# 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_sumo1-wt
#
_entry.id sumo1-wt
#
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" 
"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" 
"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 SER 2  
1 n ALA 3  
1 n ASN 4  
1 n GLN 5  
1 n GLU 6  
1 n GLU 7  
1 n ASP 8  
1 n LYS 9  
1 n LYS 10 
1 n PRO 11 
1 n GLY 12 
1 n ASP 13 
1 n GLY 14 
1 n GLY 15 
1 n ALA 16 
1 n HIS 17 
1 n ILE 18 
1 n ASN 19 
1 n LEU 20 
1 n LYS 21 
1 n VAL 22 
1 n LYS 23 
1 n GLY 24 
1 n GLN 25 
1 n ASP 26 
1 n GLY 27 
1 n ASN 28 
1 n GLU 29 
1 n VAL 30 
1 n PHE 31 
1 n PHE 32 
1 n ARG 33 
1 n ILE 34 
1 n LYS 35 
1 n ARG 36 
1 n SER 37 
1 n THR 38 
1 n GLN 39 
1 n LEU 40 
1 n LYS 41 
1 n LYS 42 
1 n LEU 43 
1 n MET 44 
1 n ASN 45 
1 n ALA 46 
1 n TYR 47 
1 n CYS 48 
1 n ASP 49 
1 n ARG 50 
1 n GLN 51 
1 n SER 52 
1 n VAL 53 
1 n ASP 54 
1 n MET 55 
1 n ASN 56 
1 n SER 57 
1 n ILE 58 
1 n ALA 59 
1 n PHE 60 
1 n LEU 61 
1 n PHE 62 
1 n ASP 63 
1 n GLY 64 
1 n ARG 65 
1 n ARG 66 
1 n LEU 67 
1 n ARG 68 
1 n ALA 69 
1 n GLU 70 
1 n GLN 71 
1 n THR 72 
1 n PRO 73 
1 n ASP 74 
1 n GLU 75 
1 n LEU 76 
1 n ASP 77 
1 n MET 78 
1 n GLU 79 
1 n ASP 80 
1 n GLY 81 
1 n ASP 82 
1 n GLU 83 
1 n ILE 84 
1 n ASP 85 
1 n ALA 86 
1 n MET 87 
1 n LEU 88 
1 n HIS 89 
1 n GLN 90 
1 n THR 91 
1 n GLY 92 
1 n GLY 93 
#
_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 @ 2026-05-06 20:21:05)"
_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 81.72
_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 29.50 1 1  
A SER 2  2 38.63 1 2  
A ALA 3  2 43.11 1 3  
A ASN 4  2 37.29 1 4  
A GLN 5  2 35.33 1 5  
A GLU 6  2 40.31 1 6  
A GLU 7  2 41.51 1 7  
A ASP 8  2 41.80 1 8  
A LYS 9  2 42.81 1 9  
A LYS 10 2 40.77 1 10 
A PRO 11 2 44.53 1 11 
A GLY 12 2 45.08 1 12 
A ASP 13 2 42.30 1 13 
A GLY 14 2 50.58 1 14 
A GLY 15 2 66.94 1 15 
A ALA 16 2 85.77 1 16 
A HIS 17 2 89.05 1 17 
A ILE 18 2 95.01 1 18 
A ASN 19 2 93.06 1 19 
A LEU 20 2 97.47 1 20 
A LYS 21 2 91.39 1 21 
A VAL 22 2 97.46 1 22 
A LYS 23 2 88.83 1 23 
A GLY 24 2 93.64 1 24 
A GLN 25 2 80.82 1 25 
A ASP 26 2 83.23 1 26 
A GLY 27 2 89.56 1 27 
A ASN 28 2 83.43 1 28 
A GLU 29 2 89.68 1 29 
A VAL 30 2 94.86 1 30 
A PHE 31 2 91.09 1 31 
A PHE 32 2 94.80 1 32 
A ARG 33 2 85.42 1 33 
A ILE 34 2 92.35 1 34 
A LYS 35 2 88.60 1 35 
A ARG 36 2 87.42 1 36 
A SER 37 2 94.40 1 37 
A THR 38 2 91.77 1 38 
A GLN 39 2 93.99 1 39 
A LEU 40 2 96.97 1 40 
A LYS 41 2 87.70 1 41 
A LYS 42 2 84.44 1 42 
A LEU 43 2 93.91 1 43 
A MET 44 2 95.38 1 44 
A ASN 45 2 91.19 1 45 
A ALA 46 2 96.01 1 46 
A TYR 47 2 95.34 1 47 
A CYS 48 2 93.99 1 48 
A ASP 49 2 88.91 1 49 
A ARG 50 2 79.43 1 50 
A GLN 51 2 85.95 1 51 
A SER 52 2 89.48 1 52 
A VAL 53 2 89.26 1 53 
A ASP 54 2 84.39 1 54 
A MET 55 2 83.21 1 55 
A ASN 56 2 82.83 1 56 
A SER 57 2 89.87 1 57 
A ILE 58 2 90.33 1 58 
A ALA 59 2 95.32 1 59 
A PHE 60 2 96.65 1 60 
A LEU 61 2 93.61 1 61 
A PHE 62 2 96.67 1 62 
A ASP 63 2 88.42 1 63 
A GLY 64 2 91.33 1 64 
A ARG 65 2 78.61 1 65 
A ARG 66 2 82.88 1 66 
A LEU 67 2 95.94 1 67 
A ARG 68 2 85.22 1 68 
A ALA 69 2 95.91 1 69 
A GLU 70 2 88.78 1 70 
A GLN 71 2 95.41 1 71 
A THR 72 2 96.58 1 72 
A PRO 73 2 96.82 1 73 
A ASP 74 2 90.74 1 74 
A GLU 75 2 90.04 1 75 
A LEU 76 2 95.94 1 76 
A ASP 77 2 91.01 1 77 
A MET 78 2 95.72 1 78 
A GLU 79 2 87.18 1 79 
A ASP 80 2 92.94 1 80 
A GLY 81 2 95.75 1 81 
A ASP 82 2 96.09 1 82 
A GLU 83 2 90.58 1 83 
A ILE 84 2 97.59 1 84 
A ASP 85 2 94.01 1 85 
A ALA 86 2 96.03 1 86 
A MET 87 2 85.91 1 87 
A LEU 88 2 80.32 1 88 
A HIS 89 2 66.78 1 89 
A GLN 90 2 58.94 1 90 
A THR 91 2 54.81 1 91 
A GLY 92 2 52.54 1 92 
A GLY 93 2 47.49 1 93 
#
_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 SER . 2  A 2  
A 3  1 n ALA . 3  A 3  
A 4  1 n ASN . 4  A 4  
A 5  1 n GLN . 5  A 5  
A 6  1 n GLU . 6  A 6  
A 7  1 n GLU . 7  A 7  
A 8  1 n ASP . 8  A 8  
A 9  1 n LYS . 9  A 9  
A 10 1 n LYS . 10 A 10 
A 11 1 n PRO . 11 A 11 
A 12 1 n GLY . 12 A 12 
A 13 1 n ASP . 13 A 13 
A 14 1 n GLY . 14 A 14 
A 15 1 n GLY . 15 A 15 
A 16 1 n ALA . 16 A 16 
A 17 1 n HIS . 17 A 17 
A 18 1 n ILE . 18 A 18 
A 19 1 n ASN . 19 A 19 
A 20 1 n LEU . 20 A 20 
A 21 1 n LYS . 21 A 21 
A 22 1 n VAL . 22 A 22 
A 23 1 n LYS . 23 A 23 
A 24 1 n GLY . 24 A 24 
A 25 1 n GLN . 25 A 25 
A 26 1 n ASP . 26 A 26 
A 27 1 n GLY . 27 A 27 
A 28 1 n ASN . 28 A 28 
A 29 1 n GLU . 29 A 29 
A 30 1 n VAL . 30 A 30 
A 31 1 n PHE . 31 A 31 
A 32 1 n PHE . 32 A 32 
A 33 1 n ARG . 33 A 33 
A 34 1 n ILE . 34 A 34 
A 35 1 n LYS . 35 A 35 
A 36 1 n ARG . 36 A 36 
A 37 1 n SER . 37 A 37 
A 38 1 n THR . 38 A 38 
A 39 1 n GLN . 39 A 39 
A 40 1 n LEU . 40 A 40 
A 41 1 n LYS . 41 A 41 
A 42 1 n LYS . 42 A 42 
A 43 1 n LEU . 43 A 43 
A 44 1 n MET . 44 A 44 
A 45 1 n ASN . 45 A 45 
A 46 1 n ALA . 46 A 46 
A 47 1 n TYR . 47 A 47 
A 48 1 n CYS . 48 A 48 
A 49 1 n ASP . 49 A 49 
A 50 1 n ARG . 50 A 50 
A 51 1 n GLN . 51 A 51 
A 52 1 n SER . 52 A 52 
A 53 1 n VAL . 53 A 53 
A 54 1 n ASP . 54 A 54 
A 55 1 n MET . 55 A 55 
A 56 1 n ASN . 56 A 56 
A 57 1 n SER . 57 A 57 
A 58 1 n ILE . 58 A 58 
A 59 1 n ALA . 59 A 59 
A 60 1 n PHE . 60 A 60 
A 61 1 n LEU . 61 A 61 
A 62 1 n PHE . 62 A 62 
A 63 1 n ASP . 63 A 63 
A 64 1 n GLY . 64 A 64 
A 65 1 n ARG . 65 A 65 
A 66 1 n ARG . 66 A 66 
A 67 1 n LEU . 67 A 67 
A 68 1 n ARG . 68 A 68 
A 69 1 n ALA . 69 A 69 
A 70 1 n GLU . 70 A 70 
A 71 1 n GLN . 71 A 71 
A 72 1 n THR . 72 A 72 
A 73 1 n PRO . 73 A 73 
A 74 1 n ASP . 74 A 74 
A 75 1 n GLU . 75 A 75 
A 76 1 n LEU . 76 A 76 
A 77 1 n ASP . 77 A 77 
A 78 1 n MET . 78 A 78 
A 79 1 n GLU . 79 A 79 
A 80 1 n ASP . 80 A 80 
A 81 1 n GLY . 81 A 81 
A 82 1 n ASP . 82 A 82 
A 83 1 n GLU . 83 A 83 
A 84 1 n ILE . 84 A 84 
A 85 1 n ASP . 85 A 85 
A 86 1 n ALA . 86 A 86 
A 87 1 n MET . 87 A 87 
A 88 1 n LEU . 88 A 88 
A 89 1 n HIS . 89 A 89 
A 90 1 n GLN . 90 A 90 
A 91 1 n THR . 91 A 91 
A 92 1 n GLY . 92 A 92 
A 93 1 n GLY . 93 A 93 
#
_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  ? -27.295 10.286  -16.102 1.00 28.52 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -26.537 11.269  -15.314 1.00 32.97 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -25.706 10.484  -14.307 1.00 33.49 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -26.269 9.923   -13.377 1.00 30.86 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -27.488 12.246  -14.616 1.00 31.87 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -28.215 13.164  -15.619 1.00 28.81 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -29.354 14.322  -14.816 1.00 26.97 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -29.901 15.293  -16.223 1.00 22.55 1  A 1 
ATOM 9   N N   . SER A 1 2  ? -24.422 10.337  -14.543 1.00 37.43 2  A 1 
ATOM 10  C CA  . SER A 1 2  ? -23.531 9.550   -13.684 1.00 41.41 2  A 1 
ATOM 11  C C   . SER A 1 2  ? -23.172 10.388  -12.457 1.00 39.99 2  A 1 
ATOM 12  O O   . SER A 1 2  ? -22.475 11.387  -12.589 1.00 37.86 2  A 1 
ATOM 13  C CB  . SER A 1 2  ? -22.276 9.151   -14.465 1.00 40.00 2  A 1 
ATOM 14  O OG  . SER A 1 2  ? -22.653 8.511   -15.677 1.00 35.12 2  A 1 
ATOM 15  N N   . ALA A 1 3  ? -23.683 10.013  -11.282 1.00 40.49 3  A 1 
ATOM 16  C CA  . ALA A 1 3  ? -23.616 10.834  -10.065 1.00 44.80 3  A 1 
ATOM 17  C C   . ALA A 1 3  ? -22.210 10.948  -9.449  1.00 45.94 3  A 1 
ATOM 18  O O   . ALA A 1 3  ? -21.926 11.922  -8.768  1.00 42.35 3  A 1 
ATOM 19  C CB  . ALA A 1 3  ? -24.610 10.239  -9.061  1.00 41.96 3  A 1 
ATOM 20  N N   . ASN A 1 4  ? -21.327 9.973   -9.682  1.00 39.68 4  A 1 
ATOM 21  C CA  . ASN A 1 4  ? -20.032 9.884   -8.991  1.00 41.98 4  A 1 
ATOM 22  C C   . ASN A 1 4  ? -18.943 10.820  -9.550  1.00 41.13 4  A 1 
ATOM 23  O O   . ASN A 1 4  ? -17.762 10.486  -9.475  1.00 38.52 4  A 1 
ATOM 24  C CB  . ASN A 1 4  ? -19.563 8.416   -8.979  1.00 40.06 4  A 1 
ATOM 25  C CG  . ASN A 1 4  ? -20.356 7.515   -8.053  1.00 33.95 4  A 1 
ATOM 26  O OD1 . ASN A 1 4  ? -21.386 7.850   -7.507  1.00 31.60 4  A 1 
ATOM 27  N ND2 . ASN A 1 4  ? -19.893 6.304   -7.851  1.00 31.37 4  A 1 
ATOM 28  N N   . GLN A 1 5  ? -19.300 11.949  -10.139 1.00 36.71 5  A 1 
ATOM 29  C CA  . GLN A 1 5  ? -18.328 12.881  -10.726 1.00 39.55 5  A 1 
ATOM 30  C C   . GLN A 1 5  ? -17.647 13.793  -9.692  1.00 40.04 5  A 1 
ATOM 31  O O   . GLN A 1 5  ? -16.662 14.450  -10.020 1.00 38.04 5  A 1 
ATOM 32  C CB  . GLN A 1 5  ? -19.024 13.683  -11.827 1.00 37.84 5  A 1 
ATOM 33  C CG  . GLN A 1 5  ? -18.017 14.395  -12.740 1.00 33.71 5  A 1 
ATOM 34  C CD  . GLN A 1 5  ? -18.667 15.126  -13.905 1.00 30.75 5  A 1 
ATOM 35  O OE1 . GLN A 1 5  ? -19.856 15.087  -14.148 1.00 30.22 5  A 1 
ATOM 36  N NE2 . GLN A 1 5  ? -17.898 15.831  -14.695 1.00 31.11 5  A 1 
ATOM 37  N N   . GLU A 1 6  ? -18.159 13.870  -8.472  1.00 42.23 6  A 1 
ATOM 38  C CA  . GLU A 1 6  ? -17.582 14.712  -7.429  1.00 45.44 6  A 1 
ATOM 39  C C   . GLU A 1 6  ? -16.292 14.085  -6.880  1.00 45.54 6  A 1 
ATOM 40  O O   . GLU A 1 6  ? -16.245 13.492  -5.811  1.00 43.79 6  A 1 
ATOM 41  C CB  . GLU A 1 6  ? -18.617 15.045  -6.345  1.00 44.26 6  A 1 
ATOM 42  C CG  . GLU A 1 6  ? -19.709 15.966  -6.904  1.00 38.47 6  A 1 
ATOM 43  C CD  . GLU A 1 6  ? -20.772 16.309  -5.861  1.00 35.25 6  A 1 
ATOM 44  O OE1 . GLU A 1 6  ? -20.752 17.449  -5.360  1.00 32.41 6  A 1 
ATOM 45  O OE2 . GLU A 1 6  ? -21.637 15.437  -5.601  1.00 35.38 6  A 1 
ATOM 46  N N   . GLU A 1 7  ? -15.190 14.261  -7.625  1.00 44.30 7  A 1 
ATOM 47  C CA  . GLU A 1 7  ? -13.885 14.461  -7.021  1.00 46.58 7  A 1 
ATOM 48  C C   . GLU A 1 7  ? -13.940 15.776  -6.227  1.00 46.31 7  A 1 
ATOM 49  O O   . GLU A 1 7  ? -13.385 16.795  -6.637  1.00 43.99 7  A 1 
ATOM 50  C CB  . GLU A 1 7  ? -12.763 14.506  -8.078  1.00 45.49 7  A 1 
ATOM 51  C CG  . GLU A 1 7  ? -12.479 13.167  -8.756  1.00 39.95 7  A 1 
ATOM 52  C CD  . GLU A 1 7  ? -11.217 13.272  -9.624  1.00 36.63 7  A 1 
ATOM 53  O OE1 . GLU A 1 7  ? -10.154 12.771  -9.192  1.00 34.00 7  A 1 
ATOM 54  O OE2 . GLU A 1 7  ? -11.288 13.888  -10.713 1.00 36.34 7  A 1 
ATOM 55  N N   . ASP A 1 8  ? -14.627 15.767  -5.083  1.00 44.82 8  A 1 
ATOM 56  C CA  . ASP A 1 8  ? -14.504 16.813  -4.078  1.00 46.30 8  A 1 
ATOM 57  C C   . ASP A 1 8  ? -13.103 16.708  -3.464  1.00 45.63 8  A 1 
ATOM 58  O O   . ASP A 1 8  ? -12.863 16.291  -2.334  1.00 42.85 8  A 1 
ATOM 59  C CB  . ASP A 1 8  ? -15.645 16.764  -3.046  1.00 44.41 8  A 1 
ATOM 60  C CG  . ASP A 1 8  ? -15.703 18.083  -2.261  1.00 39.23 8  A 1 
ATOM 61  O OD1 . ASP A 1 8  ? -15.111 18.173  -1.167  1.00 35.80 8  A 1 
ATOM 62  O OD2 . ASP A 1 8  ? -16.310 19.039  -2.785  1.00 35.37 8  A 1 
ATOM 63  N N   . LYS A 1 9  ? -12.124 17.061  -4.296  1.00 47.18 9  A 1 
ATOM 64  C CA  . LYS A 1 9  ? -10.742 17.291  -3.913  1.00 47.91 9  A 1 
ATOM 65  C C   . LYS A 1 9  ? -10.675 18.645  -3.213  1.00 47.83 9  A 1 
ATOM 66  O O   . LYS A 1 9  ? -9.909  19.524  -3.599  1.00 45.60 9  A 1 
ATOM 67  C CB  . LYS A 1 9  ? -9.840  17.164  -5.150  1.00 46.24 9  A 1 
ATOM 68  C CG  . LYS A 1 9  ? -8.363  16.983  -4.796  1.00 41.33 9  A 1 
ATOM 69  C CD  . LYS A 1 9  ? -7.557  16.893  -6.091  1.00 39.22 9  A 1 
ATOM 70  C CE  . LYS A 1 9  ? -6.088  16.627  -5.816  1.00 35.83 9  A 1 
ATOM 71  N NZ  . LYS A 1 9  ? -5.308  16.608  -7.078  1.00 34.18 9  A 1 
ATOM 72  N N   . LYS A 1 10 ? -11.512 18.827  -2.212  1.00 45.70 10 A 1 
ATOM 73  C CA  . LYS A 1 10 ? -11.353 19.927  -1.280  1.00 46.75 10 A 1 
ATOM 74  C C   . LYS A 1 10 ? -9.967  19.745  -0.677  1.00 47.23 10 A 1 
ATOM 75  O O   . LYS A 1 10 ? -9.697  18.669  -0.128  1.00 44.89 10 A 1 
ATOM 76  C CB  . LYS A 1 10 ? -12.486 19.895  -0.248  1.00 44.64 10 A 1 
ATOM 77  C CG  . LYS A 1 10 ? -12.673 21.255  0.432   1.00 38.91 10 A 1 
ATOM 78  C CD  . LYS A 1 10 ? -13.944 21.215  1.280   1.00 35.87 10 A 1 
ATOM 79  C CE  . LYS A 1 10 ? -14.288 22.597  1.809   1.00 32.41 10 A 1 
ATOM 80  N NZ  . LYS A 1 10 ? -15.614 22.580  2.474   1.00 30.51 10 A 1 
ATOM 81  N N   . PRO A 1 11 ? -9.064  20.719  -0.808  1.00 46.33 11 A 1 
ATOM 82  C CA  . PRO A 1 11 ? -7.819  20.710  -0.063  1.00 46.11 11 A 1 
ATOM 83  C C   . PRO A 1 11 ? -8.193  20.895  1.410   1.00 47.17 11 A 1 
ATOM 84  O O   . PRO A 1 11 ? -8.203  21.998  1.943   1.00 44.94 11 A 1 
ATOM 85  C CB  . PRO A 1 11 ? -6.992  21.853  -0.661  1.00 42.93 11 A 1 
ATOM 86  C CG  . PRO A 1 11 ? -8.047  22.847  -1.139  1.00 41.09 11 A 1 
ATOM 87  C CD  . PRO A 1 11 ? -9.227  21.967  -1.538  1.00 43.12 11 A 1 
ATOM 88  N N   . GLY A 1 12 ? -8.638  19.809  2.022   1.00 44.94 12 A 1 
ATOM 89  C CA  . GLY A 1 12 ? -8.911  19.751  3.439   1.00 44.99 12 A 1 
ATOM 90  C C   . GLY A 1 12 ? -7.608  19.865  4.214   1.00 46.48 12 A 1 
ATOM 91  O O   . GLY A 1 12 ? -6.512  19.732  3.670   1.00 43.92 12 A 1 
ATOM 92  N N   . ASP A 1 13 ? -7.769  20.119  5.499   1.00 46.60 13 A 1 
ATOM 93  C CA  . ASP A 1 13 ? -6.725  20.255  6.495   1.00 47.45 13 A 1 
ATOM 94  C C   . ASP A 1 13 ? -5.638  19.184  6.357   1.00 49.17 13 A 1 
ATOM 95  O O   . ASP A 1 13 ? -5.888  18.008  6.621   1.00 44.96 13 A 1 
ATOM 96  C CB  . ASP A 1 13 ? -7.435  20.170  7.852   1.00 43.57 13 A 1 
ATOM 97  C CG  . ASP A 1 13 ? -6.494  20.410  9.022   1.00 38.47 13 A 1 
ATOM 98  O OD1 . ASP A 1 13 ? -5.680  21.351  8.915   1.00 34.28 13 A 1 
ATOM 99  O OD2 . ASP A 1 13 ? -6.625  19.673  10.009  1.00 33.86 13 A 1 
ATOM 100 N N   . GLY A 1 14 ? -4.441  19.591  5.909   1.00 49.88 14 A 1 
ATOM 101 C CA  . GLY A 1 14 ? -3.103  19.024  6.099   1.00 50.29 14 A 1 
ATOM 102 C C   . GLY A 1 14 ? -2.827  17.545  5.832   1.00 52.63 14 A 1 
ATOM 103 O O   . GLY A 1 14 ? -1.660  17.150  5.800   1.00 49.53 14 A 1 
ATOM 104 N N   . GLY A 1 15 ? -3.840  16.702  5.669   1.00 63.96 15 A 1 
ATOM 105 C CA  . GLY A 1 15 ? -3.714  15.261  5.559   1.00 65.62 15 A 1 
ATOM 106 C C   . GLY A 1 15 ? -3.132  14.847  4.217   1.00 71.32 15 A 1 
ATOM 107 O O   . GLY A 1 15 ? -3.874  14.390  3.352   1.00 66.85 15 A 1 
ATOM 108 N N   . ALA A 1 16 ? -1.816  14.998  4.077   1.00 83.68 16 A 1 
ATOM 109 C CA  . ALA A 1 16 ? -1.077  14.575  2.909   1.00 87.41 16 A 1 
ATOM 110 C C   . ALA A 1 16 ? -1.355  13.092  2.647   1.00 90.91 16 A 1 
ATOM 111 O O   . ALA A 1 16 ? -1.205  12.240  3.520   1.00 87.75 16 A 1 
ATOM 112 C CB  . ALA A 1 16 ? 0.410   14.869  3.119   1.00 79.12 16 A 1 
ATOM 113 N N   . HIS A 1 17 ? -1.819  12.811  1.436   1.00 94.29 17 A 1 
ATOM 114 C CA  . HIS A 1 17 ? -1.860  11.452  0.938   1.00 95.44 17 A 1 
ATOM 115 C C   . HIS A 1 17 ? -0.508  11.168  0.313   1.00 96.07 17 A 1 
ATOM 116 O O   . HIS A 1 17 ? -0.035  11.962  -0.495  1.00 94.55 17 A 1 
ATOM 117 C CB  . HIS A 1 17 ? -2.983  11.277  -0.075  1.00 93.81 17 A 1 
ATOM 118 C CG  . HIS A 1 17 ? -4.358  11.376  0.524   1.00 92.12 17 A 1 
ATOM 119 N ND1 . HIS A 1 17 ? -4.968  12.523  0.980   1.00 79.71 17 A 1 
ATOM 120 C CD2 . HIS A 1 17 ? -5.258  10.359  0.703   1.00 79.71 17 A 1 
ATOM 121 C CE1 . HIS A 1 17 ? -6.188  12.208  1.423   1.00 81.34 17 A 1 
ATOM 122 N NE2 . HIS A 1 17 ? -6.410  10.899  1.264   1.00 83.41 17 A 1 
ATOM 123 N N   . ILE A 1 18 ? 0.074   10.036  0.666   1.00 96.83 18 A 1 
ATOM 124 C CA  . ILE A 1 18 ? 1.310   9.529   0.085   1.00 96.83 18 A 1 
ATOM 125 C C   . ILE A 1 18 ? 0.991   8.304   -0.756  1.00 97.17 18 A 1 
ATOM 126 O O   . ILE A 1 18 ? 0.017   7.591   -0.483  1.00 96.84 18 A 1 
ATOM 127 C CB  . ILE A 1 18 ? 2.374   9.255   1.165   1.00 96.13 18 A 1 
ATOM 128 C CG1 . ILE A 1 18 ? 1.916   8.213   2.205   1.00 92.87 18 A 1 
ATOM 129 C CG2 . ILE A 1 18 ? 2.760   10.593  1.834   1.00 90.54 18 A 1 
ATOM 130 C CD1 . ILE A 1 18 ? 3.035   7.776   3.146   1.00 92.91 18 A 1 
ATOM 131 N N   . ASN A 1 19 ? 1.791   8.071   -1.793  1.00 97.21 19 A 1 
ATOM 132 C CA  . ASN A 1 19 ? 1.710   6.867   -2.602  1.00 97.27 19 A 1 
ATOM 133 C C   . ASN A 1 19 ? 2.762   5.889   -2.089  1.00 97.55 19 A 1 
ATOM 134 O O   . ASN A 1 19 ? 3.951   6.185   -2.130  1.00 97.05 19 A 1 
ATOM 135 C CB  . ASN A 1 19 ? 1.903   7.212   -4.079  1.00 96.34 19 A 1 
ATOM 136 C CG  . ASN A 1 19 ? 0.892   8.231   -4.562  1.00 92.92 19 A 1 
ATOM 137 O OD1 . ASN A 1 19 ? -0.266  7.938   -4.820  1.00 84.07 19 A 1 
ATOM 138 N ND2 . ASN A 1 19 ? 1.295   9.481   -4.670  1.00 82.03 19 A 1 
ATOM 139 N N   . LEU A 1 20 ? 2.325   4.730   -1.609  1.00 97.86 20 A 1 
ATOM 140 C CA  . LEU A 1 20 ? 3.216   3.663   -1.181  1.00 97.95 20 A 1 
ATOM 141 C C   . LEU A 1 20 ? 3.220   2.572   -2.239  1.00 97.92 20 A 1 
ATOM 142 O O   . LEU A 1 20 ? 2.159   2.178   -2.732  1.00 97.38 20 A 1 
ATOM 143 C CB  . LEU A 1 20 ? 2.780   3.122   0.188   1.00 97.81 20 A 1 
ATOM 144 C CG  . LEU A 1 20 ? 2.871   4.148   1.324   1.00 97.42 20 A 1 
ATOM 145 C CD1 . LEU A 1 20 ? 2.315   3.539   2.609   1.00 96.82 20 A 1 
ATOM 146 C CD2 . LEU A 1 20 ? 4.309   4.602   1.585   1.00 96.59 20 A 1 
ATOM 147 N N   . LYS A 1 21 ? 4.398   2.068   -2.567  1.00 97.94 21 A 1 
ATOM 148 C CA  . LYS A 1 21 ? 4.568   0.956   -3.495  1.00 97.91 21 A 1 
ATOM 149 C C   . LYS A 1 21 ? 4.764   -0.324  -2.699  1.00 98.02 21 A 1 
ATOM 150 O O   . LYS A 1 21 ? 5.723   -0.445  -1.952  1.00 97.65 21 A 1 
ATOM 151 C CB  . LYS A 1 21 ? 5.744   1.269   -4.426  1.00 96.96 21 A 1 
ATOM 152 C CG  . LYS A 1 21 ? 5.906   0.169   -5.491  1.00 90.36 21 A 1 
ATOM 153 C CD  . LYS A 1 21 ? 7.022   0.495   -6.496  1.00 89.05 21 A 1 
ATOM 154 C CE  . LYS A 1 21 ? 8.373   0.579   -5.785  1.00 79.24 21 A 1 
ATOM 155 N NZ  . LYS A 1 21 ? 9.499   0.329   -6.696  1.00 75.38 21 A 1 
ATOM 156 N N   . VAL A 1 22 ? 3.875   -1.286  -2.871  1.00 97.95 22 A 1 
ATOM 157 C CA  . VAL A 1 22 ? 4.022   -2.608  -2.256  1.00 97.84 22 A 1 
ATOM 158 C C   . VAL A 1 22 ? 4.541   -3.570  -3.306  1.00 97.58 22 A 1 
ATOM 159 O O   . VAL A 1 22 ? 3.879   -3.797  -4.317  1.00 96.91 22 A 1 
ATOM 160 C CB  . VAL A 1 22 ? 2.713   -3.109  -1.630  1.00 97.64 22 A 1 
ATOM 161 C CG1 . VAL A 1 22 ? 2.955   -4.412  -0.868  1.00 97.11 22 A 1 
ATOM 162 C CG2 . VAL A 1 22 ? 2.139   -2.088  -0.644  1.00 97.20 22 A 1 
ATOM 163 N N   . LYS A 1 23 ? 5.720   -4.123  -3.063  1.00 97.15 23 A 1 
ATOM 164 C CA  . LYS A 1 23 ? 6.377   -5.077  -3.949  1.00 96.74 23 A 1 
ATOM 165 C C   . LYS A 1 23 ? 6.183   -6.489  -3.424  1.00 96.45 23 A 1 
ATOM 166 O O   . LYS A 1 23 ? 6.592   -6.820  -2.313  1.00 95.54 23 A 1 
ATOM 167 C CB  . LYS A 1 23 ? 7.843   -4.674  -4.070  1.00 95.70 23 A 1 
ATOM 168 C CG  . LYS A 1 23 ? 8.582   -5.497  -5.126  1.00 87.00 23 A 1 
ATOM 169 C CD  . LYS A 1 23 ? 9.996   -4.931  -5.196  1.00 84.94 23 A 1 
ATOM 170 C CE  . LYS A 1 23 ? 10.854  -5.581  -6.269  1.00 76.03 23 A 1 
ATOM 171 N NZ  . LYS A 1 23 ? 12.152  -4.874  -6.276  1.00 69.88 23 A 1 
ATOM 172 N N   . GLY A 1 24 ? 5.539   -7.325  -4.226  1.00 95.49 24 A 1 
ATOM 173 C CA  . GLY A 1 24 ? 5.355   -8.734  -3.913  1.00 94.09 24 A 1 
ATOM 174 C C   . GLY A 1 24 ? 6.620   -9.555  -4.158  1.00 93.55 24 A 1 
ATOM 175 O O   . GLY A 1 24 ? 7.518   -9.143  -4.890  1.00 91.45 24 A 1 
ATOM 176 N N   . GLN A 1 25 ? 6.644   -10.753 -3.587  1.00 91.63 25 A 1 
ATOM 177 C CA  . GLN A 1 25 ? 7.732   -11.712 -3.807  1.00 89.81 25 A 1 
ATOM 178 C C   . GLN A 1 25 ? 7.876   -12.092 -5.296  1.00 89.76 25 A 1 
ATOM 179 O O   . GLN A 1 25 ? 8.989   -12.308 -5.772  1.00 86.00 25 A 1 
ATOM 180 C CB  . GLN A 1 25 ? 7.448   -12.937 -2.928  1.00 86.35 25 A 1 
ATOM 181 C CG  . GLN A 1 25 ? 8.610   -13.935 -2.930  1.00 78.01 25 A 1 
ATOM 182 C CD  . GLN A 1 25 ? 8.401   -15.002 -1.850  1.00 73.45 25 A 1 
ATOM 183 O OE1 . GLN A 1 25 ? 7.448   -15.765 -1.847  1.00 67.67 25 A 1 
ATOM 184 N NE2 . GLN A 1 25 ? 9.269   -15.078 -0.872  1.00 64.71 25 A 1 
ATOM 185 N N   . ASP A 1 26 ? 6.766   -12.074 -6.042  1.00 89.76 26 A 1 
ATOM 186 C CA  . ASP A 1 26 ? 6.732   -12.332 -7.490  1.00 88.53 26 A 1 
ATOM 187 C C   . ASP A 1 26 ? 7.235   -11.143 -8.337  1.00 89.56 26 A 1 
ATOM 188 O O   . ASP A 1 26 ? 7.183   -11.171 -9.566  1.00 85.73 26 A 1 
ATOM 189 C CB  . ASP A 1 26 ? 5.299   -12.714 -7.888  1.00 84.31 26 A 1 
ATOM 190 C CG  . ASP A 1 26 ? 4.789   -13.900 -7.074  1.00 79.20 26 A 1 
ATOM 191 O OD1 . ASP A 1 26 ? 5.178   -15.039 -7.419  1.00 72.16 26 A 1 
ATOM 192 O OD2 . ASP A 1 26 ? 4.049   -13.651 -6.102  1.00 76.63 26 A 1 
ATOM 193 N N   . GLY A 1 27 ? 7.696   -10.062 -7.694  1.00 89.61 27 A 1 
ATOM 194 C CA  . GLY A 1 27 ? 8.128   -8.832  -8.364  1.00 89.69 27 A 1 
ATOM 195 C C   . GLY A 1 27 ? 6.983   -7.933  -8.824  1.00 91.00 27 A 1 
ATOM 196 O O   . GLY A 1 27 ? 7.239   -6.889  -9.428  1.00 87.96 27 A 1 
ATOM 197 N N   . ASN A 1 28 ? 5.729   -8.307  -8.532  1.00 91.21 28 A 1 
ATOM 198 C CA  . ASN A 1 28 ? 4.576   -7.480  -8.856  1.00 91.51 28 A 1 
ATOM 199 C C   . ASN A 1 28 ? 4.509   -6.268  -7.918  1.00 93.50 28 A 1 
ATOM 200 O O   . ASN A 1 28 ? 4.506   -6.416  -6.698  1.00 92.61 28 A 1 
ATOM 201 C CB  . ASN A 1 28 ? 3.305   -8.331  -8.781  1.00 87.18 28 A 1 
ATOM 202 C CG  . ASN A 1 28 ? 2.101   -7.560  -9.289  1.00 76.60 28 A 1 
ATOM 203 O OD1 . ASN A 1 28 ? 2.115   -6.954  -10.344 1.00 66.65 28 A 1 
ATOM 204 N ND2 . ASN A 1 28 ? 1.017   -7.544  -8.550  1.00 68.17 28 A 1 
ATOM 205 N N   . GLU A 1 29 ? 4.417   -5.074  -8.490  1.00 94.50 29 A 1 
ATOM 206 C CA  . GLU A 1 29 ? 4.357   -3.822  -7.748  1.00 95.03 29 A 1 
ATOM 207 C C   . GLU A 1 29 ? 2.929   -3.279  -7.765  1.00 95.33 29 A 1 
ATOM 208 O O   . GLU A 1 29 ? 2.302   -3.149  -8.822  1.00 93.95 29 A 1 
ATOM 209 C CB  . GLU A 1 29 ? 5.347   -2.811  -8.331  1.00 93.06 29 A 1 
ATOM 210 C CG  . GLU A 1 29 ? 6.802   -3.303  -8.266  1.00 87.33 29 A 1 
ATOM 211 C CD  . GLU A 1 29 ? 7.788   -2.257  -8.803  1.00 86.03 29 A 1 
ATOM 212 O OE1 . GLU A 1 29 ? 8.895   -2.130  -8.242  1.00 81.23 29 A 1 
ATOM 213 O OE2 . GLU A 1 29 ? 7.438   -1.527  -9.760  1.00 80.63 29 A 1 
ATOM 214 N N   . VAL A 1 30 ? 2.400   -2.946  -6.588  1.00 96.30 30 A 1 
ATOM 215 C CA  . VAL A 1 30 ? 1.065   -2.373  -6.433  1.00 96.20 30 A 1 
ATOM 216 C C   . VAL A 1 30 ? 1.173   -1.048  -5.697  1.00 96.95 30 A 1 
ATOM 217 O O   . VAL A 1 30 ? 1.706   -0.975  -4.594  1.00 96.57 30 A 1 
ATOM 218 C CB  . VAL A 1 30 ? 0.107   -3.339  -5.714  1.00 94.63 30 A 1 
ATOM 219 C CG1 . VAL A 1 30 ? -1.315  -2.775  -5.722  1.00 91.54 30 A 1 
ATOM 220 C CG2 . VAL A 1 30 ? 0.050   -4.710  -6.395  1.00 91.83 30 A 1 
ATOM 221 N N   . PHE A 1 31 ? 0.637   0.006   -6.308  1.00 96.67 31 A 1 
ATOM 222 C CA  . PHE A 1 31 ? 0.645   1.341   -5.729  1.00 96.58 31 A 1 
ATOM 223 C C   . PHE A 1 31 ? -0.636  1.583   -4.936  1.00 96.48 31 A 1 
ATOM 224 O O   . PHE A 1 31 ? -1.747  1.358   -5.424  1.00 95.26 31 A 1 
ATOM 225 C CB  . PHE A 1 31 ? 0.837   2.379   -6.830  1.00 95.54 31 A 1 
ATOM 226 C CG  . PHE A 1 31 ? 2.167   2.246   -7.542  1.00 92.92 31 A 1 
ATOM 227 C CD1 . PHE A 1 31 ? 3.288   2.959   -7.087  1.00 88.72 31 A 1 
ATOM 228 C CD2 . PHE A 1 31 ? 2.297   1.386   -8.648  1.00 87.64 31 A 1 
ATOM 229 C CE1 . PHE A 1 31 ? 4.524   2.823   -7.732  1.00 84.87 31 A 1 
ATOM 230 C CE2 . PHE A 1 31 ? 3.534   1.242   -9.294  1.00 84.10 31 A 1 
ATOM 231 C CZ  . PHE A 1 31 ? 4.647   1.964   -8.837  1.00 83.20 31 A 1 
ATOM 232 N N   . PHE A 1 32 ? -0.485  2.082   -3.704  1.00 96.95 32 A 1 
ATOM 233 C CA  . PHE A 1 32 ? -1.584  2.458   -2.829  1.00 96.80 32 A 1 
ATOM 234 C C   . PHE A 1 32 ? -1.463  3.919   -2.443  1.00 96.92 32 A 1 
ATOM 235 O O   . PHE A 1 32 ? -0.439  4.358   -1.936  1.00 96.07 32 A 1 
ATOM 236 C CB  . PHE A 1 32 ? -1.594  1.576   -1.586  1.00 96.24 32 A 1 
ATOM 237 C CG  . PHE A 1 32 ? -1.968  0.145   -1.880  1.00 95.94 32 A 1 
ATOM 238 C CD1 . PHE A 1 32 ? -3.320  -0.234  -1.933  1.00 93.86 32 A 1 
ATOM 239 C CD2 . PHE A 1 32 ? -0.964  -0.808  -2.111  1.00 93.80 32 A 1 
ATOM 240 C CE1 . PHE A 1 32 ? -3.669  -1.562  -2.200  1.00 91.86 32 A 1 
ATOM 241 C CE2 . PHE A 1 32 ? -1.311  -2.138  -2.381  1.00 92.07 32 A 1 
ATOM 242 C CZ  . PHE A 1 32 ? -2.662  -2.516  -2.423  1.00 92.27 32 A 1 
ATOM 243 N N   . ARG A 1 33 ? -2.550  4.666   -2.619  1.00 96.50 33 A 1 
ATOM 244 C CA  . ARG A 1 33 ? -2.656  6.029   -2.108  1.00 96.32 33 A 1 
ATOM 245 C C   . ARG A 1 33 ? -3.317  5.994   -0.739  1.00 96.31 33 A 1 
ATOM 246 O O   . ARG A 1 33 ? -4.487  5.636   -0.618  1.00 95.21 33 A 1 
ATOM 247 C CB  . ARG A 1 33 ? -3.400  6.880   -3.134  1.00 95.13 33 A 1 
ATOM 248 C CG  . ARG A 1 33 ? -3.347  8.357   -2.744  1.00 90.96 33 A 1 
ATOM 249 C CD  . ARG A 1 33 ? -4.001  9.178   -3.845  1.00 87.28 33 A 1 
ATOM 250 N NE  . ARG A 1 33 ? -3.999  10.609  -3.512  1.00 79.18 33 A 1 
ATOM 251 C CZ  . ARG A 1 33 ? -4.553  11.557  -4.236  1.00 72.61 33 A 1 
ATOM 252 N NH1 . ARG A 1 33 ? -5.152  11.296  -5.365  1.00 66.40 33 A 1 
ATOM 253 N NH2 . ARG A 1 33 ? -4.512  12.784  -3.822  1.00 63.77 33 A 1 
ATOM 254 N N   . ILE A 1 34 ? -2.590  6.393   0.301   1.00 96.42 34 A 1 
ATOM 255 C CA  . ILE A 1 34 ? -3.058  6.383   1.685   1.00 96.27 34 A 1 
ATOM 256 C C   . ILE A 1 34 ? -2.757  7.719   2.361   1.00 96.62 34 A 1 
ATOM 257 O O   . ILE A 1 34 ? -1.775  8.388   2.051   1.00 96.30 34 A 1 
ATOM 258 C CB  . ILE A 1 34 ? -2.471  5.160   2.431   1.00 95.16 34 A 1 
ATOM 259 C CG1 . ILE A 1 34 ? -3.152  4.986   3.802   1.00 87.28 34 A 1 
ATOM 260 C CG2 . ILE A 1 34 ? -0.943  5.246   2.560   1.00 84.88 34 A 1 
ATOM 261 C CD1 . ILE A 1 34 ? -2.860  3.642   4.475   1.00 85.87 34 A 1 
ATOM 262 N N   . LYS A 1 35 ? -3.621  8.129   3.283   1.00 96.53 35 A 1 
ATOM 263 C CA  . LYS A 1 35 ? -3.356  9.294   4.124   1.00 96.28 35 A 1 
ATOM 264 C C   . LYS A 1 35 ? -2.308  8.916   5.175   1.00 96.46 35 A 1 
ATOM 265 O O   . LYS A 1 35 ? -2.432  7.852   5.773   1.00 96.05 35 A 1 
ATOM 266 C CB  . LYS A 1 35 ? -4.677  9.767   4.745   1.00 95.06 35 A 1 
ATOM 267 C CG  . LYS A 1 35 ? -4.540  11.119  5.454   1.00 86.82 35 A 1 
ATOM 268 C CD  . LYS A 1 35 ? -5.876  11.591  6.036   1.00 84.93 35 A 1 
ATOM 269 C CE  . LYS A 1 35 ? -5.662  12.921  6.759   1.00 76.39 35 A 1 
ATOM 270 N NZ  . LYS A 1 35 ? -6.878  13.453  7.414   1.00 68.84 35 A 1 
ATOM 271 N N   . ARG A 1 36 ? -1.344  9.787   5.458   1.00 96.10 36 A 1 
ATOM 272 C CA  . ARG A 1 36 ? -0.266  9.542   6.445   1.00 96.17 36 A 1 
ATOM 273 C C   . ARG A 1 36 ? -0.792  9.146   7.828   1.00 96.40 36 A 1 
ATOM 274 O O   . ARG A 1 36 ? -0.204  8.298   8.483   1.00 95.82 36 A 1 
ATOM 275 C CB  . ARG A 1 36 ? 0.633   10.778  6.580   1.00 94.97 36 A 1 
ATOM 276 C CG  . ARG A 1 36 ? 1.499   11.004  5.334   1.00 90.64 36 A 1 
ATOM 277 C CD  . ARG A 1 36 ? 2.481   12.162  5.522   1.00 87.98 36 A 1 
ATOM 278 N NE  . ARG A 1 36 ? 3.530   11.835  6.506   1.00 82.82 36 A 1 
ATOM 279 C CZ  . ARG A 1 36 ? 4.735   12.374  6.592   1.00 79.33 36 A 1 
ATOM 280 N NH1 . ARG A 1 36 ? 5.116   13.338  5.801   1.00 69.90 36 A 1 
ATOM 281 N NH2 . ARG A 1 36 ? 5.583   11.943  7.481   1.00 71.53 36 A 1 
ATOM 282 N N   . SER A 1 37 ? -1.931  9.697   8.240   1.00 96.08 37 A 1 
ATOM 283 C CA  . SER A 1 37 ? -2.577  9.372   9.518   1.00 95.66 37 A 1 
ATOM 284 C C   . SER A 1 37 ? -3.474  8.125   9.478   1.00 95.90 37 A 1 
ATOM 285 O O   . SER A 1 37 ? -4.198  7.854   10.434  1.00 94.62 37 A 1 
ATOM 286 C CB  . SER A 1 37 ? -3.381  10.589  9.990   1.00 94.15 37 A 1 
ATOM 287 O OG  . SER A 1 37 ? -4.487  10.817  9.136   1.00 89.97 37 A 1 
ATOM 288 N N   . THR A 1 38 ? -3.547  7.406   8.365   1.00 95.82 38 A 1 
ATOM 289 C CA  . THR A 1 38 ? -4.405  6.219   8.227   1.00 95.61 38 A 1 
ATOM 290 C C   . THR A 1 38 ? -3.607  4.961   8.537   1.00 96.51 38 A 1 
ATOM 291 O O   . THR A 1 38 ? -2.474  4.825   8.095   1.00 96.30 38 A 1 
ATOM 292 C CB  . THR A 1 38 ? -5.028  6.133   6.827   1.00 93.69 38 A 1 
ATOM 293 O OG1 . THR A 1 38 ? -5.773  7.298   6.564   1.00 82.59 38 A 1 
ATOM 294 C CG2 . THR A 1 38 ? -6.009  4.970   6.671   1.00 81.84 38 A 1 
ATOM 295 N N   . GLN A 1 39 ? -4.218  4.018   9.249   1.00 96.98 39 A 1 
ATOM 296 C CA  . GLN A 1 39 ? -3.580  2.741   9.555   1.00 97.33 39 A 1 
ATOM 297 C C   . GLN A 1 39 ? -3.294  1.932   8.280   1.00 97.44 39 A 1 
ATOM 298 O O   . GLN A 1 39 ? -4.136  1.825   7.382   1.00 97.01 39 A 1 
ATOM 299 C CB  . GLN A 1 39 ? -4.464  1.922   10.502  1.00 96.97 39 A 1 
ATOM 300 C CG  . GLN A 1 39 ? -4.557  2.535   11.905  1.00 95.30 39 A 1 
ATOM 301 C CD  . GLN A 1 39 ? -5.453  1.710   12.830  1.00 93.40 39 A 1 
ATOM 302 O OE1 . GLN A 1 39 ? -6.426  1.097   12.419  1.00 86.87 39 A 1 
ATOM 303 N NE2 . GLN A 1 39 ? -5.171  1.679   14.106  1.00 84.57 39 A 1 
ATOM 304 N N   . LEU A 1 40 ? -2.138  1.283   8.257   1.00 97.56 40 A 1 
ATOM 305 C CA  . LEU A 1 40 ? -1.688  0.418   7.162   1.00 97.58 40 A 1 
ATOM 306 C C   . LEU A 1 40 ? -2.574  -0.820  6.976   1.00 97.36 40 A 1 
ATOM 307 O O   . LEU A 1 40 ? -2.574  -1.407  5.898   1.00 96.86 40 A 1 
ATOM 308 C CB  . LEU A 1 40 ? -0.238  -0.007  7.429   1.00 97.45 40 A 1 
ATOM 309 C CG  . LEU A 1 40 ? 0.783   1.136   7.295   1.00 97.06 40 A 1 
ATOM 310 C CD1 . LEU A 1 40 ? 2.136   0.659   7.799   1.00 96.10 40 A 1 
ATOM 311 C CD2 . LEU A 1 40 ? 0.935   1.593   5.844   1.00 95.77 40 A 1 
ATOM 312 N N   . LYS A 1 41 ? -3.391  -1.172  7.962   1.00 97.12 41 A 1 
ATOM 313 C CA  . LYS A 1 41 ? -4.344  -2.292  7.899   1.00 96.70 41 A 1 
ATOM 314 C C   . LYS A 1 41 ? -5.158  -2.301  6.607   1.00 96.71 41 A 1 
ATOM 315 O O   . LYS A 1 41 ? -5.346  -3.355  6.000   1.00 96.10 41 A 1 
ATOM 316 C CB  . LYS A 1 41 ? -5.281  -2.213  9.114   1.00 95.03 41 A 1 
ATOM 317 C CG  . LYS A 1 41 ? -6.233  -3.416  9.192   1.00 86.49 41 A 1 
ATOM 318 C CD  . LYS A 1 41 ? -7.071  -3.362  10.469  1.00 84.01 41 A 1 
ATOM 319 C CE  . LYS A 1 41 ? -7.957  -4.601  10.583  1.00 71.93 41 A 1 
ATOM 320 N NZ  . LYS A 1 41 ? -8.696  -4.627  11.868  1.00 65.18 41 A 1 
ATOM 321 N N   . LYS A 1 42 ? -5.643  -1.135  6.179   1.00 95.70 42 A 1 
ATOM 322 C CA  . LYS A 1 42 ? -6.468  -1.028  4.971   1.00 95.16 42 A 1 
ATOM 323 C C   . LYS A 1 42 ? -5.656  -1.314  3.706   1.00 95.49 42 A 1 
ATOM 324 O O   . LYS A 1 42 ? -6.164  -1.963  2.794   1.00 94.47 42 A 1 
ATOM 325 C CB  . LYS A 1 42 ? -7.130  0.356   4.944   1.00 93.66 42 A 1 
ATOM 326 C CG  . LYS A 1 42 ? -8.288  0.394   3.939   1.00 83.15 42 A 1 
ATOM 327 C CD  . LYS A 1 42 ? -9.049  1.719   4.031   1.00 76.55 42 A 1 
ATOM 328 C CE  . LYS A 1 42 ? -10.254 1.701   3.087   1.00 66.52 42 A 1 
ATOM 329 N NZ  . LYS A 1 42 ? -11.046 2.945   3.169   1.00 59.23 42 A 1 
ATOM 330 N N   . LEU A 1 43 ? -4.402  -0.865  3.664   1.00 96.33 43 A 1 
ATOM 331 C CA  . LEU A 1 43 ? -3.466  -1.131  2.575   1.00 96.45 43 A 1 
ATOM 332 C C   . LEU A 1 43 ? -3.102  -2.621  2.530   1.00 96.77 43 A 1 
ATOM 333 O O   . LEU A 1 43 ? -3.213  -3.246  1.480   1.00 96.18 43 A 1 
ATOM 334 C CB  . LEU A 1 43 ? -2.244  -0.210  2.748   1.00 95.62 43 A 1 
ATOM 335 C CG  . LEU A 1 43 ? -1.125  -0.392  1.698   1.00 93.22 43 A 1 
ATOM 336 C CD1 . LEU A 1 43 ? -0.277  0.868   1.628   1.00 88.62 43 A 1 
ATOM 337 C CD2 . LEU A 1 43 ? -0.170  -1.548  2.054   1.00 88.07 43 A 1 
ATOM 338 N N   . MET A 1 44 ? -2.733  -3.199  3.674   1.00 96.56 44 A 1 
ATOM 339 C CA  . MET A 1 44 ? -2.379  -4.617  3.796   1.00 96.63 44 A 1 
ATOM 340 C C   . MET A 1 44 ? -3.530  -5.517  3.344   1.00 96.64 44 A 1 
ATOM 341 O O   . MET A 1 44 ? -3.332  -6.410  2.527   1.00 96.53 44 A 1 
ATOM 342 C CB  . MET A 1 44 ? -2.014  -4.938  5.248   1.00 96.62 44 A 1 
ATOM 343 C CG  . MET A 1 44 ? -0.726  -4.256  5.710   1.00 96.09 44 A 1 
ATOM 344 S SD  . MET A 1 44 ? -0.367  -4.586  7.457   1.00 94.62 44 A 1 
ATOM 345 C CE  . MET A 1 44 ? 1.227   -3.753  7.597   1.00 89.33 44 A 1 
ATOM 346 N N   . ASN A 1 45 ? -4.748  -5.231  3.805   1.00 96.51 45 A 1 
ATOM 347 C CA  . ASN A 1 45 ? -5.924  -6.006  3.425   1.00 96.33 45 A 1 
ATOM 348 C C   . ASN A 1 45 ? -6.226  -5.893  1.925   1.00 96.37 45 A 1 
ATOM 349 O O   . ASN A 1 45 ? -6.516  -6.898  1.285   1.00 95.66 45 A 1 
ATOM 350 C CB  . ASN A 1 45 ? -7.107  -5.538  4.282   1.00 95.27 45 A 1 
ATOM 351 C CG  . ASN A 1 45 ? -8.244  -6.541  4.229   1.00 88.33 45 A 1 
ATOM 352 O OD1 . ASN A 1 45 ? -8.191  -7.585  4.834   1.00 80.87 45 A 1 
ATOM 353 N ND2 . ASN A 1 45 ? -9.310  -6.254  3.525   1.00 80.16 45 A 1 
ATOM 354 N N   . ALA A 1 46 ? -6.114  -4.698  1.351   1.00 96.45 46 A 1 
ATOM 355 C CA  . ALA A 1 46 ? -6.330  -4.497  -0.082  1.00 96.19 46 A 1 
ATOM 356 C C   . ALA A 1 46 ? -5.265  -5.201  -0.943  1.00 96.18 46 A 1 
ATOM 357 O O   . ALA A 1 46 ? -5.579  -5.691  -2.028  1.00 95.44 46 A 1 
ATOM 358 C CB  . ALA A 1 46 ? -6.355  -2.989  -0.364  1.00 95.77 46 A 1 
ATOM 359 N N   . TYR A 1 47 ? -4.015  -5.272  -0.465  1.00 96.08 47 A 1 
ATOM 360 C CA  . TYR A 1 47 ? -2.954  -6.016  -1.138  1.00 96.00 47 A 1 
ATOM 361 C C   . TYR A 1 47 ? -3.212  -7.524  -1.088  1.00 95.32 47 A 1 
ATOM 362 O O   . TYR A 1 47 ? -3.178  -8.182  -2.123  1.00 94.72 47 A 1 
ATOM 363 C CB  . TYR A 1 47 ? -1.603  -5.665  -0.515  1.00 96.11 47 A 1 
ATOM 364 C CG  . TYR A 1 47 ? -0.460  -6.359  -1.222  1.00 96.26 47 A 1 
ATOM 365 C CD1 . TYR A 1 47 ? 0.051   -7.575  -0.734  1.00 95.49 47 A 1 
ATOM 366 C CD2 . TYR A 1 47 ? 0.054   -5.815  -2.415  1.00 95.54 47 A 1 
ATOM 367 C CE1 . TYR A 1 47 ? 1.066   -8.244  -1.431  1.00 94.74 47 A 1 
ATOM 368 C CE2 . TYR A 1 47 ? 1.069   -6.478  -3.116  1.00 94.79 47 A 1 
ATOM 369 C CZ  . TYR A 1 47 ? 1.567   -7.695  -2.621  1.00 95.01 47 A 1 
ATOM 370 O OH  . TYR A 1 47 ? 2.545   -8.352  -3.318  1.00 93.98 47 A 1 
ATOM 371 N N   . CYS A 1 48 ? -3.546  -8.055  0.091   1.00 95.44 48 A 1 
ATOM 372 C CA  . CYS A 1 48 ? -3.854  -9.471  0.271   1.00 94.75 48 A 1 
ATOM 373 C C   . CYS A 1 48 ? -5.069  -9.906  -0.560  1.00 94.05 48 A 1 
ATOM 374 O O   . CYS A 1 48 ? -5.019  -10.958 -1.186  1.00 92.81 48 A 1 
ATOM 375 C CB  . CYS A 1 48 ? -4.099  -9.746  1.756   1.00 94.38 48 A 1 
ATOM 376 S SG  . CYS A 1 48 ? -2.565  -9.538  2.699   1.00 92.49 48 A 1 
ATOM 377 N N   . ASP A 1 49 ? -6.107  -9.082  -0.626  1.00 94.97 49 A 1 
ATOM 378 C CA  . ASP A 1 49 ? -7.290  -9.336  -1.456  1.00 94.37 49 A 1 
ATOM 379 C C   . ASP A 1 49 ? -6.925  -9.412  -2.947  1.00 93.71 49 A 1 
ATOM 380 O O   . ASP A 1 49 ? -7.300  -10.362 -3.638  1.00 92.09 49 A 1 
ATOM 381 C CB  . ASP A 1 49 ? -8.317  -8.226  -1.185  1.00 93.55 49 A 1 
ATOM 382 C CG  . ASP A 1 49 ? -9.651  -8.484  -1.882  1.00 84.27 49 A 1 
ATOM 383 O OD1 . ASP A 1 49 ? -9.875  -7.869  -2.948  1.00 78.69 49 A 1 
ATOM 384 O OD2 . ASP A 1 49 ? -10.448 -9.261  -1.322  1.00 79.63 49 A 1 
ATOM 385 N N   . ARG A 1 50 ? -6.091  -8.472  -3.433  1.00 93.35 50 A 1 
ATOM 386 C CA  . ARG A 1 50 ? -5.614  -8.480  -4.825  1.00 92.33 50 A 1 
ATOM 387 C C   . ARG A 1 50 ? -4.756  -9.697  -5.158  1.00 91.75 50 A 1 
ATOM 388 O O   . ARG A 1 50 ? -4.842  -10.196 -6.272  1.00 89.49 50 A 1 
ATOM 389 C CB  . ARG A 1 50 ? -4.804  -7.214  -5.122  1.00 90.57 50 A 1 
ATOM 390 C CG  . ARG A 1 50 ? -5.713  -6.034  -5.459  1.00 80.78 50 A 1 
ATOM 391 C CD  . ARG A 1 50 ? -4.848  -4.849  -5.880  1.00 78.79 50 A 1 
ATOM 392 N NE  . ARG A 1 50 ? -5.679  -3.752  -6.409  1.00 71.75 50 A 1 
ATOM 393 C CZ  . ARG A 1 50 ? -5.349  -2.932  -7.395  1.00 66.29 50 A 1 
ATOM 394 N NH1 . ARG A 1 50 ? -4.189  -2.999  -7.990  1.00 61.45 50 A 1 
ATOM 395 N NH2 . ARG A 1 50 ? -6.190  -2.023  -7.790  1.00 57.22 50 A 1 
ATOM 396 N N   . GLN A 1 51 ? -3.932  -10.144 -4.219  1.00 91.93 51 A 1 
ATOM 397 C CA  . GLN A 1 51 ? -3.075  -11.317 -4.395  1.00 91.00 51 A 1 
ATOM 398 C C   . GLN A 1 51 ? -3.799  -12.634 -4.067  1.00 90.79 51 A 1 
ATOM 399 O O   . GLN A 1 51 ? -3.228  -13.707 -4.225  1.00 88.20 51 A 1 
ATOM 400 C CB  . GLN A 1 51 ? -1.798  -11.144 -3.560  1.00 89.85 51 A 1 
ATOM 401 C CG  . GLN A 1 51 ? -0.919  -9.957  -4.008  1.00 86.87 51 A 1 
ATOM 402 C CD  . GLN A 1 51 ? -0.324  -10.104 -5.412  1.00 84.44 51 A 1 
ATOM 403 O OE1 . GLN A 1 51 ? -0.469  -11.090 -6.104  1.00 76.48 51 A 1 
ATOM 404 N NE2 . GLN A 1 51 ? 0.379   -9.107  -5.897  1.00 74.02 51 A 1 
ATOM 405 N N   . SER A 1 52 ? -5.065  -12.559 -3.630  1.00 91.97 52 A 1 
ATOM 406 C CA  . SER A 1 52 ? -5.870  -13.715 -3.196  1.00 91.88 52 A 1 
ATOM 407 C C   . SER A 1 52 ? -5.188  -14.539 -2.095  1.00 91.39 52 A 1 
ATOM 408 O O   . SER A 1 52 ? -5.251  -15.769 -2.081  1.00 88.82 52 A 1 
ATOM 409 C CB  . SER A 1 52 ? -6.289  -14.574 -4.391  1.00 91.25 52 A 1 
ATOM 410 O OG  . SER A 1 52 ? -7.011  -13.788 -5.326  1.00 81.60 52 A 1 
ATOM 411 N N   . VAL A 1 53 ? -4.510  -13.855 -1.162  1.00 91.52 53 A 1 
ATOM 412 C CA  . VAL A 1 53 ? -3.778  -14.462 -0.045  1.00 91.22 53 A 1 
ATOM 413 C C   . VAL A 1 53 ? -4.302  -13.947 1.289   1.00 91.84 53 A 1 
ATOM 414 O O   . VAL A 1 53 ? -4.842  -12.846 1.383   1.00 90.75 53 A 1 
ATOM 415 C CB  . VAL A 1 53 ? -2.266  -14.227 -0.158  1.00 89.67 53 A 1 
ATOM 416 C CG1 . VAL A 1 53 ? -1.658  -15.006 -1.323  1.00 85.01 53 A 1 
ATOM 417 C CG2 . VAL A 1 53 ? -1.938  -12.745 -0.320  1.00 84.83 53 A 1 
ATOM 418 N N   . ASP A 1 54 ? -4.121  -14.748 2.343   1.00 90.77 54 A 1 
ATOM 419 C CA  . ASP A 1 54 ? -4.516  -14.340 3.688   1.00 90.56 54 A 1 
ATOM 420 C C   . ASP A 1 54 ? -3.501  -13.357 4.294   1.00 91.05 54 A 1 
ATOM 421 O O   . ASP A 1 54 ? -2.294  -13.464 4.082   1.00 89.56 54 A 1 
ATOM 422 C CB  . ASP A 1 54 ? -4.702  -15.574 4.576   1.00 88.05 54 A 1 
ATOM 423 C CG  . ASP A 1 54 ? -5.469  -15.189 5.835   1.00 79.74 54 A 1 
ATOM 424 O OD1 . ASP A 1 54 ? -4.813  -14.735 6.794   1.00 72.12 54 A 1 
ATOM 425 O OD2 . ASP A 1 54 ? -6.709  -15.287 5.820   1.00 73.30 54 A 1 
ATOM 426 N N   . MET A 1 55 ? -3.977  -12.397 5.094   1.00 89.31 55 A 1 
ATOM 427 C CA  . MET A 1 55 ? -3.115  -11.404 5.738   1.00 89.24 55 A 1 
ATOM 428 C C   . MET A 1 55 ? -2.105  -12.044 6.707   1.00 89.89 55 A 1 
ATOM 429 O O   . MET A 1 55 ? -1.045  -11.485 6.964   1.00 88.03 55 A 1 
ATOM 430 C CB  . MET A 1 55 ? -3.988  -10.363 6.455   1.00 86.89 55 A 1 
ATOM 431 C CG  . MET A 1 55 ? -3.466  -8.947  6.229   1.00 80.30 55 A 1 
ATOM 432 S SD  . MET A 1 55 ? -4.465  -7.628  6.986   1.00 75.30 55 A 1 
ATOM 433 C CE  . MET A 1 55 ? -3.938  -7.781  8.702   1.00 66.68 55 A 1 
ATOM 434 N N   . ASN A 1 56 ? -2.426  -13.236 7.234   1.00 89.21 56 A 1 
ATOM 435 C CA  . ASN A 1 56 ? -1.534  -13.989 8.112   1.00 89.07 56 A 1 
ATOM 436 C C   . ASN A 1 56 ? -0.412  -14.695 7.343   1.00 90.23 56 A 1 
ATOM 437 O O   . ASN A 1 56 ? 0.615   -15.012 7.940   1.00 87.96 56 A 1 
ATOM 438 C CB  . ASN A 1 56 ? -2.355  -15.005 8.907   1.00 86.18 56 A 1 
ATOM 439 C CG  . ASN A 1 56 ? -3.354  -14.332 9.822   1.00 79.53 56 A 1 
ATOM 440 O OD1 . ASN A 1 56 ? -3.000  -13.704 10.805  1.00 70.34 56 A 1 
ATOM 441 N ND2 . ASN A 1 56 ? -4.625  -14.432 9.523   1.00 70.09 56 A 1 
ATOM 442 N N   . SER A 1 57 ? -0.583  -14.932 6.041   1.00 92.03 57 A 1 
ATOM 443 C CA  . SER A 1 57 ? 0.443   -15.560 5.204   1.00 91.99 57 A 1 
ATOM 444 C C   . SER A 1 57 ? 1.372   -14.556 4.520   1.00 93.04 57 A 1 
ATOM 445 O O   . SER A 1 57 ? 2.303   -14.964 3.834   1.00 91.75 57 A 1 
ATOM 446 C CB  . SER A 1 57 ? -0.186  -16.530 4.202   1.00 89.57 57 A 1 
ATOM 447 O OG  . SER A 1 57 ? -1.113  -15.899 3.358   1.00 80.84 57 A 1 
ATOM 448 N N   . ILE A 1 58 ? 1.171   -13.253 4.742   1.00 93.91 58 A 1 
ATOM 449 C CA  . ILE A 1 58 ? 2.060   -12.198 4.246   1.00 94.49 58 A 1 
ATOM 450 C C   . ILE A 1 58 ? 2.671   -11.405 5.399   1.00 95.11 58 A 1 
ATOM 451 O O   . ILE A 1 58 ? 1.988   -10.932 6.303   1.00 94.66 58 A 1 
ATOM 452 C CB  . ILE A 1 58 ? 1.361   -11.308 3.197   1.00 93.33 58 A 1 
ATOM 453 C CG1 . ILE A 1 58 ? 1.119   -12.155 1.929   1.00 86.56 58 A 1 
ATOM 454 C CG2 . ILE A 1 58 ? 2.187   -10.056 2.876   1.00 84.67 58 A 1 
ATOM 455 C CD1 . ILE A 1 58 ? 0.913   -11.363 0.640   1.00 79.92 58 A 1 
ATOM 456 N N   . ALA A 1 59 ? 3.986   -11.209 5.323   1.00 95.43 59 A 1 
ATOM 457 C CA  . ALA A 1 59 ? 4.702   -10.245 6.137   1.00 95.36 59 A 1 
ATOM 458 C C   . ALA A 1 59 ? 5.023   -9.017  5.288   1.00 96.12 59 A 1 
ATOM 459 O O   . ALA A 1 59 ? 5.697   -9.118  4.267   1.00 95.82 59 A 1 
ATOM 460 C CB  . ALA A 1 59 ? 5.964   -10.895 6.710   1.00 93.87 59 A 1 
ATOM 461 N N   . PHE A 1 60 ? 4.562   -7.853  5.733   1.00 96.82 60 A 1 
ATOM 462 C CA  . PHE A 1 60 ? 4.943   -6.577  5.150   1.00 97.12 60 A 1 
ATOM 463 C C   . PHE A 1 60 ? 6.198   -6.071  5.853   1.00 97.06 60 A 1 
ATOM 464 O O   . PHE A 1 60 ? 6.236   -6.005  7.082   1.00 96.64 60 A 1 
ATOM 465 C CB  . PHE A 1 60 ? 3.786   -5.591  5.248   1.00 97.12 60 A 1 
ATOM 466 C CG  . PHE A 1 60 ? 2.564   -6.031  4.476   1.00 97.22 60 A 1 
ATOM 467 C CD1 . PHE A 1 60 ? 2.435   -5.701  3.117   1.00 96.52 60 A 1 
ATOM 468 C CD2 . PHE A 1 60 ? 1.572   -6.806  5.102   1.00 96.59 60 A 1 
ATOM 469 C CE1 . PHE A 1 60 ? 1.323   -6.137  2.386   1.00 95.94 60 A 1 
ATOM 470 C CE2 . PHE A 1 60 ? 0.459   -7.253  4.369   1.00 95.95 60 A 1 
ATOM 471 C CZ  . PHE A 1 60 ? 0.336   -6.917  3.012   1.00 96.22 60 A 1 
ATOM 472 N N   . LEU A 1 61 ? 7.225   -5.743  5.092   1.00 97.32 61 A 1 
ATOM 473 C CA  . LEU A 1 61 ? 8.511   -5.266  5.582   1.00 97.21 61 A 1 
ATOM 474 C C   . LEU A 1 61 ? 8.760   -3.865  5.030   1.00 97.62 61 A 1 
ATOM 475 O O   . LEU A 1 61 ? 8.564   -3.606  3.848   1.00 97.33 61 A 1 
ATOM 476 C CB  . LEU A 1 61 ? 9.610   -6.252  5.157   1.00 96.08 61 A 1 
ATOM 477 C CG  . LEU A 1 61 ? 9.504   -7.626  5.846   1.00 91.80 61 A 1 
ATOM 478 C CD1 . LEU A 1 61 ? 10.212  -8.700  5.025   1.00 86.58 61 A 1 
ATOM 479 C CD2 . LEU A 1 61 ? 10.154  -7.604  7.234   1.00 84.94 61 A 1 
ATOM 480 N N   . PHE A 1 62 ? 9.204   -2.967  5.897   1.00 97.58 62 A 1 
ATOM 481 C CA  . PHE A 1 62 ? 9.662   -1.630  5.544   1.00 97.53 62 A 1 
ATOM 482 C C   . PHE A 1 62 ? 10.973  -1.369  6.278   1.00 97.02 62 A 1 
ATOM 483 O O   . PHE A 1 62 ? 11.065  -1.640  7.478   1.00 95.66 62 A 1 
ATOM 484 C CB  . PHE A 1 62 ? 8.588   -0.610  5.907   1.00 97.43 62 A 1 
ATOM 485 C CG  . PHE A 1 62 ? 9.016   0.813   5.649   1.00 97.50 62 A 1 
ATOM 486 C CD1 . PHE A 1 62 ? 9.347   1.658   6.720   1.00 96.70 62 A 1 
ATOM 487 C CD2 . PHE A 1 62 ? 9.134   1.277   4.330   1.00 96.61 62 A 1 
ATOM 488 C CE1 . PHE A 1 62 ? 9.790   2.964   6.475   1.00 95.68 62 A 1 
ATOM 489 C CE2 . PHE A 1 62 ? 9.580   2.583   4.083   1.00 95.81 62 A 1 
ATOM 490 C CZ  . PHE A 1 62 ? 9.908   3.424   5.156   1.00 95.90 62 A 1 
ATOM 491 N N   . ASP A 1 63 ? 11.985  -0.924  5.559   1.00 96.08 63 A 1 
ATOM 492 C CA  . ASP A 1 63 ? 13.334  -0.728  6.104   1.00 94.71 63 A 1 
ATOM 493 C C   . ASP A 1 63 ? 13.874  -1.961  6.884   1.00 94.10 63 A 1 
ATOM 494 O O   . ASP A 1 63 ? 14.466  -1.883  7.960   1.00 89.52 63 A 1 
ATOM 495 C CB  . ASP A 1 63 ? 13.370  0.592   6.892   1.00 92.27 63 A 1 
ATOM 496 C CG  . ASP A 1 63 ? 14.790  1.117   6.985   1.00 84.08 63 A 1 
ATOM 497 O OD1 . ASP A 1 63 ? 15.361  1.041   8.092   1.00 78.98 63 A 1 
ATOM 498 O OD2 . ASP A 1 63 ? 15.305  1.562   5.943   1.00 77.60 63 A 1 
ATOM 499 N N   . GLY A 1 64 ? 13.559  -3.164  6.368   1.00 92.41 64 A 1 
ATOM 500 C CA  . GLY A 1 64 ? 13.936  -4.440  6.993   1.00 91.25 64 A 1 
ATOM 501 C C   . GLY A 1 64 ? 13.145  -4.814  8.251   1.00 92.03 64 A 1 
ATOM 502 O O   . GLY A 1 64 ? 13.412  -5.856  8.865   1.00 89.62 64 A 1 
ATOM 503 N N   . ARG A 1 65 ? 12.147  -4.011  8.663   1.00 94.79 65 A 1 
ATOM 504 C CA  . ARG A 1 65 ? 11.302  -4.278  9.832   1.00 94.58 65 A 1 
ATOM 505 C C   . ARG A 1 65 ? 9.905   -4.703  9.416   1.00 95.37 65 A 1 
ATOM 506 O O   . ARG A 1 65 ? 9.305   -4.131  8.515   1.00 94.56 65 A 1 
ATOM 507 C CB  . ARG A 1 65 ? 11.245  -3.057  10.750  1.00 91.88 65 A 1 
ATOM 508 C CG  . ARG A 1 65 ? 12.626  -2.745  11.340  1.00 80.50 65 A 1 
ATOM 509 C CD  . ARG A 1 65 ? 12.525  -1.596  12.335  1.00 77.39 65 A 1 
ATOM 510 N NE  . ARG A 1 65 ? 13.840  -1.308  12.927  1.00 67.47 65 A 1 
ATOM 511 C CZ  . ARG A 1 65 ? 14.136  -1.209  14.214  1.00 60.96 65 A 1 
ATOM 512 N NH1 . ARG A 1 65 ? 13.237  -1.368  15.147  1.00 55.93 65 A 1 
ATOM 513 N NH2 . ARG A 1 65 ? 15.357  -0.943  14.573  1.00 51.25 65 A 1 
ATOM 514 N N   . ARG A 1 66 ? 9.354   -5.687  10.147  1.00 95.68 66 A 1 
ATOM 515 C CA  . ARG A 1 66 ? 7.971   -6.114  9.940   1.00 95.58 66 A 1 
ATOM 516 C C   . ARG A 1 66 ? 7.004   -5.023  10.380  1.00 96.00 66 A 1 
ATOM 517 O O   . ARG A 1 66 ? 6.976   -4.641  11.549  1.00 95.17 66 A 1 
ATOM 518 C CB  . ARG A 1 66 ? 7.708   -7.443  10.655  1.00 93.51 66 A 1 
ATOM 519 C CG  . ARG A 1 66 ? 6.315   -7.995  10.323  1.00 86.31 66 A 1 
ATOM 520 C CD  . ARG A 1 66 ? 6.098   -9.355  10.983  1.00 81.42 66 A 1 
ATOM 521 N NE  . ARG A 1 66 ? 4.745   -9.868  10.709  1.00 74.21 66 A 1 
ATOM 522 C CZ  . ARG A 1 66 ? 4.240   -11.023 11.130  1.00 68.58 66 A 1 
ATOM 523 N NH1 . ARG A 1 66 ? 4.926   -11.836 11.882  1.00 63.99 66 A 1 
ATOM 524 N NH2 . ARG A 1 66 ? 3.032   -11.367 10.794  1.00 61.26 66 A 1 
ATOM 525 N N   . LEU A 1 67 ? 6.165   -4.591  9.455   1.00 96.50 67 A 1 
ATOM 526 C CA  . LEU A 1 67 ? 5.089   -3.647  9.697   1.00 96.60 67 A 1 
ATOM 527 C C   . LEU A 1 67 ? 3.930   -4.314  10.439  1.00 96.26 67 A 1 
ATOM 528 O O   . LEU A 1 67 ? 3.634   -5.498  10.265  1.00 95.48 67 A 1 
ATOM 529 C CB  . LEU A 1 67 ? 4.615   -3.060  8.365   1.00 96.67 67 A 1 
ATOM 530 C CG  . LEU A 1 67 ? 5.675   -2.243  7.610   1.00 96.03 67 A 1 
ATOM 531 C CD1 . LEU A 1 67 ? 5.047   -1.670  6.341   1.00 95.09 67 A 1 
ATOM 532 C CD2 . LEU A 1 67 ? 6.212   -1.098  8.461   1.00 94.89 67 A 1 
ATOM 533 N N   . ARG A 1 68 ? 3.227   -3.513  11.249  1.00 96.34 68 A 1 
ATOM 534 C CA  . ARG A 1 68 ? 1.990   -3.913  11.921  1.00 96.13 68 A 1 
ATOM 535 C C   . ARG A 1 68 ? 0.803   -3.189  11.294  1.00 96.39 68 A 1 
ATOM 536 O O   . ARG A 1 68 ? 0.910   -2.037  10.890  1.00 96.09 68 A 1 
ATOM 537 C CB  . ARG A 1 68 ? 2.075   -3.631  13.423  1.00 95.15 68 A 1 
ATOM 538 C CG  . ARG A 1 68 ? 3.212   -4.414  14.096  1.00 91.34 68 A 1 
ATOM 539 C CD  . ARG A 1 68 ? 3.164   -4.188  15.606  1.00 86.73 68 A 1 
ATOM 540 N NE  . ARG A 1 68 ? 4.225   -4.938  16.300  1.00 78.37 68 A 1 
ATOM 541 C CZ  . ARG A 1 68 ? 4.162   -5.404  17.540  1.00 71.79 68 A 1 
ATOM 542 N NH1 . ARG A 1 68 ? 3.104   -5.233  18.288  1.00 64.81 68 A 1 
ATOM 543 N NH2 . ARG A 1 68 ? 5.173   -6.050  18.049  1.00 64.25 68 A 1 
ATOM 544 N N   . ALA A 1 69 ? -0.350  -3.856  11.267  1.00 96.33 69 A 1 
ATOM 545 C CA  . ALA A 1 69 ? -1.579  -3.296  10.703  1.00 96.10 69 A 1 
ATOM 546 C C   . ALA A 1 69 ? -2.062  -2.015  11.412  1.00 96.65 69 A 1 
ATOM 547 O O   . ALA A 1 69 ? -2.752  -1.199  10.805  1.00 96.09 69 A 1 
ATOM 548 C CB  . ALA A 1 69 ? -2.642  -4.395  10.769  1.00 94.40 69 A 1 
ATOM 549 N N   . GLU A 1 70 ? -1.697  -1.842  12.687  1.00 97.03 70 A 1 
ATOM 550 C CA  . GLU A 1 70 ? -2.093  -0.688  13.507  1.00 97.11 70 A 1 
ATOM 551 C C   . GLU A 1 70 ? -1.197  0.539   13.292  1.00 97.55 70 A 1 
ATOM 552 O O   . GLU A 1 70 ? -1.592  1.642   13.659  1.00 96.81 70 A 1 
ATOM 553 C CB  . GLU A 1 70 ? -2.096  -1.094  14.985  1.00 95.90 70 A 1 
ATOM 554 C CG  . GLU A 1 70 ? -3.058  -2.258  15.245  1.00 88.26 70 A 1 
ATOM 555 C CD  . GLU A 1 70 ? -3.091  -2.654  16.722  1.00 80.74 70 A 1 
ATOM 556 O OE1 . GLU A 1 70 ? -4.182  -2.544  17.315  1.00 73.01 70 A 1 
ATOM 557 O OE2 . GLU A 1 70 ? -2.040  -3.103  17.236  1.00 72.57 70 A 1 
ATOM 558 N N   . GLN A 1 71 ? -0.019  0.355   12.691  1.00 97.86 71 A 1 
ATOM 559 C CA  . GLN A 1 71 ? 0.917   1.445   12.435  1.00 97.90 71 A 1 
ATOM 560 C C   . GLN A 1 71 ? 0.412   2.337   11.302  1.00 98.11 71 A 1 
ATOM 561 O O   . GLN A 1 71 ? -0.284  1.891   10.386  1.00 97.87 71 A 1 
ATOM 562 C CB  . GLN A 1 71 ? 2.316   0.899   12.124  1.00 97.46 71 A 1 
ATOM 563 C CG  . GLN A 1 71 ? 2.943   0.256   13.367  1.00 95.84 71 A 1 
ATOM 564 C CD  . GLN A 1 71 ? 4.321   -0.336  13.074  1.00 95.29 71 A 1 
ATOM 565 O OE1 . GLN A 1 71 ? 4.476   -1.257  12.289  1.00 89.74 71 A 1 
ATOM 566 N NE2 . GLN A 1 71 ? 5.357   0.145   13.710  1.00 88.64 71 A 1 
ATOM 567 N N   . THR A 1 72 ? 0.800   3.605   11.359  1.00 97.38 72 A 1 
ATOM 568 C CA  . THR A 1 72 ? 0.510   4.592   10.318  1.00 97.33 72 A 1 
ATOM 569 C C   . THR A 1 72 ? 1.790   4.952   9.562   1.00 97.31 72 A 1 
ATOM 570 O O   . THR A 1 72 ? 2.883   4.845   10.125  1.00 97.03 72 A 1 
ATOM 571 C CB  . THR A 1 72 ? -0.154  5.843   10.909  1.00 96.82 72 A 1 
ATOM 572 O OG1 . THR A 1 72 ? 0.713   6.509   11.785  1.00 95.38 72 A 1 
ATOM 573 C CG2 . THR A 1 72 ? -1.439  5.524   11.672  1.00 94.83 72 A 1 
ATOM 574 N N   . PRO A 1 73 ? 1.696   5.393   8.296   1.00 97.39 73 A 1 
ATOM 575 C CA  . PRO A 1 73 ? 2.855   5.918   7.571   1.00 97.22 73 A 1 
ATOM 576 C C   . PRO A 1 73 ? 3.564   7.065   8.300   1.00 96.96 73 A 1 
ATOM 577 O O   . PRO A 1 73 ? 4.777   7.184   8.203   1.00 96.30 73 A 1 
ATOM 578 C CB  . PRO A 1 73 ? 2.295   6.399   6.231   1.00 96.80 73 A 1 
ATOM 579 C CG  . PRO A 1 73 ? 1.063   5.529   6.016   1.00 95.90 73 A 1 
ATOM 580 C CD  . PRO A 1 73 ? 0.532   5.331   7.432   1.00 97.15 73 A 1 
ATOM 581 N N   . ASP A 1 74 ? 2.822   7.882   9.041   1.00 96.54 74 A 1 
ATOM 582 C CA  . ASP A 1 74 ? 3.384   8.997   9.802   1.00 95.96 74 A 1 
ATOM 583 C C   . ASP A 1 74 ? 4.268   8.524   10.970  1.00 96.17 74 A 1 
ATOM 584 O O   . ASP A 1 74 ? 5.369   9.031   11.156  1.00 95.25 74 A 1 
ATOM 585 C CB  . ASP A 1 74 ? 2.231   9.865   10.305  1.00 94.11 74 A 1 
ATOM 586 C CG  . ASP A 1 74 ? 2.699   11.276  10.658  1.00 85.19 74 A 1 
ATOM 587 O OD1 . ASP A 1 74 ? 2.616   11.634  11.842  1.00 81.83 74 A 1 
ATOM 588 O OD2 . ASP A 1 74 ? 3.069   12.007  9.704   1.00 80.87 74 A 1 
ATOM 589 N N   . GLU A 1 75 ? 3.833   7.482   11.703  1.00 96.33 75 A 1 
ATOM 590 C CA  . GLU A 1 75 ? 4.621   6.872   12.787  1.00 96.03 75 A 1 
ATOM 591 C C   . GLU A 1 75 ? 5.907   6.195   12.286  1.00 96.11 75 A 1 
ATOM 592 O O   . GLU A 1 75 ? 6.855   6.016   13.054  1.00 95.13 75 A 1 
ATOM 593 C CB  . GLU A 1 75 ? 3.788   5.803   13.499  1.00 94.96 75 A 1 
ATOM 594 C CG  . GLU A 1 75 ? 2.638   6.377   14.334  1.00 85.96 75 A 1 
ATOM 595 C CD  . GLU A 1 75 ? 1.782   5.236   14.886  1.00 84.67 75 A 1 
ATOM 596 O OE1 . GLU A 1 75 ? 1.901   4.942   16.093  1.00 79.44 75 A 1 
ATOM 597 O OE2 . GLU A 1 75 ? 1.028   4.629   14.088  1.00 81.69 75 A 1 
ATOM 598 N N   . LEU A 1 76 ? 5.924   5.782   11.022  1.00 97.08 76 A 1 
ATOM 599 C CA  . LEU A 1 76 ? 7.050   5.094   10.393  1.00 96.81 76 A 1 
ATOM 600 C C   . LEU A 1 76 ? 7.936   6.039   9.575   1.00 96.69 76 A 1 
ATOM 601 O O   . LEU A 1 76 ? 8.872   5.572   8.939   1.00 95.57 76 A 1 
ATOM 602 C CB  . LEU A 1 76 ? 6.493   3.950   9.534   1.00 96.63 76 A 1 
ATOM 603 C CG  . LEU A 1 76 ? 5.815   2.850   10.369  1.00 96.03 76 A 1 
ATOM 604 C CD1 . LEU A 1 76 ? 5.002   1.950   9.451   1.00 94.55 76 A 1 
ATOM 605 C CD2 . LEU A 1 76 ? 6.846   1.989   11.108  1.00 94.17 76 A 1 
ATOM 606 N N   . ASP A 1 77 ? 7.624   7.340   9.597   1.00 96.20 77 A 1 
ATOM 607 C CA  . ASP A 1 77 ? 8.311   8.371   8.814   1.00 95.80 77 A 1 
ATOM 608 C C   . ASP A 1 77 ? 8.345   8.051   7.306   1.00 96.21 77 A 1 
ATOM 609 O O   . ASP A 1 77 ? 9.316   8.319   6.607   1.00 94.98 77 A 1 
ATOM 610 C CB  . ASP A 1 77 ? 9.680   8.694   9.448   1.00 94.47 77 A 1 
ATOM 611 C CG  . ASP A 1 77 ? 10.016  10.179  9.351   1.00 87.87 77 A 1 
ATOM 612 O OD1 . ASP A 1 77 ? 10.983  10.526  8.642   1.00 82.37 77 A 1 
ATOM 613 O OD2 . ASP A 1 77 ? 9.327   10.966  10.031  1.00 80.20 77 A 1 
ATOM 614 N N   . MET A 1 78 ? 7.264   7.425   6.814   1.00 96.70 78 A 1 
ATOM 615 C CA  . MET A 1 78 ? 7.153   7.074   5.402   1.00 96.99 78 A 1 
ATOM 616 C C   . MET A 1 78 ? 6.960   8.320   4.538   1.00 96.63 78 A 1 
ATOM 617 O O   . MET A 1 78 ? 6.193   9.232   4.872   1.00 95.67 78 A 1 
ATOM 618 C CB  . MET A 1 78 ? 6.000   6.100   5.153   1.00 97.11 78 A 1 
ATOM 619 C CG  . MET A 1 78 ? 6.274   4.700   5.686   1.00 96.19 78 A 1 
ATOM 620 S SD  . MET A 1 78 ? 4.886   3.564   5.389   1.00 95.38 78 A 1 
ATOM 621 C CE  . MET A 1 78 ? 5.683   2.009   5.809   1.00 91.11 78 A 1 
ATOM 622 N N   . GLU A 1 79 ? 7.599   8.295   3.367   1.00 96.48 79 A 1 
ATOM 623 C CA  . GLU A 1 79 ? 7.518   9.349   2.362   1.00 95.87 79 A 1 
ATOM 624 C C   . GLU A 1 79 ? 6.695   8.902   1.138   1.00 96.47 79 A 1 
ATOM 625 O O   . GLU A 1 79 ? 6.254   7.753   1.010   1.00 95.49 79 A 1 
ATOM 626 C CB  . GLU A 1 79 ? 8.932   9.837   2.004   1.00 93.56 79 A 1 
ATOM 627 C CG  . GLU A 1 79 ? 9.660   10.439  3.212   1.00 85.87 79 A 1 
ATOM 628 C CD  . GLU A 1 79 ? 10.878  11.271  2.790   1.00 78.69 79 A 1 
ATOM 629 O OE1 . GLU A 1 79 ? 10.697  12.493  2.557   1.00 72.95 79 A 1 
ATOM 630 O OE2 . GLU A 1 79 ? 11.984  10.707  2.696   1.00 69.28 79 A 1 
ATOM 631 N N   . ASP A 1 80 ? 6.422   9.845   0.237   1.00 96.25 80 A 1 
ATOM 632 C CA  . ASP A 1 80 ? 5.755   9.543   -1.028  1.00 95.94 80 A 1 
ATOM 633 C C   . ASP A 1 80 ? 6.699   8.751   -1.945  1.00 95.75 80 A 1 
ATOM 634 O O   . ASP A 1 80 ? 7.817   9.177   -2.230  1.00 93.61 80 A 1 
ATOM 635 C CB  . ASP A 1 80 ? 5.274   10.842  -1.694  1.00 94.62 80 A 1 
ATOM 636 C CG  . ASP A 1 80 ? 4.364   10.578  -2.901  1.00 92.42 80 A 1 
ATOM 637 O OD1 . ASP A 1 80 ? 4.818   10.685  -4.056  1.00 88.24 80 A 1 
ATOM 638 O OD2 . ASP A 1 80 ? 3.159   10.303  -2.690  1.00 86.66 80 A 1 
ATOM 639 N N   . GLY A 1 81 ? 6.228   7.591   -2.410  1.00 96.06 81 A 1 
ATOM 640 C CA  . GLY A 1 81 ? 7.017   6.692   -3.250  1.00 95.68 81 A 1 
ATOM 641 C C   . GLY A 1 81 ? 7.801   5.622   -2.493  1.00 96.38 81 A 1 
ATOM 642 O O   . GLY A 1 81 ? 8.505   4.842   -3.146  1.00 94.89 81 A 1 
ATOM 643 N N   . ASP A 1 82 ? 7.656   5.536   -1.163  1.00 97.43 82 A 1 
ATOM 644 C CA  . ASP A 1 82 ? 8.299   4.491   -0.370  1.00 97.68 82 A 1 
ATOM 645 C C   . ASP A 1 82 ? 7.861   3.086   -0.798  1.00 97.89 82 A 1 
ATOM 646 O O   . ASP A 1 82 ? 6.721   2.844   -1.221  1.00 97.42 82 A 1 
ATOM 647 C CB  . ASP A 1 82 ? 8.039   4.690   1.129   1.00 97.25 82 A 1 
ATOM 648 C CG  . ASP A 1 82 ? 9.170   5.420   1.845   1.00 95.77 82 A 1 
ATOM 649 O OD1 . ASP A 1 82 ? 10.333  5.209   1.444   1.00 93.05 82 A 1 
ATOM 650 O OD2 . ASP A 1 82 ? 8.869   6.113   2.834   1.00 92.26 82 A 1 
ATOM 651 N N   . GLU A 1 83 ? 8.791   2.141   -0.663  1.00 97.84 83 A 1 
ATOM 652 C CA  . GLU A 1 83 ? 8.621   0.748   -1.048  1.00 97.81 83 A 1 
ATOM 653 C C   . GLU A 1 83 ? 8.450   -0.134  0.191   1.00 97.99 83 A 1 
ATOM 654 O O   . GLU A 1 83 ? 9.244   -0.114  1.127   1.00 97.36 83 A 1 
ATOM 655 C CB  . GLU A 1 83 ? 9.788   0.301   -1.947  1.00 96.41 83 A 1 
ATOM 656 C CG  . GLU A 1 83 ? 9.580   -1.102  -2.539  1.00 87.25 83 A 1 
ATOM 657 C CD  . GLU A 1 83 ? 10.648  -1.439  -3.610  1.00 84.20 83 A 1 
ATOM 658 O OE1 . GLU A 1 83 ? 11.670  -2.055  -3.276  1.00 78.34 83 A 1 
ATOM 659 O OE2 . GLU A 1 83 ? 10.452  -1.095  -4.808  1.00 77.99 83 A 1 
ATOM 660 N N   . ILE A 1 84 ? 7.383   -0.939  0.180   1.00 98.19 84 A 1 
ATOM 661 C CA  . ILE A 1 84 ? 7.091   -1.950  1.191   1.00 98.20 84 A 1 
ATOM 662 C C   . ILE A 1 84 ? 7.260   -3.318  0.538   1.00 98.15 84 A 1 
ATOM 663 O O   . ILE A 1 84 ? 6.595   -3.617  -0.453  1.00 97.81 84 A 1 
ATOM 664 C CB  . ILE A 1 84 ? 5.670   -1.760  1.761   1.00 98.03 84 A 1 
ATOM 665 C CG1 . ILE A 1 84 ? 5.500   -0.366  2.407   1.00 97.37 84 A 1 
ATOM 666 C CG2 . ILE A 1 84 ? 5.340   -2.876  2.767   1.00 97.33 84 A 1 
ATOM 667 C CD1 . ILE A 1 84 ? 4.069   -0.060  2.864   1.00 95.62 84 A 1 
ATOM 668 N N   . ASP A 1 85 ? 8.084   -4.174  1.124   1.00 97.67 85 A 1 
ATOM 669 C CA  . ASP A 1 85 ? 8.221   -5.556  0.678   1.00 97.37 85 A 1 
ATOM 670 C C   . ASP A 1 85 ? 7.118   -6.425  1.283   1.00 97.46 85 A 1 
ATOM 671 O O   . ASP A 1 85 ? 6.961   -6.508  2.499   1.00 96.94 85 A 1 
ATOM 672 C CB  . ASP A 1 85 ? 9.604   -6.092  1.045   1.00 96.37 85 A 1 
ATOM 673 C CG  . ASP A 1 85 ? 10.683  -5.541  0.121   1.00 92.09 85 A 1 
ATOM 674 O OD1 . ASP A 1 85 ? 10.769  -6.076  -1.014  1.00 87.92 85 A 1 
ATOM 675 O OD2 . ASP A 1 85 ? 11.424  -4.646  0.559   1.00 86.24 85 A 1 
ATOM 676 N N   . ALA A 1 86 ? 6.355   -7.112  0.439   1.00 97.10 86 A 1 
ATOM 677 C CA  . ALA A 1 86 ? 5.371   -8.101  0.853   1.00 96.68 86 A 1 
ATOM 678 C C   . ALA A 1 86 ? 5.932   -9.508  0.626   1.00 95.88 86 A 1 
ATOM 679 O O   . ALA A 1 86 ? 5.991   -10.001 -0.503  1.00 94.18 86 A 1 
ATOM 680 C CB  . ALA A 1 86 ? 4.062   -7.848  0.105   1.00 96.32 86 A 1 
ATOM 681 N N   . MET A 1 87 ? 6.325   -10.168 1.715   1.00 94.91 87 A 1 
ATOM 682 C CA  . MET A 1 87 ? 6.867   -11.523 1.669   1.00 93.75 87 A 1 
ATOM 683 C C   . MET A 1 87 ? 5.831   -12.536 2.131   1.00 93.51 87 A 1 
ATOM 684 O O   . MET A 1 87 ? 5.283   -12.434 3.225   1.00 90.93 87 A 1 
ATOM 685 C CB  . MET A 1 87 ? 8.150   -11.628 2.493   1.00 91.26 87 A 1 
ATOM 686 C CG  . MET A 1 87 ? 9.273   -10.785 1.886   1.00 82.92 87 A 1 
ATOM 687 S SD  . MET A 1 87 ? 10.925  -11.427 2.247   1.00 74.45 87 A 1 
ATOM 688 C CE  . MET A 1 87 ? 11.900  -10.319 1.220   1.00 65.56 87 A 1 
ATOM 689 N N   . LEU A 1 88 ? 5.597   -13.554 1.304   1.00 90.43 88 A 1 
ATOM 690 C CA  . LEU A 1 88 ? 4.794   -14.712 1.682   1.00 87.49 88 A 1 
ATOM 691 C C   . LEU A 1 88 ? 5.562   -15.561 2.689   1.00 85.43 88 A 1 
ATOM 692 O O   . LEU A 1 88 ? 6.670   -16.027 2.421   1.00 79.28 88 A 1 
ATOM 693 C CB  . LEU A 1 88 ? 4.431   -15.509 0.426   1.00 83.81 88 A 1 
ATOM 694 C CG  . LEU A 1 88 ? 3.245   -14.887 -0.327  1.00 75.27 88 A 1 
ATOM 695 C CD1 . LEU A 1 88 ? 3.289   -15.228 -1.809  1.00 70.79 88 A 1 
ATOM 696 C CD2 . LEU A 1 88 ? 1.919   -15.398 0.241   1.00 70.03 88 A 1 
ATOM 697 N N   . HIS A 1 89 ? 4.954   -15.784 3.850   1.00 82.92 89 A 1 
ATOM 698 C CA  . HIS A 1 89 ? 5.414   -16.764 4.818   1.00 78.60 89 A 1 
ATOM 699 C C   . HIS A 1 89 ? 4.234   -17.647 5.204   1.00 76.93 89 A 1 
ATOM 700 O O   . HIS A 1 89 ? 3.183   -17.176 5.625   1.00 67.25 89 A 1 
ATOM 701 C CB  . HIS A 1 89 ? 6.102   -16.088 6.012   1.00 72.29 89 A 1 
ATOM 702 C CG  . HIS A 1 89 ? 5.205   -15.300 6.914   1.00 65.55 89 A 1 
ATOM 703 N ND1 . HIS A 1 89 ? 4.775   -14.016 6.709   1.00 58.14 89 A 1 
ATOM 704 C CD2 . HIS A 1 89 ? 4.680   -15.705 8.109   1.00 57.93 89 A 1 
ATOM 705 C CE1 . HIS A 1 89 ? 3.995   -13.663 7.744   1.00 53.83 89 A 1 
ATOM 706 N NE2 . HIS A 1 89 ? 3.928   -14.659 8.626   1.00 54.36 89 A 1 
ATOM 707 N N   . GLN A 1 90 ? 4.412   -18.956 5.053   1.00 73.00 90 A 1 
ATOM 708 C CA  . GLN A 1 90 ? 3.418   -19.921 5.513   1.00 69.81 90 A 1 
ATOM 709 C C   . GLN A 1 90 ? 3.510   -20.025 7.037   1.00 68.26 90 A 1 
ATOM 710 O O   . GLN A 1 90 ? 4.290   -20.805 7.567   1.00 60.60 90 A 1 
ATOM 711 C CB  . GLN A 1 90 ? 3.637   -21.270 4.822   1.00 63.62 90 A 1 
ATOM 712 C CG  . GLN A 1 90 ? 3.327   -21.210 3.323   1.00 55.31 90 A 1 
ATOM 713 C CD  . GLN A 1 90 ? 3.465   -22.578 2.657   1.00 50.58 90 A 1 
ATOM 714 O OE1 . GLN A 1 90 ? 4.414   -23.311 2.860   1.00 45.55 90 A 1 
ATOM 715 N NE2 . GLN A 1 90 ? 2.532   -22.967 1.828   1.00 43.73 90 A 1 
ATOM 716 N N   . THR A 1 91 ? 2.736   -19.197 7.757   1.00 60.75 91 A 1 
ATOM 717 C CA  . THR A 1 91 ? 2.636   -19.309 9.222   1.00 59.20 91 A 1 
ATOM 718 C C   . THR A 1 91 ? 1.657   -20.382 9.663   1.00 57.91 91 A 1 
ATOM 719 O O   . THR A 1 91 ? 1.821   -20.944 10.741  1.00 52.32 91 A 1 
ATOM 720 C CB  . THR A 1 91 ? 2.192   -18.001 9.876   1.00 55.01 91 A 1 
ATOM 721 O OG1 . THR A 1 91 ? 1.092   -17.441 9.197   1.00 50.07 91 A 1 
ATOM 722 C CG2 . THR A 1 91 ? 3.302   -16.970 9.911   1.00 48.39 91 A 1 
ATOM 723 N N   . GLY A 1 92 ? 0.626   -20.630 8.859   1.00 54.73 92 A 1 
ATOM 724 C CA  . GLY A 1 92 ? -0.425  -21.580 9.187   1.00 53.71 92 A 1 
ATOM 725 C C   . GLY A 1 92 ? -0.328  -22.827 8.311   1.00 52.72 92 A 1 
ATOM 726 O O   . GLY A 1 92 ? -0.351  -22.727 7.089   1.00 49.00 92 A 1 
ATOM 727 N N   . GLY A 1 93 ? -0.251  -23.966 8.952   1.00 52.26 93 A 1 
ATOM 728 C CA  . GLY A 1 93 ? -0.678  -25.261 8.427   1.00 50.11 93 A 1 
ATOM 729 C C   . GLY A 1 93 ? -2.043  -25.614 9.005   1.00 47.24 93 A 1 
ATOM 730 O O   . GLY A 1 93 ? -2.423  -25.055 10.048  1.00 42.38 93 A 1 
ATOM 731 O OXT . GLY A 1 93 ? -2.735  -26.480 8.385   1.00 45.46 93 A 1 
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