# 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_egtranscript155middle3
#
_entry.id egtranscript155middle3
#
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 ILE y ISOLEUCINE      CC[C@H](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" 
"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 GLU 1  
1 n ASP 2  
1 n VAL 3  
1 n LEU 4  
1 n GLY 5  
1 n GLN 6  
1 n SER 7  
1 n ASP 8  
1 n PRO 9  
1 n HIS 10 
1 n PRO 11 
1 n VAL 12 
1 n GLN 13 
1 n LYS 14 
1 n PRO 15 
1 n ILE 16 
1 n VAL 17 
1 n GLN 18 
1 n LEU 19 
1 n SER 20 
1 n PRO 21 
1 n CYS 22 
1 n THR 23 
1 n TRP 24 
1 n THR 25 
1 n PRO 26 
1 n THR 27 
1 n CYS 28 
1 n ARG 29 
1 n ARG 30 
1 n LEU 31 
1 n MET 32 
1 n TYR 33 
1 n ALA 34 
1 n PRO 35 
1 n ALA 36 
1 n GLY 37 
1 n VAL 38 
1 n PRO 39 
1 n TRP 40 
1 n VAL 41 
1 n ASP 42 
1 n GLY 43 
1 n LEU 44 
1 n MET 45 
1 n ALA 46 
1 n ASP 47 
1 n VAL 48 
1 n ALA 49 
1 n ARG 50 
1 n ALA 51 
1 n ASN 52 
1 n HIS 53 
1 n LEU 54 
1 n GLY 55 
1 n PRO 56 
1 n ASP 57 
1 n ASP 58 
1 n LEU 59 
1 n GLU 60 
1 n GLY 61 
1 n LEU 62 
1 n ARG 63 
1 n LEU 64 
1 n PRO 65 
1 n LYS 66 
1 n CYS 67 
1 n LYS 68 
1 n GLU 69 
1 n ALA 70 
1 n ARG 71 
1 n ASP 72 
1 n CYS 73 
1 n VAL 74 
1 n ARG 75 
1 n LYS 76 
1 n MET 77 
1 n ASN 78 
1 n GLN 79 
1 n THR 80 
1 n LEU 81 
#
_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 @ 2026-06-01 17:27:14)"
_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 75.34
_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 GLU 1  2 48.33 1 1  
A ASP 2  2 51.85 1 2  
A VAL 3  2 56.10 1 3  
A LEU 4  2 58.86 1 4  
A GLY 5  2 67.03 1 5  
A GLN 6  2 66.06 1 6  
A SER 7  2 72.33 1 7  
A ASP 8  2 75.76 1 8  
A PRO 9  2 82.26 1 9  
A HIS 10 2 78.62 1 10 
A PRO 11 2 81.55 1 11 
A VAL 12 2 80.75 1 12 
A GLN 13 2 72.21 1 13 
A LYS 14 2 69.54 1 14 
A PRO 15 2 69.40 1 15 
A ILE 16 2 61.76 1 16 
A VAL 17 2 62.80 1 17 
A GLN 18 2 63.75 1 18 
A LEU 19 2 73.66 1 19 
A SER 20 2 72.61 1 20 
A PRO 21 2 70.74 1 21 
A CYS 22 2 73.05 1 22 
A THR 23 2 72.66 1 23 
A TRP 24 2 63.72 1 24 
A THR 25 2 76.14 1 25 
A PRO 26 2 76.90 1 26 
A THR 27 2 74.57 1 27 
A CYS 28 2 77.46 1 28 
A ARG 29 2 72.11 1 29 
A ARG 30 2 71.86 1 30 
A LEU 31 2 83.34 1 31 
A MET 32 2 81.12 1 32 
A TYR 33 2 89.66 1 33 
A ALA 34 2 83.65 1 34 
A PRO 35 2 83.77 1 35 
A ALA 36 2 87.69 1 36 
A GLY 37 2 90.13 1 37 
A VAL 38 2 87.38 1 38 
A PRO 39 2 93.72 1 39 
A TRP 40 2 88.10 1 40 
A VAL 41 2 88.98 1 41 
A ASP 42 2 90.91 1 42 
A GLY 43 2 93.51 1 43 
A LEU 44 2 87.11 1 44 
A MET 45 2 88.05 1 45 
A ALA 46 2 90.24 1 46 
A ASP 47 2 87.44 1 47 
A VAL 48 2 86.13 1 48 
A ALA 49 2 87.36 1 49 
A ARG 50 2 78.10 1 50 
A ALA 51 2 84.36 1 51 
A ASN 52 2 81.91 1 52 
A HIS 53 2 79.69 1 53 
A LEU 54 2 83.51 1 54 
A GLY 55 2 85.47 1 55 
A PRO 56 2 82.21 1 56 
A ASP 57 2 78.61 1 57 
A ASP 58 2 83.57 1 58 
A LEU 59 2 83.98 1 59 
A GLU 60 2 82.07 1 60 
A GLY 61 2 88.98 1 61 
A LEU 62 2 81.97 1 62 
A ARG 63 2 73.36 1 63 
A LEU 64 2 72.80 1 64 
A PRO 65 2 74.85 1 65 
A LYS 66 2 68.07 1 66 
A CYS 67 2 75.09 1 67 
A LYS 68 2 73.17 1 68 
A GLU 69 2 71.43 1 69 
A ALA 70 2 76.88 1 70 
A ARG 71 2 67.60 1 71 
A ASP 72 2 72.18 1 72 
A CYS 73 2 71.29 1 73 
A VAL 74 2 71.80 1 74 
A ARG 75 2 67.22 1 75 
A LYS 76 2 67.13 1 76 
A MET 77 2 62.89 1 77 
A ASN 78 2 67.73 1 78 
A GLN 79 2 70.58 1 79 
A THR 80 2 60.76 1 80 
A LEU 81 2 57.67 1 81 
#
_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 GLU . 1  A 1  
A 2  1 n ASP . 2  A 2  
A 3  1 n VAL . 3  A 3  
A 4  1 n LEU . 4  A 4  
A 5  1 n GLY . 5  A 5  
A 6  1 n GLN . 6  A 6  
A 7  1 n SER . 7  A 7  
A 8  1 n ASP . 8  A 8  
A 9  1 n PRO . 9  A 9  
A 10 1 n HIS . 10 A 10 
A 11 1 n PRO . 11 A 11 
A 12 1 n VAL . 12 A 12 
A 13 1 n GLN . 13 A 13 
A 14 1 n LYS . 14 A 14 
A 15 1 n PRO . 15 A 15 
A 16 1 n ILE . 16 A 16 
A 17 1 n VAL . 17 A 17 
A 18 1 n GLN . 18 A 18 
A 19 1 n LEU . 19 A 19 
A 20 1 n SER . 20 A 20 
A 21 1 n PRO . 21 A 21 
A 22 1 n CYS . 22 A 22 
A 23 1 n THR . 23 A 23 
A 24 1 n TRP . 24 A 24 
A 25 1 n THR . 25 A 25 
A 26 1 n PRO . 26 A 26 
A 27 1 n THR . 27 A 27 
A 28 1 n CYS . 28 A 28 
A 29 1 n ARG . 29 A 29 
A 30 1 n ARG . 30 A 30 
A 31 1 n LEU . 31 A 31 
A 32 1 n MET . 32 A 32 
A 33 1 n TYR . 33 A 33 
A 34 1 n ALA . 34 A 34 
A 35 1 n PRO . 35 A 35 
A 36 1 n ALA . 36 A 36 
A 37 1 n GLY . 37 A 37 
A 38 1 n VAL . 38 A 38 
A 39 1 n PRO . 39 A 39 
A 40 1 n TRP . 40 A 40 
A 41 1 n VAL . 41 A 41 
A 42 1 n ASP . 42 A 42 
A 43 1 n GLY . 43 A 43 
A 44 1 n LEU . 44 A 44 
A 45 1 n MET . 45 A 45 
A 46 1 n ALA . 46 A 46 
A 47 1 n ASP . 47 A 47 
A 48 1 n VAL . 48 A 48 
A 49 1 n ALA . 49 A 49 
A 50 1 n ARG . 50 A 50 
A 51 1 n ALA . 51 A 51 
A 52 1 n ASN . 52 A 52 
A 53 1 n HIS . 53 A 53 
A 54 1 n LEU . 54 A 54 
A 55 1 n GLY . 55 A 55 
A 56 1 n PRO . 56 A 56 
A 57 1 n ASP . 57 A 57 
A 58 1 n ASP . 58 A 58 
A 59 1 n LEU . 59 A 59 
A 60 1 n GLU . 60 A 60 
A 61 1 n GLY . 61 A 61 
A 62 1 n LEU . 62 A 62 
A 63 1 n ARG . 63 A 63 
A 64 1 n LEU . 64 A 64 
A 65 1 n PRO . 65 A 65 
A 66 1 n LYS . 66 A 66 
A 67 1 n CYS . 67 A 67 
A 68 1 n LYS . 68 A 68 
A 69 1 n GLU . 69 A 69 
A 70 1 n ALA . 70 A 70 
A 71 1 n ARG . 71 A 71 
A 72 1 n ASP . 72 A 72 
A 73 1 n CYS . 73 A 73 
A 74 1 n VAL . 74 A 74 
A 75 1 n ARG . 75 A 75 
A 76 1 n LYS . 76 A 76 
A 77 1 n MET . 77 A 77 
A 78 1 n ASN . 78 A 78 
A 79 1 n GLN . 79 A 79 
A 80 1 n THR . 80 A 80 
A 81 1 n LEU . 81 A 81 
#
_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   . GLU A 1 1  ? -20.384 -18.522 -3.742  1.00 48.42 1  A 1 
ATOM 2   C CA  . GLU A 1 1  ? -19.656 -18.249 -4.999  1.00 54.02 1  A 1 
ATOM 3   C C   . GLU A 1 1  ? -18.531 -17.281 -4.690  1.00 55.00 1  A 1 
ATOM 4   O O   . GLU A 1 1  ? -18.750 -16.299 -3.987  1.00 52.70 1  A 1 
ATOM 5   C CB  . GLU A 1 1  ? -20.601 -17.704 -6.070  1.00 53.38 1  A 1 
ATOM 6   C CG  . GLU A 1 1  ? -21.575 -18.801 -6.524  1.00 45.99 1  A 1 
ATOM 7   C CD  . GLU A 1 1  ? -22.573 -18.276 -7.563  1.00 42.66 1  A 1 
ATOM 8   O OE1 . GLU A 1 1  ? -22.697 -18.933 -8.610  1.00 40.98 1  A 1 
ATOM 9   O OE2 . GLU A 1 1  ? -23.222 -17.252 -7.264  1.00 41.84 1  A 1 
ATOM 10  N N   . ASP A 1 2  ? -17.315 -17.633 -5.100  1.00 53.06 2  A 1 
ATOM 11  C CA  . ASP A 1 2  ? -16.079 -16.992 -4.644  1.00 57.07 2  A 1 
ATOM 12  C C   . ASP A 1 2  ? -15.890 -15.640 -5.362  1.00 56.19 2  A 1 
ATOM 13  O O   . ASP A 1 2  ? -15.694 -15.579 -6.577  1.00 54.81 2  A 1 
ATOM 14  C CB  . ASP A 1 2  ? -14.915 -17.974 -4.885  1.00 55.90 2  A 1 
ATOM 15  C CG  . ASP A 1 2  ? -13.902 -18.036 -3.738  1.00 48.57 2  A 1 
ATOM 16  O OD1 . ASP A 1 2  ? -13.804 -17.040 -2.995  1.00 44.83 2  A 1 
ATOM 17  O OD2 . ASP A 1 2  ? -13.246 -19.097 -3.622  1.00 44.39 2  A 1 
ATOM 18  N N   . VAL A 1 3  ? -15.971 -14.547 -4.611  1.00 56.79 3  A 1 
ATOM 19  C CA  . VAL A 1 3  ? -15.896 -13.158 -5.128  1.00 59.12 3  A 1 
ATOM 20  C C   . VAL A 1 3  ? -14.517 -12.840 -5.735  1.00 59.07 3  A 1 
ATOM 21  O O   . VAL A 1 3  ? -14.371 -11.895 -6.506  1.00 57.48 3  A 1 
ATOM 22  C CB  . VAL A 1 3  ? -16.264 -12.169 -3.995  1.00 57.21 3  A 1 
ATOM 23  C CG1 . VAL A 1 3  ? -16.285 -10.698 -4.432  1.00 51.56 3  A 1 
ATOM 24  C CG2 . VAL A 1 3  ? -17.656 -12.474 -3.410  1.00 51.48 3  A 1 
ATOM 25  N N   . LEU A 1 4  ? -13.517 -13.658 -5.436  1.00 58.25 4  A 1 
ATOM 26  C CA  . LEU A 1 4  ? -12.125 -13.454 -5.857  1.00 62.33 4  A 1 
ATOM 27  C C   . LEU A 1 4  ? -11.848 -13.800 -7.336  1.00 63.60 4  A 1 
ATOM 28  O O   . LEU A 1 4  ? -10.754 -13.526 -7.826  1.00 61.45 4  A 1 
ATOM 29  C CB  . LEU A 1 4  ? -11.205 -14.246 -4.911  1.00 60.93 4  A 1 
ATOM 30  C CG  . LEU A 1 4  ? -11.266 -13.808 -3.433  1.00 56.31 4  A 1 
ATOM 31  C CD1 . LEU A 1 4  ? -10.420 -14.748 -2.584  1.00 53.42 4  A 1 
ATOM 32  C CD2 . LEU A 1 4  ? -10.747 -12.384 -3.228  1.00 54.62 4  A 1 
ATOM 33  N N   . GLY A 1 5  ? -12.809 -14.389 -8.048  1.00 65.60 5  A 1 
ATOM 34  C CA  . GLY A 1 5  ? -12.660 -14.789 -9.453  1.00 67.44 5  A 1 
ATOM 35  C C   . GLY A 1 5  ? -13.256 -13.823 -10.483 1.00 68.51 5  A 1 
ATOM 36  O O   . GLY A 1 5  ? -13.136 -14.073 -11.682 1.00 66.58 5  A 1 
ATOM 37  N N   . GLN A 1 6  ? -13.923 -12.748 -10.050 1.00 70.50 6  A 1 
ATOM 38  C CA  . GLN A 1 6  ? -14.569 -11.811 -10.973 1.00 73.01 6  A 1 
ATOM 39  C C   . GLN A 1 6  ? -13.610 -10.685 -11.370 1.00 75.65 6  A 1 
ATOM 40  O O   . GLN A 1 6  ? -13.193 -9.879  -10.541 1.00 74.08 6  A 1 
ATOM 41  C CB  . GLN A 1 6  ? -15.891 -11.286 -10.394 1.00 70.95 6  A 1 
ATOM 42  C CG  . GLN A 1 6  ? -16.926 -12.421 -10.266 1.00 63.70 6  A 1 
ATOM 43  C CD  . GLN A 1 6  ? -18.322 -11.936 -9.884  1.00 58.75 6  A 1 
ATOM 44  O OE1 . GLN A 1 6  ? -18.615 -10.759 -9.763  1.00 55.78 6  A 1 
ATOM 45  N NE2 . GLN A 1 6  ? -19.265 -12.838 -9.684  1.00 52.12 6  A 1 
ATOM 46  N N   . SER A 1 7  ? -13.253 -10.622 -12.653 1.00 72.38 7  A 1 
ATOM 47  C CA  . SER A 1 7  ? -12.495 -9.516  -13.239 1.00 74.52 7  A 1 
ATOM 48  C C   . SER A 1 7  ? -13.470 -8.474  -13.786 1.00 76.85 7  A 1 
ATOM 49  O O   . SER A 1 7  ? -14.222 -8.772  -14.715 1.00 75.21 7  A 1 
ATOM 50  C CB  . SER A 1 7  ? -11.571 -10.045 -14.340 1.00 71.36 7  A 1 
ATOM 51  O OG  . SER A 1 7  ? -10.761 -9.012  -14.852 1.00 63.65 7  A 1 
ATOM 52  N N   . ASP A 1 8  ? -13.459 -7.266  -13.231 1.00 75.97 8  A 1 
ATOM 53  C CA  . ASP A 1 8  ? -14.140 -6.105  -13.803 1.00 79.38 8  A 1 
ATOM 54  C C   . ASP A 1 8  ? -13.142 -5.321  -14.672 1.00 81.52 8  A 1 
ATOM 55  O O   . ASP A 1 8  ? -12.182 -4.759  -14.140 1.00 81.01 8  A 1 
ATOM 56  C CB  . ASP A 1 8  ? -14.752 -5.242  -12.690 1.00 77.25 8  A 1 
ATOM 57  C CG  . ASP A 1 8  ? -15.576 -4.066  -13.235 1.00 72.76 8  A 1 
ATOM 58  O OD1 . ASP A 1 8  ? -15.585 -3.858  -14.473 1.00 70.49 8  A 1 
ATOM 59  O OD2 . ASP A 1 8  ? -16.203 -3.377  -12.400 1.00 67.70 8  A 1 
ATOM 60  N N   . PRO A 1 9  ? -13.322 -5.280  -16.012 1.00 82.47 9  A 1 
ATOM 61  C CA  . PRO A 1 9  ? -12.420 -4.560  -16.910 1.00 82.77 9  A 1 
ATOM 62  C C   . PRO A 1 9  ? -12.540 -3.031  -16.786 1.00 83.67 9  A 1 
ATOM 63  O O   . PRO A 1 9  ? -11.643 -2.316  -17.231 1.00 81.31 9  A 1 
ATOM 64  C CB  . PRO A 1 9  ? -12.787 -5.058  -18.314 1.00 81.88 9  A 1 
ATOM 65  C CG  . PRO A 1 9  ? -14.261 -5.435  -18.194 1.00 80.68 9  A 1 
ATOM 66  C CD  . PRO A 1 9  ? -14.374 -5.954  -16.765 1.00 83.07 9  A 1 
ATOM 67  N N   . HIS A 1 10 ? -13.618 -2.518  -16.169 1.00 83.62 10 A 1 
ATOM 68  C CA  . HIS A 1 10 ? -13.891 -1.085  -16.013 1.00 83.63 10 A 1 
ATOM 69  C C   . HIS A 1 10 ? -14.358 -0.726  -14.590 1.00 83.57 10 A 1 
ATOM 70  O O   . HIS A 1 10 ? -15.468 -0.208  -14.411 1.00 81.89 10 A 1 
ATOM 71  C CB  . HIS A 1 10 ? -14.895 -0.645  -17.093 1.00 84.08 10 A 1 
ATOM 72  C CG  . HIS A 1 10 ? -14.387 -0.865  -18.494 1.00 80.76 10 A 1 
ATOM 73  N ND1 . HIS A 1 10 ? -13.185 -0.438  -18.994 1.00 71.90 10 A 1 
ATOM 74  C CD2 . HIS A 1 10 ? -15.011 -1.558  -19.491 1.00 71.30 10 A 1 
ATOM 75  C CE1 . HIS A 1 10 ? -13.085 -0.870  -20.260 1.00 71.64 10 A 1 
ATOM 76  N NE2 . HIS A 1 10 ? -14.182 -1.549  -20.614 1.00 73.81 10 A 1 
ATOM 77  N N   . PRO A 1 11 ? -13.536 -0.983  -13.563 1.00 82.40 11 A 1 
ATOM 78  C CA  . PRO A 1 11 ? -13.921 -0.701  -12.187 1.00 82.25 11 A 1 
ATOM 79  C C   . PRO A 1 11 ? -14.122 0.804   -11.980 1.00 83.69 11 A 1 
ATOM 80  O O   . PRO A 1 11 ? -13.325 1.635   -12.433 1.00 82.78 11 A 1 
ATOM 81  C CB  . PRO A 1 11 ? -12.799 -1.266  -11.317 1.00 80.23 11 A 1 
ATOM 82  C CG  . PRO A 1 11 ? -11.576 -1.185  -12.234 1.00 78.36 11 A 1 
ATOM 83  C CD  . PRO A 1 11 ? -12.165 -1.452  -13.619 1.00 81.16 11 A 1 
ATOM 84  N N   . VAL A 1 12 ? -15.173 1.161   -11.237 1.00 82.33 12 A 1 
ATOM 85  C CA  . VAL A 1 12 ? -15.406 2.552   -10.841 1.00 82.73 12 A 1 
ATOM 86  C C   . VAL A 1 12 ? -14.271 3.005   -9.922  1.00 81.91 12 A 1 
ATOM 87  O O   . VAL A 1 12 ? -14.074 2.457   -8.832  1.00 80.49 12 A 1 
ATOM 88  C CB  . VAL A 1 12 ? -16.778 2.731   -10.167 1.00 82.21 12 A 1 
ATOM 89  C CG1 . VAL A 1 12 ? -17.010 4.192   -9.751  1.00 77.20 12 A 1 
ATOM 90  C CG2 . VAL A 1 12 ? -17.917 2.326   -11.114 1.00 78.41 12 A 1 
ATOM 91  N N   . GLN A 1 13 ? -13.535 4.033   -10.349 1.00 80.16 13 A 1 
ATOM 92  C CA  . GLN A 1 13 ? -12.475 4.615   -9.538  1.00 80.11 13 A 1 
ATOM 93  C C   . GLN A 1 13 ? -13.072 5.279   -8.294  1.00 80.63 13 A 1 
ATOM 94  O O   . GLN A 1 13 ? -13.967 6.120   -8.385  1.00 79.07 13 A 1 
ATOM 95  C CB  . GLN A 1 13 ? -11.652 5.620   -10.352 1.00 77.71 13 A 1 
ATOM 96  C CG  . GLN A 1 13 ? -10.888 4.949   -11.507 1.00 69.48 13 A 1 
ATOM 97  C CD  . GLN A 1 13 ? -10.026 5.935   -12.292 1.00 64.92 13 A 1 
ATOM 98  O OE1 . GLN A 1 13 ? -10.001 7.132   -12.057 1.00 60.95 13 A 1 
ATOM 99  N NE2 . GLN A 1 13 ? -9.280  5.467   -13.268 1.00 56.83 13 A 1 
ATOM 100 N N   . LYS A 1 14 ? -12.561 4.912   -7.118  1.00 76.28 14 A 1 
ATOM 101 C CA  . LYS A 1 14 ? -12.886 5.563   -5.844  1.00 75.75 14 A 1 
ATOM 102 C C   . LYS A 1 14 ? -11.644 6.308   -5.362  1.00 75.10 14 A 1 
ATOM 103 O O   . LYS A 1 14 ? -10.630 5.657   -5.105  1.00 73.16 14 A 1 
ATOM 104 C CB  . LYS A 1 14 ? -13.377 4.534   -4.819  1.00 75.48 14 A 1 
ATOM 105 C CG  . LYS A 1 14 ? -14.731 3.941   -5.233  1.00 69.48 14 A 1 
ATOM 106 C CD  . LYS A 1 14 ? -15.240 2.953   -4.175  1.00 66.19 14 A 1 
ATOM 107 C CE  . LYS A 1 14 ? -16.569 2.347   -4.640  1.00 61.19 14 A 1 
ATOM 108 N NZ  . LYS A 1 14 ? -17.090 1.350   -3.674  1.00 53.25 14 A 1 
ATOM 109 N N   . PRO A 1 15 ? -11.677 7.642   -5.250  1.00 71.20 15 A 1 
ATOM 110 C CA  . PRO A 1 15 ? -10.538 8.388   -4.737  1.00 70.06 15 A 1 
ATOM 111 C C   . PRO A 1 15 ? -10.283 8.032   -3.269  1.00 69.53 15 A 1 
ATOM 112 O O   . PRO A 1 15 ? -11.216 7.837   -2.488  1.00 67.83 15 A 1 
ATOM 113 C CB  . PRO A 1 15 ? -10.890 9.864   -4.935  1.00 69.25 15 A 1 
ATOM 114 C CG  . PRO A 1 15 ? -12.419 9.873   -4.893  1.00 68.08 15 A 1 
ATOM 115 C CD  . PRO A 1 15 ? -12.796 8.532   -5.519  1.00 69.84 15 A 1 
ATOM 116 N N   . ILE A 1 16 ? -9.012  7.983   -2.884  1.00 66.03 16 A 1 
ATOM 117 C CA  . ILE A 1 16 ? -8.618  7.937   -1.473  1.00 65.06 16 A 1 
ATOM 118 C C   . ILE A 1 16 ? -8.831  9.348   -0.920  1.00 64.98 16 A 1 
ATOM 119 O O   . ILE A 1 16 ? -8.081  10.263  -1.247  1.00 62.86 16 A 1 
ATOM 120 C CB  . ILE A 1 16 ? -7.163  7.442   -1.301  1.00 63.33 16 A 1 
ATOM 121 C CG1 . ILE A 1 16 ? -6.988  6.026   -1.900  1.00 59.17 16 A 1 
ATOM 122 C CG2 . ILE A 1 16 ? -6.787  7.452   0.192   1.00 57.46 16 A 1 
ATOM 123 C CD1 . ILE A 1 16 ? -5.535  5.529   -1.907  1.00 55.15 16 A 1 
ATOM 124 N N   . VAL A 1 17 ? -9.894  9.528   -0.134  1.00 65.59 17 A 1 
ATOM 125 C CA  . VAL A 1 17 ? -10.299 10.856  0.363   1.00 65.62 17 A 1 
ATOM 126 C C   . VAL A 1 17 ? -9.405  11.318  1.512   1.00 66.77 17 A 1 
ATOM 127 O O   . VAL A 1 17 ? -8.963  12.460  1.527   1.00 64.72 17 A 1 
ATOM 128 C CB  . VAL A 1 17 ? -11.778 10.854  0.786   1.00 62.70 17 A 1 
ATOM 129 C CG1 . VAL A 1 17 ? -12.251 12.259  1.184   1.00 57.27 17 A 1 
ATOM 130 C CG2 . VAL A 1 17 ? -12.692 10.366  -0.345  1.00 56.94 17 A 1 
ATOM 131 N N   . GLN A 1 18 ? -9.137  10.426  2.472   1.00 70.98 18 A 1 
ATOM 132 C CA  . GLN A 1 18 ? -8.285  10.701  3.629   1.00 71.97 18 A 1 
ATOM 133 C C   . GLN A 1 18 ? -7.796  9.396   4.254   1.00 74.08 18 A 1 
ATOM 134 O O   . GLN A 1 18 ? -8.559  8.442   4.405   1.00 72.16 18 A 1 
ATOM 135 C CB  . GLN A 1 18 ? -9.074  11.539  4.649   1.00 68.12 18 A 1 
ATOM 136 C CG  . GLN A 1 18 ? -8.182  12.103  5.762   1.00 61.19 18 A 1 
ATOM 137 C CD  . GLN A 1 18 ? -8.910  13.101  6.660   1.00 55.56 18 A 1 
ATOM 138 O OE1 . GLN A 1 18 ? -10.118 13.271  6.640   1.00 51.55 18 A 1 
ATOM 139 N NE2 . GLN A 1 18 ? -8.189  13.810  7.502   1.00 48.15 18 A 1 
ATOM 140 N N   . LEU A 1 19 ? -6.530  9.371   4.655   1.00 74.61 19 A 1 
ATOM 141 C CA  . LEU A 1 19 ? -5.954  8.278   5.437   1.00 75.25 19 A 1 
ATOM 142 C C   . LEU A 1 19 ? -5.985  8.647   6.924   1.00 75.36 19 A 1 
ATOM 143 O O   . LEU A 1 19 ? -5.387  9.644   7.338   1.00 73.40 19 A 1 
ATOM 144 C CB  . LEU A 1 19 ? -4.535  7.967   4.939   1.00 75.17 19 A 1 
ATOM 145 C CG  . LEU A 1 19 ? -4.472  7.454   3.487   1.00 73.44 19 A 1 
ATOM 146 C CD1 . LEU A 1 19 ? -3.016  7.266   3.079   1.00 70.88 19 A 1 
ATOM 147 C CD2 . LEU A 1 19 ? -5.190  6.116   3.311   1.00 71.20 19 A 1 
ATOM 148 N N   . SER A 1 20 ? -6.679  7.832   7.730   1.00 75.57 20 A 1 
ATOM 149 C CA  . SER A 1 20 ? -6.726  8.029   9.180   1.00 74.92 20 A 1 
ATOM 150 C C   . SER A 1 20 ? -5.335  7.865   9.803   1.00 75.65 20 A 1 
ATOM 151 O O   . SER A 1 20 ? -4.568  6.997   9.373   1.00 73.18 20 A 1 
ATOM 152 C CB  . SER A 1 20 ? -7.704  7.050   9.836   1.00 71.98 20 A 1 
ATOM 153 O OG  . SER A 1 20 ? -9.007  7.274   9.335   1.00 64.36 20 A 1 
ATOM 154 N N   . PRO A 1 21 ? -4.986  8.668   10.823  1.00 71.85 21 A 1 
ATOM 155 C CA  . PRO A 1 21 ? -3.729  8.497   11.536  1.00 71.93 21 A 1 
ATOM 156 C C   . PRO A 1 21 ? -3.689  7.132   12.223  1.00 74.24 21 A 1 
ATOM 157 O O   . PRO A 1 21 ? -4.694  6.657   12.757  1.00 73.10 21 A 1 
ATOM 158 C CB  . PRO A 1 21 ? -3.661  9.647   12.541  1.00 69.68 21 A 1 
ATOM 159 C CG  . PRO A 1 21 ? -5.125  9.999   12.781  1.00 66.25 21 A 1 
ATOM 160 C CD  . PRO A 1 21 ? -5.790  9.705   11.439  1.00 68.15 21 A 1 
ATOM 161 N N   . CYS A 1 22 ? -2.510  6.506   12.244  1.00 73.72 22 A 1 
ATOM 162 C CA  . CYS A 1 22 ? -2.316  5.333   13.082  1.00 74.57 22 A 1 
ATOM 163 C C   . CYS A 1 22 ? -2.091  5.769   14.535  1.00 75.62 22 A 1 
ATOM 164 O O   . CYS A 1 22 ? -1.197  6.564   14.818  1.00 73.42 22 A 1 
ATOM 165 C CB  . CYS A 1 22 ? -1.167  4.484   12.558  1.00 72.61 22 A 1 
ATOM 166 S SG  . CYS A 1 22 ? -1.152  2.924   13.477  1.00 68.33 22 A 1 
ATOM 167 N N   . THR A 1 23 ? -2.910  5.242   15.455  1.00 75.25 23 A 1 
ATOM 168 C CA  . THR A 1 23 ? -2.892  5.616   16.883  1.00 75.39 23 A 1 
ATOM 169 C C   . THR A 1 23 ? -2.461  4.480   17.805  1.00 75.97 23 A 1 
ATOM 170 O O   . THR A 1 23 ? -2.449  4.652   19.015  1.00 73.81 23 A 1 
ATOM 171 C CB  . THR A 1 23 ? -4.262  6.149   17.324  1.00 73.25 23 A 1 
ATOM 172 O OG1 . THR A 1 23 ? -5.253  5.184   17.066  1.00 67.80 23 A 1 
ATOM 173 C CG2 . THR A 1 23 ? -4.655  7.424   16.578  1.00 67.18 23 A 1 
ATOM 174 N N   . TRP A 1 24 ? -2.107  3.308   17.259  1.00 77.24 24 A 1 
ATOM 175 C CA  . TRP A 1 24 ? -1.800  2.133   18.079  1.00 77.19 24 A 1 
ATOM 176 C C   . TRP A 1 24 ? -0.488  2.299   18.864  1.00 78.93 24 A 1 
ATOM 177 O O   . TRP A 1 24 ? -0.432  2.005   20.053  1.00 76.02 24 A 1 
ATOM 178 C CB  . TRP A 1 24 ? -1.770  0.884   17.184  1.00 73.45 24 A 1 
ATOM 179 C CG  . TRP A 1 24 ? -1.709  -0.446  17.890  1.00 66.21 24 A 1 
ATOM 180 C CD1 . TRP A 1 24 ? -1.495  -0.668  19.204  1.00 59.96 24 A 1 
ATOM 181 C CD2 . TRP A 1 24 ? -1.889  -1.776  17.317  1.00 62.33 24 A 1 
ATOM 182 N NE1 . TRP A 1 24 ? -1.518  -2.014  19.485  1.00 53.42 24 A 1 
ATOM 183 C CE2 . TRP A 1 24 ? -1.760  -2.745  18.354  1.00 56.38 24 A 1 
ATOM 184 C CE3 . TRP A 1 24 ? -2.156  -2.259  16.018  1.00 53.15 24 A 1 
ATOM 185 C CZ2 . TRP A 1 24 ? -1.886  -4.126  18.123  1.00 53.94 24 A 1 
ATOM 186 C CZ3 . TRP A 1 24 ? -2.290  -3.636  15.777  1.00 52.50 24 A 1 
ATOM 187 C CH2 . TRP A 1 24 ? -2.157  -4.570  16.818  1.00 51.38 24 A 1 
ATOM 188 N N   . THR A 1 25 ? 0.572   2.790   18.215  1.00 78.99 25 A 1 
ATOM 189 C CA  . THR A 1 25 ? 1.870   3.044   18.859  1.00 79.05 25 A 1 
ATOM 190 C C   . THR A 1 25 ? 2.476   4.355   18.347  1.00 79.65 25 A 1 
ATOM 191 O O   . THR A 1 25 ? 2.177   4.762   17.224  1.00 78.20 25 A 1 
ATOM 192 C CB  . THR A 1 25 ? 2.874   1.898   18.640  1.00 77.21 25 A 1 
ATOM 193 O OG1 . THR A 1 25 ? 3.267   1.807   17.295  1.00 70.31 25 A 1 
ATOM 194 C CG2 . THR A 1 25 ? 2.355   0.527   19.067  1.00 69.56 25 A 1 
ATOM 195 N N   . PRO A 1 26 ? 3.382   4.999   19.117  1.00 77.52 26 A 1 
ATOM 196 C CA  . PRO A 1 26 ? 4.073   6.215   18.670  1.00 77.74 26 A 1 
ATOM 197 C C   . PRO A 1 26 ? 4.906   6.037   17.391  1.00 78.26 26 A 1 
ATOM 198 O O   . PRO A 1 26 ? 5.162   7.001   16.682  1.00 75.66 26 A 1 
ATOM 199 C CB  . PRO A 1 26 ? 4.973   6.617   19.843  1.00 76.92 26 A 1 
ATOM 200 C CG  . PRO A 1 26 ? 4.295   5.995   21.061  1.00 74.73 26 A 1 
ATOM 201 C CD  . PRO A 1 26 ? 3.717   4.703   20.503  1.00 77.47 26 A 1 
ATOM 202 N N   . THR A 1 27 ? 5.331   4.814   17.101  1.00 77.70 27 A 1 
ATOM 203 C CA  . THR A 1 27 ? 6.127   4.462   15.915  1.00 77.82 27 A 1 
ATOM 204 C C   . THR A 1 27 ? 5.281   3.925   14.762  1.00 79.15 27 A 1 
ATOM 205 O O   . THR A 1 27 ? 5.832   3.428   13.779  1.00 76.80 27 A 1 
ATOM 206 C CB  . THR A 1 27 ? 7.211   3.444   16.282  1.00 75.29 27 A 1 
ATOM 207 O OG1 . THR A 1 27 ? 6.621   2.298   16.863  1.00 68.14 27 A 1 
ATOM 208 C CG2 . THR A 1 27 ? 8.206   4.010   17.295  1.00 67.10 27 A 1 
ATOM 209 N N   . CYS A 1 28 ? 3.951   3.974   14.886  1.00 79.03 28 A 1 
ATOM 210 C CA  . CYS A 1 28 ? 3.081   3.428   13.860  1.00 79.40 28 A 1 
ATOM 211 C C   . CYS A 1 28 ? 3.133   4.264   12.578  1.00 80.66 28 A 1 
ATOM 212 O O   . CYS A 1 28 ? 2.921   5.475   12.605  1.00 78.75 28 A 1 
ATOM 213 C CB  . CYS A 1 28 ? 1.656   3.301   14.390  1.00 76.36 28 A 1 
ATOM 214 S SG  . CYS A 1 28 ? 0.684   2.268   13.271  1.00 70.57 28 A 1 
ATOM 215 N N   . ARG A 1 29 ? 3.379   3.599   11.456  1.00 81.39 29 A 1 
ATOM 216 C CA  . ARG A 1 29 ? 3.358   4.208   10.122  1.00 81.61 29 A 1 
ATOM 217 C C   . ARG A 1 29 ? 1.925   4.263   9.606   1.00 82.72 29 A 1 
ATOM 218 O O   . ARG A 1 29 ? 1.191   3.286   9.699   1.00 81.14 29 A 1 
ATOM 219 C CB  . ARG A 1 29 ? 4.275   3.444   9.161   1.00 79.92 29 A 1 
ATOM 220 C CG  . ARG A 1 29 ? 5.739   3.349   9.621   1.00 74.52 29 A 1 
ATOM 221 C CD  . ARG A 1 29 ? 6.365   4.724   9.871   1.00 71.00 29 A 1 
ATOM 222 N NE  . ARG A 1 29 ? 7.804   4.626   10.168  1.00 67.85 29 A 1 
ATOM 223 C CZ  . ARG A 1 29 ? 8.538   5.574   10.719  1.00 60.21 29 A 1 
ATOM 224 N NH1 . ARG A 1 29 ? 8.030   6.698   11.120  1.00 57.21 29 A 1 
ATOM 225 N NH2 . ARG A 1 29 ? 9.814   5.408   10.876  1.00 55.67 29 A 1 
ATOM 226 N N   . ARG A 1 30 ? 1.536   5.405   9.053   1.00 83.90 30 A 1 
ATOM 227 C CA  . ARG A 1 30 ? 0.181   5.620   8.522   1.00 83.99 30 A 1 
ATOM 228 C C   . ARG A 1 30 ? -0.043  4.893   7.204   1.00 85.27 30 A 1 
ATOM 229 O O   . ARG A 1 30 ? -1.145  4.419   6.946   1.00 83.96 30 A 1 
ATOM 230 C CB  . ARG A 1 30 ? -0.046  7.128   8.374   1.00 81.45 30 A 1 
ATOM 231 C CG  . ARG A 1 30 ? -1.533  7.452   8.196   1.00 73.27 30 A 1 
ATOM 232 C CD  . ARG A 1 30 ? -1.763  8.966   8.090   1.00 69.49 30 A 1 
ATOM 233 N NE  . ARG A 1 30 ? -1.227  9.690   9.264   1.00 65.61 30 A 1 
ATOM 234 C CZ  . ARG A 1 30 ? -1.366  10.973  9.526   1.00 57.88 30 A 1 
ATOM 235 N NH1 . ARG A 1 30 ? -2.148  11.738  8.827   1.00 54.63 30 A 1 
ATOM 236 N NH2 . ARG A 1 30 ? -0.689  11.512  10.496  1.00 51.01 30 A 1 
ATOM 237 N N   . LEU A 1 31 ? 0.991   4.819   6.381   1.00 85.63 31 A 1 
ATOM 238 C CA  . LEU A 1 31 ? 0.936   4.178   5.074   1.00 86.55 31 A 1 
ATOM 239 C C   . LEU A 1 31 ? 2.236   3.425   4.793   1.00 88.04 31 A 1 
ATOM 240 O O   . LEU A 1 31 ? 3.321   3.992   4.851   1.00 87.30 31 A 1 
ATOM 241 C CB  . LEU A 1 31 ? 0.643   5.257   4.019   1.00 84.91 31 A 1 
ATOM 242 C CG  . LEU A 1 31 ? 0.505   4.731   2.582   1.00 80.27 31 A 1 
ATOM 243 C CD1 . LEU A 1 31 ? -0.640  3.724   2.428   1.00 77.45 31 A 1 
ATOM 244 C CD2 . LEU A 1 31 ? 0.231   5.909   1.646   1.00 76.55 31 A 1 
ATOM 245 N N   . MET A 1 32 ? 2.096   2.149   4.437   1.00 86.20 32 A 1 
ATOM 246 C CA  . MET A 1 32 ? 3.198   1.318   3.958   1.00 86.73 32 A 1 
ATOM 247 C C   . MET A 1 32 ? 2.925   0.904   2.516   1.00 88.24 32 A 1 
ATOM 248 O O   . MET A 1 32 ? 1.785   0.605   2.166   1.00 87.75 32 A 1 
ATOM 249 C CB  . MET A 1 32 ? 3.402   0.100   4.866   1.00 84.53 32 A 1 
ATOM 250 C CG  . MET A 1 32 ? 3.742   0.499   6.306   1.00 76.75 32 A 1 
ATOM 251 S SD  . MET A 1 32 ? 3.964   -0.905  7.432   1.00 73.85 32 A 1 
ATOM 252 C CE  . MET A 1 32 ? 5.608   -1.480  6.924   1.00 64.87 32 A 1 
ATOM 253 N N   . TYR A 1 33 ? 3.954   0.878   1.668   1.00 86.97 33 A 1 
ATOM 254 C CA  . TYR A 1 33 ? 3.811   0.478   0.270   1.00 88.77 33 A 1 
ATOM 255 C C   . TYR A 1 33 ? 4.967   -0.402  -0.210  1.00 88.26 33 A 1 
ATOM 256 O O   . TYR A 1 33 ? 6.082   -0.341  0.300   1.00 87.40 33 A 1 
ATOM 257 C CB  . TYR A 1 33 ? 3.648   1.712   -0.620  1.00 89.93 33 A 1 
ATOM 258 C CG  . TYR A 1 33 ? 4.920   2.502   -0.859  1.00 91.02 33 A 1 
ATOM 259 C CD1 . TYR A 1 33 ? 5.363   3.452   0.088   1.00 90.33 33 A 1 
ATOM 260 C CD2 . TYR A 1 33 ? 5.670   2.290   -2.036  1.00 90.80 33 A 1 
ATOM 261 C CE1 . TYR A 1 33 ? 6.532   4.197   -0.148  1.00 90.49 33 A 1 
ATOM 262 C CE2 . TYR A 1 33 ? 6.841   3.033   -2.276  1.00 90.87 33 A 1 
ATOM 263 C CZ  . TYR A 1 33 ? 7.271   3.992   -1.335  1.00 90.92 33 A 1 
ATOM 264 O OH  . TYR A 1 33 ? 8.394   4.724   -1.572  1.00 90.14 33 A 1 
ATOM 265 N N   . ALA A 1 34 ? 4.692   -1.218  -1.221  1.00 86.78 34 A 1 
ATOM 266 C CA  . ALA A 1 34 ? 5.686   -2.048  -1.891  1.00 84.41 34 A 1 
ATOM 267 C C   . ALA A 1 34 ? 5.338   -2.182  -3.387  1.00 84.25 34 A 1 
ATOM 268 O O   . ALA A 1 34 ? 4.154   -2.235  -3.723  1.00 81.57 34 A 1 
ATOM 269 C CB  . ALA A 1 34 ? 5.741   -3.424  -1.207  1.00 81.25 34 A 1 
ATOM 270 N N   . PRO A 1 35 ? 6.318   -2.283  -4.279  1.00 84.61 35 A 1 
ATOM 271 C CA  . PRO A 1 35 ? 7.754   -2.201  -4.027  1.00 85.20 35 A 1 
ATOM 272 C C   . PRO A 1 35 ? 8.274   -0.758  -3.941  1.00 87.87 35 A 1 
ATOM 273 O O   . PRO A 1 35 ? 7.963   0.064   -4.802  1.00 87.42 35 A 1 
ATOM 274 C CB  . PRO A 1 35 ? 8.383   -2.922  -5.215  1.00 81.96 35 A 1 
ATOM 275 C CG  . PRO A 1 35 ? 7.414   -2.642  -6.367  1.00 78.51 35 A 1 
ATOM 276 C CD  . PRO A 1 35 ? 6.054   -2.562  -5.683  1.00 80.81 35 A 1 
ATOM 277 N N   . ALA A 1 36 ? 9.137   -0.472  -2.966  1.00 87.12 36 A 1 
ATOM 278 C CA  . ALA A 1 36 ? 9.941   0.746   -2.961  1.00 88.16 36 A 1 
ATOM 279 C C   . ALA A 1 36 ? 11.165  0.617   -3.891  1.00 88.10 36 A 1 
ATOM 280 O O   . ALA A 1 36 ? 11.681  -0.480  -4.117  1.00 87.11 36 A 1 
ATOM 281 C CB  . ALA A 1 36 ? 10.370  1.066   -1.524  1.00 87.98 36 A 1 
ATOM 282 N N   . GLY A 1 37 ? 11.654  1.746   -4.391  1.00 90.47 37 A 1 
ATOM 283 C CA  . GLY A 1 37 ? 12.789  1.838   -5.313  1.00 89.93 37 A 1 
ATOM 284 C C   . GLY A 1 37 ? 12.428  1.606   -6.781  1.00 90.87 37 A 1 
ATOM 285 O O   . GLY A 1 37 ? 13.326  1.495   -7.619  1.00 89.26 37 A 1 
ATOM 286 N N   . VAL A 1 38 ? 11.132  1.540   -7.100  1.00 88.72 38 A 1 
ATOM 287 C CA  . VAL A 1 38 ? 10.629  1.557   -8.479  1.00 88.71 38 A 1 
ATOM 288 C C   . VAL A 1 38 ? 10.148  2.978   -8.796  1.00 90.69 38 A 1 
ATOM 289 O O   . VAL A 1 38 ? 9.156   3.404   -8.207  1.00 91.14 38 A 1 
ATOM 290 C CB  . VAL A 1 38 ? 9.507   0.523   -8.687  1.00 86.78 38 A 1 
ATOM 291 C CG1 . VAL A 1 38 ? 8.979   0.568   -10.127 1.00 82.65 38 A 1 
ATOM 292 C CG2 . VAL A 1 38 ? 10.006  -0.900  -8.417  1.00 82.98 38 A 1 
ATOM 293 N N   . PRO A 1 39 ? 10.777  3.721   -9.727  1.00 93.64 39 A 1 
ATOM 294 C CA  . PRO A 1 39 ? 10.558  5.169   -9.868  1.00 93.99 39 A 1 
ATOM 295 C C   . PRO A 1 39 ? 9.094   5.604   -10.029 1.00 94.30 39 A 1 
ATOM 296 O O   . PRO A 1 39 ? 8.668   6.582   -9.425  1.00 93.63 39 A 1 
ATOM 297 C CB  . PRO A 1 39 ? 11.390  5.583   -11.089 1.00 93.85 39 A 1 
ATOM 298 C CG  . PRO A 1 39 ? 12.556  4.596   -11.062 1.00 92.71 39 A 1 
ATOM 299 C CD  . PRO A 1 39 ? 11.907  3.312   -10.563 1.00 93.95 39 A 1 
ATOM 300 N N   . TRP A 1 40 ? 8.299   4.869   -10.815 1.00 93.42 40 A 1 
ATOM 301 C CA  . TRP A 1 40 ? 6.890   5.215   -11.013 1.00 93.46 40 A 1 
ATOM 302 C C   . TRP A 1 40 ? 6.021   4.909   -9.780  1.00 93.91 40 A 1 
ATOM 303 O O   . TRP A 1 40 ? 5.055   5.622   -9.532  1.00 92.75 40 A 1 
ATOM 304 C CB  . TRP A 1 40 ? 6.356   4.510   -12.267 1.00 92.77 40 A 1 
ATOM 305 C CG  . TRP A 1 40 ? 6.150   3.029   -12.136 1.00 90.60 40 A 1 
ATOM 306 C CD1 . TRP A 1 40 ? 7.024   2.065   -12.513 1.00 86.79 40 A 1 
ATOM 307 C CD2 . TRP A 1 40 ? 5.000   2.331   -11.579 1.00 89.01 40 A 1 
ATOM 308 N NE1 . TRP A 1 40 ? 6.493   0.819   -12.225 1.00 83.05 40 A 1 
ATOM 309 C CE2 . TRP A 1 40 ? 5.246   0.928   -11.644 1.00 86.53 40 A 1 
ATOM 310 C CE3 . TRP A 1 40 ? 3.769   2.743   -11.024 1.00 83.40 40 A 1 
ATOM 311 C CZ2 . TRP A 1 40 ? 4.322   -0.023  -11.173 1.00 83.98 40 A 1 
ATOM 312 C CZ3 . TRP A 1 40 ? 2.835   1.799   -10.550 1.00 82.81 40 A 1 
ATOM 313 C CH2 . TRP A 1 40 ? 3.111   0.425   -10.621 1.00 80.87 40 A 1 
ATOM 314 N N   . VAL A 1 41 ? 6.369   3.881   -8.996  1.00 91.27 41 A 1 
ATOM 315 C CA  . VAL A 1 41 ? 5.684   3.546   -7.736  1.00 90.39 41 A 1 
ATOM 316 C C   . VAL A 1 41 ? 6.006   4.601   -6.689  1.00 90.92 41 A 1 
ATOM 317 O O   . VAL A 1 41 ? 5.093   5.134   -6.069  1.00 90.99 41 A 1 
ATOM 318 C CB  . VAL A 1 41 ? 6.066   2.142   -7.213  1.00 88.57 41 A 1 
ATOM 319 C CG1 . VAL A 1 41 ? 5.348   1.801   -5.899  1.00 85.35 41 A 1 
ATOM 320 C CG2 . VAL A 1 41 ? 5.714   1.044   -8.221  1.00 85.39 41 A 1 
ATOM 321 N N   . ASP A 1 42 ? 7.282   4.953   -6.541  1.00 92.84 42 A 1 
ATOM 322 C CA  . ASP A 1 42 ? 7.713   5.984   -5.599  1.00 92.33 42 A 1 
ATOM 323 C C   . ASP A 1 42 ? 7.070   7.344   -5.935  1.00 92.31 42 A 1 
ATOM 324 O O   . ASP A 1 42 ? 6.587   8.039   -5.043  1.00 91.98 42 A 1 
ATOM 325 C CB  . ASP A 1 42 ? 9.249   6.079   -5.597  1.00 91.85 42 A 1 
ATOM 326 C CG  . ASP A 1 42 ? 9.976   4.818   -5.100  1.00 90.69 42 A 1 
ATOM 327 O OD1 . ASP A 1 42 ? 9.383   3.997   -4.362  1.00 87.93 42 A 1 
ATOM 328 O OD2 . ASP A 1 42 ? 11.166  4.656   -5.460  1.00 87.38 42 A 1 
ATOM 329 N N   . GLY A 1 43 ? 6.979   7.695   -7.217  1.00 94.13 43 A 1 
ATOM 330 C CA  . GLY A 1 43 ? 6.282   8.896   -7.689  1.00 93.72 43 A 1 
ATOM 331 C C   . GLY A 1 43 ? 4.787   8.892   -7.356  1.00 93.57 43 A 1 
ATOM 332 O O   . GLY A 1 43 ? 4.282   9.855   -6.779  1.00 92.63 43 A 1 
ATOM 333 N N   . LEU A 1 44 ? 4.092   7.788   -7.632  1.00 92.41 44 A 1 
ATOM 334 C CA  . LEU A 1 44 ? 2.677   7.621   -7.282  1.00 91.36 44 A 1 
ATOM 335 C C   . LEU A 1 44 ? 2.449   7.760   -5.771  1.00 91.06 44 A 1 
ATOM 336 O O   . LEU A 1 44 ? 1.524   8.447   -5.339  1.00 90.27 44 A 1 
ATOM 337 C CB  . LEU A 1 44 ? 2.203   6.244   -7.792  1.00 90.43 44 A 1 
ATOM 338 C CG  . LEU A 1 44 ? 0.752   5.891   -7.410  1.00 84.19 44 A 1 
ATOM 339 C CD1 . LEU A 1 44 ? -0.261  6.842   -8.048  1.00 78.70 44 A 1 
ATOM 340 C CD2 . LEU A 1 44 ? 0.435   4.466   -7.866  1.00 78.49 44 A 1 
ATOM 341 N N   . MET A 1 45 ? 3.299   7.128   -4.957  1.00 92.10 45 A 1 
ATOM 342 C CA  . MET A 1 45 ? 3.163   7.177   -3.502  1.00 91.38 45 A 1 
ATOM 343 C C   . MET A 1 45 ? 3.490   8.560   -2.931  1.00 91.33 45 A 1 
ATOM 344 O O   . MET A 1 45 ? 2.852   8.977   -1.967  1.00 90.73 45 A 1 
ATOM 345 C CB  . MET A 1 45 ? 4.017   6.080   -2.867  1.00 90.57 45 A 1 
ATOM 346 C CG  . MET A 1 45 ? 3.509   4.672   -3.226  1.00 87.59 45 A 1 
ATOM 347 S SD  . MET A 1 45 ? 1.740   4.330   -2.975  1.00 84.75 45 A 1 
ATOM 348 C CE  . MET A 1 45 ? 1.602   4.700   -1.215  1.00 75.95 45 A 1 
ATOM 349 N N   . ALA A 1 46 ? 4.404   9.307   -3.553  1.00 91.49 46 A 1 
ATOM 350 C CA  . ALA A 1 46 ? 4.640   10.709  -3.211  1.00 90.56 46 A 1 
ATOM 351 C C   . ALA A 1 46 ? 3.407   11.590  -3.489  1.00 89.89 46 A 1 
ATOM 352 O O   . ALA A 1 46 ? 3.072   12.458  -2.680  1.00 88.88 46 A 1 
ATOM 353 C CB  . ALA A 1 46 ? 5.872   11.202  -3.980  1.00 90.36 46 A 1 
ATOM 354 N N   . ASP A 1 47 ? 2.694   11.347  -4.588  1.00 89.74 47 A 1 
ATOM 355 C CA  . ASP A 1 47 ? 1.449   12.060  -4.891  1.00 89.00 47 A 1 
ATOM 356 C C   . ASP A 1 47 ? 0.326   11.702  -3.908  1.00 88.27 47 A 1 
ATOM 357 O O   . ASP A 1 47 ? -0.358  12.597  -3.406  1.00 87.28 47 A 1 
ATOM 358 C CB  . ASP A 1 47 ? 1.029   11.794  -6.344  1.00 89.75 47 A 1 
ATOM 359 C CG  . ASP A 1 47 ? 1.925   12.493  -7.376  1.00 87.44 47 A 1 
ATOM 360 O OD1 . ASP A 1 47 ? 2.528   13.554  -7.033  1.00 84.37 47 A 1 
ATOM 361 O OD2 . ASP A 1 47 ? 1.949   12.018  -8.528  1.00 83.70 47 A 1 
ATOM 362 N N   . VAL A 1 48 ? 0.187   10.416  -3.544  1.00 88.12 48 A 1 
ATOM 363 C CA  . VAL A 1 48 ? -0.752  9.968   -2.499  1.00 86.68 48 A 1 
ATOM 364 C C   . VAL A 1 48 ? -0.424  10.617  -1.154  1.00 86.47 48 A 1 
ATOM 365 O O   . VAL A 1 48 ? -1.326  11.121  -0.484  1.00 85.59 48 A 1 
ATOM 366 C CB  . VAL A 1 48 ? -0.758  8.428   -2.377  1.00 86.07 48 A 1 
ATOM 367 C CG1 . VAL A 1 48 ? -1.587  7.934   -1.178  1.00 84.88 48 A 1 
ATOM 368 C CG2 . VAL A 1 48 ? -1.361  7.781   -3.632  1.00 85.08 48 A 1 
ATOM 369 N N   . ALA A 1 49 ? 0.850   10.657  -0.763  1.00 88.23 49 A 1 
ATOM 370 C CA  . ALA A 1 49 ? 1.284   11.297  0.474   1.00 87.50 49 A 1 
ATOM 371 C C   . ALA A 1 49 ? 0.931   12.790  0.487   1.00 87.18 49 A 1 
ATOM 372 O O   . ALA A 1 49 ? 0.320   13.272  1.442   1.00 86.45 49 A 1 
ATOM 373 C CB  . ALA A 1 49 ? 2.789   11.060  0.654   1.00 87.43 49 A 1 
ATOM 374 N N   . ARG A 1 50 ? 1.214   13.504  -0.601  1.00 87.43 50 A 1 
ATOM 375 C CA  . ARG A 1 50 ? 0.886   14.927  -0.747  1.00 86.74 50 A 1 
ATOM 376 C C   . ARG A 1 50 ? -0.616  15.189  -0.652  1.00 86.22 50 A 1 
ATOM 377 O O   . ARG A 1 50 ? -1.026  16.091  0.071   1.00 85.35 50 A 1 
ATOM 378 C CB  . ARG A 1 50 ? 1.457   15.433  -2.079  1.00 87.19 50 A 1 
ATOM 379 C CG  . ARG A 1 50 ? 1.434   16.964  -2.179  1.00 81.26 50 A 1 
ATOM 380 C CD  . ARG A 1 50 ? 1.821   17.462  -3.580  1.00 79.75 50 A 1 
ATOM 381 N NE  . ARG A 1 50 ? 3.107   16.900  -4.042  1.00 73.16 50 A 1 
ATOM 382 C CZ  . ARG A 1 50 ? 3.354   16.387  -5.241  1.00 68.23 50 A 1 
ATOM 383 N NH1 . ARG A 1 50 ? 2.566   16.567  -6.249  1.00 62.26 50 A 1 
ATOM 384 N NH2 . ARG A 1 50 ? 4.400   15.649  -5.448  1.00 61.49 50 A 1 
ATOM 385 N N   . ALA A 1 51 ? -1.422  14.383  -1.340  1.00 86.24 51 A 1 
ATOM 386 C CA  . ALA A 1 51 ? -2.880  14.514  -1.331  1.00 84.67 51 A 1 
ATOM 387 C C   . ALA A 1 51 ? -3.499  14.269  0.057   1.00 84.21 51 A 1 
ATOM 388 O O   . ALA A 1 51 ? -4.555  14.818  0.363   1.00 82.61 51 A 1 
ATOM 389 C CB  . ALA A 1 51 ? -3.453  13.541  -2.373  1.00 84.07 51 A 1 
ATOM 390 N N   . ASN A 1 52 ? -2.843  13.470  0.903   1.00 85.12 52 A 1 
ATOM 391 C CA  . ASN A 1 52 ? -3.301  13.128  2.250   1.00 84.37 52 A 1 
ATOM 392 C C   . ASN A 1 52 ? -2.557  13.882  3.367   1.00 84.47 52 A 1 
ATOM 393 O O   . ASN A 1 52 ? -2.718  13.539  4.539   1.00 83.27 52 A 1 
ATOM 394 C CB  . ASN A 1 52 ? -3.235  11.604  2.422   1.00 83.71 52 A 1 
ATOM 395 C CG  . ASN A 1 52 ? -4.311  10.897  1.630   1.00 81.12 52 A 1 
ATOM 396 O OD1 . ASN A 1 52 ? -5.413  10.686  2.112   1.00 76.98 52 A 1 
ATOM 397 N ND2 . ASN A 1 52 ? -4.036  10.511  0.411   1.00 76.21 52 A 1 
ATOM 398 N N   . HIS A 1 53 ? -1.748  14.895  3.023   1.00 85.47 53 A 1 
ATOM 399 C CA  . HIS A 1 53 ? -0.960  15.677  3.981   1.00 84.96 53 A 1 
ATOM 400 C C   . HIS A 1 53 ? -0.079  14.811  4.902   1.00 84.88 53 A 1 
ATOM 401 O O   . HIS A 1 53 ? 0.040   15.078  6.100   1.00 83.29 53 A 1 
ATOM 402 C CB  . HIS A 1 53 ? -1.880  16.642  4.750   1.00 84.56 53 A 1 
ATOM 403 C CG  . HIS A 1 53 ? -2.722  17.509  3.849   1.00 80.94 53 A 1 
ATOM 404 N ND1 . HIS A 1 53 ? -2.256  18.490  3.012   1.00 73.52 53 A 1 
ATOM 405 C CD2 . HIS A 1 53 ? -4.078  17.452  3.690   1.00 72.32 53 A 1 
ATOM 406 C CE1 . HIS A 1 53 ? -3.311  19.019  2.368   1.00 72.90 53 A 1 
ATOM 407 N NE2 . HIS A 1 53 ? -4.443  18.424  2.753   1.00 74.08 53 A 1 
ATOM 408 N N   . LEU A 1 54 ? 0.518   13.748  4.347   1.00 85.29 54 A 1 
ATOM 409 C CA  . LEU A 1 54 ? 1.398   12.848  5.081   1.00 85.03 54 A 1 
ATOM 410 C C   . LEU A 1 54 ? 2.807   13.430  5.173   1.00 85.17 54 A 1 
ATOM 411 O O   . LEU A 1 54 ? 3.366   13.902  4.178   1.00 84.15 54 A 1 
ATOM 412 C CB  . LEU A 1 54 ? 1.416   11.454  4.437   1.00 84.44 54 A 1 
ATOM 413 C CG  . LEU A 1 54 ? 0.047   10.779  4.269   1.00 83.08 54 A 1 
ATOM 414 C CD1 . LEU A 1 54 ? 0.239   9.357   3.735   1.00 80.77 54 A 1 
ATOM 415 C CD2 . LEU A 1 54 ? -0.738  10.696  5.568   1.00 80.17 54 A 1 
ATOM 416 N N   . GLY A 1 55 ? 3.389   13.363  6.369   1.00 85.38 55 A 1 
ATOM 417 C CA  . GLY A 1 55 ? 4.793   13.672  6.611   1.00 84.96 55 A 1 
ATOM 418 C C   . GLY A 1 55 ? 5.723   12.513  6.233   1.00 86.24 55 A 1 
ATOM 419 O O   . GLY A 1 55 ? 5.264   11.400  5.968   1.00 85.29 55 A 1 
ATOM 420 N N   . PRO A 1 56 ? 7.039   12.736  6.250   1.00 83.54 56 A 1 
ATOM 421 C CA  . PRO A 1 56 ? 8.024   11.688  5.960   1.00 83.00 56 A 1 
ATOM 422 C C   . PRO A 1 56 ? 7.952   10.508  6.937   1.00 84.08 56 A 1 
ATOM 423 O O   . PRO A 1 56 ? 8.202   9.374   6.544   1.00 82.36 56 A 1 
ATOM 424 C CB  . PRO A 1 56 ? 9.383   12.398  6.022   1.00 81.24 56 A 1 
ATOM 425 C CG  . PRO A 1 56 ? 9.128   13.603  6.926   1.00 79.33 56 A 1 
ATOM 426 C CD  . PRO A 1 56 ? 7.689   13.983  6.611   1.00 81.91 56 A 1 
ATOM 427 N N   . ASP A 1 57 ? 7.550   10.755  8.191   1.00 82.84 57 A 1 
ATOM 428 C CA  . ASP A 1 57 ? 7.402   9.713   9.211   1.00 82.96 57 A 1 
ATOM 429 C C   . ASP A 1 57 ? 6.120   8.883   9.063   1.00 84.34 57 A 1 
ATOM 430 O O   . ASP A 1 57 ? 5.999   7.833   9.689   1.00 83.01 57 A 1 
ATOM 431 C CB  . ASP A 1 57 ? 7.465   10.352  10.603  1.00 80.84 57 A 1 
ATOM 432 C CG  . ASP A 1 57 ? 8.848   10.932  10.896  1.00 74.93 57 A 1 
ATOM 433 O OD1 . ASP A 1 57 ? 9.839   10.207  10.632  1.00 70.46 57 A 1 
ATOM 434 O OD2 . ASP A 1 57 ? 8.898   12.084  11.378  1.00 69.48 57 A 1 
ATOM 435 N N   . ASP A 1 58 ? 5.174   9.331   8.250   1.00 85.78 58 A 1 
ATOM 436 C CA  . ASP A 1 58 ? 3.907   8.637   8.011   1.00 85.89 58 A 1 
ATOM 437 C C   . ASP A 1 58 ? 4.009   7.549   6.933   1.00 87.12 58 A 1 
ATOM 438 O O   . ASP A 1 58 ? 3.144   6.673   6.865   1.00 86.07 58 A 1 
ATOM 439 C CB  . ASP A 1 58 ? 2.843   9.661   7.604   1.00 84.20 58 A 1 
ATOM 440 C CG  . ASP A 1 58 ? 2.307   10.521  8.746   1.00 81.42 58 A 1 
ATOM 441 O OD1 . ASP A 1 58 ? 1.882   9.946   9.774   1.00 79.67 58 A 1 
ATOM 442 O OD2 . ASP A 1 58 ? 2.114   11.740  8.538   1.00 78.40 58 A 1 
ATOM 443 N N   . LEU A 1 59 ? 5.037   7.613   6.071   1.00 87.19 59 A 1 
ATOM 444 C CA  . LEU A 1 59 ? 5.183   6.769   4.890   1.00 88.02 59 A 1 
ATOM 445 C C   . LEU A 1 59 ? 6.388   5.830   5.024   1.00 88.79 59 A 1 
ATOM 446 O O   . LEU A 1 59 ? 7.508   6.273   5.257   1.00 87.99 59 A 1 
ATOM 447 C CB  . LEU A 1 59 ? 5.296   7.684   3.660   1.00 86.91 59 A 1 
ATOM 448 C CG  . LEU A 1 59 ? 5.235   6.940   2.318   1.00 80.49 59 A 1 
ATOM 449 C CD1 . LEU A 1 59 ? 3.847   6.361   2.059   1.00 76.50 59 A 1 
ATOM 450 C CD2 . LEU A 1 59 ? 5.553   7.903   1.172   1.00 75.98 59 A 1 
ATOM 451 N N   . GLU A 1 60 ? 6.172   4.533   4.800   1.00 87.45 60 A 1 
ATOM 452 C CA  . GLU A 1 60 ? 7.237   3.526   4.796   1.00 87.88 60 A 1 
ATOM 453 C C   . GLU A 1 60 ? 7.226   2.742   3.479   1.00 88.89 60 A 1 
ATOM 454 O O   . GLU A 1 60 ? 6.246   2.086   3.117   1.00 88.40 60 A 1 
ATOM 455 C CB  . GLU A 1 60 ? 7.072   2.598   6.013   1.00 86.24 60 A 1 
ATOM 456 C CG  . GLU A 1 60 ? 8.249   1.624   6.207   1.00 81.20 60 A 1 
ATOM 457 C CD  . GLU A 1 60 ? 9.557   2.308   6.645   1.00 78.03 60 A 1 
ATOM 458 O OE1 . GLU A 1 60 ? 10.630  1.761   6.306   1.00 70.45 60 A 1 
ATOM 459 O OE2 . GLU A 1 60 ? 9.481   3.345   7.344   1.00 70.07 60 A 1 
ATOM 460 N N   . GLY A 1 61 ? 8.336   2.791   2.748   1.00 89.35 61 A 1 
ATOM 461 C CA  . GLY A 1 61 ? 8.522   2.037   1.514   1.00 89.52 61 A 1 
ATOM 462 C C   . GLY A 1 61 ? 9.241   0.710   1.757   1.00 89.24 61 A 1 
ATOM 463 O O   . GLY A 1 61 ? 10.410  0.687   2.140   1.00 87.82 61 A 1 
ATOM 464 N N   . LEU A 1 62 ? 8.582   -0.401  1.469   1.00 87.40 62 A 1 
ATOM 465 C CA  . LEU A 1 62 ? 9.143   -1.745  1.581   1.00 85.94 62 A 1 
ATOM 466 C C   . LEU A 1 62 ? 9.766   -2.180  0.252   1.00 86.83 62 A 1 
ATOM 467 O O   . LEU A 1 62 ? 9.111   -2.209  -0.792  1.00 85.83 62 A 1 
ATOM 468 C CB  . LEU A 1 62 ? 8.064   -2.734  2.040   1.00 83.78 62 A 1 
ATOM 469 C CG  . LEU A 1 62 ? 7.401   -2.402  3.391   1.00 77.95 62 A 1 
ATOM 470 C CD1 . LEU A 1 62 ? 6.344   -3.465  3.685   1.00 74.47 62 A 1 
ATOM 471 C CD2 . LEU A 1 62 ? 8.412   -2.373  4.535   1.00 73.52 62 A 1 
ATOM 472 N N   . ARG A 1 63 ? 11.037  -2.571  0.283   1.00 84.91 63 A 1 
ATOM 473 C CA  . ARG A 1 63 ? 11.691  -3.169  -0.886  1.00 83.32 63 A 1 
ATOM 474 C C   . ARG A 1 63 ? 11.241  -4.617  -1.047  1.00 81.95 63 A 1 
ATOM 475 O O   . ARG A 1 63 ? 11.305  -5.395  -0.100  1.00 79.53 63 A 1 
ATOM 476 C CB  . ARG A 1 63 ? 13.214  -3.068  -0.776  1.00 82.45 63 A 1 
ATOM 477 C CG  . ARG A 1 63 ? 13.679  -1.608  -0.863  1.00 77.44 63 A 1 
ATOM 478 C CD  . ARG A 1 63 ? 15.201  -1.531  -0.829  1.00 74.66 63 A 1 
ATOM 479 N NE  . ARG A 1 63 ? 15.658  -0.131  -0.889  1.00 68.84 63 A 1 
ATOM 480 C CZ  . ARG A 1 63 ? 16.900  0.297   -0.757  1.00 61.21 63 A 1 
ATOM 481 N NH1 . ARG A 1 63 ? 17.897  -0.525  -0.569  1.00 57.23 63 A 1 
ATOM 482 N NH2 . ARG A 1 63 ? 17.163  1.573   -0.806  1.00 55.45 63 A 1 
ATOM 483 N N   . LEU A 1 64 ? 10.852  -4.997  -2.261  1.00 79.35 64 A 1 
ATOM 484 C CA  . LEU A 1 64 ? 10.576  -6.399  -2.549  1.00 77.22 64 A 1 
ATOM 485 C C   . LEU A 1 64 ? 11.859  -7.230  -2.422  1.00 78.17 64 A 1 
ATOM 486 O O   . LEU A 1 64 ? 12.891  -6.881  -3.010  1.00 75.93 64 A 1 
ATOM 487 C CB  . LEU A 1 64 ? 9.952   -6.576  -3.938  1.00 73.98 64 A 1 
ATOM 488 C CG  . LEU A 1 64 ? 8.479   -6.148  -4.041  1.00 68.04 64 A 1 
ATOM 489 C CD1 . LEU A 1 64 ? 7.997   -6.393  -5.475  1.00 65.06 64 A 1 
ATOM 490 C CD2 . LEU A 1 64 ? 7.554   -6.926  -3.114  1.00 64.68 64 A 1 
ATOM 491 N N   . PRO A 1 65 ? 11.815  -8.355  -1.684  1.00 75.88 65 A 1 
ATOM 492 C CA  . PRO A 1 65 ? 12.932  -9.279  -1.648  1.00 75.74 65 A 1 
ATOM 493 C C   . PRO A 1 65 ? 13.125  -9.919  -3.028  1.00 77.45 65 A 1 
ATOM 494 O O   . PRO A 1 65 ? 12.167  -10.192 -3.752  1.00 75.62 65 A 1 
ATOM 495 C CB  . PRO A 1 65 ? 12.578  -10.292 -0.559  1.00 73.32 65 A 1 
ATOM 496 C CG  . PRO A 1 65 ? 11.052  -10.311 -0.559  1.00 71.79 65 A 1 
ATOM 497 C CD  . PRO A 1 65 ? 10.683  -8.879  -0.917  1.00 74.18 65 A 1 
ATOM 498 N N   . LYS A 1 66 ? 14.372  -10.223 -3.391  1.00 76.08 66 A 1 
ATOM 499 C CA  . LYS A 1 66 ? 14.645  -11.040 -4.578  1.00 76.17 66 A 1 
ATOM 500 C C   . LYS A 1 66 ? 14.162  -12.464 -4.306  1.00 78.26 66 A 1 
ATOM 501 O O   . LYS A 1 66 ? 14.689  -13.138 -3.413  1.00 76.37 66 A 1 
ATOM 502 C CB  . LYS A 1 66 ? 16.133  -11.012 -4.953  1.00 73.08 66 A 1 
ATOM 503 C CG  . LYS A 1 66 ? 16.590  -9.631  -5.445  1.00 64.78 66 A 1 
ATOM 504 C CD  . LYS A 1 66 ? 18.058  -9.663  -5.904  1.00 62.07 66 A 1 
ATOM 505 C CE  . LYS A 1 66 ? 18.487  -8.268  -6.381  1.00 56.65 66 A 1 
ATOM 506 N NZ  . LYS A 1 66 ? 19.900  -8.239  -6.844  1.00 49.19 66 A 1 
ATOM 507 N N   . CYS A 1 67 ? 13.187  -12.912 -5.061  1.00 76.85 67 A 1 
ATOM 508 C CA  . CYS A 1 67 ? 12.616  -14.248 -4.955  1.00 76.96 67 A 1 
ATOM 509 C C   . CYS A 1 67 ? 12.524  -14.887 -6.342  1.00 77.05 67 A 1 
ATOM 510 O O   . CYS A 1 67 ? 12.352  -14.199 -7.343  1.00 74.62 67 A 1 
ATOM 511 C CB  . CYS A 1 67 ? 11.261  -14.228 -4.239  1.00 75.28 67 A 1 
ATOM 512 S SG  . CYS A 1 67 ? 10.581  -12.606 -3.851  1.00 69.77 67 A 1 
ATOM 513 N N   . LYS A 1 68 ? 12.664  -16.207 -6.379  1.00 80.04 68 A 1 
ATOM 514 C CA  . LYS A 1 68 ? 12.515  -17.003 -7.610  1.00 79.38 68 A 1 
ATOM 515 C C   . LYS A 1 68 ? 11.053  -17.365 -7.871  1.00 79.65 68 A 1 
ATOM 516 O O   . LYS A 1 68 ? 10.651  -17.451 -9.020  1.00 77.93 68 A 1 
ATOM 517 C CB  . LYS A 1 68 ? 13.388  -18.264 -7.531  1.00 79.17 68 A 1 
ATOM 518 C CG  . LYS A 1 68 ? 14.892  -17.946 -7.507  1.00 73.76 68 A 1 
ATOM 519 C CD  . LYS A 1 68 ? 15.704  -19.252 -7.523  1.00 69.64 68 A 1 
ATOM 520 C CE  . LYS A 1 68 ? 17.211  -18.968 -7.541  1.00 64.29 68 A 1 
ATOM 521 N NZ  . LYS A 1 68 ? 17.993  -20.232 -7.607  1.00 54.65 68 A 1 
ATOM 522 N N   . GLU A 1 69 ? 10.272  -17.519 -6.799  1.00 76.12 69 A 1 
ATOM 523 C CA  . GLU A 1 69 ? 8.866   -17.910 -6.843  1.00 78.09 69 A 1 
ATOM 524 C C   . GLU A 1 69 ? 8.003   -16.964 -5.998  1.00 78.11 69 A 1 
ATOM 525 O O   . GLU A 1 69 ? 8.447   -16.438 -4.974  1.00 76.72 69 A 1 
ATOM 526 C CB  . GLU A 1 69 ? 8.700   -19.352 -6.342  1.00 77.70 69 A 1 
ATOM 527 C CG  . GLU A 1 69 ? 9.443   -20.377 -7.215  1.00 70.64 69 A 1 
ATOM 528 C CD  . GLU A 1 69 ? 9.205   -21.826 -6.772  1.00 65.38 69 A 1 
ATOM 529 O OE1 . GLU A 1 69 ? 9.812   -22.716 -7.411  1.00 60.23 69 A 1 
ATOM 530 O OE2 . GLU A 1 69 ? 8.420   -22.034 -5.820  1.00 59.91 69 A 1 
ATOM 531 N N   . ALA A 1 70 ? 6.735   -16.783 -6.383  1.00 78.23 70 A 1 
ATOM 532 C CA  . ALA A 1 70 ? 5.799   -15.893 -5.688  1.00 76.79 70 A 1 
ATOM 533 C C   . ALA A 1 70 ? 5.589   -16.278 -4.208  1.00 78.33 70 A 1 
ATOM 534 O O   . ALA A 1 70 ? 5.511   -15.408 -3.341  1.00 75.86 70 A 1 
ATOM 535 C CB  . ALA A 1 70 ? 4.474   -15.910 -6.459  1.00 75.17 70 A 1 
ATOM 536 N N   . ARG A 1 71 ? 5.560   -17.580 -3.905  1.00 75.71 71 A 1 
ATOM 537 C CA  . ARG A 1 71 ? 5.397   -18.091 -2.535  1.00 77.52 71 A 1 
ATOM 538 C C   . ARG A 1 71 ? 6.545   -17.676 -1.612  1.00 78.49 71 A 1 
ATOM 539 O O   . ARG A 1 71 ? 6.308   -17.345 -0.451  1.00 77.36 71 A 1 
ATOM 540 C CB  . ARG A 1 71 ? 5.242   -19.617 -2.606  1.00 78.08 71 A 1 
ATOM 541 C CG  . ARG A 1 71 ? 4.768   -20.204 -1.274  1.00 71.51 71 A 1 
ATOM 542 C CD  . ARG A 1 71 ? 4.563   -21.716 -1.408  1.00 68.26 71 A 1 
ATOM 543 N NE  . ARG A 1 71 ? 4.006   -22.295 -0.170  1.00 62.44 71 A 1 
ATOM 544 C CZ  . ARG A 1 71 ? 3.782   -23.578 0.059   1.00 53.35 71 A 1 
ATOM 545 N NH1 . ARG A 1 71 ? 4.075   -24.494 -0.823  1.00 51.31 71 A 1 
ATOM 546 N NH2 . ARG A 1 71 ? 3.248   -23.962 1.182   1.00 49.55 71 A 1 
ATOM 547 N N   . ASP A 1 72 ? 7.771   -17.639 -2.128  1.00 75.36 72 A 1 
ATOM 548 C CA  . ASP A 1 72 ? 8.946   -17.195 -1.374  1.00 76.20 72 A 1 
ATOM 549 C C   . ASP A 1 72 ? 8.904   -15.691 -1.099  1.00 76.19 72 A 1 
ATOM 550 O O   . ASP A 1 72 ? 9.308   -15.248 -0.023  1.00 74.67 72 A 1 
ATOM 551 C CB  . ASP A 1 72 ? 10.229  -17.530 -2.143  1.00 75.74 72 A 1 
ATOM 552 C CG  . ASP A 1 72 ? 10.570  -19.018 -2.179  1.00 69.51 72 A 1 
ATOM 553 O OD1 . ASP A 1 72 ? 10.067  -19.755 -1.292  1.00 65.21 72 A 1 
ATOM 554 O OD2 . ASP A 1 72 ? 11.417  -19.359 -3.033  1.00 64.59 72 A 1 
ATOM 555 N N   . CYS A 1 73 ? 8.376   -14.901 -2.039  1.00 75.24 73 A 1 
ATOM 556 C CA  . CYS A 1 73 ? 8.155   -13.472 -1.837  1.00 73.11 73 A 1 
ATOM 557 C C   . CYS A 1 73 ? 7.187   -13.209 -0.687  1.00 73.00 73 A 1 
ATOM 558 O O   . CYS A 1 73 ? 7.523   -12.458 0.224   1.00 70.61 73 A 1 
ATOM 559 C CB  . CYS A 1 73 ? 7.629   -12.816 -3.118  1.00 71.25 73 A 1 
ATOM 560 S SG  . CYS A 1 73 ? 8.780   -12.712 -4.514  1.00 64.55 73 A 1 
ATOM 561 N N   . VAL A 1 74 ? 6.020   -13.866 -0.679  1.00 74.44 74 A 1 
ATOM 562 C CA  . VAL A 1 74 ? 5.011   -13.720 0.383   1.00 73.66 74 A 1 
ATOM 563 C C   . VAL A 1 74 ? 5.606   -14.078 1.746   1.00 73.51 74 A 1 
ATOM 564 O O   . VAL A 1 74 ? 5.459   -13.326 2.708   1.00 72.67 74 A 1 
ATOM 565 C CB  . VAL A 1 74 ? 3.773   -14.583 0.078   1.00 73.30 74 A 1 
ATOM 566 C CG1 . VAL A 1 74 ? 2.752   -14.562 1.223   1.00 67.19 74 A 1 
ATOM 567 C CG2 . VAL A 1 74 ? 3.058   -14.082 -1.184  1.00 67.83 74 A 1 
ATOM 568 N N   . ARG A 1 75 ? 6.339   -15.192 1.830   1.00 76.03 75 A 1 
ATOM 569 C CA  . ARG A 1 75 ? 6.972   -15.626 3.079   1.00 75.80 75 A 1 
ATOM 570 C C   . ARG A 1 75 ? 7.977   -14.604 3.611   1.00 75.12 75 A 1 
ATOM 571 O O   . ARG A 1 75 ? 7.974   -14.323 4.804   1.00 75.07 75 A 1 
ATOM 572 C CB  . ARG A 1 75 ? 7.620   -16.997 2.862   1.00 76.72 75 A 1 
ATOM 573 C CG  . ARG A 1 75 ? 8.136   -17.583 4.181   1.00 70.49 75 A 1 
ATOM 574 C CD  . ARG A 1 75 ? 8.745   -18.965 3.942   1.00 67.93 75 A 1 
ATOM 575 N NE  . ARG A 1 75 ? 9.184   -19.576 5.209   1.00 63.42 75 A 1 
ATOM 576 C CZ  . ARG A 1 75 ? 9.684   -20.788 5.357   1.00 55.54 75 A 1 
ATOM 577 N NH1 . ARG A 1 75 ? 9.874   -21.584 4.343   1.00 52.16 75 A 1 
ATOM 578 N NH2 . ARG A 1 75 ? 10.001  -21.227 6.545   1.00 51.12 75 A 1 
ATOM 579 N N   . LYS A 1 76 ? 8.830   -14.045 2.744   1.00 74.49 76 A 1 
ATOM 580 C CA  . LYS A 1 76 ? 9.834   -13.044 3.138   1.00 72.27 76 A 1 
ATOM 581 C C   . LYS A 1 76 ? 9.206   -11.701 3.509   1.00 70.61 76 A 1 
ATOM 582 O O   . LYS A 1 76 ? 9.668   -11.067 4.447   1.00 68.43 76 A 1 
ATOM 583 C CB  . LYS A 1 76 ? 10.852  -12.864 2.015   1.00 71.64 76 A 1 
ATOM 584 C CG  . LYS A 1 76 ? 11.805  -14.061 1.896   1.00 67.06 76 A 1 
ATOM 585 C CD  . LYS A 1 76 ? 12.763  -13.834 0.726   1.00 64.32 76 A 1 
ATOM 586 C CE  . LYS A 1 76 ? 13.723  -15.013 0.593   1.00 60.30 76 A 1 
ATOM 587 N NZ  . LYS A 1 76 ? 14.656  -14.814 -0.537  1.00 55.05 76 A 1 
ATOM 588 N N   . MET A 1 77 ? 8.149   -11.279 2.825   1.00 67.89 77 A 1 
ATOM 589 C CA  . MET A 1 77 ? 7.405   -10.064 3.178   1.00 67.10 77 A 1 
ATOM 590 C C   . MET A 1 77 ? 6.782   -10.181 4.569   1.00 67.65 77 A 1 
ATOM 591 O O   . MET A 1 77 ? 6.983   -9.294  5.390   1.00 65.95 77 A 1 
ATOM 592 C CB  . MET A 1 77 ? 6.339   -9.768  2.120   1.00 65.00 77 A 1 
ATOM 593 C CG  . MET A 1 77 ? 6.958   -9.259  0.817   1.00 60.46 77 A 1 
ATOM 594 S SD  . MET A 1 77 ? 5.768   -8.929  -0.512  1.00 56.43 77 A 1 
ATOM 595 C CE  . MET A 1 77 ? 4.991   -7.420  0.131   1.00 52.67 77 A 1 
ATOM 596 N N   . ASN A 1 78 ? 6.142   -11.311 4.887   1.00 70.54 78 A 1 
ATOM 597 C CA  . ASN A 1 78 ? 5.556   -11.555 6.209   1.00 70.86 78 A 1 
ATOM 598 C C   . ASN A 1 78 ? 6.586   -11.627 7.353   1.00 69.79 78 A 1 
ATOM 599 O O   . ASN A 1 78 ? 6.215   -11.482 8.506   1.00 68.26 78 A 1 
ATOM 600 C CB  . ASN A 1 78 ? 4.744   -12.860 6.156   1.00 71.22 78 A 1 
ATOM 601 C CG  . ASN A 1 78 ? 3.473   -12.768 5.333   1.00 67.38 78 A 1 
ATOM 602 O OD1 . ASN A 1 78 ? 3.041   -11.729 4.873   1.00 62.10 78 A 1 
ATOM 603 N ND2 . ASN A 1 78 ? 2.806   -13.875 5.123   1.00 61.70 78 A 1 
ATOM 604 N N   . GLN A 1 79 ? 7.859   -11.875 7.059   1.00 73.53 79 A 1 
ATOM 605 C CA  . GLN A 1 79 ? 8.943   -11.855 8.051   1.00 73.80 79 A 1 
ATOM 606 C C   . GLN A 1 79 ? 9.509   -10.448 8.299   1.00 71.55 79 A 1 
ATOM 607 O O   . GLN A 1 79 ? 10.286  -10.267 9.233   1.00 68.95 79 A 1 
ATOM 608 C CB  . GLN A 1 79 ? 10.074  -12.785 7.590   1.00 75.52 79 A 1 
ATOM 609 C CG  . GLN A 1 79 ? 9.702   -14.267 7.723   1.00 72.11 79 A 1 
ATOM 610 C CD  . GLN A 1 79 ? 10.765  -15.207 7.152   1.00 69.30 79 A 1 
ATOM 611 O OE1 . GLN A 1 79 ? 11.635  -14.865 6.362   1.00 67.22 79 A 1 
ATOM 612 N NE2 . GLN A 1 79 ? 10.729  -16.465 7.525   1.00 63.28 79 A 1 
ATOM 613 N N   . THR A 1 80 ? 9.181   -9.487  7.439   1.00 68.44 80 A 1 
ATOM 614 C CA  . THR A 1 80 ? 9.689   -8.104  7.490   1.00 64.48 80 A 1 
ATOM 615 C C   . THR A 1 80 ? 8.696   -7.150  8.167   1.00 60.65 80 A 1 
ATOM 616 O O   . THR A 1 80 ? 9.063   -6.026  8.491   1.00 57.25 80 A 1 
ATOM 617 C CB  . THR A 1 80 ? 10.047  -7.620  6.070   1.00 62.94 80 A 1 
ATOM 618 O OG1 . THR A 1 80 ? 10.840  -8.581  5.392   1.00 56.28 80 A 1 
ATOM 619 C CG2 . THR A 1 80 ? 10.866  -6.332  6.040   1.00 55.30 80 A 1 
ATOM 620 N N   . LEU A 1 81 ? 7.453   -7.595  8.380   1.00 66.52 81 A 1 
ATOM 621 C CA  . LEU A 1 81 ? 6.397   -6.899  9.122   1.00 64.05 81 A 1 
ATOM 622 C C   . LEU A 1 81 ? 6.467   -7.236  10.616  1.00 59.73 81 A 1 
ATOM 623 O O   . LEU A 1 81 ? 6.212   -6.310  11.423  1.00 55.45 81 A 1 
ATOM 624 C CB  . LEU A 1 81 ? 5.028   -7.304  8.531   1.00 60.12 81 A 1 
ATOM 625 C CG  . LEU A 1 81 ? 4.755   -6.810  7.099   1.00 55.05 81 A 1 
ATOM 626 C CD1 . LEU A 1 81 ? 3.482   -7.469  6.558   1.00 53.08 81 A 1 
ATOM 627 C CD2 . LEU A 1 81 ? 4.569   -5.300  7.054   1.00 53.49 81 A 1 
ATOM 628 O OXT . LEU A 1 81 ? 6.742   -8.417  10.920  1.00 51.57 81 A 1 
#
