# By using this file you agree to the legally binding terms of use found at
# https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
# To request access to the AlphaFold 3 model parameters, follow the process set
# out at https://github.com/google-deepmind/alphafold3. You may only use these if
# received directly from Google. Use is subject to terms of use available at
# https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
data_if04873
#
_entry.id if04873
#
loop_
_atom_type.symbol
C 
N 
O 
S 
#
loop_
_audit_author.name
_audit_author.pdbx_ordinal
"Google DeepMind" 1 
"Isomorphic Labs" 2 
#
_audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic
_audit_conform.dict_name     mmcif_ma.dic
_audit_conform.dict_version  1.4.5
#
loop_
_chem_comp.formula
_chem_comp.formula_weight
_chem_comp.id
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_smiles
_chem_comp.pdbx_synonyms
_chem_comp.type
"C3 H7 N O2"    89.093  ALA y ALANINE         C[C@H](N)C(O)=O                  ? "L-PEPTIDE LINKING" 
"C6 H15 N4 O2"  175.209 ARG y ARGININE        N[C@@H](CCCNC(N)=[NH2+])C(O)=O   ? "L-PEPTIDE LINKING" 
"C4 H8 N2 O3"   132.118 ASN y ASPARAGINE      N[C@@H](CC(N)=O)C(O)=O           ? "L-PEPTIDE LINKING" 
"C4 H7 N O4"    133.103 ASP y "ASPARTIC ACID" N[C@@H](CC(O)=O)C(O)=O           ? "L-PEPTIDE LINKING" 
"C3 H7 N O2 S"  121.158 CYS y CYSTEINE        N[C@@H](CS)C(O)=O                ? "L-PEPTIDE LINKING" 
"C5 H10 N2 O3"  146.144 GLN y GLUTAMINE       N[C@@H](CCC(N)=O)C(O)=O          ? "L-PEPTIDE LINKING" 
"C5 H9 N O4"    147.129 GLU y "GLUTAMIC ACID" N[C@@H](CCC(O)=O)C(O)=O          ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"    75.067  GLY y GLYCINE         NCC(O)=O                         ? "PEPTIDE LINKING"   
"C6 H10 N3 O2"  156.162 HIS y HISTIDINE       N[C@@H](Cc1c[nH]c[nH+]1)C(O)=O   ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 ILE y ISOLEUCINE      CC[C@H](C)[C@H](N)C(O)=O         ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 LEU y LEUCINE         CC(C)C[C@H](N)C(O)=O             ? "L-PEPTIDE LINKING" 
"C6 H15 N2 O2"  147.195 LYS y LYSINE          N[C@@H](CCCC[NH3+])C(O)=O        ? "L-PEPTIDE LINKING" 
"C5 H11 N O2 S" 149.211 MET y METHIONINE      CSCC[C@H](N)C(O)=O               ? "L-PEPTIDE LINKING" 
"C9 H11 N O2"   165.189 PHE y PHENYLALANINE   N[C@@H](Cc1ccccc1)C(O)=O         ? "L-PEPTIDE LINKING" 
"C5 H9 N O2"    115.130 PRO y PROLINE         OC(=O)[C@@H]1CCCN1               ? "L-PEPTIDE LINKING" 
"C3 H7 N O3"    105.093 SER y SERINE          N[C@@H](CO)C(O)=O                ? "L-PEPTIDE LINKING" 
"C4 H9 N O3"    119.119 THR y THREONINE       C[C@@H](O)[C@H](N)C(O)=O         ? "L-PEPTIDE LINKING" 
"C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN      N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O ? "L-PEPTIDE LINKING" 
"C9 H11 N O3"   181.189 TYR y TYROSINE        N[C@@H](Cc1ccc(O)cc1)C(O)=O      ? "L-PEPTIDE LINKING" 
#
_citation.book_publisher          ?
_citation.country                 UK
_citation.id                      primary
_citation.journal_full            Nature
_citation.journal_id_ASTM         NATUAS
_citation.journal_id_CSD          0006
_citation.journal_id_ISSN         0028-0836
_citation.journal_volume          630
_citation.page_first              493
_citation.page_last               500
_citation.pdbx_database_id_DOI    10.1038/s41586-024-07487-w
_citation.pdbx_database_id_PubMed 38718835
_citation.title                   "Accurate structure prediction of biomolecular interactions with AlphaFold 3"
_citation.year                    2024
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
primary "Google DeepMind" 1 
primary "Isomorphic Labs" 2 
#
_entity.id               1
_entity.pdbx_description .
_entity.type             polymer
#
_entity_poly.entity_id      1
_entity_poly.pdbx_strand_id A
_entity_poly.type           polypeptide(L)
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.hetero
_entity_poly_seq.mon_id
_entity_poly_seq.num
1 n MET 1   
1 n LEU 2   
1 n LEU 3   
1 n ALA 4   
1 n SER 5   
1 n CYS 6   
1 n LYS 7   
1 n PRO 8   
1 n GLY 9   
1 n TYR 10  
1 n HIS 11  
1 n ARG 12  
1 n SER 13  
1 n MET 14  
1 n CYS 15  
1 n TRP 16  
1 n TYR 17  
1 n CYS 18  
1 n GLY 19  
1 n GLU 20  
1 n ALA 21  
1 n ILE 22  
1 n SER 23  
1 n ASP 24  
1 n THR 25  
1 n GLU 26  
1 n THR 27  
1 n PRO 28  
1 n GLY 29  
1 n ARG 30  
1 n SER 31  
1 n MET 32  
1 n ARG 33  
1 n CYS 34  
1 n GLY 35  
1 n ILE 36  
1 n CYS 37  
1 n GLY 38  
1 n LYS 39  
1 n ASP 40  
1 n LEU 41  
1 n ARG 42  
1 n SER 43  
1 n CYS 44  
1 n ARG 45  
1 n ASN 46  
1 n CYS 47  
1 n ARG 48  
1 n PHE 49  
1 n PHE 50  
1 n LEU 51  
1 n PRO 52  
1 n GLY 53  
1 n SER 54  
1 n ARG 55  
1 n GLY 56  
1 n ASP 57  
1 n CYS 58  
1 n SER 59  
1 n GLU 60  
1 n THR 61  
1 n ASN 62  
1 n ALA 63  
1 n GLU 64  
1 n PRO 65  
1 n GLN 66  
1 n ALA 67  
1 n ASP 68  
1 n LYS 69  
1 n GLU 70  
1 n ARG 71  
1 n GLY 72  
1 n ASN 73  
1 n PHE 74  
1 n CYS 75  
1 n ASP 76  
1 n TRP 77  
1 n PHE 78  
1 n SER 79  
1 n LEU 80  
1 n ASN 81  
1 n PRO 82  
1 n ARG 83  
1 n PHE 84  
1 n ARG 85  
1 n SER 86  
1 n ALA 87  
1 n SER 88  
1 n ALA 89  
1 n GLY 90  
1 n GLU 91  
1 n GLN 92  
1 n LYS 93  
1 n SER 94  
1 n ARG 95  
1 n GLY 96  
1 n ALA 97  
1 n ALA 98  
1 n ALA 99  
1 n ASP 100 
1 n ALA 101 
1 n LYS 102 
1 n SER 103 
1 n ALA 104 
1 n PHE 105 
1 n GLU 106 
1 n GLY 107 
1 n LEU 108 
1 n PHE 109 
1 n LYS 110 
1 n ASP 111 
#
_ma_data.content_type "model coordinates"
_ma_data.id           1
_ma_data.name         Model
#
_ma_model_list.data_id          1
_ma_model_list.model_group_id   1
_ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.0 @ 2025-11-13 23:14:01)"
_ma_model_list.model_id         1
_ma_model_list.model_name       "Top ranked model"
_ma_model_list.model_type       "Ab initio model"
_ma_model_list.ordinal_id       1
#
loop_
_ma_protocol_step.method_type
_ma_protocol_step.ordinal_id
_ma_protocol_step.protocol_id
_ma_protocol_step.step_id
"coevolution MSA" 1 1 1 
"template search" 2 1 2 
modeling          3 1 3 
#
loop_
_ma_qa_metric.id
_ma_qa_metric.mode
_ma_qa_metric.name
_ma_qa_metric.software_group_id
_ma_qa_metric.type
1 global pLDDT 1 pLDDT 
2 local  pLDDT 1 pLDDT 
#
_ma_qa_metric_global.metric_id    1
_ma_qa_metric_global.metric_value 75.69
_ma_qa_metric_global.model_id     1
_ma_qa_metric_global.ordinal_id   1
#
_ma_software_group.group_id    1
_ma_software_group.ordinal_id  1
_ma_software_group.software_id 1
#
_ma_target_entity.data_id   1
_ma_target_entity.entity_id 1
_ma_target_entity.origin    .
#
_ma_target_entity_instance.asym_id   A
_ma_target_entity_instance.details   .
_ma_target_entity_instance.entity_id 1
#
loop_
_pdbx_data_usage.details
_pdbx_data_usage.id
_pdbx_data_usage.type
_pdbx_data_usage.url
;Non-commercial use only, by using this file you agree to the terms of use found
at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
To request access to the AlphaFold 3 model parameters, follow the process set
out at https://github.com/google-deepmind/alphafold3. You may only use these if
received directly from Google. Use is subject to terms of use available at
https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.

;
1 license    https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md 
;AlphaFold 3 and its output are not intended for, have not been validated for,
and are not approved for clinical use. They are provided "as-is" without any
warranty of any kind, whether expressed or implied. No warranty is given that
use shall not infringe the rights of any third party.

;
2 disclaimer ?                                                                              
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.hetero
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.seq_id
A 1   1 n MET . 1   A 1   
A 2   1 n LEU . 2   A 2   
A 3   1 n LEU . 3   A 3   
A 4   1 n ALA . 4   A 4   
A 5   1 n SER . 5   A 5   
A 6   1 n CYS . 6   A 6   
A 7   1 n LYS . 7   A 7   
A 8   1 n PRO . 8   A 8   
A 9   1 n GLY . 9   A 9   
A 10  1 n TYR . 10  A 10  
A 11  1 n HIS . 11  A 11  
A 12  1 n ARG . 12  A 12  
A 13  1 n SER . 13  A 13  
A 14  1 n MET . 14  A 14  
A 15  1 n CYS . 15  A 15  
A 16  1 n TRP . 16  A 16  
A 17  1 n TYR . 17  A 17  
A 18  1 n CYS . 18  A 18  
A 19  1 n GLY . 19  A 19  
A 20  1 n GLU . 20  A 20  
A 21  1 n ALA . 21  A 21  
A 22  1 n ILE . 22  A 22  
A 23  1 n SER . 23  A 23  
A 24  1 n ASP . 24  A 24  
A 25  1 n THR . 25  A 25  
A 26  1 n GLU . 26  A 26  
A 27  1 n THR . 27  A 27  
A 28  1 n PRO . 28  A 28  
A 29  1 n GLY . 29  A 29  
A 30  1 n ARG . 30  A 30  
A 31  1 n SER . 31  A 31  
A 32  1 n MET . 32  A 32  
A 33  1 n ARG . 33  A 33  
A 34  1 n CYS . 34  A 34  
A 35  1 n GLY . 35  A 35  
A 36  1 n ILE . 36  A 36  
A 37  1 n CYS . 37  A 37  
A 38  1 n GLY . 38  A 38  
A 39  1 n LYS . 39  A 39  
A 40  1 n ASP . 40  A 40  
A 41  1 n LEU . 41  A 41  
A 42  1 n ARG . 42  A 42  
A 43  1 n SER . 43  A 43  
A 44  1 n CYS . 44  A 44  
A 45  1 n ARG . 45  A 45  
A 46  1 n ASN . 46  A 46  
A 47  1 n CYS . 47  A 47  
A 48  1 n ARG . 48  A 48  
A 49  1 n PHE . 49  A 49  
A 50  1 n PHE . 50  A 50  
A 51  1 n LEU . 51  A 51  
A 52  1 n PRO . 52  A 52  
A 53  1 n GLY . 53  A 53  
A 54  1 n SER . 54  A 54  
A 55  1 n ARG . 55  A 55  
A 56  1 n GLY . 56  A 56  
A 57  1 n ASP . 57  A 57  
A 58  1 n CYS . 58  A 58  
A 59  1 n SER . 59  A 59  
A 60  1 n GLU . 60  A 60  
A 61  1 n THR . 61  A 61  
A 62  1 n ASN . 62  A 62  
A 63  1 n ALA . 63  A 63  
A 64  1 n GLU . 64  A 64  
A 65  1 n PRO . 65  A 65  
A 66  1 n GLN . 66  A 66  
A 67  1 n ALA . 67  A 67  
A 68  1 n ASP . 68  A 68  
A 69  1 n LYS . 69  A 69  
A 70  1 n GLU . 70  A 70  
A 71  1 n ARG . 71  A 71  
A 72  1 n GLY . 72  A 72  
A 73  1 n ASN . 73  A 73  
A 74  1 n PHE . 74  A 74  
A 75  1 n CYS . 75  A 75  
A 76  1 n ASP . 76  A 76  
A 77  1 n TRP . 77  A 77  
A 78  1 n PHE . 78  A 78  
A 79  1 n SER . 79  A 79  
A 80  1 n LEU . 80  A 80  
A 81  1 n ASN . 81  A 81  
A 82  1 n PRO . 82  A 82  
A 83  1 n ARG . 83  A 83  
A 84  1 n PHE . 84  A 84  
A 85  1 n ARG . 85  A 85  
A 86  1 n SER . 86  A 86  
A 87  1 n ALA . 87  A 87  
A 88  1 n SER . 88  A 88  
A 89  1 n ALA . 89  A 89  
A 90  1 n GLY . 90  A 90  
A 91  1 n GLU . 91  A 91  
A 92  1 n GLN . 92  A 92  
A 93  1 n LYS . 93  A 93  
A 94  1 n SER . 94  A 94  
A 95  1 n ARG . 95  A 95  
A 96  1 n GLY . 96  A 96  
A 97  1 n ALA . 97  A 97  
A 98  1 n ALA . 98  A 98  
A 99  1 n ALA . 99  A 99  
A 100 1 n ASP . 100 A 100 
A 101 1 n ALA . 101 A 101 
A 102 1 n LYS . 102 A 102 
A 103 1 n SER . 103 A 103 
A 104 1 n ALA . 104 A 104 
A 105 1 n PHE . 105 A 105 
A 106 1 n GLU . 106 A 106 
A 107 1 n GLY . 107 A 107 
A 108 1 n LEU . 108 A 108 
A 109 1 n PHE . 109 A 109 
A 110 1 n LYS . 110 A 110 
A 111 1 n ASP . 111 A 111 
#
_software.classification other
_software.date           ?
_software.description    "Structure prediction"
_software.name           AlphaFold
_software.pdbx_ordinal   1
_software.type           package
_software.version        "AlphaFold-beta-20231127 (3ba2d0388b83b90ab601e399702e005f73b6587c61cc70b0a0466583b05b47e1)"
#
_struct_asym.entity_id 1
_struct_asym.id        A
#
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.auth_seq_id
_atom_site.auth_asym_id
_atom_site.pdbx_PDB_model_num
ATOM 1   N N   . MET A 1 1   ? 9.983   29.575  -2.111  1.00 23.45 1   A 1 
ATOM 2   C CA  . MET A 1 1   ? 9.029   28.539  -1.664  1.00 35.19 1   A 1 
ATOM 3   C C   . MET A 1 1   ? 8.097   28.237  -2.830  1.00 36.43 1   A 1 
ATOM 4   O O   . MET A 1 1   ? 7.171   28.992  -3.067  1.00 35.42 1   A 1 
ATOM 5   C CB  . MET A 1 1   ? 8.234   29.017  -0.434  1.00 34.82 1   A 1 
ATOM 6   C CG  . MET A 1 1   ? 9.056   28.924  0.861   1.00 31.57 1   A 1 
ATOM 7   S SD  . MET A 1 1   ? 8.227   29.711  2.264   1.00 30.27 1   A 1 
ATOM 8   C CE  . MET A 1 1   ? 9.239   29.121  3.635   1.00 23.92 1   A 1 
ATOM 9   N N   . LEU A 1 2   ? 8.419   27.207  -3.625  1.00 31.90 2   A 1 
ATOM 10  C CA  . LEU A 1 2   ? 7.582   26.789  -4.751  1.00 39.61 2   A 1 
ATOM 11  C C   . LEU A 1 2   ? 6.458   25.910  -4.202  1.00 39.27 2   A 1 
ATOM 12  O O   . LEU A 1 2   ? 6.670   24.740  -3.894  1.00 38.32 2   A 1 
ATOM 13  C CB  . LEU A 1 2   ? 8.453   26.074  -5.802  1.00 38.52 2   A 1 
ATOM 14  C CG  . LEU A 1 2   ? 9.180   27.058  -6.740  1.00 34.54 2   A 1 
ATOM 15  C CD1 . LEU A 1 2   ? 10.517  26.480  -7.217  1.00 32.87 2   A 1 
ATOM 16  C CD2 . LEU A 1 2   ? 8.329   27.373  -7.967  1.00 38.31 2   A 1 
ATOM 17  N N   . LEU A 1 3   ? 5.282   26.500  -4.027  1.00 27.39 3   A 1 
ATOM 18  C CA  . LEU A 1 3   ? 4.051   25.747  -3.830  1.00 34.87 3   A 1 
ATOM 19  C C   . LEU A 1 3   ? 3.817   24.943  -5.111  1.00 34.97 3   A 1 
ATOM 20  O O   . LEU A 1 3   ? 3.473   25.507  -6.150  1.00 33.77 3   A 1 
ATOM 21  C CB  . LEU A 1 3   ? 2.894   26.718  -3.537  1.00 33.60 3   A 1 
ATOM 22  C CG  . LEU A 1 3   ? 2.959   27.383  -2.150  1.00 29.97 3   A 1 
ATOM 23  C CD1 . LEU A 1 3   ? 2.003   28.581  -2.093  1.00 27.86 3   A 1 
ATOM 24  C CD2 . LEU A 1 3   ? 2.567   26.411  -1.034  1.00 32.91 3   A 1 
ATOM 25  N N   . ALA A 1 4   ? 4.068   23.636  -5.048  1.00 35.88 4   A 1 
ATOM 26  C CA  . ALA A 1 4   ? 3.714   22.728  -6.124  1.00 40.11 4   A 1 
ATOM 27  C C   . ALA A 1 4   ? 2.194   22.803  -6.318  1.00 40.44 4   A 1 
ATOM 28  O O   . ALA A 1 4   ? 1.425   22.295  -5.502  1.00 38.75 4   A 1 
ATOM 29  C CB  . ALA A 1 4   ? 4.210   21.322  -5.778  1.00 39.62 4   A 1 
ATOM 30  N N   . SER A 1 5   ? 1.779   23.486  -7.370  1.00 33.51 5   A 1 
ATOM 31  C CA  . SER A 1 5   ? 0.389   23.597  -7.783  1.00 38.48 5   A 1 
ATOM 32  C C   . SER A 1 5   ? -0.152  22.197  -8.069  1.00 38.79 5   A 1 
ATOM 33  O O   . SER A 1 5   ? 0.120   21.613  -9.117  1.00 36.59 5   A 1 
ATOM 34  C CB  . SER A 1 5   ? 0.286   24.482  -9.026  1.00 37.70 5   A 1 
ATOM 35  O OG  . SER A 1 5   ? 0.750   25.791  -8.742  1.00 31.73 5   A 1 
ATOM 36  N N   . CYS A 1 6   ? -0.903  21.637  -7.121  1.00 34.40 6   A 1 
ATOM 37  C CA  . CYS A 1 6   ? -1.690  20.433  -7.358  1.00 37.78 6   A 1 
ATOM 38  C C   . CYS A 1 6   ? -2.739  20.768  -8.424  1.00 38.10 6   A 1 
ATOM 39  O O   . CYS A 1 6   ? -3.709  21.471  -8.142  1.00 35.89 6   A 1 
ATOM 40  C CB  . CYS A 1 6   ? -2.348  19.970  -6.048  1.00 36.22 6   A 1 
ATOM 41  S SG  . CYS A 1 6   ? -1.139  19.138  -4.987  1.00 32.29 6   A 1 
ATOM 42  N N   . LYS A 1 7   ? -2.535  20.286  -9.645  1.00 38.34 7   A 1 
ATOM 43  C CA  . LYS A 1 7   ? -3.564  20.365  -10.689 1.00 42.51 7   A 1 
ATOM 44  C C   . LYS A 1 7   ? -4.826  19.639  -10.196 1.00 44.59 7   A 1 
ATOM 45  O O   . LYS A 1 7   ? -4.709  18.490  -9.758  1.00 41.77 7   A 1 
ATOM 46  C CB  . LYS A 1 7   ? -3.052  19.749  -12.001 1.00 40.62 7   A 1 
ATOM 47  C CG  . LYS A 1 7   ? -2.005  20.624  -12.704 1.00 35.57 7   A 1 
ATOM 48  C CD  . LYS A 1 7   ? -1.549  19.967  -14.021 1.00 32.66 7   A 1 
ATOM 49  C CE  . LYS A 1 7   ? -0.540  20.850  -14.750 1.00 30.35 7   A 1 
ATOM 50  N NZ  . LYS A 1 7   ? -0.046  20.216  -16.009 1.00 29.23 7   A 1 
ATOM 51  N N   . PRO A 1 8   ? -6.011  20.262  -10.233 1.00 35.89 8   A 1 
ATOM 52  C CA  . PRO A 1 8   ? -7.254  19.588  -9.888  1.00 40.58 8   A 1 
ATOM 53  C C   . PRO A 1 8   ? -7.547  18.510  -10.941 1.00 44.64 8   A 1 
ATOM 54  O O   . PRO A 1 8   ? -7.572  18.801  -12.134 1.00 43.63 8   A 1 
ATOM 55  C CB  . PRO A 1 8   ? -8.308  20.698  -9.834  1.00 38.64 8   A 1 
ATOM 56  C CG  . PRO A 1 8   ? -7.768  21.771  -10.778 1.00 36.60 8   A 1 
ATOM 57  C CD  . PRO A 1 8   ? -6.253  21.624  -10.673 1.00 41.00 8   A 1 
ATOM 58  N N   . GLY A 1 9   ? -7.729  17.253  -10.496 1.00 41.30 9   A 1 
ATOM 59  C CA  . GLY A 1 9   ? -8.083  16.124  -11.367 1.00 44.51 9   A 1 
ATOM 60  C C   . GLY A 1 9   ? -7.166  14.903  -11.307 1.00 47.11 9   A 1 
ATOM 61  O O   . GLY A 1 9   ? -7.544  13.846  -11.813 1.00 44.41 9   A 1 
ATOM 62  N N   . TYR A 1 10  ? -6.000  14.978  -10.651 1.00 40.86 10  A 1 
ATOM 63  C CA  . TYR A 1 10  ? -5.145  13.808  -10.459 1.00 42.48 10  A 1 
ATOM 64  C C   . TYR A 1 10  ? -5.560  13.049  -9.195  1.00 45.35 10  A 1 
ATOM 65  O O   . TYR A 1 10  ? -5.388  13.534  -8.079  1.00 43.41 10  A 1 
ATOM 66  C CB  . TYR A 1 10  ? -3.666  14.210  -10.456 1.00 41.15 10  A 1 
ATOM 67  C CG  . TYR A 1 10  ? -3.171  14.599  -11.836 1.00 37.41 10  A 1 
ATOM 68  C CD1 . TYR A 1 10  ? -2.664  13.620  -12.707 1.00 33.64 10  A 1 
ATOM 69  C CD2 . TYR A 1 10  ? -3.242  15.938  -12.260 1.00 34.08 10  A 1 
ATOM 70  C CE1 . TYR A 1 10  ? -2.232  13.981  -13.997 1.00 32.53 10  A 1 
ATOM 71  C CE2 . TYR A 1 10  ? -2.811  16.299  -13.557 1.00 33.21 10  A 1 
ATOM 72  C CZ  . TYR A 1 10  ? -2.304  15.317  -14.428 1.00 33.21 10  A 1 
ATOM 73  O OH  . TYR A 1 10  ? -1.891  15.661  -15.668 1.00 31.77 10  A 1 
ATOM 74  N N   . HIS A 1 11  ? -6.110  11.839  -9.366  1.00 42.18 11  A 1 
ATOM 75  C CA  . HIS A 1 11  ? -6.331  10.892  -8.275  1.00 45.09 11  A 1 
ATOM 76  C C   . HIS A 1 11  ? -4.977  10.385  -7.775  1.00 47.86 11  A 1 
ATOM 77  O O   . HIS A 1 11  ? -4.475  9.369   -8.247  1.00 45.97 11  A 1 
ATOM 78  C CB  . HIS A 1 11  ? -7.230  9.747   -8.753  1.00 43.22 11  A 1 
ATOM 79  C CG  . HIS A 1 11  ? -8.641  10.168  -9.053  1.00 39.16 11  A 1 
ATOM 80  N ND1 . HIS A 1 11  ? -9.583  10.568  -8.139  1.00 35.90 11  A 1 
ATOM 81  C CD2 . HIS A 1 11  ? -9.232  10.221  -10.287 1.00 34.72 11  A 1 
ATOM 82  C CE1 . HIS A 1 11  ? -10.709 10.857  -8.805  1.00 34.08 11  A 1 
ATOM 83  N NE2 . HIS A 1 11  ? -10.544 10.656  -10.118 1.00 33.38 11  A 1 
ATOM 84  N N   . ARG A 1 12  ? -4.375  11.108  -6.828  1.00 51.79 12  A 1 
ATOM 85  C CA  . ARG A 1 12  ? -3.140  10.676  -6.168  1.00 55.29 12  A 1 
ATOM 86  C C   . ARG A 1 12  ? -3.403  9.376   -5.419  1.00 58.44 12  A 1 
ATOM 87  O O   . ARG A 1 12  ? -4.352  9.294   -4.634  1.00 55.50 12  A 1 
ATOM 88  C CB  . ARG A 1 12  ? -2.608  11.767  -5.234  1.00 52.89 12  A 1 
ATOM 89  C CG  . ARG A 1 12  ? -1.809  12.819  -6.007  1.00 46.62 12  A 1 
ATOM 90  C CD  . ARG A 1 12  ? -1.254  13.879  -5.060  1.00 44.33 12  A 1 
ATOM 91  N NE  . ARG A 1 12  ? -0.002  14.460  -5.578  1.00 41.80 12  A 1 
ATOM 92  C CZ  . ARG A 1 12  ? 0.854   15.198  -4.895  1.00 37.59 12  A 1 
ATOM 93  N NH1 . ARG A 1 12  ? 0.609   15.609  -3.683  1.00 35.62 12  A 1 
ATOM 94  N NH2 . ARG A 1 12  ? 1.998   15.530  -5.416  1.00 34.18 12  A 1 
ATOM 95  N N   . SER A 1 13  ? -2.574  8.365   -5.663  1.00 63.89 13  A 1 
ATOM 96  C CA  . SER A 1 13  ? -2.574  7.153   -4.851  1.00 67.09 13  A 1 
ATOM 97  C C   . SER A 1 13  ? -2.002  7.482   -3.473  1.00 70.25 13  A 1 
ATOM 98  O O   . SER A 1 13  ? -1.134  8.347   -3.345  1.00 67.38 13  A 1 
ATOM 99  C CB  . SER A 1 13  ? -1.777  6.040   -5.535  1.00 62.33 13  A 1 
ATOM 100 O OG  . SER A 1 13  ? -2.291  5.780   -6.825  1.00 54.89 13  A 1 
ATOM 101 N N   . MET A 1 14  ? -2.474  6.799   -2.423  1.00 73.48 14  A 1 
ATOM 102 C CA  . MET A 1 14  ? -2.055  7.016   -1.035  1.00 77.66 14  A 1 
ATOM 103 C C   . MET A 1 14  ? -1.374  5.768   -0.477  1.00 81.59 14  A 1 
ATOM 104 O O   . MET A 1 14  ? -1.759  4.643   -0.800  1.00 80.12 14  A 1 
ATOM 105 C CB  . MET A 1 14  ? -3.259  7.404   -0.162  1.00 71.87 14  A 1 
ATOM 106 C CG  . MET A 1 14  ? -4.062  8.599   -0.693  1.00 62.63 14  A 1 
ATOM 107 S SD  . MET A 1 14  ? -3.160  10.138  -0.954  1.00 59.07 14  A 1 
ATOM 108 C CE  . MET A 1 14  ? -2.671  10.510  0.743   1.00 50.81 14  A 1 
ATOM 109 N N   . CYS A 1 15  ? -0.396  5.950   0.413   1.00 79.15 15  A 1 
ATOM 110 C CA  . CYS A 1 15  ? 0.191   4.848   1.164   1.00 82.88 15  A 1 
ATOM 111 C C   . CYS A 1 15  ? -0.804  4.347   2.218   1.00 83.18 15  A 1 
ATOM 112 O O   . CYS A 1 15  ? -1.220  5.111   3.085   1.00 82.01 15  A 1 
ATOM 113 C CB  . CYS A 1 15  ? 1.500   5.331   1.796   1.00 83.31 15  A 1 
ATOM 114 S SG  . CYS A 1 15  ? 2.252   3.992   2.772   1.00 82.98 15  A 1 
ATOM 115 N N   . TRP A 1 16  ? -1.110  3.036   2.207   1.00 86.13 16  A 1 
ATOM 116 C CA  . TRP A 1 16  ? -1.996  2.413   3.199   1.00 86.18 16  A 1 
ATOM 117 C C   . TRP A 1 16  ? -1.515  2.616   4.639   1.00 85.70 16  A 1 
ATOM 118 O O   . TRP A 1 16  ? -2.329  2.699   5.554   1.00 83.78 16  A 1 
ATOM 119 C CB  . TRP A 1 16  ? -2.099  0.918   2.888   1.00 86.01 16  A 1 
ATOM 120 C CG  . TRP A 1 16  ? -0.848  0.114   3.121   1.00 85.65 16  A 1 
ATOM 121 C CD1 . TRP A 1 16  ? 0.107   -0.156  2.206   1.00 84.48 16  A 1 
ATOM 122 C CD2 . TRP A 1 16  ? -0.395  -0.517  4.359   1.00 86.43 16  A 1 
ATOM 123 N NE1 . TRP A 1 16  ? 1.123   -0.898  2.783   1.00 83.14 16  A 1 
ATOM 124 C CE2 . TRP A 1 16  ? 0.863   -1.143  4.114   1.00 84.77 16  A 1 
ATOM 125 C CE3 . TRP A 1 16  ? -0.920  -0.612  5.665   1.00 83.39 16  A 1 
ATOM 126 C CZ2 . TRP A 1 16  ? 1.568   -1.828  5.120   1.00 82.85 16  A 1 
ATOM 127 C CZ3 . TRP A 1 16  ? -0.223  -1.294  6.679   1.00 82.35 16  A 1 
ATOM 128 C CH2 . TRP A 1 16  ? 1.016   -1.894  6.408   1.00 81.71 16  A 1 
ATOM 129 N N   . TYR A 1 17  ? -0.196  2.729   4.858   1.00 84.13 17  A 1 
ATOM 130 C CA  . TYR A 1 17  ? 0.402   2.772   6.185   1.00 84.81 17  A 1 
ATOM 131 C C   . TYR A 1 17  ? 0.502   4.187   6.761   1.00 84.05 17  A 1 
ATOM 132 O O   . TYR A 1 17  ? 0.045   4.433   7.878   1.00 82.08 17  A 1 
ATOM 133 C CB  . TYR A 1 17  ? 1.775   2.096   6.121   1.00 85.49 17  A 1 
ATOM 134 C CG  . TYR A 1 17  ? 2.458   1.980   7.463   1.00 84.35 17  A 1 
ATOM 135 C CD1 . TYR A 1 17  ? 3.577   2.779   7.764   1.00 81.19 17  A 1 
ATOM 136 C CD2 . TYR A 1 17  ? 1.978   1.056   8.412   1.00 81.41 17  A 1 
ATOM 137 C CE1 . TYR A 1 17  ? 4.229   2.637   9.002   1.00 79.88 17  A 1 
ATOM 138 C CE2 . TYR A 1 17  ? 2.628   0.917   9.649   1.00 80.18 17  A 1 
ATOM 139 C CZ  . TYR A 1 17  ? 3.758   1.702   9.944   1.00 82.04 17  A 1 
ATOM 140 O OH  . TYR A 1 17  ? 4.399   1.554   11.133  1.00 80.19 17  A 1 
ATOM 141 N N   . CYS A 1 18  ? 1.094   5.130   6.040   1.00 85.38 18  A 1 
ATOM 142 C CA  . CYS A 1 18  ? 1.275   6.496   6.544   1.00 84.57 18  A 1 
ATOM 143 C C   . CYS A 1 18  ? 0.231   7.498   6.034   1.00 83.10 18  A 1 
ATOM 144 O O   . CYS A 1 18  ? 0.147   8.587   6.589   1.00 79.54 18  A 1 
ATOM 145 C CB  . CYS A 1 18  ? 2.716   6.967   6.286   1.00 83.77 18  A 1 
ATOM 146 S SG  . CYS A 1 18  ? 3.059   7.120   4.505   1.00 82.35 18  A 1 
ATOM 147 N N   . GLY A 1 19  ? -0.557  7.146   5.022   1.00 84.72 19  A 1 
ATOM 148 C CA  . GLY A 1 19  ? -1.540  8.039   4.410   1.00 82.08 19  A 1 
ATOM 149 C C   . GLY A 1 19  ? -0.930  9.120   3.521   1.00 80.59 19  A 1 
ATOM 150 O O   . GLY A 1 19  ? -1.637  10.055  3.155   1.00 77.07 19  A 1 
ATOM 151 N N   . GLU A 1 20  ? 0.361   9.004   3.184   1.00 80.14 20  A 1 
ATOM 152 C CA  . GLU A 1 20  ? 1.067   9.960   2.331   1.00 78.91 20  A 1 
ATOM 153 C C   . GLU A 1 20  ? 0.656   9.825   0.865   1.00 78.75 20  A 1 
ATOM 154 O O   . GLU A 1 20  ? 0.500   8.714   0.348   1.00 76.45 20  A 1 
ATOM 155 C CB  . GLU A 1 20  ? 2.583   9.775   2.494   1.00 76.92 20  A 1 
ATOM 156 C CG  . GLU A 1 20  ? 3.412   10.846  1.758   1.00 68.63 20  A 1 
ATOM 157 C CD  . GLU A 1 20  ? 3.063   12.281  2.168   1.00 66.21 20  A 1 
ATOM 158 O OE1 . GLU A 1 20  ? 3.170   13.171  1.301   1.00 59.92 20  A 1 
ATOM 159 O OE2 . GLU A 1 20  ? 2.669   12.475  3.340   1.00 57.43 20  A 1 
ATOM 160 N N   . ALA A 1 21  ? 0.498   10.962  0.194   1.00 77.49 21  A 1 
ATOM 161 C CA  . ALA A 1 21  ? 0.156   11.022  -1.218  1.00 74.52 21  A 1 
ATOM 162 C C   . ALA A 1 21  ? 1.321   10.536  -2.091  1.00 74.08 21  A 1 
ATOM 163 O O   . ALA A 1 21  ? 2.437   11.044  -2.008  1.00 71.45 21  A 1 
ATOM 164 C CB  . ALA A 1 21  ? -0.265  12.451  -1.583  1.00 71.34 21  A 1 
ATOM 165 N N   . ILE A 1 22  ? 1.035   9.591   -2.975  1.00 70.54 22  A 1 
ATOM 166 C CA  . ILE A 1 22  ? 1.980   9.111   -3.976  1.00 68.56 22  A 1 
ATOM 167 C C   . ILE A 1 22  ? 1.850   10.022  -5.203  1.00 67.47 22  A 1 
ATOM 168 O O   . ILE A 1 22  ? 0.745   10.294  -5.675  1.00 64.01 22  A 1 
ATOM 169 C CB  . ILE A 1 22  ? 1.723   7.622   -4.282  1.00 67.12 22  A 1 
ATOM 170 C CG1 . ILE A 1 22  ? 1.798   6.762   -2.997  1.00 63.55 22  A 1 
ATOM 171 C CG2 . ILE A 1 22  ? 2.726   7.111   -5.325  1.00 62.47 22  A 1 
ATOM 172 C CD1 . ILE A 1 22  ? 1.041   5.438   -3.134  1.00 59.97 22  A 1 
ATOM 173 N N   . SER A 1 23  ? 2.989   10.516  -5.684  1.00 67.21 23  A 1 
ATOM 174 C CA  . SER A 1 23  ? 3.049   11.416  -6.841  1.00 64.72 23  A 1 
ATOM 175 C C   . SER A 1 23  ? 2.638   10.743  -8.149  1.00 64.65 23  A 1 
ATOM 176 O O   . SER A 1 23  ? 2.096   11.422  -9.024  1.00 59.43 23  A 1 
ATOM 177 C CB  . SER A 1 23  ? 4.460   11.983  -6.987  1.00 60.01 23  A 1 
ATOM 178 O OG  . SER A 1 23  ? 5.425   10.974  -6.799  1.00 53.14 23  A 1 
ATOM 179 N N   . ASP A 1 24  ? 2.863   9.430   -8.253  1.00 62.80 24  A 1 
ATOM 180 C CA  . ASP A 1 24  ? 2.518   8.664   -9.445  1.00 62.26 24  A 1 
ATOM 181 C C   . ASP A 1 24  ? 1.005   8.454   -9.548  1.00 63.51 24  A 1 
ATOM 182 O O   . ASP A 1 24  ? 0.338   7.988   -8.622  1.00 60.25 24  A 1 
ATOM 183 C CB  . ASP A 1 24  ? 3.290   7.343   -9.475  1.00 57.75 24  A 1 
ATOM 184 C CG  . ASP A 1 24  ? 4.794   7.593   -9.577  1.00 52.13 24  A 1 
ATOM 185 O OD1 . ASP A 1 24  ? 5.188   8.368   -10.475 1.00 48.38 24  A 1 
ATOM 186 O OD2 . ASP A 1 24  ? 5.523   7.064   -8.713  1.00 47.63 24  A 1 
ATOM 187 N N   . THR A 1 25  ? 0.463   8.806   -10.697 1.00 58.22 25  A 1 
ATOM 188 C CA  . THR A 1 25  ? -0.974  8.724   -10.998 1.00 57.85 25  A 1 
ATOM 189 C C   . THR A 1 25  ? -1.418  7.336   -11.446 1.00 61.57 25  A 1 
ATOM 190 O O   . THR A 1 25  ? -2.618  7.059   -11.500 1.00 57.13 25  A 1 
ATOM 191 C CB  . THR A 1 25  ? -1.333  9.753   -12.069 1.00 50.65 25  A 1 
ATOM 192 O OG1 . THR A 1 25  ? -0.501  9.616   -13.197 1.00 43.76 25  A 1 
ATOM 193 C CG2 . THR A 1 25  ? -1.143  11.174  -11.545 1.00 41.58 25  A 1 
ATOM 194 N N   . GLU A 1 26  ? -0.455  6.474   -11.767 1.00 62.84 26  A 1 
ATOM 195 C CA  . GLU A 1 26  ? -0.690  5.125   -12.256 1.00 63.71 26  A 1 
ATOM 196 C C   . GLU A 1 26  ? -0.738  4.102   -11.121 1.00 67.78 26  A 1 
ATOM 197 O O   . GLU A 1 26  ? -0.406  4.368   -9.963  1.00 64.67 26  A 1 
ATOM 198 C CB  . GLU A 1 26  ? 0.358   4.758   -13.315 1.00 57.57 26  A 1 
ATOM 199 C CG  . GLU A 1 26  ? 0.258   5.681   -14.541 1.00 48.55 26  A 1 
ATOM 200 C CD  . GLU A 1 26  ? 1.093   5.204   -15.732 1.00 43.64 26  A 1 
ATOM 201 O OE1 . GLU A 1 26  ? 0.872   5.769   -16.825 1.00 40.31 26  A 1 
ATOM 202 O OE2 . GLU A 1 26  ? 1.906   4.272   -15.557 1.00 37.82 26  A 1 
ATOM 203 N N   . THR A 1 27  ? -1.178  2.893   -11.457 1.00 75.56 27  A 1 
ATOM 204 C CA  . THR A 1 27  ? -1.150  1.756   -10.535 1.00 77.22 27  A 1 
ATOM 205 C C   . THR A 1 27  ? 0.289   1.506   -10.080 1.00 79.63 27  A 1 
ATOM 206 O O   . THR A 1 27  ? 1.158   1.362   -10.936 1.00 77.96 27  A 1 
ATOM 207 C CB  . THR A 1 27  ? -1.707  0.503   -11.213 1.00 73.23 27  A 1 
ATOM 208 O OG1 . THR A 1 27  ? -3.041  0.751   -11.597 1.00 64.55 27  A 1 
ATOM 209 C CG2 . THR A 1 27  ? -1.742  -0.708  -10.291 1.00 62.58 27  A 1 
ATOM 210 N N   . PRO A 1 28  ? 0.548   1.392   -8.754  1.00 80.29 28  A 1 
ATOM 211 C CA  . PRO A 1 28  ? 1.895   1.182   -8.241  1.00 82.25 28  A 1 
ATOM 212 C C   . PRO A 1 28  ? 2.621   0.027   -8.938  1.00 82.53 28  A 1 
ATOM 213 O O   . PRO A 1 28  ? 2.099   -1.090  -9.036  1.00 79.73 28  A 1 
ATOM 214 C CB  . PRO A 1 28  ? 1.732   0.927   -6.741  1.00 80.68 28  A 1 
ATOM 215 C CG  . PRO A 1 28  ? 0.476   1.710   -6.394  1.00 78.91 28  A 1 
ATOM 216 C CD  . PRO A 1 28  ? -0.379  1.579   -7.647  1.00 82.25 28  A 1 
ATOM 217 N N   . GLY A 1 29  ? 3.841   0.288   -9.391  1.00 84.92 29  A 1 
ATOM 218 C CA  . GLY A 1 29  ? 4.722   -0.723  -9.963  1.00 84.91 29  A 1 
ATOM 219 C C   . GLY A 1 29  ? 5.072   -1.822  -8.957  1.00 86.23 29  A 1 
ATOM 220 O O   . GLY A 1 29  ? 4.935   -1.653  -7.743  1.00 84.62 29  A 1 
ATOM 221 N N   . ARG A 1 30  ? 5.556   -2.968  -9.452  1.00 82.79 30  A 1 
ATOM 222 C CA  . ARG A 1 30  ? 5.805   -4.182  -8.644  1.00 83.08 30  A 1 
ATOM 223 C C   . ARG A 1 30  ? 6.752   -3.963  -7.460  1.00 85.15 30  A 1 
ATOM 224 O O   . ARG A 1 30  ? 6.581   -4.615  -6.438  1.00 82.03 30  A 1 
ATOM 225 C CB  . ARG A 1 30  ? 6.311   -5.323  -9.548  1.00 79.11 30  A 1 
ATOM 226 C CG  . ARG A 1 30  ? 5.227   -5.835  -10.519 1.00 69.51 30  A 1 
ATOM 227 C CD  . ARG A 1 30  ? 5.717   -6.983  -11.417 1.00 65.40 30  A 1 
ATOM 228 N NE  . ARG A 1 30  ? 4.673   -7.435  -12.373 1.00 59.68 30  A 1 
ATOM 229 C CZ  . ARG A 1 30  ? 3.997   -8.585  -12.382 1.00 52.66 30  A 1 
ATOM 230 N NH1 . ARG A 1 30  ? 4.184   -9.528  -11.517 1.00 49.15 30  A 1 
ATOM 231 N NH2 . ARG A 1 30  ? 3.085   -8.827  -13.278 1.00 46.23 30  A 1 
ATOM 232 N N   . SER A 1 31  ? 7.697   -3.031  -7.576  1.00 85.62 31  A 1 
ATOM 233 C CA  . SER A 1 31  ? 8.700   -2.722  -6.543  1.00 86.09 31  A 1 
ATOM 234 C C   . SER A 1 31  ? 8.563   -1.311  -5.968  1.00 86.96 31  A 1 
ATOM 235 O O   . SER A 1 31  ? 9.483   -0.818  -5.314  1.00 85.17 31  A 1 
ATOM 236 C CB  . SER A 1 31  ? 10.108  -2.941  -7.107  1.00 83.91 31  A 1 
ATOM 237 O OG  . SER A 1 31  ? 10.209  -4.224  -7.697  1.00 76.17 31  A 1 
ATOM 238 N N   . MET A 1 32  ? 7.436   -0.641  -6.220  1.00 86.89 32  A 1 
ATOM 239 C CA  . MET A 1 32  ? 7.245   0.736   -5.776  1.00 87.80 32  A 1 
ATOM 240 C C   . MET A 1 32  ? 7.031   0.800   -4.263  1.00 89.57 32  A 1 
ATOM 241 O O   . MET A 1 32  ? 6.196   0.092   -3.697  1.00 89.02 32  A 1 
ATOM 242 C CB  . MET A 1 32  ? 6.095   1.379   -6.558  1.00 86.02 32  A 1 
ATOM 243 C CG  . MET A 1 32  ? 6.017   2.885   -6.305  1.00 77.97 32  A 1 
ATOM 244 S SD  . MET A 1 32  ? 4.686   3.690   -7.223  1.00 74.16 32  A 1 
ATOM 245 C CE  . MET A 1 32  ? 5.452   3.816   -8.856  1.00 63.65 32  A 1 
ATOM 246 N N   . ARG A 1 33  ? 7.791   1.684   -3.607  1.00 87.13 33  A 1 
ATOM 247 C CA  . ARG A 1 33  ? 7.732   1.933   -2.165  1.00 87.99 33  A 1 
ATOM 248 C C   . ARG A 1 33  ? 7.325   3.367   -1.876  1.00 88.27 33  A 1 
ATOM 249 O O   . ARG A 1 33  ? 7.600   4.275   -2.658  1.00 86.76 33  A 1 
ATOM 250 C CB  . ARG A 1 33  ? 9.077   1.603   -1.509  1.00 87.78 33  A 1 
ATOM 251 C CG  . ARG A 1 33  ? 9.385   0.106   -1.600  1.00 85.60 33  A 1 
ATOM 252 C CD  . ARG A 1 33  ? 10.666  -0.220  -0.845  1.00 82.68 33  A 1 
ATOM 253 N NE  . ARG A 1 33  ? 10.929  -1.666  -0.894  1.00 76.36 33  A 1 
ATOM 254 C CZ  . ARG A 1 33  ? 12.016  -2.279  -0.474  1.00 71.03 33  A 1 
ATOM 255 N NH1 . ARG A 1 33  ? 13.019  -1.634  0.063   1.00 66.05 33  A 1 
ATOM 256 N NH2 . ARG A 1 33  ? 12.108  -3.571  -0.595  1.00 62.84 33  A 1 
ATOM 257 N N   . CYS A 1 34  ? 6.696   3.570   -0.722  1.00 88.27 34  A 1 
ATOM 258 C CA  . CYS A 1 34  ? 6.390   4.898   -0.219  1.00 88.04 34  A 1 
ATOM 259 C C   . CYS A 1 34  ? 7.689   5.663   0.056   1.00 87.72 34  A 1 
ATOM 260 O O   . CYS A 1 34  ? 8.520   5.195   0.832   1.00 86.19 34  A 1 
ATOM 261 C CB  . CYS A 1 34  ? 5.544   4.751   1.046   1.00 87.32 34  A 1 
ATOM 262 S SG  . CYS A 1 34  ? 5.123   6.396   1.696   1.00 85.37 34  A 1 
ATOM 263 N N   . GLY A 1 35  ? 7.829   6.861   -0.501  1.00 88.24 35  A 1 
ATOM 264 C CA  . GLY A 1 35  ? 9.006   7.707   -0.285  1.00 86.81 35  A 1 
ATOM 265 C C   . GLY A 1 35  ? 9.190   8.190   1.158   1.00 86.85 35  A 1 
ATOM 266 O O   . GLY A 1 35  ? 10.293  8.567   1.533   1.00 84.02 35  A 1 
ATOM 267 N N   . ILE A 1 36  ? 8.135   8.148   1.982   1.00 86.64 36  A 1 
ATOM 268 C CA  . ILE A 1 36  ? 8.166   8.619   3.371   1.00 86.95 36  A 1 
ATOM 269 C C   . ILE A 1 36  ? 8.439   7.479   4.354   1.00 87.85 36  A 1 
ATOM 270 O O   . ILE A 1 36  ? 9.292   7.606   5.228   1.00 86.20 36  A 1 
ATOM 271 C CB  . ILE A 1 36  ? 6.853   9.355   3.709   1.00 85.17 36  A 1 
ATOM 272 C CG1 . ILE A 1 36  ? 6.567   10.537  2.748   1.00 80.46 36  A 1 
ATOM 273 C CG2 . ILE A 1 36  ? 6.829   9.832   5.172   1.00 78.09 36  A 1 
ATOM 274 C CD1 . ILE A 1 36  ? 7.648   11.626  2.699   1.00 70.51 36  A 1 
ATOM 275 N N   . CYS A 1 37  ? 7.699   6.368   4.264   1.00 87.88 37  A 1 
ATOM 276 C CA  . CYS A 1 37  ? 7.772   5.286   5.253   1.00 88.73 37  A 1 
ATOM 277 C C   . CYS A 1 37  ? 8.422   3.993   4.736   1.00 89.64 37  A 1 
ATOM 278 O O   . CYS A 1 37  ? 8.555   3.040   5.500   1.00 88.24 37  A 1 
ATOM 279 C CB  . CYS A 1 37  ? 6.378   5.044   5.841   1.00 87.61 37  A 1 
ATOM 280 S SG  . CYS A 1 37  ? 5.274   4.269   4.614   1.00 86.18 37  A 1 
ATOM 281 N N   . GLY A 1 38  ? 8.777   3.914   3.457   1.00 90.77 38  A 1 
ATOM 282 C CA  . GLY A 1 38  ? 9.444   2.762   2.850   1.00 91.56 38  A 1 
ATOM 283 C C   . GLY A 1 38  ? 8.580   1.505   2.671   1.00 92.37 38  A 1 
ATOM 284 O O   . GLY A 1 38  ? 9.094   0.489   2.199   1.00 90.90 38  A 1 
ATOM 285 N N   . LYS A 1 39  ? 7.288   1.535   3.035   1.00 90.39 39  A 1 
ATOM 286 C CA  . LYS A 1 39  ? 6.374   0.394   2.853   1.00 90.87 39  A 1 
ATOM 287 C C   . LYS A 1 39  ? 6.059   0.173   1.375   1.00 91.50 39  A 1 
ATOM 288 O O   . LYS A 1 39  ? 5.947   1.133   0.613   1.00 90.59 39  A 1 
ATOM 289 C CB  . LYS A 1 39  ? 5.086   0.594   3.670   1.00 90.32 39  A 1 
ATOM 290 C CG  . LYS A 1 39  ? 5.292   0.500   5.191   1.00 88.56 39  A 1 
ATOM 291 C CD  . LYS A 1 39  ? 5.574   -0.933  5.662   1.00 85.73 39  A 1 
ATOM 292 C CE  . LYS A 1 39  ? 5.588   -1.034  7.190   1.00 82.46 39  A 1 
ATOM 293 N NZ  . LYS A 1 39  ? 5.505   -2.444  7.656   1.00 74.09 39  A 1 
ATOM 294 N N   . ASP A 1 40  ? 5.884   -1.086  1.001   1.00 90.78 40  A 1 
ATOM 295 C CA  . ASP A 1 40  ? 5.548   -1.470  -0.365  1.00 90.96 40  A 1 
ATOM 296 C C   . ASP A 1 40  ? 4.121   -1.018  -0.714  1.00 90.71 40  A 1 
ATOM 297 O O   . ASP A 1 40  ? 3.171   -1.230  0.044   1.00 89.26 40  A 1 
ATOM 298 C CB  . ASP A 1 40  ? 5.725   -2.987  -0.548  1.00 90.16 40  A 1 
ATOM 299 C CG  . ASP A 1 40  ? 7.162   -3.499  -0.337  1.00 88.77 40  A 1 
ATOM 300 O OD1 . ASP A 1 40  ? 8.133   -2.743  -0.562  1.00 84.92 40  A 1 
ATOM 301 O OD2 . ASP A 1 40  ? 7.321   -4.672  0.065   1.00 84.71 40  A 1 
ATOM 302 N N   . LEU A 1 41  ? 3.970   -0.388  -1.879  1.00 90.52 41  A 1 
ATOM 303 C CA  . LEU A 1 41  ? 2.692   0.170   -2.325  1.00 89.92 41  A 1 
ATOM 304 C C   . LEU A 1 41  ? 1.867   -0.845  -3.115  1.00 89.70 41  A 1 
ATOM 305 O O   . LEU A 1 41  ? 0.643   -0.838  -3.026  1.00 88.02 41  A 1 
ATOM 306 C CB  . LEU A 1 41  ? 2.951   1.443   -3.133  1.00 88.77 41  A 1 
ATOM 307 C CG  . LEU A 1 41  ? 3.608   2.569   -2.317  1.00 86.26 41  A 1 
ATOM 308 C CD1 . LEU A 1 41  ? 3.939   3.734   -3.242  1.00 83.89 41  A 1 
ATOM 309 C CD2 . LEU A 1 41  ? 2.721   3.055   -1.168  1.00 83.23 41  A 1 
ATOM 310 N N   . ARG A 1 42  ? 2.506   -1.766  -3.833  1.00 89.99 42  A 1 
ATOM 311 C CA  . ARG A 1 42  ? 1.831   -2.881  -4.509  1.00 90.51 42  A 1 
ATOM 312 C C   . ARG A 1 42  ? 1.677   -4.086  -3.572  1.00 91.02 42  A 1 
ATOM 313 O O   . ARG A 1 42  ? 2.140   -5.181  -3.864  1.00 89.14 42  A 1 
ATOM 314 C CB  . ARG A 1 42  ? 2.542   -3.197  -5.830  1.00 89.35 42  A 1 
ATOM 315 C CG  . ARG A 1 42  ? 1.665   -4.096  -6.712  1.00 84.81 42  A 1 
ATOM 316 C CD  . ARG A 1 42  ? 2.382   -4.410  -8.018  1.00 83.60 42  A 1 
ATOM 317 N NE  . ARG A 1 42  ? 1.574   -5.316  -8.858  1.00 80.31 42  A 1 
ATOM 318 C CZ  . ARG A 1 42  ? 1.327   -5.191  -10.148 1.00 77.94 42  A 1 
ATOM 319 N NH1 . ARG A 1 42  ? 1.770   -4.189  -10.852 1.00 69.18 42  A 1 
ATOM 320 N NH2 . ARG A 1 42  ? 0.615   -6.092  -10.769 1.00 70.10 42  A 1 
ATOM 321 N N   . SER A 1 43  ? 1.042   -3.876  -2.429  1.00 91.71 43  A 1 
ATOM 322 C CA  . SER A 1 43  ? 0.757   -4.892  -1.412  1.00 92.01 43  A 1 
ATOM 323 C C   . SER A 1 43  ? -0.739  -5.204  -1.338  1.00 92.10 43  A 1 
ATOM 324 O O   . SER A 1 43  ? -1.569  -4.406  -1.783  1.00 91.07 43  A 1 
ATOM 325 C CB  . SER A 1 43  ? 1.283   -4.420  -0.055  1.00 91.29 43  A 1 
ATOM 326 O OG  . SER A 1 43  ? 0.574   -3.282  0.395   1.00 84.76 43  A 1 
ATOM 327 N N   . CYS A 1 44  ? -1.098  -6.347  -0.721  1.00 92.19 44  A 1 
ATOM 328 C CA  . CYS A 1 44  ? -2.508  -6.681  -0.494  1.00 92.65 44  A 1 
ATOM 329 C C   . CYS A 1 44  ? -3.242  -5.574  0.275   1.00 91.92 44  A 1 
ATOM 330 O O   . CYS A 1 44  ? -4.387  -5.280  -0.044  1.00 90.71 44  A 1 
ATOM 331 C CB  . CYS A 1 44  ? -2.617  -8.019  0.254   1.00 92.74 44  A 1 
ATOM 332 S SG  . CYS A 1 44  ? -2.023  -9.385  -0.783  1.00 90.68 44  A 1 
ATOM 333 N N   . ARG A 1 45  ? -2.580  -4.895  1.221   1.00 92.81 45  A 1 
ATOM 334 C CA  . ARG A 1 45  ? -3.175  -3.794  2.011   1.00 91.53 45  A 1 
ATOM 335 C C   . ARG A 1 45  ? -3.701  -2.634  1.156   1.00 90.79 45  A 1 
ATOM 336 O O   . ARG A 1 45  ? -4.668  -1.990  1.556   1.00 87.96 45  A 1 
ATOM 337 C CB  . ARG A 1 45  ? -2.141  -3.267  3.011   1.00 90.57 45  A 1 
ATOM 338 C CG  . ARG A 1 45  ? -1.757  -4.254  4.116   1.00 86.12 45  A 1 
ATOM 339 C CD  . ARG A 1 45  ? -2.884  -4.448  5.130   1.00 81.85 45  A 1 
ATOM 340 N NE  . ARG A 1 45  ? -2.394  -5.144  6.328   1.00 78.03 45  A 1 
ATOM 341 C CZ  . ARG A 1 45  ? -3.051  -5.326  7.456   1.00 73.06 45  A 1 
ATOM 342 N NH1 . ARG A 1 45  ? -4.292  -4.950  7.612   1.00 65.60 45  A 1 
ATOM 343 N NH2 . ARG A 1 45  ? -2.460  -5.895  8.467   1.00 66.47 45  A 1 
ATOM 344 N N   . ASN A 1 46  ? -3.111  -2.390  -0.008  1.00 90.21 46  A 1 
ATOM 345 C CA  . ASN A 1 46  ? -3.581  -1.379  -0.963  1.00 89.15 46  A 1 
ATOM 346 C C   . ASN A 1 46  ? -4.558  -1.938  -2.014  1.00 88.92 46  A 1 
ATOM 347 O O   . ASN A 1 46  ? -5.085  -1.173  -2.820  1.00 87.08 46  A 1 
ATOM 348 C CB  . ASN A 1 46  ? -2.365  -0.721  -1.631  1.00 87.43 46  A 1 
ATOM 349 C CG  . ASN A 1 46  ? -1.704  0.359   -0.798  1.00 82.79 46  A 1 
ATOM 350 O OD1 . ASN A 1 46  ? -2.286  1.028   0.033   1.00 75.06 46  A 1 
ATOM 351 N ND2 . ASN A 1 46  ? -0.441  0.609   -1.036  1.00 74.73 46  A 1 
ATOM 352 N N   . CYS A 1 47  ? -4.794  -3.248  -2.046  1.00 89.61 47  A 1 
ATOM 353 C CA  . CYS A 1 47  ? -5.608  -3.892  -3.070  1.00 90.65 47  A 1 
ATOM 354 C C   . CYS A 1 47  ? -7.106  -3.796  -2.745  1.00 90.24 47  A 1 
ATOM 355 O O   . CYS A 1 47  ? -7.521  -3.990  -1.606  1.00 89.43 47  A 1 
ATOM 356 C CB  . CYS A 1 47  ? -5.138  -5.344  -3.225  1.00 91.42 47  A 1 
ATOM 357 S SG  . CYS A 1 47  ? -5.977  -6.120  -4.634  1.00 90.20 47  A 1 
ATOM 358 N N   . ARG A 1 48  ? -7.940  -3.567  -3.767  1.00 91.22 48  A 1 
ATOM 359 C CA  . ARG A 1 48  ? -9.405  -3.535  -3.612  1.00 90.91 48  A 1 
ATOM 360 C C   . ARG A 1 48  ? -10.017 -4.871  -3.204  1.00 90.95 48  A 1 
ATOM 361 O O   . ARG A 1 48  ? -11.102 -4.868  -2.639  1.00 89.11 48  A 1 
ATOM 362 C CB  . ARG A 1 48  ? -10.064 -3.032  -4.904  1.00 89.32 48  A 1 
ATOM 363 C CG  . ARG A 1 48  ? -9.987  -4.056  -6.050  1.00 84.57 48  A 1 
ATOM 364 C CD  . ARG A 1 48  ? -10.643 -3.541  -7.331  1.00 83.10 48  A 1 
ATOM 365 N NE  . ARG A 1 48  ? -12.106 -3.435  -7.187  1.00 74.70 48  A 1 
ATOM 366 C CZ  . ARG A 1 48  ? -12.939 -3.031  -8.130  1.00 68.78 48  A 1 
ATOM 367 N NH1 . ARG A 1 48  ? -12.519 -2.642  -9.304  1.00 63.43 48  A 1 
ATOM 368 N NH2 . ARG A 1 48  ? -14.226 -3.012  -7.907  1.00 59.50 48  A 1 
ATOM 369 N N   . PHE A 1 49  ? -9.347  -5.978  -3.513  1.00 92.82 49  A 1 
ATOM 370 C CA  . PHE A 1 49  ? -9.799  -7.332  -3.188  1.00 92.77 49  A 1 
ATOM 371 C C   . PHE A 1 49  ? -9.377  -7.786  -1.790  1.00 93.02 49  A 1 
ATOM 372 O O   . PHE A 1 49  ? -9.755  -8.872  -1.366  1.00 91.52 49  A 1 
ATOM 373 C CB  . PHE A 1 49  ? -9.282  -8.300  -4.260  1.00 92.46 49  A 1 
ATOM 374 C CG  . PHE A 1 49  ? -9.728  -7.963  -5.670  1.00 91.92 49  A 1 
ATOM 375 C CD1 . PHE A 1 49  ? -11.094 -8.010  -6.008  1.00 88.22 49  A 1 
ATOM 376 C CD2 . PHE A 1 49  ? -8.778  -7.631  -6.653  1.00 88.41 49  A 1 
ATOM 377 C CE1 . PHE A 1 49  ? -11.504 -7.738  -7.321  1.00 86.96 49  A 1 
ATOM 378 C CE2 . PHE A 1 49  ? -9.194  -7.361  -7.967  1.00 87.10 49  A 1 
ATOM 379 C CZ  . PHE A 1 49  ? -10.556 -7.419  -8.304  1.00 87.76 49  A 1 
ATOM 380 N N   . PHE A 1 50  ? -8.608  -6.980  -1.052  1.00 91.89 50  A 1 
ATOM 381 C CA  . PHE A 1 50  ? -8.193  -7.312  0.303   1.00 91.64 50  A 1 
ATOM 382 C C   . PHE A 1 50  ? -9.378  -7.252  1.271   1.00 90.95 50  A 1 
ATOM 383 O O   . PHE A 1 50  ? -10.015 -6.203  1.426   1.00 88.92 50  A 1 
ATOM 384 C CB  . PHE A 1 50  ? -7.056  -6.386  0.744   1.00 91.19 50  A 1 
ATOM 385 C CG  . PHE A 1 50  ? -6.520  -6.710  2.123   1.00 90.84 50  A 1 
ATOM 386 C CD1 . PHE A 1 50  ? -6.639  -5.775  3.171   1.00 87.31 50  A 1 
ATOM 387 C CD2 . PHE A 1 50  ? -5.924  -7.959  2.369   1.00 87.22 50  A 1 
ATOM 388 C CE1 . PHE A 1 50  ? -6.152  -6.090  4.446   1.00 86.13 50  A 1 
ATOM 389 C CE2 . PHE A 1 50  ? -5.445  -8.274  3.649   1.00 86.26 50  A 1 
ATOM 390 C CZ  . PHE A 1 50  ? -5.555  -7.337  4.688   1.00 86.80 50  A 1 
ATOM 391 N N   . LEU A 1 51  ? -9.650  -8.376  1.934   1.00 91.01 51  A 1 
ATOM 392 C CA  . LEU A 1 51  ? -10.695 -8.540  2.941   1.00 89.77 51  A 1 
ATOM 393 C C   . LEU A 1 51  ? -10.071 -9.088  4.229   1.00 89.32 51  A 1 
ATOM 394 O O   . LEU A 1 51  ? -9.933  -10.306 4.369   1.00 86.39 51  A 1 
ATOM 395 C CB  . LEU A 1 51  ? -11.795 -9.478  2.414   1.00 87.66 51  A 1 
ATOM 396 C CG  . LEU A 1 51  ? -12.683 -8.902  1.299   1.00 79.73 51  A 1 
ATOM 397 C CD1 . LEU A 1 51  ? -13.752 -9.943  0.959   1.00 76.56 51  A 1 
ATOM 398 C CD2 . LEU A 1 51  ? -13.402 -7.614  1.699   1.00 76.16 51  A 1 
ATOM 399 N N   . PRO A 1 52  ? -9.689  -8.223  5.183   1.00 88.47 52  A 1 
ATOM 400 C CA  . PRO A 1 52  ? -9.061  -8.660  6.423   1.00 87.20 52  A 1 
ATOM 401 C C   . PRO A 1 52  ? -9.975  -9.611  7.204   1.00 87.39 52  A 1 
ATOM 402 O O   . PRO A 1 52  ? -11.161 -9.330  7.389   1.00 82.04 52  A 1 
ATOM 403 C CB  . PRO A 1 52  ? -8.759  -7.377  7.205   1.00 84.52 52  A 1 
ATOM 404 C CG  . PRO A 1 52  ? -9.781  -6.376  6.671   1.00 81.75 52  A 1 
ATOM 405 C CD  . PRO A 1 52  ? -9.932  -6.793  5.208   1.00 85.87 52  A 1 
ATOM 406 N N   . GLY A 1 53  ? -9.421  -10.725 7.666   1.00 88.14 53  A 1 
ATOM 407 C CA  . GLY A 1 53  ? -10.135 -11.765 8.413   1.00 87.42 53  A 1 
ATOM 408 C C   . GLY A 1 53  ? -10.894 -12.779 7.554   1.00 87.53 53  A 1 
ATOM 409 O O   . GLY A 1 53  ? -11.472 -13.720 8.103   1.00 84.15 53  A 1 
ATOM 410 N N   . SER A 1 54  ? -10.899 -12.639 6.234   1.00 87.21 54  A 1 
ATOM 411 C CA  . SER A 1 54  ? -11.399 -13.679 5.334   1.00 85.46 54  A 1 
ATOM 412 C C   . SER A 1 54  ? -10.366 -14.794 5.140   1.00 84.89 54  A 1 
ATOM 413 O O   . SER A 1 54  ? -9.168  -14.617 5.369   1.00 81.67 54  A 1 
ATOM 414 C CB  . SER A 1 54  ? -11.840 -13.090 3.993   1.00 83.73 54  A 1 
ATOM 415 O OG  . SER A 1 54  ? -10.741 -12.672 3.214   1.00 72.78 54  A 1 
ATOM 416 N N   . ARG A 1 55  ? -10.809 -15.975 4.692   1.00 84.71 55  A 1 
ATOM 417 C CA  . ARG A 1 55  ? -9.894  -17.080 4.378   1.00 83.79 55  A 1 
ATOM 418 C C   . ARG A 1 55  ? -8.955  -16.670 3.241   1.00 83.72 55  A 1 
ATOM 419 O O   . ARG A 1 55  ? -9.397  -16.473 2.120   1.00 77.89 55  A 1 
ATOM 420 C CB  . ARG A 1 55  ? -10.703 -18.347 4.054   1.00 80.04 55  A 1 
ATOM 421 C CG  . ARG A 1 55  ? -9.789  -19.568 3.876   1.00 68.03 55  A 1 
ATOM 422 C CD  . ARG A 1 55  ? -10.628 -20.826 3.666   1.00 63.43 55  A 1 
ATOM 423 N NE  . ARG A 1 55  ? -9.773  -22.021 3.514   1.00 57.06 55  A 1 
ATOM 424 C CZ  . ARG A 1 55  ? -10.164 -23.284 3.613   1.00 49.24 55  A 1 
ATOM 425 N NH1 . ARG A 1 55  ? -11.400 -23.612 3.868   1.00 46.23 55  A 1 
ATOM 426 N NH2 . ARG A 1 55  ? -9.305  -24.255 3.453   1.00 44.42 55  A 1 
ATOM 427 N N   . GLY A 1 56  ? -7.673  -16.559 3.558   1.00 86.39 56  A 1 
ATOM 428 C CA  . GLY A 1 56  ? -6.662  -16.097 2.601   1.00 85.87 56  A 1 
ATOM 429 C C   . GLY A 1 56  ? -6.614  -14.576 2.403   1.00 87.85 56  A 1 
ATOM 430 O O   . GLY A 1 56  ? -5.764  -14.112 1.645   1.00 84.29 56  A 1 
ATOM 431 N N   . ASP A 1 57  ? -7.465  -13.814 3.104   1.00 87.35 57  A 1 
ATOM 432 C CA  . ASP A 1 57  ? -7.548  -12.344 3.095   1.00 88.00 57  A 1 
ATOM 433 C C   . ASP A 1 57  ? -7.770  -11.702 1.715   1.00 89.24 57  A 1 
ATOM 434 O O   . ASP A 1 57  ? -7.476  -10.527 1.513   1.00 86.06 57  A 1 
ATOM 435 C CB  . ASP A 1 57  ? -6.363  -11.725 3.841   1.00 85.01 57  A 1 
ATOM 436 C CG  . ASP A 1 57  ? -6.313  -12.115 5.313   1.00 80.22 57  A 1 
ATOM 437 O OD1 . ASP A 1 57  ? -7.363  -11.989 5.979   1.00 75.07 57  A 1 
ATOM 438 O OD2 . ASP A 1 57  ? -5.202  -12.472 5.754   1.00 75.53 57  A 1 
ATOM 439 N N   . CYS A 1 58  ? -8.326  -12.450 0.761   1.00 89.89 58  A 1 
ATOM 440 C CA  . CYS A 1 58  ? -8.592  -11.982 -0.593  1.00 91.23 58  A 1 
ATOM 441 C C   . CYS A 1 58  ? -9.982  -12.424 -1.059  1.00 91.09 58  A 1 
ATOM 442 O O   . CYS A 1 58  ? -10.359 -13.580 -0.864  1.00 89.24 58  A 1 
ATOM 443 C CB  . CYS A 1 58  ? -7.484  -12.510 -1.510  1.00 90.05 58  A 1 
ATOM 444 S SG  . CYS A 1 58  ? -7.523  -11.633 -3.104  1.00 86.98 58  A 1 
ATOM 445 N N   . SER A 1 59  ? -10.739 -11.521 -1.672  1.00 92.87 59  A 1 
ATOM 446 C CA  . SER A 1 59  ? -12.031 -11.841 -2.295  1.00 92.05 59  A 1 
ATOM 447 C C   . SER A 1 59  ? -11.907 -12.359 -3.727  1.00 91.68 59  A 1 
ATOM 448 O O   . SER A 1 59  ? -12.889 -12.858 -4.268  1.00 89.44 59  A 1 
ATOM 449 C CB  . SER A 1 59  ? -12.955 -10.619 -2.285  1.00 91.31 59  A 1 
ATOM 450 O OG  . SER A 1 59  ? -12.406 -9.539  -3.011  1.00 83.95 59  A 1 
ATOM 451 N N   . GLU A 1 60  ? -10.740 -12.221 -4.348  1.00 90.38 60  A 1 
ATOM 452 C CA  . GLU A 1 60  ? -10.481 -12.735 -5.691  1.00 89.71 60  A 1 
ATOM 453 C C   . GLU A 1 60  ? -10.114 -14.217 -5.619  1.00 89.30 60  A 1 
ATOM 454 O O   . GLU A 1 60  ? -9.076  -14.586 -5.070  1.00 88.05 60  A 1 
ATOM 455 C CB  . GLU A 1 60  ? -9.393  -11.887 -6.366  1.00 89.43 60  A 1 
ATOM 456 C CG  . GLU A 1 60  ? -9.047  -12.361 -7.784  1.00 84.88 60  A 1 
ATOM 457 C CD  . GLU A 1 60  ? -10.301 -12.545 -8.643  1.00 85.23 60  A 1 
ATOM 458 O OE1 . GLU A 1 60  ? -10.606 -13.715 -8.974  1.00 77.21 60  A 1 
ATOM 459 O OE2 . GLU A 1 60  ? -10.986 -11.534 -8.895  1.00 78.52 60  A 1 
ATOM 460 N N   . THR A 1 61  ? -10.971 -15.070 -6.174  1.00 90.43 61  A 1 
ATOM 461 C CA  . THR A 1 61  ? -10.843 -16.536 -6.102  1.00 88.66 61  A 1 
ATOM 462 C C   . THR A 1 61  ? -9.684  -17.093 -6.921  1.00 88.63 61  A 1 
ATOM 463 O O   . THR A 1 61  ? -9.174  -18.156 -6.595  1.00 85.68 61  A 1 
ATOM 464 C CB  . THR A 1 61  ? -12.139 -17.216 -6.561  1.00 86.89 61  A 1 
ATOM 465 O OG1 . THR A 1 61  ? -12.540 -16.717 -7.820  1.00 79.98 61  A 1 
ATOM 466 C CG2 . THR A 1 61  ? -13.286 -16.960 -5.584  1.00 76.64 61  A 1 
ATOM 467 N N   . ASN A 1 62  ? -9.263  -16.370 -7.958  1.00 89.39 62  A 1 
ATOM 468 C CA  . ASN A 1 62  ? -8.156  -16.791 -8.820  1.00 89.30 62  A 1 
ATOM 469 C C   . ASN A 1 62  ? -6.794  -16.253 -8.346  1.00 89.40 62  A 1 
ATOM 470 O O   . ASN A 1 62  ? -5.764  -16.592 -8.918  1.00 87.66 62  A 1 
ATOM 471 C CB  . ASN A 1 62  ? -8.455  -16.351 -10.257 1.00 89.29 62  A 1 
ATOM 472 C CG  . ASN A 1 62  ? -9.760  -16.908 -10.783 1.00 86.12 62  A 1 
ATOM 473 O OD1 . ASN A 1 62  ? -10.020 -18.098 -10.774 1.00 77.21 62  A 1 
ATOM 474 N ND2 . ASN A 1 62  ? -10.646 -16.056 -11.249 1.00 75.36 62  A 1 
ATOM 475 N N   . ALA A 1 63  ? -6.776  -15.394 -7.320  1.00 88.74 63  A 1 
ATOM 476 C CA  . ALA A 1 63  ? -5.539  -14.868 -6.767  1.00 88.51 63  A 1 
ATOM 477 C C   . ALA A 1 63  ? -4.925  -15.853 -5.766  1.00 88.43 63  A 1 
ATOM 478 O O   . ALA A 1 63  ? -5.590  -16.342 -4.853  1.00 87.02 63  A 1 
ATOM 479 C CB  . ALA A 1 63  ? -5.801  -13.501 -6.133  1.00 87.92 63  A 1 
ATOM 480 N N   . GLU A 1 64  ? -3.619  -16.084 -5.878  1.00 90.08 64  A 1 
ATOM 481 C CA  . GLU A 1 64  ? -2.890  -16.876 -4.893  1.00 89.12 64  A 1 
ATOM 482 C C   . GLU A 1 64  ? -2.795  -16.136 -3.551  1.00 89.44 64  A 1 
ATOM 483 O O   . GLU A 1 64  ? -2.397  -14.965 -3.511  1.00 88.39 64  A 1 
ATOM 484 C CB  . GLU A 1 64  ? -1.490  -17.235 -5.396  1.00 87.09 64  A 1 
ATOM 485 C CG  . GLU A 1 64  ? -1.536  -18.199 -6.591  1.00 74.70 64  A 1 
ATOM 486 C CD  . GLU A 1 64  ? -0.137  -18.685 -7.007  1.00 68.15 64  A 1 
ATOM 487 O OE1 . GLU A 1 64  ? -0.085  -19.642 -7.807  1.00 61.40 64  A 1 
ATOM 488 O OE2 . GLU A 1 64  ? 0.860   -18.107 -6.512  1.00 59.04 64  A 1 
ATOM 489 N N   . PRO A 1 65  ? -3.119  -16.803 -2.421  1.00 89.10 65  A 1 
ATOM 490 C CA  . PRO A 1 65  ? -2.994  -16.200 -1.101  1.00 88.41 65  A 1 
ATOM 491 C C   . PRO A 1 65  ? -1.550  -15.781 -0.812  1.00 89.17 65  A 1 
ATOM 492 O O   . PRO A 1 65  ? -0.642  -16.602 -0.757  1.00 86.67 65  A 1 
ATOM 493 C CB  . PRO A 1 65  ? -3.497  -17.253 -0.109  1.00 86.17 65  A 1 
ATOM 494 C CG  . PRO A 1 65  ? -4.418  -18.130 -0.952  1.00 82.49 65  A 1 
ATOM 495 C CD  . PRO A 1 65  ? -3.742  -18.114 -2.319  1.00 85.93 65  A 1 
ATOM 496 N N   . GLN A 1 66  ? -1.340  -14.499 -0.563  1.00 89.86 66  A 1 
ATOM 497 C CA  . GLN A 1 66  ? -0.024  -13.977 -0.205  1.00 89.95 66  A 1 
ATOM 498 C C   . GLN A 1 66  ? 0.237   -14.169 1.292   1.00 90.15 66  A 1 
ATOM 499 O O   . GLN A 1 66  ? -0.621  -13.824 2.108   1.00 88.64 66  A 1 
ATOM 500 C CB  . GLN A 1 66  ? 0.082   -12.505 -0.617  1.00 88.95 66  A 1 
ATOM 501 C CG  . GLN A 1 66  ? -0.128  -12.305 -2.124  1.00 84.44 66  A 1 
ATOM 502 C CD  . GLN A 1 66  ? 0.888   -13.083 -2.953  1.00 82.90 66  A 1 
ATOM 503 O OE1 . GLN A 1 66  ? 2.086   -12.931 -2.781  1.00 75.05 66  A 1 
ATOM 504 N NE2 . GLN A 1 66  ? 0.454   -13.941 -3.857  1.00 71.69 66  A 1 
ATOM 505 N N   . ALA A 1 67  ? 1.410   -14.697 1.665   1.00 89.79 67  A 1 
ATOM 506 C CA  . ALA A 1 67  ? 1.779   -14.920 3.069   1.00 88.67 67  A 1 
ATOM 507 C C   . ALA A 1 67  ? 1.899   -13.597 3.844   1.00 88.68 67  A 1 
ATOM 508 O O   . ALA A 1 67  ? 1.325   -13.448 4.920   1.00 85.21 67  A 1 
ATOM 509 C CB  . ALA A 1 67  ? 3.086   -15.725 3.107   1.00 87.30 67  A 1 
ATOM 510 N N   . ASP A 1 68  ? 2.580   -12.615 3.255   1.00 88.91 68  A 1 
ATOM 511 C CA  . ASP A 1 68  ? 2.721   -11.275 3.821   1.00 89.28 68  A 1 
ATOM 512 C C   . ASP A 1 68  ? 1.850   -10.282 3.045   1.00 89.66 68  A 1 
ATOM 513 O O   . ASP A 1 68  ? 2.020   -10.075 1.840   1.00 87.93 68  A 1 
ATOM 514 C CB  . ASP A 1 68  ? 4.207   -10.897 3.845   1.00 87.10 68  A 1 
ATOM 515 C CG  . ASP A 1 68  ? 4.487   -9.601  4.611   1.00 81.56 68  A 1 
ATOM 516 O OD1 . ASP A 1 68  ? 3.559   -8.768  4.737   1.00 76.61 68  A 1 
ATOM 517 O OD2 . ASP A 1 68  ? 5.654   -9.423  5.026   1.00 75.74 68  A 1 
ATOM 518 N N   . LYS A 1 69  ? 0.892   -9.678  3.740   1.00 90.13 69  A 1 
ATOM 519 C CA  . LYS A 1 69  ? -0.075  -8.743  3.152   1.00 90.88 69  A 1 
ATOM 520 C C   . LYS A 1 69  ? 0.477   -7.325  3.008   1.00 91.41 69  A 1 
ATOM 521 O O   . LYS A 1 69  ? -0.115  -6.516  2.291   1.00 89.28 69  A 1 
ATOM 522 C CB  . LYS A 1 69  ? -1.370  -8.737  3.983   1.00 90.11 69  A 1 
ATOM 523 C CG  . LYS A 1 69  ? -1.971  -10.118 4.272   1.00 88.36 69  A 1 
ATOM 524 C CD  . LYS A 1 69  ? -2.204  -10.991 3.033   1.00 84.35 69  A 1 
ATOM 525 C CE  . LYS A 1 69  ? -2.848  -12.297 3.493   1.00 80.11 69  A 1 
ATOM 526 N NZ  . LYS A 1 69  ? -2.998  -13.276 2.412   1.00 70.68 69  A 1 
ATOM 527 N N   . GLU A 1 70  ? 1.576   -7.019  3.689   1.00 90.42 70  A 1 
ATOM 528 C CA  . GLU A 1 70  ? 2.205   -5.700  3.693   1.00 90.07 70  A 1 
ATOM 529 C C   . GLU A 1 70  ? 3.332   -5.579  2.667   1.00 90.12 70  A 1 
ATOM 530 O O   . GLU A 1 70  ? 3.661   -4.464  2.243   1.00 87.69 70  A 1 
ATOM 531 C CB  . GLU A 1 70  ? 2.753   -5.368  5.084   1.00 88.60 70  A 1 
ATOM 532 C CG  . GLU A 1 70  ? 1.692   -5.405  6.182   1.00 85.31 70  A 1 
ATOM 533 C CD  . GLU A 1 70  ? 2.150   -4.717  7.481   1.00 82.01 70  A 1 
ATOM 534 O OE1 . GLU A 1 70  ? 1.319   -4.647  8.408   1.00 74.81 70  A 1 
ATOM 535 O OE2 . GLU A 1 70  ? 3.279   -4.154  7.528   1.00 75.27 70  A 1 
ATOM 536 N N   . ARG A 1 71  ? 3.902   -6.707  2.264   1.00 90.25 71  A 1 
ATOM 537 C CA  . ARG A 1 71  ? 4.982   -6.761  1.277   1.00 90.43 71  A 1 
ATOM 538 C C   . ARG A 1 71  ? 4.452   -6.701  -0.147  1.00 91.05 71  A 1 
ATOM 539 O O   . ARG A 1 71  ? 3.368   -7.202  -0.462  1.00 88.80 71  A 1 
ATOM 540 C CB  . ARG A 1 71  ? 5.845   -8.011  1.512   1.00 88.75 71  A 1 
ATOM 541 C CG  . ARG A 1 71  ? 6.612   -7.965  2.848   1.00 79.12 71  A 1 
ATOM 542 C CD  . ARG A 1 71  ? 7.608   -6.801  2.938   1.00 74.39 71  A 1 
ATOM 543 N NE  . ARG A 1 71  ? 8.682   -6.943  1.941   1.00 64.62 71  A 1 
ATOM 544 C CZ  . ARG A 1 71  ? 9.790   -7.640  2.077   1.00 56.99 71  A 1 
ATOM 545 N NH1 . ARG A 1 71  ? 10.090  -8.261  3.189   1.00 51.79 71  A 1 
ATOM 546 N NH2 . ARG A 1 71  ? 10.621  -7.742  1.077   1.00 47.44 71  A 1 
ATOM 547 N N   . GLY A 1 72  ? 5.257   -6.085  -0.999  1.00 90.53 72  A 1 
ATOM 548 C CA  . GLY A 1 72  ? 5.028   -6.076  -2.435  1.00 89.87 72  A 1 
ATOM 549 C C   . GLY A 1 72  ? 4.956   -7.499  -2.982  1.00 89.80 72  A 1 
ATOM 550 O O   . GLY A 1 72  ? 5.774   -8.350  -2.637  1.00 85.92 72  A 1 
ATOM 551 N N   . ASN A 1 73  ? 3.958   -7.753  -3.816  1.00 87.98 73  A 1 
ATOM 552 C CA  . ASN A 1 73  ? 3.731   -9.046  -4.435  1.00 86.48 73  A 1 
ATOM 553 C C   . ASN A 1 73  ? 3.577   -8.915  -5.955  1.00 85.68 73  A 1 
ATOM 554 O O   . ASN A 1 73  ? 3.366   -7.829  -6.506  1.00 80.39 73  A 1 
ATOM 555 C CB  . ASN A 1 73  ? 2.549   -9.740  -3.725  1.00 82.44 73  A 1 
ATOM 556 C CG  . ASN A 1 73  ? 1.237   -8.997  -3.889  1.00 77.09 73  A 1 
ATOM 557 O OD1 . ASN A 1 73  ? 0.781   -8.721  -4.985  1.00 68.02 73  A 1 
ATOM 558 N ND2 . ASN A 1 73  ? 0.592   -8.640  -2.803  1.00 72.00 73  A 1 
ATOM 559 N N   . PHE A 1 74  ? 3.672   -10.052 -6.619  1.00 86.57 74  A 1 
ATOM 560 C CA  . PHE A 1 74  ? 3.553   -10.167 -8.071  1.00 86.12 74  A 1 
ATOM 561 C C   . PHE A 1 74  ? 2.145   -10.587 -8.520  1.00 87.80 74  A 1 
ATOM 562 O O   . PHE A 1 74  ? 1.982   -11.071 -9.629  1.00 84.51 74  A 1 
ATOM 563 C CB  . PHE A 1 74  ? 4.656   -11.092 -8.593  1.00 81.92 74  A 1 
ATOM 564 C CG  . PHE A 1 74  ? 6.052   -10.546 -8.357  1.00 75.77 74  A 1 
ATOM 565 C CD1 . PHE A 1 74  ? 6.589   -9.594  -9.241  1.00 71.31 74  A 1 
ATOM 566 C CD2 . PHE A 1 74  ? 6.807   -10.973 -7.252  1.00 69.21 74  A 1 
ATOM 567 C CE1 . PHE A 1 74  ? 7.871   -9.073  -9.029  1.00 62.05 74  A 1 
ATOM 568 C CE2 . PHE A 1 74  ? 8.089   -10.445 -7.037  1.00 62.34 74  A 1 
ATOM 569 C CZ  . PHE A 1 74  ? 8.621   -9.498  -7.926  1.00 59.82 74  A 1 
ATOM 570 N N   . CYS A 1 75  ? 1.130   -10.381 -7.662  1.00 87.46 75  A 1 
ATOM 571 C CA  . CYS A 1 75  ? -0.255  -10.712 -7.964  1.00 89.49 75  A 1 
ATOM 572 C C   . CYS A 1 75  ? -0.737  -9.942  -9.205  1.00 89.57 75  A 1 
ATOM 573 O O   . CYS A 1 75  ? -0.793  -8.706  -9.196  1.00 88.25 75  A 1 
ATOM 574 C CB  . CYS A 1 75  ? -1.108  -10.402 -6.731  1.00 88.95 75  A 1 
ATOM 575 S SG  . CYS A 1 75  ? -2.838  -10.867 -7.015  1.00 85.33 75  A 1 
ATOM 576 N N   . ASP A 1 76  ? -1.120  -10.672 -10.246 1.00 90.63 76  A 1 
ATOM 577 C CA  . ASP A 1 76  ? -1.613  -10.069 -11.489 1.00 89.89 76  A 1 
ATOM 578 C C   . ASP A 1 76  ? -3.036  -9.517  -11.348 1.00 89.88 76  A 1 
ATOM 579 O O   . ASP A 1 76  ? -3.441  -8.635  -12.101 1.00 87.44 76  A 1 
ATOM 580 C CB  . ASP A 1 76  ? -1.469  -11.084 -12.629 1.00 87.48 76  A 1 
ATOM 581 C CG  . ASP A 1 76  ? 0.009   -11.384 -12.945 1.00 78.59 76  A 1 
ATOM 582 O OD1 . ASP A 1 76  ? 0.865   -10.451 -12.875 1.00 72.30 76  A 1 
ATOM 583 O OD2 . ASP A 1 76  ? 0.299   -12.552 -13.247 1.00 70.67 76  A 1 
ATOM 584 N N   . TRP A 1 77  ? -3.749  -9.937  -10.299 1.00 89.78 77  A 1 
ATOM 585 C CA  . TRP A 1 77  ? -5.075  -9.430  -9.936  1.00 90.00 77  A 1 
ATOM 586 C C   . TRP A 1 77  ? -5.029  -8.128  -9.132  1.00 89.85 77  A 1 
ATOM 587 O O   . TRP A 1 77  ? -6.076  -7.571  -8.788  1.00 87.71 77  A 1 
ATOM 588 C CB  . TRP A 1 77  ? -5.827  -10.527 -9.174  1.00 89.56 77  A 1 
ATOM 589 C CG  . TRP A 1 77  ? -5.995  -11.782 -9.965  1.00 88.06 77  A 1 
ATOM 590 C CD1 . TRP A 1 77  ? -5.200  -12.873 -9.914  1.00 84.43 77  A 1 
ATOM 591 C CD2 . TRP A 1 77  ? -7.002  -12.064 -10.977 1.00 87.27 77  A 1 
ATOM 592 N NE1 . TRP A 1 77  ? -5.641  -13.809 -10.823 1.00 81.91 77  A 1 
ATOM 593 C CE2 . TRP A 1 77  ? -6.750  -13.360 -11.503 1.00 85.17 77  A 1 
ATOM 594 C CE3 . TRP A 1 77  ? -8.097  -11.348 -11.497 1.00 81.35 77  A 1 
ATOM 595 C CZ2 . TRP A 1 77  ? -7.556  -13.927 -12.501 1.00 82.76 77  A 1 
ATOM 596 C CZ3 . TRP A 1 77  ? -8.910  -11.906 -12.501 1.00 78.38 77  A 1 
ATOM 597 C CH2 . TRP A 1 77  ? -8.642  -13.194 -12.998 1.00 78.36 77  A 1 
ATOM 598 N N   . PHE A 1 78  ? -3.837  -7.612  -8.820  1.00 90.06 78  A 1 
ATOM 599 C CA  . PHE A 1 78  ? -3.716  -6.386  -8.039  1.00 89.54 78  A 1 
ATOM 600 C C   . PHE A 1 78  ? -4.446  -5.221  -8.709  1.00 88.89 78  A 1 
ATOM 601 O O   . PHE A 1 78  ? -4.141  -4.816  -9.832  1.00 87.71 78  A 1 
ATOM 602 C CB  . PHE A 1 78  ? -2.247  -6.031  -7.792  1.00 89.17 78  A 1 
ATOM 603 C CG  . PHE A 1 78  ? -2.086  -4.744  -7.001  1.00 88.57 78  A 1 
ATOM 604 C CD1 . PHE A 1 78  ? -1.998  -3.505  -7.665  1.00 86.63 78  A 1 
ATOM 605 C CD2 . PHE A 1 78  ? -2.088  -4.773  -5.594  1.00 86.78 78  A 1 
ATOM 606 C CE1 . PHE A 1 78  ? -1.909  -2.310  -6.929  1.00 85.38 78  A 1 
ATOM 607 C CE2 . PHE A 1 78  ? -1.995  -3.579  -4.862  1.00 85.48 78  A 1 
ATOM 608 C CZ  . PHE A 1 78  ? -1.906  -2.345  -5.527  1.00 86.20 78  A 1 
ATOM 609 N N   . SER A 1 79  ? -5.360  -4.623  -7.953  1.00 88.33 79  A 1 
ATOM 610 C CA  . SER A 1 79  ? -6.055  -3.400  -8.333  1.00 87.72 79  A 1 
ATOM 611 C C   . SER A 1 79  ? -6.093  -2.472  -7.129  1.00 87.44 79  A 1 
ATOM 612 O O   . SER A 1 79  ? -6.488  -2.881  -6.037  1.00 86.04 79  A 1 
ATOM 613 C CB  . SER A 1 79  ? -7.458  -3.747  -8.830  1.00 86.75 79  A 1 
ATOM 614 O OG  . SER A 1 79  ? -8.119  -2.584  -9.296  1.00 75.59 79  A 1 
ATOM 615 N N   . LEU A 1 80  ? -5.667  -1.226  -7.306  1.00 85.77 80  A 1 
ATOM 616 C CA  . LEU A 1 80  ? -5.631  -0.251  -6.221  1.00 84.92 80  A 1 
ATOM 617 C C   . LEU A 1 80  ? -7.044  0.013   -5.688  1.00 84.90 80  A 1 
ATOM 618 O O   . LEU A 1 80  ? -7.961  0.338   -6.447  1.00 83.72 80  A 1 
ATOM 619 C CB  . LEU A 1 80  ? -4.952  1.033   -6.717  1.00 83.69 80  A 1 
ATOM 620 C CG  . LEU A 1 80  ? -4.788  2.107   -5.629  1.00 79.40 80  A 1 
ATOM 621 C CD1 . LEU A 1 80  ? -3.776  1.706   -4.559  1.00 76.56 80  A 1 
ATOM 622 C CD2 . LEU A 1 80  ? -4.318  3.406   -6.270  1.00 75.41 80  A 1 
ATOM 623 N N   . ASN A 1 81  ? -7.217  -0.087  -4.372  1.00 84.10 81  A 1 
ATOM 624 C CA  . ASN A 1 81  ? -8.482  0.232   -3.727  1.00 83.51 81  A 1 
ATOM 625 C C   . ASN A 1 81  ? -8.771  1.737   -3.868  1.00 82.45 81  A 1 
ATOM 626 O O   . ASN A 1 81  ? -7.949  2.546   -3.428  1.00 81.25 81  A 1 
ATOM 627 C CB  . ASN A 1 81  ? -8.423  -0.231  -2.262  1.00 83.66 81  A 1 
ATOM 628 C CG  . ASN A 1 81  ? -9.759  -0.154  -1.547  1.00 83.06 81  A 1 
ATOM 629 O OD1 . ASN A 1 81  ? -10.580 0.728   -1.758  1.00 78.14 81  A 1 
ATOM 630 N ND2 . ASN A 1 81  ? -10.023 -1.086  -0.663  1.00 78.61 81  A 1 
ATOM 631 N N   . PRO A 1 82  ? -9.941  2.134   -4.388  1.00 81.21 82  A 1 
ATOM 632 C CA  . PRO A 1 82  ? -10.308 3.543   -4.543  1.00 79.03 82  A 1 
ATOM 633 C C   . PRO A 1 82  ? -10.220 4.365   -3.249  1.00 77.62 82  A 1 
ATOM 634 O O   . PRO A 1 82  ? -9.972  5.566   -3.316  1.00 74.71 82  A 1 
ATOM 635 C CB  . PRO A 1 82  ? -11.740 3.531   -5.082  1.00 78.32 82  A 1 
ATOM 636 C CG  . PRO A 1 82  ? -11.823 2.210   -5.837  1.00 76.66 82  A 1 
ATOM 637 C CD  . PRO A 1 82  ? -10.956 1.283   -4.992  1.00 79.77 82  A 1 
ATOM 638 N N   . ARG A 1 83  ? -10.349 3.723   -2.076  1.00 80.65 83  A 1 
ATOM 639 C CA  . ARG A 1 83  ? -10.180 4.373   -0.763  1.00 79.13 83  A 1 
ATOM 640 C C   . ARG A 1 83  ? -8.792  4.994   -0.567  1.00 78.07 83  A 1 
ATOM 641 O O   . ARG A 1 83  ? -8.674  5.969   0.165   1.00 75.51 83  A 1 
ATOM 642 C CB  . ARG A 1 83  ? -10.445 3.356   0.360   1.00 78.00 83  A 1 
ATOM 643 C CG  . ARG A 1 83  ? -11.915 2.915   0.412   1.00 69.06 83  A 1 
ATOM 644 C CD  . ARG A 1 83  ? -12.107 1.904   1.543   1.00 68.05 83  A 1 
ATOM 645 N NE  . ARG A 1 83  ? -13.514 1.476   1.658   1.00 63.25 83  A 1 
ATOM 646 C CZ  . ARG A 1 83  ? -13.994 0.602   2.525   1.00 57.55 83  A 1 
ATOM 647 N NH1 . ARG A 1 83  ? -13.226 -0.004  3.393   1.00 54.93 83  A 1 
ATOM 648 N NH2 . ARG A 1 83  ? -15.267 0.311   2.543   1.00 50.59 83  A 1 
ATOM 649 N N   . PHE A 1 84  ? -7.775  4.455   -1.226  1.00 78.45 84  A 1 
ATOM 650 C CA  . PHE A 1 84  ? -6.401  4.962   -1.177  1.00 76.82 84  A 1 
ATOM 651 C C   . PHE A 1 84  ? -6.086  5.972   -2.289  1.00 74.66 84  A 1 
ATOM 652 O O   . PHE A 1 84  ? -4.928  6.313   -2.492  1.00 71.68 84  A 1 
ATOM 653 C CB  . PHE A 1 84  ? -5.417  3.785   -1.165  1.00 78.13 84  A 1 
ATOM 654 C CG  . PHE A 1 84  ? -5.590  2.862   0.024   1.00 78.14 84  A 1 
ATOM 655 C CD1 . PHE A 1 84  ? -5.382  3.345   1.329   1.00 76.15 84  A 1 
ATOM 656 C CD2 . PHE A 1 84  ? -5.958  1.519   -0.174  1.00 76.84 84  A 1 
ATOM 657 C CE1 . PHE A 1 84  ? -5.549  2.488   2.431   1.00 74.92 84  A 1 
ATOM 658 C CE2 . PHE A 1 84  ? -6.121  0.664   0.932   1.00 75.34 84  A 1 
ATOM 659 C CZ  . PHE A 1 84  ? -5.916  1.147   2.235   1.00 76.82 84  A 1 
ATOM 660 N N   . ARG A 1 85  ? -7.104  6.468   -3.007  1.00 74.05 85  A 1 
ATOM 661 C CA  . ARG A 1 85  ? -6.947  7.558   -3.989  1.00 72.18 85  A 1 
ATOM 662 C C   . ARG A 1 85  ? -7.090  8.953   -3.370  1.00 71.83 85  A 1 
ATOM 663 O O   . ARG A 1 85  ? -6.827  9.948   -4.039  1.00 68.73 85  A 1 
ATOM 664 C CB  . ARG A 1 85  ? -7.929  7.369   -5.150  1.00 70.14 85  A 1 
ATOM 665 C CG  . ARG A 1 85  ? -7.647  6.084   -5.937  1.00 64.62 85  A 1 
ATOM 666 C CD  . ARG A 1 85  ? -8.603  5.991   -7.130  1.00 62.89 85  A 1 
ATOM 667 N NE  . ARG A 1 85  ? -8.339  4.787   -7.943  1.00 59.18 85  A 1 
ATOM 668 C CZ  . ARG A 1 85  ? -8.034  4.743   -9.230  1.00 54.09 85  A 1 
ATOM 669 N NH1 . ARG A 1 85  ? -7.928  5.812   -9.961  1.00 50.79 85  A 1 
ATOM 670 N NH2 . ARG A 1 85  ? -7.827  3.597   -9.816  1.00 48.09 85  A 1 
ATOM 671 N N   . SER A 1 86  ? -7.498  9.025   -2.110  1.00 68.70 86  A 1 
ATOM 672 C CA  . SER A 1 86  ? -7.627  10.257  -1.331  1.00 68.62 86  A 1 
ATOM 673 C C   . SER A 1 86  ? -6.802  10.173  -0.048  1.00 69.32 86  A 1 
ATOM 674 O O   . SER A 1 86  ? -6.570  9.080   0.472   1.00 66.08 86  A 1 
ATOM 675 C CB  . SER A 1 86  ? -9.099  10.539  -1.014  1.00 65.09 86  A 1 
ATOM 676 O OG  . SER A 1 86  ? -9.700  9.454   -0.335  1.00 56.92 86  A 1 
ATOM 677 N N   . ALA A 1 87  ? -6.386  11.321  0.469   1.00 69.96 87  A 1 
ATOM 678 C CA  . ALA A 1 87  ? -5.624  11.395  1.711   1.00 69.44 87  A 1 
ATOM 679 C C   . ALA A 1 87  ? -6.374  10.722  2.867   1.00 71.25 87  A 1 
ATOM 680 O O   . ALA A 1 87  ? -7.582  10.908  3.041   1.00 66.76 87  A 1 
ATOM 681 C CB  . ALA A 1 87  ? -5.283  12.855  2.021   1.00 64.54 87  A 1 
ATOM 682 N N   . SER A 1 88  ? -5.648  9.937   3.656   1.00 69.58 88  A 1 
ATOM 683 C CA  . SER A 1 88  ? -6.194  9.219   4.806   1.00 69.60 88  A 1 
ATOM 684 C C   . SER A 1 88  ? -5.212  9.266   5.974   1.00 72.12 88  A 1 
ATOM 685 O O   . SER A 1 88  ? -4.024  9.535   5.802   1.00 68.46 88  A 1 
ATOM 686 C CB  . SER A 1 88  ? -6.539  7.774   4.411   1.00 64.14 88  A 1 
ATOM 687 O OG  . SER A 1 88  ? -5.388  6.962   4.317   1.00 56.63 88  A 1 
ATOM 688 N N   . ALA A 1 89  ? -5.695  8.969   7.173   1.00 69.65 89  A 1 
ATOM 689 C CA  . ALA A 1 89  ? -4.845  8.836   8.358   1.00 70.69 89  A 1 
ATOM 690 C C   . ALA A 1 89  ? -3.915  7.602   8.302   1.00 72.47 89  A 1 
ATOM 691 O O   . ALA A 1 89  ? -3.015  7.474   9.133   1.00 67.48 89  A 1 
ATOM 692 C CB  . ALA A 1 89  ? -5.762  8.810   9.587   1.00 67.75 89  A 1 
ATOM 693 N N   . GLY A 1 90  ? -4.112  6.688   7.339   1.00 74.33 90  A 1 
ATOM 694 C CA  . GLY A 1 90  ? -3.432  5.394   7.297   1.00 74.66 90  A 1 
ATOM 695 C C   . GLY A 1 90  ? -3.665  4.584   8.583   1.00 76.45 90  A 1 
ATOM 696 O O   . GLY A 1 90  ? -4.695  4.718   9.249   1.00 74.23 90  A 1 
ATOM 697 N N   . GLU A 1 91  ? -2.675  3.785   8.950   1.00 73.85 91  A 1 
ATOM 698 C CA  . GLU A 1 91  ? -2.687  2.954   10.162  1.00 76.00 91  A 1 
ATOM 699 C C   . GLU A 1 91  ? -2.116  3.702   11.387  1.00 77.42 91  A 1 
ATOM 700 O O   . GLU A 1 91  ? -1.256  3.203   12.119  1.00 75.74 91  A 1 
ATOM 701 C CB  . GLU A 1 91  ? -1.931  1.647   9.876   1.00 74.56 91  A 1 
ATOM 702 C CG  . GLU A 1 91  ? -2.654  0.719   8.882   1.00 68.30 91  A 1 
ATOM 703 C CD  . GLU A 1 91  ? -3.959  0.124   9.425   1.00 66.16 91  A 1 
ATOM 704 O OE1 . GLU A 1 91  ? -4.816  -0.232  8.586   1.00 61.92 91  A 1 
ATOM 705 O OE2 . GLU A 1 91  ? -4.075  0.004   10.667  1.00 60.89 91  A 1 
ATOM 706 N N   . GLN A 1 92  ? -2.536  4.948   11.626  1.00 76.22 92  A 1 
ATOM 707 C CA  . GLN A 1 92  ? -1.995  5.737   12.744  1.00 77.17 92  A 1 
ATOM 708 C C   . GLN A 1 92  ? -2.308  5.119   14.109  1.00 79.18 92  A 1 
ATOM 709 O O   . GLN A 1 92  ? -1.426  5.058   14.964  1.00 79.09 92  A 1 
ATOM 710 C CB  . GLN A 1 92  ? -2.520  7.177   12.700  1.00 75.50 92  A 1 
ATOM 711 C CG  . GLN A 1 92  ? -1.818  8.014   11.625  1.00 67.14 92  A 1 
ATOM 712 C CD  . GLN A 1 92  ? -2.307  9.456   11.591  1.00 60.05 92  A 1 
ATOM 713 O OE1 . GLN A 1 92  ? -3.227  9.853   12.292  1.00 58.10 92  A 1 
ATOM 714 N NE2 . GLN A 1 92  ? -1.715  10.303  10.783  1.00 51.03 92  A 1 
ATOM 715 N N   . LYS A 1 93  ? -3.538  4.620   14.306  1.00 76.08 93  A 1 
ATOM 716 C CA  . LYS A 1 93  ? -3.960  4.019   15.580  1.00 78.10 93  A 1 
ATOM 717 C C   . LYS A 1 93  ? -3.184  2.741   15.895  1.00 79.66 93  A 1 
ATOM 718 O O   . LYS A 1 93  ? -2.702  2.585   17.012  1.00 78.53 93  A 1 
ATOM 719 C CB  . LYS A 1 93  ? -5.467  3.728   15.572  1.00 76.85 93  A 1 
ATOM 720 C CG  . LYS A 1 93  ? -6.319  5.004   15.557  1.00 68.91 93  A 1 
ATOM 721 C CD  . LYS A 1 93  ? -7.806  4.642   15.644  1.00 66.01 93  A 1 
ATOM 722 C CE  . LYS A 1 93  ? -8.674  5.902   15.652  1.00 60.58 93  A 1 
ATOM 723 N NZ  . LYS A 1 93  ? -10.117 5.571   15.779  1.00 51.51 93  A 1 
ATOM 724 N N   . SER A 1 94  ? -3.035  1.851   14.913  1.00 77.03 94  A 1 
ATOM 725 C CA  . SER A 1 94  ? -2.287  0.602   15.073  1.00 77.43 94  A 1 
ATOM 726 C C   . SER A 1 94  ? -0.798  0.859   15.306  1.00 78.48 94  A 1 
ATOM 727 O O   . SER A 1 94  ? -0.195  0.214   16.162  1.00 78.26 94  A 1 
ATOM 728 C CB  . SER A 1 94  ? -2.511  -0.304  13.850  1.00 76.09 94  A 1 
ATOM 729 O OG  . SER A 1 94  ? -2.229  0.411   12.667  1.00 66.25 94  A 1 
ATOM 730 N N   . ARG A 1 95  ? -0.202  1.856   14.632  1.00 79.27 95  A 1 
ATOM 731 C CA  . ARG A 1 95  ? 1.186   2.279   14.866  1.00 80.25 95  A 1 
ATOM 732 C C   . ARG A 1 95  ? 1.397   2.833   16.275  1.00 83.23 95  A 1 
ATOM 733 O O   . ARG A 1 95  ? 2.391   2.478   16.893  1.00 83.23 95  A 1 
ATOM 734 C CB  . ARG A 1 95  ? 1.607   3.326   13.833  1.00 78.60 95  A 1 
ATOM 735 C CG  . ARG A 1 95  ? 1.809   2.705   12.451  1.00 73.10 95  A 1 
ATOM 736 C CD  . ARG A 1 95  ? 2.423   3.717   11.479  1.00 71.46 95  A 1 
ATOM 737 N NE  . ARG A 1 95  ? 1.538   4.860   11.211  1.00 66.28 95  A 1 
ATOM 738 C CZ  . ARG A 1 95  ? 1.916   6.052   10.780  1.00 61.17 95  A 1 
ATOM 739 N NH1 . ARG A 1 95  ? 3.165   6.363   10.582  1.00 57.17 95  A 1 
ATOM 740 N NH2 . ARG A 1 95  ? 1.034   6.974   10.529  1.00 54.01 95  A 1 
ATOM 741 N N   . GLY A 1 96  ? 0.486   3.671   16.768  1.00 81.46 96  A 1 
ATOM 742 C CA  . GLY A 1 96  ? 0.538   4.191   18.137  1.00 83.45 96  A 1 
ATOM 743 C C   . GLY A 1 96  ? 0.502   3.068   19.168  1.00 86.89 96  A 1 
ATOM 744 O O   . GLY A 1 96  ? 1.432   2.933   19.954  1.00 87.00 96  A 1 
ATOM 745 N N   . ALA A 1 97  ? -0.491  2.176   19.070  1.00 85.59 97  A 1 
ATOM 746 C CA  . ALA A 1 97  ? -0.624  1.036   19.975  1.00 86.75 97  A 1 
ATOM 747 C C   . ALA A 1 97  ? 0.610   0.109   19.963  1.00 88.31 97  A 1 
ATOM 748 O O   . ALA A 1 97  ? 1.032   -0.369  21.015  1.00 87.13 97  A 1 
ATOM 749 C CB  . ALA A 1 97  ? -1.896  0.269   19.588  1.00 86.26 97  A 1 
ATOM 750 N N   . ALA A 1 98  ? 1.218   -0.131  18.794  1.00 84.90 98  A 1 
ATOM 751 C CA  . ALA A 1 98  ? 2.433   -0.936  18.690  1.00 85.15 98  A 1 
ATOM 752 C C   . ALA A 1 98  ? 3.649   -0.251  19.335  1.00 86.49 98  A 1 
ATOM 753 O O   . ALA A 1 98  ? 4.457   -0.920  19.979  1.00 86.94 98  A 1 
ATOM 754 C CB  . ALA A 1 98  ? 2.686   -1.253  17.210  1.00 84.03 98  A 1 
ATOM 755 N N   . ALA A 1 99  ? 3.787   1.069   19.189  1.00 87.39 99  A 1 
ATOM 756 C CA  . ALA A 1 99  ? 4.859   1.839   19.817  1.00 88.12 99  A 1 
ATOM 757 C C   . ALA A 1 99  ? 4.723   1.867   21.349  1.00 90.94 99  A 1 
ATOM 758 O O   . ALA A 1 99  ? 5.711   1.665   22.057  1.00 90.81 99  A 1 
ATOM 759 C CB  . ALA A 1 99  ? 4.864   3.251   19.224  1.00 86.03 99  A 1 
ATOM 760 N N   . ASP A 1 100 ? 3.500   2.031   21.856  1.00 89.38 100 A 1 
ATOM 761 C CA  . ASP A 1 100 ? 3.205   2.011   23.289  1.00 91.47 100 A 1 
ATOM 762 C C   . ASP A 1 100 ? 3.490   0.631   23.890  1.00 92.23 100 A 1 
ATOM 763 O O   . ASP A 1 100 ? 4.184   0.525   24.902  1.00 92.32 100 A 1 
ATOM 764 C CB  . ASP A 1 100 ? 1.736   2.409   23.529  1.00 91.04 100 A 1 
ATOM 765 C CG  . ASP A 1 100 ? 1.403   3.851   23.123  1.00 86.97 100 A 1 
ATOM 766 O OD1 . ASP A 1 100 ? 2.333   4.687   23.066  1.00 79.40 100 A 1 
ATOM 767 O OD2 . ASP A 1 100 ? 0.201   4.102   22.869  1.00 80.27 100 A 1 
ATOM 768 N N   . ALA A 1 101 ? 3.043   -0.451  23.228  1.00 90.55 101 A 1 
ATOM 769 C CA  . ALA A 1 101 ? 3.312   -1.819  23.659  1.00 90.28 101 A 1 
ATOM 770 C C   . ALA A 1 101 ? 4.813   -2.139  23.684  1.00 90.41 101 A 1 
ATOM 771 O O   . ALA A 1 101 ? 5.302   -2.745  24.638  1.00 90.77 101 A 1 
ATOM 772 C CB  . ALA A 1 101 ? 2.558   -2.783  22.734  1.00 90.71 101 A 1 
ATOM 773 N N   . LYS A 1 102 ? 5.564   -1.694  22.665  1.00 90.12 102 A 1 
ATOM 774 C CA  . LYS A 1 102 ? 7.020   -1.848  22.624  1.00 90.08 102 A 1 
ATOM 775 C C   . LYS A 1 102 ? 7.698   -1.101  23.774  1.00 91.23 102 A 1 
ATOM 776 O O   . LYS A 1 102 ? 8.540   -1.676  24.453  1.00 92.71 102 A 1 
ATOM 777 C CB  . LYS A 1 102 ? 7.541   -1.393  21.253  1.00 89.05 102 A 1 
ATOM 778 C CG  . LYS A 1 102 ? 9.054   -1.587  21.167  1.00 79.51 102 A 1 
ATOM 779 C CD  . LYS A 1 102 ? 9.621   -1.168  19.809  1.00 76.94 102 A 1 
ATOM 780 C CE  . LYS A 1 102 ? 11.135  -1.269  19.959  1.00 70.22 102 A 1 
ATOM 781 N NZ  . LYS A 1 102 ? 11.883  -0.812  18.769  1.00 61.72 102 A 1 
ATOM 782 N N   . SER A 1 103 ? 7.309   0.145   24.023  1.00 92.05 103 A 1 
ATOM 783 C CA  . SER A 1 103 ? 7.877   0.968   25.097  1.00 91.50 103 A 1 
ATOM 784 C C   . SER A 1 103 ? 7.584   0.379   26.480  1.00 91.91 103 A 1 
ATOM 785 O O   . SER A 1 103 ? 8.465   0.341   27.335  1.00 91.89 103 A 1 
ATOM 786 C CB  . SER A 1 103 ? 7.323   2.395   25.026  1.00 91.43 103 A 1 
ATOM 787 O OG  . SER A 1 103 ? 7.581   2.973   23.759  1.00 77.81 103 A 1 
ATOM 788 N N   . ALA A 1 104 ? 6.370   -0.135  26.693  1.00 93.76 104 A 1 
ATOM 789 C CA  . ALA A 1 104 ? 5.992   -0.832  27.920  1.00 93.00 104 A 1 
ATOM 790 C C   . ALA A 1 104 ? 6.818   -2.109  28.127  1.00 93.38 104 A 1 
ATOM 791 O O   . ALA A 1 104 ? 7.318   -2.340  29.222  1.00 93.57 104 A 1 
ATOM 792 C CB  . ALA A 1 104 ? 4.490   -1.132  27.877  1.00 93.80 104 A 1 
ATOM 793 N N   . PHE A 1 105 ? 7.015   -2.910  27.072  1.00 91.95 105 A 1 
ATOM 794 C CA  . PHE A 1 105 ? 7.846   -4.115  27.121  1.00 91.62 105 A 1 
ATOM 795 C C   . PHE A 1 105 ? 9.308   -3.785  27.439  1.00 92.12 105 A 1 
ATOM 796 O O   . PHE A 1 105 ? 9.877   -4.364  28.354  1.00 92.63 105 A 1 
ATOM 797 C CB  . PHE A 1 105 ? 7.718   -4.872  25.796  1.00 91.52 105 A 1 
ATOM 798 C CG  . PHE A 1 105 ? 8.524   -6.156  25.754  1.00 89.60 105 A 1 
ATOM 799 C CD1 . PHE A 1 105 ? 9.804   -6.174  25.168  1.00 85.05 105 A 1 
ATOM 800 C CD2 . PHE A 1 105 ? 8.001   -7.329  26.327  1.00 87.05 105 A 1 
ATOM 801 C CE1 . PHE A 1 105 ? 10.551  -7.365  25.148  1.00 84.19 105 A 1 
ATOM 802 C CE2 . PHE A 1 105 ? 8.753   -8.516  26.305  1.00 85.77 105 A 1 
ATOM 803 C CZ  . PHE A 1 105 ? 10.027  -8.533  25.715  1.00 85.10 105 A 1 
ATOM 804 N N   . GLU A 1 106 ? 9.908   -2.815  26.754  1.00 94.00 106 A 1 
ATOM 805 C CA  . GLU A 1 106 ? 11.288  -2.378  27.021  1.00 92.55 106 A 1 
ATOM 806 C C   . GLU A 1 106 ? 11.460  -1.804  28.439  1.00 92.34 106 A 1 
ATOM 807 O O   . GLU A 1 106 ? 12.536  -1.913  29.019  1.00 92.74 106 A 1 
ATOM 808 C CB  . GLU A 1 106 ? 11.707  -1.325  25.984  1.00 92.21 106 A 1 
ATOM 809 C CG  . GLU A 1 106 ? 11.954  -1.935  24.588  1.00 84.04 106 A 1 
ATOM 810 C CD  . GLU A 1 106 ? 12.314  -0.888  23.515  1.00 76.09 106 A 1 
ATOM 811 O OE1 . GLU A 1 106 ? 12.626  -1.311  22.375  1.00 68.24 106 A 1 
ATOM 812 O OE2 . GLU A 1 106 ? 12.251  0.329   23.781  1.00 67.25 106 A 1 
ATOM 813 N N   . GLY A 1 107 ? 10.411  -1.208  29.007  1.00 94.35 107 A 1 
ATOM 814 C CA  . GLY A 1 107 ? 10.388  -0.712  30.382  1.00 93.83 107 A 1 
ATOM 815 C C   . GLY A 1 107 ? 10.489  -1.800  31.452  1.00 94.46 107 A 1 
ATOM 816 O O   . GLY A 1 107 ? 10.969  -1.503  32.540  1.00 93.34 107 A 1 
ATOM 817 N N   . LEU A 1 108 ? 10.103  -3.051  31.148  1.00 93.40 108 A 1 
ATOM 818 C CA  . LEU A 1 108 ? 10.203  -4.183  32.085  1.00 92.48 108 A 1 
ATOM 819 C C   . LEU A 1 108 ? 11.645  -4.666  32.309  1.00 92.24 108 A 1 
ATOM 820 O O   . LEU A 1 108 ? 11.889  -5.414  33.251  1.00 91.51 108 A 1 
ATOM 821 C CB  . LEU A 1 108 ? 9.350   -5.361  31.579  1.00 93.42 108 A 1 
ATOM 822 C CG  . LEU A 1 108 ? 7.837   -5.093  31.478  1.00 90.09 108 A 1 
ATOM 823 C CD1 . LEU A 1 108 ? 7.147   -6.292  30.825  1.00 84.04 108 A 1 
ATOM 824 C CD2 . LEU A 1 108 ? 7.198   -4.862  32.847  1.00 84.17 108 A 1 
ATOM 825 N N   . PHE A 1 109 ? 12.576  -4.276  31.442  1.00 93.39 109 A 1 
ATOM 826 C CA  . PHE A 1 109 ? 13.977  -4.719  31.471  1.00 91.55 109 A 1 
ATOM 827 C C   . PHE A 1 109 ? 14.954  -3.581  31.794  1.00 90.58 109 A 1 
ATOM 828 O O   . PHE A 1 109 ? 16.164  -3.754  31.640  1.00 87.23 109 A 1 
ATOM 829 C CB  . PHE A 1 109 ? 14.325  -5.388  30.139  1.00 90.54 109 A 1 
ATOM 830 C CG  . PHE A 1 109 ? 13.439  -6.567  29.782  1.00 91.41 109 A 1 
ATOM 831 C CD1 . PHE A 1 109 ? 13.661  -7.825  30.367  1.00 86.03 109 A 1 
ATOM 832 C CD2 . PHE A 1 109 ? 12.371  -6.398  28.887  1.00 86.48 109 A 1 
ATOM 833 C CE1 . PHE A 1 109 ? 12.824  -8.907  30.054  1.00 84.98 109 A 1 
ATOM 834 C CE2 . PHE A 1 109 ? 11.530  -7.478  28.579  1.00 86.07 109 A 1 
ATOM 835 C CZ  . PHE A 1 109 ? 11.756  -8.734  29.159  1.00 87.24 109 A 1 
ATOM 836 N N   . LYS A 1 110 ? 14.450  -2.414  32.195  1.00 92.99 110 A 1 
ATOM 837 C CA  . LYS A 1 110 ? 15.275  -1.312  32.682  1.00 90.69 110 A 1 
ATOM 838 C C   . LYS A 1 110 ? 15.335  -1.404  34.204  1.00 88.78 110 A 1 
ATOM 839 O O   . LYS A 1 110 ? 14.334  -1.115  34.858  1.00 83.06 110 A 1 
ATOM 840 C CB  . LYS A 1 110 ? 14.706  0.031   32.204  1.00 87.99 110 A 1 
ATOM 841 C CG  . LYS A 1 110 ? 14.906  0.213   30.692  1.00 81.50 110 A 1 
ATOM 842 C CD  . LYS A 1 110 ? 14.259  1.517   30.218  1.00 76.45 110 A 1 
ATOM 843 C CE  . LYS A 1 110 ? 14.422  1.624   28.701  1.00 69.11 110 A 1 
ATOM 844 N NZ  . LYS A 1 110 ? 13.744  2.839   28.177  1.00 60.53 110 A 1 
ATOM 845 N N   . ASP A 1 111 ? 16.492  -1.816  34.717  1.00 88.55 111 A 1 
ATOM 846 C CA  . ASP A 1 111 ? 16.863  -1.687  36.129  1.00 84.48 111 A 1 
ATOM 847 C C   . ASP A 1 111 ? 17.174  -0.216  36.483  1.00 76.46 111 A 1 
ATOM 848 O O   . ASP A 1 111 ? 17.776  0.490   35.642  1.00 69.69 111 A 1 
ATOM 849 C CB  . ASP A 1 111 ? 18.056  -2.618  36.449  1.00 78.04 111 A 1 
ATOM 850 C CG  . ASP A 1 111 ? 17.772  -4.126  36.291  1.00 71.45 111 A 1 
ATOM 851 O OD1 . ASP A 1 111 ? 16.711  -4.602  36.770  1.00 67.86 111 A 1 
ATOM 852 O OD2 . ASP A 1 111 ? 18.644  -4.823  35.720  1.00 67.44 111 A 1 
ATOM 853 O OXT . ASP A 1 111 ? 16.808  0.184   37.610  1.00 63.82 111 A 1 
#
