# 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_prod-mmseqs2-test2
#
_entry.id prod-mmseqs2-test2
#
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" 
"C4 H7 N O4"    133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O             ? "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" 
"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" 
#
_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 
#
loop_
_entity.id
_entity.pdbx_description
_entity.type
1 . polymer 
2 . polymer 
#
loop_
_entity_poly.entity_id
_entity_poly.pdbx_strand_id
_entity_poly.type
1 A polypeptide(L) 
2 B polypeptide(L) 
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.hetero
_entity_poly_seq.mon_id
_entity_poly_seq.num
1 n MET 1  
1 n LEU 2  
1 n PRO 3  
1 n ASP 4  
1 n TRP 5  
1 n LYS 6  
1 n SER 7  
1 n SER 8  
1 n LEU 9  
1 n ILE 10 
1 n LEU 11 
1 n MET 12 
1 n ALA 13 
1 n TYR 14 
1 n ILE 15 
1 n ILE 16 
1 n ILE 17 
1 n PHE 18 
1 n LEU 19 
1 n THR 20 
1 n MET 21 
1 n LEU 22 
1 n PRO 23 
1 n ASP 24 
1 n TRP 25 
1 n LYS 26 
1 n SER 27 
1 n SER 28 
1 n LEU 29 
1 n ILE 30 
1 n LEU 31 
1 n MET 32 
1 n ALA 33 
1 n TYR 34 
1 n ILE 35 
1 n ILE 36 
1 n ILE 37 
1 n PHE 38 
1 n LEU 39 
1 n THR 40 
1 n MET 41 
1 n LEU 42 
1 n PRO 43 
1 n ASP 44 
1 n TRP 45 
1 n LYS 46 
1 n SER 47 
1 n SER 48 
1 n LEU 49 
1 n ILE 50 
1 n LEU 51 
1 n MET 52 
1 n ALA 53 
1 n TYR 54 
1 n ILE 55 
1 n ILE 56 
1 n ILE 57 
1 n PHE 58 
1 n LEU 59 
1 n THR 60 
2 n MET 1  
2 n LEU 2  
2 n PRO 3  
2 n ASP 4  
2 n TRP 5  
2 n LYS 6  
2 n SER 7  
2 n SER 8  
2 n LEU 9  
2 n ILE 10 
2 n LEU 11 
2 n MET 12 
2 n ALA 13 
2 n TYR 14 
2 n ILE 15 
2 n ILE 16 
2 n ILE 17 
2 n PHE 18 
2 n LEU 19 
2 n THR 20 
2 n MET 21 
2 n LEU 22 
2 n PRO 23 
2 n ASP 24 
2 n TRP 25 
2 n LYS 26 
2 n SER 27 
2 n SER 28 
2 n LEU 29 
2 n ILE 30 
2 n LEU 31 
2 n MET 32 
2 n ALA 33 
2 n TYR 34 
2 n ILE 35 
2 n ILE 36 
2 n ILE 37 
2 n PHE 38 
2 n LEU 39 
2 n THR 40 
2 n MET 41 
2 n LEU 42 
2 n PRO 43 
2 n ASP 44 
2 n TRP 45 
2 n LYS 46 
2 n SER 47 
2 n SER 48 
2 n LEU 49 
2 n ILE 50 
2 n LEU 51 
2 n MET 52 
2 n ALA 53 
2 n TYR 54 
2 n ILE 55 
2 n ILE 56 
2 n ILE 57 
2 n PHE 58 
2 n LEU 59 
2 n THR 60 
#
_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 @ 2025-07-17 10:55:08)"
_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 53.05
_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 46.56 1 1   
A LEU 2  2 46.15 1 2   
A PRO 3  2 46.08 1 3   
A ASP 4  2 50.93 1 4   
A TRP 5  2 46.98 1 5   
A LYS 6  2 54.14 1 6   
A SER 7  2 57.09 1 7   
A SER 8  2 57.11 1 8   
A LEU 9  2 53.36 1 9   
A ILE 10 2 58.33 1 10  
A LEU 11 2 55.89 1 11  
A MET 12 2 57.07 1 12  
A ALA 13 2 61.35 1 13  
A TYR 14 2 54.14 1 14  
A ILE 15 2 57.85 1 15  
A ILE 16 2 57.79 1 16  
A ILE 17 2 56.88 1 17  
A PHE 18 2 50.62 1 18  
A LEU 19 2 52.56 1 19  
A THR 20 2 49.73 1 20  
A MET 21 2 48.33 1 21  
A LEU 22 2 46.38 1 22  
A PRO 23 2 49.06 1 23  
A ASP 24 2 51.31 1 24  
A TRP 25 2 48.08 1 25  
A LYS 26 2 52.28 1 26  
A SER 27 2 56.35 1 27  
A SER 28 2 56.25 1 28  
A LEU 29 2 53.76 1 29  
A ILE 30 2 57.77 1 30  
A LEU 31 2 57.93 1 31  
A MET 32 2 58.28 1 32  
A ALA 33 2 61.05 1 33  
A TYR 34 2 54.38 1 34  
A ILE 35 2 58.78 1 35  
A ILE 36 2 57.38 1 36  
A ILE 37 2 54.22 1 37  
A PHE 38 2 50.49 1 38  
A LEU 39 2 53.14 1 39  
A THR 40 2 49.40 1 40  
A MET 41 2 48.45 1 41  
A LEU 42 2 47.06 1 42  
A PRO 43 2 49.63 1 43  
A ASP 44 2 51.73 1 44  
A TRP 45 2 50.32 1 45  
A LYS 46 2 51.86 1 46  
A SER 47 2 53.28 1 47  
A SER 48 2 56.62 1 48  
A LEU 49 2 52.38 1 49  
A ILE 50 2 55.43 1 50  
A LEU 51 2 55.91 1 51  
A MET 52 2 58.14 1 52  
A ALA 53 2 60.81 1 53  
A TYR 54 2 52.73 1 54  
A ILE 55 2 55.52 1 55  
A ILE 56 2 53.55 1 56  
A ILE 57 2 54.52 1 57  
A PHE 58 2 48.23 1 58  
A LEU 59 2 48.96 1 59  
A THR 60 2 48.36 1 60  
B MET 1  2 47.53 1 61  
B LEU 2  2 47.37 1 62  
B PRO 3  2 45.78 1 63  
B ASP 4  2 52.11 1 64  
B TRP 5  2 48.16 1 65  
B LYS 6  2 54.74 1 66  
B SER 7  2 57.31 1 67  
B SER 8  2 57.64 1 68  
B LEU 9  2 54.07 1 69  
B ILE 10 2 59.28 1 70  
B LEU 11 2 56.52 1 71  
B MET 12 2 57.61 1 72  
B ALA 13 2 62.17 1 73  
B TYR 14 2 55.14 1 74  
B ILE 15 2 58.87 1 75  
B ILE 16 2 57.87 1 76  
B ILE 17 2 57.12 1 77  
B PHE 18 2 51.27 1 78  
B LEU 19 2 52.94 1 79  
B THR 20 2 49.59 1 80  
B MET 21 2 48.41 1 81  
B LEU 22 2 45.93 1 82  
B PRO 23 2 48.50 1 83  
B ASP 24 2 50.91 1 84  
B TRP 25 2 48.11 1 85  
B LYS 26 2 51.74 1 86  
B SER 27 2 55.80 1 87  
B SER 28 2 56.01 1 88  
B LEU 29 2 53.58 1 89  
B ILE 30 2 57.45 1 90  
B LEU 31 2 57.77 1 91  
B MET 32 2 58.45 1 92  
B ALA 33 2 60.92 1 93  
B TYR 34 2 54.11 1 94  
B ILE 35 2 59.01 1 95  
B ILE 36 2 57.96 1 96  
B ILE 37 2 54.60 1 97  
B PHE 38 2 50.65 1 98  
B LEU 39 2 53.69 1 99  
B THR 40 2 49.72 1 100 
B MET 41 2 48.21 1 101 
B LEU 42 2 46.99 1 102 
B PRO 43 2 49.16 1 103 
B ASP 44 2 51.39 1 104 
B TRP 45 2 50.90 1 105 
B LYS 46 2 52.45 1 106 
B SER 47 2 53.15 1 107 
B SER 48 2 56.59 1 108 
B LEU 49 2 53.31 1 109 
B ILE 50 2 55.89 1 110 
B LEU 51 2 56.37 1 111 
B MET 52 2 58.32 1 112 
B ALA 53 2 61.33 1 113 
B TYR 54 2 52.69 1 114 
B ILE 55 2 55.34 1 115 
B ILE 56 2 54.06 1 116 
B ILE 57 2 54.74 1 117 
B PHE 58 2 48.52 1 118 
B LEU 59 2 48.85 1 119 
B THR 60 2 48.98 1 120 
#
_ma_software_group.group_id    1
_ma_software_group.ordinal_id  1
_ma_software_group.software_id 1
#
loop_
_ma_target_entity.data_id
_ma_target_entity.entity_id
_ma_target_entity.origin
1 1 . 
1 2 . 
#
loop_
_ma_target_entity_instance.asym_id
_ma_target_entity_instance.details
_ma_target_entity_instance.entity_id
A . 1 
B . 2 
#
loop_
_pdbx_data_usage.details
_pdbx_data_usage.id
_pdbx_data_usage.type
_pdbx_data_usage.url
;Non-commercial use only, by using this file you agree to the terms of use found
at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
To request access to the AlphaFold 3 model parameters, follow the process set
out at https://github.com/google-deepmind/alphafold3. You may only use these if
received directly from Google. Use is subject to terms of use available at
https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
;
1 license    https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md 
;AlphaFold 3 and its output are not intended for, have not been validated for,
and are not approved for clinical use. They are provided "as-is" without any
warranty of any kind, whether expressed or implied. No warranty is given that
use shall not infringe the rights of any third party.
;
2 disclaimer ?                                                                              
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.hetero
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.seq_id
A 1  1 n MET . 1  A 1  
A 2  1 n LEU . 2  A 2  
A 3  1 n PRO . 3  A 3  
A 4  1 n ASP . 4  A 4  
A 5  1 n TRP . 5  A 5  
A 6  1 n LYS . 6  A 6  
A 7  1 n SER . 7  A 7  
A 8  1 n SER . 8  A 8  
A 9  1 n LEU . 9  A 9  
A 10 1 n ILE . 10 A 10 
A 11 1 n LEU . 11 A 11 
A 12 1 n MET . 12 A 12 
A 13 1 n ALA . 13 A 13 
A 14 1 n TYR . 14 A 14 
A 15 1 n ILE . 15 A 15 
A 16 1 n ILE . 16 A 16 
A 17 1 n ILE . 17 A 17 
A 18 1 n PHE . 18 A 18 
A 19 1 n LEU . 19 A 19 
A 20 1 n THR . 20 A 20 
A 21 1 n MET . 21 A 21 
A 22 1 n LEU . 22 A 22 
A 23 1 n PRO . 23 A 23 
A 24 1 n ASP . 24 A 24 
A 25 1 n TRP . 25 A 25 
A 26 1 n LYS . 26 A 26 
A 27 1 n SER . 27 A 27 
A 28 1 n SER . 28 A 28 
A 29 1 n LEU . 29 A 29 
A 30 1 n ILE . 30 A 30 
A 31 1 n LEU . 31 A 31 
A 32 1 n MET . 32 A 32 
A 33 1 n ALA . 33 A 33 
A 34 1 n TYR . 34 A 34 
A 35 1 n ILE . 35 A 35 
A 36 1 n ILE . 36 A 36 
A 37 1 n ILE . 37 A 37 
A 38 1 n PHE . 38 A 38 
A 39 1 n LEU . 39 A 39 
A 40 1 n THR . 40 A 40 
A 41 1 n MET . 41 A 41 
A 42 1 n LEU . 42 A 42 
A 43 1 n PRO . 43 A 43 
A 44 1 n ASP . 44 A 44 
A 45 1 n TRP . 45 A 45 
A 46 1 n LYS . 46 A 46 
A 47 1 n SER . 47 A 47 
A 48 1 n SER . 48 A 48 
A 49 1 n LEU . 49 A 49 
A 50 1 n ILE . 50 A 50 
A 51 1 n LEU . 51 A 51 
A 52 1 n MET . 52 A 52 
A 53 1 n ALA . 53 A 53 
A 54 1 n TYR . 54 A 54 
A 55 1 n ILE . 55 A 55 
A 56 1 n ILE . 56 A 56 
A 57 1 n ILE . 57 A 57 
A 58 1 n PHE . 58 A 58 
A 59 1 n LEU . 59 A 59 
A 60 1 n THR . 60 A 60 
B 1  2 n MET . 1  B 1  
B 2  2 n LEU . 2  B 2  
B 3  2 n PRO . 3  B 3  
B 4  2 n ASP . 4  B 4  
B 5  2 n TRP . 5  B 5  
B 6  2 n LYS . 6  B 6  
B 7  2 n SER . 7  B 7  
B 8  2 n SER . 8  B 8  
B 9  2 n LEU . 9  B 9  
B 10 2 n ILE . 10 B 10 
B 11 2 n LEU . 11 B 11 
B 12 2 n MET . 12 B 12 
B 13 2 n ALA . 13 B 13 
B 14 2 n TYR . 14 B 14 
B 15 2 n ILE . 15 B 15 
B 16 2 n ILE . 16 B 16 
B 17 2 n ILE . 17 B 17 
B 18 2 n PHE . 18 B 18 
B 19 2 n LEU . 19 B 19 
B 20 2 n THR . 20 B 20 
B 21 2 n MET . 21 B 21 
B 22 2 n LEU . 22 B 22 
B 23 2 n PRO . 23 B 23 
B 24 2 n ASP . 24 B 24 
B 25 2 n TRP . 25 B 25 
B 26 2 n LYS . 26 B 26 
B 27 2 n SER . 27 B 27 
B 28 2 n SER . 28 B 28 
B 29 2 n LEU . 29 B 29 
B 30 2 n ILE . 30 B 30 
B 31 2 n LEU . 31 B 31 
B 32 2 n MET . 32 B 32 
B 33 2 n ALA . 33 B 33 
B 34 2 n TYR . 34 B 34 
B 35 2 n ILE . 35 B 35 
B 36 2 n ILE . 36 B 36 
B 37 2 n ILE . 37 B 37 
B 38 2 n PHE . 38 B 38 
B 39 2 n LEU . 39 B 39 
B 40 2 n THR . 40 B 40 
B 41 2 n MET . 41 B 41 
B 42 2 n LEU . 42 B 42 
B 43 2 n PRO . 43 B 43 
B 44 2 n ASP . 44 B 44 
B 45 2 n TRP . 45 B 45 
B 46 2 n LYS . 46 B 46 
B 47 2 n SER . 47 B 47 
B 48 2 n SER . 48 B 48 
B 49 2 n LEU . 49 B 49 
B 50 2 n ILE . 50 B 50 
B 51 2 n LEU . 51 B 51 
B 52 2 n MET . 52 B 52 
B 53 2 n ALA . 53 B 53 
B 54 2 n TYR . 54 B 54 
B 55 2 n ILE . 55 B 55 
B 56 2 n ILE . 56 B 56 
B 57 2 n ILE . 57 B 57 
B 58 2 n PHE . 58 B 58 
B 59 2 n LEU . 59 B 59 
B 60 2 n THR . 60 B 60 
#
_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)"
#
loop_
_struct_asym.entity_id
_struct_asym.id
1 A 
2 B 
#
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  ? 16.660  -15.157 1.197   1.00 45.50 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? 17.581  -14.657 2.232   1.00 51.25 1  A 1 
ATOM 3   C C   . MET A 1 1  ? 16.890  -14.550 3.596   1.00 52.93 1  A 1 
ATOM 4   O O   . MET A 1 1  ? 17.527  -14.695 4.637   1.00 50.88 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? 18.150  -13.288 1.831   1.00 49.79 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? 19.275  -12.805 2.731   1.00 45.76 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? 20.151  -11.368 2.071   1.00 40.13 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? 18.888  -10.101 2.279   1.00 36.23 1  A 1 
ATOM 9   N N   . LEU A 1 2  ? 15.573  -14.308 3.589   1.00 48.40 2  A 1 
ATOM 10  C CA  . LEU A 1 2  ? 14.782  -14.235 4.815   1.00 49.13 2  A 1 
ATOM 11  C C   . LEU A 1 2  ? 13.785  -15.395 4.856   1.00 48.87 2  A 1 
ATOM 12  O O   . LEU A 1 2  ? 12.709  -15.308 4.257   1.00 46.03 2  A 1 
ATOM 13  C CB  . LEU A 1 2  ? 14.048  -12.896 4.891   1.00 47.97 2  A 1 
ATOM 14  C CG  . LEU A 1 2  ? 14.955  -11.661 4.927   1.00 45.16 2  A 1 
ATOM 15  C CD1 . LEU A 1 2  ? 14.127  -10.386 4.805   1.00 42.11 2  A 1 
ATOM 16  C CD2 . LEU A 1 2  ? 15.773  -11.640 6.218   1.00 41.54 2  A 1 
ATOM 17  N N   . PRO A 1 3  ? 14.128  -16.500 5.542   1.00 45.57 3  A 1 
ATOM 18  C CA  . PRO A 1 3  ? 13.236  -17.669 5.589   1.00 47.81 3  A 1 
ATOM 19  C C   . PRO A 1 3  ? 11.964  -17.428 6.399   1.00 50.10 3  A 1 
ATOM 20  O O   . PRO A 1 3  ? 10.942  -18.079 6.165   1.00 46.38 3  A 1 
ATOM 21  C CB  . PRO A 1 3  ? 14.108  -18.750 6.243   1.00 44.67 3  A 1 
ATOM 22  C CG  . PRO A 1 3  ? 15.101  -17.996 7.076   1.00 43.08 3  A 1 
ATOM 23  C CD  . PRO A 1 3  ? 15.373  -16.718 6.323   1.00 44.98 3  A 1 
ATOM 24  N N   . ASP A 1 4  ? 12.014  -16.494 7.344   1.00 52.98 4  A 1 
ATOM 25  C CA  . ASP A 1 4  ? 10.873  -16.196 8.209   1.00 55.39 4  A 1 
ATOM 26  C C   . ASP A 1 4  ? 10.024  -15.037 7.680   1.00 55.65 4  A 1 
ATOM 27  O O   . ASP A 1 4  ? 9.254   -14.429 8.427   1.00 53.38 4  A 1 
ATOM 28  C CB  . ASP A 1 4  ? 11.366  -15.877 9.625   1.00 53.53 4  A 1 
ATOM 29  C CG  . ASP A 1 4  ? 12.069  -17.056 10.278  1.00 48.49 4  A 1 
ATOM 30  O OD1 . ASP A 1 4  ? 11.754  -18.209 9.919   1.00 44.51 4  A 1 
ATOM 31  O OD2 . ASP A 1 4  ? 12.930  -16.830 11.150  1.00 43.49 4  A 1 
ATOM 32  N N   . TRP A 1 5  ? 10.145  -14.731 6.394   1.00 51.47 5  A 1 
ATOM 33  C CA  . TRP A 1 5  ? 9.400   -13.615 5.814   1.00 52.26 5  A 1 
ATOM 34  C C   . TRP A 1 5  ? 7.892   -13.876 5.809   1.00 52.51 5  A 1 
ATOM 35  O O   . TRP A 1 5  ? 7.099   -12.942 5.944   1.00 50.44 5  A 1 
ATOM 36  C CB  . TRP A 1 5  ? 9.892   -13.323 4.391   1.00 51.07 5  A 1 
ATOM 37  C CG  . TRP A 1 5  ? 9.618   -14.425 3.410   1.00 48.82 5  A 1 
ATOM 38  C CD1 . TRP A 1 5  ? 10.426  -15.474 3.119   1.00 43.65 5  A 1 
ATOM 39  C CD2 . TRP A 1 5  ? 8.446   -14.575 2.589   1.00 44.30 5  A 1 
ATOM 40  N NE1 . TRP A 1 5  ? 9.831   -16.276 2.172   1.00 43.45 5  A 1 
ATOM 41  C CE2 . TRP A 1 5  ? 8.620   -15.746 1.829   1.00 44.25 5  A 1 
ATOM 42  C CE3 . TRP A 1 5  ? 7.284   -13.822 2.423   1.00 45.00 5  A 1 
ATOM 43  C CZ2 . TRP A 1 5  ? 7.656   -16.190 0.919   1.00 45.64 5  A 1 
ATOM 44  C CZ3 . TRP A 1 5  ? 6.320   -14.269 1.516   1.00 43.25 5  A 1 
ATOM 45  C CH2 . TRP A 1 5  ? 6.516   -15.438 0.773   1.00 41.59 5  A 1 
ATOM 46  N N   . LYS A 1 6  ? 7.484   -15.135 5.672   1.00 57.31 6  A 1 
ATOM 47  C CA  . LYS A 1 6  ? 6.061   -15.482 5.628   1.00 57.84 6  A 1 
ATOM 48  C C   . LYS A 1 6  ? 5.387   -15.223 6.973   1.00 56.88 6  A 1 
ATOM 49  O O   . LYS A 1 6  ? 4.328   -14.594 7.035   1.00 56.63 6  A 1 
ATOM 50  C CB  . LYS A 1 6  ? 5.888   -16.950 5.222   1.00 58.25 6  A 1 
ATOM 51  C CG  . LYS A 1 6  ? 6.295   -17.222 3.776   1.00 55.21 6  A 1 
ATOM 52  C CD  . LYS A 1 6  ? 6.065   -18.677 3.398   1.00 51.62 6  A 1 
ATOM 53  C CE  . LYS A 1 6  ? 6.486   -18.945 1.959   1.00 48.32 6  A 1 
ATOM 54  N NZ  . LYS A 1 6  ? 6.286   -20.369 1.582   1.00 45.21 6  A 1 
ATOM 55  N N   . SER A 1 7  ? 6.010   -15.700 8.050   1.00 57.71 7  A 1 
ATOM 56  C CA  . SER A 1 7  ? 5.454   -15.508 9.387   1.00 58.32 7  A 1 
ATOM 57  C C   . SER A 1 7  ? 5.441   -14.029 9.773   1.00 58.67 7  A 1 
ATOM 58  O O   . SER A 1 7  ? 4.536   -13.574 10.476  1.00 57.25 7  A 1 
ATOM 59  C CB  . SER A 1 7  ? 6.256   -16.314 10.412  1.00 57.81 7  A 1 
ATOM 60  O OG  . SER A 1 7  ? 7.610   -15.905 10.445  1.00 52.78 7  A 1 
ATOM 61  N N   . SER A 1 8  ? 6.423   -13.278 9.302   1.00 58.47 8  A 1 
ATOM 62  C CA  . SER A 1 8  ? 6.499   -11.850 9.606   1.00 58.64 8  A 1 
ATOM 63  C C   . SER A 1 8  ? 5.361   -11.073 8.942   1.00 59.02 8  A 1 
ATOM 64  O O   . SER A 1 8  ? 4.821   -10.136 9.531   1.00 58.19 8  A 1 
ATOM 65  C CB  . SER A 1 8  ? 7.854   -11.284 9.165   1.00 57.06 8  A 1 
ATOM 66  O OG  . SER A 1 8  ? 7.975   -11.267 7.758   1.00 51.29 8  A 1 
ATOM 67  N N   . LEU A 1 9  ? 4.979   -11.467 7.728   1.00 55.95 9  A 1 
ATOM 68  C CA  . LEU A 1 9  ? 3.883   -10.807 7.014   1.00 56.26 9  A 1 
ATOM 69  C C   . LEU A 1 9  ? 2.553   -11.012 7.736   1.00 56.40 9  A 1 
ATOM 70  O O   . LEU A 1 9  ? 1.731   -10.092 7.816   1.00 56.78 9  A 1 
ATOM 71  C CB  . LEU A 1 9  ? 3.798   -11.341 5.581   1.00 55.40 9  A 1 
ATOM 72  C CG  . LEU A 1 9  ? 4.908   -10.850 4.646   1.00 51.61 9  A 1 
ATOM 73  C CD1 . LEU A 1 9  ? 4.877   -11.625 3.331   1.00 46.69 9  A 1 
ATOM 74  C CD2 . LEU A 1 9  ? 4.766   -9.356  4.377   1.00 47.77 9  A 1 
ATOM 75  N N   . ILE A 1 10 ? 2.338   -12.214 8.272   1.00 59.19 10 A 1 
ATOM 76  C CA  . ILE A 1 10 ? 1.114   -12.514 9.018   1.00 60.37 10 A 1 
ATOM 77  C C   . ILE A 1 10 ? 1.049   -11.661 10.287  1.00 60.28 10 A 1 
ATOM 78  O O   . ILE A 1 10 ? -0.008  -11.121 10.636  1.00 59.76 10 A 1 
ATOM 79  C CB  . ILE A 1 10 ? 1.050   -14.015 9.370   1.00 60.09 10 A 1 
ATOM 80  C CG1 . ILE A 1 10 ? 0.993   -14.863 8.093   1.00 57.95 10 A 1 
ATOM 81  C CG2 . ILE A 1 10 ? -0.170  -14.305 10.251  1.00 55.18 10 A 1 
ATOM 82  C CD1 . ILE A 1 10 ? 1.214   -16.347 8.348   1.00 53.84 10 A 1 
ATOM 83  N N   . LEU A 1 11 ? 2.178   -11.531 10.968  1.00 58.73 11 A 1 
ATOM 84  C CA  . LEU A 1 11 ? 2.246   -10.728 12.186  1.00 58.76 11 A 1 
ATOM 85  C C   . LEU A 1 11 ? 1.998   -9.248  11.886  1.00 58.63 11 A 1 
ATOM 86  O O   . LEU A 1 11 ? 1.327   -8.556  12.657  1.00 58.43 11 A 1 
ATOM 87  C CB  . LEU A 1 11 ? 3.611   -10.914 12.860  1.00 58.06 11 A 1 
ATOM 88  C CG  . LEU A 1 11 ? 3.750   -10.237 14.228  1.00 54.13 11 A 1 
ATOM 89  C CD1 . LEU A 1 11 ? 2.774   -10.848 15.234  1.00 49.05 11 A 1 
ATOM 90  C CD2 . LEU A 1 11 ? 5.180   -10.374 14.742  1.00 51.36 11 A 1 
ATOM 91  N N   . MET A 1 12 ? 2.529   -8.762  10.766  1.00 61.38 12 A 1 
ATOM 92  C CA  . MET A 1 12 ? 2.334   -7.369  10.364  1.00 61.24 12 A 1 
ATOM 93  C C   . MET A 1 12 ? 0.856   -7.068  10.128  1.00 60.44 12 A 1 
ATOM 94  O O   . MET A 1 12 ? 0.365   -6.005  10.513  1.00 60.51 12 A 1 
ATOM 95  C CB  . MET A 1 12 ? 3.143   -7.066  9.094   1.00 59.90 12 A 1 
ATOM 96  C CG  . MET A 1 12 ? 4.649   -7.008  9.334   1.00 55.70 12 A 1 
ATOM 97  S SD  . MET A 1 12 ? 5.145   -5.602  10.327  1.00 49.66 12 A 1 
ATOM 98  C CE  . MET A 1 12 ? 6.937   -5.824  10.310  1.00 47.76 12 A 1 
ATOM 99  N N   . ALA A 1 13 ? 0.139   -8.007  9.508   1.00 62.07 13 A 1 
ATOM 100 C CA  . ALA A 1 13 ? -1.292  -7.833  9.251   1.00 61.78 13 A 1 
ATOM 101 C C   . ALA A 1 13 ? -2.079  -7.724  10.558  1.00 61.69 13 A 1 
ATOM 102 O O   . ALA A 1 13 ? -3.020  -6.931  10.664  1.00 60.44 13 A 1 
ATOM 103 C CB  . ALA A 1 13 ? -1.816  -8.997  8.412   1.00 60.76 13 A 1 
ATOM 104 N N   . TYR A 1 14 ? -1.695  -8.520  11.562  1.00 58.10 14 A 1 
ATOM 105 C CA  . TYR A 1 14 ? -2.351  -8.481  12.869  1.00 59.67 14 A 1 
ATOM 106 C C   . TYR A 1 14 ? -2.150  -7.126  13.549  1.00 59.70 14 A 1 
ATOM 107 O O   . TYR A 1 14 ? -3.068  -6.595  14.183  1.00 61.19 14 A 1 
ATOM 108 C CB  . TYR A 1 14 ? -1.809  -9.606  13.755  1.00 59.95 14 A 1 
ATOM 109 C CG  . TYR A 1 14 ? -2.462  -9.635  15.117  1.00 57.02 14 A 1 
ATOM 110 C CD1 . TYR A 1 14 ? -3.729  -10.190 15.290  1.00 51.37 14 A 1 
ATOM 111 C CD2 . TYR A 1 14 ? -1.814  -9.098  16.229  1.00 51.43 14 A 1 
ATOM 112 C CE1 . TYR A 1 14 ? -4.331  -10.213 16.542  1.00 47.98 14 A 1 
ATOM 113 C CE2 . TYR A 1 14 ? -2.413  -9.116  17.483  1.00 47.94 14 A 1 
ATOM 114 C CZ  . TYR A 1 14 ? -3.670  -9.677  17.632  1.00 48.92 14 A 1 
ATOM 115 O OH  . TYR A 1 14 ? -4.262  -9.696  18.877  1.00 46.44 14 A 1 
ATOM 116 N N   . ILE A 1 15 ? -0.949  -6.566  13.421  1.00 60.50 15 A 1 
ATOM 117 C CA  . ILE A 1 15 ? -0.633  -5.269  14.026  1.00 60.42 15 A 1 
ATOM 118 C C   . ILE A 1 15 ? -1.480  -4.157  13.398  1.00 59.16 15 A 1 
ATOM 119 O O   . ILE A 1 15 ? -1.939  -3.250  14.097  1.00 58.58 15 A 1 
ATOM 120 C CB  . ILE A 1 15 ? 0.874   -4.958  13.880  1.00 60.11 15 A 1 
ATOM 121 C CG1 . ILE A 1 15 ? 1.704   -5.970  14.679  1.00 57.68 15 A 1 
ATOM 122 C CG2 . ILE A 1 15 ? 1.181   -3.539  14.359  1.00 53.80 15 A 1 
ATOM 123 C CD1 . ILE A 1 15 ? 3.185   -5.942  14.330  1.00 52.55 15 A 1 
ATOM 124 N N   . ILE A 1 16 ? -1.704  -4.226  12.092  1.00 61.02 16 A 1 
ATOM 125 C CA  . ILE A 1 16 ? -2.508  -3.217  11.390  1.00 60.56 16 A 1 
ATOM 126 C C   . ILE A 1 16 ? -3.936  -3.189  11.940  1.00 59.49 16 A 1 
ATOM 127 O O   . ILE A 1 16 ? -4.490  -2.116  12.203  1.00 58.19 16 A 1 
ATOM 128 C CB  . ILE A 1 16 ? -2.519  -3.493  9.872   1.00 59.94 16 A 1 
ATOM 129 C CG1 . ILE A 1 16 ? -1.112  -3.325  9.291   1.00 57.03 16 A 1 
ATOM 130 C CG2 . ILE A 1 16 ? -3.492  -2.545  9.161   1.00 53.72 16 A 1 
ATOM 131 C CD1 . ILE A 1 16 ? -0.974  -3.881  7.887   1.00 52.34 16 A 1 
ATOM 132 N N   . ILE A 1 17 ? -4.538  -4.364  12.123  1.00 59.48 17 A 1 
ATOM 133 C CA  . ILE A 1 17 ? -5.896  -4.458  12.668  1.00 59.33 17 A 1 
ATOM 134 C C   . ILE A 1 17 ? -5.936  -3.909  14.097  1.00 58.35 17 A 1 
ATOM 135 O O   . ILE A 1 17 ? -6.877  -3.209  14.482  1.00 56.59 17 A 1 
ATOM 136 C CB  . ILE A 1 17 ? -6.396  -5.917  12.631  1.00 59.19 17 A 1 
ATOM 137 C CG1 . ILE A 1 17 ? -6.470  -6.418  11.181  1.00 56.98 17 A 1 
ATOM 138 C CG2 . ILE A 1 17 ? -7.769  -6.029  13.298  1.00 53.07 17 A 1 
ATOM 139 C CD1 . ILE A 1 17 ? -6.673  -7.918  11.075  1.00 52.04 17 A 1 
ATOM 140 N N   . PHE A 1 18 ? -4.908  -4.220  14.885  1.00 56.39 18 A 1 
ATOM 141 C CA  . PHE A 1 18 ? -4.828  -3.736  16.262  1.00 56.17 18 A 1 
ATOM 142 C C   . PHE A 1 18 ? -4.715  -2.208  16.314  1.00 55.28 18 A 1 
ATOM 143 O O   . PHE A 1 18 ? -5.294  -1.566  17.196  1.00 54.32 18 A 1 
ATOM 144 C CB  . PHE A 1 18 ? -3.632  -4.382  16.969  1.00 55.29 18 A 1 
ATOM 145 C CG  . PHE A 1 18 ? -3.548  -4.020  18.431  1.00 51.89 18 A 1 
ATOM 146 C CD1 . PHE A 1 18 ? -4.370  -4.645  19.362  1.00 46.90 18 A 1 
ATOM 147 C CD2 . PHE A 1 18 ? -2.655  -3.048  18.867  1.00 47.33 18 A 1 
ATOM 148 C CE1 . PHE A 1 18 ? -4.297  -4.311  20.707  1.00 44.25 18 A 1 
ATOM 149 C CE2 . PHE A 1 18 ? -2.580  -2.708  20.216  1.00 44.18 18 A 1 
ATOM 150 C CZ  . PHE A 1 18 ? -3.401  -3.342  21.135  1.00 44.77 18 A 1 
ATOM 151 N N   . LEU A 1 19 ? -3.984  -1.630  15.368  1.00 56.29 19 A 1 
ATOM 152 C CA  . LEU A 1 19 ? -3.789  -0.180  15.327  1.00 55.27 19 A 1 
ATOM 153 C C   . LEU A 1 19 ? -5.070  0.568   14.963  1.00 53.75 19 A 1 
ATOM 154 O O   . LEU A 1 19 ? -5.220  1.742   15.309  1.00 52.28 19 A 1 
ATOM 155 C CB  . LEU A 1 19 ? -2.677  0.165   14.328  1.00 54.42 19 A 1 
ATOM 156 C CG  . LEU A 1 19 ? -1.258  -0.090  14.853  1.00 51.85 19 A 1 
ATOM 157 C CD1 . LEU A 1 19 ? -0.255  -0.090  13.710  1.00 48.30 19 A 1 
ATOM 158 C CD2 . LEU A 1 19 ? -0.878  0.961   15.888  1.00 48.31 19 A 1 
ATOM 159 N N   . THR A 1 20 ? -6.003  -0.096  14.274  1.00 53.96 20 A 1 
ATOM 160 C CA  . THR A 1 20 ? -7.270  0.539   13.905  1.00 52.24 20 A 1 
ATOM 161 C C   . THR A 1 20 ? -8.113  0.865   15.140  1.00 50.64 20 A 1 
ATOM 162 O O   . THR A 1 20 ? -8.994  1.728   15.087  1.00 48.34 20 A 1 
ATOM 163 C CB  . THR A 1 20 ? -8.090  -0.354  12.962  1.00 50.21 20 A 1 
ATOM 164 O OG1 . THR A 1 20 ? -8.396  -1.591  13.595  1.00 47.10 20 A 1 
ATOM 165 C CG2 . THR A 1 20 ? -7.327  -0.622  11.670  1.00 45.65 20 A 1 
ATOM 166 N N   . MET A 1 21 ? -7.849  0.172   16.244  1.00 52.47 21 A 1 
ATOM 167 C CA  . MET A 1 21 ? -8.564  0.415   17.497  1.00 52.10 21 A 1 
ATOM 168 C C   . MET A 1 21 ? -8.049  1.669   18.203  1.00 49.60 21 A 1 
ATOM 169 O O   . MET A 1 21 ? -8.744  2.242   19.042  1.00 47.45 21 A 1 
ATOM 170 C CB  . MET A 1 21 ? -8.422  -0.791  18.427  1.00 51.30 21 A 1 
ATOM 171 C CG  . MET A 1 21 ? -9.007  -2.072  17.846  1.00 48.22 21 A 1 
ATOM 172 S SD  . MET A 1 21 ? -8.803  -3.476  18.959  1.00 44.06 21 A 1 
ATOM 173 C CE  . MET A 1 21 ? -9.533  -4.768  17.955  1.00 41.47 21 A 1 
ATOM 174 N N   . LEU A 1 22 ? -6.832  2.093   17.863  1.00 51.02 22 A 1 
ATOM 175 C CA  . LEU A 1 22 ? -6.229  3.274   18.469  1.00 50.13 22 A 1 
ATOM 176 C C   . LEU A 1 22 ? -6.677  4.544   17.736  1.00 49.18 22 A 1 
ATOM 177 O O   . LEU A 1 22 ? -6.913  4.511   16.528  1.00 46.21 22 A 1 
ATOM 178 C CB  . LEU A 1 22 ? -4.701  3.161   18.438  1.00 46.91 22 A 1 
ATOM 179 C CG  . LEU A 1 22 ? -4.129  1.981   19.233  1.00 44.54 22 A 1 
ATOM 180 C CD1 . LEU A 1 22 ? -2.626  1.873   19.023  1.00 41.41 22 A 1 
ATOM 181 C CD2 . LEU A 1 22 ? -4.443  2.137   20.719  1.00 41.61 22 A 1 
ATOM 182 N N   . PRO A 1 23 ? -6.793  5.669   18.454  1.00 50.94 23 A 1 
ATOM 183 C CA  . PRO A 1 23 ? -7.197  6.934   17.825  1.00 50.90 23 A 1 
ATOM 184 C C   . PRO A 1 23 ? -6.110  7.536   16.939  1.00 51.38 23 A 1 
ATOM 185 O O   . PRO A 1 23 ? -6.399  8.389   16.094  1.00 48.07 23 A 1 
ATOM 186 C CB  . PRO A 1 23 ? -7.495  7.851   19.019  1.00 47.46 23 A 1 
ATOM 187 C CG  . PRO A 1 23 ? -6.640  7.314   20.128  1.00 46.40 23 A 1 
ATOM 188 C CD  . PRO A 1 23 ? -6.594  5.824   19.909  1.00 48.24 23 A 1 
ATOM 189 N N   . ASP A 1 24 ? -4.862  7.092   17.122  1.00 54.05 24 A 1 
ATOM 190 C CA  . ASP A 1 24 ? -3.741  7.604   16.339  1.00 54.99 24 A 1 
ATOM 191 C C   . ASP A 1 24 ? -3.571  6.800   15.056  1.00 55.72 24 A 1 
ATOM 192 O O   . ASP A 1 24 ? -3.189  5.630   15.097  1.00 53.72 24 A 1 
ATOM 193 C CB  . ASP A 1 24 ? -2.457  7.559   17.167  1.00 52.91 24 A 1 
ATOM 194 C CG  . ASP A 1 24 ? -2.532  8.458   18.390  1.00 49.13 24 A 1 
ATOM 195 O OD1 . ASP A 1 24 ? -3.285  9.455   18.352  1.00 45.21 24 A 1 
ATOM 196 O OD2 . ASP A 1 24 ? -1.831  8.171   19.379  1.00 44.75 24 A 1 
ATOM 197 N N   . TRP A 1 25 ? -3.855  7.423   13.923  1.00 52.86 25 A 1 
ATOM 198 C CA  . TRP A 1 25 ? -3.707  6.788   12.617  1.00 53.14 25 A 1 
ATOM 199 C C   . TRP A 1 25 ? -2.344  7.100   11.993  1.00 53.63 25 A 1 
ATOM 200 O O   . TRP A 1 25 ? -1.984  6.505   10.977  1.00 52.42 25 A 1 
ATOM 201 C CB  . TRP A 1 25 ? -4.821  7.244   11.678  1.00 51.60 25 A 1 
ATOM 202 C CG  . TRP A 1 25 ? -4.766  8.708   11.336  1.00 50.68 25 A 1 
ATOM 203 C CD1 . TRP A 1 25 ? -4.208  9.255   10.220  1.00 46.07 25 A 1 
ATOM 204 C CD2 . TRP A 1 25 ? -5.275  9.810   12.109  1.00 46.14 25 A 1 
ATOM 205 N NE1 . TRP A 1 25 ? -4.339  10.627  10.251  1.00 44.77 25 A 1 
ATOM 206 C CE2 . TRP A 1 25 ? -4.990  10.995  11.397  1.00 44.72 25 A 1 
ATOM 207 C CE3 . TRP A 1 25 ? -5.953  9.902   13.326  1.00 45.24 25 A 1 
ATOM 208 C CZ2 . TRP A 1 25 ? -5.360  12.261  11.877  1.00 44.82 25 A 1 
ATOM 209 C CZ3 . TRP A 1 25 ? -6.317  11.173  13.807  1.00 44.41 25 A 1 
ATOM 210 C CH2 . TRP A 1 25 ? -6.018  12.331  13.079  1.00 42.59 25 A 1 
ATOM 211 N N   . LYS A 1 26 ? -1.596  8.013   12.581  1.00 55.00 26 A 1 
ATOM 212 C CA  . LYS A 1 26 ? -0.278  8.393   12.060  1.00 55.33 26 A 1 
ATOM 213 C C   . LYS A 1 26 ? 0.710   7.233   12.161  1.00 54.84 26 A 1 
ATOM 214 O O   . LYS A 1 26 ? 1.482   6.991   11.232  1.00 54.70 26 A 1 
ATOM 215 C CB  . LYS A 1 26 ? 0.256   9.613   12.823  1.00 55.79 26 A 1 
ATOM 216 C CG  . LYS A 1 26 ? -0.563  10.879  12.570  1.00 53.53 26 A 1 
ATOM 217 C CD  . LYS A 1 26 ? 0.005   12.070  13.322  1.00 50.31 26 A 1 
ATOM 218 C CE  . LYS A 1 26 ? -0.823  13.324  13.075  1.00 47.17 26 A 1 
ATOM 219 N NZ  . LYS A 1 26 ? -0.281  14.500  13.810  1.00 43.81 26 A 1 
ATOM 220 N N   . SER A 1 27 ? 0.682   6.508   13.279  1.00 57.53 27 A 1 
ATOM 221 C CA  . SER A 1 27 ? 1.570   5.362   13.469  1.00 57.45 27 A 1 
ATOM 222 C C   . SER A 1 27 ? 1.277   4.256   12.453  1.00 58.16 27 A 1 
ATOM 223 O O   . SER A 1 27 ? 2.189   3.549   12.017  1.00 56.89 27 A 1 
ATOM 224 C CB  . SER A 1 27 ? 1.426   4.817   14.889  1.00 56.38 27 A 1 
ATOM 225 O OG  . SER A 1 27 ? 0.103   4.415   15.148  1.00 51.71 27 A 1 
ATOM 226 N N   . SER A 1 28 ? 0.015   4.115   12.061  1.00 57.50 28 A 1 
ATOM 227 C CA  . SER A 1 28 ? -0.371  3.105   11.076  1.00 57.38 28 A 1 
ATOM 228 C C   . SER A 1 28 ? 0.198   3.428   9.693   1.00 58.26 28 A 1 
ATOM 229 O O   . SER A 1 28 ? 0.576   2.525   8.947   1.00 57.41 28 A 1 
ATOM 230 C CB  . SER A 1 28 ? -1.895  2.988   11.001  1.00 55.98 28 A 1 
ATOM 231 O OG  . SER A 1 28 ? -2.474  4.148   10.439  1.00 50.95 28 A 1 
ATOM 232 N N   . LEU A 1 29 ? 0.276   4.713   9.358   1.00 56.61 29 A 1 
ATOM 233 C CA  . LEU A 1 29 ? 0.819   5.140   8.066   1.00 56.67 29 A 1 
ATOM 234 C C   . LEU A 1 29 ? 2.291   4.754   7.929   1.00 57.21 29 A 1 
ATOM 235 O O   . LEU A 1 29 ? 2.739   4.366   6.846   1.00 57.56 29 A 1 
ATOM 236 C CB  . LEU A 1 29 ? 0.656   6.655   7.909   1.00 55.61 29 A 1 
ATOM 237 C CG  . LEU A 1 29 ? -0.788  7.126   7.691   1.00 51.88 29 A 1 
ATOM 238 C CD1 . LEU A 1 29 ? -0.881  8.641   7.805   1.00 47.36 29 A 1 
ATOM 239 C CD2 . LEU A 1 29 ? -1.292  6.666   6.327   1.00 47.14 29 A 1 
ATOM 240 N N   . ILE A 1 30 ? 3.045   4.848   9.016   1.00 59.22 30 A 1 
ATOM 241 C CA  . ILE A 1 30 ? 4.468   4.495   9.004   1.00 60.08 30 A 1 
ATOM 242 C C   . ILE A 1 30 ? 4.641   3.002   8.718   1.00 60.17 30 A 1 
ATOM 243 O O   . ILE A 1 30 ? 5.499   2.610   7.919   1.00 59.71 30 A 1 
ATOM 244 C CB  . ILE A 1 30 ? 5.130   4.875   10.342  1.00 59.71 30 A 1 
ATOM 245 C CG1 . ILE A 1 30 ? 5.061   6.392   10.556  1.00 56.77 30 A 1 
ATOM 246 C CG2 . ILE A 1 30 ? 6.589   4.405   10.364  1.00 53.99 30 A 1 
ATOM 247 C CD1 . ILE A 1 30 ? 5.450   6.820   11.961  1.00 52.49 30 A 1 
ATOM 248 N N   . LEU A 1 31 ? 3.828   2.165   9.356   1.00 60.52 31 A 1 
ATOM 249 C CA  . LEU A 1 31 ? 3.904   0.719   9.148   1.00 60.56 31 A 1 
ATOM 250 C C   . LEU A 1 31 ? 3.453   0.329   7.741   1.00 60.61 31 A 1 
ATOM 251 O O   . LEU A 1 31 ? 4.023   -0.581  7.133   1.00 60.09 31 A 1 
ATOM 252 C CB  . LEU A 1 31 ? 3.054   -0.001  10.199  1.00 59.95 31 A 1 
ATOM 253 C CG  . LEU A 1 31 ? 3.634   0.038   11.616  1.00 56.28 31 A 1 
ATOM 254 C CD1 . LEU A 1 31 ? 2.634   -0.521  12.618  1.00 51.93 31 A 1 
ATOM 255 C CD2 . LEU A 1 31 ? 4.938   -0.752  11.682  1.00 53.52 31 A 1 
ATOM 256 N N   . MET A 1 32 ? 2.434   1.013   7.215   1.00 63.14 32 A 1 
ATOM 257 C CA  . MET A 1 32 ? 1.939   0.732   5.866   1.00 62.67 32 A 1 
ATOM 258 C C   . MET A 1 32 ? 3.027   0.967   4.824   1.00 62.29 32 A 1 
ATOM 259 O O   . MET A 1 32 ? 3.191   0.172   3.896   1.00 61.81 32 A 1 
ATOM 260 C CB  . MET A 1 32 ? 0.721   1.611   5.557   1.00 60.98 32 A 1 
ATOM 261 C CG  . MET A 1 32 ? -0.538  1.169   6.300   1.00 56.36 32 A 1 
ATOM 262 S SD  . MET A 1 32 ? -1.166  -0.404  5.721   1.00 50.39 32 A 1 
ATOM 263 C CE  . MET A 1 32 ? -2.686  -0.497  6.684   1.00 48.56 32 A 1 
ATOM 264 N N   . ALA A 1 33 ? 3.781   2.055   4.980   1.00 62.07 33 A 1 
ATOM 265 C CA  . ALA A 1 33 ? 4.861   2.370   4.047   1.00 61.51 33 A 1 
ATOM 266 C C   . ALA A 1 33 ? 5.953   1.300   4.092   1.00 61.33 33 A 1 
ATOM 267 O O   . ALA A 1 33 ? 6.505   0.924   3.054   1.00 60.12 33 A 1 
ATOM 268 C CB  . ALA A 1 33 ? 5.448   3.743   4.373   1.00 60.22 33 A 1 
ATOM 269 N N   . TYR A 1 34 ? 6.263   0.800   5.289   1.00 59.15 34 A 1 
ATOM 270 C CA  . TYR A 1 34 ? 7.278   -0.242  5.446   1.00 60.17 34 A 1 
ATOM 271 C C   . TYR A 1 34 ? 6.848   -1.544  4.765   1.00 60.54 34 A 1 
ATOM 272 O O   . TYR A 1 34 ? 7.666   -2.226  4.137   1.00 61.39 34 A 1 
ATOM 273 C CB  . TYR A 1 34 ? 7.544   -0.486  6.932   1.00 59.79 34 A 1 
ATOM 274 C CG  . TYR A 1 34 ? 8.594   -1.542  7.164   1.00 56.88 34 A 1 
ATOM 275 C CD1 . TYR A 1 34 ? 9.950   -1.248  7.027   1.00 51.45 34 A 1 
ATOM 276 C CD2 . TYR A 1 34 ? 8.231   -2.844  7.509   1.00 51.33 34 A 1 
ATOM 277 C CE1 . TYR A 1 34 ? 10.913  -2.221  7.236   1.00 48.10 34 A 1 
ATOM 278 C CE2 . TYR A 1 34 ? 9.191   -3.822  7.716   1.00 47.78 34 A 1 
ATOM 279 C CZ  . TYR A 1 34 ? 10.530  -3.505  7.581   1.00 49.07 34 A 1 
ATOM 280 O OH  . TYR A 1 34 ? 11.484  -4.476  7.791   1.00 46.91 34 A 1 
ATOM 281 N N   . ILE A 1 35 ? 5.571   -1.895  4.889   1.00 61.54 35 A 1 
ATOM 282 C CA  . ILE A 1 35 ? 5.045   -3.125  4.290   1.00 61.25 35 A 1 
ATOM 283 C C   . ILE A 1 35 ? 5.114   -3.066  2.762   1.00 59.95 35 A 1 
ATOM 284 O O   . ILE A 1 35 ? 5.459   -4.057  2.116   1.00 59.10 35 A 1 
ATOM 285 C CB  . ILE A 1 35 ? 3.598   -3.375  4.759   1.00 61.07 35 A 1 
ATOM 286 C CG1 . ILE A 1 35 ? 3.577   -3.669  6.263   1.00 58.70 35 A 1 
ATOM 287 C CG2 . ILE A 1 35 ? 2.976   -4.537  3.991   1.00 55.11 35 A 1 
ATOM 288 C CD1 . ILE A 1 35 ? 2.195   -3.560  6.875   1.00 53.52 35 A 1 
ATOM 289 N N   . ILE A 1 36 ? 4.786   -1.920  2.184   1.00 60.94 36 A 1 
ATOM 290 C CA  . ILE A 1 36 ? 4.817   -1.755  0.727   1.00 60.17 36 A 1 
ATOM 291 C C   . ILE A 1 36 ? 6.229   -2.001  0.190   1.00 59.06 36 A 1 
ATOM 292 O O   . ILE A 1 36 ? 6.409   -2.704  -0.807  1.00 57.77 36 A 1 
ATOM 293 C CB  . ILE A 1 36 ? 4.327   -0.348  0.329   1.00 59.50 36 A 1 
ATOM 294 C CG1 . ILE A 1 36 ? 2.850   -0.177  0.696   1.00 56.51 36 A 1 
ATOM 295 C CG2 . ILE A 1 36 ? 4.522   -0.115  -1.169  1.00 53.39 36 A 1 
ATOM 296 C CD1 . ILE A 1 36 ? 2.386   1.262   0.636   1.00 51.73 36 A 1 
ATOM 297 N N   . ILE A 1 37 ? 7.232   -1.431  0.849   1.00 57.41 37 A 1 
ATOM 298 C CA  . ILE A 1 37 ? 8.626   -1.607  0.433   1.00 57.02 37 A 1 
ATOM 299 C C   . ILE A 1 37 ? 9.040   -3.075  0.565   1.00 56.24 37 A 1 
ATOM 300 O O   . ILE A 1 37 ? 9.722   -3.618  -0.312  1.00 54.50 37 A 1 
ATOM 301 C CB  . ILE A 1 37 ? 9.559   -0.701  1.264   1.00 56.44 37 A 1 
ATOM 302 C CG1 . ILE A 1 37 ? 9.227   0.775   1.017   1.00 53.51 37 A 1 
ATOM 303 C CG2 . ILE A 1 37 ? 11.024  -0.977  0.909   1.00 50.02 37 A 1 
ATOM 304 C CD1 . ILE A 1 37 ? 9.886   1.710   2.012   1.00 48.61 37 A 1 
ATOM 305 N N   . PHE A 1 38 ? 8.628   -3.730  1.649   1.00 56.62 38 A 1 
ATOM 306 C CA  . PHE A 1 38 ? 8.965   -5.133  1.874   1.00 56.47 38 A 1 
ATOM 307 C C   . PHE A 1 38 ? 8.334   -6.041  0.815   1.00 56.09 38 A 1 
ATOM 308 O O   . PHE A 1 38 ? 8.956   -7.009  0.367   1.00 54.89 38 A 1 
ATOM 309 C CB  . PHE A 1 38 ? 8.511   -5.558  3.271   1.00 55.14 38 A 1 
ATOM 310 C CG  . PHE A 1 38 ? 8.998   -6.931  3.652   1.00 51.90 38 A 1 
ATOM 311 C CD1 . PHE A 1 38 ? 10.304  -7.127  4.081   1.00 46.51 38 A 1 
ATOM 312 C CD2 . PHE A 1 38 ? 8.144   -8.026  3.573   1.00 46.80 38 A 1 
ATOM 313 C CE1 . PHE A 1 38 ? 10.752  -8.392  4.430   1.00 43.60 38 A 1 
ATOM 314 C CE2 . PHE A 1 38 ? 8.591   -9.297  3.919   1.00 43.30 38 A 1 
ATOM 315 C CZ  . PHE A 1 38 ? 9.893   -9.480  4.349   1.00 44.03 38 A 1 
ATOM 316 N N   . LEU A 1 39 ? 7.102   -5.733  0.413   1.00 56.54 39 A 1 
ATOM 317 C CA  . LEU A 1 39 ? 6.392   -6.534  -0.586  1.00 55.68 39 A 1 
ATOM 318 C C   . LEU A 1 39 ? 7.034   -6.427  -1.970  1.00 54.53 39 A 1 
ATOM 319 O O   . LEU A 1 39 ? 6.962   -7.369  -2.761  1.00 52.94 39 A 1 
ATOM 320 C CB  . LEU A 1 39 ? 4.921   -6.112  -0.661  1.00 54.72 39 A 1 
ATOM 321 C CG  . LEU A 1 39 ? 3.953   -7.033  0.101   1.00 52.61 39 A 1 
ATOM 322 C CD1 . LEU A 1 39 ? 4.270   -7.035  1.595   1.00 49.11 39 A 1 
ATOM 323 C CD2 . LEU A 1 39 ? 2.518   -6.592  -0.131  1.00 49.03 39 A 1 
ATOM 324 N N   . THR A 1 40 ? 7.662   -5.292  -2.265  1.00 53.99 40 A 1 
ATOM 325 C CA  . THR A 1 40 ? 8.305   -5.094  -3.566  1.00 52.10 40 A 1 
ATOM 326 C C   . THR A 1 40 ? 9.484   -6.045  -3.772  1.00 50.62 40 A 1 
ATOM 327 O O   . THR A 1 40 ? 9.894   -6.293  -4.909  1.00 47.92 40 A 1 
ATOM 328 C CB  . THR A 1 40 ? 8.799   -3.647  -3.726  1.00 49.55 40 A 1 
ATOM 329 O OG1 . THR A 1 40 ? 9.728   -3.327  -2.698  1.00 46.59 40 A 1 
ATOM 330 C CG2 . THR A 1 40 ? 7.631   -2.674  -3.679  1.00 45.03 40 A 1 
ATOM 331 N N   . MET A 1 41 ? 10.030  -6.571  -2.677  1.00 53.27 41 A 1 
ATOM 332 C CA  . MET A 1 41 ? 11.137  -7.525  -2.759  1.00 52.56 41 A 1 
ATOM 333 C C   . MET A 1 41 ? 10.659  -8.895  -3.240  1.00 50.82 41 A 1 
ATOM 334 O O   . MET A 1 41 ? 11.453  -9.693  -3.742  1.00 48.47 41 A 1 
ATOM 335 C CB  . MET A 1 41 ? 11.817  -7.662  -1.396  1.00 51.04 41 A 1 
ATOM 336 C CG  . MET A 1 41 ? 12.449  -6.367  -0.906  1.00 47.21 41 A 1 
ATOM 337 S SD  . MET A 1 41 ? 13.229  -6.559  0.707   1.00 43.47 41 A 1 
ATOM 338 C CE  . MET A 1 41 ? 13.783  -4.875  0.979   1.00 40.75 41 A 1 
ATOM 339 N N   . LEU A 1 42 ? 9.362   -9.166  -3.101  1.00 50.93 42 A 1 
ATOM 340 C CA  . LEU A 1 42 ? 8.776   -10.430 -3.535  1.00 50.47 42 A 1 
ATOM 341 C C   . LEU A 1 42 ? 8.426   -10.377 -5.026  1.00 49.68 42 A 1 
ATOM 342 O O   . LEU A 1 42 ? 8.129   -9.305  -5.556  1.00 46.73 42 A 1 
ATOM 343 C CB  . LEU A 1 42 ? 7.526   -10.735 -2.711  1.00 47.72 42 A 1 
ATOM 344 C CG  . LEU A 1 42 ? 7.774   -10.905 -1.209  1.00 45.59 42 A 1 
ATOM 345 C CD1 . LEU A 1 42 ? 6.457   -11.060 -0.464  1.00 42.59 42 A 1 
ATOM 346 C CD2 . LEU A 1 42 ? 8.673   -12.115 -0.952  1.00 42.77 42 A 1 
ATOM 347 N N   . PRO A 1 43 ? 8.442   -11.529 -5.714  1.00 51.60 43 A 1 
ATOM 348 C CA  . PRO A 1 43 ? 8.111   -11.562 -7.147  1.00 51.34 43 A 1 
ATOM 349 C C   . PRO A 1 43 ? 6.640   -11.268 -7.436  1.00 52.14 43 A 1 
ATOM 350 O O   . PRO A 1 43 ? 6.290   -10.928 -8.570  1.00 48.70 43 A 1 
ATOM 351 C CB  . PRO A 1 43 ? 8.473   -12.992 -7.562  1.00 47.97 43 A 1 
ATOM 352 C CG  . PRO A 1 43 ? 8.377   -13.793 -6.303  1.00 47.16 43 A 1 
ATOM 353 C CD  . PRO A 1 43 ? 8.806   -12.857 -5.203  1.00 48.52 43 A 1 
ATOM 354 N N   . ASP A 1 44 ? 5.779   -11.380 -6.420  1.00 54.77 44 A 1 
ATOM 355 C CA  . ASP A 1 44 ? 4.345   -11.143 -6.584  1.00 55.28 44 A 1 
ATOM 356 C C   . ASP A 1 44 ? 3.958   -9.690  -6.309  1.00 56.05 44 A 1 
ATOM 357 O O   . ASP A 1 44 ? 2.797   -9.397  -6.011  1.00 53.71 44 A 1 
ATOM 358 C CB  . ASP A 1 44 ? 3.559   -12.072 -5.659  1.00 53.19 44 A 1 
ATOM 359 C CG  . ASP A 1 44 ? 3.765   -13.534 -6.005  1.00 49.41 44 A 1 
ATOM 360 O OD1 . ASP A 1 44 ? 4.077   -13.833 -7.175  1.00 45.95 44 A 1 
ATOM 361 O OD2 . ASP A 1 44 ? 3.617   -14.383 -5.107  1.00 45.51 44 A 1 
ATOM 362 N N   . TRP A 1 45 ? 4.911   -8.776  -6.409  1.00 54.92 45 A 1 
ATOM 363 C CA  . TRP A 1 45 ? 4.642   -7.363  -6.150  1.00 54.93 45 A 1 
ATOM 364 C C   . TRP A 1 45 ? 3.678   -6.764  -7.177  1.00 55.15 45 A 1 
ATOM 365 O O   . TRP A 1 45 ? 2.934   -5.833  -6.864  1.00 53.62 45 A 1 
ATOM 366 C CB  . TRP A 1 45 ? 5.951   -6.569  -6.135  1.00 53.45 45 A 1 
ATOM 367 C CG  . TRP A 1 45 ? 6.673   -6.558  -7.454  1.00 52.78 45 A 1 
ATOM 368 C CD1 . TRP A 1 45 ? 7.606   -7.444  -7.875  1.00 47.93 45 A 1 
ATOM 369 C CD2 . TRP A 1 45 ? 6.514   -5.600  -8.520  1.00 48.69 45 A 1 
ATOM 370 N NE1 . TRP A 1 45 ? 8.038   -7.110  -9.140  1.00 47.11 45 A 1 
ATOM 371 C CE2 . TRP A 1 45 ? 7.386   -5.981  -9.560  1.00 47.39 45 A 1 
ATOM 372 C CE3 . TRP A 1 45 ? 5.727   -4.457  -8.680  1.00 47.95 45 A 1 
ATOM 373 C CZ2 . TRP A 1 45 ? 7.483   -5.259  -10.756 1.00 48.05 45 A 1 
ATOM 374 C CZ3 . TRP A 1 45 ? 5.823   -3.739  -9.881  1.00 47.05 45 A 1 
ATOM 375 C CH2 . TRP A 1 45 ? 6.695   -4.142  -10.900 1.00 45.48 45 A 1 
ATOM 376 N N   . LYS A 1 46 ? 3.669   -7.291  -8.389  1.00 54.98 46 A 1 
ATOM 377 C CA  . LYS A 1 46 ? 2.802   -6.770  -9.451  1.00 54.93 46 A 1 
ATOM 378 C C   . LYS A 1 46 ? 1.329   -6.989  -9.123  1.00 54.15 46 A 1 
ATOM 379 O O   . LYS A 1 46 ? 0.505   -6.093  -9.321  1.00 53.70 46 A 1 
ATOM 380 C CB  . LYS A 1 46 ? 3.153   -7.436  -10.787 1.00 55.43 46 A 1 
ATOM 381 C CG  . LYS A 1 46 ? 4.536   -7.050  -11.302 1.00 53.08 46 A 1 
ATOM 382 C CD  . LYS A 1 46 ? 4.840   -7.711  -12.635 1.00 50.14 46 A 1 
ATOM 383 C CE  . LYS A 1 46 ? 6.230   -7.339  -13.132 1.00 46.86 46 A 1 
ATOM 384 N NZ  . LYS A 1 46 ? 6.549   -7.996  -14.429 1.00 43.49 46 A 1 
ATOM 385 N N   . SER A 1 47 ? 0.991   -8.168  -8.613  1.00 54.55 47 A 1 
ATOM 386 C CA  . SER A 1 47 ? -0.394  -8.473  -8.251  1.00 54.33 47 A 1 
ATOM 387 C C   . SER A 1 47 ? -0.880  -7.581  -7.110  1.00 54.60 47 A 1 
ATOM 388 O O   . SER A 1 47 ? -2.058  -7.217  -7.061  1.00 53.24 47 A 1 
ATOM 389 C CB  . SER A 1 47 ? -0.521  -9.944  -7.853  1.00 53.68 47 A 1 
ATOM 390 O OG  . SER A 1 47 ? 0.284   -10.247 -6.732  1.00 49.26 47 A 1 
ATOM 391 N N   . SER A 1 48 ? 0.019   -7.212  -6.202  1.00 58.29 48 A 1 
ATOM 392 C CA  . SER A 1 48 ? -0.338  -6.343  -5.085  1.00 58.04 48 A 1 
ATOM 393 C C   . SER A 1 48 ? -0.701  -4.936  -5.560  1.00 58.49 48 A 1 
ATOM 394 O O   . SER A 1 48 ? -1.608  -4.309  -5.014  1.00 57.07 48 A 1 
ATOM 395 C CB  . SER A 1 48 ? 0.812   -6.281  -4.074  1.00 56.36 48 A 1 
ATOM 396 O OG  . SER A 1 48 ? 1.913   -5.561  -4.589  1.00 51.48 48 A 1 
ATOM 397 N N   . LEU A 1 49 ? -0.013  -4.447  -6.587  1.00 55.56 49 A 1 
ATOM 398 C CA  . LEU A 1 49 ? -0.288  -3.116  -7.134  1.00 55.44 49 A 1 
ATOM 399 C C   . LEU A 1 49 ? -1.687  -3.051  -7.745  1.00 55.81 49 A 1 
ATOM 400 O O   . LEU A 1 49 ? -2.384  -2.039  -7.618  1.00 55.64 49 A 1 
ATOM 401 C CB  . LEU A 1 49 ? 0.768   -2.756  -8.184  1.00 54.08 49 A 1 
ATOM 402 C CG  . LEU A 1 49 ? 2.160   -2.457  -7.618  1.00 50.26 49 A 1 
ATOM 403 C CD1 . LEU A 1 49 ? 3.182   -2.356  -8.743  1.00 46.09 49 A 1 
ATOM 404 C CD2 . LEU A 1 49 ? 2.146   -1.165  -6.812  1.00 46.12 49 A 1 
ATOM 405 N N   . ILE A 1 50 ? -2.112  -4.124  -8.397  1.00 56.78 50 A 1 
ATOM 406 C CA  . ILE A 1 50 ? -3.442  -4.182  -9.008  1.00 57.67 50 A 1 
ATOM 407 C C   . ILE A 1 50 ? -4.527  -4.134  -7.928  1.00 57.36 50 A 1 
ATOM 408 O O   . ILE A 1 50 ? -5.533  -3.431  -8.077  1.00 56.79 50 A 1 
ATOM 409 C CB  . ILE A 1 50 ? -3.587  -5.452  -9.867  1.00 57.52 50 A 1 
ATOM 410 C CG1 . ILE A 1 50 ? -2.578  -5.427  -11.021 1.00 54.59 50 A 1 
ATOM 411 C CG2 . ILE A 1 50 ? -5.014  -5.564  -10.415 1.00 52.11 50 A 1 
ATOM 412 C CD1 . ILE A 1 50 ? -2.458  -6.755  -11.745 1.00 50.61 50 A 1 
ATOM 413 N N   . LEU A 1 51 ? -4.324  -4.870  -6.839  1.00 58.71 51 A 1 
ATOM 414 C CA  . LEU A 1 51 ? -5.290  -4.885  -5.741  1.00 58.88 51 A 1 
ATOM 415 C C   . LEU A 1 51 ? -5.357  -3.531  -5.034  1.00 58.80 51 A 1 
ATOM 416 O O   . LEU A 1 51 ? -6.434  -3.097  -4.613  1.00 58.13 51 A 1 
ATOM 417 C CB  . LEU A 1 51 ? -4.922  -5.985  -4.741  1.00 58.11 51 A 1 
ATOM 418 C CG  . LEU A 1 51 ? -5.150  -7.408  -5.256  1.00 53.81 51 A 1 
ATOM 419 C CD1 . LEU A 1 51 ? -4.547  -8.425  -4.294  1.00 49.79 51 A 1 
ATOM 420 C CD2 . LEU A 1 51 ? -6.642  -7.679  -5.440  1.00 51.02 51 A 1 
ATOM 421 N N   . MET A 1 52 ? -4.220  -2.859  -4.899  1.00 62.30 52 A 1 
ATOM 422 C CA  . MET A 1 52 ? -4.177  -1.541  -4.270  1.00 62.48 52 A 1 
ATOM 423 C C   . MET A 1 52 ? -5.027  -0.537  -5.052  1.00 62.28 52 A 1 
ATOM 424 O O   . MET A 1 52 ? -5.741  0.274   -4.460  1.00 62.18 52 A 1 
ATOM 425 C CB  . MET A 1 52 ? -2.728  -1.044  -4.183  1.00 60.80 52 A 1 
ATOM 426 C CG  . MET A 1 52 ? -1.895  -1.796  -3.151  1.00 56.43 52 A 1 
ATOM 427 S SD  . MET A 1 52 ? -2.372  -1.440  -1.467  1.00 50.42 52 A 1 
ATOM 428 C CE  . MET A 1 52 ? -1.105  -2.362  -0.576  1.00 48.23 52 A 1 
ATOM 429 N N   . ALA A 1 53 ? -4.962  -0.597  -6.379  1.00 61.44 53 A 1 
ATOM 430 C CA  . ALA A 1 53 ? -5.753  0.292   -7.227  1.00 61.34 53 A 1 
ATOM 431 C C   . ALA A 1 53 ? -7.250  0.025   -7.061  1.00 60.83 53 A 1 
ATOM 432 O O   . ALA A 1 53 ? -8.060  0.956   -7.093  1.00 59.83 53 A 1 
ATOM 433 C CB  . ALA A 1 53 ? -5.341  0.120   -8.689  1.00 60.63 53 A 1 
ATOM 434 N N   . TYR A 1 54 ? -7.622  -1.242  -6.878  1.00 58.25 54 A 1 
ATOM 435 C CA  . TYR A 1 54 ? -9.027  -1.616  -6.688  1.00 59.20 54 A 1 
ATOM 436 C C   . TYR A 1 54 ? -9.605  -0.999  -5.413  1.00 59.40 54 A 1 
ATOM 437 O O   . TYR A 1 54 ? -10.770 -0.589  -5.388  1.00 60.32 54 A 1 
ATOM 438 C CB  . TYR A 1 54 ? -9.159  -3.138  -6.638  1.00 58.40 54 A 1 
ATOM 439 C CG  . TYR A 1 54 ? -10.591 -3.590  -6.500  1.00 54.67 54 A 1 
ATOM 440 C CD1 . TYR A 1 54 ? -11.447 -3.618  -7.601  1.00 49.29 54 A 1 
ATOM 441 C CD2 . TYR A 1 54 ? -11.096 -3.980  -5.262  1.00 49.10 54 A 1 
ATOM 442 C CE1 . TYR A 1 54 ? -12.763 -4.032  -7.474  1.00 45.99 54 A 1 
ATOM 443 C CE2 . TYR A 1 54 ? -12.416 -4.392  -5.125  1.00 45.73 54 A 1 
ATOM 444 C CZ  . TYR A 1 54 ? -13.244 -4.418  -6.233  1.00 47.42 54 A 1 
ATOM 445 O OH  . TYR A 1 54 ? -14.549 -4.830  -6.099  1.00 45.04 54 A 1 
ATOM 446 N N   . ILE A 1 55 ? -8.809  -0.932  -4.355  1.00 58.39 55 A 1 
ATOM 447 C CA  . ILE A 1 55 ? -9.251  -0.355  -3.082  1.00 58.25 55 A 1 
ATOM 448 C C   . ILE A 1 55 ? -9.604  1.126   -3.248  1.00 57.23 55 A 1 
ATOM 449 O O   . ILE A 1 55 ? -10.583 1.609   -2.677  1.00 56.66 55 A 1 
ATOM 450 C CB  . ILE A 1 55 ? -8.160  -0.530  -2.003  1.00 57.48 55 A 1 
ATOM 451 C CG1 . ILE A 1 55 ? -7.952  -2.017  -1.705  1.00 54.89 55 A 1 
ATOM 452 C CG2 . ILE A 1 55 ? -8.536  0.214   -0.724  1.00 51.29 55 A 1 
ATOM 453 C CD1 . ILE A 1 55 ? -6.726  -2.290  -0.858  1.00 49.98 55 A 1 
ATOM 454 N N   . ILE A 1 56 ? -8.816  1.847   -4.027  1.00 55.81 56 A 1 
ATOM 455 C CA  . ILE A 1 56 ? -9.057  3.275   -4.261  1.00 55.76 56 A 1 
ATOM 456 C C   . ILE A 1 56 ? -10.418 3.482   -4.930  1.00 54.94 56 A 1 
ATOM 457 O O   . ILE A 1 56 ? -11.189 4.361   -4.535  1.00 54.30 56 A 1 
ATOM 458 C CB  . ILE A 1 56 ? -7.931  3.878   -5.125  1.00 55.34 56 A 1 
ATOM 459 C CG1 . ILE A 1 56 ? -6.585  3.757   -4.400  1.00 52.74 56 A 1 
ATOM 460 C CG2 . ILE A 1 56 ? -8.226  5.344   -5.444  1.00 50.42 56 A 1 
ATOM 461 C CD1 . ILE A 1 56 ? -5.402  4.048   -5.298  1.00 49.09 56 A 1 
ATOM 462 N N   . ILE A 1 57 ? -10.723 2.673   -5.939  1.00 56.06 57 A 1 
ATOM 463 C CA  . ILE A 1 57 ? -12.005 2.765   -6.644  1.00 56.32 57 A 1 
ATOM 464 C C   . ILE A 1 57 ? -13.159 2.390   -5.708  1.00 55.03 57 A 1 
ATOM 465 O O   . ILE A 1 57 ? -14.235 2.997   -5.757  1.00 53.91 57 A 1 
ATOM 466 C CB  . ILE A 1 57 ? -12.000 1.862   -7.893  1.00 56.34 57 A 1 
ATOM 467 C CG1 . ILE A 1 57 ? -10.895 2.300   -8.863  1.00 54.63 57 A 1 
ATOM 468 C CG2 . ILE A 1 57 ? -13.360 1.908   -8.595  1.00 52.47 57 A 1 
ATOM 469 C CD1 . ILE A 1 57 ? -10.637 1.295   -9.971  1.00 51.37 57 A 1 
ATOM 470 N N   . PHE A 1 58 ? -12.935 1.399   -4.848  1.00 52.39 58 A 1 
ATOM 471 C CA  . PHE A 1 58 ? -13.960 0.944   -3.904  1.00 52.69 58 A 1 
ATOM 472 C C   . PHE A 1 58 ? -14.374 2.053   -2.938  1.00 51.57 58 A 1 
ATOM 473 O O   . PHE A 1 58 ? -15.549 2.164   -2.574  1.00 51.15 58 A 1 
ATOM 474 C CB  . PHE A 1 58 ? -13.446 -0.264  -3.121  1.00 52.13 58 A 1 
ATOM 475 C CG  . PHE A 1 58 ? -14.463 -0.831  -2.169  1.00 49.20 58 A 1 
ATOM 476 C CD1 . PHE A 1 58 ? -15.496 -1.640  -2.631  1.00 44.77 58 A 1 
ATOM 477 C CD2 . PHE A 1 58 ? -14.390 -0.554  -0.809  1.00 45.75 58 A 1 
ATOM 478 C CE1 . PHE A 1 58 ? -16.436 -2.164  -1.755  1.00 43.65 58 A 1 
ATOM 479 C CE2 . PHE A 1 58 ? -15.335 -1.076  0.076   1.00 43.02 58 A 1 
ATOM 480 C CZ  . PHE A 1 58 ? -16.354 -1.881  -0.399  1.00 44.21 58 A 1 
ATOM 481 N N   . LEU A 1 59 ? -13.420 2.873   -2.517  1.00 52.07 59 A 1 
ATOM 482 C CA  . LEU A 1 59 ? -13.697 3.953   -1.571  1.00 52.06 59 A 1 
ATOM 483 C C   . LEU A 1 59 ? -14.192 5.222   -2.264  1.00 50.86 59 A 1 
ATOM 484 O O   . LEU A 1 59 ? -14.579 6.185   -1.594  1.00 49.40 59 A 1 
ATOM 485 C CB  . LEU A 1 59 ? -12.435 4.253   -0.754  1.00 50.77 59 A 1 
ATOM 486 C CG  . LEU A 1 59 ? -12.009 3.110   0.173   1.00 47.84 59 A 1 
ATOM 487 C CD1 . LEU A 1 59 ? -10.636 3.395   0.773   1.00 43.82 59 A 1 
ATOM 488 C CD2 . LEU A 1 59 ? -13.039 2.904   1.280   1.00 44.88 59 A 1 
ATOM 489 N N   . THR A 1 60 ? -14.178 5.246   -3.598  1.00 54.11 60 A 1 
ATOM 490 C CA  . THR A 1 60 ? -14.625 6.415   -4.367  1.00 52.84 60 A 1 
ATOM 491 C C   . THR A 1 60 ? -16.141 6.367   -4.542  1.00 49.80 60 A 1 
ATOM 492 O O   . THR A 1 60 ? -16.834 7.300   -4.098  1.00 47.23 60 A 1 
ATOM 493 C CB  . THR A 1 60 ? -13.934 6.468   -5.739  1.00 49.10 60 A 1 
ATOM 494 O OG1 . THR A 1 60 ? -12.525 6.406   -5.566  1.00 45.33 60 A 1 
ATOM 495 C CG2 . THR A 1 60 ? -14.291 7.764   -6.450  1.00 43.76 60 A 1 
ATOM 496 O OXT . THR A 1 60 ? -16.637 5.424   -5.131  1.00 44.70 60 A 1 
ATOM 497 N N   . MET B 2 1  ? -14.962 19.836  1.797   1.00 46.51 1  B 1 
ATOM 498 C CA  . MET B 2 1  ? -13.996 20.914  1.526   1.00 52.40 1  B 1 
ATOM 499 C C   . MET B 2 1  ? -13.338 20.746  0.153   1.00 54.09 1  B 1 
ATOM 500 O O   . MET B 2 1  ? -12.987 21.725  -0.499  1.00 52.06 1  B 1 
ATOM 501 C CB  . MET B 2 1  ? -12.915 20.960  2.612   1.00 50.73 1  B 1 
ATOM 502 C CG  . MET B 2 1  ? -12.015 22.180  2.527   1.00 46.50 1  B 1 
ATOM 503 S SD  . MET B 2 1  ? -10.979 22.405  3.993   1.00 41.00 1  B 1 
ATOM 504 C CE  . MET B 2 1  ? -9.853  21.016  3.796   1.00 36.97 1  B 1 
ATOM 505 N N   . LEU B 2 2  ? -13.182 19.497  -0.292  1.00 49.40 2  B 1 
ATOM 506 C CA  . LEU B 2 2  ? -12.622 19.199  -1.610  1.00 50.44 2  B 1 
ATOM 507 C C   . LEU B 2 2  ? -13.684 18.514  -2.475  1.00 50.29 2  B 1 
ATOM 508 O O   . LEU B 2 2  ? -13.872 17.299  -2.382  1.00 47.91 2  B 1 
ATOM 509 C CB  . LEU B 2 2  ? -11.390 18.305  -1.471  1.00 49.40 2  B 1 
ATOM 510 C CG  . LEU B 2 2  ? -10.226 18.919  -0.681  1.00 46.23 2  B 1 
ATOM 511 C CD1 . LEU B 2 2  ? -9.140  17.877  -0.439  1.00 42.93 2  B 1 
ATOM 512 C CD2 . LEU B 2 2  ? -9.652  20.119  -1.430  1.00 42.34 2  B 1 
ATOM 513 N N   . PRO B 2 3  ? -14.405 19.285  -3.309  1.00 45.42 3  B 1 
ATOM 514 C CA  . PRO B 2 3  ? -15.473 18.701  -4.140  1.00 47.48 3  B 1 
ATOM 515 C C   . PRO B 2 3  ? -14.947 17.791  -5.248  1.00 49.83 3  B 1 
ATOM 516 O O   . PRO B 2 3  ? -15.652 16.883  -5.697  1.00 46.38 3  B 1 
ATOM 517 C CB  . PRO B 2 3  ? -16.177 19.933  -4.725  1.00 44.32 3  B 1 
ATOM 518 C CG  . PRO B 2 3  ? -15.130 21.005  -4.741  1.00 42.53 3  B 1 
ATOM 519 C CD  . PRO B 2 3  ? -14.263 20.743  -3.538  1.00 44.50 3  B 1 
ATOM 520 N N   . ASP B 2 4  ? -13.715 18.016  -5.691  1.00 53.83 4  B 1 
ATOM 521 C CA  . ASP B 2 4  ? -13.122 17.240  -6.779  1.00 56.66 4  B 1 
ATOM 522 C C   . ASP B 2 4  ? -12.278 16.070  -6.272  1.00 57.12 4  B 1 
ATOM 523 O O   . ASP B 2 4  ? -11.467 15.512  -7.017  1.00 55.39 4  B 1 
ATOM 524 C CB  . ASP B 2 4  ? -12.266 18.153  -7.662  1.00 54.83 4  B 1 
ATOM 525 C CG  . ASP B 2 4  ? -13.086 19.233  -8.350  1.00 49.51 4  B 1 
ATOM 526 O OD1 . ASP B 2 4  ? -14.292 19.010  -8.578  1.00 45.36 4  B 1 
ATOM 527 O OD2 . ASP B 2 4  ? -12.525 20.300  -8.661  1.00 44.18 4  B 1 
ATOM 528 N N   . TRP B 2 5  ? -12.464 15.687  -5.006  1.00 52.16 5  B 1 
ATOM 529 C CA  . TRP B 2 5  ? -11.673 14.596  -4.441  1.00 53.21 5  B 1 
ATOM 530 C C   . TRP B 2 5  ? -12.025 13.250  -5.081  1.00 53.55 5  B 1 
ATOM 531 O O   . TRP B 2 5  ? -11.158 12.381  -5.216  1.00 51.90 5  B 1 
ATOM 532 C CB  . TRP B 2 5  ? -11.861 14.527  -2.922  1.00 52.21 5  B 1 
ATOM 533 C CG  . TRP B 2 5  ? -13.251 14.161  -2.491  1.00 50.07 5  B 1 
ATOM 534 C CD1 . TRP B 2 5  ? -14.279 15.010  -2.244  1.00 44.99 5  B 1 
ATOM 535 C CD2 . TRP B 2 5  ? -13.753 12.831  -2.249  1.00 45.79 5  B 1 
ATOM 536 N NE1 . TRP B 2 5  ? -15.399 14.300  -1.870  1.00 44.68 5  B 1 
ATOM 537 C CE2 . TRP B 2 5  ? -15.100 12.962  -1.865  1.00 45.52 5  B 1 
ATOM 538 C CE3 . TRP B 2 5  ? -13.183 11.562  -2.312  1.00 46.16 5  B 1 
ATOM 539 C CZ2 . TRP B 2 5  ? -15.896 11.855  -1.554  1.00 46.90 5  B 1 
ATOM 540 C CZ3 . TRP B 2 5  ? -13.978 10.455  -2.006  1.00 44.40 5  B 1 
ATOM 541 C CH2 . TRP B 2 5  ? -15.319 10.611  -1.630  1.00 42.77 5  B 1 
ATOM 542 N N   . LYS B 2 6  ? -13.278 13.070  -5.486  1.00 58.17 6  B 1 
ATOM 543 C CA  . LYS B 2 6  ? -13.715 11.807  -6.084  1.00 58.59 6  B 1 
ATOM 544 C C   . LYS B 2 6  ? -13.051 11.574  -7.438  1.00 57.52 6  B 1 
ATOM 545 O O   . LYS B 2 6  ? -12.520 10.493  -7.701  1.00 57.78 6  B 1 
ATOM 546 C CB  . LYS B 2 6  ? -15.241 11.795  -6.237  1.00 58.98 6  B 1 
ATOM 547 C CG  . LYS B 2 6  ? -15.970 11.755  -4.898  1.00 55.82 6  B 1 
ATOM 548 C CD  . LYS B 2 6  ? -17.478 11.703  -5.091  1.00 52.05 6  B 1 
ATOM 549 C CE  . LYS B 2 6  ? -18.201 11.675  -3.755  1.00 48.31 6  B 1 
ATOM 550 N NZ  . LYS B 2 6  ? -19.679 11.646  -3.929  1.00 45.48 6  B 1 
ATOM 551 N N   . SER B 2 7  ? -13.069 12.594  -8.289  1.00 57.88 7  B 1 
ATOM 552 C CA  . SER B 2 7  ? -12.460 12.480  -9.614  1.00 58.51 7  B 1 
ATOM 553 C C   . SER B 2 7  ? -10.946 12.295  -9.515  1.00 58.95 7  B 1 
ATOM 554 O O   . SER B 2 7  ? -10.346 11.597  -10.336 1.00 57.82 7  B 1 
ATOM 555 C CB  . SER B 2 7  ? -12.782 13.720  -10.450 1.00 57.90 7  B 1 
ATOM 556 O OG  . SER B 2 7  ? -12.283 14.894  -9.843  1.00 52.80 7  B 1 
ATOM 557 N N   . SER B 2 8  ? -10.335 12.898  -8.506  1.00 58.51 8  B 1 
ATOM 558 C CA  . SER B 2 8  ? -8.890  12.778  -8.317  1.00 59.04 8  B 1 
ATOM 559 C C   . SER B 2 8  ? -8.492  11.354  -7.925  1.00 59.56 8  B 1 
ATOM 560 O O   . SER B 2 8  ? -7.454  10.854  -8.366  1.00 59.06 8  B 1 
ATOM 561 C CB  . SER B 2 8  ? -8.409  13.774  -7.257  1.00 57.67 8  B 1 
ATOM 562 O OG  . SER B 2 8  ? -8.875  13.431  -5.972  1.00 52.00 8  B 1 
ATOM 563 N N   . LEU B 2 9  ? -9.320  10.693  -7.118  1.00 56.33 9  B 1 
ATOM 564 C CA  . LEU B 2 9  ? -9.041  9.317   -6.701  1.00 56.83 9  B 1 
ATOM 565 C C   . LEU B 2 9  ? -9.098  8.360   -7.890  1.00 56.98 9  B 1 
ATOM 566 O O   . LEU B 2 9  ? -8.283  7.436   -7.994  1.00 57.78 9  B 1 
ATOM 567 C CB  . LEU B 2 9  ? -10.044 8.886   -5.626  1.00 56.24 9  B 1 
ATOM 568 C CG  . LEU B 2 9  ? -9.819  9.514   -4.248  1.00 52.42 9  B 1 
ATOM 569 C CD1 . LEU B 2 9  ? -10.998 9.219   -3.332  1.00 47.42 9  B 1 
ATOM 570 C CD2 . LEU B 2 9  ? -8.528  8.993   -3.625  1.00 48.57 9  B 1 
ATOM 571 N N   . ILE B 2 10 ? -10.051 8.580   -8.793  1.00 60.21 10 B 1 
ATOM 572 C CA  . ILE B 2 10 ? -10.179 7.748   -9.992  1.00 61.38 10 B 1 
ATOM 573 C C   . ILE B 2 10 ? -8.945  7.913   -10.882 1.00 61.31 10 B 1 
ATOM 574 O O   . ILE B 2 10 ? -8.415  6.934   -11.420 1.00 61.13 10 B 1 
ATOM 575 C CB  . ILE B 2 10 ? -11.459 8.115   -10.770 1.00 61.09 10 B 1 
ATOM 576 C CG1 . ILE B 2 10 ? -12.702 7.822   -9.923  1.00 58.90 10 B 1 
ATOM 577 C CG2 . ILE B 2 10 ? -11.521 7.333   -12.086 1.00 56.09 10 B 1 
ATOM 578 C CD1 . ILE B 2 10 ? -13.974 8.419   -10.496 1.00 54.13 10 B 1 
ATOM 579 N N   . LEU B 2 11 ? -8.481  9.142   -11.025 1.00 59.37 11 B 1 
ATOM 580 C CA  . LEU B 2 11 ? -7.300  9.425   -11.840 1.00 59.41 11 B 1 
ATOM 581 C C   . LEU B 2 11 ? -6.048  8.788   -11.232 1.00 59.31 11 B 1 
ATOM 582 O O   . LEU B 2 11 ? -5.194  8.266   -11.958 1.00 59.32 11 B 1 
ATOM 583 C CB  . LEU B 2 11 ? -7.109  10.937  -11.982 1.00 58.71 11 B 1 
ATOM 584 C CG  . LEU B 2 11 ? -5.985  11.357  -12.936 1.00 54.74 11 B 1 
ATOM 585 C CD1 . LEU B 2 11 ? -6.289  10.897  -14.363 1.00 49.39 11 B 1 
ATOM 586 C CD2 . LEU B 2 11 ? -5.804  12.872  -12.903 1.00 51.94 11 B 1 
ATOM 587 N N   . MET B 2 12 ? -5.939  8.823   -9.905  1.00 61.77 12 B 1 
ATOM 588 C CA  . MET B 2 12 ? -4.798  8.221   -9.214  1.00 61.77 12 B 1 
ATOM 589 C C   . MET B 2 12 ? -4.739  6.716   -9.459  1.00 60.89 12 B 1 
ATOM 590 O O   . MET B 2 12 ? -3.657  6.159   -9.670  1.00 61.19 12 B 1 
ATOM 591 C CB  . MET B 2 12 ? -4.882  8.506   -7.708  1.00 60.46 12 B 1 
ATOM 592 C CG  . MET B 2 12 ? -4.600  9.963   -7.353  1.00 56.30 12 B 1 
ATOM 593 S SD  . MET B 2 12 ? -2.895  10.437  -7.633  1.00 50.43 12 B 1 
ATOM 594 C CE  . MET B 2 12 ? -2.938  12.135  -7.033  1.00 48.05 12 B 1 
ATOM 595 N N   . ALA B 2 13 ? -5.899  6.053   -9.449  1.00 62.68 13 B 1 
ATOM 596 C CA  . ALA B 2 13 ? -5.963  4.612   -9.694  1.00 62.66 13 B 1 
ATOM 597 C C   . ALA B 2 13 ? -5.487  4.271   -11.106 1.00 62.31 13 B 1 
ATOM 598 O O   . ALA B 2 13 ? -4.801  3.266   -11.316 1.00 61.32 13 B 1 
ATOM 599 C CB  . ALA B 2 13 ? -7.387  4.110   -9.478  1.00 61.88 13 B 1 
ATOM 600 N N   . TYR B 2 14 ? -5.849  5.110   -12.080 1.00 59.35 14 B 1 
ATOM 601 C CA  . TYR B 2 14 ? -5.426  4.904   -13.465 1.00 60.85 14 B 1 
ATOM 602 C C   . TYR B 2 14 ? -3.904  5.005   -13.602 1.00 60.76 14 B 1 
ATOM 603 O O   . TYR B 2 14 ? -3.286  4.237   -14.348 1.00 62.22 14 B 1 
ATOM 604 C CB  . TYR B 2 14 ? -6.108  5.925   -14.375 1.00 61.02 14 B 1 
ATOM 605 C CG  . TYR B 2 14 ? -5.730  5.752   -15.827 1.00 57.79 14 B 1 
ATOM 606 C CD1 . TYR B 2 14 ? -6.316  4.752   -16.606 1.00 52.26 14 B 1 
ATOM 607 C CD2 . TYR B 2 14 ? -4.777  6.581   -16.420 1.00 52.20 14 B 1 
ATOM 608 C CE1 . TYR B 2 14 ? -5.965  4.594   -17.940 1.00 49.02 14 B 1 
ATOM 609 C CE2 . TYR B 2 14 ? -4.420  6.420   -17.753 1.00 48.89 14 B 1 
ATOM 610 C CZ  . TYR B 2 14 ? -5.018  5.428   -18.507 1.00 49.94 14 B 1 
ATOM 611 O OH  . TYR B 2 14 ? -4.666  5.275   -19.829 1.00 47.40 14 B 1 
ATOM 612 N N   . ILE B 2 15 ? -3.302  5.955   -12.891 1.00 61.74 15 B 1 
ATOM 613 C CA  . ILE B 2 15 ? -1.851  6.153   -12.940 1.00 61.57 15 B 1 
ATOM 614 C C   . ILE B 2 15 ? -1.119  4.933   -12.372 1.00 60.14 15 B 1 
ATOM 615 O O   . ILE B 2 15 ? -0.077  4.528   -12.898 1.00 59.51 15 B 1 
ATOM 616 C CB  . ILE B 2 15 ? -1.451  7.433   -12.172 1.00 61.13 15 B 1 
ATOM 617 C CG1 . ILE B 2 15 ? -2.034  8.670   -12.865 1.00 58.70 15 B 1 
ATOM 618 C CG2 . ILE B 2 15 ? 0.070   7.556   -12.076 1.00 54.79 15 B 1 
ATOM 619 C CD1 . ILE B 2 15 ? -1.971  9.923   -12.007 1.00 53.34 15 B 1 
ATOM 620 N N   . ILE B 2 16 ? -1.656  4.335   -11.314 1.00 61.18 16 B 1 
ATOM 621 C CA  . ILE B 2 16 ? -1.041  3.156   -10.695 1.00 60.65 16 B 1 
ATOM 622 C C   . ILE B 2 16 ? -0.979  1.996   -11.692 1.00 59.40 16 B 1 
ATOM 623 O O   . ILE B 2 16 ? 0.053   1.331   -11.821 1.00 58.18 16 B 1 
ATOM 624 C CB  . ILE B 2 16 ? -1.818  2.738   -9.430  1.00 59.98 16 B 1 
ATOM 625 C CG1 . ILE B 2 16 ? -1.714  3.831   -8.361  1.00 57.11 16 B 1 
ATOM 626 C CG2 . ILE B 2 16 ? -1.273  1.418   -8.881  1.00 53.96 16 B 1 
ATOM 627 C CD1 . ILE B 2 16 ? -2.698  3.647   -7.222  1.00 52.48 16 B 1 
ATOM 628 N N   . ILE B 2 17 ? -2.078  1.753   -12.407 1.00 59.73 17 B 1 
ATOM 629 C CA  . ILE B 2 17 ? -2.127  0.683   -13.404 1.00 59.63 17 B 1 
ATOM 630 C C   . ILE B 2 17 ? -1.128  0.963   -14.533 1.00 58.37 17 B 1 
ATOM 631 O O   . ILE B 2 17 ? -0.444  0.054   -15.013 1.00 56.67 17 B 1 
ATOM 632 C CB  . ILE B 2 17 ? -3.553  0.529   -13.967 1.00 59.55 17 B 1 
ATOM 633 C CG1 . ILE B 2 17 ? -4.523  0.120   -12.849 1.00 57.29 17 B 1 
ATOM 634 C CG2 . ILE B 2 17 ? -3.577  -0.515  -15.089 1.00 53.44 17 B 1 
ATOM 635 C CD1 . ILE B 2 17 ? -5.979  0.228   -13.252 1.00 52.25 17 B 1 
ATOM 636 N N   . PHE B 2 18 ? -1.038  2.221   -14.949 1.00 57.29 18 B 1 
ATOM 637 C CA  . PHE B 2 18 ? -0.105  2.608   -16.005 1.00 57.03 18 B 1 
ATOM 638 C C   . PHE B 2 18 ? 1.350   2.384   -15.579 1.00 56.12 18 B 1 
ATOM 639 O O   . PHE B 2 18 ? 2.188   1.973   -16.390 1.00 55.09 18 B 1 
ATOM 640 C CB  . PHE B 2 18 ? -0.324  4.074   -16.382 1.00 56.02 18 B 1 
ATOM 641 C CG  . PHE B 2 18 ? 0.524   4.520   -17.545 1.00 52.36 18 B 1 
ATOM 642 C CD1 . PHE B 2 18 ? 0.169   4.185   -18.846 1.00 47.35 18 B 1 
ATOM 643 C CD2 . PHE B 2 18 ? 1.680   5.265   -17.331 1.00 47.70 18 B 1 
ATOM 644 C CE1 . PHE B 2 18 ? 0.952   4.593   -19.918 1.00 44.76 18 B 1 
ATOM 645 C CE2 . PHE B 2 18 ? 2.469   5.673   -18.402 1.00 44.77 18 B 1 
ATOM 646 C CZ  . PHE B 2 18 ? 2.102   5.338   -19.696 1.00 45.53 18 B 1 
ATOM 647 N N   . LEU B 2 19 ? 1.649   2.646   -14.310 1.00 56.87 19 B 1 
ATOM 648 C CA  . LEU B 2 19 ? 3.010   2.488   -13.793 1.00 55.71 19 B 1 
ATOM 649 C C   . LEU B 2 19 ? 3.437   1.024   -13.719 1.00 54.11 19 B 1 
ATOM 650 O O   . LEU B 2 19 ? 4.635   0.729   -13.750 1.00 52.49 19 B 1 
ATOM 651 C CB  . LEU B 2 19 ? 3.116   3.137   -12.410 1.00 54.66 19 B 1 
ATOM 652 C CG  . LEU B 2 19 ? 3.220   4.667   -12.440 1.00 52.20 19 B 1 
ATOM 653 C CD1 . LEU B 2 19 ? 2.950   5.252   -11.061 1.00 48.78 19 B 1 
ATOM 654 C CD2 . LEU B 2 19 ? 4.596   5.099   -12.930 1.00 48.73 19 B 1 
ATOM 655 N N   . THR B 2 20 ? 2.479   0.101   -13.625 1.00 53.71 20 B 1 
ATOM 656 C CA  . THR B 2 20 ? 2.801   -1.327  -13.570 1.00 52.10 20 B 1 
ATOM 657 C C   . THR B 2 20 ? 3.427   -1.809  -14.878 1.00 50.23 20 B 1 
ATOM 658 O O   . THR B 2 20 ? 4.113   -2.834  -14.906 1.00 47.91 20 B 1 
ATOM 659 C CB  . THR B 2 20 ? 1.551   -2.173  -13.271 1.00 50.31 20 B 1 
ATOM 660 O OG1 . THR B 2 20 ? 0.575   -1.983  -14.289 1.00 47.17 20 B 1 
ATOM 661 C CG2 . THR B 2 20 ? 0.955   -1.794  -11.922 1.00 45.67 20 B 1 
ATOM 662 N N   . MET B 2 21 ? 3.183   -1.076  -15.961 1.00 52.37 21 B 1 
ATOM 663 C CA  . MET B 2 21 ? 3.753   -1.416  -17.265 1.00 52.03 21 B 1 
ATOM 664 C C   . MET B 2 21 ? 5.220   -1.005  -17.358 1.00 49.35 21 B 1 
ATOM 665 O O   . MET B 2 21 ? 5.960   -1.523  -18.198 1.00 47.25 21 B 1 
ATOM 666 C CB  . MET B 2 21 ? 2.958   -0.739  -18.380 1.00 51.56 21 B 1 
ATOM 667 C CG  . MET B 2 21 ? 1.497   -1.171  -18.425 1.00 48.35 21 B 1 
ATOM 668 S SD  . MET B 2 21 ? 0.585   -0.333  -19.732 1.00 44.57 21 B 1 
ATOM 669 C CE  . MET B 2 21 ? -1.045  -1.025  -19.457 1.00 41.80 21 B 1 
ATOM 670 N N   . LEU B 2 22 ? 5.639   -0.075  -16.502 1.00 50.69 22 B 1 
ATOM 671 C CA  . LEU B 2 22 ? 7.018   0.401   -16.496 1.00 49.66 22 B 1 
ATOM 672 C C   . LEU B 2 22 ? 7.902   -0.521  -15.652 1.00 48.51 22 B 1 
ATOM 673 O O   . LEU B 2 22 ? 7.436   -1.099  -14.668 1.00 45.37 22 B 1 
ATOM 674 C CB  . LEU B 2 22 ? 7.079   1.830   -15.950 1.00 46.47 22 B 1 
ATOM 675 C CG  . LEU B 2 22 ? 6.318   2.871   -16.780 1.00 44.06 22 B 1 
ATOM 676 C CD1 . LEU B 2 22 ? 6.323   4.220   -16.080 1.00 41.30 22 B 1 
ATOM 677 C CD2 . LEU B 2 22 ? 6.936   3.001   -18.172 1.00 41.39 22 B 1 
ATOM 678 N N   . PRO B 2 23 ? 9.181   -0.664  -16.017 1.00 50.48 23 B 1 
ATOM 679 C CA  . PRO B 2 23 ? 10.104  -1.514  -15.250 1.00 50.42 23 B 1 
ATOM 680 C C   . PRO B 2 23 ? 10.496  -0.911  -13.907 1.00 51.10 23 B 1 
ATOM 681 O O   . PRO B 2 23 ? 10.973  -1.629  -13.020 1.00 47.58 23 B 1 
ATOM 682 C CB  . PRO B 2 23 ? 11.329  -1.633  -16.168 1.00 46.82 23 B 1 
ATOM 683 C CG  . PRO B 2 23 ? 11.301  -0.386  -16.998 1.00 45.58 23 B 1 
ATOM 684 C CD  . PRO B 2 23 ? 9.842   -0.075  -17.202 1.00 47.52 23 B 1 
ATOM 685 N N   . ASP B 2 24 ? 10.285  0.403   -13.741 1.00 53.87 24 B 1 
ATOM 686 C CA  . ASP B 2 24 ? 10.634  1.083   -12.497 1.00 54.68 24 B 1 
ATOM 687 C C   . ASP B 2 24 ? 9.471   1.036   -11.512 1.00 55.36 24 B 1 
ATOM 688 O O   . ASP B 2 24 ? 8.433   1.663   -11.739 1.00 53.09 24 B 1 
ATOM 689 C CB  . ASP B 2 24 ? 11.024  2.533   -12.785 1.00 52.42 24 B 1 
ATOM 690 C CG  . ASP B 2 24 ? 12.269  2.629   -13.652 1.00 48.52 24 B 1 
ATOM 691 O OD1 . ASP B 2 24 ? 13.097  1.692   -13.615 1.00 45.03 24 B 1 
ATOM 692 O OD2 . ASP B 2 24 ? 12.422  3.644   -14.360 1.00 44.32 24 B 1 
ATOM 693 N N   . TRP B 2 25 ? 9.638   0.290   -10.433 1.00 52.93 25 B 1 
ATOM 694 C CA  . TRP B 2 25 ? 8.624   0.176   -9.389  1.00 53.12 25 B 1 
ATOM 695 C C   . TRP B 2 25 ? 8.855   1.183   -8.261  1.00 53.64 25 B 1 
ATOM 696 O O   . TRP B 2 25 ? 7.999   1.341   -7.391  1.00 52.20 25 B 1 
ATOM 697 C CB  . TRP B 2 25 ? 8.604   -1.242  -8.819  1.00 51.50 25 B 1 
ATOM 698 C CG  . TRP B 2 25 ? 9.866   -1.615  -8.086  1.00 50.59 25 B 1 
ATOM 699 C CD1 . TRP B 2 25 ? 10.068  -1.542  -6.742  1.00 46.19 25 B 1 
ATOM 700 C CD2 . TRP B 2 25 ? 11.095  -2.102  -8.649  1.00 46.26 25 B 1 
ATOM 701 N NE1 . TRP B 2 25 ? 11.347  -1.950  -6.434  1.00 44.91 25 B 1 
ATOM 702 C CE2 . TRP B 2 25 ? 12.003  -2.305  -7.585  1.00 44.93 25 B 1 
ATOM 703 C CE3 . TRP B 2 25 ? 11.512  -2.399  -9.948  1.00 45.24 25 B 1 
ATOM 704 C CZ2 . TRP B 2 25 ? 13.308  -2.781  -7.789  1.00 44.91 25 B 1 
ATOM 705 C CZ3 . TRP B 2 25 ? 12.818  -2.875  -10.149 1.00 44.42 25 B 1 
ATOM 706 C CH2 . TRP B 2 25 ? 13.696  -3.060  -9.073  1.00 42.67 25 B 1 
ATOM 707 N N   . LYS B 2 26 ? 9.990   1.855   -8.255  1.00 54.39 26 B 1 
ATOM 708 C CA  . LYS B 2 26 ? 10.314  2.835   -7.213  1.00 54.77 26 B 1 
ATOM 709 C C   . LYS B 2 26 ? 9.376   4.038   -7.274  1.00 54.29 26 B 1 
ATOM 710 O O   . LYS B 2 26 ? 8.920   4.529   -6.239  1.00 53.93 26 B 1 
ATOM 711 C CB  . LYS B 2 26 ? 11.772  3.290   -7.356  1.00 55.28 26 B 1 
ATOM 712 C CG  . LYS B 2 26 ? 12.777  2.176   -7.070  1.00 52.84 26 B 1 
ATOM 713 C CD  . LYS B 2 26 ? 14.209  2.667   -7.197  1.00 49.82 26 B 1 
ATOM 714 C CE  . LYS B 2 26 ? 15.203  1.546   -6.921  1.00 46.77 26 B 1 
ATOM 715 N NZ  . LYS B 2 26 ? 16.608  2.010   -7.052  1.00 43.58 26 B 1 
ATOM 716 N N   . SER B 2 27 ? 9.071   4.510   -8.480  1.00 56.82 27 B 1 
ATOM 717 C CA  . SER B 2 27 ? 8.164   5.645   -8.656  1.00 56.89 27 B 1 
ATOM 718 C C   . SER B 2 27 ? 6.754   5.311   -8.166  1.00 57.23 27 B 1 
ATOM 719 O O   . SER B 2 27 ? 6.048   6.182   -7.652  1.00 55.86 27 B 1 
ATOM 720 C CB  . SER B 2 27 ? 8.120   6.057   -10.126 1.00 56.24 27 B 1 
ATOM 721 O OG  . SER B 2 27 ? 7.677   4.996   -10.944 1.00 51.73 27 B 1 
ATOM 722 N N   . SER B 2 28 ? 6.346   4.051   -8.305  1.00 57.52 28 B 1 
ATOM 723 C CA  . SER B 2 28 ? 5.029   3.618   -7.847  1.00 57.25 28 B 1 
ATOM 724 C C   . SER B 2 28 ? 4.922   3.663   -6.323  1.00 58.02 28 B 1 
ATOM 725 O O   . SER B 2 28 ? 3.863   3.985   -5.782  1.00 57.01 28 B 1 
ATOM 726 C CB  . SER B 2 28 ? 4.730   2.204   -8.352  1.00 55.67 28 B 1 
ATOM 727 O OG  . SER B 2 28 ? 5.558   1.250   -7.721  1.00 50.58 28 B 1 
ATOM 728 N N   . LEU B 2 29 ? 6.017   3.362   -5.631  1.00 56.54 29 B 1 
ATOM 729 C CA  . LEU B 2 29 ? 6.034   3.386   -4.166  1.00 56.56 29 B 1 
ATOM 730 C C   . LEU B 2 29 ? 5.780   4.796   -3.631  1.00 57.11 29 B 1 
ATOM 731 O O   . LEU B 2 29 ? 5.092   4.970   -2.621  1.00 57.03 29 B 1 
ATOM 732 C CB  . LEU B 2 29 ? 7.380   2.864   -3.652  1.00 55.33 29 B 1 
ATOM 733 C CG  . LEU B 2 29 ? 7.594   1.358   -3.832  1.00 51.64 29 B 1 
ATOM 734 C CD1 . LEU B 2 29 ? 9.040   0.983   -3.534  1.00 47.23 29 B 1 
ATOM 735 C CD2 . LEU B 2 29 ? 6.649   0.577   -2.924  1.00 47.16 29 B 1 
ATOM 736 N N   . ILE B 2 30 ? 6.315   5.802   -4.304  1.00 58.97 30 B 1 
ATOM 737 C CA  . ILE B 2 30 ? 6.134   7.196   -3.889  1.00 59.87 30 B 1 
ATOM 738 C C   . ILE B 2 30 ? 4.660   7.593   -3.999  1.00 59.94 30 B 1 
ATOM 739 O O   . ILE B 2 30 ? 4.109   8.234   -3.098  1.00 59.33 30 B 1 
ATOM 740 C CB  . ILE B 2 30 ? 7.021   8.134   -4.731  1.00 59.34 30 B 1 
ATOM 741 C CG1 . ILE B 2 30 ? 8.502   7.807   -4.508  1.00 56.33 30 B 1 
ATOM 742 C CG2 . ILE B 2 30 ? 6.743   9.597   -4.368  1.00 53.67 30 B 1 
ATOM 743 C CD1 . ILE B 2 30 ? 9.428   8.494   -5.497  1.00 52.14 30 B 1 
ATOM 744 N N   . LEU B 2 31 ? 4.011   7.213   -5.100  1.00 60.41 31 B 1 
ATOM 745 C CA  . LEU B 2 31 ? 2.599   7.536   -5.303  1.00 60.39 31 B 1 
ATOM 746 C C   . LEU B 2 31 ? 1.704   6.776   -4.325  1.00 60.25 31 B 1 
ATOM 747 O O   . LEU B 2 31 ? 0.704   7.319   -3.845  1.00 59.59 31 B 1 
ATOM 748 C CB  . LEU B 2 31 ? 2.199   7.225   -6.748  1.00 59.84 31 B 1 
ATOM 749 C CG  . LEU B 2 31 ? 2.788   8.183   -7.786  1.00 56.06 31 B 1 
ATOM 750 C CD1 . LEU B 2 31 ? 2.505   7.679   -9.196  1.00 52.00 31 B 1 
ATOM 751 C CD2 . LEU B 2 31 ? 2.212   9.585   -7.607  1.00 53.59 31 B 1 
ATOM 752 N N   . MET B 2 32 ? 2.049   5.521   -4.025  1.00 63.33 32 B 1 
ATOM 753 C CA  . MET B 2 32 ? 1.274   4.713   -3.085  1.00 62.93 32 B 1 
ATOM 754 C C   . MET B 2 32 ? 1.244   5.356   -1.702  1.00 62.68 32 B 1 
ATOM 755 O O   . MET B 2 32 ? 0.198   5.398   -1.051  1.00 62.11 32 B 1 
ATOM 756 C CB  . MET B 2 32 ? 1.862   3.300   -2.994  1.00 61.13 32 B 1 
ATOM 757 C CG  . MET B 2 32 ? 1.572   2.451   -4.226  1.00 56.47 32 B 1 
ATOM 758 S SD  . MET B 2 32 ? -0.161  2.033   -4.389  1.00 50.42 32 B 1 
ATOM 759 C CE  . MET B 2 32 ? -0.077  0.936   -5.814  1.00 48.56 32 B 1 
ATOM 760 N N   . ALA B 2 33 ? 2.391   5.871   -1.253  1.00 61.87 33 B 1 
ATOM 761 C CA  . ALA B 2 33 ? 2.475   6.525   0.050   1.00 61.42 33 B 1 
ATOM 762 C C   . ALA B 2 33 ? 1.601   7.779   0.092   1.00 61.21 33 B 1 
ATOM 763 O O   . ALA B 2 33 ? 0.948   8.056   1.102   1.00 59.87 33 B 1 
ATOM 764 C CB  . ALA B 2 33 ? 3.929   6.879   0.366   1.00 60.23 33 B 1 
ATOM 765 N N   . TYR B 2 34 ? 1.580   8.535   -1.005  1.00 59.07 34 B 1 
ATOM 766 C CA  . TYR B 2 34 ? 0.766   9.750   -1.084  1.00 60.04 34 B 1 
ATOM 767 C C   . TYR B 2 34 ? -0.726  9.422   -1.016  1.00 60.39 34 B 1 
ATOM 768 O O   . TYR B 2 34 ? -1.498  10.136  -0.367  1.00 61.29 34 B 1 
ATOM 769 C CB  . TYR B 2 34 ? 1.083   10.502  -2.375  1.00 59.60 34 B 1 
ATOM 770 C CG  . TYR B 2 34 ? 0.289   11.776  -2.510  1.00 56.53 34 B 1 
ATOM 771 C CD1 . TYR B 2 34 ? 0.656   12.927  -1.814  1.00 51.03 34 B 1 
ATOM 772 C CD2 . TYR B 2 34 ? -0.839  11.826  -3.327  1.00 50.92 34 B 1 
ATOM 773 C CE1 . TYR B 2 34 ? -0.080  14.098  -1.937  1.00 47.60 34 B 1 
ATOM 774 C CE2 . TYR B 2 34 ? -1.581  12.995  -3.451  1.00 47.42 34 B 1 
ATOM 775 C CZ  . TYR B 2 34 ? -1.194  14.126  -2.756  1.00 48.74 34 B 1 
ATOM 776 O OH  . TYR B 2 34 ? -1.928  15.286  -2.882  1.00 46.68 34 B 1 
ATOM 777 N N   . ILE B 2 35 ? -1.144  8.350   -1.685  1.00 61.69 35 B 1 
ATOM 778 C CA  . ILE B 2 35 ? -2.551  7.944   -1.703  1.00 61.44 35 B 1 
ATOM 779 C C   . ILE B 2 35 ? -3.023  7.529   -0.309  1.00 59.99 35 B 1 
ATOM 780 O O   . ILE B 2 35 ? -4.137  7.866   0.098   1.00 59.26 35 B 1 
ATOM 781 C CB  . ILE B 2 35 ? -2.764  6.798   -2.712  1.00 61.36 35 B 1 
ATOM 782 C CG1 . ILE B 2 35 ? -2.516  7.298   -4.140  1.00 59.03 35 B 1 
ATOM 783 C CG2 . ILE B 2 35 ? -4.176  6.231   -2.592  1.00 55.50 35 B 1 
ATOM 784 C CD1 . ILE B 2 35 ? -2.338  6.176   -5.145  1.00 53.83 35 B 1 
ATOM 785 N N   . ILE B 2 36 ? -2.189  6.804   0.428   1.00 61.66 36 B 1 
ATOM 786 C CA  . ILE B 2 36 ? -2.541  6.356   1.780   1.00 60.77 36 B 1 
ATOM 787 C C   . ILE B 2 36 ? -2.822  7.557   2.685   1.00 59.62 36 B 1 
ATOM 788 O O   . ILE B 2 36 ? -3.806  7.571   3.426   1.00 58.13 36 B 1 
ATOM 789 C CB  . ILE B 2 36 ? -1.415  5.484   2.372   1.00 60.13 36 B 1 
ATOM 790 C CG1 . ILE B 2 36 ? -1.273  4.187   1.572   1.00 57.16 36 B 1 
ATOM 791 C CG2 . ILE B 2 36 ? -1.701  5.163   3.841   1.00 53.95 36 B 1 
ATOM 792 C CD1 . ILE B 2 36 ? 0.003   3.430   1.884   1.00 52.28 36 B 1 
ATOM 793 N N   . ILE B 2 37 ? -1.967  8.571   2.627   1.00 58.06 37 B 1 
ATOM 794 C CA  . ILE B 2 37 ? -2.140  9.778   3.438   1.00 57.56 37 B 1 
ATOM 795 C C   . ILE B 2 37 ? -3.427  10.509  3.041   1.00 56.82 37 B 1 
ATOM 796 O O   . ILE B 2 37 ? -4.173  10.986  3.903   1.00 54.92 37 B 1 
ATOM 797 C CB  . ILE B 2 37 ? -0.916  10.708  3.298   1.00 56.77 37 B 1 
ATOM 798 C CG1 . ILE B 2 37 ? 0.344   10.015  3.832   1.00 53.82 37 B 1 
ATOM 799 C CG2 . ILE B 2 37 ? -1.154  12.018  4.054   1.00 50.20 37 B 1 
ATOM 800 C CD1 . ILE B 2 37 ? 1.628   10.738  3.457   1.00 48.63 37 B 1 
ATOM 801 N N   . PHE B 2 38 ? -3.699  10.592  1.740   1.00 56.58 38 B 1 
ATOM 802 C CA  . PHE B 2 38 ? -4.899  11.269  1.249   1.00 56.44 38 B 1 
ATOM 803 C C   . PHE B 2 38 ? -6.174  10.545  1.692   1.00 56.03 38 B 1 
ATOM 804 O O   . PHE B 2 38 ? -7.173  11.186  2.028   1.00 55.02 38 B 1 
ATOM 805 C CB  . PHE B 2 38 ? -4.851  11.369  -0.276  1.00 55.24 38 B 1 
ATOM 806 C CG  . PHE B 2 38 ? -5.954  12.222  -0.841  1.00 51.98 38 B 1 
ATOM 807 C CD1 . PHE B 2 38 ? -5.868  13.609  -0.804  1.00 46.71 38 B 1 
ATOM 808 C CD2 . PHE B 2 38 ? -7.081  11.633  -1.403  1.00 46.96 38 B 1 
ATOM 809 C CE1 . PHE B 2 38 ? -6.887  14.396  -1.322  1.00 43.91 38 B 1 
ATOM 810 C CE2 . PHE B 2 38 ? -8.106  12.417  -1.923  1.00 43.74 38 B 1 
ATOM 811 C CZ  . PHE B 2 38 ? -8.008  13.798  -1.883  1.00 44.58 38 B 1 
ATOM 812 N N   . LEU B 2 39 ? -6.146  9.216   1.698   1.00 57.10 39 B 1 
ATOM 813 C CA  . LEU B 2 39 ? -7.307  8.416   2.089   1.00 56.20 39 B 1 
ATOM 814 C C   . LEU B 2 39 ? -7.631  8.562   3.576   1.00 55.07 39 B 1 
ATOM 815 O O   . LEU B 2 39 ? -8.792  8.444   3.971   1.00 53.58 39 B 1 
ATOM 816 C CB  . LEU B 2 39 ? -7.078  6.940   1.750   1.00 55.32 39 B 1 
ATOM 817 C CG  . LEU B 2 39 ? -7.757  6.465   0.455   1.00 53.17 39 B 1 
ATOM 818 C CD1 . LEU B 2 39 ? -7.206  7.221   -0.754  1.00 49.62 39 B 1 
ATOM 819 C CD2 . LEU B 2 39 ? -7.557  4.969   0.273   1.00 49.48 39 B 1 
ATOM 820 N N   . THR B 2 40 ? -6.614  8.820   4.400   1.00 54.37 40 B 1 
ATOM 821 C CA  . THR B 2 40 ? -6.823  8.975   5.840   1.00 52.42 40 B 1 
ATOM 822 C C   . THR B 2 40 ? -7.676  10.202  6.164   1.00 50.92 40 B 1 
ATOM 823 O O   . THR B 2 40 ? -8.268  10.282  7.244   1.00 48.32 40 B 1 
ATOM 824 C CB  . THR B 2 40 ? -5.482  9.084   6.587   1.00 49.89 40 B 1 
ATOM 825 O OG1 . THR B 2 40 ? -4.741  10.199  6.110   1.00 46.98 40 B 1 
ATOM 826 C CG2 . THR B 2 40 ? -4.666  7.812   6.409   1.00 45.17 40 B 1 
ATOM 827 N N   . MET B 2 41 ? -7.738  11.159  5.239   1.00 52.94 41 B 1 
ATOM 828 C CA  . MET B 2 41 ? -8.555  12.357  5.429   1.00 52.30 41 B 1 
ATOM 829 C C   . MET B 2 41 ? -10.043 12.051  5.269   1.00 50.48 41 B 1 
ATOM 830 O O   . MET B 2 41 ? -10.890 12.801  5.757   1.00 48.19 41 B 1 
ATOM 831 C CB  . MET B 2 41 ? -8.140  13.440  4.431   1.00 50.84 41 B 1 
ATOM 832 C CG  . MET B 2 41 ? -6.704  13.908  4.613   1.00 47.11 41 B 1 
ATOM 833 S SD  . MET B 2 41 ? -6.243  15.174  3.417   1.00 43.26 41 B 1 
ATOM 834 C CE  . MET B 2 41 ? -4.531  15.426  3.884   1.00 40.54 41 B 1 
ATOM 835 N N   . LEU B 2 42 ? -10.370 10.947  4.596   1.00 50.82 42 B 1 
ATOM 836 C CA  . LEU B 2 42 ? -11.754 10.535  4.387   1.00 50.39 42 B 1 
ATOM 837 C C   . LEU B 2 42 ? -12.272 9.748   5.593   1.00 49.82 42 B 1 
ATOM 838 O O   . LEU B 2 42 ? -11.493 9.086   6.283   1.00 47.00 42 B 1 
ATOM 839 C CB  . LEU B 2 42 ? -11.854 9.684   3.120   1.00 47.73 42 B 1 
ATOM 840 C CG  . LEU B 2 42 ? -11.452 10.407  1.831   1.00 45.50 42 B 1 
ATOM 841 C CD1 . LEU B 2 42 ? -11.446 9.440   0.658   1.00 42.30 42 B 1 
ATOM 842 C CD2 . LEU B 2 42 ? -12.399 11.574  1.553   1.00 42.39 42 B 1 
ATOM 843 N N   . PRO B 2 43 ? -13.587 9.797   5.858   1.00 50.96 43 B 1 
ATOM 844 C CA  . PRO B 2 43 ? -14.161 9.063   6.996   1.00 50.79 43 B 1 
ATOM 845 C C   . PRO B 2 43 ? -14.116 7.547   6.823   1.00 51.47 43 B 1 
ATOM 846 O O   . PRO B 2 43 ? -14.233 6.809   7.804   1.00 48.34 43 B 1 
ATOM 847 C CB  . PRO B 2 43 ? -15.609 9.565   7.050   1.00 47.71 43 B 1 
ATOM 848 C CG  . PRO B 2 43 ? -15.906 10.016  5.657   1.00 46.78 43 B 1 
ATOM 849 C CD  . PRO B 2 43 ? -14.607 10.560  5.126   1.00 48.05 43 B 1 
ATOM 850 N N   . ASP B 2 44 ? -13.941 7.073   5.584   1.00 54.26 44 B 1 
ATOM 851 C CA  . ASP B 2 44 ? -13.896 5.641   5.296   1.00 54.94 44 B 1 
ATOM 852 C C   . ASP B 2 44 ? -12.477 5.077   5.357   1.00 55.80 44 B 1 
ATOM 853 O O   . ASP B 2 44 ? -12.197 4.022   4.782   1.00 53.67 44 B 1 
ATOM 854 C CB  . ASP B 2 44 ? -14.503 5.372   3.919   1.00 52.93 44 B 1 
ATOM 855 C CG  . ASP B 2 44 ? -15.970 5.759   3.854   1.00 49.18 44 B 1 
ATOM 856 O OD1 . ASP B 2 44 ? -16.634 5.760   4.911   1.00 45.49 44 B 1 
ATOM 857 O OD2 . ASP B 2 44 ? -16.457 6.062   2.749   1.00 44.88 44 B 1 
ATOM 858 N N   . TRP B 2 45 ? -11.579 5.760   6.054   1.00 55.20 45 B 1 
ATOM 859 C CA  . TRP B 2 45 ? -10.193 5.309   6.157   1.00 55.23 45 B 1 
ATOM 860 C C   . TRP B 2 45 ? -10.074 3.982   6.909   1.00 55.30 45 B 1 
ATOM 861 O O   . TRP B 2 45 ? -9.156  3.198   6.651   1.00 53.92 45 B 1 
ATOM 862 C CB  . TRP B 2 45 ? -9.335  6.379   6.843   1.00 54.10 45 B 1 
ATOM 863 C CG  . TRP B 2 45 ? -9.725  6.652   8.270   1.00 53.69 45 B 1 
ATOM 864 C CD1 . TRP B 2 45 ? -10.627 7.570   8.704   1.00 48.66 45 B 1 
ATOM 865 C CD2 . TRP B 2 45 ? -9.217  5.995   9.448   1.00 49.66 45 B 1 
ATOM 866 N NE1 . TRP B 2 45 ? -10.721 7.523   10.077  1.00 47.87 45 B 1 
ATOM 867 C CE2 . TRP B 2 45 ? -9.864  6.568   10.558  1.00 48.28 45 B 1 
ATOM 868 C CE3 . TRP B 2 45 ? -8.272  4.993   9.656   1.00 48.53 45 B 1 
ATOM 869 C CZ2 . TRP B 2 45 ? -9.599  6.158   11.872  1.00 48.60 45 B 1 
ATOM 870 C CZ3 . TRP B 2 45 ? -8.008  4.580   10.969  1.00 47.49 45 B 1 
ATOM 871 C CH2 . TRP B 2 45 ? -8.669  5.167   12.057  1.00 46.09 45 B 1 
ATOM 872 N N   . LYS B 2 46 ? -10.993 3.718   7.826   1.00 55.62 46 B 1 
ATOM 873 C CA  . LYS B 2 46 ? -10.952 2.486   8.618   1.00 55.51 46 B 1 
ATOM 874 C C   . LYS B 2 46 ? -11.167 1.253   7.743   1.00 54.80 46 B 1 
ATOM 875 O O   . LYS B 2 46 ? -10.468 0.249   7.894   1.00 54.48 46 B 1 
ATOM 876 C CB  . LYS B 2 46 ? -12.010 2.539   9.726   1.00 56.03 46 B 1 
ATOM 877 C CG  . LYS B 2 46 ? -11.709 3.594   10.787  1.00 53.70 46 B 1 
ATOM 878 C CD  . LYS B 2 46 ? -12.765 3.606   11.879  1.00 50.69 46 B 1 
ATOM 879 C CE  . LYS B 2 46 ? -12.470 4.674   12.920  1.00 47.18 46 B 1 
ATOM 880 N NZ  . LYS B 2 46 ? -13.516 4.716   13.981  1.00 44.08 46 B 1 
ATOM 881 N N   . SER B 2 47 ? -12.124 1.329   6.821   1.00 54.49 47 B 1 
ATOM 882 C CA  . SER B 2 47 ? -12.401 0.209   5.922   1.00 54.18 47 B 1 
ATOM 883 C C   . SER B 2 47 ? -11.215 -0.068  4.999   1.00 54.56 47 B 1 
ATOM 884 O O   . SER B 2 47 ? -10.951 -1.221  4.650   1.00 53.23 47 B 1 
ATOM 885 C CB  . SER B 2 47 ? -13.651 0.496   5.091   1.00 53.39 47 B 1 
ATOM 886 O OG  . SER B 2 47 ? -13.481 1.648   4.291   1.00 49.07 47 B 1 
ATOM 887 N N   . SER B 2 48 ? -10.488 0.975   4.619   1.00 58.00 48 B 1 
ATOM 888 C CA  . SER B 2 48 ? -9.321  0.813   3.755   1.00 57.93 48 B 1 
ATOM 889 C C   . SER B 2 48 ? -8.195  0.062   4.466   1.00 58.43 48 B 1 
ATOM 890 O O   . SER B 2 48 ? -7.493  -0.742  3.846   1.00 57.28 48 B 1 
ATOM 891 C CB  . SER B 2 48 ? -8.821  2.182   3.277   1.00 56.42 48 B 1 
ATOM 892 O OG  . SER B 2 48 ? -8.237  2.918   4.330   1.00 51.45 48 B 1 
ATOM 893 N N   . LEU B 2 49 ? -8.032  0.304   5.761   1.00 56.50 49 B 1 
ATOM 894 C CA  . LEU B 2 49 ? -6.997  -0.375  6.543   1.00 56.36 49 B 1 
ATOM 895 C C   . LEU B 2 49 ? -7.264  -1.877  6.624   1.00 56.81 49 B 1 
ATOM 896 O O   . LEU B 2 49 ? -6.330  -2.685  6.570   1.00 56.69 49 B 1 
ATOM 897 C CB  . LEU B 2 49 ? -6.928  0.226   7.949   1.00 55.01 49 B 1 
ATOM 898 C CG  . LEU B 2 49 ? -6.338  1.638   8.015   1.00 51.27 49 B 1 
ATOM 899 C CD1 . LEU B 2 49 ? -6.539  2.238   9.401   1.00 46.86 49 B 1 
ATOM 900 C CD2 . LEU B 2 49 ? -4.852  1.618   7.672   1.00 46.95 49 B 1 
ATOM 901 N N   . ILE B 2 50 ? -8.525  -2.258  6.744   1.00 57.43 50 B 1 
ATOM 902 C CA  . ILE B 2 50 ? -8.902  -3.673  6.808   1.00 58.24 50 B 1 
ATOM 903 C C   . ILE B 2 50 ? -8.574  -4.373  5.486   1.00 58.14 50 B 1 
ATOM 904 O O   . ILE B 2 50 ? -8.053  -5.492  5.477   1.00 57.34 50 B 1 
ATOM 905 C CB  . ILE B 2 50 ? -10.399 -3.820  7.144   1.00 57.91 50 B 1 
ATOM 906 C CG1 . ILE B 2 50 ? -10.689 -3.232  8.531   1.00 54.97 50 B 1 
ATOM 907 C CG2 . ILE B 2 50 ? -10.814 -5.294  7.097   1.00 52.33 50 B 1 
ATOM 908 C CD1 . ILE B 2 50 ? -12.171 -3.081  8.822   1.00 50.79 50 B 1 
ATOM 909 N N   . LEU B 2 51 ? -8.873  -3.717  4.368   1.00 59.17 51 B 1 
ATOM 910 C CA  . LEU B 2 51 ? -8.589  -4.287  3.051   1.00 59.32 51 B 1 
ATOM 911 C C   . LEU B 2 51 ? -7.084  -4.395  2.801   1.00 59.22 51 B 1 
ATOM 912 O O   . LEU B 2 51 ? -6.621  -5.358  2.179   1.00 58.69 51 B 1 
ATOM 913 C CB  . LEU B 2 51 ? -9.243  -3.431  1.963   1.00 58.54 51 B 1 
ATOM 914 C CG  . LEU B 2 51 ? -10.773 -3.525  1.919   1.00 54.26 51 B 1 
ATOM 915 C CD1 . LEU B 2 51 ? -11.344 -2.478  0.971   1.00 50.26 51 B 1 
ATOM 916 C CD2 . LEU B 2 51 ? -11.208 -4.923  1.481   1.00 51.47 51 B 1 
ATOM 917 N N   . MET B 2 52 ? -6.319  -3.420  3.280   1.00 62.61 52 B 1 
ATOM 918 C CA  . MET B 2 52 ? -4.865  -3.444  3.130   1.00 62.75 52 B 1 
ATOM 919 C C   . MET B 2 52 ? -4.266  -4.666  3.829   1.00 62.58 52 B 1 
ATOM 920 O O   . MET B 2 52 ? -3.361  -5.312  3.298   1.00 62.48 52 B 1 
ATOM 921 C CB  . MET B 2 52 ? -4.252  -2.160  3.700   1.00 60.98 52 B 1 
ATOM 922 C CG  . MET B 2 52 ? -4.526  -0.925  2.849   1.00 56.54 52 B 1 
ATOM 923 S SD  . MET B 2 52 ? -3.650  -0.934  1.291   1.00 50.48 52 B 1 
ATOM 924 C CE  . MET B 2 52 ? -4.102  0.693   0.662   1.00 48.15 52 B 1 
ATOM 925 N N   . ALA B 2 53 ? -4.782  -4.987  5.015   1.00 61.79 53 B 1 
ATOM 926 C CA  . ALA B 2 53 ? -4.310  -6.154  5.760   1.00 61.84 53 B 1 
ATOM 927 C C   . ALA B 2 53 ? -4.626  -7.451  5.014   1.00 61.57 53 B 1 
ATOM 928 O O   . ALA B 2 53 ? -3.834  -8.399  5.040   1.00 60.40 53 B 1 
ATOM 929 C CB  . ALA B 2 53 ? -4.943  -6.177  7.150   1.00 61.03 53 B 1 
ATOM 930 N N   . TYR B 2 54 ? -5.780  -7.500  4.340   1.00 58.41 54 B 1 
ATOM 931 C CA  . TYR B 2 54 ? -6.178  -8.682  3.573   1.00 59.44 54 B 1 
ATOM 932 C C   . TYR B 2 54 ? -5.205  -8.964  2.427   1.00 59.70 54 B 1 
ATOM 933 O O   . TYR B 2 54 ? -4.909  -10.125 2.125   1.00 60.63 54 B 1 
ATOM 934 C CB  . TYR B 2 54 ? -7.594  -8.496  3.023   1.00 58.55 54 B 1 
ATOM 935 C CG  . TYR B 2 54 ? -8.081  -9.704  2.263   1.00 54.73 54 B 1 
ATOM 936 C CD1 . TYR B 2 54 ? -8.560  -10.829 2.932   1.00 49.18 54 B 1 
ATOM 937 C CD2 . TYR B 2 54 ? -8.051  -9.725  0.869   1.00 48.72 54 B 1 
ATOM 938 C CE1 . TYR B 2 54 ? -9.004  -11.940 2.230   1.00 45.64 54 B 1 
ATOM 939 C CE2 . TYR B 2 54 ? -8.489  -10.838 0.161   1.00 45.49 54 B 1 
ATOM 940 C CZ  . TYR B 2 54 ? -8.967  -11.940 0.847   1.00 47.05 54 B 1 
ATOM 941 O OH  . TYR B 2 54 ? -9.404  -13.041 0.145   1.00 44.77 54 B 1 
ATOM 942 N N   . ILE B 2 55 ? -4.706  -7.915  1.786   1.00 58.06 55 B 1 
ATOM 943 C CA  . ILE B 2 55 ? -3.759  -8.061  0.676   1.00 57.93 55 B 1 
ATOM 944 C C   . ILE B 2 55 ? -2.465  -8.724  1.149   1.00 56.73 55 B 1 
ATOM 945 O O   . ILE B 2 55 ? -1.893  -9.564  0.448   1.00 56.23 55 B 1 
ATOM 946 C CB  . ILE B 2 55 ? -3.456  -6.685  0.040   1.00 57.34 55 B 1 
ATOM 947 C CG1 . ILE B 2 55 ? -4.727  -6.112  -0.597  1.00 54.95 55 B 1 
ATOM 948 C CG2 . ILE B 2 55 ? -2.349  -6.802  -1.005  1.00 51.37 55 B 1 
ATOM 949 C CD1 . ILE B 2 55 ? -4.580  -4.664  -1.017  1.00 50.07 55 B 1 
ATOM 950 N N   . ILE B 2 56 ? -2.001  -8.359  2.333   1.00 56.26 56 B 1 
ATOM 951 C CA  . ILE B 2 56 ? -0.771  -8.933  2.891   1.00 56.23 56 B 1 
ATOM 952 C C   . ILE B 2 56 ? -0.922  -10.447 3.070   1.00 55.41 56 B 1 
ATOM 953 O O   . ILE B 2 56 ? -0.025  -11.218 2.718   1.00 54.62 56 B 1 
ATOM 954 C CB  . ILE B 2 56 ? -0.423  -8.259  4.233   1.00 55.82 56 B 1 
ATOM 955 C CG1 . ILE B 2 56 ? -0.177  -6.760  4.022   1.00 53.45 56 B 1 
ATOM 956 C CG2 . ILE B 2 56 ? 0.814   -8.913  4.853   1.00 51.00 56 B 1 
ATOM 957 C CD1 . ILE B 2 56 ? -0.127  -5.982  5.320   1.00 49.69 56 B 1 
ATOM 958 N N   . ILE B 2 57 ? -2.054  -10.877 3.615   1.00 56.18 57 B 1 
ATOM 959 C CA  . ILE B 2 57 ? -2.319  -12.304 3.820   1.00 56.51 57 B 1 
ATOM 960 C C   . ILE B 2 57 ? -2.436  -13.027 2.475   1.00 55.11 57 B 1 
ATOM 961 O O   . ILE B 2 57 ? -1.975  -14.163 2.326   1.00 53.79 57 B 1 
ATOM 962 C CB  . ILE B 2 57 ? -3.601  -12.500 4.656   1.00 56.57 57 B 1 
ATOM 963 C CG1 . ILE B 2 57 ? -3.439  -11.846 6.036   1.00 55.13 57 B 1 
ATOM 964 C CG2 . ILE B 2 57 ? -3.916  -13.991 4.816   1.00 52.74 57 B 1 
ATOM 965 C CD1 . ILE B 2 57 ? -4.744  -11.742 6.806   1.00 51.92 57 B 1 
ATOM 966 N N   . PHE B 2 58 ? -3.045  -12.370 1.493   1.00 52.81 58 B 1 
ATOM 967 C CA  . PHE B 2 58 ? -3.222  -12.956 0.161   1.00 53.00 58 B 1 
ATOM 968 C C   . PHE B 2 58 ? -1.880  -13.266 -0.504  1.00 52.06 58 B 1 
ATOM 969 O O   . PHE B 2 58 ? -1.743  -14.275 -1.206  1.00 51.44 58 B 1 
ATOM 970 C CB  . PHE B 2 58 ? -4.032  -12.008 -0.723  1.00 52.18 58 B 1 
ATOM 971 C CG  . PHE B 2 58 ? -4.305  -12.563 -2.096  1.00 49.41 58 B 1 
ATOM 972 C CD1 . PHE B 2 58 ? -5.303  -13.513 -2.294  1.00 45.10 58 B 1 
ATOM 973 C CD2 . PHE B 2 58 ? -3.561  -12.135 -3.190  1.00 45.89 58 B 1 
ATOM 974 C CE1 . PHE B 2 58 ? -5.553  -14.022 -3.559  1.00 43.93 58 B 1 
ATOM 975 C CE2 . PHE B 2 58 ? -3.811  -12.648 -4.462  1.00 43.32 58 B 1 
ATOM 976 C CZ  . PHE B 2 58 ? -4.807  -13.588 -4.644  1.00 44.62 58 B 1 
ATOM 977 N N   . LEU B 2 59 ? -0.893  -12.406 -0.292  1.00 51.83 59 B 1 
ATOM 978 C CA  . LEU B 2 59 ? 0.423   -12.589 -0.900  1.00 51.78 59 B 1 
ATOM 979 C C   . LEU B 2 59 ? 1.328   -13.501 -0.071  1.00 50.64 59 B 1 
ATOM 980 O O   . LEU B 2 59 ? 2.432   -13.846 -0.505  1.00 48.89 59 B 1 
ATOM 981 C CB  . LEU B 2 59 ? 1.089   -11.223 -1.098  1.00 50.49 59 B 1 
ATOM 982 C CG  . LEU B 2 59 ? 0.385   -10.329 -2.126  1.00 47.93 59 B 1 
ATOM 983 C CD1 . LEU B 2 59 ? 0.970   -8.921  -2.095  1.00 44.19 59 B 1 
ATOM 984 C CD2 . LEU B 2 59 ? 0.505   -10.924 -3.527  1.00 45.06 59 B 1 
ATOM 985 N N   . THR B 2 60 ? 0.880   -13.894 1.119   1.00 54.53 60 B 1 
ATOM 986 C CA  . THR B 2 60 ? 1.666   -14.773 1.998   1.00 53.47 60 B 1 
ATOM 987 C C   . THR B 2 60 ? 1.447   -16.232 1.597   1.00 50.55 60 B 1 
ATOM 988 O O   . THR B 2 60 ? 2.426   -16.915 1.238   1.00 47.69 60 B 1 
ATOM 989 C CB  . THR B 2 60 ? 1.284   -14.566 3.470   1.00 49.73 60 B 1 
ATOM 990 O OG1 . THR B 2 60 ? 1.387   -13.186 3.800   1.00 45.95 60 B 1 
ATOM 991 C CG2 . THR B 2 60 ? 2.217   -15.364 4.365   1.00 44.27 60 B 1 
ATOM 992 O OXT . THR B 2 60 ? 0.325   -16.698 1.653   1.00 45.62 60 B 1 
#
