
ATOM   1406 C CZ   . ARG A 1 91  ? 11.30100  -35.73800 -18.67800 1.000 77.89092  ? 89  ARG A CZ   1 
ATOM   1407 N NH1  . ARG A 1 91  ? 10.76900  -35.91700 -17.47900 1.000 80.55703  ? 89  ARG A NH1  1 
ATOM   1408 N NH2  . ARG A 1 91  ? 10.60300  -36.08200 -19.75600 1.000 76.51707  ? 89  ARG A NH2  1 
ATOM   1409 H H    . ARG A 1 91  ? 13.54900  -31.65700 -14.52000 1.000 82.79000  ? 89  ARG A H    1 
ATOM   1410 H HA   . ARG A 1 91  ? 14.28300  -34.16300 -15.24100 1.000 87.08000  ? 89  ARG A HA   1 
ATOM   1411 H HB2  . ARG A 1 91  ? 14.35500  -31.76700 -16.71900 1.000 92.52000  ? 89  ARG A HB2  1 
ATOM   1412 H HB3  . ARG A 1 91  ? 15.22600  -33.01400 -17.17000 1.000 92.52000  ? 89  ARG A HB3  1 
ATOM   1413 H HG2  . ARG A 1 91  ? 12.42000  -33.14000 -16.97300 1.000 97.22000  ? 89  ARG A HG2  1 
ATOM   1414 H HG3  . ARG A 1 91  ? 13.16900  -32.83100 -18.34200 1.000 97.22000  ? 89  ARG A HG3  1 
ATOM   1415 H HD2  . ARG A 1 91  ? 14.29400  -34.96400 -17.99400 1.000 98.51000  ? 89  ARG A HD2  1 
ATOM   1416 H HD3  . ARG A 1 91  ? 13.14800  -35.26700 -16.93800 1.000 98.51000  ? 89  ARG A HD3  1 
ATOM   1417 H HE   . ARG A 1 91  ? 12.81700  -35.15100 -19.63300 1.000 99.21000  ? 89  ARG A HE   1 
ATOM   1418 H HH11 . ARG A 1 91  ? 11.20500  -35.69900 -16.77200 1.000 97.73000  ? 89  ARG A HH11 1 
ATOM   1419 H HH12 . ARG A 1 91  ? 9.98000   -36.25200 -17.40800 1.000 97.73000  ? 89  ARG A HH12 1 
ATOM   1420 H HH21 . ARG A 1 91  ? 10.94000  -35.97100 -20.54000 1.000 92.88000  ? 89  ARG A HH21 1 
ATOM   1421 H HH22 . ARG A 1 91  ? 9.81600   -36.41700 -19.67000 1.000 92.88000  ? 89  ARG A HH22 1 
ATOM   1422 N N    . PRO A 1 92  ? 16.82400  -33.90500 -15.02400 1.000 72.23761  ? 90  PRO A N    1 
ATOM   1423 C CA   . PRO A 1 92  ? 18.19300  -33.73700 -14.50600 1.000 66.84749  ? 90  PRO A CA   1 
ATOM   1424 C C    . PRO A 1 92  ? 18.80900  -32.39800 -14.87000 1.000 73.73779  ? 90  PRO A C    1 
ATOM   1425 O O    . PRO A 1 92  ? 19.50600  -31.79400 -14.04500 1.000 69.29778  ? 90  PRO A O    1 
ATOM   1426 C CB   . PRO A 1 92  ? 18.95900  -34.90500 -15.14500 1.000 69.97155  ? 90  PRO A CB   1 
ATOM   1427 C CG   . PRO A 1 92  ? 17.91200  -35.89200 -15.55400 1.000 76.42495  ? 90  PRO A CG   1 
ATOM   1428 C CD   . PRO A 1 92  ? 16.68000  -35.10600 -15.86400 1.000 74.39313  ? 90  PRO A CD   1 
ATOM   1429 H HA   . PRO A 1 92  ? 18.20100  -33.84000 -13.54200 1.000 81.28000  ? 90  PRO A HA   1 
ATOM   1430 H HB2  . PRO A 1 92  ? 19.45100  -34.58800 -15.91900 1.000 85.02000  ? 90  PRO A HB2  1 
ATOM   1431 H HB3  . PRO A 1 92  ? 19.56100  -35.29600 -14.49300 1.000 85.02000  ? 90  PRO A HB3  1 
ATOM   1432 H HG2  . PRO A 1 92  ? 18.21300  -36.37400 -16.34000 1.000 92.77000  ? 90  PRO A HG2  1 
ATOM   1433 H HG3  . PRO A 1 92  ? 17.74600  -36.50700 -14.82300 1.000 92.77000  ? 90  PRO A HG3  1 
ATOM   1434 H HD2  . PRO A 1 92  ? 16.66100  -34.86300 -16.80300 1.000 90.33000  ? 90  PRO A HD2  1 
ATOM   1435 H HD3  . PRO A 1 92  ? 15.89100  -35.60900 -15.61000 1.000 90.33000  ? 90  PRO A HD3  1 
ATOM   1436 N N    . THR A 1 93  ? 18.57000  -31.91400 -16.09100 1.000 75.55643  ? 91  THR A N    1 
ATOM   1437 C CA   . THR A 1 93  ? 19.14600  -30.64300 -16.51100 1.000 75.56169  ? 91  THR A CA   1 
ATOM   1438 C C    . THR A 1 93  ? 18.67700  -29.48200 -15.64600 1.000 73.48776  ? 91  THR A C    1 
ATOM   1439 O O    . THR A 1 93  ? 19.29800  -28.41400 -15.67100 1.000 71.08747  ? 91  THR A O    1 
ATOM   1440 C CB   . THR A 1 93  ? 18.78900  -30.35700 -17.97200 1.000 71.27434  ? 91  THR A CB   1 
ATOM   1441 O OG1  . THR A 1 93  ? 17.36300  -30.35500 -18.12500 1.000 69.42148  ? 91  THR A OG1  1 
ATOM   1442 C CG2  . THR A 1 93  ? 19.40200  -31.40300 -18.89300 1.000 72.69556  ? 91  THR A CG2  1 
ATOM   1443 H H    . THR A 1 93  ? 18.08300  -32.30000 -16.68600 1.000 91.72000  ? 91  THR A H    1 
ATOM   1444 H HA   . THR A 1 93  ? 20.11200  -30.69600 -16.44300 1.000 91.73000  ? 91  THR A HA   1 
ATOM   1445 H HB   . THR A 1 93  ? 19.13900  -29.48800 -18.22300 1.000 86.34000  ? 91  THR A HB   1 
ATOM   1446 H HG1  . THR A 1 93  ? 17.16000  -30.19900 -18.92500 1.000 83.14000  ? 91  THR A HG1  1 
ATOM   1447 H HG21 . THR A 1 93  ? 19.12800  -31.23900 -19.80900 1.000 81.97000  ? 91  THR A HG21 1 
ATOM   1448 H HG22 . THR A 1 93  ? 20.37000  -31.36300 -18.84200 1.000 81.97000  ? 91  THR A HG22 1 
ATOM   1449 H HG23 . THR A 1 93  ? 19.10800  -32.29000 -18.63100 1.000 81.97000  ? 91  THR A HG23 1 
ATOM   1450 N N    . GLY A 1 94  ? 17.60500  -29.66800 -14.87900 1.000 71.58753  ? 92  GLY A N    1 
ATOM   1451 C CA   . GLY A 1 94  ? 16.99200  -28.60000 -14.12500 1.000 76.08807  ? 92  GLY A CA   1 
ATOM   1452 C C    . GLY A 1 94  ? 15.73300  -28.04700 -14.75200 1.000 76.03280  ? 92  GLY A C    1 
ATOM   1453 O O    . GLY A 1 94  ? 15.00100  -27.30700 -14.08200 1.000 81.99141  ? 92  GLY A O    1 
ATOM   1454 H H    . GLY A 1 94  ? 17.20800  -30.42400 -14.78300 1.000 86.96000  ? 92  GLY A H    1 
ATOM   1455 H HA2  . GLY A 1 94  ? 16.76800  -28.92700 -13.24000 1.000 92.36000  ? 92  GLY A HA2  1 
ATOM   1456 H HA3  . GLY A 1 94  ? 17.62500  -27.87200 -14.02600 1.000 92.36000  ? 92  GLY A HA3  1 
ATOM   1457 N N    . GLU A 1 95  ? 15.46200  -28.38000 -16.01200 1.000 76.73025  ? 93  GLU A N    1 
ATOM   1458 C CA   . GLU A 1 95  ? 14.23500  -27.93700 -16.65600 1.000 81.05446  ? 93  GLU A CA   1 
ATOM   1459 C C    . GLU A 1 95  ? 13.02500  -28.40700 -15.85800 1.000 79.70956  ? 93  GLU A C    1 
ATOM   1460 O O    . GLU A 1 95  ? 12.98600  -29.53700 -15.36400 1.000 81.42555  ? 93  GLU A O    1 
ATOM   1461 C CB   . GLU A 1 95  ? 14.16200  -28.47500 -18.08700 1.000 80.01749  ? 93  GLU A CB   1 
ATOM   1462 C CG   . GLU A 1 95  ? 13.08700  -27.82200 -18.94300 1.000 87.32626  ? 93  GLU A CG   1 
ATOM   1463 C CD   . GLU A 1 95  ? 12.49000  -28.77100 -19.96700 1.000 91.18988  ? 93  GLU A CD   1 
ATOM   1464 O OE1  . GLU A 1 95  ? 13.16500  -29.75700 -20.33600 1.000 87.26046  ? 93  GLU A OE1  1 
ATOM   1465 O OE2  . GLU A 1 95  ? 11.34100  -28.53300 -20.39700 1.000 100.10937 ? 93  GLU A OE2  1 
ATOM   1466 H H    . GLU A 1 95  ? 15.97100  -28.85900 -16.51200 1.000 93.13000  ? 93  GLU A H    1 
ATOM   1467 H HA   . GLU A 1 95  ? 14.22100  -26.96800 -16.69200 1.000 98.32000  ? 93  GLU A HA   1 
ATOM   1468 H HB2  . GLU A 1 95  ? 15.01700  -28.32500 -18.52000 1.000 97.08000  ? 93  GLU A HB2  1 
ATOM   1469 H HB3  . GLU A 1 95  ? 13.97500  -29.42600 -18.05100 1.000 97.08000  ? 93  GLU A HB3  1 
ATOM   1470 H HG2  . GLU A 1 95  ? 12.36900  -27.51100 -18.36900 1.000 105.85000 ? 93  GLU A HG2  1 
ATOM   1471 H HG3  . GLU A 1 95  ? 13.47700  -27.07300 -19.42100 1.000 105.85000 ? 93  GLU A HG3  1 
ATOM   1472 N N    . LEU A 1 96  ? 12.04000  -27.52400 -15.72300 1.000 92.55583  ? 94  LEU A N    1 
ATOM   1473 C CA   . LEU A 1 96  ? 10.77300  -27.84200 -15.07700 1.000 84.42591  ? 94  LEU A CA   1 
ATOM   1474 C C    . LEU A 1 96  ? 9.72700   -28.09200 -16.15400 1.000 84.88913  ? 94  LEU A C    1 
ATOM   1475 O O    . LEU A 1 96  ? 9.59000   -27.29400 -17.08700 1.000 93.26381  ? 94  LEU A O    1 
ATOM   1476 C CB   . LEU A 1 96  ? 10.33200  -26.70700 -14.15500 1.000 82.42041  ? 94  LEU A CB   1 
ATOM   1477 C CG   . LEU A 1 96  ? 11.36800  -26.27200 -13.11600 1.000 79.62270  ? 94  LEU A CG   1 
ATOM   1478 C CD1  . LEU A 1 96  ? 10.89900  -25.03500 -12.36800 1.000 80.09381  ? 94  LEU A CD1  1 
ATOM   1479 C CD2  . LEU A 1 96  ? 11.66400  -27.40300 -12.14700 1.000 76.59866  ? 94  LEU A CD2  1 
ATOM   1480 H H    . LEU A 1 96  ? 12.08500  -26.71300 -16.00600 1.000 112.12000 ? 94  LEU A H    1 
ATOM   1481 H HA   . LEU A 1 96  ? 10.86900  -28.64900 -14.54800 1.000 102.37000 ? 94  LEU A HA   1 
ATOM   1482 H HB2  . LEU A 1 96  ? 10.12200  -25.93200 -14.70000 1.000 99.96000  ? 94  LEU A HB2  1 
ATOM   1483 H HB3  . LEU A 1 96  ? 9.53800   -26.99100 -13.67500 1.000 99.96000  ? 94  LEU A HB3  1 
ATOM   1484 H HG   . LEU A 1 96  ? 12.19400  -26.04700 -13.57100 1.000 96.60000  ? 94  LEU A HG   1 
ATOM   1485 H HD11 . LEU A 1 96  ? 11.57800  -24.77900 -11.72400 1.000 97.17000  ? 94  LEU A HD11 1 
ATOM   1486 H HD12 . LEU A 1 96  ? 10.75900  -24.31600 -13.00400 1.000 97.17000  ? 94  LEU A HD12 1 
ATOM   1487 H HD13 . LEU A 1 96  ? 10.06800  -25.23900 -11.91100 1.000 97.17000  ? 94  LEU A HD13 1 
ATOM   1488 H HD21 . LEU A 1 96  ? 12.14400  -27.04900 -11.38200 1.000 92.98000  ? 94  LEU A HD21 1 
ATOM   1489 H HD22 . LEU A 1 96  ? 10.82800  -27.79900 -11.86200 1.000 92.98000  ? 94  LEU A HD22 1 
ATOM   1490 H HD23 . LEU A 1 96  ? 12.20500  -28.06700 -12.60100 1.000 92.98000  ? 94  LEU A HD23 1 
ATOM   1491 N N    . MET A 1 97  ? 8.99000   -29.19400 -16.02300 1.000 83.79689  ? 95  MET A N    1 
ATOM   1492 C CA   . MET A 1 97  ? 8.08400   -29.66200 -17.07300 1.000 81.56767  ? 95  MET A CA   1 
ATOM   1493 C C    . MET A 1 97  ? 6.75200   -30.07700 -16.46200 1.000 73.25089  ? 95  MET A C    1 
ATOM   1494 O O    . MET A 1 97  ? 6.44600   -31.26700 -16.34300 1.000 72.80083  ? 95  MET A O    1 
ATOM   1495 C CB   . MET A 1 97  ? 8.71300   -30.82500 -17.84400 1.000 74.91688  ? 95  MET A CB   1 
ATOM   1496 C CG   . MET A 1 97  ? 7.98800   -31.20900 -19.12500 1.000 80.83601  ? 95  MET A CG   1 
ATOM   1497 S SD   . MET A 1 97  ? 8.35300   -32.90700 -19.61400 1.000 88.05793  ? 95  MET A SD   1 
ATOM   1498 C CE   . MET A 1 97  ? 8.78800   -32.70300 -21.33800 1.000 103.14921 ? 95  MET A CE   1 
ATOM   1499 H H    . MET A 1 97  ? 8.99700   -29.69600 -15.32500 1.000 101.61000 ? 95  MET A H    1 
ATOM   1500 H HA   . MET A 1 97  ? 7.92900   -28.94100 -17.70300 1.000 98.94000  ? 95  MET A HA   1 
ATOM   1501 H HB2  . MET A 1 97  ? 9.62100   -30.58100 -18.08400 1.000 90.96000  ? 95  MET A HB2  1 
ATOM   1502 H HB3  . MET A 1 97  ? 8.72700   -31.60600 -17.26900 1.000 90.96000  ? 95  MET A HB3  1 
ATOM   1503 H HG2  . MET A 1 97  ? 7.03100   -31.13300 -18.98800 1.000 98.06000  ? 95  MET A HG2  1 
ATOM   1504 H HG3  . MET A 1 97  ? 8.27200   -30.62000 -19.84100 1.000 98.06000  ? 95  MET A HG3  1 
ATOM   1505 H HE1  . MET A 1 97  ? 8.99800   -33.57200 -21.71500 1.000 124.83000 ? 95  MET A HE1  1 
ATOM   1506 H HE2  . MET A 1 97  ? 8.03600   -32.31000 -21.80800 1.000 124.83000 ? 95  MET A HE2  1 
ATOM   1507 H HE3  . MET A 1 97  ? 9.56000   -32.11900 -21.40100 1.000 124.83000 ? 95  MET A HE3  1 
ATOM   1508 N N    . PRO A 1 98  ? 5.92500   -29.11000 -16.06900 1.000 72.32446  ? 96  PRO A N    1 
ATOM   1509 C CA   . PRO A 1 98  ? 4.57500   -29.45500 -15.59900 1.000 75.84067  ? 96  PRO A CA   1 
ATOM   1510 C C    . PRO A 1 98  ? 3.71900   -29.98200 -16.74200 1.000 76.41179  ? 96  PRO A C    1 
ATOM   1511 O O    . PRO A 1 98  ? 3.63000   -29.36500 -17.80500 1.000 73.67725  ? 96  PRO A O    1 
ATOM   1512 C CB   . PRO A 1 98  ? 4.03600   -28.12800 -15.05100 1.000 74.20363  ? 96  PRO A CB   1 
ATOM   1513 C CG   . PRO A 1 98  ? 4.82300   -27.07400 -15.76500 1.000 79.60428  ? 96  PRO A CG   1 
ATOM   1514 C CD   . PRO A 1 98  ? 6.19100   -27.66300 -15.97900 1.000 78.75944  ? 96  PRO A CD   1 
ATOM   1515 H HA   . PRO A 1 98  ? 4.61600   -30.11200 -14.88700 1.000 92.06000  ? 96  PRO A HA   1 
ATOM   1516 H HB2  . PRO A 1 98  ? 3.09100   -28.04900 -15.25400 1.000 90.10000  ? 96  PRO A HB2  1 
ATOM   1517 H HB3  . PRO A 1 98  ? 4.18800   -28.08200 -14.09400 1.000 90.10000  ? 96  PRO A HB3  1 
ATOM   1518 H HG2  . PRO A 1 98  ? 4.40100   -26.87300 -16.61500 1.000 96.59000  ? 96  PRO A HG2  1 
ATOM   1519 H HG3  . PRO A 1 98  ? 4.87600   -26.27800 -15.21300 1.000 96.59000  ? 96  PRO A HG3  1 
ATOM   1520 H HD2  . PRO A 1 98  ? 6.57300   -27.33500 -16.80800 1.000 95.57000  ? 96  PRO A HD2  1 
ATOM   1521 H HD3  . PRO A 1 98  ? 6.76500   -27.47100 -15.22100 1.000 95.57000  ? 96  PRO A HD3  1 
ATOM   1522 N N    . LEU A 1 99  ? 3.08800   -31.13100 -16.51500 1.000 69.37148  ? 97  LEU A N    1 
ATOM   1523 C CA   . LEU A 1 99  ? 2.20500   -31.75600 -17.49000 1.000 68.25818  ? 97  LEU A CA   1 
ATOM   1524 C C    . LEU A 1 99  ? 0.78800   -31.77100 -16.93800 1.000 68.08448  ? 97  LEU A C    1 
ATOM   1525 O O    . LEU A 1 99  ? 0.57600   -32.12100 -15.77300 1.000 64.54984  ? 97  LEU A O    1 
ATOM   1526 C CB   . LEU A 1 99  ? 2.65300   -33.18400 -17.81600 1.000 66.66852  ? 97  LEU A CB   1 
ATOM   1527 C CG   . LEU A 1 99  ? 4.02400   -33.38300 -18.46500 1.000 73.73779  ? 97  LEU A CG   1 
ATOM   1528 C CD1  . LEU A 1 99  ? 4.36400   -34.86600 -18.47200 1.000 84.23905  ? 97  LEU A CD1  1 
ATOM   1529 C CD2  . LEU A 1 99  ? 4.06700   -32.81900 -19.87900 1.000 72.77978  ? 97  LEU A CD2  1 
ATOM   1530 H H    . LEU A 1 99  ? 3.15900   -31.57800 -15.78300 1.000 84.30000  ? 97  LEU A H    1 
ATOM   1531 H HA   . LEU A 1 99  ? 2.20800   -31.24000 -18.31100 1.000 82.97000  ? 97  LEU A HA   1 
ATOM   1532 H HB2  . LEU A 1 99  ? 2.65700   -33.69000 -16.98800 1.000 81.06000  ? 97  LEU A HB2  1 
ATOM   1533 H HB3  . LEU A 1 99  ? 1.99800   -33.57000 -18.41800 1.000 81.06000  ? 97  LEU A HB3  1 
ATOM   1534 H HG   . LEU A 1 99  ? 4.69500   -32.92300 -17.93700 1.000 89.54000  ? 97  LEU A HG   1 
ATOM   1535 H HD11 . LEU A 1 99  ? 5.24000   -34.99100 -18.86900 1.000 102.14000 ? 97  LEU A HD11 1 
ATOM   1536 H HD12 . LEU A 1 99  ? 4.35500   -35.19600 -17.56100 1.000 102.14000 ? 97  LEU A HD12 1 
ATOM   1537 H HD13 . LEU A 1 99  ? 3.69700   -35.33600 -18.99700 1.000 102.14000 ? 97  LEU A HD13 1 
ATOM   1538 H HD21 . LEU A 1 99  ? 4.94800   -32.97600 -20.25400 1.000 88.39000  ? 97  LEU A HD21 1 
ATOM   1539 H HD22 . LEU A 1 99  ? 3.39400   -33.26500 -20.41700 1.000 88.39000  ? 97  LEU A HD22 1 
ATOM   1540 H HD23 . LEU A 1 99  ? 3.88600   -31.86700 -19.84400 1.000 88.39000  ? 97  LEU A HD23 1 
ATOM   1541 N N    . ALA A 1 100 ? -0.17500  -31.39000 -17.77200 1.000 65.62366  ? 98  ALA A N    1 
ATOM   1542 C CA   . ALA A 1 100 ? -1.57900  -31.45400 -17.39200 1.000 71.61385  ? 98  ALA A CA   1 
ATOM   1543 C C    . ALA A 1 100 ? -2.11500  -32.85600 -17.65100 1.000 72.52975  ? 98  ALA A C    1 
ATOM   1544 O O    . ALA A 1 100 ? -1.90200  -33.42100 -18.72900 1.000 76.83290  ? 98  ALA A O    1 
ATOM   1545 C CB   . ALA A 1 100 ? -2.39200  -30.42300 -18.16900 1.000 64.03136  ? 98  ALA A CB   1 
ATOM   1546 H H    . ALA A 1 100 ? -0.03900  -31.09000 -18.56600 1.000 79.81000  ? 98  ALA A H    1 
ATOM   1547 H HA   . ALA A 1 100 ? -1.66700  -31.26200 -16.44500 1.000 86.99000  ? 98  ALA A HA   1 
ATOM   1548 H HB1  . ALA A 1 100 ? -3.31500  -30.46300 -17.87400 1.000 77.89000  ? 98  ALA A HB1  1 
ATOM   1549 H HB2  . ALA A 1 100 ? -2.02800  -29.54100 -17.99700 1.000 77.89000  ? 98  ALA A HB2  1 
ATOM   1550 H HB3  . ALA A 1 100 ? -2.33600  -30.62500 -19.11600 1.000 77.89000  ? 98  ALA A HB3  1 
ATOM   1551 N N    . ALA A 1 101 ? -2.80900  -33.41600 -16.66300 1.000 66.96066  ? 99  ALA A N    1 
ATOM   1552 C CA   . ALA A 1 101 ? -3.29900  -34.78800 -16.74000 1.000 69.23725  ? 99  ALA A CA   1 
ATOM   1553 C C    . ALA A 1 101 ? -4.68900  -34.85400 -16.13300 1.000 67.78181  ? 99  ALA A C    1 
ATOM   1554 O O    . ALA A 1 101 ? -4.85800  -34.59200 -14.93800 1.000 69.21619  ? 99  ALA A O    1 
ATOM   1555 C CB   . ALA A 1 101 ? -2.35600  -35.75200 -16.01300 1.000 69.42938  ? 99  ALA A CB   1 
ATOM   1556 H H    . ALA A 1 101 ? -3.01100  -33.01600 -15.92900 1.000 81.41000  ? 99  ALA A H    1 
ATOM   1557 H HA   . ALA A 1 101 ? -3.35800  -35.06000 -17.66900 1.000 84.15000  ? 99  ALA A HA   1 
ATOM   1558 H HB1  . ALA A 1 101 ? -2.67400  -36.66000 -16.13700 1.000 84.37000  ? 99  ALA A HB1  1 
ATOM   1559 H HB2  . ALA A 1 101 ? -1.46500  -35.65900 -16.38300 1.000 84.37000  ? 99  ALA A HB2  1 
ATOM   1560 H HB3  . ALA A 1 101 ? -2.34500  -35.52900 -15.06900 1.000 84.37000  ? 99  ALA A HB3  1 
ATOM   1561 N N    . ARG A 1 102 ? -5.67700  -35.21000 -16.95000 1.000 70.85586  ? 100 ARG A N    1 
ATOM   1562 C CA   . ARG A 1 102 ? -7.03200  -35.43700 -16.45900 1.000 75.63802  ? 100 ARG A CA   1 
ATOM   1563 C C    . ARG A 1 102 ? -7.07100  -36.80300 -15.78800 1.000 68.81088  ? 100 ARG A C    1 
ATOM   1564 O O    . ARG A 1 102 ? -7.00900  -37.83700 -16.46300 1.000 73.70884  ? 100 ARG A O    1 
ATOM   1565 C CB   . ARG A 1 102 ? -8.04500  -35.35100 -17.59700 1.000 78.73312  ? 100 ARG A CB   1 
ATOM   1566 C CG   . ARG A 1 102 ? -9.47300  -35.62800 -17.14800 1.000 79.36215  ? 100 ARG A CG   1 
ATOM   1567 C CD   . ARG A 1 102 ? -10.50500 -35.21600 -18.18700 1.000 79.21476  ? 100 ARG A CD   1 
ATOM   1568 N NE   . ARG A 1 102 ? -10.53200 -33.77200 -18.39800 1.000 77.23821  ? 100 ARG A NE   1 
ATOM   1569 C CZ   . ARG A 1 102 ? -10.11800 -33.15600 -19.49900 1.000 80.56229  ? 100 ARG A CZ   1 
ATOM   1570 N NH1  . ARG A 1 102 ? -9.64700  -33.82900 -20.53700 1.000 78.78576  ? 100 ARG A NH1  1 
ATOM   1571 N NH2  . ARG A 1 102 ? -10.18900 -31.83000 -19.56400 1.000 93.57438  ? 100 ARG A NH2  1 
ATOM   1572 H H    . ARG A 1 102 ? -5.58700  -35.32700 -17.79700 1.000 86.08000  ? 100 ARG A H    1 
ATOM   1573 H HA   . ARG A 1 102 ? -7.25500  -34.76400 -15.79800 1.000 91.82000  ? 100 ARG A HA   1 
ATOM   1574 H HB2  . ARG A 1 102 ? -8.01800  -34.45800 -17.97500 1.000 95.54000  ? 100 ARG A HB2  1 
ATOM   1575 H HB3  . ARG A 1 102 ? -7.81300  -36.00500 -18.27500 1.000 95.54000  ? 100 ARG A HB3  1 
ATOM   1576 H HG2  . ARG A 1 102 ? -9.57500  -36.57900 -16.98500 1.000 96.29000  ? 100 ARG A HG2  1 
ATOM   1577 H HG3  . ARG A 1 102 ? -9.65100  -35.13100 -16.33400 1.000 96.29000  ? 100 ARG A HG3  1 
ATOM   1578 H HD2  . ARG A 1 102 ? -10.30900 -35.66400 -19.02200 1.000 96.11000  ? 100 ARG A HD2  1 
ATOM   1579 H HD3  . ARG A 1 102 ? -11.38300 -35.48300 -17.87300 1.000 96.11000  ? 100 ARG A HD3  1 
ATOM   1580 H HE   . ARG A 1 102 ? -10.83900 -33.28300 -17.76100 1.000 93.74000  ? 100 ARG A HE   1 
ATOM   1581 H HH11 . ARG A 1 102 ? -9.59300  -34.68500 -20.51700 1.000 95.60000  ? 100 ARG A HH11 1 
ATOM   1582 H HH12 . ARG A 1 102 ? -9.38700  -33.40300 -21.23700 1.000 95.60000  ? 100 ARG A HH12 1 
ATOM   1583 H HH21 . ARG A 1 102 ? -10.49500 -31.38300 -18.89600 1.000 113.35000 ? 100 ARG A HH21 1 
ATOM   1584 H HH22 . ARG A 1 102 ? -9.92600  -31.42000 -20.27200 1.000 113.35000 ? 100 ARG A HH22 1 
ATOM   1585 N N    . MET A 1 103 ? -7.15900  -36.81300 -14.46100 1.000 65.30520  ? 101 MET A N    1 
ATOM   1586 C CA   . MET A 1 103 ? -7.17100  -38.06800 -13.72700 1.000 71.83756  ? 101 MET A CA   1 
ATOM   1587 C C    . MET A 1 103 ? -8.45800  -38.83700 -14.00600 1.000 73.78779  ? 101 MET A C    1 
ATOM   1588 O O    . MET A 1 103 ? -9.50000  -38.25800 -14.32500 1.000 75.03794  ? 101 MET A O    1 
ATOM   1589 C CB   . MET A 1 103 ? -7.02900  -37.81400 -12.22700 1.000 69.16092  ? 101 MET A CB   1 
ATOM   1590 C CG   . MET A 1 103 ? -5.82900  -36.95900 -11.84300 1.000 80.20435  ? 101 MET A CG   1 
ATOM   1591 S SD   . MET A 1 103 ? -4.31900  -37.39700 -12.72800 1.000 71.19538  ? 101 MET A SD   1 
ATOM   1592 C CE   . MET A 1 103 ? -4.10600  -39.10400 -12.22800 1.000 67.29228  ? 101 MET A CE   1 
ATOM   1593 H H    . MET A 1 103 ? -7.21300  -36.11100 -13.96800 1.000 79.42000  ? 101 MET A H    1 
ATOM   1594 H HA   . MET A 1 103 ? -6.42000  -38.60900 -14.01500 1.000 87.26000  ? 101 MET A HA   1 
ATOM   1595 H HB2  . MET A 1 103 ? -7.82900  -37.36900 -11.90600 1.000 84.05000  ? 101 MET A HB2  1 
ATOM   1596 H HB3  . MET A 1 103 ? -6.92600  -38.66800 -11.78400 1.000 84.05000  ? 101 MET A HB3  1 
ATOM   1597 H HG2  . MET A 1 103 ? -6.03000  -36.03100 -12.03900 1.000 97.30000  ? 101 MET A HG2  1 
ATOM   1598 H HG3  . MET A 1 103 ? -5.65900  -37.06600 -10.89400 1.000 97.30000  ? 101 MET A HG3  1 
ATOM   1599 H HE1  . MET A 1 103 ? -3.31000  -39.46000 -12.65300 1.000 81.81000  ? 101 MET A HE1  1 
ATOM   1600 H HE2  . MET A 1 103 ? -4.01000  -39.14000 -11.26300 1.000 81.81000  ? 101 MET A HE2  1 
ATOM   1601 H HE3  . MET A 1 103 ? -4.88400  -39.61300 -12.50300 1.000 81.81000  ? 101 MET A HE3  1 
ATOM   1602 N N    . GLY A 1 104 ? -8.37600  -40.15800 -13.87400 1.000 70.35054  ? 102 GLY A N    1 
ATOM   1603 C CA   . GLY A 1 104 ? -9.47300  -41.04700 -14.20400 1.000 67.51073  ? 102 GLY A CA   1 
ATOM   1604 C C    . GLY A 1 104 ? -9.74600  -42.03100 -13.08300 1.000 58.68072  ? 102 GLY A C    1 
ATOM   1605 O O    . GLY A 1 104 ? -9.72600  -41.69100 -11.90100 1.000 62.28905  ? 102 GLY A O    1 
ATOM   1606 H H    . GLY A 1 104 ? -7.67600  -40.56800 -13.58800 1.000 85.48000  ? 102 GLY A H    1 
ATOM   1607 H HA2  . GLY A 1 104 ? -10.27800 -40.53100 -14.36500 1.000 82.07000  ? 102 GLY A HA2  1 
ATOM   1608 H HA3  . GLY A 1 104 ? -9.25800  -41.54500 -15.00800 1.000 82.07000  ? 102 GLY A HA3  1 
ATOM   1609 N N    . THR A 1 105 ? -9.99900  -43.27600 -13.47800 1.000 65.23677  ? 103 THR A N    1 
ATOM   1610 C CA   . THR A 1 105 ? -10.44800 -44.29100 -12.53600 1.000 70.20315  ? 103 THR A CA   1 
ATOM   1611 C C    . THR A 1 105 ? -9.38500  -44.58300 -11.48400 1.000 66.19478  ? 103 THR A C    1 
ATOM   1612 O O    . THR A 1 105 ? -8.18600  -44.60800 -11.77500 1.000 55.90934  ? 103 THR A O    1 
ATOM   1613 C CB   . THR A 1 105 ? -10.80400 -45.57700 -13.28700 1.000 67.89498  ? 103 THR A CB   1 
ATOM   1614 O OG1  . THR A 1 105 ? -9.89200  -45.76400 -14.37600 1.000 70.70058  ? 103 THR A OG1  1 
ATOM   1615 C CG2  . THR A 1 105 ? -12.22300 -45.51600 -13.82800 1.000 79.85694  ? 103 THR A CG2  1 
ATOM   1616 H H    . THR A 1 105 ? -9.91800  -43.55700 -14.28700 1.000 79.34000  ? 103 THR A H    1 
ATOM   1617 H HA   . THR A 1 105 ? -11.24500 -43.97500 -12.08200 1.000 85.30000  ? 103 THR A HA   1 
ATOM   1618 H HB   . THR A 1 105 ? -10.74000 -46.33200 -12.68100 1.000 82.53000  ? 103 THR A HB   1 
ATOM   1619 H HG1  . THR A 1 105 ? -10.13200 -46.41900 -14.84200 1.000 85.90000  ? 103 THR A HG1  1 
ATOM   1620 H HG21 . THR A 1 105 ? -12.36600 -46.23600 -14.46100 1.000 96.89000  ? 103 THR A HG21 1 
ATOM   1621 H HG22 . THR A 1 105 ? -12.85900 -45.60300 -13.10100 1.000 96.89000  ? 103 THR A HG22 1 
ATOM   1622 H HG23 . THR A 1 105 ? -12.37000 -44.66900 -14.27700 1.000 96.89000  ? 103 THR A HG23 1 
ATOM   1623 N N    . HIS A 1 106 ? -9.83700  -44.79000 -10.24900 1.000 67.14226  ? 104 HIS A N    1 
ATOM   1624 C CA   . HIS A 1 106 ? -9.00500  -45.35400 -9.19600  1.000 69.68993  ? 104 HIS A CA   1 
ATOM   1625 C C    . HIS A 1 106 ? -9.16900  -46.86700 -9.22500  1.000 66.30269  ? 104 HIS A C    1 
ATOM   1626 O O    . HIS A 1 106 ? -10.29000 -47.37300 -9.32900  1.000 71.17959  ? 104 HIS A O    1 
ATOM   1627 C CB   . HIS A 1 106 ? -9.40000  -44.82700 -7.81400  1.000 65.77368  ? 104 HIS A CB   1 
ATOM   1628 C CG   . HIS A 1 106 ? -9.43500  -43.33300 -7.70600  1.000 71.23749  ? 104 HIS A CG   1 
ATOM   1629 N ND1  . HIS A 1 106 ? -9.22300  -42.67500 -6.51300  1.000 75.79856  ? 104 HIS A ND1  1 
ATOM   1630 C CD2  . HIS A 1 106 ? -9.68400  -42.37100 -8.62600  1.000 74.51420  ? 104 HIS A CD2  1 
ATOM   1631 C CE1  . HIS A 1 106 ? -9.32600  -41.37200 -6.70600  1.000 79.28319  ? 104 HIS A CE1  1 
ATOM   1632 N NE2  . HIS A 1 106 ? -9.60600  -41.16100 -7.97900  1.000 78.97263  ? 104 HIS A NE2  1 
ATOM   1633 H H    . HIS A 1 106 ? -10.63800 -44.60700 -9.99400  1.000 81.63000  ? 104 HIS A H    1 
ATOM   1634 H HA   . HIS A 1 106 ? -8.07400  -45.13700 -9.35900  1.000 84.69000  ? 104 HIS A HA   1 
ATOM   1635 H HB2  . HIS A 1 106 ? -10.28500 -45.15900 -7.59700  1.000 79.99000  ? 104 HIS A HB2  1 
ATOM   1636 H HB3  . HIS A 1 106 ? -8.76000  -45.15400 -7.16300  1.000 79.99000  ? 104 HIS A HB3  1 
ATOM   1637 H HD2  . HIS A 1 106 ? -9.86800  -42.50200 -9.52800  1.000 90.48000  ? 104 HIS A HD2  1 
ATOM   1638 H HE1  . HIS A 1 106 ? -9.22000  -40.71500 -6.05600  1.000 96.20000  ? 104 HIS A HE1  1 
ATOM   1639 H HE2  . HIS A 1 106 ? -9.72000  -40.39100 -8.34300  1.000 95.82000  ? 104 HIS A HE2  1 
ATOM   1640 N N    . ALA A 1 107 ? -8.05800  -47.59000 -9.13100  1.000 66.72905  ? 105 ALA A N    1 
ATOM   1641 C CA   . ALA A 1 107 ? -8.13600  -49.04000 -9.23600  1.000 68.01342  ? 105 ALA A CA   1 
ATOM   1642 C C    . ALA A 1 107 ? -6.79300  -49.66500 -8.89800  1.000 71.09537  ? 105 ALA A C    1 
ATOM   1643 O O    . ALA A 1 107 ? -5.76200  -48.99200 -8.82600  1.000 69.56097  ? 105 ALA A O    1 
ATOM   1644 C CB   . ALA A 1 107 ? -8.57900  -49.46700 -10.63800 1.000 67.44230  ? 105 ALA A CB   1 
ATOM   1645 H H    . ALA A 1 107 ? -7.26700  -47.27500 -9.01000  1.000 81.13000  ? 105 ALA A H    1 
ATOM   1646 H HA   . ALA A 1 107 ? -8.79000  -49.36900 -8.60000  1.000 82.67000  ? 105 ALA A HA   1 
ATOM   1647 H HB1  . ALA A 1 107 ? -9.46100  -49.10600 -10.81500 1.000 81.99000  ? 105 ALA A HB1  1 
ATOM   1648 H HB2  . ALA A 1 107 ? -7.94500  -49.12200 -11.28700 1.000 81.99000  ? 105 ALA A HB2  1 
ATOM   1649 H HB3  . ALA A 1 107 ? -8.59900  -50.43600 -10.67800 1.000 81.99000  ? 105 ALA A HB3  1 
ATOM   1650 N N    . THR A 1 108 ? -6.83100  -50.97700 -8.68800  1.000 75.62749  ? 106 THR A N    1 
ATOM   1651 C CA   . THR A 1 108 ? -5.63700  -51.79800 -8.56600  1.000 72.26656  ? 106 THR A CA   1 
ATOM   1652 C C    . THR A 1 108 ? -5.28500  -52.33100 -9.95000  1.000 76.38811  ? 106 THR A C    1 
ATOM   1653 O O    . THR A 1 108 ? -6.10500  -53.00300 -10.58600 1.000 77.11714  ? 106 THR A O    1 
ATOM   1654 C CB   . THR A 1 108 ? -5.87900  -52.94000 -7.58000  1.000 69.63203  ? 106 THR A CB   1 
ATOM   1655 O OG1  . THR A 1 108 ? -6.09100  -52.40400 -6.26800  1.000 65.26835  ? 106 THR A OG1  1 
ATOM   1656 C CG2  . THR A 1 108 ? -4.69700  -53.88200 -7.55300  1.000 81.53872  ? 106 THR A CG2  1 
ATOM   1657 H H    . THR A 1 108 ? -7.56100  -51.42500 -8.61100  1.000 91.81000  ? 106 THR A H    1 
ATOM   1658 H HA   . THR A 1 108 ? -4.89900  -51.25800 -8.24200  1.000 87.78000  ? 106 THR A HA   1 
ATOM   1659 H HB   . THR A 1 108 ? -6.66300  -53.44100 -7.85400  1.000 84.61000  ? 106 THR A HB   1 
ATOM   1660 H HG1  . THR A 1 108 ? -6.22500  -53.02700 -5.72100  1.000 79.38000  ? 106 THR A HG1  1 
ATOM   1661 H HG21 . THR A 1 108 ? -4.72500  -54.42900 -6.75300  1.000 98.91000  ? 106 THR A HG21 1 
ATOM   1662 H HG22 . THR A 1 108 ? -4.70700  -54.45800 -8.33300  1.000 98.91000  ? 106 THR A HG22 1 
ATOM   1663 H HG23 . THR A 1 108 ? -3.88200  -53.36000 -7.55200  1.000 98.91000  ? 106 THR A HG23 1 
ATOM   1664 N N    . MET A 1 109 ? -4.07800  -52.02400 -10.42000 1.000 68.88457  ? 107 MET A N    1 
ATOM   1665 C CA   . MET A 1 109 ? -3.65900  -52.33500 -11.77800 1.000 69.73468  ? 107 MET A CA   1 
ATOM   1666 C C    . MET A 1 109 ? -2.58800  -53.41600 -11.79400 1.000 67.12121  ? 107 MET A C    1 
ATOM   1667 O O    . MET A 1 109 ? -1.88200  -53.64500 -10.80800 1.000 69.83732  ? 107 MET A O    1 
ATOM   1668 C CB   . MET A 1 109 ? -3.11600  -51.08700 -12.48400 1.000 69.41622  ? 107 MET A CB   1 
ATOM   1669 C CG   . MET A 1 109 ? -4.13200  -50.34600 -13.33200 1.000 81.86508  ? 107 MET A CG   1 
ATOM   1670 S SD   . MET A 1 109 ? -5.24400  -49.30200 -12.37400 1.000 102.37017 ? 107 MET A SD   1 
ATOM   1671 C CE   . MET A 1 109 ? -4.08100  -48.14800 -11.64900 1.000 93.92442  ? 107 MET A CE   1 
ATOM   1672 H H    . MET A 1 109 ? -3.47200  -51.62600 -9.95700  1.000 83.72000  ? 107 MET A H    1 
ATOM   1673 H HA   . MET A 1 109 ? -4.42700  -52.65000 -12.28000 1.000 84.74000  ? 107 MET A HA   1 
ATOM   1674 H HB2  . MET A 1 109 ? -2.77900  -50.47400 -11.81300 1.000 84.36000  ? 107 MET A HB2  1 
ATOM   1675 H HB3  . MET A 1 109 ? -2.39100  -51.35700 -13.06900 1.000 84.36000  ? 107 MET A HB3  1 
ATOM   1676 H HG2  . MET A 1 109 ? -3.66000  -49.77800 -13.96000 1.000 99.30000  ? 107 MET A HG2  1 
ATOM   1677 H HG3  . MET A 1 109 ? -4.67100  -50.99200 -13.81400 1.000 99.30000  ? 107 MET A HG3  1 
ATOM   1678 H HE1  . MET A 1 109 ? -3.59900  -48.59000 -10.93300 1.000 113.77000 ? 107 MET A HE1  1 
ATOM   1679 H HE2  . MET A 1 109 ? -4.57100  -47.38800 -11.29700 1.000 113.77000 ? 107 MET A HE2  1 
ATOM   1680 H HE3  . MET A 1 109 ? -3.46200  -47.85200 -12.33400 1.000 113.77000 ? 107 MET A HE3  1 
ATOM   1681 N N    . LYS A 1 110 ? -2.46900  -54.07300 -12.94700 1.000 66.93960  ? 108 LYS A N    1 
ATOM   1682 C CA   . LYS A 1 110 ? -1.42800  -55.06700 -13.19900 1.000 76.74868  ? 108 LYS A CA   1 
ATOM   1683 C C    . LYS A 1 110 ? -0.38500  -54.41200 -14.10000 1.000 69.60045  ? 108 LYS A C    1 
ATOM   1684 O O    . LYS A 1 110 ? -0.55500  -54.34900 -15.32000 1.000 71.48489  ? 108 LYS A O    1 
ATOM   1685 C CB   . LYS A 1 110 ? -2.01200  -56.32100 -13.84300 1.000 72.33236  ? 108 LYS A CB   1 
ATOM   1686 C CG   . LYS A 1 110 ? -1.35800  -57.61100 -13.38600 1.000 78.91999  ? 108 LYS A CG   1 
ATOM   1687 C CD   . LYS A 1 110 ? -2.11200  -58.22400 -12.21900 1.000 83.81531  ? 108 LYS A CD   1 
ATOM   1688 C CE   . LYS A 1 110 ? -1.43500  -59.49000 -11.72500 1.000 100.20938 ? 108 LYS A CE   1 
ATOM   1689 N NZ   . LYS A 1 110 ? -0.08200  -59.21900 -11.16000 1.000 93.02168  ? 108 LYS A NZ   1 
ATOM   1690 H H    . LYS A 1 110 ? -2.99500  -53.95600 -13.61700 1.000 81.38000  ? 108 LYS A H    1 
ATOM   1691 H HA   . LYS A 1 110 ? -1.00800  -55.31800 -12.36300 1.000 93.16000  ? 108 LYS A HA   1 
ATOM   1692 H HB2  . LYS A 1 110 ? -2.95500  -56.37400 -13.62100 1.000 87.86000  ? 108 LYS A HB2  1 
ATOM   1693 H HB3  . LYS A 1 110 ? -1.90600  -56.26100 -14.80500 1.000 87.86000  ? 108 LYS A HB3  1 
ATOM   1694 H HG2  . LYS A 1 110 ? -1.35900  -58.24800 -14.11800 1.000 95.76000  ? 108 LYS A HG2  1 
ATOM   1695 H HG3  . LYS A 1 110 ? -0.44900  -57.42700 -13.10100 1.000 95.76000  ? 108 LYS A HG3  1 
ATOM   1696 H HD2  . LYS A 1 110 ? -2.14000  -57.58900 -11.48700 1.000 101.63000 ? 108 LYS A HD2  1 
ATOM   1697 H HD3  . LYS A 1 110 ? -3.01200  -58.45100 -12.50200 1.000 101.63000 ? 108 LYS A HD3  1 
ATOM   1698 H HE2  . LYS A 1 110 ? -1.97900  -59.89000 -11.02800 1.000 121.31000 ? 108 LYS A HE2  1 
ATOM   1699 H HE3  . LYS A 1 110 ? -1.33500  -60.10700 -12.46700 1.000 121.31000 ? 108 LYS A HE3  1 
ATOM   1700 H HZ1  . LYS A 1 110 ? 0.44800   -58.87900 -11.78900 1.000 112.68000 ? 108 LYS A HZ1  1 
ATOM   1701 H HZ2  . LYS A 1 110 ? -0.14400  -58.63800 -10.48800 1.000 112.68000 ? 108 LYS A HZ2  1 
ATOM   1702 H HZ3  . LYS A 1 110 ? 0.27800   -59.97500 -10.85700 1.000 112.68000 ? 108 LYS A HZ3  1 
ATOM   1703 N N    . ILE A 1 111 ? 0.68500   -53.90300 -13.49700 1.000 71.51647  ? 109 ILE A N    1 
ATOM   1704 C CA   . ILE A 1 111 ? 1.76100   -53.23700 -14.22400 1.000 72.11654  ? 109 ILE A CA   1 
ATOM   1705 C C    . ILE A 1 111 ? 2.94200   -54.20000 -14.26100 1.000 77.67247  ? 109 ILE A C    1 
ATOM   1706 O O    . ILE A 1 111 ? 3.53300   -54.51200 -13.22000 1.000 76.46443  ? 109 ILE A O    1 
ATOM   1707 C CB   . ILE A 1 111 ? 2.15800   -51.90100 -13.57700 1.000 78.08305  ? 109 ILE A CB   1 
ATOM   1708 C CG1  . ILE A 1 111 ? 0.98900   -50.90100 -13.54900 1.000 73.15351  ? 109 ILE A CG1  1 
ATOM   1709 C CG2  . ILE A 1 111 ? 3.36500   -51.28500 -14.29500 1.000 80.67809  ? 109 ILE A CG2  1 
ATOM   1710 C CD1  . ILE A 1 111 ? -0.06100  -51.07900 -14.63700 1.000 75.97753  ? 109 ILE A CD1  1 
ATOM   1711 H H    . ILE A 1 111 ? 0.81300   -53.93200 -12.64700 1.000 86.88000  ? 109 ILE A H    1 
ATOM   1712 H HA   . ILE A 1 111 ? 1.49100   -53.07900 -15.14100 1.000 87.60000  ? 109 ILE A HA   1 
ATOM   1713 H HB   . ILE A 1 111 ? 2.41700   -52.08100 -12.66000 1.000 94.76000  ? 109 ILE A HB   1 
ATOM   1714 H HG12 . ILE A 1 111 ? 0.53700   -50.98400 -12.69500 1.000 88.84000  ? 109 ILE A HG12 1 
ATOM   1715 H HG13 . ILE A 1 111 ? 1.34900   -50.00500 -13.63800 1.000 88.84000  ? 109 ILE A HG13 1 
ATOM   1716 H HG21 . ILE A 1 111 ? 3.56600   -50.42600 -13.89100 1.000 97.87000  ? 109 ILE A HG21 1 
ATOM   1717 H HG22 . ILE A 1 111 ? 4.12900   -51.87400 -14.20900 1.000 97.87000  ? 109 ILE A HG22 1 
ATOM   1718 H HG23 . ILE A 1 111 ? 3.14400   -51.16500 -15.23200 1.000 97.87000  ? 109 ILE A HG23 1 
ATOM   1719 H HD11 . ILE A 1 111 ? -0.58000  -50.26300 -14.70800 1.000 92.23000  ? 109 ILE A HD11 1 
ATOM   1720 H HD12 . ILE A 1 111 ? 0.38400   -51.26000 -15.47600 1.000 92.23000  ? 109 ILE A HD12 1 
ATOM   1721 H HD13 . ILE A 1 111 ? -0.64100  -51.81800 -14.40300 1.000 92.23000  ? 109 ILE A HD13 1 
ATOM   1722 N N    . GLN A 1 112 ? 3.28300   -54.67500 -15.45800 1.000 76.27230  ? 110 GLN A N    1 
ATOM   1723 C CA   . GLN A 1 112 ? 4.44500   -55.53900 -15.66400 1.000 76.82763  ? 110 GLN A CA   1 
ATOM   1724 C C    . GLN A 1 112 ? 4.43900   -56.71400 -14.68800 1.000 77.69616  ? 110 GLN A C    1 
ATOM   1725 O O    . GLN A 1 112 ? 5.44200   -57.03200 -14.04500 1.000 73.34300  ? 110 GLN A O    1 
ATOM   1726 C CB   . GLN A 1 112 ? 5.74300   -54.73700 -15.54700 1.000 82.31250  ? 110 GLN A CB   1 
ATOM   1727 C CG   . GLN A 1 112 ? 5.83100   -53.56200 -16.50700 1.000 81.99404  ? 110 GLN A CG   1 
ATOM   1728 C CD   . GLN A 1 112 ? 7.15700   -53.50900 -17.24000 1.000 90.33715  ? 110 GLN A CD   1 
ATOM   1729 O OE1  . GLN A 1 112 ? 8.15700   -53.02900 -16.70500 1.000 99.44350  ? 110 GLN A OE1  1 
ATOM   1730 N NE2  . GLN A 1 112 ? 7.17200   -54.00600 -18.47300 1.000 114.55584 ? 110 GLN A NE2  1 
ATOM   1731 H H    . GLN A 1 112 ? 2.84800   -54.50700 -16.18100 1.000 92.59000  ? 110 GLN A H    1 
ATOM   1732 H HA   . GLN A 1 112 ? 4.40500   -55.90300 -16.56200 1.000 93.25000  ? 110 GLN A HA   1 
ATOM   1733 H HB2  . GLN A 1 112 ? 5.81400   -54.38800 -14.64500 1.000 99.83000  ? 110 GLN A HB2  1 
ATOM   1734 H HB3  . GLN A 1 112 ? 6.49100   -55.32600 -15.73100 1.000 99.83000  ? 110 GLN A HB3  1 
ATOM   1735 H HG2  . GLN A 1 112 ? 5.12500   -53.63900 -17.16800 1.000 99.45000  ? 110 GLN A HG2  1 
ATOM   1736 H HG3  . GLN A 1 112 ? 5.73000   -52.73700 -16.00700 1.000 99.45000  ? 110 GLN A HG3  1 
ATOM   1737 H HE21 . GLN A 1 112 ? 6.45300   -54.33300 -18.81300 1.000 138.52000 ? 110 GLN A HE21 1 
ATOM   1738 H HE22 . GLN A 1 112 ? 7.90000   -53.99900 -18.93000 1.000 138.52000 ? 110 GLN A HE22 1 
ATOM   1739 N N    . GLY A 1 113 ? 3.28400   -57.36900 -14.58300 1.000 79.18318  ? 111 GLY A N    1 
ATOM   1740 C CA   . GLY A 1 113 ? 3.14000   -58.52300 -13.72300 1.000 68.43452  ? 111 GLY A CA   1 
ATOM   1741 C C    . GLY A 1 113 ? 3.04300   -58.21700 -12.24600 1.000 79.01210  ? 111 GLY A C    1 
ATOM   1742 O O    . GLY A 1 113 ? 2.99700   -59.15600 -11.44100 1.000 86.31298  ? 111 GLY A O    1 
ATOM   1743 H H    . GLY A 1 113 ? 2.56600   -57.15700 -15.00700 1.000 96.08000  ? 111 GLY A H    1 
ATOM   1744 H HA2  . GLY A 1 113 ? 2.34000   -59.00700 -13.98000 1.000 83.18000  ? 111 GLY A HA2  1 
ATOM   1745 H HA3  . GLY A 1 113 ? 3.90100   -59.11000 -13.85600 1.000 83.18000  ? 111 GLY A HA3  1 
ATOM   1746 N N    . ALA A 1 114 ? 3.00800   -56.94500 -11.86200 1.000 66.42639  ? 112 ALA A N    1 
ATOM   1747 C CA   . ALA A 1 114 ? 2.92300   -56.54100 -10.46800 1.000 70.64794  ? 112 ALA A CA   1 
ATOM   1748 C C    . ALA A 1 114 ? 1.62700   -55.77900 -10.22700 1.000 74.32470  ? 112 ALA A C    1 
ATOM   1749 O O    . ALA A 1 114 ? 0.99200   -55.28000 -11.15900 1.000 77.31980  ? 112 ALA A O    1 
ATOM   1750 C CB   . ALA A 1 114 ? 4.12100   -55.67000 -10.06600 1.000 69.82153  ? 112 ALA A CB   1 
ATOM   1751 H H    . ALA A 1 114 ? 3.03300   -56.28100 -12.40800 1.000 80.77000  ? 112 ALA A H    1 
ATOM   1752 H HA   . ALA A 1 114 ? 2.92000   -57.32900 -9.90300  1.000 85.84000  ? 112 ALA A HA   1 
ATOM   1753 H HB1  . ALA A 1 114 ? 4.00600   -55.38000 -9.14700  1.000 84.84000  ? 112 ALA A HB1  1 
ATOM   1754 H HB2  . ALA A 1 114 ? 4.93400   -56.19300 -10.15000 1.000 84.84000  ? 112 ALA A HB2  1 
ATOM   1755 H HB3  . ALA A 1 114 ? 4.16000   -54.90000 -10.65400 1.000 84.84000  ? 112 ALA A HB3  1 
ATOM   1756 N N    . THR A 1 115 ? 1.25000   -55.68600 -8.95500  1.000 70.20052  ? 113 THR A N    1 
ATOM   1757 C CA   . THR A 1 115 ? 0.00200   -55.05800 -8.54200  1.000 70.09261  ? 113 THR A CA   1 
ATOM   1758 C C    . THR A 1 115 ? 0.29700   -53.68600 -7.95200  1.000 75.37219  ? 113 THR A C    1 
ATOM   1759 O O    . THR A 1 115 ? 1.16000   -53.55300 -7.07800  1.000 82.23618  ? 113 THR A O    1 
ATOM   1760 C CB   . THR A 1 115 ? -0.73300  -55.93400 -7.52600  1.000 69.01880  ? 113 THR A CB   1 
ATOM   1761 O OG1  . THR A 1 115 ? -1.37300  -57.02000 -8.20900  1.000 78.83314  ? 113 THR A OG1  1 
ATOM   1762 C CG2  . THR A 1 115 ? -1.77200  -55.12900 -6.77000  1.000 75.35377  ? 113 THR A CG2  1 
ATOM   1763 H H    . THR A 1 115 ? 1.71400   -55.98800 -8.29700  1.000 85.30000  ? 113 THR A H    1 
ATOM   1764 H HA   . THR A 1 115 ? -0.57200  -54.94300 -9.31400  1.000 85.17000  ? 113 THR A HA   1 
ATOM   1765 H HB   . THR A 1 115 ? -0.09600  -56.28800 -6.88600  1.000 83.88000  ? 113 THR A HB   1 
ATOM   1766 H HG1  . THR A 1 115 ? -1.77900  -57.50600 -7.65800  1.000 95.66000  ? 113 THR A HG1  1 
ATOM   1767 H HG21 . THR A 1 115 ? -2.49200  -55.70800 -6.47600  1.000 91.49000  ? 113 THR A HG21 1 
ATOM   1768 H HG22 . THR A 1 115 ? -1.36900  -54.70600 -5.99500  1.000 91.49000  ? 113 THR A HG22 1 
ATOM   1769 H HG23 . THR A 1 115 ? -2.13300  -54.44700 -7.35100  1.000 91.49000  ? 113 THR A HG23 1 
ATOM   1770 N N    . VAL A 1 116 ? -0.42500  -52.67300 -8.42800  1.000 67.54757  ? 114 VAL A N    1 
ATOM   1771 C CA   . VAL A 1 116 ? -0.17400  -51.28600 -8.05500  1.000 77.66984  ? 114 VAL A CA   1 
ATOM   1772 C C    . VAL A 1 116 ? -1.50700  -50.60100 -7.78700  1.000 77.50666  ? 114 VAL A C    1 
ATOM   1773 O O    . VAL A 1 116 ? -2.35700  -50.52500 -8.68500  1.000 77.31190  ? 114 VAL A O    1 
ATOM   1774 C CB   . VAL A 1 116 ? 0.60500   -50.52900 -9.14500  1.000 74.63263  ? 114 VAL A CB   1 
ATOM   1775 C CG1  . VAL A 1 116 ? 0.39200   -49.02700 -9.02400  1.000 72.60344  ? 114 VAL A CG1  1 
ATOM   1776 C CG2  . VAL A 1 116 ? 2.07800   -50.86000 -9.05300  1.000 79.18844  ? 114 VAL A CG2  1 
ATOM   1777 H H    . VAL A 1 116 ? -1.07800  -52.76800 -8.97900  1.000 82.11000  ? 114 VAL A H    1 
ATOM   1778 H HA   . VAL A 1 116 ? 0.34600   -51.26300 -7.23700  1.000 94.26000  ? 114 VAL A HA   1 
ATOM   1779 H HB   . VAL A 1 116 ? 0.28600   -50.81000 -10.01700 1.000 90.62000  ? 114 VAL A HB   1 
ATOM   1780 H HG11 . VAL A 1 116 ? 1.08700   -48.57200 -9.52400  1.000 88.18000  ? 114 VAL A HG11 1 
ATOM   1781 H HG12 . VAL A 1 116 ? -0.47600  -48.79400 -9.38900  1.000 88.18000  ? 114 VAL A HG12 1 
ATOM   1782 H HG13 . VAL A 1 116 ? 0.44200   -48.77200 -8.08900  1.000 88.18000  ? 114 VAL A HG13 1 
ATOM   1783 H HG21 . VAL A 1 116 ? 2.58000   -50.25500 -9.62100  1.000 96.08000  ? 114 VAL A HG21 1 
ATOM   1784 H HG22 . VAL A 1 116 ? 2.35900   -50.76500 -8.13100  1.000 96.08000  ? 114 VAL A HG22 1 
ATOM   1785 H HG23 . VAL A 1 116 ? 2.20900   -51.77600 -9.34200  1.000 96.08000  ? 114 VAL A HG23 1 
ATOM   1786 N N    . GLY A 1 117 ? -1.69000  -50.10800 -6.56900  1.000 78.16200  ? 115 GLY A N    1 
ATOM   1787 C CA   . GLY A 1 117 ? -2.82300  -49.24900 -6.27100  1.000 74.45893  ? 115 GLY A CA   1 
ATOM   1788 C C    . GLY A 1 117 ? -2.50800  -47.82300 -6.68000  1.000 70.99535  ? 115 GLY A C    1 
ATOM   1789 O O    . GLY A 1 117 ? -1.46800  -47.27100 -6.30200  1.000 71.95863  ? 115 GLY A O    1 
ATOM   1790 H H    . GLY A 1 117 ? -1.17200  -50.25700 -5.89900  1.000 94.85000  ? 115 GLY A H    1 
ATOM   1791 H HA2  . GLY A 1 117 ? -3.60600  -49.55100 -6.75700  1.000 90.41000  ? 115 GLY A HA2  1 
ATOM   1792 H HA3  . GLY A 1 117 ? -3.01400  -49.27000 -5.32000  1.000 90.41000  ? 115 GLY A HA3  1 
ATOM   1793 N N    . GLY A 1 118 ? -3.39600  -47.22900 -7.46500  1.000 73.61672  ? 116 GLY A N    1 
ATOM   1794 C CA   . GLY A 1 118 ? -3.16100  -45.88500 -7.94900  1.000 70.88745  ? 116 GLY A CA   1 
ATOM   1795 C C    . GLY A 1 118 ? -4.34700  -45.36900 -8.72700  1.000 68.39767  ? 116 GLY A C    1 
ATOM   1796 O O    . GLY A 1 118 ? -5.45600  -45.89600 -8.61800  1.000 75.05637  ? 116 GLY A O    1 
ATOM   1797 H H    . GLY A 1 118 ? -4.13500  -47.58100 -7.72800  1.000 89.40000  ? 116 GLY A H    1 
ATOM   1798 H HA2  . GLY A 1 118 ? -2.99800  -45.29400 -7.19900  1.000 86.12000  ? 116 GLY A HA2  1 
ATOM   1799 H HA3  . GLY A 1 118 ? -2.38200  -45.87700 -8.52700  1.000 86.12000  ? 116 GLY A HA3  1 
ATOM   1800 N N    . GLN A 1 119 ? -4.09900  -44.32800 -9.52000  1.000 60.11247  ? 117 GLN A N    1 
ATOM   1801 C CA   . GLN A 1 119 ? -5.14300  -43.69100 -10.31000 1.000 68.72929  ? 117 GLN A CA   1 
ATOM   1802 C C    . GLN A 1 119 ? -4.62900  -43.43000 -11.71500 1.000 63.41287  ? 117 GLN A C    1 
ATOM   1803 O O    . GLN A 1 119 ? -3.54600  -42.86500 -11.88900 1.000 64.52879  ? 117 GLN A O    1 
ATOM   1804 C CB   . GLN A 1 119 ? -5.59800  -42.37300 -9.67400  1.000 72.05601  ? 117 GLN A CB   1 
ATOM   1805 C CG   . GLN A 1 119 ? -6.78200  -41.73800 -10.38100 1.000 68.62402  ? 117 GLN A CG   1 
ATOM   1806 C CD   . GLN A 1 119 ? -7.20400  -40.42800 -9.75100  1.000 70.28737  ? 117 GLN A CD   1 
ATOM   1807 O OE1  . GLN A 1 119 ? -6.51400  -39.89200 -8.88400  1.000 70.83218  ? 117 GLN A OE1  1 
ATOM   1808 N NE2  . GLN A 1 119 ? -8.34400  -39.90400 -10.18600 1.000 71.56384  ? 117 GLN A NE2  1 
ATOM   1809 H H    . GLN A 1 119 ? -3.32300  -43.97000 -9.61700  1.000 73.20000  ? 117 GLN A H    1 
ATOM   1810 H HA   . GLN A 1 119 ? -5.91000  -44.28200 -10.37100 1.000 83.53000  ? 117 GLN A HA   1 
ATOM   1811 H HB2  . GLN A 1 119 ? -5.85600  -42.54100 -8.75400  1.000 87.53000  ? 117 GLN A HB2  1 
ATOM   1812 H HB3  . GLN A 1 119 ? -4.86200  -41.74200 -9.70000  1.000 87.53000  ? 117 GLN A HB3  1 
ATOM   1813 H HG2  . GLN A 1 119 ? -6.54300  -41.56000 -11.30400 1.000 83.41000  ? 117 GLN A HG2  1 
ATOM   1814 H HG3  . GLN A 1 119 ? -7.53500  -42.34700 -10.34700 1.000 83.41000  ? 117 GLN A HG3  1 
ATOM   1815 H HE21 . GLN A 1 119 ? -8.79900  -40.30800 -10.79400 1.000 86.93000  ? 117 GLN A HE21 1 
ATOM   1816 H HE22 . GLN A 1 119 ? -8.62800  -39.16100 -9.86000  1.000 86.93000  ? 117 GLN A HE22 1 
ATOM   1817 N N    . MET A 1 120 ? -5.41100  -43.83600 -12.71100 1.000 64.69986  ? 118 MET A N    1 
ATOM   1818 C CA   . MET A 1 120 ? -5.05100  -43.58000 -14.09600 1.000 65.41574  ? 118 MET A CA   1 
ATOM   1819 C C    . MET A 1 120 ? -5.18300  -42.09500 -14.41600 1.000 70.30580  ? 118 MET A C    1 
ATOM   1820 O O    . MET A 1 120 ? -6.00400  -41.37800 -13.83600 1.000 70.93745  ? 118 MET A O    1 
ATOM   1821 C CB   . MET A 1 120 ? -5.94100  -44.39000 -15.03900 1.000 68.37136  ? 118 MET A CB   1 
ATOM   1822 C CG   . MET A 1 120 ? -5.62500  -45.87900 -15.09400 1.000 69.78468  ? 118 MET A CG   1 
ATOM   1823 S SD   . MET A 1 120 ? -6.87600  -46.80900 -16.00700 1.000 71.06115  ? 118 MET A SD   1 
ATOM   1824 C CE   . MET A 1 120 ? -6.64600  -46.15900 -17.66300 1.000 75.61696  ? 118 MET A CE   1 
ATOM   1825 H H    . MET A 1 120 ? -6.15200  -44.26000 -12.60900 1.000 78.70000  ? 118 MET A H    1 
ATOM   1826 H HA   . MET A 1 120 ? -4.13200  -43.85500 -14.24000 1.000 79.56000  ? 118 MET A HA   1 
ATOM   1827 H HB2  . MET A 1 120 ? -6.86300  -44.29600 -14.75100 1.000 83.11000  ? 118 MET A HB2  1 
ATOM   1828 H HB3  . MET A 1 120 ? -5.84200  -44.03600 -15.93600 1.000 83.11000  ? 118 MET A HB3  1 
ATOM   1829 H HG2  . MET A 1 120 ? -4.77100  -46.00700 -15.53700 1.000 84.80000  ? 118 MET A HG2  1 
ATOM   1830 H HG3  . MET A 1 120 ? -5.58800  -46.23000 -14.19000 1.000 84.80000  ? 118 MET A HG3  1 
ATOM   1831 H HE1  . MET A 1 120 ? -7.24600  -46.62100 -18.26900 1.000 91.80000  ? 118 MET A HE1  1 
ATOM   1832 H HE2  . MET A 1 120 ? -6.84500  -45.21000 -17.66000 1.000 91.80000  ? 118 MET A HE2  1 
ATOM   1833 H HE3  . MET A 1 120 ? -5.72600  -46.30400 -17.93400 1.000 91.80000  ? 118 MET A HE3  1 
ATOM   1834 N N    . GLY A 1 121 ? -4.36000  -41.63800 -15.35800 1.000 68.09501  ? 119 GLY A N    1 
ATOM   1835 C CA   . GLY A 1 121 ? -4.43300  -40.27200 -15.83000 1.000 71.98495  ? 119 GLY A CA   1 
ATOM   1836 C C    . GLY A 1 121 ? -4.19900  -40.22000 -17.32600 1.000 70.39791  ? 119 GLY A C    1 
ATOM   1837 O O    . GLY A 1 121 ? -3.66200  -41.15300 -17.92700 1.000 70.23737  ? 119 GLY A O    1 
ATOM   1838 H H    . GLY A 1 121 ? -3.74800  -42.10800 -15.73800 1.000 82.77000  ? 119 GLY A H    1 
ATOM   1839 H HA2  . GLY A 1 121 ? -5.30800  -39.90000 -15.63700 1.000 87.44000  ? 119 GLY A HA2  1 
ATOM   1840 H HA3  . GLY A 1 121 ? -3.75800  -39.73300 -15.38800 1.000 87.44000  ? 119 GLY A HA3  1 
ATOM   1841 N N    . MET A 1 122 ? -4.61300  -39.10500 -17.92200 1.000 77.66721  ? 120 MET A N    1 
ATOM   1842 C CA   . MET A 1 122 ? -4.53000  -38.91200 -19.36700 1.000 80.04381  ? 120 MET A CA   1 
ATOM   1843 C C    . MET A 1 122 ? -3.86800  -37.56800 -19.63700 1.000 75.12216  ? 120 MET A C    1 
ATOM   1844 O O    . MET A 1 122 ? -4.45500  -36.51600 -19.36100 1.000 75.85646  ? 120 MET A O    1 
ATOM   1845 C CB   . MET A 1 122 ? -5.91900  -38.98400 -20.00600 1.000 82.11511  ? 120 MET A CB   1 
ATOM   1846 C CG   . MET A 1 122 ? -5.91700  -38.96300 -21.53000 1.000 80.20172  ? 120 MET A CG   1 
ATOM   1847 S SD   . MET A 1 122 ? -4.74700  -40.12600 -22.26900 1.000 87.58945  ? 120 MET A SD   1 
ATOM   1848 C CE   . MET A 1 122 ? -5.65300  -41.66700 -22.14900 1.000 90.85037  ? 120 MET A CE   1 
ATOM   1849 H H    . MET A 1 122 ? -4.95200  -38.43400 -17.50400 1.000 94.26000  ? 120 MET A H    1 
ATOM   1850 H HA   . MET A 1 122 ? -3.98000  -39.61500 -19.74300 1.000 97.11000  ? 120 MET A HA   1 
ATOM   1851 H HB2  . MET A 1 122 ? -6.34800  -39.80700 -19.72400 1.000 99.59000  ? 120 MET A HB2  1 
ATOM   1852 H HB3  . MET A 1 122 ? -6.44000  -38.22400 -19.70200 1.000 99.59000  ? 120 MET A HB3  1 
ATOM   1853 H HG2  . MET A 1 122 ? -6.80400  -39.19200 -21.84700 1.000 97.30000  ? 120 MET A HG2  1 
ATOM   1854 H HG3  . MET A 1 122 ? -5.68000  -38.07200 -21.83100 1.000 97.30000  ? 120 MET A HG3  1 
ATOM   1855 H HE1  . MET A 1 122 ? -5.11300  -42.38000 -22.52300 1.000 110.08000 ? 120 MET A HE1  1 
ATOM   1856 H HE2  . MET A 1 122 ? -5.84200  -41.85000 -21.21500 1.000 110.08000 ? 120 MET A HE2  1 
ATOM   1857 H HE3  . MET A 1 122 ? -6.48200  -41.58500 -22.64500 1.000 110.08000 ? 120 MET A HE3  1 
ATOM   1858 N N    . LEU A 1 123 ? -2.65000  -37.60300 -20.17200 1.000 76.50917  ? 121 LEU A N    1 
ATOM   1859 C CA   . LEU A 1 123 ? -1.93600  -36.37500 -20.49000 1.000 82.98363  ? 121 LEU A CA   1 
ATOM   1860 C C    . LEU A 1 123 ? -2.62900  -35.63500 -21.62800 1.000 87.64209  ? 121 LEU A C    1 
ATOM   1861 O O    . LEU A 1 123 ? -3.23300  -36.23900 -22.51900 1.000 78.91736  ? 121 LEU A O    1 
ATOM   1862 C CB   . LEU A 1 123 ? -0.48600  -36.67800 -20.86900 1.000 81.15447  ? 121 LEU A CB   1 
ATOM   1863 C CG   . LEU A 1 123 ? 0.36700   -37.39300 -19.81800 1.000 72.78504  ? 121 LEU A CG   1 
ATOM   1864 C CD1  . LEU A 1 123 ? 1.78900   -37.57100 -20.32700 1.000 75.98806  ? 121 LEU A CD1  1 
ATOM   1865 C CD2  . LEU A 1 123 ? 0.36600   -36.64100 -18.49700 1.000 68.57664  ? 121 LEU A CD2  1 
ATOM   1866 H H    . LEU A 1 123 ? -2.21800  -38.32300 -20.35900 1.000 92.87000  ? 121 LEU A H    1 
ATOM   1867 H HA   . LEU A 1 123 ? -1.93400  -35.79600 -19.71200 1.000 100.64000 ? 121 LEU A HA   1 
ATOM   1868 H HB2  . LEU A 1 123 ? -0.48900  -37.23400 -21.66300 1.000 98.44000  ? 121 LEU A HB2  1 
ATOM   1869 H HB3  . LEU A 1 123 ? -0.04500  -35.83800 -21.07000 1.000 98.44000  ? 121 LEU A HB3  1 
ATOM   1870 H HG   . LEU A 1 123 ? -0.00500  -38.27500 -19.65900 1.000 88.40000  ? 121 LEU A HG   1 
ATOM   1871 H HD11 . LEU A 1 123 ? 2.31200   -38.02700 -19.64900 1.000 92.24000  ? 121 LEU A HD11 1 
ATOM   1872 H HD12 . LEU A 1 123 ? 1.76900   -38.09900 -21.14100 1.000 92.24000  ? 121 LEU A HD12 1 
ATOM   1873 H HD13 . LEU A 1 123 ? 2.17100   -36.69800 -20.50800 1.000 92.24000  ? 121 LEU A HD13 1 
ATOM   1874 H HD21 . LEU A 1 123 ? 1.01500   -37.04700 -17.90200 1.000 83.35000  ? 121 LEU A HD21 1 
ATOM   1875 H HD22 . LEU A 1 123 ? 0.60100   -35.71400 -18.66100 1.000 83.35000  ? 121 LEU A HD22 1 
ATOM   1876 H HD23 . LEU A 1 123 ? -0.52000  -36.69400 -18.10700 1.000 83.35000  ? 121 LEU A HD23 1 
ATOM   1877 N N    . LEU A 1 124 ? -2.52700  -34.31000 -21.59400 1.000 91.28463  ? 122 LEU A N    1 
ATOM   1878 C CA   . LEU A 1 124 ? -3.22300  -33.43300 -22.52600 1.000 91.89523  ? 122 LEU A CA   1 
ATOM   1879 C C    . LEU A 1 124 ? -2.19500  -32.73700 -23.40700 1.000 99.15136  ? 122 LEU A C    1 
ATOM   1880 O O    . LEU A 1 124 ? -1.34100  -31.99900 -22.90400 1.000 107.41288 ? 122 LEU A O    1 
ATOM   1881 C CB   . LEU A 1 124 ? -4.07100  -32.40900 -21.77200 1.000 83.30999  ? 122 LEU A CB   1 
ATOM   1882 C CG   . LEU A 1 124 ? -4.81900  -32.94100 -20.54600 1.000 82.76255  ? 122 LEU A CG   1 
ATOM   1883 C CD1  . LEU A 1 124 ? -5.40200  -31.79700 -19.73200 1.000 77.28558  ? 122 LEU A CD1  1 
ATOM   1884 C CD2  . LEU A 1 124 ? -5.91400  -33.91300 -20.95200 1.000 82.44146  ? 122 LEU A CD2  1 
ATOM   1885 H H    . LEU A 1 124 ? -2.04600  -33.88500 -21.02200 1.000 110.60000 ? 122 LEU A H    1 
ATOM   1886 H HA   . LEU A 1 124 ? -3.80900  -33.95800 -23.09300 1.000 111.33000 ? 122 LEU A HA   1 
ATOM   1887 H HB2  . LEU A 1 124 ? -3.49000  -31.69400 -21.47000 1.000 101.03000 ? 122 LEU A HB2  1 
ATOM   1888 H HB3  . LEU A 1 124 ? -4.73400  -32.05100 -22.38300 1.000 101.03000 ? 122 LEU A HB3  1 
ATOM   1889 H HG   . LEU A 1 124 ? -4.19700  -33.41700 -19.97500 1.000 100.37000 ? 122 LEU A HG   1 
ATOM   1890 H HD11 . LEU A 1 124 ? -5.76700  -32.15100 -18.90600 1.000 93.80000  ? 122 LEU A HD11 1 
ATOM   1891 H HD12 . LEU A 1 124 ? -4.69900  -31.15900 -19.53700 1.000 93.80000  ? 122 LEU A HD12 1 
ATOM   1892 H HD13 . LEU A 1 124 ? -6.10300  -31.36900 -20.24800 1.000 93.80000  ? 122 LEU A HD13 1 
ATOM   1893 H HD21 . LEU A 1 124 ? -6.37400  -34.22100 -20.15500 1.000 99.99000  ? 122 LEU A HD21 1 
ATOM   1894 H HD22 . LEU A 1 124 ? -6.53800  -33.45800 -21.53900 1.000 99.99000  ? 122 LEU A HD22 1 
ATOM   1895 H HD23 . LEU A 1 124 ? -5.51300  -34.66500 -21.41400 1.000 99.99000  ? 122 LEU A HD23 1 
ATOM   1896 N N    . THR A 1 125 ? -2.27700  -32.97500 -24.71300 1.000 106.48382 ? 123 THR A N    1 
ATOM   1897 C CA   . THR A 1 125 ? -1.36900  -32.35100 -25.66900 1.000 105.89691 ? 123 THR A CA   1 
ATOM   1898 C C    . THR A 1 125 ? 0.08100   -32.69800 -25.34200 1.000 111.16859 ? 123 THR A C    1 
ATOM   1899 O O    . THR A 1 125 ? 0.66900   -33.59200 -25.95100 1.000 111.86078 ? 123 THR A O    1 
ATOM   1900 C CB   . THR A 1 125 ? -1.52800  -30.81700 -25.68500 1.000 106.17589 ? 123 THR A CB   1 
ATOM   1901 O OG1  . THR A 1 125 ? -2.91400  -30.47600 -25.82100 1.000 107.00493 ? 123 THR A OG1  1 
ATOM   1902 C CG2  . THR A 1 125 ? -0.74500  -30.20600 -26.84100 1.000 105.49686 ? 123 THR A CG2  1 
ATOM   1903 H H    . THR A 1 125 ? -2.85600  -33.49900 -25.07300 1.000 128.84000 ? 123 THR A H    1 
ATOM   1904 H HA   . THR A 1 125 ? -1.56600  -32.68400 -26.55800 1.000 128.13000 ? 123 THR A HA   1 
ATOM   1905 H HB   . THR A 1 125 ? -1.18600  -30.44900 -24.85600 1.000 128.47000 ? 123 THR A HB   1 
ATOM   1906 H HG1  . THR A 1 125 ? -3.00500  -29.64100 -25.83000 1.000 129.46000 ? 123 THR A HG1  1 
ATOM   1907 H HG21 . THR A 1 125 ? 0.20700   -30.32800 -26.70000 1.000 127.65000 ? 123 THR A HG21 1 
ATOM   1908 H HG22 . THR A 1 125 ? -0.99700  -30.63300 -27.67500 1.000 127.65000 ? 123 THR A HG22 1 
ATOM   1909 H HG23 . THR A 1 125 ? -0.93400  -29.25700 -26.90300 1.000 127.65000 ? 123 THR A HG23 1 
ATOM   1910 N N    . LEU A 1 134 ? 6.13100   -32.74400 -23.65000 1.000 99.27243  ? 132 LEU A N    1 
ATOM   1911 C CA   . LEU A 1 134 ? 6.35900   -33.77800 -24.65300 1.000 107.35761 ? 132 LEU A CA   1 
ATOM   1912 C C    . LEU A 1 134 ? 5.89000   -35.14200 -24.15300 1.000 106.53119 ? 132 LEU A C    1 
ATOM   1913 O O    . LEU A 1 134 ? 5.25700   -35.89800 -24.89100 1.000 111.00805 ? 132 LEU A O    1 
ATOM   1914 C CB   . LEU A 1 134 ? 7.84000   -33.84000 -25.03300 1.000 102.09645 ? 132 LEU A CB   1 
ATOM   1915 C CG   . LEU A 1 134 ? 8.36000   -32.68700 -25.89400 1.000 105.86796 ? 132 LEU A CG   1 
ATOM   1916 C CD1  . LEU A 1 134 ? 8.60800   -31.43900 -25.05600 1.000 108.20508 ? 132 LEU A CD1  1 
ATOM   1917 C CD2  . LEU A 1 134 ? 9.62100   -33.10300 -26.63300 1.000 100.25413 ? 132 LEU A CD2  1 
ATOM   1918 H HA   . LEU A 1 134 ? 5.85300   -33.56100 -25.45200 1.000 129.88000 ? 132 LEU A HA   1 
ATOM   1919 H HB2  . LEU A 1 134 ? 8.36400   -33.85200 -24.21700 1.000 123.57000 ? 132 LEU A HB2  1 
ATOM   1920 H HB3  . LEU A 1 134 ? 7.99400   -34.66100 -25.52600 1.000 123.57000 ? 132 LEU A HB3  1 
ATOM   1921 H HG   . LEU A 1 134 ? 7.68800   -32.46700 -26.55800 1.000 128.10000 ? 132 LEU A HG   1 
ATOM   1922 H HD11 . LEU A 1 134 ? 9.06500   -30.78000 -25.60200 1.000 130.90000 ? 132 LEU A HD11 1 
ATOM   1923 H HD12 . LEU A 1 134 ? 7.75700   -31.08400 -24.75500 1.000 130.90000 ? 132 LEU A HD12 1 
ATOM   1924 H HD13 . LEU A 1 134 ? 9.15900   -31.67500 -24.29300 1.000 130.90000 ? 132 LEU A HD13 1 
ATOM   1925 H HD21 . LEU A 1 134 ? 10.29600  -33.35900 -25.98500 1.000 121.36000 ? 132 LEU A HD21 1 
ATOM   1926 H HD22 . LEU A 1 134 ? 9.41500   -33.85400 -27.21100 1.000 121.36000 ? 132 LEU A HD22 1 
ATOM   1927 H HD23 . LEU A 1 134 ? 9.93700   -32.35400 -27.16300 1.000 121.36000 ? 132 LEU A HD23 1 
ATOM   1928 N N    . GLY A 1 135 ? 6.20300   -35.44800 -22.90400 1.000 93.65860  ? 133 GLY A N    1 
ATOM   1929 C CA   . GLY A 1 135 ? 5.80800   -36.71100 -22.31600 1.000 90.77404  ? 133 GLY A CA   1 
ATOM   1930 C C    . GLY A 1 135 ? 6.68400   -37.05200 -21.13000 1.000 91.75837  ? 133 GLY A C    1 
ATOM   1931 O O    . GLY A 1 135 ? 7.57800   -36.29800 -20.74600 1.000 97.04585  ? 133 GLY A O    1 
ATOM   1932 H H    . GLY A 1 135 ? 6.64700   -34.93600 -22.37400 1.000 113.45000 ? 133 GLY A H    1 
ATOM   1933 H HA2  . GLY A 1 135 ? 4.88600   -36.66100 -22.01900 1.000 109.99000 ? 133 GLY A HA2  1 
ATOM   1934 H HA3  . GLY A 1 135 ? 5.88600   -37.41900 -22.97500 1.000 109.99000 ? 133 GLY A HA3  1 
ATOM   1935 N N    . THR A 1 136 ? 6.39900   -38.21500 -20.55200 1.000 80.99129  ? 134 THR A N    1 
ATOM   1936 C CA   . THR A 1 136 ? 7.14700   -38.74100 -19.41900 1.000 78.57521  ? 134 THR A CA   1 
ATOM   1937 C C    . THR A 1 136 ? 8.17700   -39.76200 -19.89200 1.000 78.42519  ? 134 THR A C    1 
ATOM   1938 O O    . THR A 1 136 ? 8.03000   -40.38800 -20.94600 1.000 77.22505  ? 134 THR A O    1 
ATOM   1939 C CB   . THR A 1 136 ? 6.20700   -39.38200 -18.39400 1.000 79.49901  ? 134 THR A CB   1 
ATOM   1940 O OG1  . THR A 1 136 ? 5.50100   -40.47300 -18.99900 1.000 76.44074  ? 134 THR A OG1  1 
ATOM   1941 C CG2  . THR A 1 136 ? 5.20400   -38.35900 -17.87700 1.000 76.34863  ? 134 THR A CG2  1 
ATOM   1942 H H    . THR A 1 136 ? 5.75900   -38.73000 -20.80700 1.000 98.24000  ? 134 THR A H    1 
ATOM   1943 H HA   . THR A 1 136 ? 7.61900   -38.01500 -18.98300 1.000 95.35000  ? 134 THR A HA   1 
ATOM   1944 H HB   . THR A 1 136 ? 6.72500   -39.71000 -17.64200 1.000 96.45000  ? 134 THR A HB   1 
ATOM   1945 H HG1  . THR A 1 136 ? 4.97800   -40.82100 -18.44100 1.000 92.79000  ? 134 THR A HG1  1 
ATOM   1946 H HG21 . THR A 1 136 ? 5.67200   -37.60100 -17.49400 1.000 92.68000  ? 134 THR A HG21 1 
ATOM   1947 H HG22 . THR A 1 136 ? 4.64200   -38.04800 -18.60400 1.000 92.68000  ? 134 THR A HG22 1 
ATOM   1948 H HG23 . THR A 1 136 ? 4.64300   -38.76100 -17.19500 1.000 92.68000  ? 134 THR A HG23 1 
ATOM   1949 N N    . THR A 1 137 ? 9.23300   -39.92400 -19.09000 1.000 76.77499  ? 135 THR A N    1 
ATOM   1950 C CA   . THR A 1 137 ? 10.35700  -40.77900 -19.45500 1.000 76.17492  ? 135 THR A CA   1 
ATOM   1951 C C    . THR A 1 137 ? 10.85600  -41.55800 -18.24400 1.000 72.20076  ? 135 THR A C    1 
ATOM   1952 O O    . THR A 1 137 ? 10.44800  -41.27200 -17.11100 1.000 66.35006  ? 135 THR A O    1 
ATOM   1953 C CB   . THR A 1 137 ? 11.50700  -39.94600 -20.02900 1.000 69.89259  ? 135 THR A CB   1 
ATOM   1954 O OG1  . THR A 1 137 ? 12.06800  -39.12800 -18.99300 1.000 75.68276  ? 135 THR A OG1  1 
ATOM   1955 C CG2  . THR A 1 137 ? 11.01900  -39.05700 -21.15800 1.000 78.28833  ? 135 THR A CG2  1 
ATOM   1956 H H    . THR A 1 137 ? 9.31900   -39.54500 -18.32300 1.000 93.19000  ? 135 THR A H    1 
ATOM   1957 H HA   . THR A 1 137 ? 10.07200  -41.41300 -20.13100 1.000 92.46000  ? 135 THR A HA   1 
ATOM   1958 H HB   . THR A 1 137 ? 12.19200  -40.53500 -20.38000 1.000 84.93000  ? 135 THR A HB   1 
ATOM   1959 H HG1  . THR A 1 137 ? 12.70000  -38.66800 -19.30100 1.000 91.88000  ? 135 THR A HG1  1 
ATOM   1960 H HG21 . THR A 1 137 ? 10.58500  -39.59500 -21.83900 1.000 95.00000  ? 135 THR A HG21 1 
ATOM   1961 H HG22 . THR A 1 137 ? 10.38600  -38.40600 -20.82000 1.000 95.00000  ? 135 THR A HG22 1 
ATOM   1962 H HG23 . THR A 1 137 ? 11.76900  -38.58800 -21.55700 1.000 95.00000  ? 135 THR A HG23 1 
ATOM   1963 N N    . PRO A 1 138 ? 11.73400  -42.54300 -18.43500 1.000 67.47651  ? 136 PRO A N    1 
ATOM   1964 C CA   . PRO A 1 138 ? 12.34800  -43.20400 -17.27700 1.000 68.25029  ? 136 PRO A CA   1 
ATOM   1965 C C    . PRO A 1 138 ? 13.15500  -42.21200 -16.45200 1.000 74.21153  ? 136 PRO A C    1 
ATOM   1966 O O    . PRO A 1 138 ? 13.84300  -41.34100 -16.98800 1.000 71.97442  ? 136 PRO A O    1 
ATOM   1967 C CB   . PRO A 1 138 ? 13.24000  -44.27900 -17.90900 1.000 69.58466  ? 136 PRO A CB   1 
ATOM   1968 C CG   . PRO A 1 138 ? 12.65300  -44.51700 -19.26400 1.000 65.91053  ? 136 PRO A CG   1 
ATOM   1969 C CD   . PRO A 1 138 ? 12.11900  -43.18500 -19.70500 1.000 68.51348  ? 136 PRO A CD   1 
ATOM   1970 H HA   . PRO A 1 138 ? 11.67000  -43.62100 -16.72600 1.000 82.96000  ? 136 PRO A HA   1 
ATOM   1971 H HB2  . PRO A 1 138 ? 14.14900  -43.94900 -17.98100 1.000 84.56000  ? 136 PRO A HB2  1 
ATOM   1972 H HB3  . PRO A 1 138 ? 13.20800  -45.08700 -17.37400 1.000 84.56000  ? 136 PRO A HB3  1 
ATOM   1973 H HG2  . PRO A 1 138 ? 13.34500  -44.82600 -19.87000 1.000 80.15000  ? 136 PRO A HG2  1 
ATOM   1974 H HG3  . PRO A 1 138 ? 11.93700  -45.16900 -19.20000 1.000 80.15000  ? 136 PRO A HG3  1 
ATOM   1975 H HD2  . PRO A 1 138 ? 12.81400  -42.67400 -20.14800 1.000 83.27000  ? 136 PRO A HD2  1 
ATOM   1976 H HD3  . PRO A 1 138 ? 11.34400  -43.30400 -20.27500 1.000 83.27000  ? 136 PRO A HD3  1 
ATOM   1977 N N    . GLY A 1 139 ? 13.06700  -42.35800 -15.13200 1.000 74.22469  ? 137 GLY A N    1 
ATOM   1978 C CA   . GLY A 1 139 ? 13.62400  -41.39500 -14.20700 1.000 68.10817  ? 137 GLY A CA   1 
ATOM   1979 C C    . GLY A 1 139 ? 12.62900  -40.37600 -13.69800 1.000 69.51623  ? 137 GLY A C    1 
ATOM   1980 O O    . GLY A 1 139 ? 13.00900  -39.50300 -12.90700 1.000 57.47794  ? 137 GLY A O    1 
ATOM   1981 H H    . GLY A 1 139 ? 12.68100  -43.02200 -14.74700 1.000 90.13000  ? 137 GLY A H    1 
ATOM   1982 H HA2  . GLY A 1 139 ? 13.98900  -41.86600 -13.44200 1.000 82.79000  ? 137 GLY A HA2  1 
ATOM   1983 H HA3  . GLY A 1 139 ? 14.34900  -40.91800 -14.64100 1.000 82.79000  ? 137 GLY A HA3  1 
ATOM   1984 N N    . ASP A 1 140 ? 11.36700  -40.46300 -14.12100 1.000 73.57724  ? 138 ASP A N    1 
ATOM   1985 C CA   . ASP A 1 140 ? 10.33600  -39.52800 -13.69900 1.000 67.08173  ? 138 ASP A CA   1 
ATOM   1986 C C    . ASP A 1 140 ? 9.51000   -40.02600 -12.52000 1.000 61.14681  ? 138 ASP A C    1 
ATOM   1987 O O    . ASP A 1 140 ? 8.79500   -39.22600 -11.90900 1.000 62.16008  ? 138 ASP A O    1 
ATOM   1988 C CB   . ASP A 1 140 ? 9.39300   -39.21500 -14.86800 1.000 65.92369  ? 138 ASP A CB   1 
ATOM   1989 C CG   . ASP A 1 140 ? 10.07200  -38.42700 -15.97300 1.000 70.54530  ? 138 ASP A CG   1 
ATOM   1990 O OD1  . ASP A 1 140 ? 11.26900  -38.10100 -15.82700 1.000 68.70561  ? 138 ASP A OD1  1 
ATOM   1991 O OD2  . ASP A 1 140 ? 9.40800   -38.12900 -16.98800 1.000 67.31597  ? 138 ASP A OD2  1 
ATOM   1992 H H    . ASP A 1 140 ? 11.08200  -41.06700 -14.66200 1.000 89.35000  ? 138 ASP A H    1 
ATOM   1993 H HA   . ASP A 1 140 ? 10.75900  -38.69700 -13.43200 1.000 81.56000  ? 138 ASP A HA   1 
ATOM   1994 H HB2  . ASP A 1 140 ? 9.07200   -40.04800 -15.24700 1.000 80.17000  ? 138 ASP A HB2  1 
ATOM   1995 H HB3  . ASP A 1 140 ? 8.64600   -38.69000 -14.54000 1.000 80.17000  ? 138 ASP A HB3  1 
ATOM   1996 N N    . CYS A 1 141 ? 9.58100   -41.31300 -12.18800 1.000 66.05529  ? 139 CYS A N    1 
ATOM   1997 C CA   . CYS A 1 141 ? 8.83500   -41.81700 -11.04400 1.000 71.52173  ? 139 CYS A CA   1 
ATOM   1998 C C    . CYS A 1 141 ? 9.20800   -41.04500 -9.78400  1.000 64.12611  ? 139 CYS A C    1 
ATOM   1999 O O    . CYS A 1 141 ? 10.32200  -40.53300 -9.64600  1.000 61.32841  ? 139 CYS A O    1 
ATOM   2000 C CB   . CYS A 1 141 ? 9.10500   -43.30500 -10.84000 1.000 69.40306  ? 139 CYS A CB   1 
ATOM   2001 S SG   . CYS A 1 141 ? 8.28100   -44.37600 -12.02200 1.000 68.30029  ? 139 CYS A SG   1 
ATOM   2002 H H    . CYS A 1 141 ? 10.04700  -41.90500 -12.60300 1.000 80.32000  ? 139 CYS A H    1 
ATOM   2003 H HA   . CYS A 1 141 ? 7.88600   -41.69900 -11.20400 1.000 86.89000  ? 139 CYS A HA   1 
ATOM   2004 H HB2  . CYS A 1 141 ? 10.05900  -43.46100 -10.91700 1.000 84.34000  ? 139 CYS A HB2  1 
ATOM   2005 H HB3  . CYS A 1 141 ? 8.80300   -43.55700 -9.95300  1.000 84.34000  ? 139 CYS A HB3  1 
ATOM   2006 H HG   . CYS A 1 141 ? 8.54800   -45.51800 -11.76700 1.000 83.02000  ? 139 CYS A HG   1 
ATOM   2007 N N    . GLY A 1 142 ? 8.26000   -40.97300 -8.85400  1.000 67.01067  ? 140 GLY A N    1 
ATOM   2008 C CA   . GLY A 1 142 ? 8.42900   -40.21700 -7.63900  1.000 70.45318  ? 140 GLY A CA   1 
ATOM   2009 C C    . GLY A 1 142 ? 7.95400   -38.78400 -7.72100  1.000 67.59231  ? 140 GLY A C    1 
ATOM   2010 O O    . GLY A 1 142 ? 7.69200   -38.17200 -6.67900  1.000 67.00014  ? 140 GLY A O    1 
ATOM   2011 H H    . GLY A 1 142 ? 7.49700   -41.36500 -8.91400  1.000 81.47000  ? 140 GLY A H    1 
ATOM   2012 H HA2  . GLY A 1 142 ? 7.94000   -40.65400 -6.92500  1.000 85.60000  ? 140 GLY A HA2  1 
ATOM   2013 H HA3  . GLY A 1 142 ? 9.36800   -40.21000 -7.39900  1.000 85.60000  ? 140 GLY A HA3  1 
ATOM   2014 N N    . CYS A 1 143 ? 7.83200   -38.23100 -8.92300  1.000 63.71027  ? 141 CYS A N    1 
ATOM   2015 C CA   . CYS A 1 143 ? 7.34700   -36.86900 -9.05800  1.000 73.78516  ? 141 CYS A CA   1 
ATOM   2016 C C    . CYS A 1 143 ? 5.86800   -36.79900 -8.68400  1.000 66.74221  ? 141 CYS A C    1 
ATOM   2017 O O    . CYS A 1 143 ? 5.11200   -37.74300 -8.92400  1.000 61.16786  ? 141 CYS A O    1 
ATOM   2018 C CB   . CYS A 1 143 ? 7.55400   -36.36800 -10.48100 1.000 69.36621  ? 141 CYS A CB   1 
ATOM   2019 S SG   . CYS A 1 143 ? 9.28900   -36.11700 -10.89900 1.000 86.47879  ? 141 CYS A SG   1 
ATOM   2020 H H    . CYS A 1 143 ? 8.02200   -38.62000 -9.66600  1.000 77.51000  ? 141 CYS A H    1 
ATOM   2021 H HA   . CYS A 1 143 ? 7.85600   -36.30300 -8.45900  1.000 89.60000  ? 141 CYS A HA   1 
ATOM   2022 H HB2  . CYS A 1 143 ? 7.19000   -37.02000 -11.10000 1.000 84.30000  ? 141 CYS A HB2  1 
ATOM   2023 H HB3  . CYS A 1 143 ? 7.09400   -35.52100 -10.58600 1.000 84.30000  ? 141 CYS A HB3  1 
ATOM   2024 H HG   . CYS A 1 143 ? 9.86500   -37.16400 -10.79400 1.000 104.83000 ? 141 CYS A HG   1 
ATOM   2025 N N    . PRO A 1 144 ? 5.43000   -35.68800 -8.10000  1.000 69.36621  ? 142 PRO A N    1 
ATOM   2026 C CA   . PRO A 1 144 ? 4.08400   -35.63000 -7.52700  1.000 63.55236  ? 142 PRO A CA   1 
ATOM   2027 C C    . PRO A 1 144 ? 3.00900   -35.20000 -8.51100  1.000 58.65703  ? 142 PRO A C    1 
ATOM   2028 O O    . PRO A 1 144 ? 3.25400   -34.49500 -9.49100  1.000 58.91233  ? 142 PRO A O    1 
ATOM   2029 C CB   . PRO A 1 144 ? 4.24600   -34.58000 -6.41800  1.000 65.22361  ? 142 PRO A CB   1 
ATOM   2030 C CG   . PRO A 1 144 ? 5.23400   -33.62000 -7.00500  1.000 68.92669  ? 142 PRO A CG   1 
ATOM   2031 C CD   . PRO A 1 144 ? 6.19100   -34.45300 -7.83000  1.000 66.84749  ? 142 PRO A CD   1 
ATOM   2032 H HA   . PRO A 1 144 ? 3.84400   -36.48300 -7.13300  1.000 77.32000  ? 142 PRO A HA   1 
ATOM   2033 H HB2  . PRO A 1 144 ? 3.39700   -34.14500 -6.24500  1.000 79.33000  ? 142 PRO A HB2  1 
ATOM   2034 H HB3  . PRO A 1 144 ? 4.59700   -34.99500 -5.61500  1.000 79.33000  ? 142 PRO A HB3  1 
ATOM   2035 H HG2  . PRO A 1 144 ? 4.76900   -32.98100 -7.56700  1.000 83.77000  ? 142 PRO A HG2  1 
ATOM   2036 H HG3  . PRO A 1 144 ? 5.70800   -33.16400 -6.29400  1.000 83.77000  ? 142 PRO A HG3  1 
ATOM   2037 H HD2  . PRO A 1 144 ? 6.39900   -34.00200 -8.66100  1.000 81.27000  ? 142 PRO A HD2  1 
ATOM   2038 H HD3  . PRO A 1 144 ? 6.99100   -34.64800 -7.31800  1.000 81.27000  ? 142 PRO A HD3  1 
ATOM   2039 N N    . TYR A 1 145 ? 1.79300   -35.65200 -8.22300  1.000 68.08448  ? 143 TYR A N    1 
ATOM   2040 C CA   . TYR A 1 145 ? 0.58400   -35.15100 -8.86100  1.000 69.59782  ? 143 TYR A CA   1 
ATOM   2041 C C    . TYR A 1 145 ? -0.10700  -34.20100 -7.89200  1.000 67.85550  ? 143 TYR A C    1 
ATOM   2042 O O    . TYR A 1 145 ? -0.34200  -34.55700 -6.73200  1.000 69.81363  ? 143 TYR A O    1 
ATOM   2043 C CB   . TYR A 1 145 ? -0.36000  -36.29500 -9.23500  1.000 62.78648  ? 143 TYR A CB   1 
ATOM   2044 C CG   . TYR A 1 145 ? 0.09900   -37.13400 -10.40600 1.000 65.08412  ? 143 TYR A CG   1 
ATOM   2045 C CD1  . TYR A 1 145 ? 1.09200   -38.09200 -10.25300 1.000 65.63945  ? 143 TYR A CD1  1 
ATOM   2046 C CD2  . TYR A 1 145 ? -0.47500  -36.98200 -11.66100 1.000 61.69161  ? 143 TYR A CD2  1 
ATOM   2047 C CE1  . TYR A 1 145 ? 1.50700   -38.86700 -11.31900 1.000 62.16272  ? 143 TYR A CE1  1 
ATOM   2048 C CE2  . TYR A 1 145 ? -0.06600  -37.75200 -12.73200 1.000 69.57150  ? 143 TYR A CE2  1 
ATOM   2049 C CZ   . TYR A 1 145 ? 0.92500   -38.69300 -12.55600 1.000 64.87620  ? 143 TYR A CZ   1 
ATOM   2050 O OH   . TYR A 1 145 ? 1.33700   -39.46400 -13.61900 1.000 63.77080  ? 143 TYR A OH   1 
ATOM   2051 H H    . TYR A 1 145 ? 1.64000   -36.26800 -7.64300  1.000 82.76000  ? 143 TYR A H    1 
ATOM   2052 H HA   . TYR A 1 145 ? 0.81500   -34.66200 -9.66600  1.000 84.57000  ? 143 TYR A HA   1 
ATOM   2053 H HB2  . TYR A 1 145 ? -0.45100  -36.88400 -8.47000  1.000 76.40000  ? 143 TYR A HB2  1 
ATOM   2054 H HB3  . TYR A 1 145 ? -1.22500  -35.92000 -9.46300  1.000 76.40000  ? 143 TYR A HB3  1 
ATOM   2055 H HD1  . TYR A 1 145 ? 1.48700   -38.21200 -9.42000  1.000 79.83000  ? 143 TYR A HD1  1 
ATOM   2056 H HD2  . TYR A 1 145 ? -1.14400  -36.34800 -11.78300 1.000 75.09000  ? 143 TYR A HD2  1 
ATOM   2057 H HE1  . TYR A 1 145 ? 2.17500   -39.50200 -11.20200 1.000 75.65000  ? 143 TYR A HE1  1 
ATOM   2058 H HE2  . TYR A 1 145 ? -0.45800  -37.63600 -13.56800 1.000 84.54000  ? 143 TYR A HE2  1 
ATOM   2059 H HH   . TYR A 1 145 ? 0.90400   -39.25700 -14.30900 1.000 77.58000  ? 143 TYR A HH   1 
ATOM   2060 N N    . ILE A 1 146 ? -0.42500  -32.99600 -8.36000  1.000 69.71625  ? 144 ILE A N    1 
ATOM   2061 C CA   . ILE A 1 146 ? -1.06400  -31.98600 -7.52600  1.000 68.53716  ? 144 ILE A CA   1 
ATOM   2062 C C    . ILE A 1 146 ? -2.16700  -31.30600 -8.32500  1.000 68.32135  ? 144 ILE A C    1 
ATOM   2063 O O    . ILE A 1 146 ? -2.08000  -31.16500 -9.54800  1.000 68.92932  ? 144 ILE A O    1 
ATOM   2064 C CB   . ILE A 1 146 ? -0.05300  -30.94000 -7.00000  1.000 67.04488  ? 144 ILE A CB   1 
ATOM   2065 C CG1  . ILE A 1 146 ? 0.70900   -30.28700 -8.15600  1.000 74.32470  ? 144 ILE A CG1  1 
ATOM   2066 C CG2  . ILE A 1 146 ? 0.92000   -31.57900 -6.01800  1.000 73.06929  ? 144 ILE A CG2  1 
ATOM   2067 C CD1  . ILE A 1 146 ? 0.29700   -28.85500 -8.42600  1.000 74.43787  ? 144 ILE A CD1  1 
ATOM   2068 H H    . ILE A 1 146 ? -0.27900  -32.73900 -9.16700  1.000 84.72000  ? 144 ILE A H    1 
ATOM   2069 H HA   . ILE A 1 146 ? -1.47200  -32.42000 -6.76100  1.000 83.30000  ? 144 ILE A HA   1 
ATOM   2070 H HB   . ILE A 1 146 ? -0.54700  -30.24800 -6.53200  1.000 81.51000  ? 144 ILE A HB   1 
ATOM   2071 H HG12 . ILE A 1 146 ? 1.65600   -30.28800 -7.94600  1.000 90.25000  ? 144 ILE A HG12 1 
ATOM   2072 H HG13 . ILE A 1 146 ? 0.55400   -30.79300 -8.96800  1.000 90.25000  ? 144 ILE A HG13 1 
ATOM   2073 H HG21 . ILE A 1 146 ? 1.58600   -30.92200 -5.76100  1.000 88.74000  ? 144 ILE A HG21 1 
ATOM   2074 H HG22 . ILE A 1 146 ? 0.42900   -31.87300 -5.23600  1.000 88.74000  ? 144 ILE A HG22 1 
ATOM   2075 H HG23 . ILE A 1 146 ? 1.35000   -32.33600 -6.44500  1.000 88.74000  ? 144 ILE A HG23 1 
ATOM   2076 H HD11 . ILE A 1 146 ? 0.81500   -28.51200 -9.17100  1.000 90.38000  ? 144 ILE A HD11 1 
ATOM   2077 H HD12 . ILE A 1 146 ? -0.64800  -28.83500 -8.64300  1.000 90.38000  ? 144 ILE A HD12 1 
ATOM   2078 H HD13 . ILE A 1 146 ? 0.46700   -28.32300 -7.63300  1.000 90.38000  ? 144 ILE A HD13 1 
ATOM   2079 N N    . TYR A 1 147 ? -3.22200  -30.90000 -7.61900  1.000 74.81160  ? 145 TYR A N    1 
ATOM   2080 C CA   . TYR A 1 147 ? -4.29600  -30.10700 -8.20100  1.000 81.16499  ? 145 TYR A CA   1 
ATOM   2081 C C    . TYR A 1 147 ? -4.74900  -29.07700 -7.17700  1.000 82.39672  ? 145 TYR A C    1 
ATOM   2082 O O    . TYR A 1 147 ? -4.64000  -29.29200 -5.96600  1.000 78.64890  ? 145 TYR A O    1 
ATOM   2083 C CB   . TYR A 1 147 ? -5.47800  -30.98400 -8.65200  1.000 79.01737  ? 145 TYR A CB   1 
ATOM   2084 C CG   . TYR A 1 147 ? -6.35500  -31.50200 -7.53200  1.000 74.61684  ? 145 TYR A CG   1 
ATOM   2085 C CD1  . TYR A 1 147 ? -6.03400  -32.66900 -6.85100  1.000 76.04859  ? 145 TYR A CD1  1 
ATOM   2086 C CD2  . TYR A 1 147 ? -7.51600  -30.83300 -7.17100  1.000 75.67223  ? 145 TYR A CD2  1 
ATOM   2087 C CE1  . TYR A 1 147 ? -6.83900  -33.14700 -5.83200  1.000 70.10314  ? 145 TYR A CE1  1 
ATOM   2088 C CE2  . TYR A 1 147 ? -8.32600  -31.30300 -6.15500  1.000 80.66230  ? 145 TYR A CE2  1 
ATOM   2089 C CZ   . TYR A 1 147 ? -7.98400  -32.46000 -5.49000  1.000 74.20363  ? 145 TYR A CZ   1 
ATOM   2090 O OH   . TYR A 1 147 ? -8.79100  -32.92800 -4.47800  1.000 78.61206  ? 145 TYR A OH   1 
ATOM   2091 H H    . TYR A 1 147 ? -3.33800  -31.07600 -6.78500  1.000 90.83000  ? 145 TYR A H    1 
ATOM   2092 H HA   . TYR A 1 147 ? -3.95800  -29.63300 -8.97700  1.000 98.45000  ? 145 TYR A HA   1 
ATOM   2093 H HB2  . TYR A 1 147 ? -6.04000  -30.46200 -9.24600  1.000 95.88000  ? 145 TYR A HB2  1 
ATOM   2094 H HB3  . TYR A 1 147 ? -5.12700  -31.75300 -9.12800  1.000 95.88000  ? 145 TYR A HB3  1 
ATOM   2095 H HD1  . TYR A 1 147 ? -5.26200  -33.13400 -7.08000  1.000 92.32000  ? 145 TYR A HD1  1 
ATOM   2096 H HD2  . TYR A 1 147 ? -7.75000  -30.05100 -7.61700  1.000 91.86000  ? 145 TYR A HD2  1 
ATOM   2097 H HE1  . TYR A 1 147 ? -6.61000  -33.92800 -5.38200  1.000 85.19000  ? 145 TYR A HE1  1 
ATOM   2098 H HE2  . TYR A 1 147 ? -9.09900  -30.84100 -5.92200  1.000 97.85000  ? 145 TYR A HE2  1 
ATOM   2099 H HH   . TYR A 1 147 ? -8.47000  -33.63500 -4.15800  1.000 95.39000  ? 145 TYR A HH   1 
ATOM   2100 N N    . LYS A 1 148 ? -5.24900  -27.94800 -7.67400  1.000 81.19658  ? 146 LYS A N    1 
ATOM   2101 C CA   . LYS A 1 148 ? -5.64400  -26.83100 -6.82600  1.000 85.97347  ? 146 LYS A CA   1 
ATOM   2102 C C    . LYS A 1 148 ? -7.11600  -26.96500 -6.45300  1.000 84.60225  ? 146 LYS A C    1 
ATOM   2103 O O    . LYS A 1 148 ? -7.98000  -27.04600 -7.33200  1.000 72.19287  ? 146 LYS A O    1 
ATOM   2104 C CB   . LYS A 1 148 ? -5.38900  -25.50400 -7.53900  1.000 82.45725  ? 146 LYS A CB   1 
ATOM   2105 C CG   . LYS A 1 148 ? -5.69900  -24.27300 -6.70200  1.000 88.97909  ? 146 LYS A CG   1 
ATOM   2106 C CD   . LYS A 1 148 ? -4.59000  -23.23900 -6.80300  1.000 92.40845  ? 146 LYS A CD   1 
ATOM   2107 C CE   . LYS A 1 148 ? -5.05700  -21.87400 -6.32600  1.000 104.55727 ? 146 LYS A CE   1 
ATOM   2108 N NZ   . LYS A 1 148 ? -5.69900  -21.09100 -7.41800  1.000 97.29588  ? 146 LYS A NZ   1 
ATOM   2109 H H    . LYS A 1 148 ? -5.37000  -27.80400 -8.51300  1.000 98.49000  ? 146 LYS A H    1 
ATOM   2110 H HA   . LYS A 1 148 ? -5.12000  -26.84500 -6.01000  1.000 104.23000 ? 146 LYS A HA   1 
ATOM   2111 H HB2  . LYS A 1 148 ? -4.45300  -25.46200 -7.79100  1.000 100.01000 ? 146 LYS A HB2  1 
ATOM   2112 H HB3  . LYS A 1 148 ? -5.94300  -25.46700 -8.33400  1.000 100.01000 ? 146 LYS A HB3  1 
ATOM   2113 H HG2  . LYS A 1 148 ? -6.52200  -23.86900 -7.01900  1.000 107.83000 ? 146 LYS A HG2  1 
ATOM   2114 H HG3  . LYS A 1 148 ? -5.78900  -24.53200 -5.77200  1.000 107.83000 ? 146 LYS A HG3  1 
ATOM   2115 H HD2  . LYS A 1 148 ? -3.85200  -23.51600 -6.24100  1.000 111.95000 ? 146 LYS A HD2  1 
ATOM   2116 H HD3  . LYS A 1 148 ? -4.30300  -23.16000 -7.72600  1.000 111.95000 ? 146 LYS A HD3  1 
ATOM   2117 H HE2  . LYS A 1 148 ? -5.70700  -21.99000 -5.61500  1.000 126.53000 ? 146 LYS A HE2  1 
ATOM   2118 H HE3  . LYS A 1 148 ? -4.29300  -21.37100 -6.00200  1.000 126.53000 ? 146 LYS A HE3  1 
ATOM   2119 H HZ1  . LYS A 1 148 ? -5.96200  -20.29800 -7.11000  1.000 117.81000 ? 146 LYS A HZ1  1 
ATOM   2120 H HZ2  . LYS A 1 148 ? -5.12100  -20.96600 -8.08300  1.000 117.81000 ? 146 LYS A HZ2  1 
ATOM   2121 H HZ3  . LYS A 1 148 ? -6.40800  -21.52900 -7.73000  1.000 117.81000 ? 146 LYS A HZ3  1 
ATOM   2122 N N    . ARG A 1 149 ? -7.39800  -26.97200 -5.15100  1.000 81.99141  ? 147 ARG A N    1 
ATOM   2123 C CA   . ARG A 1 149 ? -8.75700  -27.09500 -4.62600  1.000 88.98962  ? 147 ARG A CA   1 
ATOM   2124 C C    . ARG A 1 149 ? -9.06900  -25.82800 -3.83800  1.000 89.32913  ? 147 ARG A C    1 
ATOM   2125 O O    . ARG A 1 149 ? -8.60200  -25.65900 -2.70700  1.000 84.34696  ? 147 ARG A O    1 
ATOM   2126 C CB   . ARG A 1 149 ? -8.89400  -28.34400 -3.76000  1.000 83.79952  ? 147 ARG A CB   1 
ATOM   2127 C CG   . ARG A 1 149 ? -10.27900 -28.54200 -3.15900  1.000 79.25424  ? 147 ARG A CG   1 
ATOM   2128 C CD   . ARG A 1 149 ? -10.45700 -29.96100 -2.63300  1.000 83.93901  ? 147 ARG A CD   1 
ATOM   2129 N NE   . ARG A 1 149 ? -9.73700  -30.19100 -1.38600  1.000 84.19694  ? 147 ARG A NE   1 
ATOM   2130 C CZ   . ARG A 1 149 ? -9.48200  -31.39000 -0.87800  1.000 81.73348  ? 147 ARG A CZ   1 
ATOM   2131 N NH1  . ARG A 1 149 ? -9.85100  -32.49700 -1.50200  1.000 86.66565  ? 147 ARG A NH1  1 
ATOM   2132 N NH2  . ARG A 1 149 ? -8.83500  -31.48000 0.28100   1.000 80.17803  ? 147 ARG A NH2  1 
ATOM   2133 H H    . ARG A 1 149 ? -6.80100  -26.90500 -4.53500  1.000 99.45000  ? 147 ARG A H    1 
ATOM   2134 H HA   . ARG A 1 149 ? -9.38600  -27.16200 -5.36100  1.000 107.84000 ? 147 ARG A HA   1 
ATOM   2135 H HB2  . ARG A 1 149 ? -8.69400  -29.12200 -4.30400  1.000 101.62000 ? 147 ARG A HB2  1 
ATOM   2136 H HB3  . ARG A 1 149 ? -8.26100  -28.28500 -3.02800  1.000 101.62000 ? 147 ARG A HB3  1 
ATOM   2137 H HG2  . ARG A 1 149 ? -10.39900 -27.92600 -2.41900  1.000 96.16000  ? 147 ARG A HG2  1 
ATOM   2138 H HG3  . ARG A 1 149 ? -10.95000 -28.38400 -3.84100  1.000 96.16000  ? 147 ARG A HG3  1 
ATOM   2139 H HD2  . ARG A 1 149 ? -11.40000 -30.12200 -2.46900  1.000 101.78000 ? 147 ARG A HD2  1 
ATOM   2140 H HD3  . ARG A 1 149 ? -10.12300 -30.58800 -3.29400  1.000 101.78000 ? 147 ARG A HD3  1 
ATOM   2141 H HE   . ARG A 1 149 ? -9.45900  -29.50300 -0.95100  1.000 102.09000 ? 147 ARG A HE   1 
ATOM   2142 H HH11 . ARG A 1 149 ? -10.27000 -32.45200 -2.25100  1.000 105.05000 ? 147 ARG A HH11 1 
ATOM   2143 H HH12 . ARG A 1 149 ? -9.67500  -33.26400 -1.15500  1.000 105.05000 ? 147 ARG A HH12 1 
ATOM   2144 H HH21 . ARG A 1 149 ? -8.59000  -30.76600 0.69300   1.000 97.27000  ? 147 ARG A HH21 1 
ATOM   2145 H HH22 . ARG A 1 149 ? -8.66300  -32.25200 0.61900   1.000 97.27000  ? 147 ARG A HH22 1 
ATOM   2146 N N    . GLY A 1 150 ? -9.86200  -24.93800 -4.42600  1.000 91.98998  ? 148 GLY A N    1 
ATOM   2147 C CA   . GLY A 1 150 ? -10.08800 -23.65200 -3.80400  1.000 89.10016  ? 148 GLY A CA   1 
ATOM   2148 C C    . GLY A 1 150 ? -8.78800  -22.87600 -3.78000  1.000 94.40342  ? 148 GLY A C    1 
ATOM   2149 O O    . GLY A 1 150 ? -8.19200  -22.60200 -4.82800  1.000 95.74043  ? 148 GLY A O    1 
ATOM   2150 H H    . GLY A 1 150 ? -10.27200 -25.05600 -5.17300  1.000 111.45000 ? 148 GLY A H    1 
ATOM   2151 H HA2  . GLY A 1 150 ? -10.74900 -23.15000 -4.30600  1.000 107.98000 ? 148 GLY A HA2  1 
ATOM   2152 H HA3  . GLY A 1 150 ? -10.40300 -23.77200 -2.89500  1.000 107.98000 ? 148 GLY A HA3  1 
ATOM   2153 N N    . ASN A 1 151 ? -8.32400  -22.53900 -2.58100  1.000 95.22984  ? 149 ASN A N    1 
ATOM   2154 C CA   . ASN A 1 151 ? -7.04400  -21.87300 -2.40100  1.000 93.42173  ? 149 ASN A CA   1 
ATOM   2155 C C    . ASN A 1 151 ? -5.97400  -22.80200 -1.84400  1.000 96.63527  ? 149 ASN A C    1 
ATOM   2156 O O    . ASN A 1 151 ? -4.84000  -22.35900 -1.63500  1.000 90.02922  ? 149 ASN A O    1 
ATOM   2157 C CB   . ASN A 1 151 ? -7.20000  -20.66200 -1.47400  1.000 98.62498  ? 149 ASN A CB   1 
ATOM   2158 C CG   . ASN A 1 151 ? -8.57900  -20.03300 -1.55600  1.000 111.49232 ? 149 ASN A CG   1 
ATOM   2159 O OD1  . ASN A 1 151 ? -8.98400  -19.52900 -2.60400  1.000 114.96905 ? 149 ASN A OD1  1 
ATOM   2160 N ND2  . ASN A 1 151 ? -9.30100  -20.04200 -0.43900  1.000 116.57450 ? 149 ASN A ND2  1 
ATOM   2161 H H    . ASN A 1 151 ? -8.74200  -22.68900 -1.84400  1.000 115.34000 ? 149 ASN A H    1 
ATOM   2162 H HA   . ASN A 1 151 ? -6.73400  -21.54800 -3.26000  1.000 113.16000 ? 149 ASN A HA   1 
ATOM   2163 H HB2  . ASN A 1 151 ? -7.05300  -20.94500 -0.55800  1.000 119.41000 ? 149 ASN A HB2  1 
ATOM   2164 H HB3  . ASN A 1 151 ? -6.54800  -19.98800 -1.72200  1.000 119.41000 ? 149 ASN A HB3  1 
ATOM   2165 H HD21 . ASN A 1 151 ? -8.98400  -20.40000 0.27500   1.000 140.95000 ? 149 ASN A HD21 1 
ATOM   2166 H HD22 . ASN A 1 151 ? -10.08800 -19.69600 -0.43300  1.000 140.95000 ? 149 ASN A HD22 1 
ATOM   2167 N N    . ASP A 1 152 ? -6.30100  -24.06700 -1.59500  1.000 102.22805 ? 150 ASP A N    1 
ATOM   2168 C CA   . ASP A 1 152 ? -5.35400  -25.04100 -1.07500  1.000 99.47508  ? 150 ASP A CA   1 
ATOM   2169 C C    . ASP A 1 152 ? -4.85400  -25.94300 -2.19700  1.000 93.75861  ? 150 ASP A C    1 
ATOM   2170 O O    . ASP A 1 152 ? -5.58200  -26.25000 -3.14500  1.000 87.34468  ? 150 ASP A O    1 
ATOM   2171 C CB   . ASP A 1 152 ? -5.99100  -25.90100 0.02100   1.000 91.46097  ? 150 ASP A CB   1 
ATOM   2172 C CG   . ASP A 1 152 ? -6.20900  -25.13900 1.31200   1.000 87.24467  ? 150 ASP A CG   1 
ATOM   2173 O OD1  . ASP A 1 152 ? -5.47100  -24.16300 1.56200   1.000 99.71459  ? 150 ASP A OD1  1 
ATOM   2174 O OD2  . ASP A 1 152 ? -7.11600  -25.52300 2.08000   1.000 106.63121 ? 150 ASP A OD2  1 
ATOM   2175 H H    . ASP A 1 152 ? -7.08700  -24.39200 -1.72300  1.000 123.73000 ? 150 ASP A H    1 
ATOM   2176 H HA   . ASP A 1 152 ? -4.59100  -24.57900 -0.69400  1.000 120.43000 ? 150 ASP A HA   1 
ATOM   2177 H HB2  . ASP A 1 152 ? -6.85300  -26.21900 -0.28900  1.000 110.81000 ? 150 ASP A HB2  1 
ATOM   2178 H HB3  . ASP A 1 152 ? -5.40800  -26.65300 0.21100   1.000 110.81000 ? 150 ASP A HB3  1 
ATOM   2179 N N    . TYR A 1 153 ? -3.59900  -26.36400 -2.07900  1.000 84.03639  ? 151 TYR A N    1 
ATOM   2180 C CA   . TYR A 1 153 ? -3.00200  -27.32300 -2.99600  1.000 78.49362  ? 151 TYR A CA   1 
ATOM   2181 C C    . TYR A 1 153 ? -3.06100  -28.71500 -2.38400  1.000 79.04632  ? 151 TYR A C    1 
ATOM   2182 O O    . TYR A 1 153 ? -2.82700  -28.88900 -1.18500  1.000 79.48058  ? 151 TYR A O    1 
ATOM   2183 C CB   . TYR A 1 153 ? -1.55500  -26.94800 -3.31500  1.000 79.35952  ? 151 TYR A CB   1 
ATOM   2184 C CG   . TYR A 1 153 ? -1.43400  -25.85900 -4.35300  1.000 91.10303  ? 151 TYR A CG   1 
ATOM   2185 C CD1  . TYR A 1 153 ? -1.56100  -26.14900 -5.70400  1.000 88.47113  ? 151 TYR A CD1  1 
ATOM   2186 C CD2  . TYR A 1 153 ? -1.19600  -24.54200 -3.98500  1.000 93.47173  ? 151 TYR A CD2  1 
ATOM   2187 C CE1  . TYR A 1 153 ? -1.45400  -25.15900 -6.66100  1.000 96.73791  ? 151 TYR A CE1  1 
ATOM   2188 C CE2  . TYR A 1 153 ? -1.08600  -23.54400 -4.93400  1.000 111.22123 ? 151 TYR A CE2  1 
ATOM   2189 C CZ   . TYR A 1 153 ? -1.21600  -23.85800 -6.27100  1.000 99.70932  ? 151 TYR A CZ   1 
ATOM   2190 O OH   . TYR A 1 153 ? -1.10800  -22.86800 -7.22100  1.000 107.79714 ? 151 TYR A OH   1 
ATOM   2191 H H    . TYR A 1 153 ? -3.06200  -26.10100 -1.46100  1.000 101.90000 ? 151 TYR A H    1 
ATOM   2192 H HA   . TYR A 1 153 ? -3.50400  -27.33300 -3.82600  1.000 95.25000  ? 151 TYR A HA   1 
ATOM   2193 H HB2  . TYR A 1 153 ? -1.12500  -26.63500 -2.50300  1.000 96.29000  ? 151 TYR A HB2  1 
ATOM   2194 H HB3  . TYR A 1 153 ? -1.09400  -27.73300 -3.65100  1.000 96.29000  ? 151 TYR A HB3  1 
ATOM   2195 H HD1  . TYR A 1 153 ? -1.72200  -27.02600 -5.97000  1.000 107.22000 ? 151 TYR A HD1  1 
ATOM   2196 H HD2  . TYR A 1 153 ? -1.10800  -24.32800 -3.08400  1.000 113.23000 ? 151 TYR A HD2  1 
ATOM   2197 H HE1  . TYR A 1 153 ? -1.54100  -25.36900 -7.56300  1.000 117.14000 ? 151 TYR A HE1  1 
ATOM   2198 H HE2  . TYR A 1 153 ? -0.92600  -22.66600 -4.67300  1.000 134.53000 ? 151 TYR A HE2  1 
ATOM   2199 H HH   . TYR A 1 153 ? -0.96400  -22.12800 -6.85000  1.000 130.41000 ? 151 TYR A HH   1 
ATOM   2200 N N    . VAL A 1 154 ? -3.38000  -29.70400 -3.21600  1.000 78.21990  ? 152 VAL A N    1 
ATOM   2201 C CA   . VAL A 1 154 ? -3.57100  -31.07900 -2.77200  1.000 76.46443  ? 152 VAL A CA   1 
ATOM   2202 C C    . VAL A 1 154 ? -2.69800  -31.98200 -3.62700  1.000 72.07443  ? 152 VAL A C    1 
ATOM   2203 O O    . VAL A 1 154 ? -2.84700  -32.01100 -4.85400  1.000 72.12181  ? 152 VAL A O    1 
ATOM   2204 C CB   . VAL A 1 154 ? -5.04300  -31.51500 -2.86900  1.000 77.31980  ? 152 VAL A CB   1 
ATOM   2205 C CG1  . VAL A 1 154 ? -5.21800  -32.92300 -2.31500  1.000 71.67175  ? 152 VAL A CG1  1 
ATOM   2206 C CG2  . VAL A 1 154 ? -5.94300  -30.52200 -2.14600  1.000 76.71709  ? 152 VAL A CG2  1 
ATOM   2207 H H    . VAL A 1 154 ? -3.49300  -29.59900 -4.06200  1.000 94.92000  ? 152 VAL A H    1 
ATOM   2208 H HA   . VAL A 1 154 ? -3.28700  -31.16500 -1.84900  1.000 92.81000  ? 152 VAL A HA   1 
ATOM   2209 H HB   . VAL A 1 154 ? -5.30500  -31.52800 -3.80300  1.000 93.84000  ? 152 VAL A HB   1 
ATOM   2210 H HG11 . VAL A 1 154 ? -6.16600  -33.11800 -2.24600  1.000 87.06000  ? 152 VAL A HG11 1 
ATOM   2211 H HG12 . VAL A 1 154 ? -4.79400  -33.55600 -2.91500  1.000 87.06000  ? 152 VAL A HG12 1 
ATOM   2212 H HG13 . VAL A 1 154 ? -4.80700  -32.97000 -1.43800  1.000 87.06000  ? 152 VAL A HG13 1 
ATOM   2213 H HG21 . VAL A 1 154 ? -6.85200  -30.86200 -2.14700  1.000 93.12000  ? 152 VAL A HG21 1 
ATOM   2214 H HG22 . VAL A 1 154 ? -5.62900  -30.41900 -1.23400  1.000 93.12000  ? 152 VAL A HG22 1 
ATOM   2215 H HG23 . VAL A 1 154 ? -5.90800  -29.66900 -2.60700  1.000 93.12000  ? 152 VAL A HG23 1 
ATOM   2216 N N    . VAL A 1 155 ? -1.79700  -32.71800 -2.98600  1.000 78.56731  ? 153 VAL A N    1 
ATOM   2217 C CA   . VAL A 1 155 ? -0.99700  -33.73300 -3.66100  1.000 78.21201  ? 153 VAL A CA   1 
ATOM   2218 C C    . VAL A 1 155 ? -1.72500  -35.06100 -3.54100  1.000 71.18485  ? 153 VAL A C    1 
ATOM   2219 O O    . VAL A 1 155 ? -2.22700  -35.41000 -2.46500  1.000 68.97406  ? 153 VAL A O    1 
ATOM   2220 C CB   . VAL A 1 155 ? 0.42400   -33.81000 -3.07000  1.000 73.59567  ? 153 VAL A CB   1 
ATOM   2221 C CG1  . VAL A 1 155 ? 0.38500   -33.90900 -1.55000  1.000 74.59842  ? 153 VAL A CG1  1 
ATOM   2222 C CG2  . VAL A 1 155 ? 1.18000   -34.99200 -3.66300  1.000 71.13748  ? 153 VAL A CG2  1 
ATOM   2223 H H    . VAL A 1 155 ? -1.63600  -32.64600 -2.14600  1.000 95.34000  ? 153 VAL A H    1 
ATOM   2224 H HA   . VAL A 1 155 ? -0.92500  -33.51200 -4.60200  1.000 94.91000  ? 153 VAL A HA   1 
ATOM   2225 H HB   . VAL A 1 155 ? 0.90600   -33.00100 -3.30300  1.000 89.37000  ? 153 VAL A HB   1 
ATOM   2226 H HG11 . VAL A 1 155 ? 1.27200   -34.13700 -1.22900  1.000 90.57000  ? 153 VAL A HG11 1 
ATOM   2227 H HG12 . VAL A 1 155 ? 0.11300   -33.05400 -1.18200  1.000 90.57000  ? 153 VAL A HG12 1 
ATOM   2228 H HG13 . VAL A 1 155 ? -0.24400  -34.59900 -1.29200  1.000 90.57000  ? 153 VAL A HG13 1 
ATOM   2229 H HG21 . VAL A 1 155 ? 2.12600   -34.88500 -3.47500  1.000 86.42000  ? 153 VAL A HG21 1 
ATOM   2230 H HG22 . VAL A 1 155 ? 0.85500   -35.81300 -3.26100  1.000 86.42000  ? 153 VAL A HG22 1 
ATOM   2231 H HG23 . VAL A 1 155 ? 1.03500   -35.01000 -4.62200  1.000 86.42000  ? 153 VAL A HG23 1 
ATOM   2232 N N    . ILE A 1 156 ? -1.79700  -35.80300 -4.64500  1.000 63.81555  ? 154 ILE A N    1 
ATOM   2233 C CA   . ILE A 1 156 ? -2.62000  -37.00500 -4.71400  1.000 77.99883  ? 154 ILE A CA   1 
ATOM   2234 C C    . ILE A 1 156 ? -1.81300  -38.27700 -4.93200  1.000 74.52736  ? 154 ILE A C    1 
ATOM   2235 O O    . ILE A 1 156 ? -2.37600  -39.37400 -4.78900  1.000 68.61612  ? 154 ILE A O    1 
ATOM   2236 C CB   . ILE A 1 156 ? -3.70500  -36.87800 -5.80800  1.000 79.53585  ? 154 ILE A CB   1 
ATOM   2237 C CG1  . ILE A 1 156 ? -3.06300  -36.73300 -7.19000  1.000 71.79282  ? 154 ILE A CG1  1 
ATOM   2238 C CG2  . ILE A 1 156 ? -4.61500  -35.69000 -5.51000  1.000 75.35377  ? 154 ILE A CG2  1 
ATOM   2239 C CD1  . ILE A 1 156 ? -4.05100  -36.40600 -8.29100  1.000 78.20148  ? 154 ILE A CD1  1 
ATOM   2240 H H    . ILE A 1 156 ? -1.37300  -35.62900 -5.37200  1.000 77.64000  ? 154 ILE A H    1 
ATOM   2241 H HA   . ILE A 1 156 ? -3.08300  -37.10500 -3.86800  1.000 94.65000  ? 154 ILE A HA   1 
ATOM   2242 H HB   . ILE A 1 156 ? -4.24100  -37.68500 -5.80200  1.000 96.50000  ? 154 ILE A HB   1 
ATOM   2243 H HG12 . ILE A 1 156 ? -2.40800  -36.01800 -7.16000  1.000 87.21000  ? 154 ILE A HG12 1 
ATOM   2244 H HG13 . ILE A 1 156 ? -2.62800  -37.56800 -7.42400  1.000 87.21000  ? 154 ILE A HG13 1 
ATOM   2245 H HG21 . ILE A 1 156 ? -5.43500  -35.78300 -6.01800  1.000 91.48000  ? 154 ILE A HG21 1 
ATOM   2246 H HG22 . ILE A 1 156 ? -4.81500  -35.67800 -4.56100  1.000 91.48000  ? 154 ILE A HG22 1 
ATOM   2247 H HG23 . ILE A 1 156 ? -4.15800  -34.87200 -5.76100  1.000 91.48000  ? 154 ILE A HG23 1 
ATOM   2248 H HD11 . ILE A 1 156 ? -3.61900  -36.53500 -9.15000  1.000 94.90000  ? 154 ILE A HD11 1 
ATOM   2249 H HD12 . ILE A 1 156 ? -4.81600  -36.99700 -8.21300  1.000 94.90000  ? 154 ILE A HD12 1 
ATOM   2250 H HD13 . ILE A 1 156 ? -4.33500  -35.48300 -8.19900  1.000 94.90000  ? 154 ILE A HD13 1 
ATOM   2251 N N    . GLY A 1 157 ? -0.53100  -38.18500 -5.26400  1.000 73.10350  ? 155 GLY A N    1 
ATOM   2252 C CA   . GLY A 1 157 ? 0.27100   -39.37700 -5.44900  1.000 68.45031  ? 155 GLY A CA   1 
ATOM   2253 C C    . GLY A 1 157 ? 1.57800   -39.05000 -6.14500  1.000 67.87919  ? 155 GLY A C    1 
ATOM   2254 O O    . GLY A 1 157 ? 1.96100   -37.88500 -6.27500  1.000 67.24490  ? 155 GLY A O    1 
ATOM   2255 H H    . GLY A 1 157 ? -0.10700  -37.44700 -5.38700  1.000 88.78000  ? 155 GLY A H    1 
ATOM   2256 H HA2  . GLY A 1 157 ? 0.46900   -39.77400 -4.58700  1.000 83.20000  ? 155 GLY A HA2  1 
ATOM   2257 H HA3  . GLY A 1 157 ? -0.21700  -40.02100 -5.98200  1.000 83.20000  ? 155 GLY A HA3  1 
ATOM   2258 N N    . VAL A 1 158 ? 2.25400   -40.11100 -6.59100  1.000 60.82835  ? 156 VAL A N    1 
ATOM   2259 C CA   . VAL A 1 158 ? 3.55500   -40.00300 -7.23900  1.000 61.86268  ? 156 VAL A CA   1 
ATOM   2260 C C    . VAL A 1 158 ? 3.55400   -40.83400 -8.51500  1.000 59.35448  ? 156 VAL A C    1 
ATOM   2261 O O    . VAL A 1 158 ? 2.90700   -41.88200 -8.59900  1.000 64.50773  ? 156 VAL A O    1 
ATOM   2262 C CB   . VAL A 1 158 ? 4.70200   -40.45200 -6.30400  1.000 63.15757  ? 156 VAL A CB   1 
ATOM   2263 C CG1  . VAL A 1 158 ? 4.75000   -39.57500 -5.06500  1.000 69.83732  ? 156 VAL A CG1  1 
ATOM   2264 C CG2  . VAL A 1 158 ? 4.54000   -41.91600 -5.92200  1.000 67.62916  ? 156 VAL A CG2  1 
ATOM   2265 H H    . VAL A 1 158 ? 1.97000   -40.92000 -6.52600  1.000 74.05000  ? 156 VAL A H    1 
ATOM   2266 H HA   . VAL A 1 158 ? 3.71100   -39.07800 -7.48300  1.000 75.30000  ? 156 VAL A HA   1 
ATOM   2267 H HB   . VAL A 1 158 ? 5.54600   -40.35600 -6.77200  1.000 76.85000  ? 156 VAL A HB   1 
ATOM   2268 H HG11 . VAL A 1 158 ? 4.13400   -38.83500 -5.17700  1.000 84.86000  ? 156 VAL A HG11 1 
ATOM   2269 H HG12 . VAL A 1 158 ? 4.49500   -40.10400 -4.29300  1.000 84.86000  ? 156 VAL A HG12 1 
ATOM   2270 H HG13 . VAL A 1 158 ? 5.65300   -39.23800 -4.95300  1.000 84.86000  ? 156 VAL A HG13 1 
ATOM   2271 H HG21 . VAL A 1 158 ? 5.18700   -42.13400 -5.23400  1.000 82.21000  ? 156 VAL A HG21 1 
ATOM   2272 H HG22 . VAL A 1 158 ? 3.64100   -42.05800 -5.58600  1.000 82.21000  ? 156 VAL A HG22 1 
ATOM   2273 H HG23 . VAL A 1 158 ? 4.69200   -42.46800 -6.70400  1.000 82.21000  ? 156 VAL A HG23 1 
ATOM   2274 N N    . HIS A 1 159 ? 4.30200   -40.36000 -9.50900  1.000 59.13867  ? 157 HIS A N    1 
ATOM   2275 C CA   . HIS A 1 159 ? 4.33700   -41.01800 -10.80800 1.000 62.51276  ? 157 HIS A CA   1 
ATOM   2276 C C    . HIS A 1 159 ? 4.94700   -42.41000 -10.69000 1.000 67.96604  ? 157 HIS A C    1 
ATOM   2277 O O    . HIS A 1 159 ? 5.87000   -42.64700 -9.90600  1.000 62.11534  ? 157 HIS A O    1 
ATOM   2278 C CB   . HIS A 1 159 ? 5.13900   -40.17800 -11.79900 1.000 64.86041  ? 157 HIS A CB   1 
ATOM   2279 C CG   . HIS A 1 159 ? 4.95900   -40.59200 -13.22500 1.000 67.90025  ? 157 HIS A CG   1 
ATOM   2280 N ND1  . HIS A 1 159 ? 3.72000   -40.68400 -13.82100 1.000 63.92345  ? 157 HIS A ND1  1 
ATOM   2281 C CD2  . HIS A 1 159 ? 5.86000   -40.93400 -14.17600 1.000 65.37626  ? 157 HIS A CD2  1 
ATOM   2282 C CE1  . HIS A 1 159 ? 3.86500   -41.06600 -15.07700 1.000 69.22935  ? 157 HIS A CE1  1 
ATOM   2283 N NE2  . HIS A 1 159 ? 5.15400   -41.22500 -15.31700 1.000 67.52652  ? 157 HIS A NE2  1 
ATOM   2284 H H    . HIS A 1 159 ? 4.79700   -39.65900 -9.45500  1.000 72.02000  ? 157 HIS A H    1 
ATOM   2285 H HA   . HIS A 1 159 ? 3.43400   -41.11200 -11.14700 1.000 76.07000  ? 157 HIS A HA   1 
ATOM   2286 H HB2  . HIS A 1 159 ? 4.86000   -39.25200 -11.72100 1.000 78.89000  ? 157 HIS A HB2  1 
ATOM   2287 H HB3  . HIS A 1 159 ? 6.08200   -40.25600 -11.58400 1.000 78.89000  ? 157 HIS A HB3  1 
ATOM   2288 H HD2  . HIS A 1 159 ? 6.78400   -40.96700 -14.07500 1.000 79.51000  ? 157 HIS A HD2  1 
ATOM   2289 H HE1  . HIS A 1 159 ? 3.17700   -41.20100 -15.68800 1.000 84.13000  ? 157 HIS A HE1  1 
ATOM   2290 H HE2  . HIS A 1 159 ? 5.49600   -41.47100 -16.06700 1.000 82.09000  ? 157 HIS A HE2  1 
ATOM   2291 N N    . THR A 1 160 ? 4.43500   -43.33500 -11.50200 1.000 61.25208  ? 158 THR A N    1 
ATOM   2292 C CA   . THR A 1 160 ? 4.82800   -44.73300 -11.38600 1.000 68.92669  ? 158 THR A CA   1 
ATOM   2293 C C    . THR A 1 160 ? 5.05300   -45.39000 -12.74200 1.000 72.82189  ? 158 THR A C    1 
ATOM   2294 O O    . THR A 1 160 ? 6.00700   -46.15700 -12.90900 1.000 73.18509  ? 158 THR A O    1 
ATOM   2295 C CB   . THR A 1 160 ? 3.76200   -45.50200 -10.60100 1.000 68.05553  ? 158 THR A CB   1 
ATOM   2296 O OG1  . THR A 1 160 ? 3.67700   -44.97400 -9.27200  1.000 75.70908  ? 158 THR A OG1  1 
ATOM   2297 C CG2  . THR A 1 160 ? 4.10400   -46.97300 -10.52900 1.000 69.89785  ? 158 THR A CG2  1 
ATOM   2298 H H    . THR A 1 160 ? 3.86200   -43.17700 -12.12400 1.000 74.56000  ? 158 THR A H    1 
ATOM   2299 H HA   . THR A 1 160 ? 5.65900   -44.79000 -10.89000 1.000 83.77000  ? 158 THR A HA   1 
ATOM   2300 H HB   . THR A 1 160 ? 2.90300   -45.40700 -11.04200 1.000 82.73000  ? 158 THR A HB   1 
ATOM   2301 H HG1  . THR A 1 160 ? 4.41800   -45.05300 -8.88400  1.000 91.91000  ? 158 THR A HG1  1 
ATOM   2302 H HG21 . THR A 1 160 ? 3.52000   -47.40900 -9.89000  1.000 84.94000  ? 158 THR A HG21 1 
ATOM   2303 H HG22 . THR A 1 160 ? 3.98300   -47.39100 -11.39600 1.000 84.94000  ? 158 THR A HG22 1 
ATOM   2304 H HG23 . THR A 1 160 ? 5.02400   -47.08800 -10.24500 1.000 84.94000  ? 158 THR A HG23 1 
ATOM   2305 N N    . ALA A 1 161 ? 4.18600   -45.11400 -13.71100 1.000 72.90611  ? 159 ALA A N    1 
ATOM   2306 C CA   . ALA A 1 161 ? 4.28500   -45.76100 -15.01200 1.000 76.36442  ? 159 ALA A CA   1 
ATOM   2307 C C    . ALA A 1 161 ? 3.57300   -44.90300 -16.04600 1.000 74.52472  ? 159 ALA A C    1 
ATOM   2308 O O    . ALA A 1 161 ? 2.86200   -43.95300 -15.71400 1.000 73.40354  ? 159 ALA A O    1 
ATOM   2309 C CB   . ALA A 1 161 ? 3.69700   -47.17500 -14.97700 1.000 83.83110  ? 159 ALA A CB   1 
ATOM   2310 H H    . ALA A 1 161 ? 3.53400   -44.55800 -13.64000 1.000 88.55000  ? 159 ALA A H    1 
ATOM   2311 H HA   . ALA A 1 161 ? 5.21900   -45.82800 -15.26500 1.000 92.70000  ? 159 ALA A HA   1 
ATOM   2312 H HB1  . ALA A 1 161 ? 3.78000   -47.57300 -15.85800 1.000 101.66000 ? 159 ALA A HB1  1 
ATOM   2313 H HB2  . ALA A 1 161 ? 4.18600   -47.70400 -14.32700 1.000 101.66000 ? 159 ALA A HB2  1 
ATOM   2314 H HB3  . ALA A 1 161 ? 2.76200   -47.12100 -14.72500 1.000 101.66000 ? 159 ALA A HB3  1 
ATOM   2315 N N    . ALA A 1 162 ? 3.77800   -45.25700 -17.31600 1.000 72.03232  ? 160 ALA A N    1 
ATOM   2316 C CA   . ALA A 1 162 ? 3.14300   -44.54900 -18.42700 1.000 80.35700  ? 160 ALA A CA   1 
ATOM   2317 C C    . ALA A 1 162 ? 2.99400   -45.54700 -19.57300 1.000 71.95863  ? 160 ALA A C    1 
ATOM   2318 O O    . ALA A 1 162 ? 3.94700   -45.77400 -20.32300 1.000 81.84139  ? 160 ALA A O    1 
ATOM   2319 C CB   . ALA A 1 162 ? 3.95900   -43.33400 -18.84500 1.000 79.03053  ? 160 ALA A CB   1 
ATOM   2320 H H    . ALA A 1 162 ? 4.28400   -45.90800 -17.56100 1.000 87.50000  ? 160 ALA A H    1 
ATOM   2321 H HA   . ALA A 1 162 ? 2.26000   -44.25100 -18.16000 1.000 97.49000  ? 160 ALA A HA   1 
ATOM   2322 H HB1  . ALA A 1 162 ? 4.80900   -43.63400 -19.20300 1.000 95.89000  ? 160 ALA A HB1  1 
ATOM   2323 H HB2  . ALA A 1 162 ? 3.46900   -42.84500 -19.52500 1.000 95.89000  ? 160 ALA A HB2  1 
ATOM   2324 H HB3  . ALA A 1 162 ? 4.10200   -42.76800 -18.07100 1.000 95.89000  ? 160 ALA A HB3  1 
ATOM   2325 N N    . ALA A 1 163 ? 1.80100   -46.12700 -19.69800 1.000 76.94344  ? 161 ALA A N    1 
ATOM   2326 C CA   . ALA A 1 163 ? 1.55800   -47.14900 -20.70800 1.000 80.69125  ? 161 ALA A CA   1 
ATOM   2327 C C    . ALA A 1 163 ? 2.05100   -46.69300 -22.07400 1.000 76.34863  ? 161 ALA A C    1 
ATOM   2328 O O    . ALA A 1 163 ? 1.81900   -45.55500 -22.48900 1.000 72.69819  ? 161 ALA A O    1 
ATOM   2329 C CB   . ALA A 1 163 ? 0.06600   -47.48000 -20.78500 1.000 69.94523  ? 161 ALA A CB   1 
ATOM   2330 H H    . ALA A 1 163 ? 1.11700   -45.94500 -19.20900 1.000 93.39000  ? 161 ALA A H    1 
ATOM   2331 H HA   . ALA A 1 163 ? 2.03700   -47.95700 -20.46600 1.000 97.88000  ? 161 ALA A HA   1 
ATOM   2332 H HB1  . ALA A 1 163 ? -0.23800  -47.78500 -19.91700 1.000 84.99000  ? 161 ALA A HB1  1 
ATOM   2333 H HB2  . ALA A 1 163 ? -0.42000  -46.68100 -21.04300 1.000 84.99000  ? 161 ALA A HB2  1 
ATOM   2334 H HB3  . ALA A 1 163 ? -0.06800  -48.17600 -21.44700 1.000 84.99000  ? 161 ALA A HB3  1 
ATOM   2335 N N    . ARG A 1 164 ? 2.73100   -47.59400 -22.77200 1.000 74.69317  ? 162 ARG A N    1 
ATOM   2336 C CA   . ARG A 1 164 ? 3.20600   -47.30200 -24.11300 1.000 82.79151  ? 162 ARG A CA   1 
ATOM   2337 C C    . ARG A 1 164 ? 2.04400   -47.35200 -25.10100 1.000 85.63658  ? 162 ARG A C    1 
ATOM   2338 O O    . ARG A 1 164 ? 1.00400   -47.97100 -24.85100 1.000 78.40151  ? 162 ARG A O    1 
ATOM   2339 C CB   . ARG A 1 164 ? 4.30100   -48.29100 -24.51600 1.000 86.84199  ? 162 ARG A CB   1 
ATOM   2340 C CG   . ARG A 1 164 ? 5.09200   -47.91000 -25.76200 1.000 104.02826 ? 162 ARG A CG   1 
ATOM   2341 C CD   . ARG A 1 164 ? 6.33400   -48.79100 -25.94900 1.000 100.98053 ? 162 ARG A CD   1 
ATOM   2342 N NE   . ARG A 1 164 ? 6.26600   -50.05100 -25.21400 1.000 108.53933 ? 162 ARG A NE   1 
ATOM   2343 C CZ   . ARG A 1 164 ? 7.32200   -50.79000 -24.89500 1.000 110.87908 ? 162 ARG A CZ   1 
ATOM   2344 N NH1  . ARG A 1 164 ? 8.54700   -50.43700 -25.25400 1.000 142.03808 ? 162 ARG A NH1  1 
ATOM   2345 N NH2  . ARG A 1 164 ? 7.14600   -51.91300 -24.20300 1.000 114.81113 ? 162 ARG A NH2  1 
ATOM   2346 H H    . ARG A 1 164 ? 2.93000   -48.38200 -22.49000 1.000 90.69000  ? 162 ARG A H    1 
ATOM   2347 H HA   . ARG A 1 164 ? 3.58200   -46.40800 -24.13200 1.000 100.41000 ? 162 ARG A HA   1 
ATOM   2348 H HB2  . ARG A 1 164 ? 4.93000   -48.36800 -23.78100 1.000 105.27000 ? 162 ARG A HB2  1 
ATOM   2349 H HB3  . ARG A 1 164 ? 3.88800   -49.15200 -24.68300 1.000 105.27000 ? 162 ARG A HB3  1 
ATOM   2350 H HG2  . ARG A 1 164 ? 4.52600   -48.01600 -26.54300 1.000 125.89000 ? 162 ARG A HG2  1 
ATOM   2351 H HG3  . ARG A 1 164 ? 5.38400   -46.98800 -25.68400 1.000 125.89000 ? 162 ARG A HG3  1 
ATOM   2352 H HD2  . ARG A 1 164 ? 6.43200   -49.00000 -26.89100 1.000 122.24000 ? 162 ARG A HD2  1 
ATOM   2353 H HD3  . ARG A 1 164 ? 7.11100   -48.30300 -25.63600 1.000 122.24000 ? 162 ARG A HD3  1 
ATOM   2354 H HE   . ARG A 1 164 ? 5.49600   -50.43000 -25.15600 1.000 131.31000 ? 162 ARG A HE   1 
ATOM   2355 H HH11 . ARG A 1 164 ? 8.67600   -49.71400 -25.70100 1.000 171.50000 ? 162 ARG A HH11 1 
ATOM   2356 H HH12 . ARG A 1 164 ? 9.21600   -50.93200 -25.03700 1.000 171.50000 ? 162 ARG A HH12 1 
ATOM   2357 H HH21 . ARG A 1 164 ? 6.35500   -52.15200 -23.96600 1.000 138.83000 ? 162 ARG A HH21 1 
ATOM   2358 H HH22 . ARG A 1 164 ? 7.82300   -52.39900 -23.99300 1.000 138.83000 ? 162 ARG A HH22 1 
ATOM   2359 N N    . GLY A 1 165 ? 2.23000   -46.68200 -26.23400 1.000 90.67140  ? 163 GLY A N    1 
ATOM   2360 C CA   . GLY A 1 165 ? 1.16900   -46.59100 -27.21700 1.000 86.61565  ? 163 GLY A CA   1 
ATOM   2361 C C    . GLY A 1 165 ? 0.00400   -45.74300 -26.76600 1.000 83.54423  ? 163 GLY A C    1 
ATOM   2362 O O    . GLY A 1 165 ? -1.14400  -46.04000 -27.11100 1.000 87.15519  ? 163 GLY A O    1 
ATOM   2363 H H    . GLY A 1 165 ? 2.95600   -46.27600 -26.45200 1.000 109.86000 ? 163 GLY A H    1 
ATOM   2364 H HA2  . GLY A 1 165 ? 1.52300   -46.21000 -28.03600 1.000 104.99000 ? 163 GLY A HA2  1 
ATOM   2365 H HA3  . GLY A 1 165 ? 0.83800   -47.48100 -27.41400 1.000 104.99000 ? 163 GLY A HA3  1 
ATOM   2366 N N    . GLY A 1 166 ? 0.26900   -44.69600 -25.99700 1.000 79.58323  ? 164 GLY A N    1 
ATOM   2367 C CA   . GLY A 1 166 ? -0.78900  -43.83400 -25.51500 1.000 82.87573  ? 164 GLY A CA   1 
ATOM   2368 C C    . GLY A 1 166 ? -0.24500  -42.84600 -24.50800 1.000 79.92274  ? 164 GLY A C    1 
ATOM   2369 O O    . GLY A 1 166 ? 0.93800   -42.86600 -24.15300 1.000 78.46467  ? 164 GLY A O    1 
ATOM   2370 H H    . GLY A 1 166 ? 1.05700   -44.46500 -25.74100 1.000 96.56000  ? 164 GLY A H    1 
ATOM   2371 H HA2  . GLY A 1 166 ? -1.17900  -43.34500 -26.25600 1.000 100.51000 ? 164 GLY A HA2  1 
ATOM   2372 H HA3  . GLY A 1 166 ? -1.48100  -44.36600 -25.09100 1.000 100.51000 ? 164 GLY A HA3  1 
ATOM   2373 N N    . ASN A 1 167 ? -1.14200  -41.97400 -24.05200 1.000 80.04644  ? 165 ASN A N    1 
ATOM   2374 C CA   . ASN A 1 167 ? -0.81800  -40.96500 -23.05400 1.000 82.84151  ? 165 ASN A CA   1 
ATOM   2375 C C    . ASN A 1 167 ? -1.31200  -41.34600 -21.66300 1.000 78.14621  ? 165 ASN A C    1 
ATOM   2376 O O    . ASN A 1 167 ? -1.40200  -40.48200 -20.78400 1.000 71.86914  ? 165 ASN A O    1 
ATOM   2377 C CB   . ASN A 1 167 ? -1.39600  -39.61300 -23.47100 1.000 78.11989  ? 165 ASN A CB   1 
ATOM   2378 C CG   . ASN A 1 167 ? -0.64700  -38.99800 -24.63500 1.000 81.36502  ? 165 ASN A CG   1 
ATOM   2379 O OD1  . ASN A 1 167 ? 0.57800   -39.09400 -24.71900 1.000 82.36251  ? 165 ASN A OD1  1 
ATOM   2380 N ND2  . ASN A 1 167 ? -1.38000  -38.36500 -25.54300 1.000 91.10303  ? 165 ASN A ND2  1 
ATOM   2381 H H    . ASN A 1 167 ? -1.96100  -41.94900 -24.31300 1.000 97.12000  ? 165 ASN A H    1 
ATOM   2382 H HA   . ASN A 1 167 ? 0.14600   -40.87000 -23.00700 1.000 100.47000 ? 165 ASN A HA   1 
ATOM   2383 H HB2  . ASN A 1 167 ? -2.32000  -39.73400 -23.74000 1.000 94.80000  ? 165 ASN A HB2  1 
ATOM   2384 H HB3  . ASN A 1 167 ? -1.34500  -39.00000 -22.72200 1.000 94.80000  ? 165 ASN A HB3  1 
ATOM   2385 H HD21 . ASN A 1 167 ? -2.23400  -38.31900 -25.45100 1.000 110.38000 ? 165 ASN A HD21 1 
ATOM   2386 H HD22 . ASN A 1 167 ? -1.00100  -37.99900 -26.22300 1.000 110.38000 ? 165 ASN A HD22 1 
ATOM   2387 N N    . THR A 1 168 ? -1.63200  -42.61800 -21.44500 1.000 81.27027  ? 166 THR A N    1 
ATOM   2388 C CA   . THR A 1 168 ? -2.07000  -43.07000 -20.13100 1.000 79.10949  ? 166 THR A CA   1 
ATOM   2389 C C    . THR A 1 168 ? -0.89800  -43.04000 -19.15700 1.000 73.67725  ? 166 THR A C    1 
ATOM   2390 O O    . THR A 1 168 ? 0.15200   -43.63600 -19.41700 1.000 68.29240  ? 166 THR A O    1 
ATOM   2391 C CB   . THR A 1 168 ? -2.65700  -44.47700 -20.22300 1.000 72.82189  ? 166 THR A CB   1 
ATOM   2392 O OG1  . THR A 1 168 ? -3.89800  -44.43400 -20.94000 1.000 83.14418  ? 166 THR A OG1  1 
ATOM   2393 C CG2  . THR A 1 168 ? -2.89500  -45.05100 -18.83700 1.000 68.05553  ? 166 THR A CG2  1 
ATOM   2394 H H    . THR A 1 168 ? -1.60400  -43.23800 -22.04000 1.000 98.58000  ? 166 THR A H    1 
ATOM   2395 H HA   . THR A 1 168 ? -2.75900  -42.47300 -19.80000 1.000 95.99000  ? 166 THR A HA   1 
ATOM   2396 H HB   . THR A 1 168 ? -2.03500  -45.05500 -20.69100 1.000 88.44000  ? 166 THR A HB   1 
ATOM   2397 H HG1  . THR A 1 168 ? -4.44300  -43.93400 -20.54200 1.000 100.83000 ? 166 THR A HG1  1 
ATOM   2398 H HG21 . THR A 1 168 ? -3.26200  -44.36800 -18.25400 1.000 82.73000  ? 166 THR A HG21 1 
ATOM   2399 H HG22 . THR A 1 168 ? -3.52100  -45.79000 -18.88800 1.000 82.73000  ? 166 THR A HG22 1 
ATOM   2400 H HG23 . THR A 1 168 ? -2.06100  -45.37100 -18.46000 1.000 82.73000  ? 166 THR A HG23 1 
ATOM   2401 N N    . VAL A 1 169 ? -1.07500  -42.33400 -18.04200 1.000 68.54769  ? 167 VAL A N    1 
ATOM   2402 C CA   . VAL A 1 169 ? -0.10200  -42.30200 -16.96000 1.000 69.45833  ? 167 VAL A CA   1 
ATOM   2403 C C    . VAL A 1 169 ? -0.76300  -42.86700 -15.71000 1.000 65.87106  ? 167 VAL A C    1 
ATOM   2404 O O    . VAL A 1 169 ? -1.99000  -42.92600 -15.59700 1.000 69.12145  ? 167 VAL A O    1 
ATOM   2405 C CB   . VAL A 1 169 ? 0.44000   -40.88200 -16.69600 1.000 69.54781  ? 167 VAL A CB   1 
ATOM   2406 C CG1  . VAL A 1 169 ? 1.39900   -40.47300 -17.79900 1.000 69.91628  ? 167 VAL A CG1  1 
ATOM   2407 C CG2  . VAL A 1 169 ? -0.70300  -39.88300 -16.58500 1.000 70.29001  ? 167 VAL A CG2  1 
ATOM   2408 H H    . VAL A 1 169 ? -1.77200  -41.85500 -17.88800 1.000 83.31000  ? 167 VAL A H    1 
ATOM   2409 H HA   . VAL A 1 169 ? 0.64900   -42.87200 -17.18700 1.000 84.41000  ? 167 VAL A HA   1 
ATOM   2410 H HB   . VAL A 1 169 ? 0.92600   -40.87800 -15.85700 1.000 84.51000  ? 167 VAL A HB   1 
ATOM   2411 H HG11 . VAL A 1 169 ? 1.72700   -39.57900 -17.61600 1.000 84.96000  ? 167 VAL A HG11 1 
ATOM   2412 H HG12 . VAL A 1 169 ? 2.13900   -41.10000 -17.82200 1.000 84.96000  ? 167 VAL A HG12 1 
ATOM   2413 H HG13 . VAL A 1 169 ? 0.92800   -40.48600 -18.64700 1.000 84.96000  ? 167 VAL A HG13 1 
ATOM   2414 H HG21 . VAL A 1 169 ? -0.34100  -39.01900 -16.33500 1.000 85.41000  ? 167 VAL A HG21 1 
ATOM   2415 H HG22 . VAL A 1 169 ? -1.15100  -39.81700 -17.44300 1.000 85.41000  ? 167 VAL A HG22 1 
ATOM   2416 H HG23 . VAL A 1 169 ? -1.32600  -40.18800 -15.90700 1.000 85.41000  ? 167 VAL A HG23 1 
ATOM   2417 N N    . ILE A 1 170 ? 0.07200   -43.28500 -14.76100 1.000 70.44002  ? 168 ILE A N    1 
ATOM   2418 C CA   . ILE A 1 170 ? -0.38300  -43.92400 -13.53200 1.000 68.38451  ? 168 ILE A CA   1 
ATOM   2419 C C    . ILE A 1 170 ? 0.15300   -43.13500 -12.34600 1.000 70.79796  ? 168 ILE A C    1 
ATOM   2420 O O    . ILE A 1 170 ? 1.35000   -42.83300 -12.28400 1.000 61.29156  ? 168 ILE A O    1 
ATOM   2421 C CB   . ILE A 1 170 ? 0.06700   -45.39400 -13.45600 1.000 69.54518  ? 168 ILE A CB   1 
ATOM   2422 C CG1  . ILE A 1 170 ? -0.42200  -46.16800 -14.68500 1.000 69.98471  ? 168 ILE A CG1  1 
ATOM   2423 C CG2  . ILE A 1 170 ? -0.45000  -46.04300 -12.17800 1.000 64.08926  ? 168 ILE A CG2  1 
ATOM   2424 C CD1  . ILE A 1 170 ? -1.93200  -46.29000 -14.78300 1.000 70.89797  ? 168 ILE A CD1  1 
ATOM   2425 H H    . ILE A 1 170 ? 0.92700   -43.20700 -14.80900 1.000 85.59000  ? 168 ILE A H    1 
ATOM   2426 H HA   . ILE A 1 170 ? -1.35100  -43.89900 -13.49400 1.000 83.12000  ? 168 ILE A HA   1 
ATOM   2427 H HB   . ILE A 1 170 ? 1.03700   -45.41900 -13.44300 1.000 84.51000  ? 168 ILE A HB   1 
ATOM   2428 H HG12 . ILE A 1 170 ? -0.10800  -45.72000 -15.48600 1.000 85.04000  ? 168 ILE A HG12 1 
ATOM   2429 H HG13 . ILE A 1 170 ? -0.05700  -47.06600 -14.65000 1.000 85.04000  ? 168 ILE A HG13 1 
ATOM   2430 H HG21 . ILE A 1 170 ? -0.34100  -47.00400 -12.24800 1.000 77.97000  ? 168 ILE A HG21 1 
ATOM   2431 H HG22 . ILE A 1 170 ? 0.05900   -45.70700 -11.42300 1.000 77.97000  ? 168 ILE A HG22 1 
ATOM   2432 H HG23 . ILE A 1 170 ? -1.38900  -45.82400 -12.07000 1.000 77.97000  ? 168 ILE A HG23 1 
ATOM   2433 H HD11 . ILE A 1 170 ? -2.15400  -46.77600 -15.59300 1.000 86.14000  ? 168 ILE A HD11 1 
ATOM   2434 H HD12 . ILE A 1 170 ? -2.26500  -46.77200 -14.01000 1.000 86.14000  ? 168 ILE A HD12 1 
ATOM   2435 H HD13 . ILE A 1 170 ? -2.32300  -45.40300 -14.81500 1.000 86.14000  ? 168 ILE A HD13 1 
ATOM   2436 N N    . CYS A 1 171 ? -0.73200  -42.82000 -11.40400 1.000 72.09022  ? 169 CYS A N    1 
ATOM   2437 C CA   . CYS A 1 171 ? -0.40400  -42.04300 -10.21100 1.000 65.59997  ? 169 CYS A CA   1 
ATOM   2438 C C    . CYS A 1 171 ? -0.62200  -42.93800 -8.99400  1.000 64.13927  ? 169 CYS A C    1 
ATOM   2439 O O    . CYS A 1 171 ? -1.75800  -43.12300 -8.54700  1.000 70.65584  ? 169 CYS A O    1 
ATOM   2440 C CB   . CYS A 1 171 ? -1.25900  -40.77900 -10.14300 1.000 60.75728  ? 169 CYS A CB   1 
ATOM   2441 S SG   . CYS A 1 171 ? -1.28400  -39.95500 -8.53400  1.000 57.47268  ? 169 CYS A SG   1 
ATOM   2442 H H    . CYS A 1 171 ? -1.55900  -43.05400 -11.43600 1.000 87.56000  ? 169 CYS A H    1 
ATOM   2443 H HA   . CYS A 1 171 ? 0.53000   -41.78200 -10.23800 1.000 79.78000  ? 169 CYS A HA   1 
ATOM   2444 H HB2  . CYS A 1 171 ? -0.92300  -40.14300 -10.79300 1.000 73.96000  ? 169 CYS A HB2  1 
ATOM   2445 H HB3  . CYS A 1 171 ? -2.17400  -41.01500 -10.36400 1.000 73.96000  ? 169 CYS A HB3  1 
ATOM   2446 H HG   . CYS A 1 171 ? -0.16400  -39.63500 -8.24700  1.000 70.02000  ? 169 CYS A HG   1 
ATOM   2447 N N    . ALA A 1 172 ? 0.46400   -43.49800 -8.46300  1.000 60.64938  ? 170 ALA A N    1 
ATOM   2448 C CA   . ALA A 1 172 ? 0.36300   -44.34000 -7.27700  1.000 68.32135  ? 170 ALA A CA   1 
ATOM   2449 C C    . ALA A 1 172 ? -0.14100  -43.52900 -6.09000  1.000 67.41598  ? 170 ALA A C    1 
ATOM   2450 O O    . ALA A 1 172 ? 0.25300   -42.37600 -5.89200  1.000 70.06630  ? 170 ALA A O    1 
ATOM   2451 C CB   . ALA A 1 172 ? 1.71900   -44.96400 -6.95000  1.000 72.12707  ? 170 ALA A CB   1 
ATOM   2452 H H    . ALA A 1 172 ? 1.26300   -43.40600 -8.76800  1.000 73.84000  ? 170 ALA A H    1 
ATOM   2453 H HA   . ALA A 1 172 ? -0.26900  -45.05600 -7.44600  1.000 83.04000  ? 170 ALA A HA   1 
ATOM   2454 H HB1  . ALA A 1 172 ? 1.64300   -45.46600 -6.12400  1.000 87.61000  ? 170 ALA A HB1  1 
ATOM   2455 H HB2  . ALA A 1 172 ? 1.97600   -45.55600 -7.67300  1.000 87.61000  ? 170 ALA A HB2  1 
ATOM   2456 H HB3  . ALA A 1 172 ? 2.37600   -44.25800 -6.84700  1.000 87.61000  ? 170 ALA A HB3  1 
ATOM   2457 N N    . THR A 1 173 ? -1.01000  -44.14400 -5.29000  1.000 70.43213  ? 171 THR A N    1 
ATOM   2458 C CA   . THR A 1 173 ? -1.68400  -43.46900 -4.19100  1.000 77.58562  ? 171 THR A CA   1 
ATOM   2459 C C    . THR A 1 173 ? -1.56100  -44.29200 -2.91600  1.000 71.03746  ? 171 THR A C    1 
ATOM   2460 O O    . THR A 1 173 ? -1.19300  -45.46900 -2.93700  1.000 66.30005  ? 171 THR A O    1 
ATOM   2461 C CB   . THR A 1 173 ? -3.16800  -43.23400 -4.50700  1.000 72.85084  ? 171 THR A CB   1 
ATOM   2462 O OG1  . THR A 1 173 ? -3.86000  -44.48900 -4.52600  1.000 71.54279  ? 171 THR A OG1  1 
ATOM   2463 C CG2  . THR A 1 173 ? -3.32800  -42.55900 -5.85600  1.000 73.10087  ? 171 THR A CG2  1 
ATOM   2464 H H    . THR A 1 173 ? -1.22800  -44.97200 -5.36900  1.000 85.58000  ? 171 THR A H    1 
ATOM   2465 H HA   . THR A 1 173 ? -1.26700  -42.60700 -4.03600  1.000 94.16000  ? 171 THR A HA   1 
ATOM   2466 H HB   . THR A 1 173 ? -3.55700  -42.66000 -3.82800  1.000 88.48000  ? 171 THR A HB   1 
ATOM   2467 H HG1  . THR A 1 173 ? -3.91200  -44.80300 -3.74900  1.000 86.91000  ? 171 THR A HG1  1 
ATOM   2468 H HG21 . THR A 1 173 ? -4.24800  -42.27500 -5.97700  1.000 88.78000  ? 171 THR A HG21 1 
ATOM   2469 H HG22 . THR A 1 173 ? -2.74900  -41.78300 -5.90800  1.000 88.78000  ? 171 THR A HG22 1 
ATOM   2470 H HG23 . THR A 1 173 ? -3.09300  -43.17500 -6.56500  1.000 88.78000  ? 171 THR A HG23 1 
ATOM   2471 N N    . GLN A 1 174 ? -1.88700  -43.64800 -1.79700  1.000 82.75729  ? 172 GLN A N    1 
ATOM   2472 C CA   . GLN A 1 174 ? -1.95100  -44.30700 -0.49600  1.000 83.92848  ? 172 GLN A CA   1 
ATOM   2473 C C    . GLN A 1 174 ? -0.57800  -44.77300 -0.02500  1.000 89.27123  ? 172 GLN A C    1 
ATOM   2474 O O    . GLN A 1 174 ? -0.31900  -44.84900 1.17900   1.000 90.85826  ? 172 GLN A O    1 
ATOM   2475 C CB   . GLN A 1 174 ? -2.91100  -45.49800 -0.55100  1.000 85.58921  ? 172 GLN A CB   1 
ATOM   2476 C CG   . GLN A 1 174 ? -3.39600  -45.97900 0.81000   1.000 87.57366  ? 172 GLN A CG   1 
ATOM   2477 C CD   . GLN A 1 174 ? -4.38400  -45.01900 1.45200   1.000 91.33990  ? 172 GLN A CD   1 
ATOM   2478 O OE1  . GLN A 1 174 ? -4.41300  -43.83100 1.13000   1.000 90.34767  ? 172 GLN A OE1  1 
ATOM   2479 N NE2  . GLN A 1 174 ? -5.20600  -45.53500 2.36000   1.000 90.31609  ? 172 GLN A NE2  1 
ATOM   2480 H H    . GLN A 1 174 ? -2.07900  -42.81000 -1.76600  1.000 100.37000 ? 172 GLN A H    1 
ATOM   2481 H HA   . GLN A 1 174 ? -2.28700  -43.67500 0.15700   1.000 101.77000 ? 172 GLN A HA   1 
ATOM   2482 H HB2  . GLN A 1 174 ? -3.69100  -45.24300 -1.06800  1.000 103.76000 ? 172 GLN A HB2  1 
ATOM   2483 H HB3  . GLN A 1 174 ? -2.46200  -46.24000 -0.98300  1.000 103.76000 ? 172 GLN A HB3  1 
ATOM   2484 H HG2  . GLN A 1 174 ? -3.83700  -46.83700 0.70400   1.000 106.14000 ? 172 GLN A HG2  1 
ATOM   2485 H HG3  . GLN A 1 174 ? -2.63500  -46.06800 1.40400   1.000 106.14000 ? 172 GLN A HG3  1 
ATOM   2486 H HE21 . GLN A 1 174 ? -5.15800  -46.37000 2.55800   1.000 109.44000 ? 172 GLN A HE21 1 
ATOM   2487 H HE22 . GLN A 1 174 ? -5.78400  -45.03300 2.75200   1.000 109.44000 ? 172 GLN A HE22 1 
HETATM 2488 C C01  . AG7 B 2 .   ? 6.26400   -48.83100 -16.92600 1.000 72.94822  ? 201 AG7 A C01  1 
HETATM 2489 C C02  . AG7 B 2 .   ? 6.93800   -49.62600 -15.75700 1.000 79.79115  ? 201 AG7 A C02  1 
HETATM 2490 O O03  . AG7 B 2 .   ? 6.21600   -47.64300 -16.90000 1.000 77.21452  ? 201 AG7 A O03  1 
HETATM 2491 C C04  . AG7 B 2 .   ? 7.41200   -48.65800 -14.65000 1.000 79.26213  ? 201 AG7 A C04  1 
HETATM 2492 C C05  . AG7 B 2 .   ? 8.08000   -49.44300 -13.49800 1.000 80.17803  ? 201 AG7 A C05  1 
HETATM 2493 C C06  . AG7 B 2 .   ? 6.99600   -50.26900 -12.75100 1.000 82.40199  ? 201 AG7 A C06  1 
HETATM 2494 C C07  . AG7 B 2 .   ? 6.09900   -49.62300 -11.90400 1.000 80.61493  ? 201 AG7 A C07  1 
HETATM 2495 C C08  . AG7 B 2 .   ? 5.12500   -50.35400 -11.23400 1.000 81.74664  ? 201 AG7 A C08  1 
HETATM 2496 C C09  . AG7 B 2 .   ? 5.04900   -51.72900 -11.40800 1.000 86.63934  ? 201 AG7 A C09  1 
HETATM 2497 C C10  . AG7 B 2 .   ? 5.94600   -52.37500 -12.25200 1.000 87.83422  ? 201 AG7 A C10  1 
HETATM 2498 C C11  . AG7 B 2 .   ? 6.91800   -51.64200 -12.92700 1.000 87.22362  ? 201 AG7 A C11  1 
HETATM 2499 N N12  . AG7 B 2 .   ? 8.41900   -46.22000 -14.76800 1.000 67.91867  ? 201 AG7 A N12  1 
HETATM 2500 C C13  . AG7 B 2 .   ? 9.39500   -45.31100 -15.34700 1.000 79.41215  ? 201 AG7 A C13  1 
HETATM 2501 C C14  . AG7 B 2 .   ? 8.63900   -44.08000 -15.91900 1.000 73.85622  ? 201 AG7 A C14  1 
HETATM 2502 C C15  . AG7 B 2 .   ? 7.80900   -44.47900 -17.22700 1.000 77.31453  ? 201 AG7 A C15  1 
HETATM 2503 C C16  . AG7 B 2 .   ? 7.13800   -43.13100 -17.83300 1.000 80.13592  ? 201 AG7 A C16  1 
HETATM 2504 N N17  . AG7 B 2 .   ? 7.37000   -43.07800 -19.14500 1.000 84.26537  ? 201 AG7 A N17  1 
HETATM 2505 O O18  . AG7 B 2 .   ? 6.53100   -42.31900 -17.20200 1.000 76.32757  ? 201 AG7 A O18  1 
HETATM 2506 C C19  . AG7 B 2 .   ? 10.44300  -44.82300 -14.34800 1.000 79.27003  ? 201 AG7 A C19  1 
HETATM 2507 C C20  . AG7 B 2 .   ? 10.87200  -45.90200 -13.31600 1.000 65.28151  ? 201 AG7 A C20  1 
HETATM 2508 C C21  . AG7 B 2 .   ? 12.19300  -46.54300 -13.79300 1.000 76.44074  ? 201 AG7 A C21  1 
HETATM 2509 O O22  . AG7 B 2 .   ? 12.36700  -47.93200 -13.68400 1.000 76.89080  ? 201 AG7 A O22  1 
HETATM 2510 O O23  . AG7 B 2 .   ? 13.05800  -45.88000 -14.27900 1.000 85.04967  ? 201 AG7 A O23  1 
HETATM 2511 C C47  . AG7 B 2 .   ? 8.41900   -47.66400 -15.21500 1.000 76.18545  ? 201 AG7 A C47  1 
HETATM 2512 O O48  . AG7 B 2 .   ? 9.20800   -48.03900 -16.01600 1.000 73.50092  ? 201 AG7 A O48  1 
HETATM 2513 C C50  . AG7 B 2 .   ? 13.10500  -48.47300 -14.73400 1.000 91.29252  ? 201 AG7 A C50  1 
HETATM 2514 C C53  . AG7 B 2 .   ? 12.74400  -49.94100 -14.91600 1.000 92.37423  ? 201 AG7 A C53  1 
HETATM 2515 C C57  . AG7 B 2 .   ? 5.63200   -49.57700 -18.13200 1.000 75.52484  ? 201 AG7 A C57  1 
HETATM 2516 N N58  . AG7 B 2 .   ? 4.22800   -49.18300 -18.12700 1.000 73.07718  ? 201 AG7 A N58  1 
HETATM 2517 C C59  . AG7 B 2 .   ? 3.17400   -50.18300 -17.88500 1.000 71.95863  ? 201 AG7 A C59  1 
HETATM 2518 O O60  . AG7 B 2 .   ? 3.45100   -51.31300 -17.69300 1.000 73.14298  ? 201 AG7 A O60  1 
HETATM 2519 C C78  . AG7 B 2 .   ? 6.28400   -49.22800 -19.45000 1.000 75.24850  ? 201 AG7 A C78  1 
HETATM 2520 C C81  . AG7 B 2 .   ? 5.67900   -47.96200 -20.02900 1.000 80.29910  ? 201 AG7 A C81  1 
HETATM 2521 F F1   . AG7 B 2 .   ? 4.09800   -52.44400 -10.75200 1.000 83.73636  ? 201 AG7 A F1   1 
HETATM 2522 C C82  . AG7 B 2 .   ? 7.77000   -49.02700 -19.27600 1.000 71.69017  ? 201 AG7 A C82  1 
HETATM 2523 C C83  . AG7 B 2 .   ? 8.17700   -44.30000 -19.55500 1.000 81.70190  ? 201 AG7 A C83  1 
HETATM 2524 C C84  . AG7 B 2 .   ? 8.63400   -44.96600 -18.17600 1.000 69.63730  ? 201 AG7 A C84  1 
HETATM 2525 C C1   . AG7 B 2 .   ? 1.70200   -49.72900 -17.85400 1.000 77.13030  ? 201 AG7 A C1   1 
HETATM 2526 C C2   . AG7 B 2 .   ? 0.59000   -50.52000 -17.97700 1.000 83.00732  ? 201 AG7 A C2   1 
HETATM 2527 C C3   . AG7 B 2 .   ? -0.50800  -49.71200 -17.86800 1.000 90.13975  ? 201 AG7 A C3   1 
HETATM 2528 O O4   . AG7 B 2 .   ? -0.08700  -48.45400 -17.67200 1.000 78.52520  ? 201 AG7 A O4   1 
HETATM 2529 N N5   . AG7 B 2 .   ? 1.29600   -48.46900 -17.65500 1.000 74.41682  ? 201 AG7 A N5   1 
HETATM 2530 C C4   . AG7 B 2 .   ? -1.95900  -50.15300 -17.95000 1.000 116.07444 ? 201 AG7 A C4   1 
HETATM 2531 H H2   . AG7 B 2 .   ? 7.66300   -50.18200 -16.08300 1.000 96.81000  ? 201 AG7 A H2   1 
HETATM 2532 H H3   . AG7 B 2 .   ? 6.26200   -50.23800 -15.42700 1.000 96.81000  ? 201 AG7 A H3   1 
HETATM 2533 H H27  . AG7 B 2 .   ? 6.64000   -48.18400 -14.30300 1.000 96.17000  ? 201 AG7 A H27  1 
HETATM 2534 H H28  . AG7 B 2 .   ? 8.76700   -50.02700 -13.85600 1.000 97.27000  ? 201 AG7 A H28  1 
HETATM 2535 H H29  . AG7 B 2 .   ? 8.51300   -48.82900 -12.88500 1.000 97.27000  ? 201 AG7 A H29  1 
HETATM 2536 H H30  . AG7 B 2 .   ? 6.13900   -48.70200 -11.77900 1.000 97.79000  ? 201 AG7 A H30  1 
HETATM 2537 H H31  . AG7 B 2 .   ? 4.52500   -49.92500 -10.66700 1.000 99.15000  ? 201 AG7 A H31  1 
HETATM 2538 H H33  . AG7 B 2 .   ? 5.89200   -53.29600 -12.36900 1.000 106.46000 ? 201 AG7 A H33  1 
HETATM 2539 H H34  . AG7 B 2 .   ? 7.51600   -52.07800 -13.49000 1.000 105.73000 ? 201 AG7 A H34  1 
HETATM 2540 H H49  . AG7 B 2 .   ? 7.85000   -45.93200 -14.19100 1.000 82.56000  ? 201 AG7 A H49  1 
HETATM 2541 H H91  . AG7 B 2 .   ? 9.85000   -45.78800 -16.05700 1.000 96.35000  ? 201 AG7 A H91  1 
HETATM 2542 H H35  . AG7 B 2 .   ? 8.06600   -43.69400 -15.23800 1.000 89.69000  ? 201 AG7 A H35  1 
HETATM 2543 H H36  . AG7 B 2 .   ? 9.27400   -43.39200 -16.17100 1.000 89.69000  ? 201 AG7 A H36  1 
HETATM 2544 H H94  . AG7 B 2 .   ? 7.11000   -45.10500 -16.98000 1.000 93.83000  ? 201 AG7 A H94  1 
HETATM 2545 H H39  . AG7 B 2 .   ? 7.10800   -42.45000 -19.67000 1.000 102.18000 ? 201 AG7 A H39  1 
HETATM 2546 H H191 . AG7 B 2 .   ? 11.22000  -44.54200 -14.85100 1.000 96.18000  ? 201 AG7 A H191 1 
HETATM 2547 H H192 . AG7 B 2 .   ? 10.11600  -44.02800 -13.90300 1.000 96.18000  ? 201 AG7 A H192 1 
HETATM 2548 H H41  . AG7 B 2 .   ? 11.03200  -45.51200 -12.44200 1.000 79.40000  ? 201 AG7 A H41  1 
HETATM 2549 H H42  . AG7 B 2 .   ? 10.20100  -46.58800 -13.18500 1.000 79.40000  ? 201 AG7 A H42  1 
HETATM 2550 H H51  . AG7 B 2 .   ? 14.05100  -48.37700 -14.54200 1.000 110.61000 ? 201 AG7 A H51  1 
HETATM 2551 H H52  . AG7 B 2 .   ? 12.92100  -47.97800 -15.54800 1.000 110.61000 ? 201 AG7 A H52  1 
HETATM 2552 H H53  . AG7 B 2 .   ? 12.94800  -50.46000 -14.12200 1.000 111.90000 ? 201 AG7 A H53  1 
HETATM 2553 H H54  . AG7 B 2 .   ? 11.80500  -50.05700 -15.12800 1.000 111.90000 ? 201 AG7 A H54  1 
HETATM 2554 H H56  . AG7 B 2 .   ? 13.26200  -50.30800 -15.64900 1.000 111.90000 ? 201 AG7 A H56  1 
HETATM 2555 H H77  . AG7 B 2 .   ? 5.68000   -50.53400 -17.98500 1.000 91.69000  ? 201 AG7 A H77  1 
HETATM 2556 H H61  . AG7 B 2 .   ? 4.01700   -48.35900 -18.24900 1.000 88.75000  ? 201 AG7 A H61  1 
HETATM 2557 H H79  . AG7 B 2 .   ? 6.13900   -49.95800 -20.07200 1.000 91.36000  ? 201 AG7 A H79  1 
HETATM 2558 H H82  . AG7 B 2 .   ? 5.63900   -47.26400 -19.35700 1.000 97.42000  ? 201 AG7 A H82  1 
HETATM 2559 H H84  . AG7 B 2 .   ? 6.22200   -47.63200 -20.76200 1.000 97.42000  ? 201 AG7 A H84  1 
HETATM 2560 H H85  . AG7 B 2 .   ? 4.78300   -48.09600 -20.37500 1.000 97.42000  ? 201 AG7 A H85  1 
HETATM 2561 H H86  . AG7 B 2 .   ? 7.98500   -48.17500 -18.86500 1.000 87.08000  ? 201 AG7 A H86  1 
HETATM 2562 H H87  . AG7 B 2 .   ? 8.21500   -49.05300 -20.13800 1.000 87.08000  ? 201 AG7 A H87  1 
HETATM 2563 H H88  . AG7 B 2 .   ? 8.15400   -49.72900 -18.72800 1.000 87.08000  ? 201 AG7 A H88  1 
HETATM 2564 H H89  . AG7 B 2 .   ? 8.93500   -44.03900 -20.10100 1.000 99.10000  ? 201 AG7 A H89  1 
HETATM 2565 H H90  . AG7 B 2 .   ? 7.63900   -44.91000 -20.08400 1.000 99.10000  ? 201 AG7 A H90  1 
HETATM 2566 H H92  . AG7 B 2 .   ? 9.56900   -44.78800 -17.99100 1.000 84.62000  ? 201 AG7 A H92  1 
HETATM 2567 H H93  . AG7 B 2 .   ? 8.53000   -45.92800 -18.23800 1.000 84.62000  ? 201 AG7 A H93  1 
HETATM 2568 H H8   . AG7 B 2 .   ? 0.57900   -51.44000 -18.11500 1.000 100.67000 ? 201 AG7 A H8   1 
HETATM 2569 H H5   . AG7 B 2 .   ? -2.16500  -50.51900 -18.82400 1.000 140.35000 ? 201 AG7 A H5   1 
HETATM 2570 H H6   . AG7 B 2 .   ? -2.56200  -49.41100 -17.78800 1.000 140.35000 ? 201 AG7 A H6   1 
HETATM 2571 H H7   . AG7 B 2 .   ? -2.13000  -50.83800 -17.28500 1.000 140.35000 ? 201 AG7 A H7   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   . PRO A 2   ? 1.38210 1.15170 1.47860 0.01980  -0.00950 0.10110  0   PRO A N   
2    C CA  . PRO A 2   ? 1.66890 1.40710 1.75010 0.00650  -0.01230 0.09680  0   PRO A CA  
3    C C   . PRO A 2   ? 1.48620 1.20960 1.56320 0.01990  0.00450  0.06420  0   PRO A C   
4    O O   . PRO A 2   ? 1.57040 1.31080 1.65760 0.03870  0.01870  0.04710  0   PRO A O   
5    C CB  . PRO A 2   ? 1.49650 1.18500 1.59270 0.00570  -0.03590 0.11320  0   PRO A CB  
6    C CG  . PRO A 2   ? 1.60420 1.31170 1.71530 0.00650  -0.04830 0.13790  0   PRO A CG  
7    C CD  . PRO A 2   ? 1.63300 1.38250 1.75110 0.02370  -0.03020 0.12320  0   PRO A CD  
15   N N   . ALA A 3   ? 2.19970 1.89310 2.26090 0.00850  0.00180  0.05700  1   ALA A N   
16   C CA  . ALA A 3   ? 1.94410 1.62340 1.99570 0.01810  0.01660  0.02660  1   ALA A CA  
17   C C   . ALA A 3   ? 1.84350 1.47450 1.88010 0.00480  0.00500  0.02280  1   ALA A C   
18   O O   . ALA A 3   ? 1.68190 1.30450 1.71250 -0.01750 -0.01170 0.04610  1   ALA A O   
19   C CB  . ALA A 3   ? 1.61450 1.33890 1.65070 0.01210  0.03340  0.01800  1   ALA A CB  
25   N N   . PRO A 4   ? 1.56340 1.16450 1.59160 0.01580  0.01300  -0.00570 2   PRO A N   
26   C CA  . PRO A 4   ? 1.50040 1.05060 1.51050 0.00240  0.00020  -0.01220 2   PRO A CA  
27   C C   . PRO A 4   ? 1.51240 1.08420 1.49880 -0.02530 0.00020  -0.00420 2   PRO A C   
28   O O   . PRO A 4   ? 1.50650 1.12960 1.48980 -0.02830 0.01410  -0.00230 2   PRO A O   
29   C CB  . PRO A 4   ? 1.53710 1.05990 1.54140 0.02420  0.01330  -0.04940 2   PRO A CB  
30   C CG  . PRO A 4   ? 1.56200 1.12380 1.58700 0.04910  0.03260  -0.05870 2   PRO A CG  
31   C CD  . PRO A 4   ? 1.56930 1.18430 1.60140 0.03880  0.03430  -0.03330 2   PRO A CD  
39   N N   . PRO A 5   ? 1.71410 1.24760 1.68560 -0.04580 -0.01660 0.00050  3   PRO A N   
40   C CA  . PRO A 5   ? 1.71500 1.27420 1.66860 -0.07210 -0.01710 0.00900  3   PRO A CA  
41   C C   . PRO A 5   ? 1.70330 1.27340 1.63820 -0.06780 -0.00050 -0.01740 3   PRO A C   
42   O O   . PRO A 5   ? 1.55260 1.16380 1.48140 -0.08130 0.00490  -0.01080 3   PRO A O   
43   C CB  . PRO A 5   ? 1.49430 1.00350 1.43860 -0.09550 -0.04260 0.02140  3   PRO A CB  
44   C CG  . PRO A 5   ? 1.66260 1.10610 1.60980 -0.07520 -0.05050 0.00130  3   PRO A CG  
45   C CD  . PRO A 5   ? 1.54420 1.00870 1.51620 -0.04670 -0.03840 -0.00090 3   PRO A CD  
53   N N   . SER A 6   ? 1.48040 1.01760 1.40690 -0.04910 0.00760  -0.04690 4   SER A N   
54   C CA  . SER A 6   ? 1.46590 1.01470 1.37070 -0.04820 0.02250  -0.07010 4   SER A CA  
55   C C   . SER A 6   ? 1.41090 1.02100 1.32470 -0.04210 0.03970  -0.06600 4   SER A C   
56   O O   . SER A 6   ? 1.43890 1.07470 1.33990 -0.05490 0.04300  -0.06580 4   SER A O   
57   C CB  . SER A 6   ? 1.47620 0.98680 1.37110 -0.02720 0.03120  -0.10310 4   SER A CB  
58   O OG  . SER A 6   ? 1.46460 0.96270 1.38620 -0.00330 0.03170  -0.10420 4   SER A OG  
64   N N   . ILE A 7   ? 1.47700 1.10910 1.41390 -0.02280 0.04800  -0.06200 5   ILE A N   
65   C CA  . ILE A 7   ? 1.44760 1.13230 1.39280 -0.01690 0.06140  -0.05900 5   ILE A CA  
66   C C   . ILE A 7   ? 1.31990 1.03940 1.26600 -0.03510 0.05500  -0.03830 5   ILE A C   
67   O O   . ILE A 7   ? 1.25820 1.00840 1.19880 -0.03930 0.06120  -0.04090 5   ILE A O   
68   C CB  . ILE A 7   ? 1.45030 1.14980 1.42120 0.00460  0.06760  -0.05580 5   ILE A CB  
69   C CG1 . ILE A 7   ? 1.44240 1.12040 1.41650 0.02560  0.07830  -0.07980 5   ILE A CG1 
70   C CG2 . ILE A 7   ? 1.29920 1.04980 1.27840 0.00740  0.07640  -0.04920 5   ILE A CG2 
71   C CD1 . ILE A 7   ? 1.48140 1.16070 1.48640 0.04680  0.07810  -0.07490 5   ILE A CD1 
83   N N   . TRP A 8   ? 1.33240 1.04900 1.28640 -0.04630 0.04200  -0.01710 6   TRP A N   
84   C CA  . TRP A 8   ? 1.21860 0.97650 1.17570 -0.06230 0.03830  0.00170  6   TRP A CA  
85   C C   . TRP A 8   ? 1.10210 0.86410 1.04480 -0.07940 0.03550  -0.00220 6   TRP A C   
86   O O   . TRP A 8   ? 1.02540 0.82930 0.97230 -0.08320 0.03940  0.00150  6   TRP A O   
87   C CB  . TRP A 8   ? 1.11720 0.87220 1.08240 -0.07550 0.02440  0.02680  6   TRP A CB  
88   C CG  . TRP A 8   ? 1.20330 0.97510 1.18390 -0.06370 0.02560  0.03840  6   TRP A CG  
89   C CD1 . TRP A 8   ? 1.17820 0.91740 1.16860 -0.05480 0.01740  0.04360  6   TRP A CD1 
90   C CD2 . TRP A 8   ? 1.05020 0.87440 1.03810 -0.05980 0.03320  0.04590  6   TRP A CD2 
91   N NE1 . TRP A 8   ? 1.13640 0.90610 1.13910 -0.04760 0.01900  0.05640  6   TRP A NE1 
92   C CE2 . TRP A 8   ? 1.06730 0.88860 1.06630 -0.05080 0.02910  0.05690  6   TRP A CE2 
93   C CE3 . TRP A 8   ? 1.08510 0.95640 1.07150 -0.06190 0.04180  0.04320  6   TRP A CE3 
94   C CZ2 . TRP A 8   ? 1.00460 0.86850 1.00880 -0.04630 0.03340  0.06490  6   TRP A CZ2 
95   C CZ3 . TRP A 8   ? 1.08930 1.00080 1.08200 -0.05480 0.04670  0.04850  6   TRP A CZ3 
96   C CH2 . TRP A 8   ? 1.06250 0.97010 1.06170 -0.04820 0.04270  0.05910  6   TRP A CH2 
107  N N   . SER A 9   ? 1.16640 0.88390 1.09280 -0.08920 0.02710  -0.01040 7   SER A N   
108  C CA  . SER A 9   ? 1.11760 0.83700 1.02970 -0.10870 0.02090  -0.01150 7   SER A CA  
109  C C   . SER A 9   ? 1.11910 0.86490 1.02560 -0.10200 0.03200  -0.02500 7   SER A C   
110  O O   . SER A 9   ? 1.03570 0.80330 0.94020 -0.11590 0.02700  -0.02000 7   SER A O   
111  C CB  . SER A 9   ? 1.03990 0.70020 0.93020 -0.11870 0.00950  -0.02260 7   SER A CB  
112  O OG  . SER A 9   ? 1.20280 0.84550 1.07330 -0.10880 0.01940  -0.04890 7   SER A OG  
118  N N   . ARG A 10  ? 1.05060 0.79570 0.95660 -0.08190 0.04530  -0.04030 8   ARG A N   
119  C CA  . ARG A 10  ? 1.10660 0.87410 1.00650 -0.07820 0.05340  -0.05040 8   ARG A CA  
120  C C   . ARG A 10  ? 1.07160 0.88760 0.99060 -0.07690 0.05340  -0.03800 8   ARG A C   
121  O O   . ARG A 10  ? 0.96550 0.79930 0.88170 -0.08150 0.05170  -0.04020 8   ARG A O   
122  C CB  . ARG A 10  ? 1.12780 0.88880 1.02560 -0.05900 0.06730  -0.06650 8   ARG A CB  
123  C CG  . ARG A 10  ? 1.15250 0.86930 1.03280 -0.05470 0.07060  -0.08490 8   ARG A CG  
124  C CD  . ARG A 10  ? 1.10690 0.82560 1.00120 -0.03130 0.08380  -0.09410 8   ARG A CD  
125  N NE  . ARG A 10  ? 1.13880 0.81760 1.02230 -0.02180 0.08780  -0.11420 8   ARG A NE  
126  C CZ  . ARG A 10  ? 1.11020 0.78180 0.97240 -0.01860 0.09920  -0.13660 8   ARG A CZ  
127  N NH1 . ARG A 10  ? 1.11950 0.81720 0.96570 -0.02870 0.10490  -0.13850 8   ARG A NH1 
128  N NH2 . ARG A 10  ? 1.12070 0.75850 0.97730 -0.00480 0.10430  -0.15790 8   ARG A NH2 
142  N N   . ILE A 11  ? 1.03660 0.87360 0.97430 -0.07040 0.05430  -0.02590 9   ILE A N   
143  C CA  . ILE A 11  ? 1.05220 0.93530 1.00640 -0.06650 0.05540  -0.01860 9   ILE A CA  
144  C C   . ILE A 11  ? 1.00170 0.90590 0.96000 -0.08290 0.04660  -0.00910 9   ILE A C   
145  O O   . ILE A 11  ? 0.95150 0.84910 0.90900 -0.09810 0.03950  0.00270  9   ILE A O   
146  C CB  . ILE A 11  ? 1.02690 0.92790 0.99490 -0.05750 0.05850  -0.00870 9   ILE A CB  
147  C CG1 . ILE A 11  ? 0.96920 0.85130 0.93760 -0.04120 0.06540  -0.01680 9   ILE A CG1 
148  C CG2 . ILE A 11  ? 0.88410 0.83250 0.86560 -0.05180 0.06040  -0.00580 9   ILE A CG2 
149  C CD1 . ILE A 11  ? 1.02450 0.92760 1.00580 -0.03160 0.06700  -0.00770 9   ILE A CD1 
161  N N   . VAL A 12  ? 0.90910 0.83910 0.87410 -0.08080 0.04530  -0.01290 10  VAL A N   
162  C CA  . VAL A 12  ? 0.92920 0.88550 0.90430 -0.09370 0.03660  -0.00460 10  VAL A CA  
163  C C   . VAL A 12  ? 0.84770 0.84820 0.84420 -0.08030 0.03800  -0.00690 10  VAL A C   
164  O O   . VAL A 12  ? 0.89120 0.88980 0.88820 -0.06560 0.04090  -0.01700 10  VAL A O   
165  C CB  . VAL A 12  ? 0.96230 0.89300 0.92110 -0.10840 0.02720  -0.00860 10  VAL A CB  
166  C CG1 . VAL A 12  ? 1.01960 0.90210 0.95440 -0.11960 0.02530  -0.01130 10  VAL A CG1 
167  C CG2 . VAL A 12  ? 0.99100 0.91610 0.94300 -0.09940 0.02820  -0.02040 10  VAL A CG2 
177  N N   . ASN A 13  ? 0.86840 0.90980 0.88410 -0.08560 0.03530  0.00240  11  ASN A N   
178  C CA  . ASN A 13  ? 0.84540 0.93070 0.88440 -0.07060 0.03610  -0.00290 11  ASN A CA  
179  C C   . ASN A 13  ? 0.85940 0.93340 0.90090 -0.06610 0.02640  -0.01160 11  ASN A C   
180  O O   . ASN A 13  ? 0.77240 0.82860 0.80620 -0.08140 0.01660  -0.00750 11  ASN A O   
181  C CB  . ASN A 13  ? 0.73330 0.86930 0.79440 -0.07870 0.03550  0.00830  11  ASN A CB  
182  C CG  . ASN A 13  ? 1.01940 1.15530 1.08600 -0.09780 0.02300  0.01740  11  ASN A CG  
183  O OD1 . ASN A 13  ? 1.03450 1.20570 1.12580 -0.09380 0.01720  0.01670  11  ASN A OD1 
184  N ND2 . ASN A 13  ? 1.16000 1.25610 1.20510 -0.11830 0.01740  0.02540  11  ASN A ND2 
191  N N   . PHE A 14  ? 0.78010 0.86250 0.83060 -0.04680 0.02680  -0.02260 12  PHE A N   
192  C CA  . PHE A 14  ? 0.81450 0.88360 0.86800 -0.04260 0.01470  -0.02850 12  PHE A CA  
193  C C   . PHE A 14  ? 0.69300 0.79340 0.77290 -0.02120 0.01120  -0.03800 12  PHE A C   
194  O O   . PHE A 14  ? 0.70170 0.79840 0.77920 -0.00640 0.01560  -0.04710 12  PHE A O   
195  C CB  . PHE A 14  ? 0.89260 0.92040 0.92130 -0.04380 0.01620  -0.03290 12  PHE A CB  
196  C CG  . PHE A 14  ? 0.93760 0.94620 0.95980 -0.05110 0.00240  -0.03260 12  PHE A CG  
197  C CD1 . PHE A 14  ? 0.85610 0.85700 0.88120 -0.04130 -0.00450 -0.03750 12  PHE A CD1 
198  C CD2 . PHE A 14  ? 0.88590 0.88320 0.89720 -0.07030 -0.00600 -0.02570 12  PHE A CD2 
199  C CE1 . PHE A 14  ? 0.86310 0.84690 0.88080 -0.05140 -0.01950 -0.03340 12  PHE A CE1 
200  C CE2 . PHE A 14  ? 0.87090 0.85190 0.87280 -0.07980 -0.02010 -0.02320 12  PHE A CE2 
201  C CZ  . PHE A 14  ? 0.88580 0.86080 0.89120 -0.07070 -0.02680 -0.02600 12  PHE A CZ  
211  N N   . GLY A 15  ? 0.71640 0.84770 0.82270 -0.01880 0.00230  -0.03670 13  GLY A N   
212  C CA  . GLY A 15  ? 0.71120 0.87100 0.84540 0.00490  -0.00220 -0.04940 13  GLY A CA  
213  C C   . GLY A 15  ? 0.68380 0.87450 0.82050 0.01880  0.01410  -0.05800 13  GLY A C   
214  O O   . GLY A 15  ? 0.74920 0.96910 0.88560 0.01000  0.02630  -0.05000 13  GLY A O   
218  N N   . SER A 16  ? 0.63820 0.82170 0.77500 0.03830  0.01270  -0.07320 14  SER A N   
219  C CA  . SER A 16  ? 0.69590 0.90730 0.83090 0.05200  0.02630  -0.08370 14  SER A CA  
220  C C   . SER A 16  ? 0.71220 0.90540 0.81820 0.04020  0.03830  -0.07480 14  SER A C   
221  O O   . SER A 16  ? 0.63130 0.84920 0.73170 0.04630  0.04940  -0.07890 14  SER A O   
222  C CB  . SER A 16  ? 0.61010 0.81320 0.75250 0.07600  0.01710  -0.10420 14  SER A CB  
223  O OG  . SER A 16  ? 0.79850 0.96910 0.91620 0.07520  0.01870  -0.10570 14  SER A OG  
229  N N   . GLY A 17  ? 0.70870 0.86080 0.79640 0.02420  0.03590  -0.06360 15  GLY A N   
230  C CA  . GLY A 17  ? 0.74550 0.87770 0.81080 0.01610  0.04540  -0.05620 15  GLY A CA  
231  C C   . GLY A 17  ? 0.71730 0.82440 0.76970 -0.00430 0.04640  -0.04230 15  GLY A C   
232  O O   . GLY A 17  ? 0.68900 0.81140 0.74820 -0.01630 0.04530  -0.03380 15  GLY A O   
236  N N   . TRP A 18  ? 0.78450 0.85390 0.81920 -0.00810 0.04800  -0.04090 16  TRP A N   
237  C CA  . TRP A 18  ? 0.83320 0.87450 0.85280 -0.02420 0.05010  -0.03220 16  TRP A CA  
238  C C   . TRP A 18  ? 0.89740 0.90320 0.90330 -0.02600 0.04740  -0.03730 16  TRP A C   
239  O O   . TRP A 18  ? 0.81270 0.81630 0.82140 -0.01690 0.04350  -0.04380 16  TRP A O   
240  C CB  . TRP A 18  ? 0.74030 0.77710 0.75250 -0.02640 0.05830  -0.02470 16  TRP A CB  
241  C CG  . TRP A 18  ? 0.80630 0.88210 0.82780 -0.02760 0.06170  -0.01720 16  TRP A CG  
242  C CD1 . TRP A 18  ? 0.75700 0.86510 0.78530 -0.01490 0.06560  -0.02230 16  TRP A CD1 
243  C CD2 . TRP A 18  ? 0.82610 0.91510 0.84920 -0.04440 0.06140  -0.00280 16  TRP A CD2 
244  N NE1 . TRP A 18  ? 0.73420 0.87970 0.76710 -0.02250 0.06990  -0.01230 16  TRP A NE1 
245  C CE2 . TRP A 18  ? 0.83720 0.97250 0.86860 -0.04170 0.06680  0.00170  16  TRP A CE2 
246  C CE3 . TRP A 18  ? 0.75600 0.82200 0.77260 -0.06300 0.05580  0.00680  16  TRP A CE3 
247  C CZ2 . TRP A 18  ? 0.74300 0.90670 0.77840 -0.05860 0.06760  0.01840  16  TRP A CZ2 
248  C CZ3 . TRP A 18  ? 0.82610 0.91460 0.84750 -0.07970 0.05400  0.02330  16  TRP A CZ3 
249  C CH2 . TRP A 18  ? 0.82100 0.96010 0.85270 -0.07820 0.06030  0.03040  16  TRP A CH2 
260  N N   . GLY A 19  ? 0.93430 0.91310 0.92440 -0.03890 0.04890  -0.03440 17  GLY A N   
261  C CA  . GLY A 19  ? 0.88200 0.83220 0.85540 -0.04230 0.04960  -0.04010 17  GLY A CA  
262  C C   . GLY A 19  ? 0.93870 0.86010 0.89570 -0.04870 0.05660  -0.04110 17  GLY A C   
263  O O   . GLY A 19  ? 0.93850 0.85620 0.89580 -0.05520 0.05610  -0.03490 17  GLY A O   
267  N N   . PHE A 20  ? 0.93950 0.84120 0.88270 -0.04700 0.06250  -0.04900 18  PHE A N   
268  C CA  . PHE A 20  ? 0.99500 0.86990 0.92660 -0.04570 0.07110  -0.05470 18  PHE A CA  
269  C C   . PHE A 20  ? 0.99320 0.84670 0.90010 -0.05520 0.07330  -0.06510 18  PHE A C   
270  O O   . PHE A 20  ? 0.93310 0.79470 0.83390 -0.05560 0.07540  -0.06850 18  PHE A O   
271  C CB  . PHE A 20  ? 0.93160 0.81220 0.87520 -0.02930 0.08020  -0.05640 18  PHE A CB  
272  C CG  . PHE A 20  ? 0.95920 0.81500 0.89890 -0.02310 0.08820  -0.06270 18  PHE A CG  
273  C CD1 . PHE A 20  ? 0.92550 0.76420 0.86800 -0.02480 0.08410  -0.05730 18  PHE A CD1 
274  C CD2 . PHE A 20  ? 0.90640 0.75790 0.84230 -0.01520 0.09880  -0.07350 18  PHE A CD2 
275  C CE1 . PHE A 20  ? 0.93120 0.74220 0.87340 -0.01680 0.08830  -0.06380 18  PHE A CE1 
276  C CE2 . PHE A 20  ? 0.91920 0.74940 0.85640 -0.00530 0.10630  -0.08200 18  PHE A CE2 
277  C CZ  . PHE A 20  ? 0.99560 0.80230 0.93640 -0.00500 0.09980  -0.07780 18  PHE A CZ  
287  N N   . TRP A 21  ? 0.95930 0.78520 0.84980 -0.06450 0.07160  -0.06970 19  TRP A N   
288  C CA  . TRP A 21  ? 1.05700 0.85990 0.91810 -0.07350 0.07450  -0.08310 19  TRP A CA  
289  C C   . TRP A 21  ? 1.06050 0.85260 0.91830 -0.05850 0.09020  -0.09740 19  TRP A C   
290  O O   . TRP A 21  ? 1.12220 0.88910 0.98080 -0.05110 0.09300  -0.10420 19  TRP A O   
291  C CB  . TRP A 21  ? 1.00500 0.77910 0.84860 -0.08930 0.06460  -0.08450 19  TRP A CB  
292  C CG  . TRP A 21  ? 1.08390 0.87210 0.92870 -0.10670 0.04930  -0.07200 19  TRP A CG  
293  C CD1 . TRP A 21  ? 1.04030 0.84270 0.90490 -0.11230 0.03930  -0.05720 19  TRP A CD1 
294  C CD2 . TRP A 21  ? 1.06610 0.85940 0.89390 -0.12130 0.04140  -0.07200 19  TRP A CD2 
295  N NE1 . TRP A 21  ? 1.03910 0.85680 0.90390 -0.12710 0.02640  -0.04920 19  TRP A NE1 
296  C CE2 . TRP A 21  ? 1.02490 0.83460 0.86720 -0.13300 0.02590  -0.05730 19  TRP A CE2 
297  C CE3 . TRP A 21  ? 1.12420 0.91300 0.92630 -0.12670 0.04550  -0.08140 19  TRP A CE3 
298  C CZ2 . TRP A 21  ? 0.98680 0.80480 0.82140 -0.14840 0.01230  -0.05160 19  TRP A CZ2 
299  C CZ3 . TRP A 21  ? 1.14820 0.94390 0.93800 -0.14480 0.03150  -0.07430 19  TRP A CZ3 
300  C CH2 . TRP A 21  ? 1.06780 0.87620 0.87510 -0.15460 0.01400  -0.05940 19  TRP A CH2 
311  N N   . VAL A 22  ? 0.92730 0.73960 0.78410 -0.05400 0.09920  -0.10100 20  VAL A N   
312  C CA  . VAL A 22  ? 0.98000 0.79040 0.83540 -0.04020 0.11590  -0.11530 20  VAL A CA  
313  C C   . VAL A 22  ? 1.05960 0.84170 0.88290 -0.04590 0.12180  -0.13540 20  VAL A C   
314  O O   . VAL A 22  ? 1.03860 0.80820 0.86240 -0.03090 0.13430  -0.15190 20  VAL A O   
315  C CB  . VAL A 22  ? 1.02550 0.86960 0.88700 -0.03870 0.12310  -0.11150 20  VAL A CB  
316  C CG1 . VAL A 22  ? 0.94140 0.79250 0.80280 -0.02590 0.14230  -0.12660 20  VAL A CG1 
317  C CG2 . VAL A 22  ? 0.90640 0.77230 0.79840 -0.03120 0.11590  -0.09520 20  VAL A CG2 
327  N N   . SER A 23  ? 0.98450 0.75590 0.78000 -0.06650 0.11210  -0.13550 21  SER A N   
328  C CA  . SER A 23  ? 1.06890 0.81180 0.82700 -0.07510 0.11540  -0.15590 21  SER A CA  
329  C C   . SER A 23  ? 1.08990 0.81820 0.82750 -0.09960 0.09620  -0.14740 21  SER A C   
330  O O   . SER A 23  ? 1.01850 0.76510 0.77430 -0.10730 0.08300  -0.12680 21  SER A O   
331  C CB  . SER A 23  ? 1.11100 0.87440 0.84700 -0.07620 0.13210  -0.16930 21  SER A CB  
332  O OG  . SER A 23  ? 0.96860 0.75030 0.68600 -0.09870 0.12300  -0.15700 21  SER A OG  
338  N N   . PRO A 24  ? 1.13550 0.83180 0.83630 -0.11160 0.09340  -0.16390 22  PRO A N   
339  C CA  . PRO A 24  ? 1.17030 0.85290 0.85210 -0.13710 0.07270  -0.15450 22  PRO A CA  
340  C C   . PRO A 24  ? 1.12030 0.83590 0.80310 -0.15280 0.06290  -0.13570 22  PRO A C   
341  O O   . PRO A 24  ? 1.16240 0.87810 0.84850 -0.16930 0.04360  -0.12040 22  PRO A O   
342  C CB  . PRO A 24  ? 1.16800 0.81470 0.80220 -0.14670 0.07500  -0.18030 22  PRO A CB  
343  C CG  . PRO A 24  ? 1.12420 0.75180 0.76490 -0.12110 0.09210  -0.20250 22  PRO A CG  
344  C CD  . PRO A 24  ? 1.10400 0.77250 0.78120 -0.10080 0.10740  -0.19330 22  PRO A CD  
352  N N   . SER A 25  ? 1.08770 0.83180 0.77020 -0.14850 0.07430  -0.13510 23  SER A N   
353  C CA  . SER A 25  ? 1.17550 0.94540 0.85770 -0.16400 0.06210  -0.11680 23  SER A CA  
354  C C   . SER A 25  ? 1.14930 0.95180 0.86680 -0.15050 0.06560  -0.10310 23  SER A C   
355  O O   . SER A 25  ? 1.09870 0.91910 0.82050 -0.16160 0.05240  -0.08710 23  SER A O   
356  C CB  . SER A 25  ? 1.20980 0.98050 0.84560 -0.18310 0.06560  -0.12570 23  SER A CB  
357  O OG  . SER A 25  ? 1.26200 1.04190 0.88740 -0.17000 0.09050  -0.14380 23  SER A OG  
363  N N   . LEU A 26  ? 1.03590 0.84420 0.77870 -0.12770 0.08010  -0.10820 24  LEU A N   
364  C CA  . LEU A 26  ? 1.04410 0.88080 0.81740 -0.11560 0.08280  -0.09690 24  LEU A CA  
365  C C   . LEU A 26  ? 0.99620 0.83580 0.80590 -0.10190 0.07570  -0.08730 24  LEU A C   
366  O O   . LEU A 26  ? 0.85560 0.68330 0.67580 -0.08880 0.08320  -0.09370 24  LEU A O   
367  C CB  . LEU A 26  ? 1.06780 0.91620 0.84220 -0.10170 0.10470  -0.10870 24  LEU A CB  
368  C CG  . LEU A 26  ? 0.96170 0.84130 0.76010 -0.09520 0.10710  -0.09680 24  LEU A CG  
369  C CD1 . LEU A 26  ? 1.11590 1.00810 0.90980 -0.11380 0.08920  -0.07930 24  LEU A CD1 
370  C CD2 . LEU A 26  ? 1.07520 0.97240 0.86720 -0.08860 0.12910  -0.10870 24  LEU A CD2 
382  N N   . PHE A 27  ? 1.01610 0.87210 0.84450 -0.10470 0.06060  -0.07230 25  PHE A N   
383  C CA  . PHE A 27  ? 1.02730 0.89290 0.88740 -0.09320 0.05370  -0.06420 25  PHE A CA  
384  C C   . PHE A 27  ? 0.94660 0.83350 0.82990 -0.08180 0.05190  -0.05770 25  PHE A C   
385  O O   . PHE A 27  ? 0.87390 0.76820 0.75530 -0.08970 0.04140  -0.05090 25  PHE A O   
386  C CB  . PHE A 27  ? 1.09660 0.96360 0.96040 -0.10540 0.03590  -0.05540 25  PHE A CB  
387  C CG  . PHE A 27  ? 1.03790 0.91860 0.93040 -0.09540 0.03250  -0.04960 25  PHE A CG  
388  C CD1 . PHE A 27  ? 0.99460 0.86450 0.88690 -0.09410 0.03880  -0.05170 25  PHE A CD1 
389  C CD2 . PHE A 27  ? 0.96210 0.86710 0.88110 -0.08820 0.02210  -0.04210 25  PHE A CD2 
390  C CE1 . PHE A 27  ? 1.00260 0.89090 0.91890 -0.08850 0.03620  -0.04390 25  PHE A CE1 
391  C CE2 . PHE A 27  ? 0.98190 0.90660 0.92530 -0.07920 0.02160  -0.03850 25  PHE A CE2 
392  C CZ  . PHE A 27  ? 1.02580 0.94480 0.96690 -0.08100 0.02930  -0.03800 25  PHE A CZ  
402  N N   . ILE A 28  ? 0.93480 0.82900 0.83830 -0.06480 0.05970  -0.05880 26  ILE A N   
403  C CA  . ILE A 28  ? 0.92560 0.83710 0.84950 -0.05390 0.05680  -0.05420 26  ILE A CA  
404  C C   . ILE A 28  ? 0.91940 0.84280 0.86570 -0.04320 0.05020  -0.05100 26  ILE A C   
405  O O   . ILE A 28  ? 0.81350 0.73520 0.76230 -0.04130 0.05430  -0.05130 26  ILE A O   
406  C CB  . ILE A 28  ? 0.87820 0.79340 0.80570 -0.04370 0.07140  -0.05810 26  ILE A CB  
407  C CG1 . ILE A 28  ? 0.86730 0.77910 0.80660 -0.03040 0.07970  -0.06070 26  ILE A CG1 
408  C CG2 . ILE A 28  ? 0.88580 0.79470 0.79060 -0.05240 0.08290  -0.06500 26  ILE A CG2 
409  C CD1 . ILE A 28  ? 0.91710 0.83100 0.86280 -0.01950 0.09330  -0.06470 26  ILE A CD1 
421  N N   . THR A 29  ? 0.97060 0.90630 0.93220 -0.03710 0.03920  -0.04800 27  THR A N   
422  C CA  . THR A 29  ? 0.98220 0.93410 0.96370 -0.02540 0.03380  -0.04850 27  THR A CA  
423  C C   . THR A 29  ? 0.86230 0.82070 0.85640 -0.01540 0.02460  -0.04980 27  THR A C   
424  O O   . THR A 29  ? 0.82020 0.77130 0.80930 -0.01900 0.02320  -0.04740 27  THR A O   
425  C CB  . THR A 29  ? 0.94970 0.90860 0.93720 -0.03110 0.02330  -0.04650 27  THR A CB  
426  O OG1 . THR A 29  ? 0.93730 0.91960 0.94570 -0.01790 0.02080  -0.04910 27  THR A OG1 
427  C CG2 . THR A 29  ? 0.87360 0.82490 0.85910 -0.03990 0.00680  -0.04280 27  THR A CG2 
435  N N   . SER A 30  ? 0.93490 0.90830 0.94540 -0.00340 0.01790  -0.05410 28  SER A N   
436  C CA  . SER A 30  ? 0.85800 0.83350 0.87970 0.00760  0.00630  -0.05870 28  SER A CA  
437  C C   . SER A 30  ? 0.82600 0.79740 0.85880 0.00810  -0.01390 -0.05990 28  SER A C   
438  O O   . SER A 30  ? 0.80290 0.78300 0.84300 0.00680  -0.01720 -0.05970 28  SER A O   
439  C CB  . SER A 30  ? 0.84480 0.83960 0.87490 0.02280  0.01200  -0.06640 28  SER A CB  
440  O OG  . SER A 30  ? 0.94240 0.93740 0.98220 0.03480  -0.00190 -0.07520 28  SER A OG  
446  N N   . THR A 31  ? 0.89380 0.85150 0.93030 0.00920  -0.02980 -0.05950 29  THR A N   
447  C CA  . THR A 31  ? 0.82490 0.77300 0.87460 0.01050  -0.05370 -0.05950 29  THR A CA  
448  C C   . THR A 31  ? 0.82170 0.78640 0.89330 0.03170  -0.05890 -0.07400 29  THR A C   
449  O O   . THR A 31  ? 0.81760 0.78300 0.90580 0.03550  -0.07440 -0.07510 29  THR A O   
450  C CB  . THR A 31  ? 0.92990 0.85630 0.97880 0.00550  -0.07230 -0.05430 29  THR A CB  
451  O OG1 . THR A 31  ? 0.95580 0.87570 0.98560 -0.01530 -0.06550 -0.04020 29  THR A OG1 
452  C CG2 . THR A 31  ? 0.91600 0.82650 0.98080 0.00730  -0.10180 -0.05310 29  THR A CG2 
460  N N   . HIS A 32  ? 0.78010 0.76130 0.85240 0.04570  -0.04620 -0.08530 30  HIS A N   
461  C CA  . HIS A 32  ? 0.79750 0.80170 0.88810 0.06650  -0.04770 -0.10180 30  HIS A CA  
462  C C   . HIS A 32  ? 0.75710 0.79040 0.85800 0.06550  -0.03740 -0.09980 30  HIS A C   
463  O O   . HIS A 32  ? 0.67710 0.73130 0.80080 0.08070  -0.04370 -0.11070 30  HIS A O   
464  C CB  . HIS A 32  ? 0.74780 0.76560 0.83040 0.07780  -0.03570 -0.11280 30  HIS A CB  
465  C CG  . HIS A 32  ? 0.77390 0.77770 0.86160 0.09320  -0.05290 -0.12840 30  HIS A CG  
466  N ND1 . HIS A 32  ? 0.86700 0.88750 0.96980 0.11560  -0.05820 -0.14990 30  HIS A ND1 
467  C CD2 . HIS A 32  ? 0.89420 0.86870 0.97390 0.08920  -0.06700 -0.12650 30  HIS A CD2 
468  C CE1 . HIS A 32  ? 0.88800 0.88430 0.98970 0.12560  -0.07600 -0.16260 30  HIS A CE1 
469  N NE2 . HIS A 32  ? 0.90390 0.87160 0.99180 0.10840  -0.08270 -0.14700 30  HIS A NE2 
477  N N   . VAL A 33  ? 0.76430 0.79980 0.85060 0.04830  -0.02280 -0.08660 31  VAL A N   
478  C CA  . VAL A 33  ? 0.82520 0.88950 0.91930 0.04450  -0.01260 -0.08290 31  VAL A CA  
479  C C   . VAL A 33  ? 0.73510 0.79170 0.83420 0.03050  -0.02370 -0.07230 31  VAL A C   
480  O O   . VAL A 33  ? 0.74930 0.83280 0.86260 0.02860  -0.02130 -0.06950 31  VAL A O   
481  C CB  . VAL A 33  ? 0.81740 0.88730 0.89290 0.03390  0.00770  -0.07520 31  VAL A CB  
482  C CG1 . VAL A 33  ? 0.80890 0.88440 0.87700 0.04460  0.01620  -0.08230 31  VAL A CG1 
483  C CG2 . VAL A 33  ? 0.85350 0.89170 0.90820 0.01500  0.00950  -0.06360 31  VAL A CG2 
493  N N   . ILE A 34  ? 0.77380 0.79800 0.86120 0.01870  -0.03620 -0.06470 32  ILE A N   
494  C CA  . ILE A 34  ? 0.79920 0.81550 0.88540 0.00200  -0.04740 -0.05320 32  ILE A CA  
495  C C   . ILE A 34  ? 0.83040 0.86630 0.95040 0.01390  -0.06470 -0.05650 32  ILE A C   
496  O O   . ILE A 34  ? 0.81930 0.85470 0.95870 0.03300  -0.07710 -0.06710 32  ILE A O   
497  C CB  . ILE A 34  ? 0.84040 0.82260 0.90570 -0.01400 -0.05840 -0.04420 32  ILE A CB  
498  C CG1 . ILE A 34  ? 0.92580 0.90060 0.98440 -0.03390 -0.07070 -0.03180 32  ILE A CG1 
499  C CG2 . ILE A 34  ? 0.86780 0.83620 0.94610 -0.00300 -0.07790 -0.04770 32  ILE A CG2 
500  C CD1 . ILE A 34  ? 0.94380 0.89160 0.97140 -0.05550 -0.07440 -0.02190 32  ILE A CD1 
512  N N   . PRO A 35  ? 0.78830 0.84160 0.91870 0.00450  -0.06790 -0.04850 33  PRO A N   
513  C CA  . PRO A 35  ? 0.83390 0.90920 1.00260 0.01720  -0.08610 -0.05060 33  PRO A CA  
514  C C   . PRO A 35  ? 0.81370 0.85770 0.98610 0.01170  -0.11490 -0.04270 33  PRO A C   
515  O O   . PRO A 35  ? 0.84000 0.85940 0.98730 -0.01290 -0.12200 -0.02780 33  PRO A O   
516  C CB  . PRO A 35  ? 0.81480 0.91740 0.99030 0.00280  -0.08120 -0.04000 33  PRO A CB  
517  C CG  . PRO A 35  ? 0.79150 0.88670 0.93340 -0.01310 -0.05880 -0.03600 33  PRO A CG  
518  C CD  . PRO A 35  ? 0.83570 0.89100 0.94660 -0.01670 -0.05580 -0.03810 33  PRO A CD  
526  N N   . GLN A 36  ? 0.78610 0.83080 0.98900 0.03440  -0.13260 -0.05300 34  GLN A N   
527  C CA  . GLN A 36  ? 0.87310 0.88420 1.08270 0.03070  -0.16440 -0.04440 34  GLN A CA  
528  C C   . GLN A 36  ? 0.83010 0.85300 1.07130 0.02920  -0.18820 -0.03420 34  GLN A C   
529  O O   . GLN A 36  ? 0.76690 0.76290 1.01920 0.02690  -0.21930 -0.02520 34  GLN A O   
530  C CB  . GLN A 36  ? 0.85550 0.85170 1.08200 0.05620  -0.17660 -0.06110 34  GLN A CB  
531  C CG  . GLN A 36  ? 0.97370 0.95160 1.16940 0.05430  -0.16100 -0.06730 34  GLN A CG  
532  C CD  . GLN A 36  ? 0.98170 0.92250 1.14510 0.02660  -0.17020 -0.04820 34  GLN A CD  
533  O OE1 . GLN A 36  ? 0.99250 0.93410 1.12670 0.00410  -0.15400 -0.03660 34  GLN A OE1 
534  N NE2 . GLN A 36  ? 0.93210 0.84080 1.10080 0.02780  -0.19690 -0.04520 34  GLN A NE2 
543  N N   . GLY A 37  ? 0.80200 0.86480 1.05950 0.02860  -0.17680 -0.03300 35  GLY A N   
544  C CA  . GLY A 37  ? 0.76240 0.84420 1.05730 0.02970  -0.19970 -0.02360 35  GLY A CA  
545  C C   . GLY A 37  ? 0.86330 0.95120 1.14060 -0.00180 -0.19960 -0.00310 35  GLY A C   
546  O O   . GLY A 37  ? 0.73070 0.83820 1.03900 -0.00440 -0.21890 0.00750  35  GLY A O   
550  N N   . THR A 38  ? 0.94600 1.01660 1.17500 -0.02520 -0.17970 0.00180  36  THR A N   
551  C CA  . THR A 38  ? 0.93510 1.00670 1.14090 -0.05520 -0.17790 0.01710  36  THR A CA  
552  C C   . THR A 38  ? 0.94740 0.97570 1.11340 -0.08340 -0.19460 0.03210  36  THR A C   
553  O O   . THR A 38  ? 0.99290 0.99100 1.12960 -0.08630 -0.19010 0.02940  36  THR A O   
554  C CB  . THR A 38  ? 0.93960 1.01910 1.11790 -0.06220 -0.14580 0.01100  36  THR A CB  
555  O OG1 . THR A 38  ? 0.96420 1.07910 1.17000 -0.03560 -0.12790 -0.00420 36  THR A OG1 
556  C CG2 . THR A 38  ? 0.94730 1.03930 1.11800 -0.08690 -0.14640 0.02390  36  THR A CG2 
564  N N   . GLN A 39  ? 0.98880 1.01770 1.15300 -0.10570 -0.21400 0.04900  37  GLN A N   
565  C CA  . GLN A 39  ? 0.99710 0.99040 1.11720 -0.13730 -0.22880 0.06410  37  GLN A CA  
566  C C   . GLN A 39  ? 1.07000 1.05290 1.14140 -0.16330 -0.21000 0.06420  37  GLN A C   
567  O O   . GLN A 39  ? 1.10790 1.06950 1.14250 -0.19250 -0.22260 0.07600  37  GLN A O   
568  C CB  . GLN A 39  ? 0.98880 0.98440 1.13290 -0.14810 -0.26670 0.08360  37  GLN A CB  
569  C CG  . GLN A 39  ? 0.99530 0.99730 1.19280 -0.12030 -0.29040 0.08290  37  GLN A CG  
570  C CD  . GLN A 39  ? 1.11370 1.10770 1.32940 -0.13440 -0.33250 0.10590  37  GLN A CD  
571  O OE1 . GLN A 39  ? 1.09810 1.06510 1.27140 -0.16750 -0.34710 0.12370  37  GLN A OE1 
572  N NE2 . GLN A 39  ? 1.14590 1.16560 1.42540 -0.10900 -0.35270 0.10540  37  GLN A NE2 
581  N N   . GLU A 40  ? 0.92150 0.91700 0.99010 -0.15380 -0.18140 0.05070  38  GLU A N   
582  C CA  . GLU A 40  ? 1.06040 1.04260 1.08790 -0.17510 -0.16520 0.04860  38  GLU A CA  
583  C C   . GLU A 40  ? 0.96840 0.95280 0.99000 -0.15900 -0.13410 0.03280  38  GLU A C   
584  O O   . GLU A 40  ? 0.89240 0.90380 0.94980 -0.13450 -0.12540 0.02600  38  GLU A O   
585  C CB  . GLU A 40  ? 0.98950 0.99240 1.03180 -0.18980 -0.17600 0.05880  38  GLU A CB  
586  C CG  . GLU A 40  ? 1.04870 1.04370 1.08480 -0.21410 -0.20730 0.07640  38  GLU A CG  
587  C CD  . GLU A 40  ? 1.16300 1.17160 1.20150 -0.23530 -0.21630 0.08630  38  GLU A CD  
588  O OE1 . GLU A 40  ? 1.15970 1.18020 1.20110 -0.23320 -0.19770 0.08000  38  GLU A OE1 
589  O OE2 . GLU A 40  ? 1.20460 1.21140 1.24210 -0.25610 -0.24420 0.10250  38  GLU A OE2 
596  N N   . PHE A 41  ? 1.02520 0.98150 1.00120 -0.17270 -0.11820 0.02640  39  PHE A N   
597  C CA  . PHE A 41  ? 1.03560 0.98950 1.00380 -0.16090 -0.09140 0.01370  39  PHE A CA  
598  C C   . PHE A 41  ? 1.00610 0.93700 0.93830 -0.18200 -0.08480 0.01160  39  PHE A C   
599  O O   . PHE A 41  ? 0.98620 0.88780 0.87710 -0.19910 -0.08630 0.00870  39  PHE A O   
600  C CB  . PHE A 41  ? 0.96830 0.90680 0.92160 -0.14850 -0.07780 0.00420  39  PHE A CB  
601  C CG  . PHE A 41  ? 0.84960 0.80660 0.83850 -0.12490 -0.08240 0.00290  39  PHE A CG  
602  C CD1 . PHE A 41  ? 0.80160 0.79070 0.83000 -0.10560 -0.08030 0.00010  39  PHE A CD1 
603  C CD2 . PHE A 41  ? 0.88510 0.82800 0.86670 -0.12300 -0.08950 0.00390  39  PHE A CD2 
604  C CE1 . PHE A 41  ? 0.92710 0.93010 0.98520 -0.08240 -0.08490 -0.00540 39  PHE A CE1 
605  C CE2 . PHE A 41  ? 0.84280 0.79610 0.85550 -0.10190 -0.09690 0.00130  39  PHE A CE2 
606  C CZ  . PHE A 41  ? 0.79850 0.78000 0.84860 -0.08030 -0.09460 -0.00530 39  PHE A CZ  
616  N N   . PHE A 42  ? 0.97210 0.91640 0.91870 -0.18170 -0.07860 0.01290  40  PHE A N   
617  C CA  . PHE A 42  ? 0.91950 0.83790 0.83550 -0.20190 -0.07650 0.01140  40  PHE A CA  
618  C C   . PHE A 42  ? 0.98830 0.89060 0.88020 -0.22930 -0.09780 0.01860  40  PHE A C   
619  O O   . PHE A 42  ? 0.94560 0.81100 0.79300 -0.24650 -0.09680 0.01080  40  PHE A O   
620  C CB  . PHE A 42  ? 0.98740 0.87120 0.86870 -0.19670 -0.05650 -0.00440 40  PHE A CB  
621  C CG  . PHE A 42  ? 0.96800 0.86600 0.87070 -0.17140 -0.03810 -0.01000 40  PHE A CG  
622  C CD1 . PHE A 42  ? 0.96730 0.88980 0.89830 -0.16430 -0.03350 -0.00400 40  PHE A CD1 
623  C CD2 . PHE A 42  ? 0.93600 0.82570 0.82940 -0.15720 -0.02610 -0.01960 40  PHE A CD2 
624  C CE1 . PHE A 42  ? 0.92850 0.86440 0.87520 -0.14330 -0.01800 -0.00850 40  PHE A CE1 
625  C CE2 . PHE A 42  ? 1.00170 0.90400 0.91380 -0.13570 -0.01150 -0.02380 40  PHE A CE2 
626  C CZ  . PHE A 42  ? 0.97940 0.90340 0.91650 -0.12860 -0.00780 -0.01870 40  PHE A CZ  
636  N N   . GLY A 43  ? 1.05490 0.98490 0.97650 -0.23280 -0.11820 0.03280  41  GLY A N   
637  C CA  . GLY A 43  ? 1.01440 0.93380 0.91770 -0.25970 -0.14240 0.04330  41  GLY A CA  
638  C C   . GLY A 43  ? 1.10120 0.99660 0.96890 -0.26900 -0.14970 0.04170  41  GLY A C   
639  O O   . GLY A 43  ? 1.12210 1.01230 0.97600 -0.29180 -0.17310 0.05320  41  GLY A O   
643  N N   . VAL A 44  ? 1.04530 0.92870 0.89770 -0.25430 -0.13170 0.02980  42  VAL A N   
644  C CA  . VAL A 44  ? 1.11060 0.97620 0.92750 -0.26530 -0.13620 0.02970  42  VAL A CA  
645  C C   . VAL A 44  ? 1.09880 0.98490 0.95220 -0.25360 -0.15230 0.04270  42  VAL A C   
646  O O   . VAL A 44  ? 1.04250 0.94650 0.93380 -0.22700 -0.14340 0.03900  42  VAL A O   
647  C CB  . VAL A 44  ? 1.08480 0.93040 0.86800 -0.25720 -0.10850 0.01100  42  VAL A CB  
648  C CG1 . VAL A 44  ? 1.15820 0.99350 0.90390 -0.27150 -0.11140 0.01250  42  VAL A CG1 
649  C CG2 . VAL A 44  ? 1.08260 0.90330 0.83450 -0.26490 -0.09510 -0.00400 42  VAL A CG2 
659  N N   . PRO A 45  ? 1.07560 0.95790 0.91860 -0.27290 -0.17800 0.05800  43  PRO A N   
660  C CA  . PRO A 45  ? 1.06880 0.96400 0.94800 -0.26140 -0.19730 0.07090  43  PRO A CA  
661  C C   . PRO A 45  ? 1.12950 1.01810 1.00300 -0.24620 -0.18110 0.06270  43  PRO A C   
662  O O   . PRO A 45  ? 1.08390 0.95670 0.91300 -0.25650 -0.16360 0.05450  43  PRO A O   
663  C CB  . PRO A 45  ? 0.95660 0.84100 0.81140 -0.29220 -0.22780 0.09020  43  PRO A CB  
664  C CG  . PRO A 45  ? 1.22960 1.10430 1.04950 -0.31670 -0.22790 0.08800  43  PRO A CG  
665  C CD  . PRO A 45  ? 1.18110 1.04480 0.97780 -0.30710 -0.19320 0.06470  43  PRO A CD  
673  N N   . THR A 46  ? 1.05770 0.96020 0.97780 -0.22100 -0.18740 0.06410  44  THR A N   
674  C CA  . THR A 46  ? 1.22160 1.11710 1.13970 -0.20860 -0.17780 0.05910  44  THR A CA  
675  C C   . THR A 46  ? 1.16570 1.04440 1.04880 -0.23370 -0.19220 0.07340  44  THR A C   
676  O O   . THR A 46  ? 1.06310 0.93620 0.92880 -0.23290 -0.17880 0.06970  44  THR A O   
677  C CB  . THR A 46  ? 1.15830 1.06710 1.13080 -0.17930 -0.18870 0.05800  44  THR A CB  
678  O OG1 . THR A 46  ? 1.13140 1.03500 1.12330 -0.18610 -0.22470 0.07590  44  THR A OG1 
679  C CG2 . THR A 46  ? 1.26050 1.19540 1.26980 -0.15870 -0.17910 0.04800  44  THR A CG2 
687  N N   . LYS A 47  ? 1.17480 1.04830 1.04730 -0.25790 -0.22000 0.09130  45  LYS A N   
688  C CA  . LYS A 47  ? 1.18770 1.04820 1.02240 -0.28700 -0.23560 0.10830  45  LYS A CA  
689  C C   . LYS A 47  ? 1.20680 1.06160 0.97970 -0.30720 -0.20860 0.09770  45  LYS A C   
690  O O   . LYS A 47  ? 1.17890 1.03070 0.91880 -0.32640 -0.20920 0.10650  45  LYS A O   
691  C CB  . LYS A 47  ? 1.22900 1.08620 1.06750 -0.30900 -0.27420 0.13150  45  LYS A CB  
692  C CG  . LYS A 47  ? 1.30680 1.16720 1.20670 -0.29060 -0.30740 0.14510  45  LYS A CG  
693  C CD  . LYS A 47  ? 1.30810 1.18720 1.26340 -0.25210 -0.29530 0.12720  45  LYS A CD  
694  C CE  . LYS A 47  ? 1.22340 1.10400 1.23700 -0.22890 -0.32440 0.13440  45  LYS A CE  
695  N NZ  . LYS A 47  ? 1.16080 1.02360 1.17320 -0.22140 -0.32620 0.13430  45  LYS A NZ  
709  N N   . GLN A 48  ? 1.15920 1.01330 0.91690 -0.30300 -0.18540 0.07870  46  GLN A N   
710  C CA  . GLN A 48  ? 1.18610 1.03270 0.88940 -0.31560 -0.15790 0.06250  46  GLN A CA  
711  C C   . GLN A 48  ? 1.14690 0.99820 0.85690 -0.29110 -0.12450 0.04320  46  GLN A C   
712  O O   . GLN A 48  ? 1.15200 1.00100 0.82220 -0.29780 -0.10100 0.02960  46  GLN A O   
713  C CB  . GLN A 48  ? 1.24650 1.08270 0.92800 -0.32540 -0.15450 0.05170  46  GLN A CB  
714  C CG  . GLN A 48  ? 1.40320 1.23520 1.07300 -0.35330 -0.18760 0.07060  46  GLN A CG  
715  C CD  . GLN A 48  ? 1.46260 1.27750 1.07860 -0.37670 -0.18240 0.05870  46  GLN A CD  
716  O OE1 . GLN A 48  ? 1.49400 1.30400 1.12010 -0.38010 -0.19220 0.05830  46  GLN A OE1 
717  N NE2 . GLN A 48  ? 1.49720 1.30430 1.05520 -0.39360 -0.16710 0.04840  46  GLN A NE2 
726  N N   . ILE A 49  ? 1.06090 0.92050 0.81990 -0.26260 -0.12210 0.04090  47  ILE A N   
727  C CA  . ILE A 49  ? 1.05230 0.91680 0.82150 -0.23900 -0.09350 0.02440  47  ILE A CA  
728  C C   . ILE A 49  ? 1.10350 0.97510 0.87780 -0.23770 -0.09490 0.03300  47  ILE A C   
729  O O   . ILE A 49  ? 1.05080 0.92290 0.84780 -0.23990 -0.12100 0.05010  47  ILE A O   
730  C CB  . ILE A 49  ? 0.99940 0.87130 0.81430 -0.21150 -0.09000 0.01750  47  ILE A CB  
731  C CG1 . ILE A 49  ? 1.04200 0.90870 0.85070 -0.21660 -0.08810 0.01140  47  ILE A CG1 
732  C CG2 . ILE A 49  ? 0.89750 0.77440 0.72330 -0.18860 -0.06430 0.00370  47  ILE A CG2 
733  C CD1 . ILE A 49  ? 0.97890 0.86170 0.83480 -0.19870 -0.09530 0.01370  47  ILE A CD1 
745  N N   . GLN A 50  ? 1.06630 0.94340 0.82200 -0.23410 -0.06840 0.02150  48  GLN A N   
746  C CA  . GLN A 50  ? 1.11650 1.00450 0.87460 -0.23600 -0.06660 0.03000  48  GLN A CA  
747  C C   . GLN A 50  ? 1.07330 0.96690 0.86920 -0.20590 -0.05440 0.02060  48  GLN A C   
748  O O   . GLN A 50  ? 1.14220 1.04000 0.93500 -0.19200 -0.02760 0.00390  48  GLN A O   
749  C CB  . GLN A 50  ? 1.10500 1.00340 0.81830 -0.25350 -0.04490 0.02420  48  GLN A CB  
750  C CG  . GLN A 50  ? 1.32070 1.23890 1.04000 -0.25130 -0.03280 0.02830  48  GLN A CG  
751  C CD  . GLN A 50  ? 1.43310 1.37040 1.11050 -0.26640 -0.00720 0.01970  48  GLN A CD  
752  O OE1 . GLN A 50  ? 1.42080 1.37850 1.10540 -0.25640 0.01470  0.01300  48  GLN A OE1 
753  N NE2 . GLN A 50  ? 1.39170 1.32510 1.02550 -0.29030 -0.00980 0.01910  48  GLN A NE2 
762  N N   . ILE A 51  ? 1.05620 0.94800 0.88730 -0.19560 -0.07570 0.03080  49  ILE A N   
763  C CA  . ILE A 51  ? 1.01390 0.91000 0.87900 -0.16830 -0.06830 0.02200  49  ILE A CA  
764  C C   . ILE A 51  ? 1.02820 0.93010 0.89560 -0.17240 -0.07020 0.03090  49  ILE A C   
765  O O   . ILE A 51  ? 0.85370 0.75070 0.71840 -0.19020 -0.09400 0.04930  49  ILE A O   
766  C CB  . ILE A 51  ? 0.94960 0.84110 0.85220 -0.15120 -0.08940 0.02280  49  ILE A CB  
767  C CG1 . ILE A 51  ? 0.99520 0.88910 0.90020 -0.14640 -0.08360 0.01430  49  ILE A CG1 
768  C CG2 . ILE A 51  ? 0.96630 0.86240 0.89850 -0.12550 -0.08420 0.01370  49  ILE A CG2 
769  C CD1 . ILE A 51  ? 0.96760 0.86280 0.90280 -0.14050 -0.10910 0.02040  49  ILE A CD1 
781  N N   . HIS A 52  ? 1.08810 1.00060 0.96180 -0.15770 -0.04730 0.02020  50  HIS A N   
782  C CA  . HIS A 52  ? 1.08140 1.00270 0.96380 -0.15940 -0.04890 0.02830  50  HIS A CA  
783  C C   . HIS A 52  ? 1.06670 0.98800 0.97980 -0.13210 -0.04450 0.01750  50  HIS A C   
784  O O   . HIS A 52  ? 1.06310 0.99060 0.97850 -0.11620 -0.02190 0.00290  50  HIS A O   
785  C CB  . HIS A 52  ? 1.09940 1.04180 0.95730 -0.17190 -0.02390 0.02750  50  HIS A CB  
786  C CG  . HIS A 52  ? 1.16430 1.12220 1.03360 -0.17670 -0.02560 0.03890  50  HIS A CG  
787  N ND1 . HIS A 52  ? 1.16800 1.13350 1.06150 -0.15640 -0.01500 0.03130  50  HIS A ND1 
788  C CD2 . HIS A 52  ? 1.18070 1.14900 1.04050 -0.20210 -0.03890 0.05970  50  HIS A CD2 
789  C CE1 . HIS A 52  ? 1.17190 1.15190 1.07180 -0.16850 -0.02160 0.04610  50  HIS A CE1 
790  N NE2 . HIS A 52  ? 1.20220 1.18470 1.08230 -0.19680 -0.03590 0.06410  50  HIS A NE2 
798  N N   . LYS A 53  ? 0.98530 0.89760 0.92000 -0.12760 -0.06780 0.02480  51  LYS A N   
799  C CA  . LYS A 53  ? 1.01530 0.92620 0.97550 -0.10310 -0.06740 0.01380  51  LYS A CA  
800  C C   . LYS A 53  ? 0.95530 0.87200 0.92120 -0.10760 -0.06990 0.02170  51  LYS A C   
801  O O   . LYS A 53  ? 0.96510 0.87600 0.92850 -0.12650 -0.09030 0.03870  51  LYS A O   
802  C CB  . LYS A 53  ? 0.96580 0.86030 0.94820 -0.09000 -0.09320 0.01050  51  LYS A CB  
803  C CG  . LYS A 53  ? 1.09590 0.99380 1.08240 -0.07920 -0.08690 0.00000  51  LYS A CG  
804  C CD  . LYS A 53  ? 0.96360 0.85160 0.97580 -0.06630 -0.11290 -0.00300 51  LYS A CD  
805  C CE  . LYS A 53  ? 1.02470 0.92380 1.04370 -0.05890 -0.10690 -0.01010 51  LYS A CE  
806  N NZ  . LYS A 53  ? 1.00310 0.92010 1.03020 -0.03900 -0.08420 -0.02600 51  LYS A NZ  
820  N N   . SER A 54  ? 0.88940 0.81840 0.86360 -0.09220 -0.05080 0.01170  52  SER A N   
821  C CA  . SER A 54  ? 0.96060 0.89810 0.94480 -0.09390 -0.05310 0.01830  52  SER A CA  
822  C C   . SER A 54  ? 0.84880 0.77960 0.85120 -0.07010 -0.05660 0.00510  52  SER A C   
823  O O   . SER A 54  ? 0.82190 0.76530 0.82730 -0.05630 -0.03580 -0.00460 52  SER A O   
824  C CB  . SER A 54  ? 0.94930 0.91420 0.92550 -0.09990 -0.02540 0.02020  52  SER A CB  
825  O OG  . SER A 54  ? 1.06390 1.04110 1.05700 -0.09290 -0.02280 0.02180  52  SER A OG  
831  N N   . GLY A 55  ? 0.88150 0.79140 0.89500 -0.06540 -0.08420 0.00410  53  GLY A N   
832  C CA  . GLY A 55  ? 0.86080 0.76490 0.88720 -0.04260 -0.08830 -0.01180 53  GLY A CA  
833  C C   . GLY A 55  ? 0.82320 0.73190 0.85080 -0.02560 -0.07630 -0.02700 53  GLY A C   
834  O O   . GLY A 55  ? 0.79790 0.69850 0.82730 -0.02630 -0.08640 -0.02770 53  GLY A O   
838  N N   . GLU A 56  ? 0.81460 0.73850 0.84260 -0.01200 -0.05610 -0.03690 54  GLU A N   
839  C CA  . GLU A 56  ? 0.81350 0.74750 0.84200 0.00040  -0.04260 -0.04790 54  GLU A CA  
840  C C   . GLU A 56  ? 0.88980 0.83300 0.90640 -0.00800 -0.02030 -0.04320 54  GLU A C   
841  O O   . GLU A 56  ? 0.86520 0.81570 0.88130 -0.00200 -0.01010 -0.04910 54  GLU A O   
842  C CB  . GLU A 56  ? 0.85550 0.80040 0.88900 0.01790  -0.03620 -0.05980 54  GLU A CB  
843  C CG  . GLU A 56  ? 0.89700 0.83120 0.93930 0.02970  -0.05790 -0.07070 54  GLU A CG  
844  C CD  . GLU A 56  ? 0.91250 0.84330 0.96540 0.03950  -0.07000 -0.08080 54  GLU A CD  
845  O OE1 . GLU A 56  ? 0.94810 0.89660 1.00280 0.04340  -0.05620 -0.08390 54  GLU A OE1 
846  O OE2 . GLU A 56  ? 0.96770 0.87830 1.02960 0.04300  -0.09500 -0.08480 54  GLU A OE2 
853  N N   . PHE A 57  ? 0.83990 0.78390 0.84710 -0.02200 -0.01280 -0.03360 55  PHE A N   
854  C CA  . PHE A 57  ? 0.88330 0.83180 0.87670 -0.02930 0.00680  -0.03270 55  PHE A CA  
855  C C   . PHE A 57  ? 0.86770 0.80720 0.84910 -0.04410 -0.00220 -0.02810 55  PHE A C   
856  O O   . PHE A 57  ? 0.78200 0.71710 0.75850 -0.05860 -0.01540 -0.01790 55  PHE A O   
857  C CB  . PHE A 57  ? 0.90300 0.86190 0.89290 -0.03530 0.02060  -0.02750 55  PHE A CB  
858  C CG  . PHE A 57  ? 0.86390 0.82570 0.84000 -0.03840 0.04180  -0.03180 55  PHE A CG  
859  C CD1 . PHE A 57  ? 0.86750 0.82580 0.82390 -0.05460 0.04320  -0.02970 55  PHE A CD1 
860  C CD2 . PHE A 57  ? 0.80920 0.77460 0.79070 -0.02570 0.05850  -0.03830 55  PHE A CD2 
861  C CE1 . PHE A 57  ? 0.84080 0.79850 0.78140 -0.05650 0.06200  -0.03750 55  PHE A CE1 
862  C CE2 . PHE A 57  ? 0.88800 0.85000 0.85750 -0.02660 0.07560  -0.04490 55  PHE A CE2 
863  C CZ  . PHE A 57  ? 0.85820 0.81600 0.80620 -0.04140 0.07800  -0.04620 55  PHE A CZ  
873  N N   . CYS A 58  ? 0.92450 0.86190 0.90090 -0.04280 0.00290  -0.03320 56  CYS A N   
874  C CA  . CYS A 58  ? 0.93020 0.85980 0.89550 -0.05720 -0.00730 -0.02840 56  CYS A CA  
875  C C   . CYS A 58  ? 0.93430 0.86180 0.87620 -0.06780 0.01050  -0.03090 56  CYS A C   
876  O O   . CYS A 58  ? 0.87210 0.80010 0.81360 -0.05940 0.02550  -0.03880 56  CYS A O   
877  C CB  . CYS A 58  ? 0.96390 0.89450 0.94500 -0.04830 -0.01940 -0.03200 56  CYS A CB  
878  S SG  . CYS A 58  ? 1.00560 0.92730 0.98110 -0.06550 -0.04040 -0.02250 56  CYS A SG  
884  N N   . ARG A 59  ? 0.92590 0.84970 0.84690 -0.08700 0.00740  -0.02440 57  ARG A N   
885  C CA  . ARG A 59  ? 0.86810 0.78900 0.76150 -0.09800 0.02380  -0.02980 57  ARG A CA  
886  C C   . ARG A 59  ? 0.96230 0.87280 0.83880 -0.11490 0.01020  -0.02550 57  ARG A C   
887  O O   . ARG A 59  ? 0.99330 0.90260 0.86770 -0.12840 -0.00970 -0.01300 57  ARG A O   
888  C CB  . ARG A 59  ? 0.99320 0.92550 0.87180 -0.10850 0.03420  -0.02680 57  ARG A CB  
889  C CG  . ARG A 59  ? 1.05580 0.99050 0.91410 -0.10780 0.05950  -0.04030 57  ARG A CG  
890  C CD  . ARG A 59  ? 1.05610 1.01040 0.89710 -0.12220 0.06900  -0.03650 57  ARG A CD  
891  N NE  . ARG A 59  ? 1.36820 1.33000 1.19680 -0.11490 0.09600  -0.05350 57  ARG A NE  
892  C CZ  . ARG A 59  ? 1.40820 1.39150 1.25290 -0.10280 0.11300  -0.05740 57  ARG A CZ  
893  N NH1 . ARG A 59  ? 1.37540 1.37490 1.24670 -0.09920 0.10570  -0.04420 57  ARG A NH1 
894  N NH2 . ARG A 59  ? 1.21840 1.20640 1.05340 -0.09350 0.13650  -0.07560 57  ARG A NH2 
908  N N   . LEU A 60  ? 0.95720 0.85860 0.82230 -0.11550 0.01800  -0.03400 58  LEU A N   
909  C CA  . LEU A 60  ? 1.03640 0.92800 0.88450 -0.13290 0.00470  -0.02990 58  LEU A CA  
910  C C   . LEU A 60  ? 1.06810 0.94860 0.87760 -0.14630 0.01910  -0.04000 58  LEU A C   
911  O O   . LEU A 60  ? 1.05370 0.92560 0.85910 -0.13660 0.03580  -0.05350 58  LEU A O   
912  C CB  . LEU A 60  ? 0.94220 0.83360 0.81160 -0.12480 -0.00320 -0.03020 58  LEU A CB  
913  C CG  . LEU A 60  ? 0.87370 0.77780 0.77820 -0.11390 -0.02160 -0.02210 58  LEU A CG  
914  C CD1 . LEU A 60  ? 0.94750 0.86350 0.87830 -0.09070 -0.01130 -0.02900 58  LEU A CD1 
915  C CD2 . LEU A 60  ? 0.88680 0.79340 0.80030 -0.12220 -0.03990 -0.01520 58  LEU A CD2 
927  N N   . ARG A 61  ? 1.09900 0.97870 0.87950 -0.16870 0.01140  -0.03380 59  ARG A N   
928  C CA  . ARG A 61  ? 1.15490 1.02520 0.89230 -0.18370 0.02370  -0.04550 59  ARG A CA  
929  C C   . ARG A 61  ? 1.14500 1.00170 0.86220 -0.20500 0.00360  -0.03910 59  ARG A C   
930  O O   . ARG A 61  ? 1.12470 0.98670 0.84200 -0.22070 -0.01840 -0.02130 59  ARG A O   
931  C CB  . ARG A 61  ? 1.15960 1.04670 0.87360 -0.19560 0.03360  -0.04380 59  ARG A CB  
932  C CG  . ARG A 61  ? 1.28810 1.17070 0.95330 -0.21060 0.04880  -0.05940 59  ARG A CG  
933  C CD  . ARG A 61  ? 1.25700 1.12780 0.91990 -0.19030 0.07350  -0.08530 59  ARG A CD  
934  N NE  . ARG A 61  ? 1.26290 1.15650 0.93150 -0.17700 0.09790  -0.09470 59  ARG A NE  
935  C CZ  . ARG A 61  ? 1.30590 1.19370 0.97840 -0.15620 0.11990  -0.11660 59  ARG A CZ  
936  N NH1 . ARG A 61  ? 1.24910 1.10460 0.91810 -0.14730 0.11970  -0.13130 59  ARG A NH1 
937  N NH2 . ARG A 61  ? 1.14470 1.06030 0.82760 -0.14450 0.14070  -0.12280 59  ARG A NH2 
951  N N   . PHE A 62  ? 1.22980 1.06740 0.93120 -0.20640 0.00860  -0.05210 60  PHE A N   
952  C CA  . PHE A 62  ? 1.31110 1.13540 0.99340 -0.22790 -0.01130 -0.04620 60  PHE A CA  
953  C C   . PHE A 62  ? 1.34130 1.15550 0.96750 -0.25130 -0.00700 -0.05520 60  PHE A C   
954  O O   . PHE A 62  ? 1.31350 1.12820 0.91630 -0.24610 0.01660  -0.07290 60  PHE A O   
955  C CB  . PHE A 62  ? 1.19440 1.00280 0.88920 -0.22070 -0.01190 -0.05320 60  PHE A CB  
956  C CG  . PHE A 62  ? 1.12980 0.95390 0.87600 -0.20170 -0.01730 -0.04320 60  PHE A CG  
957  C CD1 . PHE A 62  ? 1.10360 0.93470 0.87370 -0.17750 0.00020  -0.05000 60  PHE A CD1 
958  C CD2 . PHE A 62  ? 1.06660 0.90170 0.83730 -0.20780 -0.03980 -0.02750 60  PHE A CD2 
959  C CE1 . PHE A 62  ? 0.97880 0.82700 0.79090 -0.16130 -0.00380 -0.04230 60  PHE A CE1 
960  C CE2 . PHE A 62  ? 1.07100 0.92620 0.88760 -0.18910 -0.04210 -0.02130 60  PHE A CE2 
961  C CZ  . PHE A 62  ? 1.03530 0.89670 0.86980 -0.16660 -0.02370 -0.02930 60  PHE A CZ  
971  N N   . PRO A 63  ? 1.30940 1.11680 0.91250 -0.27740 -0.02960 -0.04410 61  PRO A N   
972  C CA  . PRO A 63  ? 1.42830 1.22720 0.97140 -0.30240 -0.02640 -0.05340 61  PRO A CA  
973  C C   . PRO A 63  ? 1.43320 1.20490 0.94600 -0.29840 -0.00960 -0.08200 61  PRO A C   
974  O O   . PRO A 63  ? 1.49030 1.26020 0.96550 -0.29870 0.01210  -0.10340 61  PRO A O   
975  C CB  . PRO A 63  ? 1.31160 1.10760 0.84480 -0.33040 -0.05990 -0.03140 61  PRO A CB  
976  C CG  . PRO A 63  ? 1.24680 1.05520 0.84000 -0.31680 -0.07900 -0.01060 61  PRO A CG  
977  C CD  . PRO A 63  ? 1.21220 1.02150 0.84290 -0.28500 -0.05920 -0.02360 61  PRO A CD  
985  N N   . LYS A 64  ? 1.36600 1.11740 0.89640 -0.29480 -0.02060 -0.08260 62  LYS A N   
986  C CA  . LYS A 64  ? 1.39910 1.11670 0.90560 -0.29260 -0.01220 -0.10660 62  LYS A CA  
987  C C   . LYS A 64  ? 1.37700 1.08930 0.92290 -0.26220 0.00340  -0.11530 62  LYS A C   
988  O O   . LYS A 64  ? 1.31270 1.04650 0.90700 -0.24730 0.00100  -0.09890 62  LYS A O   
989  C CB  . LYS A 64  ? 1.34710 1.04400 0.84360 -0.31540 -0.03950 -0.09770 62  LYS A CB  
990  C CG  . LYS A 64  ? 1.47560 1.17190 0.92680 -0.34910 -0.05860 -0.08970 62  LYS A CG  
991  C CD  . LYS A 64  ? 1.62900 1.33750 1.03700 -0.35530 -0.04120 -0.10080 62  LYS A CD  
992  C CE  . LYS A 64  ? 1.72760 1.40660 1.07260 -0.36450 -0.02800 -0.13360 62  LYS A CE  
993  N NZ  . LYS A 64  ? 1.61640 1.31600 0.92210 -0.36670 -0.00450 -0.14800 62  LYS A NZ  
1007 N N   . PRO A 65  ? 1.37640 1.05910 0.90230 -0.25250 0.01830  -0.14130 63  PRO A N   
1008 C CA  . PRO A 65  ? 1.34060 1.01280 0.90370 -0.22740 0.02700  -0.14580 63  PRO A CA  
1009 C C   . PRO A 65  ? 1.32500 0.98870 0.91440 -0.23550 0.00500  -0.12780 63  PRO A C   
1010 O O   . PRO A 65  ? 1.30560 0.95050 0.87230 -0.25910 -0.01420 -0.12490 63  PRO A O   
1011 C CB  . PRO A 65  ? 1.28700 0.92270 0.81680 -0.21900 0.04220  -0.17870 63  PRO A CB  
1012 C CG  . PRO A 65  ? 1.33560 0.95430 0.80790 -0.24540 0.03420  -0.19050 63  PRO A CG  
1013 C CD  . PRO A 65  ? 1.30130 0.95870 0.76940 -0.26250 0.02750  -0.16920 63  PRO A CD  
1021 N N   . ILE A 66  ? 1.24410 0.92550 0.88150 -0.21720 0.00790  -0.11520 64  ILE A N   
1022 C CA  . ILE A 66  ? 1.18410 0.87160 0.85290 -0.22340 -0.00960 -0.09550 64  ILE A CA  
1023 C C   . ILE A 66  ? 1.21850 0.88260 0.90150 -0.21260 -0.00570 -0.10040 64  ILE A C   
1024 O O   . ILE A 66  ? 1.27130 0.91820 0.95490 -0.22790 -0.02190 -0.09290 64  ILE A O   
1025 C CB  . ILE A 66  ? 1.12970 0.86300 0.84250 -0.21400 -0.01270 -0.07440 64  ILE A CB  
1026 C CG1 . ILE A 66  ? 1.14500 0.89510 0.84310 -0.22430 -0.01860 -0.06910 64  ILE A CG1 
1027 C CG2 . ILE A 66  ? 1.18820 0.93710 0.93290 -0.22180 -0.02970 -0.05510 64  ILE A CG2 
1028 C CD1 . ILE A 66  ? 1.21320 0.99890 0.94990 -0.22240 -0.03270 -0.04760 64  ILE A CD1 
1040 N N   . ARG A 67  ? 1.23320 0.89640 0.92870 -0.18810 0.01340  -0.11070 65  ARG A N   
1041 C CA  . ARG A 67  ? 1.17530 0.81390 0.88500 -0.17670 0.01570  -0.11390 65  ARG A CA  
1042 C C   . ARG A 67  ? 1.26430 0.86160 0.94250 -0.16730 0.02720  -0.14330 65  ARG A C   
1043 O O   . ARG A 67  ? 1.25430 0.85600 0.94280 -0.14390 0.04540  -0.15480 65  ARG A O   
1044 C CB  . ARG A 67  ? 1.19160 0.86220 0.94350 -0.15540 0.02580  -0.10160 65  ARG A CB  
1045 C CG  . ARG A 67  ? 1.14440 0.85220 0.92890 -0.16210 0.01460  -0.07630 65  ARG A CG  
1046 C CD  . ARG A 67  ? 1.16660 0.85950 0.95950 -0.17590 0.00010  -0.06390 65  ARG A CD  
1047 N NE  . ARG A 67  ? 1.08480 0.75180 0.88400 -0.16330 0.00560  -0.06800 65  ARG A NE  
1048 C CZ  . ARG A 67  ? 1.19070 0.88100 1.01910 -0.14720 0.01370  -0.05820 65  ARG A CZ  
1049 N NH1 . ARG A 67  ? 1.20940 0.94870 1.06220 -0.14040 0.01860  -0.04650 65  ARG A NH1 
1050 N NH2 . ARG A 67  ? 1.14840 0.81040 0.98100 -0.13740 0.01530  -0.06080 65  ARG A NH2 
1064 N N   . THR A 68  ? 1.31470 0.87290 0.95470 -0.18540 0.01580  -0.15660 66  THR A N   
1065 C CA  . THR A 68  ? 1.25310 0.76910 0.86020 -0.17560 0.02580  -0.18930 66  THR A CA  
1066 C C   . THR A 68  ? 1.30840 0.78990 0.93600 -0.15680 0.02610  -0.19610 66  THR A C   
1067 O O   . THR A 68  ? 1.31390 0.76300 0.92420 -0.14040 0.03660  -0.22520 66  THR A O   
1068 C CB  . THR A 68  ? 1.35270 0.83110 0.91070 -0.20140 0.01020  -0.20290 66  THR A CB  
1069 O OG1 . THR A 68  ? 1.58060 1.04130 1.14840 -0.22290 -0.01610 -0.18240 66  THR A OG1 
1070 C CG2 . THR A 68  ? 1.35100 0.86020 0.88160 -0.21850 0.01160  -0.20040 66  THR A CG2 
1078 N N   . ASP A 69  ? 1.27810 0.76750 0.94240 -0.15850 0.01460  -0.16990 67  ASP A N   
1079 C CA  . ASP A 69  ? 1.27380 0.73030 0.95850 -0.14380 0.01100  -0.17090 67  ASP A CA  
1080 C C   . ASP A 69  ? 1.30640 0.78400 1.01850 -0.11190 0.03230  -0.17690 67  ASP A C   
1081 O O   . ASP A 69  ? 1.29020 0.73430 1.01380 -0.09460 0.03180  -0.18640 67  ASP A O   
1082 C CB  . ASP A 69  ? 1.25910 0.72390 0.97200 -0.16010 -0.00840 -0.13760 67  ASP A CB  
1083 C CG  . ASP A 69  ? 1.25810 0.78880 1.00020 -0.16150 -0.00250 -0.11230 67  ASP A CG  
1084 O OD1 . ASP A 69  ? 1.24610 0.80400 0.97700 -0.17300 -0.00210 -0.11020 67  ASP A OD1 
1085 O OD2 . ASP A 69  ? 1.27080 0.82480 1.04640 -0.15070 0.00070  -0.09530 67  ASP A OD2 
1090 N N   . VAL A 70  ? 1.18190 0.71200 0.90620 -0.10430 0.04830  -0.17060 68  VAL A N   
1091 C CA  . VAL A 70  ? 1.20220 0.75830 0.95660 -0.07740 0.06570  -0.17090 68  VAL A CA  
1092 C C   . VAL A 70  ? 1.21870 0.77670 0.95530 -0.06080 0.08680  -0.20020 68  VAL A C   
1093 O O   . VAL A 70  ? 1.16450 0.73280 0.86950 -0.07270 0.09260  -0.21100 68  VAL A O   
1094 C CB  . VAL A 70  ? 1.22860 0.84050 1.01010 -0.07840 0.06880  -0.14580 68  VAL A CB  
1095 C CG1 . VAL A 70  ? 1.28230 0.89920 1.09160 -0.08360 0.05490  -0.12010 68  VAL A CG1 
1096 C CG2 . VAL A 70  ? 1.19080 0.82780 0.95370 -0.09810 0.06550  -0.14040 68  VAL A CG2 
1106 N N   . THR A 71  ? 1.30150 0.85200 1.05920 -0.03410 0.09780  -0.21210 69  THR A N   
1107 C CA  . THR A 71  ? 1.26550 0.83440 1.01810 -0.01470 0.12160  -0.23670 69  THR A CA  
1108 C C   . THR A 71  ? 1.20120 0.83110 0.97190 -0.01360 0.13430  -0.22020 69  THR A C   
1109 O O   . THR A 71  ? 1.12270 0.77500 0.91940 -0.01750 0.12590  -0.19340 69  THR A O   
1110 C CB  . THR A 71  ? 1.22630 0.77140 1.00420 0.01560  0.12740  -0.25270 69  THR A CB  
1111 O OG1 . THR A 71  ? 1.36410 0.93440 1.13960 0.03550  0.15280  -0.27830 69  THR A OG1 
1112 C CG2 . THR A 71  ? 1.27190 0.83410 1.09660 0.02630  0.12110  -0.22530 69  THR A CG2 
1120 N N   . GLY A 72  ? 1.11880 0.77610 0.87390 -0.00950 0.15380  -0.23660 70  GLY A N   
1121 C CA  . GLY A 72  ? 1.16210 0.87430 0.93360 -0.01000 0.16410  -0.22110 70  GLY A CA  
1122 C C   . GLY A 72  ? 1.13200 0.86730 0.94630 0.01620  0.17530  -0.21830 70  GLY A C   
1123 O O   . GLY A 72  ? 1.29750 1.03160 1.11790 0.03710  0.19090  -0.24080 70  GLY A O   
1127 N N   . MET A 73  ? 1.05060 0.80850 0.89560 0.01620  0.16710  -0.19200 71  MET A N   
1128 C CA  . MET A 73  ? 1.05250 0.83130 0.93820 0.03840  0.17380  -0.18610 71  MET A CA  
1129 C C   . MET A 73  ? 1.05770 0.88780 0.95190 0.04050  0.18980  -0.18440 71  MET A C   
1130 O O   . MET A 73  ? 1.02700 0.87560 0.89430 0.02440  0.19590  -0.18760 71  MET A O   
1131 C CB  . MET A 73  ? 1.04270 0.82320 0.95430 0.03660  0.15730  -0.15950 71  MET A CB  
1132 C CG  . MET A 73  ? 1.17880 0.92010 1.08190 0.02640  0.13910  -0.15250 71  MET A CG  
1133 S SD  . MET A 73  ? 1.18830 0.94360 1.12120 0.02510  0.12410  -0.12220 71  MET A SD  
1134 C CE  . MET A 73  ? 0.94300 0.73480 0.91080 0.04630  0.13490  -0.11780 71  MET A CE  
1144 N N   . ILE A 74  ? 1.03570 0.88990 0.96840 0.05810  0.19420  -0.17640 72  ILE A N   
1145 C CA  . ILE A 74  ? 0.97860 0.88400 0.92680 0.05870  0.20580  -0.16930 72  ILE A CA  
1146 C C   . ILE A 74  ? 0.95090 0.87210 0.90970 0.04550  0.19000  -0.14200 72  ILE A C   
1147 O O   . ILE A 74  ? 0.94180 0.84950 0.91900 0.05050  0.17660  -0.12920 72  ILE A O   
1148 C CB  . ILE A 74  ? 0.99250 0.91800 0.97950 0.08560  0.21870  -0.17660 72  ILE A CB  
1149 C CG1 . ILE A 74  ? 1.02820 0.93620 1.00490 0.10230  0.23470  -0.20870 72  ILE A CG1 
1150 C CG2 . ILE A 74  ? 0.96150 0.94430 0.96780 0.08280  0.22830  -0.16470 72  ILE A CG2 
1151 C CD1 . ILE A 74  ? 1.07320 1.01230 1.08890 0.13040  0.25200  -0.22060 72  ILE A CD1 
1163 N N   . LEU A 75  ? 0.89400 0.84310 0.83990 0.02800  0.19060  -0.13360 73  LEU A N   
1164 C CA  . LEU A 75  ? 0.98110 0.94430 0.93670 0.01660  0.17480  -0.11100 73  LEU A CA  
1165 C C   . LEU A 75  ? 0.91020 0.91680 0.88530 0.01630  0.18160  -0.10210 73  LEU A C   
1166 O O   . LEU A 75  ? 0.88320 0.91440 0.84530 0.00770  0.19450  -0.10740 73  LEU A O   
1167 C CB  . LEU A 75  ? 0.96910 0.92120 0.89440 -0.00620 0.16260  -0.10550 73  LEU A CB  
1168 C CG  . LEU A 75  ? 0.79590 0.76120 0.72930 -0.01770 0.14530  -0.08570 73  LEU A CG  
1169 C CD1 . LEU A 75  ? 0.90260 0.85620 0.85600 -0.00810 0.13230  -0.07750 73  LEU A CD1 
1170 C CD2 . LEU A 75  ? 0.89920 0.85670 0.80430 -0.03940 0.13440  -0.08190 73  LEU A CD2 
1182 N N   . GLU A 76  ? 0.98100 0.99910 0.98580 0.02350  0.17240  -0.08760 74  GLU A N   
1183 C CA  . GLU A 76  ? 0.95230 1.01100 0.98020 0.02260  0.17580  -0.07680 74  GLU A CA  
1184 C C   . GLU A 76  ? 0.91640 0.97610 0.95530 0.01510  0.15440  -0.05760 74  GLU A C   
1185 O O   . GLU A 76  ? 0.93100 0.96470 0.96650 0.01730  0.14080  -0.05510 74  GLU A O   
1186 C CB  . GLU A 76  ? 0.80400 0.88100 0.86540 0.04530  0.18940  -0.08290 74  GLU A CB  
1187 C CG  . GLU A 76  ? 0.86470 0.94660 0.91850 0.05590  0.21230  -0.10570 74  GLU A CG  
1188 C CD  . GLU A 76  ? 0.84810 0.94320 0.94030 0.08310  0.22350  -0.11380 74  GLU A CD  
1189 O OE1 . GLU A 76  ? 0.81800 0.91050 0.93960 0.09270  0.21090  -0.10030 74  GLU A OE1 
1190 O OE2 . GLU A 76  ? 0.88930 0.99790 0.98240 0.09540  0.24420  -0.13450 74  GLU A OE2 
1197 N N   . GLU A 77  ? 0.74090 0.83250 0.79260 0.00560  0.15140  -0.04470 75  GLU A N   
1198 C CA  . GLU A 77  ? 0.90750 0.99870 0.96790 -0.00280 0.12920  -0.02820 75  GLU A CA  
1199 C C   . GLU A 77  ? 0.91800 1.01510 1.00840 0.01340  0.12520  -0.02330 75  GLU A C   
1200 O O   . GLU A 77  ? 0.85770 0.98620 0.97360 0.01550  0.12860  -0.01520 75  GLU A O   
1201 C CB  . GLU A 77  ? 1.06940 1.18840 1.12950 -0.02340 0.12400  -0.01430 75  GLU A CB  
1202 C CG  . GLU A 77  ? 1.05470 1.17190 1.12660 -0.03180 0.09900  0.00190  75  GLU A CG  
1203 C CD  . GLU A 77  ? 1.13360 1.27150 1.20240 -0.05650 0.08920  0.01830  75  GLU A CD  
1204 O OE1 . GLU A 77  ? 1.63890 1.76040 1.70610 -0.06770 0.06360  0.02910  75  GLU A OE1 
1205 O OE2 . GLU A 77  ? 1.19930 1.37030 1.26690 -0.06530 0.10660  0.02010  75  GLU A OE2 
1212 N N   . GLY A 78  ? 0.83050 0.90020 0.91800 0.02310  0.11730  -0.02660 76  GLY A N   
1213 C CA  . GLY A 78  ? 0.91290 0.98560 1.02340 0.03560  0.11050  -0.02000 76  GLY A CA  
1214 C C   . GLY A 78  ? 0.81950 0.90230 0.95310 0.05310  0.12560  -0.02470 76  GLY A C   
1215 O O   . GLY A 78  ? 0.87150 0.95710 1.00220 0.05800  0.14300  -0.03680 76  GLY A O   
1219 N N   . ALA A 79  ? 0.80830 0.89590 0.96520 0.06310  0.11730  -0.01570 77  ALA A N   
1220 C CA  . ALA A 79  ? 0.78710 0.88330 0.97340 0.08180  0.12620  -0.01710 77  ALA A CA  
1221 C C   . ALA A 79  ? 0.75500 0.88660 0.97570 0.08390  0.11960  -0.00220 77  ALA A C   
1222 O O   . ALA A 79  ? 0.67840 0.81590 0.89560 0.07150  0.10320  0.00990  77  ALA A O   
1223 C CB  . ALA A 79  ? 0.92430 0.98850 1.10830 0.09160  0.11850  -0.01670 77  ALA A CB  
1229 N N   . PRO A 80  ? 0.72750 0.88320 0.98280 0.09990  0.13130  -0.00380 78  PRO A N   
1230 C CA  . PRO A 80  ? 0.71800 0.91090 1.01170 0.10230  0.12350  0.01260  78  PRO A CA  
1231 C C   . PRO A 80  ? 0.68580 0.86350 0.97850 0.09800  0.09890  0.02820  78  PRO A C   
1232 O O   . PRO A 80  ? 0.65270 0.79750 0.93220 0.10360  0.09180  0.02690  78  PRO A O   
1233 C CB  . PRO A 80  ? 0.76720 0.97620 1.09960 0.12730  0.13800  0.00520  78  PRO A CB  
1234 C CG  . PRO A 80  ? 0.79730 0.98520 1.10780 0.13490  0.15790  -0.01850 78  PRO A CG  
1235 C CD  . PRO A 80  ? 0.74820 0.90420 1.00910 0.11510  0.15330  -0.02250 78  PRO A CD  
1243 N N   . GLU A 81  ? 0.74770 0.95070 1.05260 0.08610  0.08500  0.04370  79  GLU A N   
1244 C CA  . GLU A 81  ? 0.78900 0.98010 1.08870 0.08020  0.06080  0.05690  79  GLU A CA  
1245 C C   . GLU A 81  ? 0.72300 0.90850 1.04610 0.09690  0.05570  0.06390  79  GLU A C   
1246 O O   . GLU A 81  ? 0.78610 0.99770 1.15120 0.11090  0.06130  0.06880  79  GLU A O   
1247 C CB  . GLU A 81  ? 0.80270 1.02410 1.11790 0.06550  0.04580  0.07250  79  GLU A CB  
1248 C CG  . GLU A 81  ? 0.73780 0.95510 1.02610 0.04510  0.04110  0.07000  79  GLU A CG  
1249 C CD  . GLU A 81  ? 0.77240 1.01740 1.07040 0.04060  0.06050  0.06660  79  GLU A CD  
1250 O OE1 . GLU A 81  ? 0.79720 1.05910 1.11510 0.05630  0.08210  0.05910  79  GLU A OE1 
1251 O OE2 . GLU A 81  ? 0.83360 1.08330 1.11840 0.02090  0.05320  0.07130  79  GLU A OE2 
1258 N N   . GLY A 82  ? 0.82840 0.98200 1.12580 0.09500  0.04400  0.06520  80  GLY A N   
1259 C CA  . GLY A 82  ? 0.73360 0.87560 1.04640 0.10660  0.03550  0.07470  80  GLY A CA  
1260 C C   . GLY A 82  ? 0.80650 0.91600 1.10860 0.11700  0.04610  0.06360  80  GLY A C   
1261 O O   . GLY A 82  ? 0.71960 0.81030 1.02410 0.12140  0.03490  0.07330  80  GLY A O   
1265 N N   . THR A 83  ? 0.80950 0.91110 1.09840 0.11880  0.06520  0.04510  81  THR A N   
1266 C CA  . THR A 83  ? 0.72770 0.79520 1.00330 0.12640  0.07360  0.03330  81  THR A CA  
1267 C C   . THR A 83  ? 0.78580 0.82590 1.02820 0.11440  0.06080  0.03980  81  THR A C   
1268 O O   . THR A 83  ? 0.76690 0.81000 0.98100 0.09960  0.05640  0.03960  81  THR A O   
1269 C CB  . THR A 83  ? 0.77910 0.84410 1.03690 0.12450  0.09380  0.01280  81  THR A CB  
1270 O OG1 . THR A 83  ? 0.75130 0.84840 1.03930 0.13520  0.10830  0.00650  81  THR A OG1 
1271 C CG2 . THR A 83  ? 0.82430 0.85060 1.06470 0.12970  0.09980  0.00020  81  THR A CG2 
1279 N N   . VAL A 84  ? 0.78350 0.79810 1.03080 0.12090  0.05410  0.04570  82  VAL A N   
1280 C CA  . VAL A 84  ? 0.85140 0.84430 1.06850 0.10790  0.04350  0.05380  82  VAL A CA  
1281 C C   . VAL A 84  ? 0.88990 0.85760 1.08310 0.10470  0.05580  0.03750  82  VAL A C   
1282 O O   . VAL A 84  ? 0.86140 0.80310 1.06370 0.11410  0.05890  0.03160  82  VAL A O   
1283 C CB  . VAL A 84  ? 0.84690 0.82550 1.08030 0.11150  0.02610  0.07350  82  VAL A CB  
1284 C CG1 . VAL A 84  ? 0.94230 0.90580 1.14210 0.09410  0.01640  0.08410  82  VAL A CG1 
1285 C CG2 . VAL A 84  ? 0.71690 0.72200 0.97590 0.11420  0.01240  0.09060  82  VAL A CG2 
1295 N N   . ALA A 85  ? 0.84750 0.82120 1.01120 0.09180  0.06080  0.02970  83  ALA A N   
1296 C CA  . ALA A 85  ? 0.78530 0.73890 0.92520 0.08570  0.06990  0.01640  83  ALA A CA  
1297 C C   . ALA A 85  ? 0.82420 0.76680 0.94190 0.07260  0.06050  0.02630  83  ALA A C   
1298 O O   . ALA A 85  ? 0.77860 0.73250 0.89430 0.06700  0.04870  0.04180  83  ALA A O   
1299 C CB  . ALA A 85  ? 0.90080 0.86920 1.02570 0.07940  0.07940  0.00330  83  ALA A CB  
1305 N N   . THR A 86  ? 0.77630 0.69990 0.87620 0.06590  0.06580  0.01780  84  THR A N   
1306 C CA  . THR A 86  ? 0.85680 0.77470 0.93740 0.05140  0.05890  0.02720  84  THR A CA  
1307 C C   . THR A 86  ? 0.80150 0.73010 0.86100 0.04220  0.06590  0.01570  84  THR A C   
1308 O O   . THR A 86  ? 0.79950 0.71720 0.85470 0.04360  0.07460  0.00120  84  THR A O   
1309 C CB  . THR A 86  ? 0.90590 0.78800 0.98900 0.05000  0.05370  0.03180  84  THR A CB  
1310 O OG1 . THR A 86  ? 0.94270 0.81300 1.05020 0.06100  0.04440  0.04280  84  THR A OG1 
1311 C CG2 . THR A 86  ? 0.87630 0.75830 0.94110 0.03100  0.04540  0.04590  84  THR A CG2 
1319 N N   . LEU A 87  ? 0.83500 0.78680 0.88190 0.03330  0.06180  0.02160  85  LEU A N   
1320 C CA  . LEU A 87  ? 0.88720 0.85230 0.91910 0.02660  0.06620  0.01150  85  LEU A CA  
1321 C C   . LEU A 87  ? 0.85390 0.81340 0.87580 0.01370  0.06460  0.01820  85  LEU A C   
1322 O O   . LEU A 87  ? 0.90570 0.88070 0.92280 0.00520  0.05930  0.03210  85  LEU A O   
1323 C CB  . LEU A 87  ? 0.91360 0.90880 0.93980 0.02740  0.06290  0.01010  85  LEU A CB  
1324 C CG  . LEU A 87  ? 0.93000 0.94180 0.94540 0.02370  0.06520  -0.00070 85  LEU A CG  
1325 C CD1 . LEU A 87  ? 0.92970 0.92660 0.94630 0.02500  0.06940  -0.01300 85  LEU A CD1 
1326 C CD2 . LEU A 87  ? 0.79280 0.82900 0.80340 0.02840  0.06070  -0.00640 85  LEU A CD2 
1338 N N   . LEU A 88  ? 0.86730 0.80690 0.88470 0.01000  0.06850  0.00970  86  LEU A N   
1339 C CA  . LEU A 88  ? 0.97170 0.90260 0.98090 -0.00450 0.06500  0.01680  86  LEU A CA  
1340 C C   . LEU A 88  ? 0.88640 0.84930 0.88880 -0.01180 0.06690  0.01390  86  LEU A C   
1341 O O   . LEU A 88  ? 0.83300 0.79310 0.83180 -0.01320 0.06960  0.00270  86  LEU A O   
1342 C CB  . LEU A 88  ? 0.88390 0.77700 0.88930 -0.00580 0.06630  0.00760  86  LEU A CB  
1343 C CG  . LEU A 88  ? 0.94430 0.80820 0.95910 0.00800  0.06870  0.00040  86  LEU A CG  
1344 C CD1 . LEU A 88  ? 0.97140 0.79550 0.97720 0.00380  0.06760  -0.00840 86  LEU A CD1 
1345 C CD2 . LEU A 88  ? 0.94770 0.80930 0.97720 0.01400  0.06110  0.01540  86  LEU A CD2 
1357 N N   . ILE A 89  ? 0.90320 0.89890 0.90450 -0.01620 0.06520  0.02380  87  ILE A N   
1358 C CA  . ILE A 89  ? 0.91240 0.94490 0.91140 -0.01960 0.06810  0.01910  87  ILE A CA  
1359 C C   . ILE A 89  ? 0.83080 0.87570 0.82780 -0.03790 0.06560  0.03420  87  ILE A C   
1360 O O   . ILE A 89  ? 0.82420 0.87430 0.81840 -0.04820 0.06140  0.05230  87  ILE A O   
1361 C CB  . ILE A 89  ? 0.95660 1.02390 0.95400 -0.01100 0.06970  0.01540  87  ILE A CB  
1362 C CG1 . ILE A 89  ? 0.95790 1.02440 0.95200 -0.01290 0.06540  0.03030  87  ILE A CG1 
1363 C CG2 . ILE A 89  ? 0.87260 0.93550 0.87330 0.00400  0.07030  -0.00310 87  ILE A CG2 
1364 C CD1 . ILE A 89  ? 1.06720 1.16800 1.05380 -0.00740 0.06580  0.02660  87  ILE A CD1 
1376 N N   . LYS A 90  ? 0.78370 0.83400 0.78290 -0.04420 0.06630  0.02910  88  LYS A N   
1377 C CA  . LYS A 90  ? 0.86460 0.93600 0.86530 -0.06310 0.06360  0.04350  88  LYS A CA  
1378 C C   . LYS A 90  ? 0.82120 0.95280 0.82840 -0.06070 0.07020  0.04080  88  LYS A C   
1379 O O   . LYS A 90  ? 0.82290 0.96960 0.83470 -0.04390 0.07450  0.02270  88  LYS A O   
1380 C CB  . LYS A 90  ? 0.87990 0.92660 0.88080 -0.07240 0.05910  0.04000  88  LYS A CB  
1381 C CG  . LYS A 90  ? 0.87820 0.87940 0.87140 -0.08710 0.04990  0.05170  88  LYS A CG  
1382 C CD  . LYS A 90  ? 0.94870 0.92000 0.93640 -0.09390 0.04540  0.04250  88  LYS A CD  
1383 C CE  . LYS A 90  ? 1.04460 0.96380 1.02220 -0.10660 0.03480  0.04930  88  LYS A CE  
1384 N NZ  . LYS A 90  ? 0.97080 0.85250 0.93610 -0.10820 0.03220  0.03350  88  LYS A NZ  
1398 N N   . ARG A 91  ? 0.80440 0.97080 0.81250 -0.07770 0.07030  0.05870  89  ARG A N   
1399 C CA  . ARG A 91  ? 0.82540 1.05730 0.84100 -0.07620 0.07890  0.05590  89  ARG A CA  
1400 C C   . ARG A 91  ? 0.83680 1.09510 0.86680 -0.09030 0.07780  0.06250  89  ARG A C   
1401 O O   . ARG A 91  ? 0.79400 1.02140 0.82300 -0.10830 0.06850  0.07620  89  ARG A O   
1402 C CB  . ARG A 91  ? 0.87450 1.14170 0.87980 -0.08670 0.08190  0.07280  89  ARG A CB  
1403 C CG  . ARG A 91  ? 0.93050 1.19080 0.92350 -0.07090 0.08390  0.06340  89  ARG A CG  
1404 C CD  . ARG A 91  ? 0.93230 1.22460 0.92880 -0.04810 0.09260  0.03610  89  ARG A CD  
1405 N NE  . ARG A 91  ? 0.94180 1.24340 0.92270 -0.03910 0.09410  0.03070  89  ARG A NE  
1406 C CZ  . ARG A 91  ? 0.90630 1.17060 0.88260 -0.02480 0.08890  0.01960  89  ARG A CZ  
1407 N NH1 . ARG A 91  ? 0.95240 1.17040 0.93800 -0.01690 0.08380  0.01200  89  ARG A NH1 
1408 N NH2 . ARG A 91  ? 0.88990 1.16650 0.85090 -0.02020 0.08840  0.01710  89  ARG A NH2 
1422 N N   . PRO A 92  ? 0.79470 1.11020 0.83980 -0.08160 0.08610  0.05200  90  PRO A N   
1423 C CA  . PRO A 92  ? 0.70930 1.05680 0.77380 -0.09470 0.08430  0.05960  90  PRO A CA  
1424 C C   . PRO A 92  ? 0.79210 1.15520 0.85440 -0.12640 0.08000  0.09020  90  PRO A C   
1425 O O   . PRO A 92  ? 0.73730 1.08820 0.80750 -0.14450 0.07030  0.10210  90  PRO A O   
1426 C CB  . PRO A 92  ? 0.71990 1.13590 0.80280 -0.07630 0.09610  0.04260  90  PRO A CB  
1427 C CG  . PRO A 92  ? 0.81120 1.20990 0.88270 -0.05030 0.10000  0.01960  90  PRO A CG  
1428 C CD  . PRO A 92  ? 0.80900 1.16210 0.85550 -0.05870 0.09620  0.03150  90  PRO A CD  
1436 N N   . THR A 93  ? 0.81060 1.19930 0.86090 -0.13600 0.08460  0.10510  91  THR A N   
1437 C CA  . THR A 93  ? 0.80630 1.21070 0.85400 -0.16960 0.07780  0.13830  91  THR A CA  
1438 C C   . THR A 93  ? 0.80920 1.13590 0.84710 -0.18630 0.05920  0.15260  91  THR A C   
1439 O O   . THR A 93  ? 0.77810 1.10590 0.81700 -0.21630 0.04810  0.17970  91  THR A O   
1440 C CB  . THR A 93  ? 0.74580 1.18470 0.77760 -0.17750 0.08370  0.15280  91  THR A CB  
1441 O OG1 . THR A 93  ? 0.74700 1.13030 0.76040 -0.16360 0.07920  0.14550  91  THR A OG1 
1442 C CG2 . THR A 93  ? 0.73340 1.25640 0.77230 -0.16340 0.10330  0.13760  91  THR A CG2 
1450 N N   . GLY A 94  ? 0.81020 1.07090 0.83890 -0.16790 0.05510  0.13450  92  GLY A N   
1451 C CA  . GLY A 94  ? 0.89580 1.08170 0.91350 -0.17810 0.03950  0.14220  92  GLY A CA  
1452 C C   . GLY A 94  ? 0.91200 1.06070 0.91620 -0.17360 0.03510  0.14870  92  GLY A C   
1453 O O   . GLY A 94  ? 1.01180 1.09420 1.00930 -0.17310 0.02390  0.14760  92  GLY A O   
1457 N N   . GLU A 95  ? 0.90820 1.09860 0.90860 -0.16990 0.04290  0.15450  93  GLU A N   
1458 C CA  . GLU A 95  ? 0.97720 1.13570 0.96680 -0.16520 0.03690  0.16190  93  GLU A CA  
1459 C C   . GLU A 95  ? 0.97750 1.08430 0.96680 -0.13800 0.03850  0.13670  93  GLU A C   
1460 O O   . GLU A 95  ? 0.99420 1.11210 0.98750 -0.11850 0.04930  0.11200  93  GLU A O   
1461 C CB  . GLU A 95  ? 0.94680 1.16430 0.92920 -0.16370 0.04650  0.16730  93  GLU A CB  
1462 C CG  . GLU A 95  ? 1.05120 1.24440 1.02240 -0.16760 0.03600  0.18500  93  GLU A CG  
1463 C CD  . GLU A 95  ? 1.09130 1.32130 1.05220 -0.15220 0.04630  0.17420  93  GLU A CD  
1464 O OE1 . GLU A 95  ? 1.02280 1.31020 0.98250 -0.14520 0.06170  0.15910  93  GLU A OE1 
1465 O OE2 . GLU A 95  ? 1.21600 1.41670 1.17100 -0.14640 0.03790  0.17980  93  GLU A OE2 
1472 N N   . LEU A 96  ? 1.15970 1.21080 1.14620 -0.13710 0.02670  0.14380  94  LEU A N   
1473 C CA  . LEU A 96  ? 1.07040 1.07850 1.05890 -0.11240 0.02890  0.12290  94  LEU A CA  
1474 C C   . LEU A 96  ? 1.07300 1.09220 1.06020 -0.10180 0.02920  0.12770  94  LEU A C   
1475 O O   . LEU A 96  ? 1.17960 1.20010 1.16390 -0.11580 0.01840  0.15240  94  LEU A O   
1476 C CB  . LEU A 96  ? 1.06700 1.00790 1.05670 -0.11440 0.01630  0.12350  94  LEU A CB  
1477 C CG  . LEU A 96  ? 1.03850 0.96170 1.02510 -0.12960 0.01150  0.12140  94  LEU A CG  
1478 C CD1 . LEU A 96  ? 1.06870 0.92150 1.05300 -0.13200 -0.00330 0.12130  94  LEU A CD1 
1479 C CD2 . LEU A 96  ? 0.99560 0.93290 0.98190 -0.11700 0.02450  0.09600  94  LEU A CD2 
1491 N N   . MET A 97  ? 1.05620 1.08240 1.04530 -0.07950 0.03920  0.10610  95  MET A N   
1492 C CA  . MET A 97  ? 1.02290 1.06690 1.00940 -0.07010 0.03950  0.10850  95  MET A CA  
1493 C C   . MET A 97  ? 0.92510 0.93750 0.92060 -0.04790 0.04090  0.09170  95  MET A C   
1494 O O   . MET A 97  ? 0.91410 0.94260 0.90940 -0.03380 0.04910  0.07330  95  MET A O   
1495 C CB  . MET A 97  ? 0.92210 1.02430 0.90010 -0.06820 0.05030  0.09990  95  MET A CB  
1496 C CG  . MET A 97  ? 0.99240 1.11820 0.96080 -0.06480 0.04860  0.10510  95  MET A CG  
1497 S SD  . MET A 97  ? 1.07020 1.24560 1.03000 -0.05020 0.06160  0.07880  95  MET A SD  
1498 C CE  . MET A 97  ? 1.24990 1.48080 1.18850 -0.06710 0.06210  0.09670  95  MET A CE  
1508 N N   . PRO A 98  ? 0.92510 0.89280 0.93010 -0.04430 0.03220  0.09770  96  PRO A N   
1509 C CA  . PRO A 98  ? 0.97240 0.91950 0.98970 -0.02320 0.03470  0.08380  96  PRO A CA  
1510 C C   . PRO A 98  ? 0.97110 0.94220 0.99000 -0.01750 0.03120  0.09110  96  PRO A C   
1511 O O   . PRO A 98  ? 0.93520 0.91280 0.95140 -0.02790 0.02020  0.11320  96  PRO A O   
1512 C CB  . PRO A 98  ? 0.96420 0.86170 0.99350 -0.02080 0.02520  0.08950  96  PRO A CB  
1513 C CG  . PRO A 98  ? 1.03630 0.92900 1.05930 -0.04260 0.01140  0.11510  96  PRO A CG  
1514 C CD  . PRO A 98  ? 1.01720 0.95070 1.02460 -0.05850 0.01880  0.11620  96  PRO A CD  
1522 N N   . LEU A 99  ? 0.87690 0.86020 0.89870 -0.00320 0.03860  0.07390  97  LEU A N   
1523 C CA  . LEU A 99  ? 0.85580 0.85930 0.87840 0.00230  0.03400  0.07790  97  LEU A CA  
1524 C C   . LEU A 99  ? 0.85310 0.83640 0.89740 0.01840  0.03280  0.07260  97  LEU A C   
1525 O O   . LEU A 99  ? 0.80990 0.78110 0.86160 0.02770  0.04190  0.05560  97  LEU A O   
1526 C CB  . LEU A 99  ? 0.82920 0.86630 0.83760 0.00420  0.04060  0.06260  97  LEU A CB  
1527 C CG  . LEU A 99  ? 0.91400 0.98390 0.90380 -0.00800 0.04460  0.06380  97  LEU A CG  
1528 C CD1 . LEU A 99  ? 1.04160 1.13530 1.02380 0.00100  0.05110  0.04140  97  LEU A CD1 
1529 C CD2 . LEU A 99  ? 0.89890 0.99040 0.87600 -0.02150 0.03660  0.08560  97  LEU A CD2 
1541 N N   . ALA A 100 ? 0.81820 0.80180 0.87340 0.02050  0.02130  0.08840  98  ALA A N   
1542 C CA  . ALA A 100 ? 0.88860 0.86300 0.96940 0.03620  0.01970  0.08530  98  ALA A CA  
1543 C C   . ALA A 100 ? 0.89260 0.89320 0.97000 0.04010  0.02130  0.07590  98  ALA A C   
1544 O O   . ALA A 100 ? 0.94560 0.96830 1.00540 0.03190  0.01480  0.08130  98  ALA A O   
1545 C CB  . ALA A 100 ? 0.79020 0.75360 0.88910 0.03730  0.00350  0.10810  98  ALA A CB  
1551 N N   . ALA A 101 ? 0.81770 0.81600 0.91050 0.05120  0.02930  0.06180  99  ALA A N   
1552 C CA  . ALA A 101 ? 0.84070 0.85880 0.93120 0.05270  0.02870  0.05320  99  ALA A CA  
1553 C C   . ALA A 101 ? 0.81160 0.83150 0.93230 0.06370  0.02990  0.05310  99  ALA A C   
1554 O O   . ALA A 101 ? 0.82900 0.83920 0.96170 0.07100  0.04170  0.04300  99  ALA A O   
1555 C CB  . ALA A 101 ? 0.84840 0.86870 0.92090 0.04970  0.03800  0.03470  99  ALA A CB  
1561 N N   . ARG A 102 ? 0.84130 0.87710 0.97380 0.06410  0.01780  0.06420  100 ARG A N   
1562 C CA  . ARG A 102 ? 0.88730 0.93480 1.05180 0.07290  0.01810  0.06580  100 ARG A CA  
1563 C C   . ARG A 102 ? 0.79980 0.85820 0.95650 0.06860  0.02290  0.05270  100 ARG A C   
1564 O O   . ARG A 102 ? 0.86430 0.93120 1.00510 0.06030  0.01190  0.05240  100 ARG A O   
1565 C CB  . ARG A 102 ? 0.91610 0.97820 1.09720 0.07240  0.00040  0.08490  100 ARG A CB  
1566 C CG  . ARG A 102 ? 0.90480 0.98680 1.12380 0.08050  -0.00010 0.08880  100 ARG A CG  
1567 C CD  . ARG A 102 ? 0.89030 0.98510 1.13440 0.08220  -0.01880 0.11060  100 ARG A CD  
1568 N NE  . ARG A 102 ? 0.86480 0.94310 1.12680 0.09180  -0.02200 0.12150  100 ARG A NE  
1569 C CZ  . ARG A 102 ? 0.91570 0.98270 1.16260 0.08390  -0.03730 0.13760  100 ARG A CZ  
1570 N NH1 . ARG A 102 ? 0.90250 0.97700 1.11400 0.06720  -0.04840 0.14290  100 ARG A NH1 
1571 N NH2 . ARG A 102 ? 1.08020 1.12790 1.34730 0.09250  -0.04250 0.14860  100 ARG A NH2 
1585 N N   . MET A 103 ? 0.75300 0.80940 0.91890 0.07330  0.03770  0.04160  101 MET A N   
1586 C CA  . MET A 103 ? 0.83540 0.90030 0.99380 0.06650  0.04030  0.03250  101 MET A CA  
1587 C C   . MET A 103 ? 0.84510 0.93370 1.02480 0.06370  0.02990  0.04240  101 MET A C   
1588 O O   . MET A 103 ? 0.84630 0.94940 1.05540 0.07070  0.02720  0.05410  101 MET A O   
1589 C CB  . MET A 103 ? 0.80210 0.86260 0.96310 0.06960  0.05830  0.02080  101 MET A CB  
1590 C CG  . MET A 103 ? 0.95650 0.99220 1.09870 0.07110  0.06710  0.01170  101 MET A CG  
1591 S SD  . MET A 103 ? 0.85720 0.88150 0.96640 0.06140  0.05750  0.00990  101 MET A SD  
1592 C CE  . MET A 103 ? 0.80960 0.84100 0.90620 0.05260  0.05280  0.00120  101 MET A CE  
1602 N N   . GLY A 104 ? 0.80490 0.89650 0.97160 0.05290  0.02210  0.03860  102 GLY A N   
1603 C CA  . GLY A 104 ? 0.75740 0.86810 0.93960 0.04550  0.00770  0.04900  102 GLY A CA  
1604 C C   . GLY A 104 ? 0.64170 0.76090 0.82700 0.03580  0.01020  0.04650  102 GLY A C   
1605 O O   . GLY A 104 ? 0.68340 0.80820 0.87510 0.03810  0.02770  0.04170  102 GLY A O   
1609 N N   . THR A 105 ? 0.72720 0.84590 0.90560 0.02330  -0.00940 0.05020  103 THR A N   
1610 C CA  . THR A 105 ? 0.78480 0.91320 0.96940 0.00970  -0.01310 0.05420  103 THR A CA  
1611 C C   . THR A 105 ? 0.74740 0.85750 0.91020 0.00670  -0.00390 0.04170  103 THR A C   
1612 O O   . THR A 105 ? 0.63400 0.71850 0.77180 0.01120  -0.00540 0.02890  103 THR A O   
1613 C CB  . THR A 105 ? 0.76010 0.88160 0.93800 -0.00400 -0.04140 0.05990  103 THR A CB  
1614 O OG1 . THR A 105 ? 0.81410 0.90890 0.96330 0.00100  -0.05290 0.04760  103 THR A OG1 
1615 C CG2 . THR A 105 ? 0.89160 1.04250 1.10010 -0.00850 -0.05130 0.07840  103 THR A CG2 
1623 N N   . HIS A 106 ? 0.75010 0.87770 0.92330 -0.00200 0.00570  0.04670  104 HIS A N   
1624 C CA  . HIS A 106 ? 0.79430 0.90670 0.94690 -0.01110 0.00780  0.04000  104 HIS A CA  
1625 C C   . HIS A 106 ? 0.75630 0.85940 0.90350 -0.02950 -0.01830 0.04810  104 HIS A C   
1626 O O   . HIS A 106 ? 0.80450 0.92910 0.97090 -0.04100 -0.02880 0.06350  104 HIS A O   
1627 C CB  . HIS A 106 ? 0.73360 0.87060 0.89490 -0.01400 0.03070  0.04170  104 HIS A CB  
1628 C CG  . HIS A 106 ? 0.79720 0.94180 0.96770 0.00470  0.05450  0.03290  104 HIS A CG  
1629 N ND1 . HIS A 106 ? 0.85520 1.00550 1.01930 0.00700  0.07630  0.02390  104 HIS A ND1 
1630 C CD2 . HIS A 106 ? 0.83380 0.97850 1.01890 0.02120  0.05760  0.03200  104 HIS A CD2 
1631 C CE1 . HIS A 106 ? 0.89560 1.04590 1.07090 0.02570  0.09140  0.01590  104 HIS A CE1 
1632 N NE2 . HIS A 106 ? 0.88810 1.03490 1.07760 0.03420  0.07980  0.02210  104 HIS A NE2 
1640 N N   . ALA A 107 ? 0.78020 0.85130 0.90390 -0.03230 -0.03060 0.03840  105 ALA A N   
1641 C CA  . ALA A 107 ? 0.80420 0.85720 0.92280 -0.04760 -0.05990 0.04410  105 ALA A CA  
1642 C C   . ALA A 107 ? 0.86190 0.88060 0.95880 -0.04670 -0.06990 0.03150  105 ALA A C   
1643 O O   . ALA A 107 ? 0.84900 0.85950 0.93450 -0.03350 -0.05530 0.01790  105 ALA A O   
1644 C CB  . ALA A 107 ? 0.79890 0.84380 0.91980 -0.04480 -0.08050 0.04360  105 ALA A CB  
1650 N N   . THR A 108 ? 0.92690 0.92570 1.02090 -0.06170 -0.09730 0.03780  106 THR A N   
1651 C CA  . THR A 108 ? 0.90170 0.86360 0.98050 -0.05900 -0.11520 0.02590  106 THR A CA  
1652 C C   . THR A 108 ? 0.96450 0.90170 1.03620 -0.04530 -0.13410 0.00890  106 THR A C   
1653 O O   . THR A 108 ? 0.97440 0.90550 1.05020 -0.05330 -0.15500 0.01460  106 THR A O   
1654 C CB  . THR A 108 ? 0.87190 0.82160 0.95220 -0.08300 -0.13830 0.04270  106 THR A CB  
1655 O OG1 . THR A 108 ? 0.80740 0.78390 0.88860 -0.09590 -0.11790 0.05610  106 THR A OG1 
1656 C CG2 . THR A 108 ? 1.04030 0.94770 1.11010 -0.07820 -0.16250 0.03060  106 THR A CG2 
1664 N N   . MET A 109 ? 0.87720 0.80280 0.93730 -0.02580 -0.12670 -0.01200 107 MET A N   
1665 C CA  . MET A 109 ? 0.89620 0.80720 0.94620 -0.01000 -0.13760 -0.03200 107 MET A CA  
1666 C C   . MET A 109 ? 0.87670 0.75370 0.91990 -0.00170 -0.15950 -0.04960 107 MET A C   
1667 O O   . MET A 109 ? 0.91320 0.78060 0.95970 -0.00420 -0.16110 -0.04760 107 MET A O   
1668 C CB  . MET A 109 ? 0.88740 0.81940 0.93070 0.00700  -0.11100 -0.04280 107 MET A CB  
1669 C CG  . MET A 109 ? 1.03660 0.99070 1.08320 0.00630  -0.10290 -0.03430 107 MET A CG  
1670 S SD  . MET A 109 ? 1.27910 1.26390 1.34660 -0.00460 -0.08150 -0.01020 107 MET A SD  
1671 C CE  . MET A 109 ? 1.17210 1.16240 1.23420 0.00560  -0.05330 -0.01760 107 MET A CE  
1681 N N   . LYS A 110 ? 0.88360 0.74250 0.91730 0.00910  -0.17720 -0.06810 108 LYS A N   
1682 C CA  . LYS A 110 ? 1.01990 0.84740 1.04880 0.02370  -0.19740 -0.09160 108 LYS A CA  
1683 C C   . LYS A 110 ? 0.92650 0.77280 0.94520 0.04760  -0.17650 -0.11590 108 LYS A C   
1684 O O   . LYS A 110 ? 0.95310 0.80520 0.95780 0.05620  -0.17620 -0.13000 108 LYS A O   
1685 C CB  . LYS A 110 ? 0.97740 0.76980 1.00110 0.01970  -0.23340 -0.09900 108 LYS A CB  
1686 C CG  . LYS A 110 ? 1.07360 0.82210 1.10290 0.02340  -0.26520 -0.10920 108 LYS A CG  
1687 C CD  . LYS A 110 ? 1.13710 0.86880 1.17870 -0.00500 -0.28660 -0.07880 108 LYS A CD  
1688 C CE  . LYS A 110 ? 1.35830 1.04220 1.40700 -0.00280 -0.32220 -0.08550 108 LYS A CE  
1689 N NZ  . LYS A 110 ? 1.26290 0.95240 1.31910 0.01440  -0.30890 -0.09600 108 LYS A NZ  
1703 N N   . ILE A 111 ? 0.94460 0.80340 0.96930 0.05580  -0.15920 -0.11900 109 ILE A N   
1704 C CA  . ILE A 111 ? 0.94630 0.82940 0.96440 0.07530  -0.13820 -0.13810 109 ILE A CA  
1705 C C   . ILE A 111 ? 1.02050 0.88600 1.04470 0.09400  -0.15360 -0.16240 109 ILE A C   
1706 O O   . ILE A 111 ? 1.00420 0.85800 1.04310 0.09230  -0.16070 -0.15690 109 ILE A O   
1707 C CB  . ILE A 111 ? 1.01060 0.92290 1.03330 0.07100  -0.10860 -0.12400 109 ILE A CB  
1708 C CG1 . ILE A 111 ? 0.94340 0.87220 0.96390 0.05660  -0.09360 -0.10260 109 ILE A CG1 
1709 C CG2 . ILE A 111 ? 1.03610 0.97520 1.05410 0.08800  -0.08970 -0.14110 109 ILE A CG2 
1710 C CD1 . ILE A 111 ? 0.98200 0.91100 0.99380 0.05430  -0.10260 -0.10260 109 ILE A CD1 
1722 N N   . GLN A 112 ? 1.00660 0.87140 1.02000 0.11220  -0.15940 -0.19000 110 GLN A N   
1723 C CA  . GLN A 112 ? 1.01460 0.86850 1.03600 0.13590  -0.17130 -0.21890 110 GLN A CA  
1724 C C   . GLN A 112 ? 1.03510 0.84310 1.07390 0.13220  -0.20450 -0.21460 110 GLN A C   
1725 O O   . GLN A 112 ? 0.97510 0.77860 1.03300 0.14270  -0.20990 -0.21990 110 GLN A O   
1726 C CB  . GLN A 112 ? 1.06760 0.96120 1.09870 0.14850  -0.14460 -0.22470 110 GLN A CB  
1727 C CG  . GLN A 112 ? 1.05400 0.99320 1.06820 0.14950  -0.11400 -0.22590 110 GLN A CG  
1728 C CD  . GLN A 112 ? 1.14720 1.12160 1.16360 0.17280  -0.09960 -0.25270 110 GLN A CD  
1729 O OE1 . GLN A 112 ? 1.24870 1.24760 1.28210 0.17660  -0.08580 -0.24880 110 GLN A OE1 
1730 N NE2 . GLN A 112 ? 1.45790 1.43810 1.45660 0.18790  -0.10280 -0.28030 110 GLN A NE2 
1739 N N   . GLY A 113 ? 1.06690 0.84140 1.10030 0.11510  -0.22920 -0.20230 111 GLY A N   
1740 C CA  . GLY A 113 ? 0.94160 0.66960 0.98900 0.10650  -0.26520 -0.19400 111 GLY A CA  
1741 C C   . GLY A 113 ? 1.07030 0.80100 1.13080 0.08420  -0.26290 -0.16080 111 GLY A C   
1742 O O   . GLY A 113 ? 1.17110 0.86540 1.24300 0.07410  -0.29380 -0.14980 111 GLY A O   
1746 N N   . ALA A 114 ? 0.89850 0.66940 0.95600 0.07540  -0.22900 -0.14470 112 ALA A N   
1747 C CA  . ALA A 114 ? 0.94740 0.72490 1.01200 0.05460  -0.22290 -0.11640 112 ALA A CA  
1748 C C   . ALA A 114 ? 0.99010 0.78790 1.04600 0.03170  -0.20660 -0.09200 112 ALA A C   
1749 O O   . ALA A 114 ? 1.02560 0.83980 1.07240 0.03470  -0.19390 -0.09640 112 ALA A O   
1750 C CB  . ALA A 114 ? 0.92560 0.73120 0.99610 0.06500  -0.19810 -0.12040 112 ALA A CB  
1756 N N   . THR A 115 ? 0.93620 0.73550 0.99560 0.00900  -0.20710 -0.06620 113 THR A N   
1757 C CA  . THR A 115 ? 0.92870 0.75030 0.98420 -0.01250 -0.19240 -0.04300 113 THR A CA  
1758 C C   . THR A 115 ? 0.98570 0.84040 1.03770 -0.01280 -0.15700 -0.03770 113 THR A C   
1759 O O   . THR A 115 ? 1.07300 0.92630 1.12530 -0.01440 -0.15410 -0.03570 113 THR A O   
1760 C CB  . THR A 115 ? 0.91930 0.72420 0.97890 -0.04010 -0.21720 -0.01760 113 THR A CB  
1761 O OG1 . THR A 115 ? 1.05230 0.82880 1.11420 -0.04400 -0.24880 -0.01900 113 THR A OG1 
1762 C CG2 . THR A 115 ? 0.98840 0.82820 1.04650 -0.06120 -0.19460 0.00590  113 THR A CG2 
1770 N N   . VAL A 116 ? 0.87850 0.76040 0.92760 -0.01170 -0.13280 -0.03520 114 VAL A N   
1771 C CA  . VAL A 116 ? 0.99910 0.90740 1.04460 -0.00900 -0.10060 -0.03370 114 VAL A CA  
1772 C C   . VAL A 116 ? 0.98820 0.91990 1.03680 -0.02120 -0.08500 -0.01760 114 VAL A C   
1773 O O   . VAL A 116 ? 0.98150 0.92150 1.03450 -0.01850 -0.08570 -0.01670 114 VAL A O   
1774 C CB  . VAL A 116 ? 0.95830 0.87730 1.00010 0.01220  -0.08510 -0.05210 114 VAL A CB  
1775 C CG1 . VAL A 116 ? 0.92520 0.86880 0.96460 0.01230  -0.05530 -0.04660 114 VAL A CG1 
1776 C CG2 . VAL A 116 ? 1.01890 0.92830 1.06160 0.02400  -0.09090 -0.06630 114 VAL A CG2 
1786 N N   . GLY A 117 ? 0.99290 0.93730 1.03960 -0.03400 -0.07120 -0.00580 115 GLY A N   
1787 C CA  . GLY A 117 ? 0.93480 0.90750 0.98680 -0.04030 -0.05030 0.00470  115 GLY A CA  
1788 C C   . GLY A 117 ? 0.88750 0.87220 0.93780 -0.02420 -0.02430 -0.00570 115 GLY A C   
1789 O O   . GLY A 117 ? 0.90490 0.88340 0.94580 -0.01920 -0.01480 -0.01380 115 GLY A O   
1793 N N   . GLY A 118 ? 0.91180 0.91270 0.97260 -0.01740 -0.01560 -0.00360 116 GLY A N   
1794 C CA  . GLY A 118 ? 0.87470 0.88320 0.93550 -0.00320 0.00460  -0.01070 116 GLY A CA  
1795 C C   . GLY A 118 ? 0.83180 0.85850 0.90850 0.00180  0.00930  -0.00380 116 GLY A C   
1796 O O   . GLY A 118 ? 0.90710 0.94770 0.99700 -0.00710 0.00240  0.00750  116 GLY A O   
1800 N N   . GLN A 119 ? 0.72630 0.75440 0.80330 0.01460  0.01940  -0.00850 117 GLN A N   
1801 C CA  . GLN A 119 ? 0.82460 0.86860 0.91820 0.02060  0.02240  -0.00070 117 GLN A CA  
1802 C C   . GLN A 119 ? 0.76230 0.79990 0.84720 0.02900  0.01590  -0.00470 117 GLN A C   
1803 O O   . GLN A 119 ? 0.78370 0.81250 0.85560 0.03430  0.02270  -0.01250 117 GLN A O   
1804 C CB  . GLN A 119 ? 0.85870 0.91400 0.96510 0.02710  0.04370  0.00110  117 GLN A CB  
1805 C CG  . GLN A 119 ? 0.80100 0.87450 0.93190 0.03460  0.04490  0.01100  117 GLN A CG  
1806 C CD  . GLN A 119 ? 0.81440 0.89550 0.96070 0.04510  0.06470  0.00930  117 GLN A CD  
1807 O OE1 . GLN A 119 ? 0.82960 0.89840 0.96330 0.04650  0.07760  -0.00080 117 GLN A OE1 
1808 N NE2 . GLN A 119 ? 0.81460 0.91500 0.98950 0.05320  0.06560  0.01840  117 GLN A NE2 
1817 N N   . MET A 120 ? 0.77410 0.81900 0.86520 0.02810  0.00210  0.00160  118 MET A N   
1818 C CA  . MET A 120 ? 0.78750 0.83100 0.86700 0.03380  -0.00420 -0.00090 118 MET A CA  
1819 C C   . MET A 120 ? 0.84410 0.89500 0.93220 0.04080  0.00860  0.00670  118 MET A C   
1820 O O   . MET A 120 ? 0.84200 0.90140 0.95190 0.04360  0.01790  0.01510  118 MET A O   
1821 C CB  . MET A 120 ? 0.82270 0.87090 0.90420 0.02890  -0.02440 0.00450  118 MET A CB  
1822 C CG  . MET A 120 ? 0.85060 0.88280 0.91810 0.02320  -0.04320 -0.00610 118 MET A CG  
1823 S SD  . MET A 120 ? 0.86480 0.89890 0.93630 0.01370  -0.06970 0.00220  118 MET A SD  
1824 C CE  . MET A 120 ? 0.92650 0.96720 0.97940 0.02070  -0.07180 -0.00120 118 MET A CE  
1834 N N   . GLY A 121 ? 0.82250 0.87090 0.89390 0.04380  0.00830  0.00380  119 GLY A N   
1835 C CA  . GLY A 121 ? 0.86870 0.92020 0.94620 0.04770  0.01480  0.01420  119 GLY A CA  
1836 C C   . GLY A 121 ? 0.85180 0.91060 0.91240 0.04520  0.00430  0.01830  119 GLY A C   
1837 O O   . GLY A 121 ? 0.85610 0.91690 0.89570 0.04300  -0.00350 0.00740  119 GLY A O   
1841 N N   . MET A 122 ? 0.93970 1.00210 1.00920 0.04590  0.00320  0.03380  120 MET A N   
1842 C CA  . MET A 122 ? 0.97210 1.04450 1.02470 0.04050  -0.00790 0.04270  120 MET A CA  
1843 C C   . MET A 122 ? 0.91200 0.98120 0.96110 0.03860  -0.00190 0.05360  120 MET A C   
1844 O O   . MET A 122 ? 0.91640 0.97710 0.98870 0.04240  -0.00150 0.06710  120 MET A O   
1845 C CB  . MET A 122 ? 0.99000 1.07120 1.05880 0.03890  -0.02330 0.05760  120 MET A CB  
1846 C CG  . MET A 122 ? 0.96960 1.06200 1.01570 0.03040  -0.03800 0.06670  120 MET A CG  
1847 S SD  . MET A 122 ? 1.07610 1.17480 1.07710 0.02580  -0.03930 0.04370  120 MET A SD  
1848 C CE  . MET A 122 ? 1.11830 1.21130 1.12230 0.02540  -0.05500 0.03250  120 MET A CE  
1858 N N   . LEU A 123 ? 0.93600 1.01290 0.95810 0.03280  0.00170  0.04790  121 LEU A N   
1859 C CA  . LEU A 123 ? 1.02000 1.09640 1.03660 0.02630  0.00520  0.06120  121 LEU A CA  
1860 C C   . LEU A 123 ? 1.07680 1.15910 1.09410 0.01930  -0.00920 0.08490  121 LEU A C   
1861 O O   . LEU A 123 ? 0.96510 1.06070 0.97270 0.01610  -0.02090 0.08760  121 LEU A O   
1862 C CB  . LEU A 123 ? 1.00030 1.09370 0.98950 0.02010  0.01280  0.05080  121 LEU A CB  
1863 C CG  . LEU A 123 ? 0.89570 0.98490 0.88490 0.02630  0.02430  0.02920  121 LEU A CG  
1864 C CD1 . LEU A 123 ? 0.93530 1.04860 0.90330 0.02130  0.03130  0.02130  121 LEU A CD1 
1865 C CD2 . LEU A 123 ? 0.84380 0.90900 0.85280 0.02930  0.03210  0.03130  121 LEU A CD2 
1877 N N   . LEU A 124 ? 1.12360 1.19320 1.15160 0.01570  -0.01080 0.10280  122 LEU A N   
1878 C CA  . LEU A 124 ? 1.12920 1.19820 1.16420 0.00920  -0.02760 0.12950  122 LEU A CA  
1879 C C   . LEU A 124 ? 1.22610 1.30620 1.23500 -0.00850 -0.03070 0.14510  122 LEU A C   
1880 O O   . LEU A 124 ? 1.33450 1.40280 1.34390 -0.01250 -0.02370 0.14740  122 LEU A O   
1881 C CB  . LEU A 124 ? 1.01650 1.05840 1.09050 0.02060  -0.03100 0.13940  122 LEU A CB  
1882 C CG  . LEU A 124 ? 1.00310 1.03780 1.10370 0.03780  -0.02060 0.12110  122 LEU A CG  
1883 C CD1 . LEU A 124 ? 0.93040 0.94000 1.06610 0.05080  -0.01960 0.12570  122 LEU A CD1 
1884 C CD2 . LEU A 124 ? 0.99000 1.04340 1.09900 0.04050  -0.02920 0.12110  122 LEU A CD2 
1896 N N   . THR A 125 ? 1.31900 1.42330 1.30360 -0.02120 -0.04170 0.15670  123 THR A N   
1897 C CA  . THR A 125 ? 1.31440 1.43800 1.27120 -0.04170 -0.04500 0.17470  123 THR A CA  
1898 C C   . THR A 125 ? 1.38170 1.52320 1.31900 -0.04490 -0.02560 0.15670  123 THR A C   
1899 O O   . THR A 125 ? 1.38900 1.56340 1.29780 -0.04810 -0.01820 0.14150  123 THR A O   
1900 C CB  . THR A 125 ? 1.31980 1.41880 1.29560 -0.05010 -0.05860 0.20590  123 THR A CB  
1901 O OG1 . THR A 125 ? 1.32700 1.40790 1.33080 -0.04210 -0.07660 0.22080  123 THR A OG1 
1902 C CG2 . THR A 125 ? 1.31340 1.43660 1.25840 -0.07670 -0.06660 0.23130  123 THR A CG2 
1910 N N   . LEU A 134 ? 1.21250 1.43660 1.12280 -0.06670 0.03870  0.11820  132 LEU A N   
1911 C CA  . LEU A 134 ? 1.30760 1.57740 1.19410 -0.06370 0.04550  0.10260  132 LEU A CA  
1912 C C   . LEU A 134 ? 1.29950 1.55680 1.19140 -0.03930 0.04920  0.06960  132 LEU A C   
1913 O O   . LEU A 134 ? 1.35850 1.62430 1.23500 -0.03340 0.04450  0.05950  132 LEU A O   
1914 C CB  . LEU A 134 ? 1.22670 1.55070 1.10180 -0.07420 0.05980  0.10000  132 LEU A CB  
1915 C CG  . LEU A 134 ? 1.26940 1.62250 1.13060 -0.10370 0.05590  0.13460  132 LEU A CG  
1916 C CD1 . LEU A 134 ? 1.30400 1.62130 1.18600 -0.11710 0.04770  0.15870  132 LEU A CD1 
1917 C CD2 . LEU A 134 ? 1.18010 1.60540 1.02370 -0.11170 0.07270  0.12690  132 LEU A CD2 
1928 N N   . GLY A 135 ? 1.13690 1.37260 1.04910 -0.02740 0.05520  0.05430  133 GLY A N   
1929 C CA  . GLY A 135 ? 1.10310 1.32370 1.02220 -0.00730 0.05610  0.02670  133 GLY A CA  
1930 C C   . GLY A 135 ? 1.11220 1.32680 1.04740 0.00040  0.06450  0.01180  133 GLY A C   
1931 O O   . GLY A 135 ? 1.17460 1.39660 1.11610 -0.00980 0.06990  0.02210  133 GLY A O   
1935 N N   . THR A 136 ? 0.97850 1.17840 0.92040 0.01660  0.06300  -0.01100 134 THR A N   
1936 C CA  . THR A 136 ? 0.94540 1.13790 0.90220 0.02470  0.06750  -0.02570 134 THR A CA  
1937 C C   . THR A 136 ? 0.93270 1.16200 0.88510 0.03490  0.07290  -0.04810 134 THR A C   
1938 O O   . THR A 136 ? 0.91580 1.16630 0.85210 0.04070  0.07190  -0.05990 134 THR A O   
1939 C CB  . THR A 136 ? 0.96640 1.11910 0.93510 0.03420  0.06020  -0.03420 134 THR A CB  
1940 O OG1 . THR A 136 ? 0.93050 1.08260 0.89130 0.04380  0.05210  -0.04790 134 THR A OG1 
1941 C CG2 . THR A 136 ? 0.93410 1.05590 0.91090 0.02750  0.05750  -0.01550 134 THR A CG2 
1949 N N   . THR A 137 ? 0.90410 1.14130 0.87170 0.03790  0.07800  -0.05510 135 THR A N   
1950 C CA  . THR A 137 ? 0.88220 1.15890 0.85320 0.04970  0.08400  -0.07610 135 THR A CA  
1951 C C   . THR A 137 ? 0.83060 1.08940 0.82330 0.06110  0.07940  -0.08990 135 THR A C   
1952 O O   . THR A 137 ? 0.76640 0.98700 0.76760 0.05540  0.07380  -0.08040 135 THR A O   
1953 C CB  . THR A 137 ? 0.78600 1.11360 0.75600 0.03700  0.09650  -0.06400 135 THR A CB  
1954 O OG1 . THR A 137 ? 0.85780 1.17360 0.84420 0.02470  0.09700  -0.04770 135 THR A OG1 
1955 C CG2 . THR A 137 ? 0.89470 1.23770 0.84220 0.02070  0.09830  -0.04410 135 THR A CG2 
1963 N N   . PRO A 138 ? 0.75850 1.04440 0.76090 0.07740  0.08070  -0.11270 136 PRO A N   
1964 C CA  . PRO A 138 ? 0.76520 1.03660 0.79140 0.08650  0.07380  -0.12190 136 PRO A CA  
1965 C C   . PRO A 138 ? 0.83370 1.11290 0.87310 0.07070  0.07900  -0.10250 136 PRO A C   
1966 O O   . PRO A 138 ? 0.79300 1.11080 0.83090 0.05900  0.09010  -0.09030 136 PRO A O   
1967 C CB  . PRO A 138 ? 0.76640 1.07500 0.80250 0.10850  0.07560  -0.14990 136 PRO A CB  
1968 C CG  . PRO A 138 ? 0.72340 1.04680 0.73410 0.11370  0.07900  -0.16130 136 PRO A CG  
1969 C CD  . PRO A 138 ? 0.76120 1.08920 0.75280 0.09040  0.08670  -0.13350 136 PRO A CD  
1977 N N   . GLY A 139 ? 0.84250 1.08480 0.89290 0.06820  0.06950  -0.09880 137 GLY A N   
1978 C CA  . GLY A 139 ? 0.76440 1.00150 0.82190 0.05100  0.07110  -0.08060 137 GLY A CA  
1979 C C   . GLY A 139 ? 0.80090 0.99730 0.84310 0.03510  0.07050  -0.06290 137 GLY A C   
1980 O O   . GLY A 139 ? 0.65160 0.83670 0.69560 0.02020  0.07050  -0.04940 137 GLY A O   
1984 N N   . ASP A 140 ? 0.86420 1.03860 0.89280 0.03850  0.06900  -0.06360 138 ASP A N   
1985 C CA  . ASP A 140 ? 0.79700 0.93610 0.81570 0.02760  0.06890  -0.04910 138 ASP A CA  
1986 C C   . ASP A 140 ? 0.73450 0.83420 0.75460 0.03020  0.06180  -0.05350 138 ASP A C   
1987 O O   . ASP A 140 ? 0.75810 0.83070 0.77300 0.02230  0.06340  -0.04420 138 ASP A O   
1988 C CB  . ASP A 140 ? 0.78510 0.92810 0.79160 0.02820  0.07080  -0.04370 138 ASP A CB  
1989 C CG  . ASP A 140 ? 0.83340 1.01340 0.83360 0.01900  0.07770  -0.03250 138 ASP A CG  
1990 O OD1 . ASP A 140 ? 0.79940 1.00430 0.80680 0.01180  0.08200  -0.02870 138 ASP A OD1 
1991 O OD2 . ASP A 140 ? 0.79430 0.98080 0.78260 0.01690  0.07770  -0.02550 138 ASP A OD2 
1996 N N   . CYS A 141 ? 0.79550 0.89190 0.82240 0.04060  0.05350  -0.06710 139 CYS A N   
1997 C CA  . CYS A 141 ? 0.87580 0.93910 0.90260 0.03900  0.04580  -0.06780 139 CYS A CA  
1998 C C   . CYS A 141 ? 0.78810 0.83540 0.81300 0.02570  0.04800  -0.05930 139 CYS A C   
1999 O O   . CYS A 141 ? 0.74660 0.80800 0.77560 0.01970  0.05030  -0.05580 139 CYS A O   
2000 C CB  . CYS A 141 ? 0.84650 0.90780 0.88270 0.04960  0.03230  -0.08100 139 CYS A CB  
2001 S SG  . CYS A 141 ? 0.83310 0.89570 0.86630 0.06380  0.02440  -0.09370 139 CYS A SG  
2007 N N   . GLY A 142 ? 0.83590 0.85610 0.85410 0.02040  0.04720  -0.05620 140 GLY A N   
2008 C CA  . GLY A 142 ? 0.88820 0.89010 0.89860 0.00780  0.05010  -0.05110 140 GLY A CA  
2009 C C   . GLY A 142 ? 0.85850 0.84880 0.86090 0.00250  0.06030  -0.04450 140 GLY A C   
2010 O O   . GLY A 142 ? 0.86150 0.83010 0.85410 -0.00540 0.06340  -0.04410 140 GLY A O   
2014 N N   . CYS A 143 ? 0.80420 0.80700 0.80950 0.00640  0.06440  -0.03970 141 CYS A N   
2015 C CA  . CYS A 143 ? 0.93840 0.92590 0.93920 0.00210  0.07010  -0.03180 141 CYS A CA  
2016 C C   . CYS A 143 ? 0.85530 0.82440 0.85620 0.00840  0.07370  -0.03400 141 CYS A C   
2017 O O   . CYS A 143 ? 0.78040 0.75740 0.78630 0.01570  0.07150  -0.03720 141 CYS A O   
2018 C CB  . CYS A 143 ? 0.87490 0.88230 0.87840 0.00250  0.07070  -0.02260 141 CYS A CB  
2019 S SG  . CYS A 143 ? 1.08120 1.11800 1.08660 -0.00790 0.06980  -0.01680 141 CYS A SG  
2025 N N   . PRO A 144 ? 0.89760 0.84330 0.89470 0.00590  0.07850  -0.03300 142 PRO A N   
2026 C CA  . PRO A 144 ? 0.82690 0.76080 0.82700 0.01300  0.08440  -0.03780 142 PRO A CA  
2027 C C   . PRO A 144 ? 0.75930 0.69660 0.77280 0.02290  0.08510  -0.03110 142 PRO A C   
2028 O O   . PRO A 144 ? 0.76130 0.69930 0.77780 0.02230  0.08120  -0.02140 142 PRO A O   
2029 C CB  . PRO A 144 ? 0.86080 0.76750 0.84990 0.00750  0.08920  -0.04380 142 PRO A CB  
2030 C CG  . PRO A 144 ? 0.91110 0.80990 0.89790 0.00000  0.08370  -0.03540 142 PRO A CG  
2031 C CD  . PRO A 144 ? 0.87380 0.80210 0.86400 -0.00390 0.07800  -0.02900 142 PRO A CD  
2039 N N   . TYR A 145 ? 0.87410 0.81620 0.89660 0.03030  0.08880  -0.03420 143 TYR A N   
2040 C CA  . TYR A 145 ? 0.88690 0.83110 0.92640 0.04070  0.08970  -0.02830 143 TYR A CA  
2041 C C   . TYR A 145 ? 0.86890 0.79570 0.91360 0.04720  0.09940  -0.03610 143 TYR A C   
2042 O O   . TYR A 145 ? 0.89560 0.82320 0.93380 0.04550  0.10760  -0.04640 143 TYR A O   
2043 C CB  . TYR A 145 ? 0.78980 0.75590 0.83990 0.04450  0.08650  -0.02590 143 TYR A CB  
2044 C CG  . TYR A 145 ? 0.81530 0.79630 0.86130 0.04210  0.07580  -0.02100 143 TYR A CG  
2045 C CD1 . TYR A 145 ? 0.82480 0.81050 0.85870 0.03650  0.07140  -0.02720 143 TYR A CD1 
2046 C CD2 . TYR A 145 ? 0.76630 0.75720 0.82050 0.04630  0.06920  -0.01130 143 TYR A CD2 
2047 C CE1 . TYR A 145 ? 0.77730 0.77720 0.80740 0.03750  0.06270  -0.02740 143 TYR A CE1 
2048 C CE2 . TYR A 145 ? 0.86410 0.86950 0.90980 0.04430  0.06030  -0.01020 143 TYR A CE2 
2049 C CZ  . TYR A 145 ? 0.80710 0.81710 0.84080 0.04110  0.05810  -0.02000 143 TYR A CZ  
2050 O OH  . TYR A 145 ? 0.79090 0.81590 0.81620 0.04210  0.05030  -0.02330 143 TYR A OH  
2060 N N   . ILE A 146 ? 0.89420 0.80500 0.94970 0.05440  0.09770  -0.03150 144 ILE A N   
2061 C CA  . ILE A 146 ? 0.88360 0.77420 0.94630 0.06460  0.10580  -0.04220 144 ILE A CA  
2062 C C   . ILE A 146 ? 0.87120 0.76230 0.96240 0.07950  0.10190  -0.03390 144 ILE A C   
2063 O O   . ILE A 146 ? 0.87560 0.76990 0.97350 0.07730  0.08990  -0.01740 144 ILE A O   
2064 C CB  . ILE A 146 ? 0.88230 0.73770 0.92740 0.05780  0.10370  -0.04830 144 ILE A CB  
2065 C CG1 . ILE A 146 ? 0.97810 0.82250 1.02340 0.05010  0.08950  -0.03100 144 ILE A CG1 
2066 C CG2 . ILE A 146 ? 0.96700 0.82290 0.98640 0.04360  0.10730  -0.05720 144 ILE A CG2 
2067 C CD1 . ILE A 146 ? 0.98580 0.79790 1.04460 0.05850  0.08230  -0.02750 144 ILE A CD1 
2079 N N   . TYR A 147 ? 0.94760 0.83890 1.05600 0.09460  0.11220  -0.04550 145 TYR A N   
2080 C CA  . TYR A 147 ? 1.01770 0.90720 1.15900 0.11220  0.10820  -0.03980 145 TYR A CA  
2081 C C   . TYR A 147 ? 1.03790 0.90530 1.18750 0.12850  0.11870  -0.06030 145 TYR A C   
2082 O O   . TYR A 147 ? 0.99550 0.86470 1.12810 0.12720  0.13350  -0.07940 145 TYR A O   
2083 C CB  . TYR A 147 ? 0.96860 0.89870 1.13500 0.11830  0.10950  -0.03110 145 TYR A CB  
2084 C CG  . TYR A 147 ? 0.90070 0.85790 1.07650 0.12520  0.12730  -0.04560 145 TYR A CG  
2085 C CD1 . TYR A 147 ? 0.91990 0.89570 1.07390 0.11060  0.13420  -0.04970 145 TYR A CD1 
2086 C CD2 . TYR A 147 ? 0.90000 0.86710 1.10810 0.14610  0.13650  -0.05390 145 TYR A CD2 
2087 C CE1 . TYR A 147 ? 0.83280 0.83740 0.99340 0.11280  0.14980  -0.05940 145 TYR A CE1 
2088 C CE2 . TYR A 147 ? 0.94910 0.94970 1.16600 0.15110  0.15500  -0.06640 145 TYR A CE2 
2089 C CZ  . TYR A 147 ? 0.86940 0.88940 1.06060 0.13250  0.16160  -0.06780 145 TYR A CZ  
2090 O OH  . TYR A 147 ? 0.91060 0.96770 1.10860 0.13360  0.17930  -0.07700 145 TYR A OH  
2100 N N   . LYS A 148 ? 1.02160 0.86690 1.19660 0.14400  0.10970  -0.05660 146 LYS A N   
2101 C CA  . LYS A 148 ? 1.08830 0.90490 1.27340 0.16320  0.11640  -0.07860 146 LYS A CA  
2102 C C   . LYS A 148 ? 1.04710 0.89890 1.26850 0.18650  0.13100  -0.08920 146 LYS A C   
2103 O O   . LYS A 148 ? 0.87090 0.74470 1.12740 0.19590  0.12310  -0.07260 146 LYS A O   
2104 C CB  . LYS A 148 ? 1.05560 0.82520 1.25220 0.16850  0.09550  -0.06880 146 LYS A CB  
2105 C CG  . LYS A 148 ? 1.14860 0.87770 1.35450 0.18960  0.09830  -0.09400 146 LYS A CG  
2106 C CD  . LYS A 148 ? 1.21920 0.88860 1.40330 0.17750  0.07940  -0.09080 146 LYS A CD  
2107 C CE  . LYS A 148 ? 1.38330 1.00360 1.58580 0.20200  0.07340  -0.11160 146 LYS A CE  
2108 N NZ  . LYS A 148 ? 1.28330 0.88650 1.52700 0.21580  0.05090  -0.09090 146 LYS A NZ  
2122 N N   . ARG A 149 ? 1.01400 0.87430 1.22700 0.19480  0.15220  -0.11610 147 ARG A N   
2123 C CA  . ARG A 149 ? 1.07750 0.97970 1.32400 0.21640  0.17050  -0.12920 147 ARG A CA  
2124 C C   . ARG A 149 ? 1.08870 0.96070 1.34470 0.24220  0.17910  -0.15940 147 ARG A C   
2125 O O   . ARG A 149 ? 1.04170 0.89880 1.26430 0.23910  0.19270  -0.18470 147 ARG A O   
2126 C CB  . ARG A 149 ? 1.00270 0.95170 1.22960 0.20180  0.18990  -0.13440 147 ARG A CB  
2127 C CG  . ARG A 149 ? 0.91610 0.91870 1.17650 0.22000  0.21110  -0.14600 147 ARG A CG  
2128 C CD  . ARG A 149 ? 0.96370 1.01690 1.20870 0.19860  0.22290  -0.13850 147 ARG A CD  
2129 N NE  . ARG A 149 ? 0.98500 1.03070 1.18340 0.18370  0.23650  -0.15680 147 ARG A NE  
2130 C CZ  . ARG A 149 ? 0.95350 1.02610 1.12590 0.15860  0.24050  -0.14830 147 ARG A CZ  
2131 N NH1 . ARG A 149 ? 1.00010 1.10560 1.18720 0.14560  0.23160  -0.12350 147 ARG A NH1 
2132 N NH2 . ARG A 149 ? 0.95100 1.01450 1.08090 0.14540  0.25100  -0.16460 147 ARG A NH2 
2146 N N   . GLY A 150 ? 1.11080 0.97240 1.41200 0.26810  0.16960  -0.15770 148 GLY A N   
2147 C CA  . GLY A 150 ? 1.08350 0.90610 1.39580 0.29520  0.17260  -0.18730 148 GLY A CA  
2148 C C   . GLY A 150 ? 1.18740 0.93860 1.46090 0.28100  0.15480  -0.19020 148 GLY A C   
2149 O O   . GLY A 150 ? 1.21450 0.93530 1.48790 0.26760  0.12910  -0.16290 148 GLY A O   
2153 N N   . ASN A 151 ? 1.21750 0.94470 1.45610 0.28120  0.16800  -0.22200 149 ASN A N   
2154 C CA  . ASN A 151 ? 1.22990 0.89190 1.42780 0.26390  0.15160  -0.22580 149 ASN A CA  
2155 C C   . ASN A 151 ? 1.28410 0.95800 1.42960 0.23020  0.15890  -0.22250 149 ASN A C   
2156 O O   . ASN A 151 ? 1.22790 0.85450 1.33830 0.21220  0.14590  -0.22400 149 ASN A O   
2157 C CB  . ASN A 151 ? 1.31330 0.92680 1.50720 0.28820  0.15510  -0.26570 149 ASN A CB  
2158 C CG  . ASN A 151 ? 1.45360 1.07920 1.70340 0.33000  0.16130  -0.28190 149 ASN A CG  
2159 O OD1 . ASN A 151 ? 1.48840 1.09920 1.78070 0.34230  0.13980  -0.26070 149 ASN A OD1 
2160 N ND2 . ASN A 151 ? 1.50790 1.16270 1.75870 0.35190  0.19030  -0.31970 149 ASN A ND2 
2167 N N   . ASP A 152 ? 1.33610 1.07070 1.47740 0.22060  0.17710  -0.21660 150 ASP A N   
2168 C CA  . ASP A 152 ? 1.31150 1.05980 1.40830 0.19000  0.18190  -0.21150 150 ASP A CA  
2169 C C   . ASP A 152 ? 1.23150 0.99920 1.33170 0.16900  0.16730  -0.17530 150 ASP A C   
2170 O O   . ASP A 152 ? 1.12960 0.92440 1.26470 0.17720  0.16280  -0.15660 150 ASP A O   
2171 C CB  . ASP A 152 ? 1.19620 0.99660 1.28230 0.19010  0.20920  -0.22820 150 ASP A CB  
2172 C CG  . ASP A 152 ? 1.15490 0.93870 1.22130 0.20450  0.22630  -0.26790 150 ASP A CG  
2173 O OD1 . ASP A 152 ? 1.34020 1.06440 1.38410 0.20430  0.21470  -0.28260 150 ASP A OD1 
2174 O OD2 . ASP A 152 ? 1.38260 1.21430 1.45460 0.21470  0.25110  -0.28460 150 ASP A OD2 
2179 N N   . TYR A 153 ? 1.12490 0.87940 1.18870 0.14240  0.15940  -0.16690 151 TYR A N   
2180 C CA  . TYR A 153 ? 1.04820 0.82410 1.11010 0.12280  0.14840  -0.13830 151 TYR A CA  
2181 C C   . TYR A 153 ? 1.04560 0.86520 1.09260 0.11010  0.16130  -0.13810 151 TYR A C   
2182 O O   . TYR A 153 ? 1.06030 0.88000 1.07960 0.10280  0.17260  -0.15540 151 TYR A O   
2183 C CB  . TYR A 153 ? 1.07940 0.81930 1.11660 0.10230  0.13070  -0.12750 151 TYR A CB  
2184 C CG  . TYR A 153 ? 1.23330 0.93930 1.28890 0.10720  0.11150  -0.11350 151 TYR A CG  
2185 C CD1 . TYR A 153 ? 1.18660 0.91180 1.26310 0.10490  0.10020  -0.08670 151 TYR A CD1 
2186 C CD2 . TYR A 153 ? 1.28280 0.93570 1.33300 0.11260  0.10270  -0.12630 151 TYR A CD2 
2187 C CE1 . TYR A 153 ? 1.29610 0.99210 1.38740 0.10600  0.08090  -0.07020 151 TYR A CE1 
2188 C CE2 . TYR A 153 ? 1.51310 1.13220 1.58060 0.11450  0.08150  -0.10990 151 TYR A CE2 
2189 C CZ  . TYR A 153 ? 1.35260 0.99530 1.44060 0.11020  0.07090  -0.08040 151 TYR A CZ  
2190 O OH  . TYR A 153 ? 1.46060 1.07140 1.56380 0.10880  0.04810  -0.06060 151 TYR A OH  
2200 N N   . VAL A 154 ? 1.01790 0.87230 1.08180 0.10610  0.15740  -0.11790 152 VAL A N   
2201 C CA  . VAL A 154 ? 0.98520 0.87920 1.04090 0.09430  0.16520  -0.11410 152 VAL A CA  
2202 C C   . VAL A 154 ? 0.93040 0.82960 0.97850 0.07760  0.14980  -0.09380 152 VAL A C   
2203 O O   . VAL A 154 ? 0.92310 0.82690 0.99030 0.08150  0.13900  -0.07810 152 VAL A O   
2204 C CB  . VAL A 154 ? 0.97120 0.90740 1.05920 0.10770  0.17560  -0.11200 152 VAL A CB  
2205 C CG1 . VAL A 154 ? 0.89080 0.86450 0.96790 0.09150  0.18110  -0.10630 152 VAL A CG1 
2206 C CG2 . VAL A 154 ? 0.95890 0.89450 1.06150 0.12950  0.19190  -0.13410 152 VAL A CG2 
2216 N N   . VAL A 155 ? 1.02170 0.92140 1.04210 0.05960  0.14830  -0.09480 153 VAL A N   
2217 C CA  . VAL A 155 ? 1.01570 0.92500 1.03100 0.04640  0.13530  -0.07960 153 VAL A CA  
2218 C C   . VAL A 155 ? 0.91290 0.85600 0.93580 0.04270  0.13680  -0.07360 153 VAL A C   
2219 O O   . VAL A 155 ? 0.88280 0.83990 0.89800 0.03850  0.14730  -0.08080 153 VAL A O   
2220 C CB  . VAL A 155 ? 0.97280 0.86390 0.95960 0.03000  0.12930  -0.08240 153 VAL A CB  
2221 C CG1 . VAL A 155 ? 0.99390 0.88300 0.95750 0.02200  0.13920  -0.09640 153 VAL A CG1 
2222 C CG2 . VAL A 155 ? 0.93680 0.84330 0.92280 0.02000  0.11720  -0.06990 153 VAL A CG2 
2232 N N   . ILE A 156 ? 0.81060 0.76720 0.84690 0.04260  0.12560  -0.06000 154 ILE A N   
2233 C CA  . ILE A 156 ? 0.97720 0.96190 1.02450 0.03940  0.12300  -0.05240 154 ILE A CA  
2234 C C   . ILE A 156 ? 0.93660 0.92280 0.97230 0.02680  0.10850  -0.04610 154 ILE A C   
2235 O O   . ILE A 156 ? 0.85440 0.85770 0.89500 0.02030  0.10310  -0.04000 154 ILE A O   
2236 C CB  . ILE A 156 ? 0.98180 0.98210 1.05810 0.05140  0.12020  -0.04320 154 ILE A CB  
2237 C CG1 . ILE A 156 ? 0.88710 0.87660 0.96410 0.05340  0.10670  -0.03490 154 ILE A CG1 
2238 C CG2 . ILE A 156 ? 0.92230 0.92380 1.01700 0.06690  0.13350  -0.05020 154 ILE A CG2 
2239 C CD1 . ILE A 156 ? 0.95610 0.95690 1.05830 0.06390  0.10180  -0.02460 154 ILE A CD1 
2251 N N   . GLY A 157 ? 0.92820 0.89820 0.95120 0.02330  0.10100  -0.04710 155 GLY A N   
2252 C CA  . GLY A 157 ? 0.87080 0.84300 0.88700 0.01530  0.08720  -0.04400 155 GLY A CA  
2253 C C   . GLY A 157 ? 0.86840 0.83180 0.87890 0.01620  0.08150  -0.04480 155 GLY A C   
2254 O O   . GLY A 157 ? 0.86490 0.81750 0.87260 0.01820  0.08730  -0.04600 155 GLY A O   
2258 N N   . VAL A 158 ? 0.77720 0.74650 0.78750 0.01460  0.06910  -0.04420 156 VAL A N   
2259 C CA  . VAL A 158 ? 0.79060 0.76160 0.79830 0.01560  0.06450  -0.04570 156 VAL A CA  
2260 C C   . VAL A 158 ? 0.75180 0.73670 0.76670 0.02340  0.05540  -0.04630 156 VAL A C   
2261 O O   . VAL A 158 ? 0.81510 0.80160 0.83430 0.02490  0.04660  -0.04700 156 VAL A O   
2262 C CB  . VAL A 158 ? 0.81140 0.77720 0.81110 0.00690  0.05850  -0.04890 156 VAL A CB  
2263 C CG1 . VAL A 158 ? 0.90530 0.85610 0.89210 -0.00250 0.06680  -0.04990 156 VAL A CG1 
2264 C CG2 . VAL A 158 ? 0.86680 0.83350 0.86930 0.00470  0.04550  -0.04940 156 VAL A CG2 
2274 N N   . HIS A 159 ? 0.74570 0.74110 0.76020 0.02690  0.05670  -0.04600 157 HIS A N   
2275 C CA  . HIS A 159 ? 0.78240 0.79390 0.79890 0.03460  0.05020  -0.04910 157 HIS A CA  
2276 C C   . HIS A 159 ? 0.84990 0.86390 0.86860 0.03860  0.03850  -0.05960 157 HIS A C   
2277 O O   . HIS A 159 ? 0.77630 0.78750 0.79630 0.03560  0.03610  -0.06270 157 HIS A O   
2278 C CB  . HIS A 159 ? 0.80770 0.83590 0.82080 0.03450  0.05570  -0.04570 157 HIS A CB  
2279 C CG  . HIS A 159 ? 0.84100 0.88810 0.85080 0.04090  0.05190  -0.04790 157 HIS A CG  
2280 N ND1 . HIS A 159 ? 0.79160 0.83550 0.80170 0.04340  0.04790  -0.04360 157 HIS A ND1 
2281 C CD2 . HIS A 159 ? 0.80220 0.87440 0.80740 0.04500  0.05170  -0.05490 157 HIS A CD2 
2282 C CE1 . HIS A 159 ? 0.85530 0.91780 0.85730 0.04730  0.04400  -0.04770 157 HIS A CE1 
2283 N NE2 . HIS A 159 ? 0.82880 0.90990 0.82700 0.04900  0.04750  -0.05580 157 HIS A NE2 
2291 N N   . THR A 160 ? 0.76350 0.78080 0.78300 0.04550  0.02900  -0.06520 158 THR A N   
2292 C CA  . THR A 160 ? 0.86130 0.87310 0.88450 0.05100  0.01380  -0.07640 158 THR A CA  
2293 C C   . THR A 160 ? 0.90740 0.93200 0.92750 0.06300  0.00740  -0.08960 158 THR A C   
2294 O O   . THR A 160 ? 0.90880 0.93880 0.93310 0.07260  0.00050  -0.10370 158 THR A O   
2295 C CB  . THR A 160 ? 0.85600 0.84780 0.88200 0.04420  0.00260  -0.07100 158 THR A CB  
2296 O OG1 . THR A 160 ? 0.95570 0.93970 0.98120 0.03300  0.00970  -0.06180 158 THR A OG1 
2297 C CG2 . THR A 160 ? 0.88200 0.86120 0.91260 0.04880  -0.01810 -0.08080 158 THR A CG2 
2305 N N   . ALA A 161 ? 0.90900 0.93930 0.92180 0.06330  0.00890  -0.08640 159 ALA A N   
2306 C CA  . ALA A 161 ? 0.95200 0.99360 0.95590 0.07310  0.00210  -0.10030 159 ALA A CA  
2307 C C   . ALA A 161 ? 0.92760 0.98290 0.92110 0.06900  0.00880  -0.09040 159 ALA A C   
2308 O O   . ALA A 161 ? 0.91330 0.96450 0.91120 0.06070  0.01560  -0.07320 159 ALA A O   
2309 C CB  . ALA A 161 ? 1.05370 1.07260 1.05890 0.07690  -0.01900 -0.11020 159 ALA A CB  
2315 N N   . ALA A 162 ? 0.89530 0.96700 0.87460 0.07560  0.00600  -0.10220 160 ALA A N   
2316 C CA  . ALA A 162 ? 1.00030 1.08650 0.96640 0.07010  0.00880  -0.09200 160 ALA A CA  
2317 C C   . ALA A 162 ? 0.89830 0.98930 0.84650 0.07720  -0.00310 -0.11020 160 ALA A C   
2318 O O   . ALA A 162 ? 1.01980 1.13460 0.95520 0.08510  0.00220  -0.12700 160 ALA A O   
2319 C CB  . ALA A 162 ? 0.97620 1.08950 0.93710 0.06500  0.02480  -0.08230 160 ALA A CB  
2325 N N   . ALA A 163 ? 0.96860 1.03920 0.91570 0.07390  -0.01910 -0.10760 161 ALA A N   
2326 C CA  . ALA A 163 ? 1.02360 1.09070 0.95160 0.07930  -0.03460 -0.12630 161 ALA A CA  
2327 C C   . ALA A 163 ? 0.96620 1.06630 0.86840 0.08020  -0.02580 -0.13270 161 ALA A C   
2328 O O   . ALA A 163 ? 0.91530 1.03370 0.81320 0.06980  -0.01660 -0.11190 161 ALA A O   
2329 C CB  . ALA A 163 ? 0.89350 0.94020 0.82390 0.06970  -0.05250 -0.11400 161 ALA A CB  
2335 N N   . ARG A 164 ? 0.94840 1.05640 0.83320 0.09270  -0.02950 -0.16170 162 ARG A N   
2336 C CA  . ARG A 164 ? 1.04850 1.19310 0.90410 0.09330  -0.02060 -0.17120 162 ARG A CA  
2337 C C   . ARG A 164 ? 1.09440 1.23310 0.92630 0.08250  -0.03540 -0.16440 162 ARG A C   
2338 O O   . ARG A 164 ? 1.01200 1.11740 0.84950 0.07910  -0.05530 -0.16160 162 ARG A O   
2339 C CB  . ARG A 164 ? 1.09870 1.25660 0.94430 0.11320  -0.01860 -0.20880 162 ARG A CB  
2340 C CG  . ARG A 164 ? 1.30860 1.51800 1.12600 0.11470  -0.00200 -0.22050 162 ARG A CG  
2341 C CD  . ARG A 164 ? 1.26300 1.49310 1.08070 0.13860  0.00500  -0.25900 162 ARG A CD  
2342 N NE  . ARG A 164 ? 1.36770 1.55250 1.20380 0.15560  -0.01430 -0.28100 162 ARG A NE  
2343 C CZ  . ARG A 164 ? 1.38960 1.58030 1.24300 0.17820  -0.01210 -0.30870 162 ARG A CZ  
2344 N NH1 . ARG A 164 ? 1.76520 2.01030 1.62130 0.18780  0.01070  -0.32000 162 ARG A NH1 
2345 N NH2 . ARG A 164 ? 1.44970 1.59210 1.32050 0.19080  -0.03470 -0.32390 162 ARG A NH2 
2359 N N   . GLY A 165 ? 1.15540 1.32920 0.96050 0.07460  -0.02680 -0.15930 163 GLY A N   
2360 C CA  . GLY A 165 ? 1.11260 1.28470 0.89370 0.06160  -0.04150 -0.14880 163 GLY A CA  
2361 C C   . GLY A 165 ? 1.07150 1.22780 0.87500 0.04690  -0.04870 -0.11200 163 GLY A C   
2362 O O   . GLY A 165 ? 1.12420 1.26370 0.92360 0.03910  -0.06820 -0.10410 163 GLY A O   
2366 N N   . GLY A 166 ? 1.01120 1.17280 0.83980 0.04350  -0.03430 -0.09020 164 GLY A N   
2367 C CA  . GLY A 166 ? 1.04930 1.19690 0.90270 0.03350  -0.03930 -0.05850 164 GLY A CA  
2368 C C   . GLY A 166 ? 1.00320 1.15120 0.88230 0.03410  -0.02230 -0.04440 164 GLY A C   
2369 O O   . GLY A 166 ? 0.98120 1.14020 0.85990 0.04040  -0.00820 -0.05700 164 GLY A O   
2373 N N   . ASN A 167 ? 1.00080 1.13680 0.90380 0.02810  -0.02510 -0.01860 165 ASN A N   
2374 C CA  . ASN A 167 ? 1.03040 1.15980 0.95740 0.02850  -0.01180 -0.00540 165 ASN A CA  
2375 C C   . ASN A 167 ? 0.96980 1.07440 0.92500 0.03550  -0.01110 -0.00910 165 ASN A C   
2376 O O   . ASN A 167 ? 0.88650 0.98150 0.86270 0.03570  -0.00250 0.00250  165 ASN A O   
2377 C CB  . ASN A 167 ? 0.96700 1.09930 0.90190 0.01880  -0.01480 0.02410  165 ASN A CB  
2378 C CG  . ASN A 167 ? 1.00830 1.16750 0.91570 0.00760  -0.01250 0.03290  165 ASN A CG  
2379 O OD1 . ASN A 167 ? 1.01970 1.19750 0.91220 0.00760  -0.00010 0.02090  165 ASN A OD1 
2380 N ND2 . ASN A 167 ? 1.13160 1.29660 1.03330 -0.00320 -0.02520 0.05560  165 ASN A ND2 
2387 N N   . THR A 168 ? 1.01340 1.10690 0.96760 0.04010  -0.02080 -0.02500 166 THR A N   
2388 C CA  . THR A 168 ? 0.98470 1.05860 0.96250 0.04320  -0.02110 -0.02660 166 THR A CA  
2389 C C   . THR A 168 ? 0.91620 0.98590 0.89730 0.04820  -0.00740 -0.03730 166 THR A C   
2390 O O   . THR A 168 ? 0.85080 0.92650 0.81750 0.05350  -0.00600 -0.05520 166 THR A O   
2391 C CB  . THR A 168 ? 0.91040 0.97190 0.88460 0.04330  -0.03920 -0.03830 166 THR A CB  
2392 O OG1 . THR A 168 ? 1.03910 1.10420 1.01580 0.03620  -0.05340 -0.02430 166 THR A OG1 
2393 C CG2 . THR A 168 ? 0.84890 0.89320 0.84370 0.04360  -0.03990 -0.03950 166 THR A CG2 
2401 N N   . VAL A 169 ? 0.84760 0.90860 0.84830 0.04710  0.00230  -0.02720 167 VAL A N   
2402 C CA  . VAL A 169 ? 0.86020 0.91430 0.86460 0.04930  0.01270  -0.03500 167 VAL A CA  
2403 C C   . VAL A 169 ? 0.81490 0.85310 0.83480 0.04800  0.00990  -0.03470 167 VAL A C   
2404 O O   . VAL A 169 ? 0.85230 0.88920 0.88480 0.04520  0.00460  -0.02500 167 VAL A O   
2405 C CB  . VAL A 169 ? 0.85930 0.91620 0.86700 0.04650  0.02670  -0.02450 167 VAL A CB  
2406 C CG1 . VAL A 169 ? 0.86290 0.94020 0.85340 0.04440  0.02980  -0.02460 167 VAL A CG1 
2407 C CG2 . VAL A 169 ? 0.86550 0.91630 0.88890 0.04490  0.02780  -0.00720 167 VAL A CG2 
2417 N N   . ILE A 170 ? 0.87560 0.90540 0.89540 0.04860  0.01300  -0.04390 168 ILE A N   
2418 C CA  . ILE A 170 ? 0.85060 0.86740 0.88030 0.04420  0.00910  -0.04300 168 ILE A CA  
2419 C C   . ILE A 170 ? 0.88170 0.89390 0.91440 0.04130  0.02330  -0.04060 168 ILE A C   
2420 O O   . ILE A 170 ? 0.76330 0.77650 0.78900 0.04300  0.02860  -0.04660 168 ILE A O   
2421 C CB  . ILE A 170 ? 0.87060 0.87630 0.89550 0.04550  -0.00720 -0.05570 168 ILE A CB  
2422 C CG1 . ILE A 170 ? 0.87840 0.88460 0.89610 0.04860  -0.02280 -0.06160 168 ILE A CG1 
2423 C CG2 . ILE A 170 ? 0.80270 0.79570 0.83670 0.03640  -0.01360 -0.04960 168 ILE A CG2 
2424 C CD1 . ILE A 170 ? 0.88680 0.89300 0.91400 0.04070  -0.03120 -0.04790 168 ILE A CD1 
2436 N N   . CYS A 171 ? 0.89560 0.90520 0.93830 0.03650  0.02910  -0.03260 169 CYS A N   
2437 C CA  . CYS A 171 ? 0.81560 0.81920 0.85770 0.03320  0.04250  -0.03230 169 CYS A CA  
2438 C C   . CYS A 171 ? 0.79880 0.79750 0.84070 0.02430  0.03810  -0.03230 169 CYS A C   
2439 O O   . CYS A 171 ? 0.87570 0.88190 0.92700 0.01970  0.03910  -0.02530 169 CYS A O   
2440 C CB  . CYS A 171 ? 0.74970 0.75660 0.80220 0.03670  0.05500  -0.02530 169 CYS A CB  
2441 S SG  . CYS A 171 ? 0.71150 0.70990 0.76230 0.03340  0.07100  -0.02870 169 CYS A SG  
2447 N N   . ALA A 172 ? 0.76080 0.75010 0.79350 0.02060  0.03220  -0.03830 170 ALA A N   
2448 C CA  . ALA A 172 ? 0.86090 0.84390 0.89110 0.00920  0.02500  -0.03520 170 ALA A CA  
2449 C C   . ALA A 172 ? 0.84920 0.83620 0.87610 0.00190  0.04120  -0.03130 170 ALA A C   
2450 O O   . ALA A 172 ? 0.88550 0.86960 0.90710 0.00550  0.05510  -0.03560 170 ALA A O   
2451 C CB  . ALA A 172 ? 0.91500 0.88680 0.93870 0.00800  0.01430  -0.04150 170 ALA A CB  
2457 N N   . THR A 173 ? 0.88440 0.87850 0.91320 -0.00940 0.03850  -0.02360 171 THR A N   
2458 C CA  . THR A 173 ? 0.97220 0.97790 0.99780 -0.01570 0.05580  -0.02170 171 THR A CA  
2459 C C   . THR A 173 ? 0.89360 0.89920 0.90630 -0.03450 0.04900  -0.01550 171 THR A C   
2460 O O   . THR A 173 ? 0.83720 0.83280 0.84910 -0.04270 0.02780  -0.00950 171 THR A O   
2461 C CB  . THR A 173 ? 0.89830 0.92680 0.94290 -0.01180 0.06400  -0.01560 171 THR A CB  
2462 O OG1 . THR A 173 ? 0.87590 0.91410 0.92830 -0.02350 0.04810  -0.00370 171 THR A OG1 
2463 C CG2 . THR A 173 ? 0.89740 0.92500 0.95510 0.00450  0.06520  -0.01790 171 THR A CG2 
2471 N N   . GLN A 174 ? 1.04220 1.05820 1.04400 -0.04150 0.06600  -0.01730 172 GLN A N   
2472 C CA  . GLN A 174 ? 1.06010 1.08280 1.04600 -0.06280 0.06230  -0.00920 172 GLN A CA  
2473 C C   . GLN A 174 ? 1.14150 1.14020 1.11020 -0.07180 0.04640  -0.00910 172 GLN A C   
2474 O O   . GLN A 174 ? 1.16820 1.16770 1.11630 -0.08850 0.04720  -0.00580 172 GLN A O   
2475 C CB  . GLN A 174 ? 1.07160 1.11040 1.07000 -0.07560 0.04830  0.00740  172 GLN A CB  
2476 C CG  . GLN A 174 ? 1.09490 1.15350 1.07900 -0.10030 0.05000  0.01960  172 GLN A CG  
2477 C CD  . GLN A 174 ? 1.13130 1.22440 1.11480 -0.09850 0.08010  0.01380  172 GLN A CD  
2478 O OE1 . GLN A 174 ? 1.11760 1.20950 1.10570 -0.07840 0.09920  -0.00250 172 GLN A OE1 
2479 N NE2 . GLN A 174 ? 1.10920 1.23430 1.08810 -0.11950 0.08360  0.02720  172 GLN A NE2 
2488 C C01 . AG7 B .   ? 0.90660 0.96200 0.90310 0.11770  -0.02500 -0.17040 201 AG7 A C01 
2489 C C02 . AG7 B .   ? 0.99280 1.02800 1.01090 0.12340  -0.03740 -0.17550 201 AG7 A C02 
2490 O O03 . AG7 B .   ? 0.95570 1.02870 0.94940 0.10690  -0.00860 -0.15290 201 AG7 A O03 
2491 C C04 . AG7 B .   ? 0.97980 1.02270 1.00910 0.11150  -0.02420 -0.15560 201 AG7 A C04 
2492 C C05 . AG7 B .   ? 0.99130 1.01510 1.04000 0.11470  -0.03890 -0.15810 201 AG7 A C05 
2493 C C06 . AG7 B .   ? 1.03330 1.01560 1.08200 0.10480  -0.06040 -0.14920 201 AG7 A C06 
2494 C C07 . AG7 B .   ? 1.01550 0.98800 1.05950 0.08510  -0.05490 -0.12630 201 AG7 A C07 
2495 C C08 . AG7 B .   ? 1.03920 0.98290 1.08390 0.07370  -0.07270 -0.11610 201 AG7 A C08 
2496 C C09 . AG7 B .   ? 1.10810 1.02600 1.15780 0.08030  -0.09940 -0.12710 201 AG7 A C09 
2497 C C10 . AG7 B .   ? 1.12080 1.04140 1.17510 0.10220  -0.10690 -0.15230 201 AG7 A C10 
2498 C C11 . AG7 B .   ? 1.10130 1.05750 1.15530 0.11520  -0.08560 -0.16430 201 AG7 A C11 
2499 N N12 . AG7 B .   ? 0.81970 0.91520 0.84570 0.09690  0.01380  -0.13310 201 AG7 A N12 
2500 C C13 . AG7 B .   ? 0.95230 1.08760 0.97740 0.09550  0.03070  -0.13070 201 AG7 A C13 
2501 C C14 . AG7 B .   ? 0.88560 1.02580 0.89480 0.08170  0.04140  -0.11220 201 AG7 A C14 
2502 C C15 . AG7 B .   ? 0.93370 1.07890 0.92500 0.08700  0.03750  -0.12020 201 AG7 A C15 
2503 C C16 . AG7 B .   ? 0.97130 1.12380 0.94970 0.07200  0.04610  -0.09770 201 AG7 A C16 
2504 N N17 . AG7 B .   ? 1.01850 1.20270 0.98050 0.07350  0.05060  -0.10280 201 AG7 A N17 
2505 O O18 . AG7 B .   ? 0.92820 1.06080 0.91110 0.06190  0.04740  -0.08000 201 AG7 A O18 
2506 C C19 . AG7 B .   ? 0.94270 1.08570 0.98350 0.08940  0.03530  -0.12240 201 AG7 A C19 
2507 C C20 . AG7 B .   ? 0.76630 0.88910 0.82500 0.09700  0.01950  -0.13120 201 AG7 A C20 
2508 C C21 . AG7 B .   ? 0.89000 1.04760 0.96680 0.11500  0.01930  -0.15020 201 AG7 A C21 
2509 O O22 . AG7 B .   ? 0.89620 1.03860 0.98670 0.13320  0.00130  -0.16970 201 AG7 A O22 
2510 O O23 . AG7 B .   ? 0.98400 1.18270 1.06480 0.11400  0.03360  -0.14870 201 AG7 A O23 
2511 C C47 . AG7 B .   ? 0.92710 1.01240 0.95520 0.11360  -0.00280 -0.15610 201 AG7 A C47 
2512 O O48 . AG7 B .   ? 0.88420 0.99520 0.91330 0.12820  0.00010  -0.17490 201 AG7 A O48 
2513 C C50 . AG7 B .   ? 1.06450 1.24180 1.16240 0.15450  0.00530  -0.19390 201 AG7 A C50 
2514 C C53 . AG7 B .   ? 1.08730 1.23340 1.18910 0.17380  -0.01650 -0.21710 201 AG7 A C53 
2515 C C57 . AG7 B .   ? 0.94750 0.99710 0.92500 0.12470  -0.03710 -0.18730 201 AG7 A C57 
2516 N N58 . AG7 B .   ? 0.92390 0.95820 0.89450 0.10840  -0.04150 -0.16640 201 AG7 A N58 
2517 C C59 . AG7 B .   ? 0.92150 0.91930 0.89330 0.10390  -0.06570 -0.16590 201 AG7 A C59 
2518 O O60 . AG7 B .   ? 0.94260 0.91740 0.91910 0.11280  -0.08370 -0.18230 201 AG7 A O60 
2519 C C78 . AG7 B .   ? 0.93630 1.02660 0.89620 0.13330  -0.02250 -0.20220 201 AG7 A C78 
2520 C C81 . AG7 B .   ? 0.99860 1.10900 0.94340 0.11710  -0.00880 -0.17950 201 AG7 A C81 
2521 F F1  . AG7 B .   ? 1.08000 0.97100 1.13060 0.06530  -0.11880 -0.11340 201 AG7 A F1  
2522 C C82 . AG7 B .   ? 0.87550 0.99900 0.84940 0.14420  -0.00790 -0.21210 201 AG7 A C82 
2523 C C83 . AG7 B .   ? 0.97990 1.18270 0.94170 0.09110  0.04850  -0.13180 201 AG7 A C83 
2524 C C84 . AG7 B .   ? 0.82720 1.00550 0.81320 0.09870  0.04130  -0.13890 201 AG7 A C84 
2525 C C1  . AG7 B .   ? 0.98980 0.98040 0.96040 0.08680  -0.06900 -0.14210 201 AG7 A C1  
2526 C C2  . AG7 B .   ? 1.07270 1.03960 1.04160 0.07950  -0.09080 -0.13900 201 AG7 A C2  
2527 C C3  . AG7 B .   ? 1.15820 1.13390 1.13280 0.06560  -0.08490 -0.11440 201 AG7 A C3  
2528 O O4  . AG7 B .   ? 1.00210 1.00090 0.98060 0.06550  -0.06130 -0.10410 201 AG7 A O4  
2529 N N5  . AG7 B .   ? 0.94840 0.95590 0.92320 0.07700  -0.05190 -0.12020 201 AG7 A N5  
2530 C C4  . AG7 B .   ? 1.48950 1.45240 1.46840 0.05240  -0.10350 -0.10050 201 AG7 A C4  
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