# 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_multifold-mushy-insect-af3
#
_entry.id multifold-mushy-insect-af3
#
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](C(=O)O)N                     ? "L-PEPTIDE LINKING" 
"C6 H15 N4 O2"  175.209 ARG y ARGININE        C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N     ? "L-PEPTIDE LINKING" 
"C4 H8 N2 O3"   132.118 ASN y ASPARAGINE      C([C@@H](C(=O)O)N)C(=O)N             ? "L-PEPTIDE LINKING" 
"C4 H7 N O4"    133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O             ? "L-PEPTIDE LINKING" 
"C3 H7 N O2 S"  121.158 CYS y CYSTEINE        C([C@@H](C(=O)O)N)S                  ? "L-PEPTIDE LINKING" 
"C5 H10 N2 O3"  146.144 GLN y GLUTAMINE       C(CC(=O)N)[C@@H](C(=O)O)N            ? "L-PEPTIDE LINKING" 
"C5 H9 N O4"    147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[C@@H](C(=O)O)N            ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"    75.067  GLY y GLYCINE         C(C(=O)O)N                           ? "PEPTIDE LINKING"   
"C6 H10 N3 O2"  156.162 HIS y HISTIDINE       c1c([nH+]c[nH]1)C[C@@H](C(=O)O)N     ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 LEU y LEUCINE         CC(C)C[C@@H](C(=O)O)N                ? "L-PEPTIDE LINKING" 
"C6 H15 N2 O2"  147.195 LYS y LYSINE          C(CC[NH3+])C[C@@H](C(=O)O)N          ? "L-PEPTIDE LINKING" 
"C5 H11 N O2 S" 149.211 MET y METHIONINE      CSCC[C@@H](C(=O)O)N                  ? "L-PEPTIDE LINKING" 
"C9 H11 N O2"   165.189 PHE y PHENYLALANINE   c1ccc(cc1)C[C@@H](C(=O)O)N           ? "L-PEPTIDE LINKING" 
"C5 H9 N O2"    115.130 PRO y PROLINE         C1C[C@H](NC1)C(=O)O                  ? "L-PEPTIDE LINKING" 
"C3 H7 N O3"    105.093 SER y SERINE          C([C@@H](C(=O)O)N)O                  ? "L-PEPTIDE LINKING" 
"C4 H9 N O3"    119.119 THR y THREONINE       C[C@H]([C@@H](C(=O)O)N)O             ? "L-PEPTIDE LINKING" 
"C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN      c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" 
"C9 H11 N O3"   181.189 TYR y TYROSINE        c1cc(ccc1C[C@@H](C(=O)O)N)O          ? "L-PEPTIDE LINKING" 
"C5 H11 N O2"   117.146 VAL y VALINE          CC(C)[C@@H](C(=O)O)N                 ? "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 ALA 2  
1 n LEU 3  
1 n TRP 4  
1 n MET 5  
1 n ARG 6  
1 n LEU 7  
1 n LEU 8  
1 n PRO 9  
1 n LEU 10 
1 n LEU 11 
1 n ALA 12 
1 n LEU 13 
1 n LEU 14 
1 n ALA 15 
1 n LEU 16 
1 n TRP 17 
1 n GLY 18 
1 n PRO 19 
1 n ASP 20 
1 n PRO 21 
1 n ALA 22 
1 n ALA 23 
1 n ALA 24 
1 n PHE 25 
1 n VAL 26 
1 n ASN 27 
1 n GLN 28 
1 n HIS 29 
1 n LEU 30 
1 n CYS 31 
1 n GLY 32 
1 n SER 33 
1 n HIS 34 
1 n LEU 35 
1 n VAL 36 
1 n GLU 37 
1 n ALA 38 
1 n LEU 39 
1 n TYR 40 
1 n LEU 41 
1 n VAL 42 
1 n CYS 43 
1 n GLY 44 
1 n GLU 45 
1 n ARG 46 
1 n GLY 47 
1 n PHE 48 
1 n PHE 49 
1 n TYR 50 
1 n THR 51 
1 n PRO 52 
1 n LYS 53 
1 n THR 54 
1 n ARG 55 
1 n ARG 56 
1 n GLU 57 
1 n ALA 58 
1 n GLU 59 
1 n ASP 60 
1 n LEU 61 
1 n GLN 62 
1 n VAL 63 
1 n GLY 64 
1 n GLN 65 
1 n VAL 66 
1 n GLU 67 
1 n LEU 68 
1 n GLY 69 
1 n GLY 70 
#
_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 (3.0.1 @ 2026-08-12 15:19:01)"
_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 72.44
_ma_qa_metric_global.model_id     1
_ma_qa_metric_global.ordinal_id   1
#
loop_
_ma_qa_metric_local.label_asym_id
_ma_qa_metric_local.label_comp_id
_ma_qa_metric_local.label_seq_id
_ma_qa_metric_local.metric_id
_ma_qa_metric_local.metric_value
_ma_qa_metric_local.model_id
_ma_qa_metric_local.ordinal_id
A MET 1  2 73.61 1 1  
A ALA 2  2 87.07 1 2  
A LEU 3  2 84.54 1 3  
A TRP 4  2 75.75 1 4  
A MET 5  2 83.87 1 5  
A ARG 6  2 80.32 1 6  
A LEU 7  2 89.10 1 7  
A LEU 8  2 87.01 1 8  
A PRO 9  2 91.15 1 9  
A LEU 10 2 86.69 1 10 
A LEU 11 2 86.78 1 11 
A ALA 12 2 90.00 1 12 
A LEU 13 2 85.06 1 13 
A LEU 14 2 84.39 1 14 
A ALA 15 2 85.13 1 15 
A LEU 16 2 81.86 1 16 
A TRP 17 2 70.46 1 17 
A GLY 18 2 70.36 1 18 
A PRO 19 2 66.50 1 19 
A ASP 20 2 59.33 1 20 
A PRO 21 2 54.91 1 21 
A ALA 22 2 53.59 1 22 
A ALA 23 2 55.70 1 23 
A ALA 24 2 52.09 1 24 
A PHE 25 2 47.06 1 25 
A VAL 26 2 53.05 1 26 
A ASN 27 2 52.59 1 27 
A GLN 28 2 62.66 1 28 
A HIS 29 2 68.15 1 29 
A LEU 30 2 71.79 1 30 
A CYS 31 2 81.64 1 31 
A GLY 32 2 85.41 1 32 
A SER 33 2 87.17 1 33 
A HIS 34 2 81.67 1 34 
A LEU 35 2 86.20 1 35 
A VAL 36 2 86.16 1 36 
A GLU 37 2 80.65 1 37 
A ALA 38 2 90.29 1 38 
A LEU 39 2 85.88 1 39 
A TYR 40 2 79.97 1 40 
A LEU 41 2 85.43 1 41 
A VAL 42 2 88.36 1 42 
A CYS 43 2 89.78 1 43 
A GLY 44 2 87.28 1 44 
A GLU 45 2 73.91 1 45 
A ARG 46 2 73.02 1 46 
A GLY 47 2 81.81 1 47 
A PHE 48 2 73.98 1 48 
A PHE 49 2 70.72 1 49 
A TYR 50 2 72.39 1 50 
A THR 51 2 72.39 1 51 
A PRO 52 2 75.77 1 52 
A LYS 53 2 63.04 1 53 
A THR 54 2 70.32 1 54 
A ARG 55 2 60.17 1 55 
A ARG 56 2 56.29 1 56 
A GLU 57 2 61.17 1 57 
A ALA 58 2 71.68 1 58 
A GLU 59 2 60.20 1 59 
A ASP 60 2 64.55 1 60 
A LEU 61 2 63.81 1 61 
A GLN 62 2 63.17 1 62 
A VAL 63 2 66.50 1 63 
A GLY 64 2 70.32 1 64 
A GLN 65 2 57.15 1 65 
A VAL 66 2 62.60 1 66 
A GLU 67 2 60.09 1 67 
A LEU 68 2 61.60 1 68 
A GLY 69 2 56.77 1 69 
A GLY 70 2 53.70 1 70 
#
_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 ALA . 2  A 2  
A 3  1 n LEU . 3  A 3  
A 4  1 n TRP . 4  A 4  
A 5  1 n MET . 5  A 5  
A 6  1 n ARG . 6  A 6  
A 7  1 n LEU . 7  A 7  
A 8  1 n LEU . 8  A 8  
A 9  1 n PRO . 9  A 9  
A 10 1 n LEU . 10 A 10 
A 11 1 n LEU . 11 A 11 
A 12 1 n ALA . 12 A 12 
A 13 1 n LEU . 13 A 13 
A 14 1 n LEU . 14 A 14 
A 15 1 n ALA . 15 A 15 
A 16 1 n LEU . 16 A 16 
A 17 1 n TRP . 17 A 17 
A 18 1 n GLY . 18 A 18 
A 19 1 n PRO . 19 A 19 
A 20 1 n ASP . 20 A 20 
A 21 1 n PRO . 21 A 21 
A 22 1 n ALA . 22 A 22 
A 23 1 n ALA . 23 A 23 
A 24 1 n ALA . 24 A 24 
A 25 1 n PHE . 25 A 25 
A 26 1 n VAL . 26 A 26 
A 27 1 n ASN . 27 A 27 
A 28 1 n GLN . 28 A 28 
A 29 1 n HIS . 29 A 29 
A 30 1 n LEU . 30 A 30 
A 31 1 n CYS . 31 A 31 
A 32 1 n GLY . 32 A 32 
A 33 1 n SER . 33 A 33 
A 34 1 n HIS . 34 A 34 
A 35 1 n LEU . 35 A 35 
A 36 1 n VAL . 36 A 36 
A 37 1 n GLU . 37 A 37 
A 38 1 n ALA . 38 A 38 
A 39 1 n LEU . 39 A 39 
A 40 1 n TYR . 40 A 40 
A 41 1 n LEU . 41 A 41 
A 42 1 n VAL . 42 A 42 
A 43 1 n CYS . 43 A 43 
A 44 1 n GLY . 44 A 44 
A 45 1 n GLU . 45 A 45 
A 46 1 n ARG . 46 A 46 
A 47 1 n GLY . 47 A 47 
A 48 1 n PHE . 48 A 48 
A 49 1 n PHE . 49 A 49 
A 50 1 n TYR . 50 A 50 
A 51 1 n THR . 51 A 51 
A 52 1 n PRO . 52 A 52 
A 53 1 n LYS . 53 A 53 
A 54 1 n THR . 54 A 54 
A 55 1 n ARG . 55 A 55 
A 56 1 n ARG . 56 A 56 
A 57 1 n GLU . 57 A 57 
A 58 1 n ALA . 58 A 58 
A 59 1 n GLU . 59 A 59 
A 60 1 n ASP . 60 A 60 
A 61 1 n LEU . 61 A 61 
A 62 1 n GLN . 62 A 62 
A 63 1 n VAL . 63 A 63 
A 64 1 n GLY . 64 A 64 
A 65 1 n GLN . 65 A 65 
A 66 1 n VAL . 66 A 66 
A 67 1 n GLU . 67 A 67 
A 68 1 n LEU . 68 A 68 
A 69 1 n GLY . 69 A 69 
A 70 1 n GLY . 70 A 70 
#
_software.classification other
_software.date           ?
_software.description    "Structure prediction"
_software.name           AlphaFold
_software.pdbx_ordinal   1
_software.type           package
_software.version        "AlphaFold-beta-20231127 (25b635fa27adb4b12654a9dc6367a96b1463ec03aa886066ffc6cf0691bbe007)"
#
_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  ? 6.647   -27.969 37.270  1.00 80.98 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? 7.612   -28.169 36.170  1.00 82.07 1  A 1 
ATOM 3   C C   . MET A 1 1  ? 6.933   -28.529 34.847  1.00 80.25 1  A 1 
ATOM 4   O O   . MET A 1 1  ? 7.213   -27.873 33.856  1.00 77.81 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? 8.706   -29.174 36.562  1.00 76.16 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? 9.513   -28.711 37.796  1.00 70.09 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? 10.215  -27.043 37.647  1.00 65.60 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? 11.115  -26.905 39.206  1.00 55.95 1  A 1 
ATOM 9   N N   . ALA A 1 2  ? 5.977   -29.475 34.804  1.00 89.98 2  A 1 
ATOM 10  C CA  . ALA A 1 2  ? 5.326   -29.901 33.547  1.00 88.67 2  A 1 
ATOM 11  C C   . ALA A 1 2  ? 4.427   -28.839 32.868  1.00 87.77 2  A 1 
ATOM 12  O O   . ALA A 1 2  ? 4.303   -28.822 31.642  1.00 84.20 2  A 1 
ATOM 13  C CB  . ALA A 1 2  ? 4.537   -31.175 33.846  1.00 84.72 2  A 1 
ATOM 14  N N   . LEU A 1 3  ? 3.814   -27.927 33.632  1.00 91.54 3  A 1 
ATOM 15  C CA  . LEU A 1 3  ? 2.949   -26.853 33.106  1.00 90.27 3  A 1 
ATOM 16  C C   . LEU A 1 3  ? 3.729   -25.828 32.271  1.00 90.97 3  A 1 
ATOM 17  O O   . LEU A 1 3  ? 3.261   -25.418 31.211  1.00 89.82 3  A 1 
ATOM 18  C CB  . LEU A 1 3  ? 2.212   -26.185 34.284  1.00 89.45 3  A 1 
ATOM 19  C CG  . LEU A 1 3  ? 0.687   -26.401 34.238  1.00 77.73 3  A 1 
ATOM 20  C CD1 . LEU A 1 3  ? 0.182   -26.949 35.574  1.00 71.86 3  A 1 
ATOM 21  C CD2 . LEU A 1 3  ? -0.043  -25.093 33.949  1.00 74.65 3  A 1 
ATOM 22  N N   . TRP A 1 4  ? 4.943   -25.480 32.694  1.00 91.11 4  A 1 
ATOM 23  C CA  . TRP A 1 4  ? 5.822   -24.553 31.968  1.00 89.54 4  A 1 
ATOM 24  C C   . TRP A 1 4  ? 6.277   -25.110 30.616  1.00 90.31 4  A 1 
ATOM 25  O O   . TRP A 1 4  ? 6.268   -24.386 29.620  1.00 88.76 4  A 1 
ATOM 26  C CB  . TRP A 1 4  ? 7.017   -24.189 32.857  1.00 87.25 4  A 1 
ATOM 27  C CG  . TRP A 1 4  ? 6.903   -22.864 33.538  1.00 78.91 4  A 1 
ATOM 28  C CD1 . TRP A 1 4  ? 5.911   -22.463 34.365  1.00 70.15 4  A 1 
ATOM 29  C CD2 . TRP A 1 4  ? 7.816   -21.727 33.426  1.00 72.33 4  A 1 
ATOM 30  N NE1 . TRP A 1 4  ? 6.143   -21.161 34.760  1.00 64.44 4  A 1 
ATOM 31  C CE2 . TRP A 1 4  ? 7.304   -20.661 34.216  1.00 67.96 4  A 1 
ATOM 32  C CE3 . TRP A 1 4  ? 9.026   -21.505 32.738  1.00 63.34 4  A 1 
ATOM 33  C CZ2 . TRP A 1 4  ? 7.957   -19.422 34.317  1.00 67.52 4  A 1 
ATOM 34  C CZ3 . TRP A 1 4  ? 9.692   -20.261 32.840  1.00 64.20 4  A 1 
ATOM 35  C CH2 . TRP A 1 4  ? 9.156   -19.224 33.621  1.00 64.73 4  A 1 
ATOM 36  N N   . MET A 1 5  ? 6.572   -26.409 30.540  1.00 91.52 5  A 1 
ATOM 37  C CA  . MET A 1 5  ? 6.935   -27.070 29.276  1.00 90.35 5  A 1 
ATOM 38  C C   . MET A 1 5  ? 5.774   -27.124 28.269  1.00 90.72 5  A 1 
ATOM 39  O O   . MET A 1 5  ? 6.025   -27.199 27.070  1.00 91.20 5  A 1 
ATOM 40  C CB  . MET A 1 5  ? 7.449   -28.487 29.551  1.00 90.31 5  A 1 
ATOM 41  C CG  . MET A 1 5  ? 8.892   -28.470 30.065  1.00 79.39 5  A 1 
ATOM 42  S SD  . MET A 1 5  ? 9.512   -30.096 30.580  1.00 73.50 5  A 1 
ATOM 43  C CE  . MET A 1 5  ? 9.521   -31.001 29.009  1.00 63.98 5  A 1 
ATOM 44  N N   . ARG A 1 6  ? 4.515   -27.063 28.724  1.00 91.22 6  A 1 
ATOM 45  C CA  . ARG A 1 6  ? 3.332   -27.006 27.845  1.00 89.47 6  A 1 
ATOM 46  C C   . ARG A 1 6  ? 2.960   -25.575 27.432  1.00 91.19 6  A 1 
ATOM 47  O O   . ARG A 1 6  ? 2.374   -25.396 26.369  1.00 91.41 6  A 1 
ATOM 48  C CB  . ARG A 1 6  ? 2.155   -27.716 28.520  1.00 89.15 6  A 1 
ATOM 49  C CG  . ARG A 1 6  ? 2.399   -29.231 28.666  1.00 83.00 6  A 1 
ATOM 50  C CD  . ARG A 1 6  ? 1.201   -30.040 28.217  1.00 79.70 6  A 1 
ATOM 51  N NE  . ARG A 1 6  ? 1.433   -31.491 28.317  1.00 74.34 6  A 1 
ATOM 52  C CZ  . ARG A 1 6  ? 0.537   -32.441 28.116  1.00 67.89 6  A 1 
ATOM 53  N NH1 . ARG A 1 6  ? -0.706  -32.173 27.823  1.00 61.80 6  A 1 
ATOM 54  N NH2 . ARG A 1 6  ? 0.876   -33.697 28.216  1.00 64.35 6  A 1 
ATOM 55  N N   . LEU A 1 7  ? 3.312   -24.562 28.235  1.00 93.10 7  A 1 
ATOM 56  C CA  . LEU A 1 7  ? 3.071   -23.145 27.935  1.00 92.68 7  A 1 
ATOM 57  C C   . LEU A 1 7  ? 4.111   -22.554 26.966  1.00 93.79 7  A 1 
ATOM 58  O O   . LEU A 1 7  ? 3.765   -21.681 26.172  1.00 94.02 7  A 1 
ATOM 59  C CB  . LEU A 1 7  ? 3.029   -22.366 29.261  1.00 92.73 7  A 1 
ATOM 60  C CG  . LEU A 1 7  ? 1.682   -22.501 29.993  1.00 85.69 7  A 1 
ATOM 61  C CD1 . LEU A 1 7  ? 1.837   -22.151 31.471  1.00 79.05 7  A 1 
ATOM 62  C CD2 . LEU A 1 7  ? 0.630   -21.562 29.392  1.00 81.73 7  A 1 
ATOM 63  N N   . LEU A 1 8  ? 5.344   -23.064 26.984  1.00 93.18 8  A 1 
ATOM 64  C CA  . LEU A 1 8  ? 6.429   -22.669 26.076  1.00 92.01 8  A 1 
ATOM 65  C C   . LEU A 1 8  ? 6.053   -22.737 24.582  1.00 92.66 8  A 1 
ATOM 66  O O   . LEU A 1 8  ? 6.241   -21.736 23.887  1.00 93.43 8  A 1 
ATOM 67  C CB  . LEU A 1 8  ? 7.680   -23.505 26.411  1.00 92.12 8  A 1 
ATOM 68  C CG  . LEU A 1 8  ? 8.808   -22.664 27.029  1.00 81.21 8  A 1 
ATOM 69  C CD1 . LEU A 1 8  ? 9.664   -23.516 27.968  1.00 74.76 8  A 1 
ATOM 70  C CD2 . LEU A 1 8  ? 9.710   -22.090 25.947  1.00 76.71 8  A 1 
ATOM 71  N N   . PRO A 1 9  ? 5.490   -23.834 24.044  1.00 91.67 9  A 1 
ATOM 72  C CA  . PRO A 1 9  ? 5.112   -23.894 22.634  1.00 91.02 9  A 1 
ATOM 73  C C   . PRO A 1 9  ? 3.929   -22.974 22.299  1.00 91.44 9  A 1 
ATOM 74  O O   . PRO A 1 9  ? 3.863   -22.463 21.187  1.00 92.29 9  A 1 
ATOM 75  C CB  . PRO A 1 9  ? 4.795   -25.370 22.351  1.00 89.92 9  A 1 
ATOM 76  C CG  . PRO A 1 9  ? 4.393   -25.924 23.710  1.00 89.39 9  A 1 
ATOM 77  C CD  . PRO A 1 9  ? 5.279   -25.136 24.663  1.00 92.31 9  A 1 
ATOM 78  N N   . LEU A 1 10 ? 3.021   -22.708 23.254  1.00 91.68 10 A 1 
ATOM 79  C CA  . LEU A 1 10 ? 1.912   -21.761 23.084  1.00 90.49 10 A 1 
ATOM 80  C C   . LEU A 1 10 ? 2.408   -20.315 22.978  1.00 91.34 10 A 1 
ATOM 81  O O   . LEU A 1 10 ? 1.955   -19.571 22.108  1.00 92.06 10 A 1 
ATOM 82  C CB  . LEU A 1 10 ? 0.923   -21.953 24.250  1.00 90.69 10 A 1 
ATOM 83  C CG  . LEU A 1 10 ? -0.364  -22.675 23.821  1.00 81.34 10 A 1 
ATOM 84  C CD1 . LEU A 1 10 ? -1.012  -23.384 25.004  1.00 77.00 10 A 1 
ATOM 85  C CD2 . LEU A 1 10 ? -1.374  -21.673 23.248  1.00 78.93 10 A 1 
ATOM 86  N N   . LEU A 1 11 ? 3.385   -19.934 23.812  1.00 91.77 11 A 1 
ATOM 87  C CA  . LEU A 1 11 ? 4.059   -18.636 23.742  1.00 89.71 11 A 1 
ATOM 88  C C   . LEU A 1 11 ? 4.861   -18.471 22.447  1.00 89.81 11 A 1 
ATOM 89  O O   . LEU A 1 11 ? 4.825   -17.402 21.843  1.00 90.61 11 A 1 
ATOM 90  C CB  . LEU A 1 11 ? 4.959   -18.478 24.983  1.00 90.00 11 A 1 
ATOM 91  C CG  . LEU A 1 11 ? 4.283   -17.647 26.087  1.00 83.28 11 A 1 
ATOM 92  C CD1 . LEU A 1 11 ? 4.767   -18.074 27.467  1.00 78.50 11 A 1 
ATOM 93  C CD2 . LEU A 1 11 ? 4.600   -16.163 25.899  1.00 80.60 11 A 1 
ATOM 94  N N   . ALA A 1 12 ? 5.527   -19.534 21.987  1.00 91.86 12 A 1 
ATOM 95  C CA  . ALA A 1 12 ? 6.230   -19.535 20.705  1.00 89.95 12 A 1 
ATOM 96  C C   . ALA A 1 12 ? 5.259   -19.349 19.525  1.00 89.43 12 A 1 
ATOM 97  O O   . ALA A 1 12 ? 5.546   -18.565 18.624  1.00 88.97 12 A 1 
ATOM 98  C CB  . ALA A 1 12 ? 7.039   -20.830 20.583  1.00 89.78 12 A 1 
ATOM 99  N N   . LEU A 1 13 ? 4.086   -19.993 19.550  1.00 90.71 13 A 1 
ATOM 100 C CA  . LEU A 1 13 ? 3.043   -19.789 18.541  1.00 88.03 13 A 1 
ATOM 101 C C   . LEU A 1 13 ? 2.522   -18.349 18.540  1.00 87.60 13 A 1 
ATOM 102 O O   . LEU A 1 13 ? 2.390   -17.755 17.475  1.00 87.88 13 A 1 
ATOM 103 C CB  . LEU A 1 13 ? 1.880   -20.779 18.746  1.00 88.39 13 A 1 
ATOM 104 C CG  . LEU A 1 13 ? 1.632   -21.662 17.503  1.00 80.54 13 A 1 
ATOM 105 C CD1 . LEU A 1 13 ? 2.340   -23.009 17.656  1.00 77.73 13 A 1 
ATOM 106 C CD2 . LEU A 1 13 ? 0.144   -21.918 17.314  1.00 79.58 13 A 1 
ATOM 107 N N   . LEU A 1 14 ? 2.261   -17.758 19.718  1.00 89.75 14 A 1 
ATOM 108 C CA  . LEU A 1 14 ? 1.846   -16.355 19.824  1.00 86.48 14 A 1 
ATOM 109 C C   . LEU A 1 14 ? 2.914   -15.389 19.298  1.00 85.70 14 A 1 
ATOM 110 O O   . LEU A 1 14 ? 2.569   -14.388 18.676  1.00 85.28 14 A 1 
ATOM 111 C CB  . LEU A 1 14 ? 1.493   -15.998 21.279  1.00 86.74 14 A 1 
ATOM 112 C CG  . LEU A 1 14 ? -0.022  -15.869 21.514  1.00 81.97 14 A 1 
ATOM 113 C CD1 . LEU A 1 14 ? -0.613  -17.181 22.025  1.00 78.90 14 A 1 
ATOM 114 C CD2 . LEU A 1 14 ? -0.301  -14.777 22.542  1.00 80.26 14 A 1 
ATOM 115 N N   . ALA A 1 15 ? 4.191   -15.685 19.520  1.00 88.56 15 A 1 
ATOM 116 C CA  . ALA A 1 15 ? 5.297   -14.875 19.012  1.00 85.36 15 A 1 
ATOM 117 C C   . ALA A 1 15 ? 5.430   -14.963 17.479  1.00 83.68 15 A 1 
ATOM 118 O O   . ALA A 1 15 ? 5.742   -13.959 16.846  1.00 82.53 15 A 1 
ATOM 119 C CB  . ALA A 1 15 ? 6.583   -15.299 19.726  1.00 85.52 15 A 1 
ATOM 120 N N   . LEU A 1 16 ? 5.139   -16.118 16.870  1.00 87.37 16 A 1 
ATOM 121 C CA  . LEU A 1 16 ? 5.088   -16.269 15.405  1.00 84.03 16 A 1 
ATOM 122 C C   . LEU A 1 16 ? 3.908   -15.522 14.765  1.00 82.89 16 A 1 
ATOM 123 O O   . LEU A 1 16 ? 3.992   -15.134 13.603  1.00 81.30 16 A 1 
ATOM 124 C CB  . LEU A 1 16 ? 5.018   -17.760 15.015  1.00 84.58 16 A 1 
ATOM 125 C CG  . LEU A 1 16 ? 6.373   -18.350 14.591  1.00 79.50 16 A 1 
ATOM 126 C CD1 . LEU A 1 16 ? 7.099   -18.995 15.766  1.00 77.68 16 A 1 
ATOM 127 C CD2 . LEU A 1 16 ? 6.169   -19.418 13.515  1.00 77.54 16 A 1 
ATOM 128 N N   . TRP A 1 17 ? 2.817   -15.303 15.508  1.00 83.28 17 A 1 
ATOM 129 C CA  . TRP A 1 17 ? 1.667   -14.489 15.100  1.00 78.95 17 A 1 
ATOM 130 C C   . TRP A 1 17 ? 1.836   -13.002 15.446  1.00 76.95 17 A 1 
ATOM 131 O O   . TRP A 1 17 ? 0.889   -12.228 15.348  1.00 73.00 17 A 1 
ATOM 132 C CB  . TRP A 1 17 ? 0.384   -15.084 15.706  1.00 78.65 17 A 1 
ATOM 133 C CG  . TRP A 1 17 ? -0.156  -16.289 14.988  1.00 75.33 17 A 1 
ATOM 134 C CD1 . TRP A 1 17 ? 0.462   -17.474 14.824  1.00 67.74 17 A 1 
ATOM 135 C CD2 . TRP A 1 17 ? -1.450  -16.433 14.324  1.00 72.20 17 A 1 
ATOM 136 N NE1 . TRP A 1 17 ? -0.340  -18.336 14.103  1.00 63.34 17 A 1 
ATOM 137 C CE2 . TRP A 1 17 ? -1.536  -17.749 13.775  1.00 66.09 17 A 1 
ATOM 138 C CE3 . TRP A 1 17 ? -2.557  -15.587 14.136  1.00 63.41 17 A 1 
ATOM 139 C CZ2 . TRP A 1 17 ? -2.663  -18.203 13.073  1.00 65.16 17 A 1 
ATOM 140 C CZ3 . TRP A 1 17 ? -3.696  -16.029 13.435  1.00 60.88 17 A 1 
ATOM 141 C CH2 . TRP A 1 17 ? -3.753  -17.332 12.902  1.00 61.43 17 A 1 
ATOM 142 N N   . GLY A 1 18 ? 3.025   -12.604 15.874  1.00 74.34 18 A 1 
ATOM 143 C CA  . GLY A 1 18 ? 3.360   -11.201 16.107  1.00 71.38 18 A 1 
ATOM 144 C C   . GLY A 1 18 ? 3.223   -10.373 14.821  1.00 69.20 18 A 1 
ATOM 145 O O   . GLY A 1 18 ? 3.302   -10.921 13.720  1.00 66.52 18 A 1 
ATOM 146 N N   . PRO A 1 19 ? 3.006   -9.052  14.939  1.00 68.55 19 A 1 
ATOM 147 C CA  . PRO A 1 19 ? 2.833   -8.180  13.783  1.00 67.84 19 A 1 
ATOM 148 C C   . PRO A 1 19 ? 4.056   -8.280  12.870  1.00 66.93 19 A 1 
ATOM 149 O O   . PRO A 1 19 ? 5.186   -8.047  13.300  1.00 62.58 19 A 1 
ATOM 150 C CB  . PRO A 1 19 ? 2.626   -6.772  14.348  1.00 65.92 19 A 1 
ATOM 151 C CG  . PRO A 1 19 ? 3.269   -6.838  15.733  1.00 65.06 19 A 1 
ATOM 152 C CD  . PRO A 1 19 ? 3.026   -8.286  16.158  1.00 68.63 19 A 1 
ATOM 153 N N   . ASP A 1 20 ? 3.811   -8.655  11.616  1.00 61.89 20 A 1 
ATOM 154 C CA  . ASP A 1 20 ? 4.828   -8.772  10.582  1.00 63.99 20 A 1 
ATOM 155 C C   . ASP A 1 20 ? 5.662   -7.477  10.524  1.00 63.22 20 A 1 
ATOM 156 O O   . ASP A 1 20 ? 5.082   -6.385  10.414  1.00 61.53 20 A 1 
ATOM 157 C CB  . ASP A 1 20 ? 4.150   -9.040  9.221   1.00 61.88 20 A 1 
ATOM 158 C CG  . ASP A 1 20 ? 4.565   -10.368 8.611   1.00 55.72 20 A 1 
ATOM 159 O OD1 . ASP A 1 20 ? 5.768   -10.471 8.284   1.00 53.17 20 A 1 
ATOM 160 O OD2 . ASP A 1 20 ? 3.683   -11.243 8.465   1.00 53.20 20 A 1 
ATOM 161 N N   . PRO A 1 21 ? 7.002   -7.535  10.543  1.00 54.78 21 A 1 
ATOM 162 C CA  . PRO A 1 21 ? 7.843   -6.350  10.375  1.00 55.77 21 A 1 
ATOM 163 C C   . PRO A 1 21 ? 7.601   -5.639  9.033   1.00 56.10 21 A 1 
ATOM 164 O O   . PRO A 1 21 ? 7.887   -4.454  8.902   1.00 54.41 21 A 1 
ATOM 165 C CB  . PRO A 1 21 ? 9.288   -6.853  10.526  1.00 54.61 21 A 1 
ATOM 166 C CG  . PRO A 1 21 ? 9.196   -8.342  10.187  1.00 52.29 21 A 1 
ATOM 167 C CD  . PRO A 1 21 ? 7.806   -8.731  10.678  1.00 56.38 21 A 1 
ATOM 168 N N   . ALA A 1 22 ? 6.975   -6.323  8.061   1.00 53.47 22 A 1 
ATOM 169 C CA  . ALA A 1 22 ? 6.497   -5.730  6.814   1.00 54.40 22 A 1 
ATOM 170 C C   . ALA A 1 22 ? 5.428   -4.638  7.027   1.00 55.01 22 A 1 
ATOM 171 O O   . ALA A 1 22 ? 5.368   -3.679  6.255   1.00 53.00 22 A 1 
ATOM 172 C CB  . ALA A 1 22 ? 5.959   -6.863  5.933   1.00 52.05 22 A 1 
ATOM 173 N N   . ALA A 1 23 ? 4.627   -4.708  8.097   1.00 54.33 23 A 1 
ATOM 174 C CA  . ALA A 1 23 ? 3.642   -3.677  8.427   1.00 56.69 23 A 1 
ATOM 175 C C   . ALA A 1 23 ? 4.286   -2.336  8.827   1.00 57.13 23 A 1 
ATOM 176 O O   . ALA A 1 23 ? 3.677   -1.281  8.650   1.00 55.47 23 A 1 
ATOM 177 C CB  . ALA A 1 23 ? 2.727   -4.210  9.534   1.00 54.90 23 A 1 
ATOM 178 N N   . ALA A 1 24 ? 5.540   -2.348  9.305   1.00 51.53 24 A 1 
ATOM 179 C CA  . ALA A 1 24 ? 6.280   -1.125  9.616   1.00 52.77 24 A 1 
ATOM 180 C C   . ALA A 1 24 ? 6.667   -0.332  8.354   1.00 53.36 24 A 1 
ATOM 181 O O   . ALA A 1 24 ? 6.741   0.893   8.405   1.00 51.93 24 A 1 
ATOM 182 C CB  . ALA A 1 24 ? 7.505   -1.487  10.455  1.00 50.86 24 A 1 
ATOM 183 N N   . PHE A 1 25 ? 6.848   -1.000  7.208   1.00 50.61 25 A 1 
ATOM 184 C CA  . PHE A 1 25 ? 7.140   -0.336  5.933   1.00 52.25 25 A 1 
ATOM 185 C C   . PHE A 1 25 ? 5.931   0.410   5.361   1.00 52.22 25 A 1 
ATOM 186 O O   . PHE A 1 25 ? 6.094   1.443   4.714   1.00 51.47 25 A 1 
ATOM 187 C CB  . PHE A 1 25 ? 7.674   -1.363  4.924   1.00 51.68 25 A 1 
ATOM 188 C CG  . PHE A 1 25 ? 9.188   -1.361  4.834   1.00 48.28 25 A 1 
ATOM 189 C CD1 . PHE A 1 25 ? 9.828   -0.481  3.938   1.00 44.78 25 A 1 
ATOM 190 C CD2 . PHE A 1 25 ? 9.963   -2.214  5.644   1.00 43.72 25 A 1 
ATOM 191 C CE1 . PHE A 1 25 ? 11.234  -0.455  3.852   1.00 39.92 25 A 1 
ATOM 192 C CE2 . PHE A 1 25 ? 11.369  -2.186  5.562   1.00 40.78 25 A 1 
ATOM 193 C CZ  . PHE A 1 25 ? 12.006  -1.306  4.662   1.00 41.97 25 A 1 
ATOM 194 N N   . VAL A 1 26 ? 4.713   -0.065  5.632   1.00 53.07 26 A 1 
ATOM 195 C CA  . VAL A 1 26 ? 3.472   0.551   5.127   1.00 55.32 26 A 1 
ATOM 196 C C   . VAL A 1 26 ? 3.189   1.909   5.789   1.00 56.48 26 A 1 
ATOM 197 O O   . VAL A 1 26 ? 2.518   2.756   5.203   1.00 54.69 26 A 1 
ATOM 198 C CB  . VAL A 1 26 ? 2.282   -0.416  5.291   1.00 53.28 26 A 1 
ATOM 199 C CG1 . VAL A 1 26 ? 1.002   0.122   4.631   1.00 48.72 26 A 1 
ATOM 200 C CG2 . VAL A 1 26 ? 2.572   -1.780  4.638   1.00 49.77 26 A 1 
ATOM 201 N N   . ASN A 1 27 ? 3.733   2.155   6.981   1.00 54.78 27 A 1 
ATOM 202 C CA  . ASN A 1 27 ? 3.554   3.415   7.710   1.00 56.79 27 A 1 
ATOM 203 C C   . ASN A 1 27 ? 4.602   4.494   7.382   1.00 57.69 27 A 1 
ATOM 204 O O   . ASN A 1 27 ? 4.535   5.592   7.933   1.00 56.57 27 A 1 
ATOM 205 C CB  . ASN A 1 27 ? 3.461   3.112   9.215   1.00 54.75 27 A 1 
ATOM 206 C CG  . ASN A 1 27 ? 2.060   2.697   9.628   1.00 49.31 27 A 1 
ATOM 207 O OD1 . ASN A 1 27 ? 1.060   3.224   9.176   1.00 46.09 27 A 1 
ATOM 208 N ND2 . ASN A 1 27 ? 1.934   1.758   10.531  1.00 44.78 27 A 1 
ATOM 209 N N   . GLN A 1 28 ? 5.560   4.218   6.490   1.00 69.62 28 A 1 
ATOM 210 C CA  . GLN A 1 28 ? 6.486   5.247   6.025   1.00 69.85 28 A 1 
ATOM 211 C C   . GLN A 1 28 ? 5.793   6.116   4.976   1.00 71.59 28 A 1 
ATOM 212 O O   . GLN A 1 28 ? 5.779   5.820   3.784   1.00 70.24 28 A 1 
ATOM 213 C CB  . GLN A 1 28 ? 7.804   4.639   5.524   1.00 67.24 28 A 1 
ATOM 214 C CG  . GLN A 1 28 ? 8.607   4.050   6.694   1.00 59.14 28 A 1 
ATOM 215 C CD  . GLN A 1 28 ? 10.013  3.611   6.296   1.00 57.23 28 A 1 
ATOM 216 O OE1 . GLN A 1 28 ? 10.463  3.737   5.171   1.00 51.56 28 A 1 
ATOM 217 N NE2 . GLN A 1 28 ? 10.786  3.084   7.222   1.00 47.44 28 A 1 
ATOM 218 N N   . HIS A 1 29 ? 5.194   7.211   5.432   1.00 75.47 29 A 1 
ATOM 219 C CA  . HIS A 1 29 ? 4.619   8.219   4.546   1.00 77.31 29 A 1 
ATOM 220 C C   . HIS A 1 29 ? 5.754   8.948   3.819   1.00 79.06 29 A 1 
ATOM 221 O O   . HIS A 1 29 ? 6.523   9.685   4.431   1.00 76.99 29 A 1 
ATOM 222 C CB  . HIS A 1 29 ? 3.736   9.184   5.353   1.00 75.03 29 A 1 
ATOM 223 C CG  . HIS A 1 29 ? 2.497   8.528   5.914   1.00 67.48 29 A 1 
ATOM 224 N ND1 . HIS A 1 29 ? 2.439   7.687   7.007   1.00 59.25 29 A 1 
ATOM 225 C CD2 . HIS A 1 29 ? 1.223   8.647   5.431   1.00 58.89 29 A 1 
ATOM 226 C CE1 . HIS A 1 29 ? 1.162   7.304   7.170   1.00 55.27 29 A 1 
ATOM 227 N NE2 . HIS A 1 29 ? 0.374   7.873   6.234   1.00 56.70 29 A 1 
ATOM 228 N N   . LEU A 1 30 ? 5.842   8.754   2.497   1.00 72.24 30 A 1 
ATOM 229 C CA  . LEU A 1 30 ? 6.685   9.577   1.635   1.00 75.36 30 A 1 
ATOM 230 C C   . LEU A 1 30 ? 6.098   10.991  1.620   1.00 78.85 30 A 1 
ATOM 231 O O   . LEU A 1 30 ? 5.031   11.232  1.049   1.00 78.11 30 A 1 
ATOM 232 C CB  . LEU A 1 30 ? 6.739   8.958   0.226   1.00 74.26 30 A 1 
ATOM 233 C CG  . LEU A 1 30 ? 7.670   7.734   0.130   1.00 69.08 30 A 1 
ATOM 234 C CD1 . LEU A 1 30 ? 7.252   6.852   -1.050  1.00 63.10 30 A 1 
ATOM 235 C CD2 . LEU A 1 30 ? 9.124   8.148   -0.080  1.00 63.33 30 A 1 
ATOM 236 N N   . CYS A 1 31 ? 6.771   11.924  2.282   1.00 82.51 31 A 1 
ATOM 237 C CA  . CYS A 1 31 ? 6.315   13.301  2.412   1.00 83.95 31 A 1 
ATOM 238 C C   . CYS A 1 31 ? 7.195   14.254  1.588   1.00 86.23 31 A 1 
ATOM 239 O O   . CYS A 1 31 ? 8.413   14.110  1.524   1.00 83.46 31 A 1 
ATOM 240 C CB  . CYS A 1 31 ? 6.272   13.685  3.898   1.00 80.62 31 A 1 
ATOM 241 S SG  . CYS A 1 31 ? 4.910   12.827  4.722   1.00 73.07 31 A 1 
ATOM 242 N N   . GLY A 1 32 ? 6.575   15.265  1.001   1.00 84.02 32 A 1 
ATOM 243 C CA  . GLY A 1 32 ? 7.266   16.389  0.363   1.00 85.06 32 A 1 
ATOM 244 C C   . GLY A 1 32 ? 8.146   15.994  -0.828  1.00 87.15 32 A 1 
ATOM 245 O O   . GLY A 1 32 ? 7.672   15.369  -1.777  1.00 85.42 32 A 1 
ATOM 246 N N   . SER A 1 33 ? 9.414   16.387  -0.790  1.00 87.81 33 A 1 
ATOM 247 C CA  . SER A 1 33 ? 10.360  16.233  -1.904  1.00 89.66 33 A 1 
ATOM 248 C C   . SER A 1 33 ? 10.558  14.786  -2.351  1.00 89.81 33 A 1 
ATOM 249 O O   . SER A 1 33 ? 10.587  14.533  -3.552  1.00 87.77 33 A 1 
ATOM 250 C CB  . SER A 1 33 ? 11.717  16.843  -1.529  1.00 88.57 33 A 1 
ATOM 251 O OG  . SER A 1 33 ? 12.175  16.316  -0.295  1.00 79.40 33 A 1 
ATOM 252 N N   . HIS A 1 34 ? 10.592  13.824  -1.421  1.00 89.57 34 A 1 
ATOM 253 C CA  . HIS A 1 34 ? 10.761  12.403  -1.757  1.00 89.72 34 A 1 
ATOM 254 C C   . HIS A 1 34 ? 9.591   11.832  -2.567  1.00 90.66 34 A 1 
ATOM 255 O O   . HIS A 1 34 ? 9.792   10.993  -3.441  1.00 89.82 34 A 1 
ATOM 256 C CB  . HIS A 1 34 ? 10.942  11.595  -0.469  1.00 89.11 34 A 1 
ATOM 257 C CG  . HIS A 1 34 ? 12.256  11.857  0.211   1.00 84.13 34 A 1 
ATOM 258 N ND1 . HIS A 1 34 ? 13.500  11.679  -0.354  1.00 71.09 34 A 1 
ATOM 259 C CD2 . HIS A 1 34 ? 12.450  12.302  1.491   1.00 69.93 34 A 1 
ATOM 260 C CE1 . HIS A 1 34 ? 14.415  12.012  0.571   1.00 69.95 34 A 1 
ATOM 261 N NE2 . HIS A 1 34 ? 13.825  12.395  1.712   1.00 72.72 34 A 1 
ATOM 262 N N   . LEU A 1 35 ? 8.368   12.294  -2.317  1.00 88.83 35 A 1 
ATOM 263 C CA  . LEU A 1 35 ? 7.201   11.906  -3.115  1.00 89.21 35 A 1 
ATOM 264 C C   . LEU A 1 35 ? 7.293   12.472  -4.538  1.00 90.46 35 A 1 
ATOM 265 O O   . LEU A 1 35 ? 7.032   11.758  -5.500  1.00 90.30 35 A 1 
ATOM 266 C CB  . LEU A 1 35 ? 5.917   12.364  -2.404  1.00 88.12 35 A 1 
ATOM 267 C CG  . LEU A 1 35 ? 4.622   12.015  -3.165  1.00 84.36 35 A 1 
ATOM 268 C CD1 . LEU A 1 35 ? 4.413   10.506  -3.299  1.00 79.25 35 A 1 
ATOM 269 C CD2 . LEU A 1 35 ? 3.424   12.610  -2.433  1.00 79.04 35 A 1 
ATOM 270 N N   . VAL A 1 36 ? 7.682   13.736  -4.675  1.00 88.82 36 A 1 
ATOM 271 C CA  . VAL A 1 36 ? 7.840   14.398  -5.980  1.00 87.95 36 A 1 
ATOM 272 C C   . VAL A 1 36 ? 8.935   13.720  -6.802  1.00 88.79 36 A 1 
ATOM 273 O O   . VAL A 1 36 ? 8.727   13.444  -7.981  1.00 88.97 36 A 1 
ATOM 274 C CB  . VAL A 1 36 ? 8.130   15.900  -5.808  1.00 85.98 36 A 1 
ATOM 275 C CG1 . VAL A 1 36 ? 8.350   16.602  -7.155  1.00 81.29 36 A 1 
ATOM 276 C CG2 . VAL A 1 36 ? 6.954   16.602  -5.107  1.00 81.30 36 A 1 
ATOM 277 N N   . GLU A 1 37 ? 10.055  13.381  -6.180  1.00 87.05 37 A 1 
ATOM 278 C CA  . GLU A 1 37 ? 11.168  12.688  -6.832  1.00 87.56 37 A 1 
ATOM 279 C C   . GLU A 1 37 ? 10.774  11.274  -7.286  1.00 88.44 37 A 1 
ATOM 280 O O   . GLU A 1 37 ? 11.028  10.898  -8.431  1.00 89.42 37 A 1 
ATOM 281 C CB  . GLU A 1 37 ? 12.358  12.691  -5.865  1.00 87.99 37 A 1 
ATOM 282 C CG  . GLU A 1 37 ? 13.655  12.198  -6.522  1.00 80.27 37 A 1 
ATOM 283 C CD  . GLU A 1 37 ? 14.890  12.494  -5.653  1.00 74.43 37 A 1 
ATOM 284 O OE1 . GLU A 1 37 ? 15.994  12.518  -6.228  1.00 65.12 37 A 1 
ATOM 285 O OE2 . GLU A 1 37 ? 14.725  12.710  -4.429  1.00 65.56 37 A 1 
ATOM 286 N N   . ALA A 1 38 ? 10.059  10.517  -6.455  1.00 90.84 38 A 1 
ATOM 287 C CA  . ALA A 1 38 ? 9.531   9.205   -6.836  1.00 90.19 38 A 1 
ATOM 288 C C   . ALA A 1 38 ? 8.547   9.295   -8.018  1.00 90.85 38 A 1 
ATOM 289 O O   . ALA A 1 38 ? 8.619   8.496   -8.951  1.00 90.11 38 A 1 
ATOM 290 C CB  . ALA A 1 38 ? 8.874   8.567   -5.605  1.00 89.47 38 A 1 
ATOM 291 N N   . LEU A 1 39 ? 7.653   10.283  -8.022  1.00 90.35 39 A 1 
ATOM 292 C CA  . LEU A 1 39 ? 6.727   10.526  -9.135  1.00 89.36 39 A 1 
ATOM 293 C C   . LEU A 1 39 ? 7.468   10.912  -10.419 1.00 90.01 39 A 1 
ATOM 294 O O   . LEU A 1 39 ? 7.116   10.422  -11.490 1.00 89.38 39 A 1 
ATOM 295 C CB  . LEU A 1 39 ? 5.722   11.622  -8.746  1.00 88.34 39 A 1 
ATOM 296 C CG  . LEU A 1 39 ? 4.670   11.174  -7.719  1.00 83.21 39 A 1 
ATOM 297 C CD1 . LEU A 1 39 ? 3.879   12.390  -7.245  1.00 78.09 39 A 1 
ATOM 298 C CD2 . LEU A 1 39 ? 3.691   10.150  -8.292  1.00 78.32 39 A 1 
ATOM 299 N N   . TYR A 1 40 ? 8.504   11.732  -10.323 1.00 89.68 40 A 1 
ATOM 300 C CA  . TYR A 1 40 ? 9.330   12.117  -11.464 1.00 88.69 40 A 1 
ATOM 301 C C   . TYR A 1 40 ? 10.072  10.917  -12.063 1.00 89.52 40 A 1 
ATOM 302 O O   . TYR A 1 40 ? 10.066  10.742  -13.280 1.00 89.00 40 A 1 
ATOM 303 C CB  . TYR A 1 40 ? 10.302  13.222  -11.041 1.00 87.52 40 A 1 
ATOM 304 C CG  . TYR A 1 40 ? 11.032  13.835  -12.217 1.00 81.31 40 A 1 
ATOM 305 C CD1 . TYR A 1 40 ? 12.319  13.387  -12.571 1.00 75.25 40 A 1 
ATOM 306 C CD2 . TYR A 1 40 ? 10.398  14.835  -12.984 1.00 74.16 40 A 1 
ATOM 307 C CE1 . TYR A 1 40 ? 12.976  13.943  -13.689 1.00 70.84 40 A 1 
ATOM 308 C CE2 . TYR A 1 40 ? 11.050  15.390  -14.103 1.00 71.53 40 A 1 
ATOM 309 C CZ  . TYR A 1 40 ? 12.342  14.940  -14.453 1.00 71.92 40 A 1 
ATOM 310 O OH  . TYR A 1 40 ? 12.971  15.471  -15.538 1.00 70.28 40 A 1 
ATOM 311 N N   . LEU A 1 41 ? 10.630  10.034  -11.225 1.00 90.18 41 A 1 
ATOM 312 C CA  . LEU A 1 41 ? 11.298  8.806   -11.674 1.00 90.19 41 A 1 
ATOM 313 C C   . LEU A 1 41 ? 10.339  7.835   -12.380 1.00 90.43 41 A 1 
ATOM 314 O O   . LEU A 1 41 ? 10.714  7.212   -13.371 1.00 89.51 41 A 1 
ATOM 315 C CB  . LEU A 1 41 ? 11.954  8.117   -10.464 1.00 90.41 41 A 1 
ATOM 316 C CG  . LEU A 1 41 ? 13.228  8.814   -9.948  1.00 81.38 41 A 1 
ATOM 317 C CD1 . LEU A 1 41 ? 13.648  8.180   -8.624  1.00 75.64 41 A 1 
ATOM 318 C CD2 . LEU A 1 41 ? 14.395  8.686   -10.929 1.00 75.72 41 A 1 
ATOM 319 N N   . VAL A 1 42 ? 9.102   7.698   -11.898 1.00 91.43 42 A 1 
ATOM 320 C CA  . VAL A 1 42 ? 8.111   6.758   -12.458 1.00 90.52 42 A 1 
ATOM 321 C C   . VAL A 1 42 ? 7.433   7.311   -13.713 1.00 90.38 42 A 1 
ATOM 322 O O   . VAL A 1 42 ? 7.236   6.579   -14.683 1.00 88.67 42 A 1 
ATOM 323 C CB  . VAL A 1 42 ? 7.073   6.378   -11.384 1.00 89.52 42 A 1 
ATOM 324 C CG1 . VAL A 1 42 ? 5.937   5.507   -11.949 1.00 84.16 42 A 1 
ATOM 325 C CG2 . VAL A 1 42 ? 7.730   5.566   -10.256 1.00 83.83 42 A 1 
ATOM 326 N N   . CYS A 1 43 ? 7.044   8.578   -13.701 1.00 91.93 43 A 1 
ATOM 327 C CA  . CYS A 1 43 ? 6.280   9.195   -14.791 1.00 90.86 43 A 1 
ATOM 328 C C   . CYS A 1 43 ? 7.172   9.822   -15.867 1.00 90.48 43 A 1 
ATOM 329 O O   . CYS A 1 43 ? 6.729   9.960   -17.010 1.00 87.78 43 A 1 
ATOM 330 C CB  . CYS A 1 43 ? 5.309   10.228  -14.201 1.00 89.92 43 A 1 
ATOM 331 S SG  . CYS A 1 43 ? 4.133   9.442   -13.067 1.00 87.73 43 A 1 
ATOM 332 N N   . GLY A 1 44 ? 8.410   10.192  -15.537 1.00 90.41 44 A 1 
ATOM 333 C CA  . GLY A 1 44 ? 9.350   10.866  -16.429 1.00 88.14 44 A 1 
ATOM 334 C C   . GLY A 1 44 ? 8.734   12.096  -17.102 1.00 87.42 44 A 1 
ATOM 335 O O   . GLY A 1 44 ? 7.987   12.856  -16.488 1.00 83.15 44 A 1 
ATOM 336 N N   . GLU A 1 45 ? 8.994   12.250  -18.399 1.00 82.72 45 A 1 
ATOM 337 C CA  . GLU A 1 45 ? 8.497   13.375  -19.210 1.00 83.20 45 A 1 
ATOM 338 C C   . GLU A 1 45 ? 6.985   13.324  -19.503 1.00 81.92 45 A 1 
ATOM 339 O O   . GLU A 1 45 ? 6.413   14.301  -19.978 1.00 78.39 45 A 1 
ATOM 340 C CB  . GLU A 1 45 ? 9.265   13.448  -20.540 1.00 81.39 45 A 1 
ATOM 341 C CG  . GLU A 1 45 ? 10.779  13.620  -20.342 1.00 72.45 45 A 1 
ATOM 342 C CD  . GLU A 1 45 ? 11.505  13.997  -21.649 1.00 66.34 45 A 1 
ATOM 343 O OE1 . GLU A 1 45 ? 12.616  14.541  -21.536 1.00 59.56 45 A 1 
ATOM 344 O OE2 . GLU A 1 45 ? 10.943  13.724  -22.735 1.00 59.25 45 A 1 
ATOM 345 N N   . ARG A 1 46 ? 6.314   12.201  -19.209 1.00 86.54 46 A 1 
ATOM 346 C CA  . ARG A 1 46 ? 4.858   12.075  -19.442 1.00 85.36 46 A 1 
ATOM 347 C C   . ARG A 1 46 ? 4.027   12.897  -18.459 1.00 84.78 46 A 1 
ATOM 348 O O   . ARG A 1 46 ? 2.834   13.081  -18.692 1.00 78.94 46 A 1 
ATOM 349 C CB  . ARG A 1 46 ? 4.431   10.599  -19.414 1.00 84.82 46 A 1 
ATOM 350 C CG  . ARG A 1 46 ? 5.115   9.781   -20.518 1.00 77.97 46 A 1 
ATOM 351 C CD  . ARG A 1 46 ? 4.610   8.338   -20.489 1.00 72.70 46 A 1 
ATOM 352 N NE  . ARG A 1 46 ? 5.257   7.520   -21.532 1.00 64.76 46 A 1 
ATOM 353 C CZ  . ARG A 1 46 ? 5.057   6.237   -21.755 1.00 58.44 46 A 1 
ATOM 354 N NH1 . ARG A 1 46 ? 4.214   5.540   -21.038 1.00 55.01 46 A 1 
ATOM 355 N NH2 . ARG A 1 46 ? 5.704   5.623   -22.708 1.00 53.92 46 A 1 
ATOM 356 N N   . GLY A 1 47 ? 4.650   13.372  -17.385 1.00 83.05 47 A 1 
ATOM 357 C CA  . GLY A 1 47 ? 3.988   14.115  -16.321 1.00 82.23 47 A 1 
ATOM 358 C C   . GLY A 1 47 ? 3.096   13.239  -15.443 1.00 83.16 47 A 1 
ATOM 359 O O   . GLY A 1 47 ? 2.821   12.071  -15.726 1.00 78.82 47 A 1 
ATOM 360 N N   . PHE A 1 48 ? 2.641   13.820  -14.337 1.00 80.50 48 A 1 
ATOM 361 C CA  . PHE A 1 48 ? 1.745   13.174  -13.385 1.00 81.09 48 A 1 
ATOM 362 C C   . PHE A 1 48 ? 0.360   13.827  -13.437 1.00 82.05 48 A 1 
ATOM 363 O O   . PHE A 1 48 ? 0.208   15.011  -13.131 1.00 80.01 48 A 1 
ATOM 364 C CB  . PHE A 1 48 ? 2.358   13.230  -11.983 1.00 78.93 48 A 1 
ATOM 365 C CG  . PHE A 1 48 ? 1.450   12.660  -10.911 1.00 75.01 48 A 1 
ATOM 366 C CD1 . PHE A 1 48 ? 0.768   13.523  -10.031 1.00 70.96 48 A 1 
ATOM 367 C CD2 . PHE A 1 48 ? 1.264   11.270  -10.809 1.00 69.73 48 A 1 
ATOM 368 C CE1 . PHE A 1 48 ? -0.082  12.996  -9.046  1.00 64.69 48 A 1 
ATOM 369 C CE2 . PHE A 1 48 ? 0.408   10.740  -9.826  1.00 65.31 48 A 1 
ATOM 370 C CZ  . PHE A 1 48 ? -0.263  11.604  -8.939  1.00 65.48 48 A 1 
ATOM 371 N N   . PHE A 1 49 ? -0.645  13.032  -13.789 1.00 79.61 49 A 1 
ATOM 372 C CA  . PHE A 1 49 ? -2.038  13.479  -13.828 1.00 79.32 49 A 1 
ATOM 373 C C   . PHE A 1 49 ? -2.849  12.709  -12.788 1.00 79.54 49 A 1 
ATOM 374 O O   . PHE A 1 49 ? -3.002  11.489  -12.876 1.00 78.34 49 A 1 
ATOM 375 C CB  . PHE A 1 49 ? -2.607  13.316  -15.243 1.00 78.12 49 A 1 
ATOM 376 C CG  . PHE A 1 49 ? -1.884  14.158  -16.278 1.00 71.51 49 A 1 
ATOM 377 C CD1 . PHE A 1 49 ? -2.220  15.516  -16.450 1.00 66.49 49 A 1 
ATOM 378 C CD2 . PHE A 1 49 ? -0.847  13.595  -17.047 1.00 65.39 49 A 1 
ATOM 379 C CE1 . PHE A 1 49 ? -1.523  16.302  -17.385 1.00 58.62 49 A 1 
ATOM 380 C CE2 . PHE A 1 49 ? -0.147  14.381  -17.980 1.00 60.41 49 A 1 
ATOM 381 C CZ  . PHE A 1 49 ? -0.488  15.735  -18.149 1.00 60.62 49 A 1 
ATOM 382 N N   . TYR A 1 50 ? -3.378  13.425  -11.797 1.00 77.24 50 A 1 
ATOM 383 C CA  . TYR A 1 50 ? -4.241  12.862  -10.772 1.00 77.70 50 A 1 
ATOM 384 C C   . TYR A 1 50 ? -5.693  13.285  -11.008 1.00 79.29 50 A 1 
ATOM 385 O O   . TYR A 1 50 ? -6.039  14.465  -10.925 1.00 78.83 50 A 1 
ATOM 386 C CB  . TYR A 1 50 ? -3.740  13.267  -9.383  1.00 76.00 50 A 1 
ATOM 387 C CG  . TYR A 1 50 ? -4.613  12.730  -8.263  1.00 73.23 50 A 1 
ATOM 388 C CD1 . TYR A 1 50 ? -5.493  13.593  -7.574  1.00 71.20 50 A 1 
ATOM 389 C CD2 . TYR A 1 50 ? -4.570  11.363  -7.927  1.00 69.37 50 A 1 
ATOM 390 C CE1 . TYR A 1 50 ? -6.314  13.093  -6.548  1.00 65.82 50 A 1 
ATOM 391 C CE2 . TYR A 1 50 ? -5.392  10.855  -6.907  1.00 66.75 50 A 1 
ATOM 392 C CZ  . TYR A 1 50 ? -6.265  11.721  -6.213  1.00 67.80 50 A 1 
ATOM 393 O OH  . TYR A 1 50 ? -7.066  11.239  -5.221  1.00 65.51 50 A 1 
ATOM 394 N N   . THR A 1 51 ? -6.546  12.295  -11.271 1.00 75.16 51 A 1 
ATOM 395 C CA  . THR A 1 51 ? -8.001  12.480  -11.295 1.00 76.23 51 A 1 
ATOM 396 C C   . THR A 1 51 ? -8.610  11.885  -10.026 1.00 76.30 51 A 1 
ATOM 397 O O   . THR A 1 51 ? -8.451  10.686  -9.768  1.00 75.14 51 A 1 
ATOM 398 C CB  . THR A 1 51 ? -8.633  11.889  -12.564 1.00 74.23 51 A 1 
ATOM 399 O OG1 . THR A 1 51 ? -8.074  10.640  -12.884 1.00 64.96 51 A 1 
ATOM 400 C CG2 . THR A 1 51 ? -8.387  12.790  -13.772 1.00 64.73 51 A 1 
ATOM 401 N N   . PRO A 1 52 ? -9.293  12.698  -9.201  1.00 75.87 52 A 1 
ATOM 402 C CA  . PRO A 1 52 ? -9.980  12.217  -8.010  1.00 77.22 52 A 1 
ATOM 403 C C   . PRO A 1 52 ? -10.971 11.103  -8.357  1.00 78.36 52 A 1 
ATOM 404 O O   . PRO A 1 52 ? -11.662 11.171  -9.372  1.00 76.01 52 A 1 
ATOM 405 C CB  . PRO A 1 52 ? -10.696 13.435  -7.413  1.00 75.06 52 A 1 
ATOM 406 C CG  . PRO A 1 52 ? -9.902  14.625  -7.945  1.00 71.96 52 A 1 
ATOM 407 C CD  . PRO A 1 52 ? -9.427  14.144  -9.316  1.00 75.88 52 A 1 
ATOM 408 N N   . LYS A 1 53 ? -11.084 10.093  -7.486  1.00 70.13 53 A 1 
ATOM 409 C CA  . LYS A 1 53 ? -11.970 8.935   -7.690  1.00 71.40 53 A 1 
ATOM 410 C C   . LYS A 1 53 ? -13.430 9.347   -7.923  1.00 71.08 53 A 1 
ATOM 411 O O   . LYS A 1 53 ? -14.078 8.809   -8.813  1.00 69.81 53 A 1 
ATOM 412 C CB  . LYS A 1 53 ? -11.820 7.991   -6.488  1.00 69.09 53 A 1 
ATOM 413 C CG  . LYS A 1 53 ? -12.522 6.651   -6.733  1.00 60.75 53 A 1 
ATOM 414 C CD  . LYS A 1 53 ? -12.358 5.695   -5.546  1.00 57.47 53 A 1 
ATOM 415 C CE  . LYS A 1 53 ? -13.164 4.430   -5.851  1.00 52.10 53 A 1 
ATOM 416 N NZ  . LYS A 1 53 ? -13.223 3.498   -4.702  1.00 45.52 53 A 1 
ATOM 417 N N   . THR A 1 54 ? -13.894 10.371  -7.217  1.00 74.25 54 A 1 
ATOM 418 C CA  . THR A 1 54 ? -15.248 10.938  -7.352  1.00 75.01 54 A 1 
ATOM 419 C C   . THR A 1 54 ? -15.537 11.479  -8.753  1.00 74.25 54 A 1 
ATOM 420 O O   . THR A 1 54 ? -16.660 11.379  -9.232  1.00 71.55 54 A 1 
ATOM 421 C CB  . THR A 1 54 ? -15.436 12.081  -6.351  1.00 72.74 54 A 1 
ATOM 422 O OG1 . THR A 1 54 ? -14.374 13.008  -6.466  1.00 62.74 54 A 1 
ATOM 423 C CG2 . THR A 1 54 ? -15.433 11.580  -4.906  1.00 61.72 54 A 1 
ATOM 424 N N   . ARG A 1 55 ? -14.526 12.017  -9.435  1.00 69.16 55 A 1 
ATOM 425 C CA  . ARG A 1 55 ? -14.664 12.507  -10.809 1.00 70.17 55 A 1 
ATOM 426 C C   . ARG A 1 55 ? -14.764 11.354  -11.811 1.00 70.91 55 A 1 
ATOM 427 O O   . ARG A 1 55 ? -15.580 11.435  -12.719 1.00 69.98 55 A 1 
ATOM 428 C CB  . ARG A 1 55 ? -13.515 13.470  -11.130 1.00 68.31 55 A 1 
ATOM 429 C CG  . ARG A 1 55 ? -13.672 14.061  -12.543 1.00 59.22 55 A 1 
ATOM 430 C CD  . ARG A 1 55 ? -12.565 15.073  -12.843 1.00 58.92 55 A 1 
ATOM 431 N NE  . ARG A 1 55 ? -12.658 15.515  -14.240 1.00 54.26 55 A 1 
ATOM 432 C CZ  . ARG A 1 55 ? -11.981 16.490  -14.820 1.00 48.48 55 A 1 
ATOM 433 N NH1 . ARG A 1 55 ? -11.100 17.207  -14.173 1.00 46.79 55 A 1 
ATOM 434 N NH2 . ARG A 1 55 ? -12.193 16.741  -16.078 1.00 45.64 55 A 1 
ATOM 435 N N   . ARG A 1 56 ? -13.989 10.274  -11.627 1.00 63.49 56 A 1 
ATOM 436 C CA  . ARG A 1 56 ? -14.066 9.084   -12.498 1.00 64.84 56 A 1 
ATOM 437 C C   . ARG A 1 56 ? -15.431 8.407   -12.400 1.00 65.94 56 A 1 
ATOM 438 O O   . ARG A 1 56 ? -16.023 8.100   -13.425 1.00 66.89 56 A 1 
ATOM 439 C CB  . ARG A 1 56 ? -12.972 8.067   -12.158 1.00 63.11 56 A 1 
ATOM 440 C CG  . ARG A 1 56 ? -11.556 8.603   -12.393 1.00 56.30 56 A 1 
ATOM 441 C CD  . ARG A 1 56 ? -10.551 7.475   -12.141 1.00 53.86 56 A 1 
ATOM 442 N NE  . ARG A 1 56 ? -9.195  8.000   -11.926 1.00 50.78 56 A 1 
ATOM 443 C CZ  . ARG A 1 56 ? -8.168  7.341   -11.428 1.00 45.26 56 A 1 
ATOM 444 N NH1 . ARG A 1 56 ? -8.233  6.066   -11.151 1.00 44.74 56 A 1 
ATOM 445 N NH2 . ARG A 1 56 ? -7.049  7.960   -11.191 1.00 43.99 56 A 1 
ATOM 446 N N   . GLU A 1 57 ? -15.949 8.238   -11.200 1.00 66.93 57 A 1 
ATOM 447 C CA  . GLU A 1 57 ? -17.282 7.658   -10.976 1.00 68.77 57 A 1 
ATOM 448 C C   . GLU A 1 57 ? -18.394 8.511   -11.617 1.00 68.14 57 A 1 
ATOM 449 O O   . GLU A 1 57 ? -19.354 7.969   -12.163 1.00 67.91 57 A 1 
ATOM 450 C CB  . GLU A 1 57 ? -17.517 7.495   -9.460  1.00 67.17 57 A 1 
ATOM 451 C CG  . GLU A 1 57 ? -16.662 6.361   -8.859  1.00 57.76 57 A 1 
ATOM 452 C CD  . GLU A 1 57 ? -16.662 6.299   -7.315  1.00 53.33 57 A 1 
ATOM 453 O OE1 . GLU A 1 57 ? -16.191 5.268   -6.768  1.00 51.01 57 A 1 
ATOM 454 O OE2 . GLU A 1 57 ? -17.016 7.302   -6.660  1.00 49.48 57 A 1 
ATOM 455 N N   . ALA A 1 58 ? -18.256 9.832   -11.624 1.00 73.04 58 A 1 
ATOM 456 C CA  . ALA A 1 58 ? -19.191 10.730  -12.302 1.00 72.59 58 A 1 
ATOM 457 C C   . ALA A 1 58 ? -19.087 10.666  -13.839 1.00 72.08 58 A 1 
ATOM 458 O O   . ALA A 1 58 ? -20.111 10.764  -14.514 1.00 70.17 58 A 1 
ATOM 459 C CB  . ALA A 1 58 ? -18.968 12.154  -11.783 1.00 70.51 58 A 1 
ATOM 460 N N   . GLU A 1 59 ? -17.884 10.492  -14.399 1.00 65.03 59 A 1 
ATOM 461 C CA  . GLU A 1 59 ? -17.672 10.335  -15.846 1.00 66.75 59 A 1 
ATOM 462 C C   . GLU A 1 59 ? -18.197 8.982   -16.357 1.00 65.89 59 A 1 
ATOM 463 O O   . GLU A 1 59 ? -18.902 8.961   -17.367 1.00 65.72 59 A 1 
ATOM 464 C CB  . GLU A 1 59 ? -16.186 10.560  -16.212 1.00 66.50 59 A 1 
ATOM 465 C CG  . GLU A 1 59 ? -15.831 12.058  -16.253 1.00 57.73 59 A 1 
ATOM 466 C CD  . GLU A 1 59 ? -14.341 12.368  -16.500 1.00 54.10 59 A 1 
ATOM 467 O OE1 . GLU A 1 59 ? -13.987 12.714  -17.639 1.00 50.68 59 A 1 
ATOM 468 O OE2 . GLU A 1 59 ? -13.553 12.376  -15.516 1.00 49.43 59 A 1 
ATOM 469 N N   . ASP A 1 60 ? -17.976 7.878   -15.638 1.00 68.99 60 A 1 
ATOM 470 C CA  . ASP A 1 60 ? -18.521 6.553   -15.994 1.00 70.32 60 A 1 
ATOM 471 C C   . ASP A 1 60 ? -20.060 6.539   -16.007 1.00 68.66 60 A 1 
ATOM 472 O O   . ASP A 1 60 ? -20.681 5.966   -16.906 1.00 67.88 60 A 1 
ATOM 473 C CB  . ASP A 1 60 ? -18.004 5.477   -15.012 1.00 68.83 60 A 1 
ATOM 474 C CG  . ASP A 1 60 ? -16.653 4.855   -15.405 1.00 59.78 60 A 1 
ATOM 475 O OD1 . ASP A 1 60 ? -16.358 4.772   -16.618 1.00 55.40 60 A 1 
ATOM 476 O OD2 . ASP A 1 60 ? -15.932 4.418   -14.474 1.00 56.53 60 A 1 
ATOM 477 N N   . LEU A 1 61 ? -20.706 7.219   -15.051 1.00 67.45 61 A 1 
ATOM 478 C CA  . LEU A 1 61 ? -22.168 7.353   -15.021 1.00 68.51 61 A 1 
ATOM 479 C C   . LEU A 1 61 ? -22.709 8.156   -16.211 1.00 69.33 61 A 1 
ATOM 480 O O   . LEU A 1 61 ? -23.774 7.826   -16.734 1.00 67.03 61 A 1 
ATOM 481 C CB  . LEU A 1 61 ? -22.592 7.997   -13.692 1.00 67.37 61 A 1 
ATOM 482 C CG  . LEU A 1 61 ? -22.535 7.034   -12.492 1.00 59.39 61 A 1 
ATOM 483 C CD1 . LEU A 1 61 ? -22.676 7.829   -11.197 1.00 54.58 61 A 1 
ATOM 484 C CD2 . LEU A 1 61 ? -23.661 5.998   -12.533 1.00 56.82 61 A 1 
ATOM 485 N N   . GLN A 1 62 ? -21.987 9.183   -16.668 1.00 69.34 62 A 1 
ATOM 486 C CA  . GLN A 1 62 ? -22.389 9.976   -17.834 1.00 70.84 62 A 1 
ATOM 487 C C   . GLN A 1 62 ? -22.214 9.201   -19.144 1.00 69.23 62 A 1 
ATOM 488 O O   . GLN A 1 62 ? -23.101 9.252   -19.993 1.00 68.71 62 A 1 
ATOM 489 C CB  . GLN A 1 62 ? -21.605 11.295  -17.878 1.00 69.86 62 A 1 
ATOM 490 C CG  . GLN A 1 62 ? -22.107 12.284  -16.817 1.00 60.79 62 A 1 
ATOM 491 C CD  . GLN A 1 62 ? -21.306 13.581  -16.766 1.00 56.47 62 A 1 
ATOM 492 O OE1 . GLN A 1 62 ? -20.643 14.004  -17.698 1.00 55.16 62 A 1 
ATOM 493 N NE2 . GLN A 1 62 ? -21.355 14.302  -15.669 1.00 48.13 62 A 1 
ATOM 494 N N   . VAL A 1 63 ? -21.121 8.436   -19.305 1.00 68.40 63 A 1 
ATOM 495 C CA  . VAL A 1 63 ? -20.885 7.606   -20.499 1.00 70.45 63 A 1 
ATOM 496 C C   . VAL A 1 63 ? -21.935 6.492   -20.603 1.00 70.02 63 A 1 
ATOM 497 O O   . VAL A 1 63 ? -22.522 6.305   -21.668 1.00 65.95 63 A 1 
ATOM 498 C CB  . VAL A 1 63 ? -19.446 7.052   -20.501 1.00 67.89 63 A 1 
ATOM 499 C CG1 . VAL A 1 63 ? -19.201 6.089   -21.675 1.00 59.83 63 A 1 
ATOM 500 C CG2 . VAL A 1 63 ? -18.427 8.192   -20.650 1.00 62.95 63 A 1 
ATOM 501 N N   . GLY A 1 64 ? -22.262 5.815   -19.497 1.00 71.29 64 A 1 
ATOM 502 C CA  . GLY A 1 64 ? -23.310 4.786   -19.472 1.00 72.12 64 A 1 
ATOM 503 C C   . GLY A 1 64 ? -24.715 5.321   -19.779 1.00 70.12 64 A 1 
ATOM 504 O O   . GLY A 1 64 ? -25.542 4.605   -20.350 1.00 67.73 64 A 1 
ATOM 505 N N   . GLN A 1 65 ? -25.002 6.579   -19.474 1.00 64.01 65 A 1 
ATOM 506 C CA  . GLN A 1 65 ? -26.299 7.206   -19.764 1.00 64.54 65 A 1 
ATOM 507 C C   . GLN A 1 65 ? -26.441 7.641   -21.236 1.00 62.57 65 A 1 
ATOM 508 O O   . GLN A 1 65 ? -27.555 7.653   -21.758 1.00 63.21 65 A 1 
ATOM 509 C CB  . GLN A 1 65 ? -26.508 8.364   -18.775 1.00 62.57 65 A 1 
ATOM 510 C CG  . GLN A 1 65 ? -27.977 8.792   -18.684 1.00 53.45 65 A 1 
ATOM 511 C CD  . GLN A 1 65 ? -28.237 9.732   -17.502 1.00 51.36 65 A 1 
ATOM 512 O OE1 . GLN A 1 65 ? -27.436 10.568  -17.123 1.00 48.93 65 A 1 
ATOM 513 N NE2 . GLN A 1 65 ? -29.388 9.639   -16.859 1.00 43.67 65 A 1 
ATOM 514 N N   . VAL A 1 66 ? -25.326 7.947   -21.923 1.00 62.80 66 A 1 
ATOM 515 C CA  . VAL A 1 66 ? -25.328 8.295   -23.357 1.00 66.93 66 A 1 
ATOM 516 C C   . VAL A 1 66 ? -25.516 7.053   -24.240 1.00 65.98 66 A 1 
ATOM 517 O O   . VAL A 1 66 ? -26.207 7.138   -25.250 1.00 63.28 66 A 1 
ATOM 518 C CB  . VAL A 1 66 ? -24.056 9.088   -23.723 1.00 64.23 66 A 1 
ATOM 519 C CG1 . VAL A 1 66 ? -23.941 9.380   -25.226 1.00 56.30 66 A 1 
ATOM 520 C CG2 . VAL A 1 66 ? -24.047 10.458  -23.021 1.00 58.71 66 A 1 
ATOM 521 N N   . GLU A 1 67 ? -24.994 5.881   -23.848 1.00 63.55 67 A 1 
ATOM 522 C CA  . GLU A 1 67 ? -25.208 4.620   -24.590 1.00 66.69 67 A 1 
ATOM 523 C C   . GLU A 1 67 ? -26.636 4.055   -24.452 1.00 64.30 67 A 1 
ATOM 524 O O   . GLU A 1 67 ? -27.091 3.331   -25.339 1.00 65.81 67 A 1 
ATOM 525 C CB  . GLU A 1 67 ? -24.175 3.557   -24.173 1.00 65.68 67 A 1 
ATOM 526 C CG  . GLU A 1 67 ? -22.869 3.676   -24.970 1.00 57.87 67 A 1 
ATOM 527 C CD  . GLU A 1 67 ? -22.011 2.397   -24.839 1.00 55.59 67 A 1 
ATOM 528 O OE1 . GLU A 1 67 ? -22.032 1.578   -25.778 1.00 49.65 67 A 1 
ATOM 529 O OE2 . GLU A 1 67 ? -21.330 2.253   -23.789 1.00 51.64 67 A 1 
ATOM 530 N N   . LEU A 1 68 ? -27.367 4.378   -23.398 1.00 64.62 68 A 1 
ATOM 531 C CA  . LEU A 1 68 ? -28.749 3.910   -23.175 1.00 65.92 68 A 1 
ATOM 532 C C   . LEU A 1 68 ? -29.828 4.827   -23.776 1.00 64.32 68 A 1 
ATOM 533 O O   . LEU A 1 68 ? -31.008 4.480   -23.742 1.00 60.73 68 A 1 
ATOM 534 C CB  . LEU A 1 68 ? -28.939 3.687   -21.661 1.00 65.67 68 A 1 
ATOM 535 C CG  . LEU A 1 68 ? -28.662 2.229   -21.250 1.00 58.97 68 A 1 
ATOM 536 C CD1 . LEU A 1 68 ? -28.003 2.161   -19.876 1.00 53.97 68 A 1 
ATOM 537 C CD2 . LEU A 1 68 ? -29.967 1.427   -21.185 1.00 58.59 68 A 1 
ATOM 538 N N   . GLY A 1 69 ? -29.444 5.987   -24.312 1.00 57.44 69 A 1 
ATOM 539 C CA  . GLY A 1 69 ? -30.365 6.998   -24.848 1.00 60.39 69 A 1 
ATOM 540 C C   . GLY A 1 69 ? -30.360 7.142   -26.377 1.00 56.07 69 A 1 
ATOM 541 O O   . GLY A 1 69 ? -30.960 8.092   -26.874 1.00 53.18 69 A 1 
ATOM 542 N N   . GLY A 1 70 ? -29.672 6.231   -27.101 1.00 56.66 70 A 1 
ATOM 543 C CA  . GLY A 1 70 ? -29.581 6.202   -28.562 1.00 58.38 70 A 1 
ATOM 544 C C   . GLY A 1 70 ? -30.481 5.152   -29.197 1.00 52.92 70 A 1 
ATOM 545 O O   . GLY A 1 70 ? -30.541 4.030   -28.652 1.00 47.17 70 A 1 
ATOM 546 O OXT . GLY A 1 70 ? -31.065 5.484   -30.253 1.00 53.39 70 A 1 
#
