# 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_line12-5s-rrna-5s-ribosomal-rna
#
_entry.id line12-5s-rrna-5s-ribosomal-rna
#
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" 
"C3 H7 N O2 S" 121.158 CYS y CYSTEINE  C([C@@H](C(=O)O)N)S      ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"   75.067  GLY y GLYCINE   C(C(=O)O)N               ? "PEPTIDE LINKING"   
"C4 H9 N O3"   119.119 THR y THREONINE C[C@H]([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 
#
_entity.id               1
_entity.pdbx_description .
_entity.type             polymer
#
_entity_poly.entity_id      1
_entity_poly.pdbx_strand_id K
_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 THR 1   
1 n ALA 2   
1 n THR 3   
1 n GLY 4   
1 n THR 5   
1 n GLY 6   
1 n GLY 7   
1 n THR 8   
1 n THR 9   
1 n ALA 10  
1 n CYS 11  
1 n ALA 12  
1 n ALA 13  
1 n THR 14  
1 n ALA 15  
1 n GLY 16  
1 n CYS 17  
1 n ALA 18  
1 n GLY 19  
1 n ALA 20  
1 n GLY 21  
1 n ALA 22  
1 n GLY 23  
1 n GLY 24  
1 n ALA 25  
1 n THR 26  
1 n ALA 27  
1 n CYS 28  
1 n ALA 29  
1 n CYS 30  
1 n CYS 31  
1 n THR 32  
1 n GLY 33  
1 n THR 34  
1 n THR 35  
1 n CYS 36  
1 n CYS 37  
1 n CYS 38  
1 n ALA 39  
1 n THR 40  
1 n THR 41  
1 n CYS 42  
1 n CYS 43  
1 n GLY 44  
1 n ALA 45  
1 n ALA 46  
1 n CYS 47  
1 n ALA 48  
1 n CYS 49  
1 n ALA 50  
1 n GLY 51  
1 n ALA 52  
1 n ALA 53  
1 n GLY 54  
1 n THR 55  
1 n THR 56  
1 n ALA 57  
1 n ALA 58  
1 n GLY 59  
1 n CYS 60  
1 n THR 61  
1 n CYS 62  
1 n THR 63  
1 n CYS 64  
1 n THR 65  
1 n ALA 66  
1 n GLY 67  
1 n CYS 68  
1 n GLY 69  
1 n CYS 70  
1 n THR 71  
1 n GLY 72  
1 n ALA 73  
1 n THR 74  
1 n GLY 75  
1 n GLY 76  
1 n THR 77  
1 n ALA 78  
1 n CYS 79  
1 n THR 80  
1 n THR 81  
1 n GLY 82  
1 n GLY 83  
1 n THR 84  
1 n GLY 85  
1 n GLY 86  
1 n GLY 87  
1 n ALA 88  
1 n ALA 89  
1 n ALA 90  
1 n CYS 91  
1 n THR 92  
1 n GLY 93  
1 n CYS 94  
1 n CYS 95  
1 n THR 96  
1 n GLY 97  
1 n GLY 98  
1 n GLY 99  
1 n ALA 100 
1 n GLY 101 
1 n ALA 102 
1 n GLY 103 
1 n THR 104 
1 n ALA 105 
1 n GLY 106 
1 n GLY 107 
1 n ALA 108 
1 n CYS 109 
1 n GLY 110 
1 n THR 111 
1 n ALA 112 
1 n GLY 113 
1 n CYS 114 
1 n CYS 115 
1 n ALA 116 
1 n CYS 117 
#
_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 @ 2025-09-01 09:23:08)"
_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 40.22
_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
K THR 1   2 36.80 1 1   
K ALA 2   2 40.69 1 2   
K THR 3   2 38.06 1 3   
K GLY 4   2 38.54 1 4   
K THR 5   2 36.12 1 5   
K GLY 6   2 34.69 1 6   
K GLY 7   2 36.08 1 7   
K THR 8   2 35.42 1 8   
K THR 9   2 41.56 1 9   
K ALA 10  2 44.00 1 10  
K CYS 11  2 44.05 1 11  
K ALA 12  2 45.50 1 12  
K ALA 13  2 45.53 1 13  
K THR 14  2 44.08 1 14  
K ALA 15  2 46.35 1 15  
K GLY 16  2 45.45 1 16  
K CYS 17  2 44.91 1 17  
K ALA 18  2 44.67 1 18  
K GLY 19  2 45.59 1 19  
K ALA 20  2 43.29 1 20  
K GLY 21  2 40.59 1 21  
K ALA 22  2 37.82 1 22  
K GLY 23  2 36.68 1 23  
K GLY 24  2 35.80 1 24  
K ALA 25  2 38.88 1 25  
K THR 26  2 40.50 1 26  
K ALA 27  2 46.79 1 27  
K CYS 28  2 48.48 1 28  
K ALA 29  2 51.19 1 29  
K CYS 30  2 50.80 1 30  
K CYS 31  2 50.67 1 31  
K THR 32  2 50.25 1 32  
K GLY 33  2 50.76 1 33  
K THR 34  2 47.45 1 34  
K THR 35  2 47.53 1 35  
K CYS 36  2 48.04 1 36  
K CYS 37  2 49.33 1 37  
K CYS 38  2 47.18 1 38  
K ALA 39  2 47.17 1 39  
K THR 40  2 45.13 1 40  
K THR 41  2 43.95 1 41  
K CYS 42  2 46.11 1 42  
K CYS 43  2 45.41 1 43  
K GLY 44  2 46.12 1 44  
K ALA 45  2 46.80 1 45  
K ALA 46  2 48.08 1 46  
K CYS 47  2 48.53 1 47  
K ALA 48  2 48.18 1 48  
K CYS 49  2 46.28 1 49  
K ALA 50  2 44.31 1 50  
K GLY 51  2 41.30 1 51  
K ALA 52  2 39.50 1 52  
K ALA 53  2 37.24 1 53  
K GLY 54  2 34.73 1 54  
K THR 55  2 35.17 1 55  
K THR 56  2 35.97 1 56  
K ALA 57  2 38.81 1 57  
K ALA 58  2 38.78 1 58  
K GLY 59  2 40.16 1 59  
K CYS 60  2 41.74 1 60  
K THR 61  2 40.73 1 61  
K CYS 62  2 41.18 1 62  
K THR 63  2 42.01 1 63  
K CYS 64  2 39.48 1 64  
K THR 65  2 40.92 1 65  
K ALA 66  2 40.68 1 66  
K GLY 67  2 42.94 1 67  
K CYS 68  2 42.75 1 68  
K GLY 69  2 43.77 1 69  
K CYS 70  2 43.86 1 70  
K THR 71  2 41.85 1 71  
K GLY 72  2 39.55 1 72  
K ALA 73  2 38.22 1 73  
K THR 74  2 34.17 1 74  
K GLY 75  2 33.71 1 75  
K GLY 76  2 34.32 1 76  
K THR 77  2 33.09 1 77  
K ALA 78  2 34.54 1 78  
K CYS 79  2 33.04 1 79  
K THR 80  2 31.34 1 80  
K THR 81  2 30.96 1 81  
K GLY 82  2 28.96 1 82  
K GLY 83  2 26.83 1 83  
K THR 84  2 29.22 1 84  
K GLY 85  2 28.19 1 85  
K GLY 86  2 31.73 1 86  
K GLY 87  2 34.51 1 87  
K ALA 88  2 36.48 1 88  
K ALA 89  2 40.53 1 89  
K ALA 90  2 43.02 1 90  
K CYS 91  2 41.62 1 91  
K THR 92  2 42.00 1 92  
K GLY 93  2 45.09 1 93  
K CYS 94  2 41.59 1 94  
K CYS 95  2 41.84 1 95  
K THR 96  2 41.00 1 96  
K GLY 97  2 37.85 1 97  
K GLY 98  2 36.46 1 98  
K GLY 99  2 31.91 1 99  
K ALA 100 2 31.57 1 100 
K GLY 101 2 29.41 1 101 
K ALA 102 2 33.60 1 102 
K GLY 103 2 29.50 1 103 
K THR 104 2 31.52 1 104 
K ALA 105 2 34.24 1 105 
K GLY 106 2 34.69 1 106 
K GLY 107 2 34.99 1 107 
K ALA 108 2 37.27 1 108 
K CYS 109 2 37.06 1 109 
K GLY 110 2 37.16 1 110 
K THR 111 2 37.52 1 111 
K ALA 112 2 39.26 1 112 
K GLY 113 2 39.73 1 113 
K CYS 114 2 38.80 1 114 
K CYS 115 2 39.45 1 115 
K ALA 116 2 35.50 1 116 
K CYS 117 2 32.02 1 117 
#
_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   K
_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
K 1   1 n THR . 1   K 1   
K 2   1 n ALA . 2   K 2   
K 3   1 n THR . 3   K 3   
K 4   1 n GLY . 4   K 4   
K 5   1 n THR . 5   K 5   
K 6   1 n GLY . 6   K 6   
K 7   1 n GLY . 7   K 7   
K 8   1 n THR . 8   K 8   
K 9   1 n THR . 9   K 9   
K 10  1 n ALA . 10  K 10  
K 11  1 n CYS . 11  K 11  
K 12  1 n ALA . 12  K 12  
K 13  1 n ALA . 13  K 13  
K 14  1 n THR . 14  K 14  
K 15  1 n ALA . 15  K 15  
K 16  1 n GLY . 16  K 16  
K 17  1 n CYS . 17  K 17  
K 18  1 n ALA . 18  K 18  
K 19  1 n GLY . 19  K 19  
K 20  1 n ALA . 20  K 20  
K 21  1 n GLY . 21  K 21  
K 22  1 n ALA . 22  K 22  
K 23  1 n GLY . 23  K 23  
K 24  1 n GLY . 24  K 24  
K 25  1 n ALA . 25  K 25  
K 26  1 n THR . 26  K 26  
K 27  1 n ALA . 27  K 27  
K 28  1 n CYS . 28  K 28  
K 29  1 n ALA . 29  K 29  
K 30  1 n CYS . 30  K 30  
K 31  1 n CYS . 31  K 31  
K 32  1 n THR . 32  K 32  
K 33  1 n GLY . 33  K 33  
K 34  1 n THR . 34  K 34  
K 35  1 n THR . 35  K 35  
K 36  1 n CYS . 36  K 36  
K 37  1 n CYS . 37  K 37  
K 38  1 n CYS . 38  K 38  
K 39  1 n ALA . 39  K 39  
K 40  1 n THR . 40  K 40  
K 41  1 n THR . 41  K 41  
K 42  1 n CYS . 42  K 42  
K 43  1 n CYS . 43  K 43  
K 44  1 n GLY . 44  K 44  
K 45  1 n ALA . 45  K 45  
K 46  1 n ALA . 46  K 46  
K 47  1 n CYS . 47  K 47  
K 48  1 n ALA . 48  K 48  
K 49  1 n CYS . 49  K 49  
K 50  1 n ALA . 50  K 50  
K 51  1 n GLY . 51  K 51  
K 52  1 n ALA . 52  K 52  
K 53  1 n ALA . 53  K 53  
K 54  1 n GLY . 54  K 54  
K 55  1 n THR . 55  K 55  
K 56  1 n THR . 56  K 56  
K 57  1 n ALA . 57  K 57  
K 58  1 n ALA . 58  K 58  
K 59  1 n GLY . 59  K 59  
K 60  1 n CYS . 60  K 60  
K 61  1 n THR . 61  K 61  
K 62  1 n CYS . 62  K 62  
K 63  1 n THR . 63  K 63  
K 64  1 n CYS . 64  K 64  
K 65  1 n THR . 65  K 65  
K 66  1 n ALA . 66  K 66  
K 67  1 n GLY . 67  K 67  
K 68  1 n CYS . 68  K 68  
K 69  1 n GLY . 69  K 69  
K 70  1 n CYS . 70  K 70  
K 71  1 n THR . 71  K 71  
K 72  1 n GLY . 72  K 72  
K 73  1 n ALA . 73  K 73  
K 74  1 n THR . 74  K 74  
K 75  1 n GLY . 75  K 75  
K 76  1 n GLY . 76  K 76  
K 77  1 n THR . 77  K 77  
K 78  1 n ALA . 78  K 78  
K 79  1 n CYS . 79  K 79  
K 80  1 n THR . 80  K 80  
K 81  1 n THR . 81  K 81  
K 82  1 n GLY . 82  K 82  
K 83  1 n GLY . 83  K 83  
K 84  1 n THR . 84  K 84  
K 85  1 n GLY . 85  K 85  
K 86  1 n GLY . 86  K 86  
K 87  1 n GLY . 87  K 87  
K 88  1 n ALA . 88  K 88  
K 89  1 n ALA . 89  K 89  
K 90  1 n ALA . 90  K 90  
K 91  1 n CYS . 91  K 91  
K 92  1 n THR . 92  K 92  
K 93  1 n GLY . 93  K 93  
K 94  1 n CYS . 94  K 94  
K 95  1 n CYS . 95  K 95  
K 96  1 n THR . 96  K 96  
K 97  1 n GLY . 97  K 97  
K 98  1 n GLY . 98  K 98  
K 99  1 n GLY . 99  K 99  
K 100 1 n ALA . 100 K 100 
K 101 1 n GLY . 101 K 101 
K 102 1 n ALA . 102 K 102 
K 103 1 n GLY . 103 K 103 
K 104 1 n THR . 104 K 104 
K 105 1 n ALA . 105 K 105 
K 106 1 n GLY . 106 K 106 
K 107 1 n GLY . 107 K 107 
K 108 1 n ALA . 108 K 108 
K 109 1 n CYS . 109 K 109 
K 110 1 n GLY . 110 K 110 
K 111 1 n THR . 111 K 111 
K 112 1 n ALA . 112 K 112 
K 113 1 n GLY . 113 K 113 
K 114 1 n CYS . 114 K 114 
K 115 1 n CYS . 115 K 115 
K 116 1 n ALA . 116 K 116 
K 117 1 n CYS . 117 K 117 
#
_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        K
#
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   . THR K 1 1   ? 0.776   -20.638 5.927   1.00 33.30 1   K 1 
ATOM 2   C CA  . THR K 1 1   ? -0.618  -20.572 5.441   1.00 39.08 1   K 1 
ATOM 3   C C   . THR K 1 1   ? -1.531  -20.434 6.647   1.00 39.10 1   K 1 
ATOM 4   O O   . THR K 1 1   ? -1.672  -21.387 7.401   1.00 37.53 1   K 1 
ATOM 5   C CB  . THR K 1 1   ? -1.002  -21.824 4.620   1.00 38.88 1   K 1 
ATOM 6   O OG1 . THR K 1 1   ? 0.045   -22.775 4.660   1.00 35.08 1   K 1 
ATOM 7   C CG2 . THR K 1 1   ? -1.230  -21.471 3.158   1.00 34.63 1   K 1 
ATOM 8   N N   . ALA K 1 2   ? -2.061  -19.251 6.883   1.00 40.43 2   K 1 
ATOM 9   C CA  . ALA K 1 2   ? -3.046  -19.017 7.938   1.00 42.02 2   K 1 
ATOM 10  C C   . ALA K 1 2   ? -4.425  -18.912 7.268   1.00 41.44 2   K 1 
ATOM 11  O O   . ALA K 1 2   ? -4.716  -17.937 6.581   1.00 38.82 2   K 1 
ATOM 12  C CB  . ALA K 1 2   ? -2.662  -17.768 8.736   1.00 40.72 2   K 1 
ATOM 13  N N   . THR K 1 3   ? -5.241  -19.940 7.430   1.00 37.07 3   K 1 
ATOM 14  C CA  . THR K 1 3   ? -6.649  -19.953 7.021   1.00 39.65 3   K 1 
ATOM 15  C C   . THR K 1 3   ? -7.477  -19.308 8.130   1.00 38.52 3   K 1 
ATOM 16  O O   . THR K 1 3   ? -7.770  -19.940 9.141   1.00 37.10 3   K 1 
ATOM 17  C CB  . THR K 1 3   ? -7.136  -21.386 6.718   1.00 40.41 3   K 1 
ATOM 18  O OG1 . THR K 1 3   ? -6.292  -22.355 7.311   1.00 37.01 3   K 1 
ATOM 19  C CG2 . THR K 1 3   ? -7.134  -21.661 5.217   1.00 36.65 3   K 1 
ATOM 20  N N   . GLY K 1 4   ? -7.823  -18.045 7.961   1.00 37.68 4   K 1 
ATOM 21  C CA  . GLY K 1 4   ? -8.789  -17.375 8.828   1.00 39.98 4   K 1 
ATOM 22  C C   . GLY K 1 4   ? -10.208 -17.818 8.463   1.00 39.32 4   K 1 
ATOM 23  O O   . GLY K 1 4   ? -10.715 -17.462 7.402   1.00 37.18 4   K 1 
ATOM 24  N N   . THR K 1 5   ? -10.840 -18.593 9.337   1.00 35.06 5   K 1 
ATOM 25  C CA  . THR K 1 5   ? -12.275 -18.874 9.252   1.00 37.83 5   K 1 
ATOM 26  C C   . THR K 1 5   ? -13.061 -17.706 9.847   1.00 37.46 5   K 1 
ATOM 27  O O   . THR K 1 5   ? -12.933 -17.425 11.035  1.00 35.41 5   K 1 
ATOM 28  C CB  . THR K 1 5   ? -12.636 -20.182 9.984   1.00 37.62 5   K 1 
ATOM 29  O OG1 . THR K 1 5   ? -11.893 -20.312 11.173  1.00 34.68 5   K 1 
ATOM 30  C CG2 . THR K 1 5   ? -12.330 -21.409 9.125   1.00 34.78 5   K 1 
ATOM 31  N N   . GLY K 1 6   ? -13.890 -17.077 9.042   1.00 33.56 6   K 1 
ATOM 32  C CA  . GLY K 1 6   ? -14.966 -16.195 9.486   1.00 35.40 6   K 1 
ATOM 33  C C   . GLY K 1 6   ? -14.539 -14.835 10.052  1.00 35.76 6   K 1 
ATOM 34  O O   . GLY K 1 6   ? -14.245 -14.714 11.233  1.00 34.05 6   K 1 
ATOM 35  N N   . GLY K 1 7   ? -14.601 -13.795 9.232   1.00 35.17 7   K 1 
ATOM 36  C CA  . GLY K 1 7   ? -14.777 -12.398 9.653   1.00 36.57 7   K 1 
ATOM 37  C C   . GLY K 1 7   ? -13.680 -11.734 10.494  1.00 37.18 7   K 1 
ATOM 38  O O   . GLY K 1 7   ? -13.806 -10.548 10.810  1.00 35.41 7   K 1 
ATOM 39  N N   . THR K 1 8   ? -12.629 -12.445 10.852  1.00 35.37 8   K 1 
ATOM 40  C CA  . THR K 1 8   ? -11.505 -11.893 11.608  1.00 36.87 8   K 1 
ATOM 41  C C   . THR K 1 8   ? -10.309 -11.692 10.692  1.00 37.27 8   K 1 
ATOM 42  O O   . THR K 1 8   ? -9.869  -12.607 10.000  1.00 35.44 8   K 1 
ATOM 43  C CB  . THR K 1 8   ? -11.150 -12.756 12.834  1.00 36.00 8   K 1 
ATOM 44  O OG1 . THR K 1 8   ? -11.422 -14.119 12.615  1.00 33.72 8   K 1 
ATOM 45  C CG2 . THR K 1 8   ? -11.971 -12.329 14.049  1.00 33.25 8   K 1 
ATOM 46  N N   . THR K 1 9   ? -9.789  -10.481 10.705  1.00 41.30 9   K 1 
ATOM 47  C CA  . THR K 1 9   ? -8.552  -10.125 10.004  1.00 43.21 9   K 1 
ATOM 48  C C   . THR K 1 9   ? -7.403  -10.946 10.593  1.00 43.47 9   K 1 
ATOM 49  O O   . THR K 1 9   ? -6.889  -10.634 11.663  1.00 42.26 9   K 1 
ATOM 50  C CB  . THR K 1 9   ? -8.275  -8.619  10.148  1.00 42.40 9   K 1 
ATOM 51  O OG1 . THR K 1 9   ? -9.432  -7.877  9.824   1.00 39.83 9   K 1 
ATOM 52  C CG2 . THR K 1 9   ? -7.169  -8.143  9.216   1.00 38.42 9   K 1 
ATOM 53  N N   . ALA K 1 10  ? -7.030  -12.031 9.927   1.00 43.93 10  K 1 
ATOM 54  C CA  . ALA K 1 10  ? -5.904  -12.850 10.344  1.00 44.39 10  K 1 
ATOM 55  C C   . ALA K 1 10  ? -4.597  -12.186 9.880   1.00 45.49 10  K 1 
ATOM 56  O O   . ALA K 1 10  ? -4.255  -12.225 8.698   1.00 43.97 10  K 1 
ATOM 57  C CB  . ALA K 1 10  ? -6.089  -14.272 9.802   1.00 42.22 10  K 1 
ATOM 58  N N   . CYS K 1 11  ? -3.857  -11.607 10.825  1.00 43.60 11  K 1 
ATOM 59  C CA  . CYS K 1 11  ? -2.474  -11.230 10.571  1.00 44.78 11  K 1 
ATOM 60  C C   . CYS K 1 11  ? -1.615  -12.496 10.669  1.00 43.68 11  K 1 
ATOM 61  O O   . CYS K 1 11  ? -1.369  -12.998 11.767  1.00 43.12 11  K 1 
ATOM 62  C CB  . CYS K 1 11  ? -1.994  -10.176 11.572  1.00 45.23 11  K 1 
ATOM 63  S SG  . CYS K 1 11  ? -3.102  -8.820  11.951  1.00 43.92 11  K 1 
ATOM 64  N N   . ALA K 1 12  ? -1.177  -13.018 9.541   1.00 46.41 12  K 1 
ATOM 65  C CA  . ALA K 1 12  ? -0.195  -14.093 9.544   1.00 46.62 12  K 1 
ATOM 66  C C   . ALA K 1 12  ? 1.188   -13.493 9.823   1.00 45.17 12  K 1 
ATOM 67  O O   . ALA K 1 12  ? 1.741   -12.771 8.995   1.00 43.27 12  K 1 
ATOM 68  C CB  . ALA K 1 12  ? -0.267  -14.853 8.218   1.00 46.05 12  K 1 
ATOM 69  N N   . ALA K 1 13  ? 1.749   -13.795 10.990  1.00 47.02 13  K 1 
ATOM 70  C CA  . ALA K 1 13  ? 3.124   -13.458 11.335  1.00 46.30 13  K 1 
ATOM 71  C C   . ALA K 1 13  ? 4.082   -14.447 10.654  1.00 46.29 13  K 1 
ATOM 72  O O   . ALA K 1 13  ? 4.581   -15.373 11.277  1.00 43.84 13  K 1 
ATOM 73  C CB  . ALA K 1 13  ? 3.257   -13.440 12.863  1.00 44.18 13  K 1 
ATOM 74  N N   . THR K 1 14  ? 4.313   -14.272 9.366   1.00 45.98 14  K 1 
ATOM 75  C CA  . THR K 1 14  ? 5.418   -14.957 8.674   1.00 46.30 14  K 1 
ATOM 76  C C   . THR K 1 14  ? 5.947   -14.042 7.578   1.00 45.36 14  K 1 
ATOM 77  O O   . THR K 1 14  ? 5.191   -13.265 7.001   1.00 42.66 14  K 1 
ATOM 78  C CB  . THR K 1 14  ? 5.018   -16.334 8.103   1.00 45.23 14  K 1 
ATOM 79  O OG1 . THR K 1 14  ? 4.114   -17.011 8.954   1.00 41.70 14  K 1 
ATOM 80  C CG2 . THR K 1 14  ? 6.222   -17.258 7.957   1.00 41.34 14  K 1 
ATOM 81  N N   . ALA K 1 15  ? 7.246   -14.121 7.323   1.00 45.50 15  K 1 
ATOM 82  C CA  . ALA K 1 15  ? 7.942   -13.304 6.335   1.00 47.22 15  K 1 
ATOM 83  C C   . ALA K 1 15  ? 7.173   -13.237 5.003   1.00 47.89 15  K 1 
ATOM 84  O O   . ALA K 1 15  ? 6.932   -14.258 4.364   1.00 45.31 15  K 1 
ATOM 85  C CB  . ALA K 1 15  ? 9.350   -13.886 6.150   1.00 45.81 15  K 1 
ATOM 86  N N   . GLY K 1 16  ? 6.775   -12.043 4.626   1.00 45.14 16  K 1 
ATOM 87  C CA  . GLY K 1 16  ? 5.840   -11.783 3.533   1.00 45.86 16  K 1 
ATOM 88  C C   . GLY K 1 16  ? 4.425   -11.528 4.057   1.00 46.33 16  K 1 
ATOM 89  O O   . GLY K 1 16  ? 3.559   -12.390 3.964   1.00 44.47 16  K 1 
ATOM 90  N N   . CYS K 1 17  ? 4.189   -10.355 4.640   1.00 45.47 17  K 1 
ATOM 91  C CA  . CYS K 1 17  ? 2.865   -9.961  5.113   1.00 45.89 17  K 1 
ATOM 92  C C   . CYS K 1 17  ? 1.929   -9.674  3.933   1.00 44.96 17  K 1 
ATOM 93  O O   . CYS K 1 17  ? 1.733   -8.526  3.540   1.00 43.66 17  K 1 
ATOM 94  C CB  . CYS K 1 17  ? 2.972   -8.734  6.021   1.00 45.43 17  K 1 
ATOM 95  S SG  . CYS K 1 17  ? 4.052   -8.889  7.456   1.00 44.06 17  K 1 
ATOM 96  N N   . ALA K 1 18  ? 1.340   -10.715 3.391   1.00 45.83 18  K 1 
ATOM 97  C CA  . ALA K 1 18  ? 0.150   -10.593 2.571   1.00 45.69 18  K 1 
ATOM 98  C C   . ALA K 1 18  ? -1.059  -10.830 3.489   1.00 44.87 18  K 1 
ATOM 99  O O   . ALA K 1 18  ? -1.471  -11.966 3.707   1.00 42.61 18  K 1 
ATOM 100 C CB  . ALA K 1 18  ? 0.242   -11.564 1.392   1.00 44.34 18  K 1 
ATOM 101 N N   . GLY K 1 19  ? -1.591  -9.763  4.079   1.00 46.47 19  K 1 
ATOM 102 C CA  . GLY K 1 19  ? -2.860  -9.823  4.798   1.00 46.43 19  K 1 
ATOM 103 C C   . GLY K 1 19  ? -3.988  -10.032 3.791   1.00 45.53 19  K 1 
ATOM 104 O O   . GLY K 1 19  ? -4.510  -9.067  3.246   1.00 43.92 19  K 1 
ATOM 105 N N   . ALA K 1 20  ? -4.352  -11.284 3.517   1.00 44.60 20  K 1 
ATOM 106 C CA  . ALA K 1 20  ? -5.562  -11.581 2.769   1.00 44.08 20  K 1 
ATOM 107 C C   . ALA K 1 20  ? -6.753  -11.445 3.732   1.00 43.54 20  K 1 
ATOM 108 O O   . ALA K 1 20  ? -7.044  -12.353 4.506   1.00 41.74 20  K 1 
ATOM 109 C CB  . ALA K 1 20  ? -5.440  -12.966 2.129   1.00 42.47 20  K 1 
ATOM 110 N N   . GLY K 1 21  ? -7.419  -10.299 3.705   1.00 41.42 21  K 1 
ATOM 111 C CA  . GLY K 1 21  ? -8.709  -10.145 4.368   1.00 41.62 21  K 1 
ATOM 112 C C   . GLY K 1 21  ? -9.731  -11.048 3.673   1.00 40.53 21  K 1 
ATOM 113 O O   . GLY K 1 21  ? -10.052 -10.830 2.506   1.00 38.79 21  K 1 
ATOM 114 N N   . ALA K 1 22  ? -10.227 -12.072 4.372   1.00 38.90 22  K 1 
ATOM 115 C CA  . ALA K 1 22  ? -11.345 -12.856 3.872   1.00 38.47 22  K 1 
ATOM 116 C C   . ALA K 1 22  ? -12.610 -11.983 3.878   1.00 38.19 22  K 1 
ATOM 117 O O   . ALA K 1 22  ? -12.968 -11.416 4.908   1.00 36.40 22  K 1 
ATOM 118 C CB  . ALA K 1 22  ? -11.492 -14.123 4.719   1.00 37.13 22  K 1 
ATOM 119 N N   . GLY K 1 23  ? -13.275 -11.882 2.740   1.00 37.24 23  K 1 
ATOM 120 C CA  . GLY K 1 23  ? -14.613 -11.310 2.634   1.00 36.97 23  K 1 
ATOM 121 C C   . GLY K 1 23  ? -14.728 -9.815  2.958   1.00 36.99 23  K 1 
ATOM 122 O O   . GLY K 1 23  ? -15.244 -9.448  4.005   1.00 35.52 23  K 1 
ATOM 123 N N   . GLY K 1 24  ? -14.317 -8.954  2.036   1.00 35.79 24  K 1 
ATOM 124 C CA  . GLY K 1 24  ? -14.719 -7.540  2.030   1.00 35.98 24  K 1 
ATOM 125 C C   . GLY K 1 24  ? -14.141 -6.640  3.131   1.00 36.46 24  K 1 
ATOM 126 O O   . GLY K 1 24  ? -14.497 -5.463  3.190   1.00 34.95 24  K 1 
ATOM 127 N N   . ALA K 1 25  ? -13.269 -7.153  3.985   1.00 38.98 25  K 1 
ATOM 128 C CA  . ALA K 1 25  ? -12.607 -6.348  5.000   1.00 39.32 25  K 1 
ATOM 129 C C   . ALA K 1 25  ? -11.323 -5.720  4.440   1.00 39.95 25  K 1 
ATOM 130 O O   . ALA K 1 25  ? -10.442 -6.413  3.928   1.00 38.52 25  K 1 
ATOM 131 C CB  . ALA K 1 25  ? -12.364 -7.203  6.246   1.00 37.63 25  K 1 
ATOM 132 N N   . THR K 1 26  ? -11.214 -4.413  4.579   1.00 40.92 26  K 1 
ATOM 133 C CA  . THR K 1 26  ? -9.973  -3.684  4.305   1.00 41.97 26  K 1 
ATOM 134 C C   . THR K 1 26  ? -8.933  -4.085  5.349   1.00 42.32 26  K 1 
ATOM 135 O O   . THR K 1 26  ? -9.060  -3.728  6.516   1.00 41.13 26  K 1 
ATOM 136 C CB  . THR K 1 26  ? -10.224 -2.171  4.351   1.00 40.86 26  K 1 
ATOM 137 O OG1 . THR K 1 26  ? -11.276 -1.831  3.471   1.00 38.73 26  K 1 
ATOM 138 C CG2 . THR K 1 26  ? -8.998  -1.377  3.924   1.00 37.56 26  K 1 
ATOM 139 N N   . ALA K 1 27  ? -7.926  -4.845  4.948   1.00 46.29 27  K 1 
ATOM 140 C CA  . ALA K 1 27  ? -6.818  -5.204  5.818   1.00 47.15 27  K 1 
ATOM 141 C C   . ALA K 1 27  ? -5.626  -4.285  5.522   1.00 48.16 27  K 1 
ATOM 142 O O   . ALA K 1 27  ? -4.988  -4.411  4.477   1.00 46.99 27  K 1 
ATOM 143 C CB  . ALA K 1 27  ? -6.495  -6.690  5.629   1.00 45.37 27  K 1 
ATOM 144 N N   . CYS K 1 28  ? -5.317  -3.385  6.454   1.00 48.63 28  K 1 
ATOM 145 C CA  . CYS K 1 28  ? -4.052  -2.671  6.436   1.00 49.31 28  K 1 
ATOM 146 C C   . CYS K 1 28  ? -3.041  -3.514  7.219   1.00 49.36 28  K 1 
ATOM 147 O O   . CYS K 1 28  ? -3.177  -3.668  8.430   1.00 48.08 28  K 1 
ATOM 148 C CB  . CYS K 1 28  ? -4.201  -1.264  7.029   1.00 48.44 28  K 1 
ATOM 149 S SG  . CYS K 1 28  ? -5.621  -0.258  6.497   1.00 47.04 28  K 1 
ATOM 150 N N   . ALA K 1 29  ? -2.074  -4.090  6.531   1.00 51.03 29  K 1 
ATOM 151 C CA  . ALA K 1 29  ? -0.992  -4.823  7.168   1.00 51.83 29  K 1 
ATOM 152 C C   . ALA K 1 29  ? 0.258   -3.937  7.213   1.00 52.70 29  K 1 
ATOM 153 O O   . ALA K 1 29  ? 0.775   -3.519  6.176   1.00 50.73 29  K 1 
ATOM 154 C CB  . ALA K 1 29  ? -0.763  -6.144  6.431   1.00 49.65 29  K 1 
ATOM 155 N N   . CYS K 1 30  ? 0.738   -3.674  8.413   1.00 51.25 30  K 1 
ATOM 156 C CA  . CYS K 1 30  ? 2.000   -2.991  8.640   1.00 51.82 30  K 1 
ATOM 157 C C   . CYS K 1 30  ? 3.042   -4.037  9.019   1.00 52.12 30  K 1 
ATOM 158 O O   . CYS K 1 30  ? 2.841   -4.779  9.978   1.00 49.82 30  K 1 
ATOM 159 C CB  . CYS K 1 30  ? 1.873   -1.954  9.765   1.00 51.53 30  K 1 
ATOM 160 S SG  . CYS K 1 30  ? 0.210   -1.365  10.128  1.00 48.27 30  K 1 
ATOM 161 N N   . CYS K 1 31  ? 4.130   -4.088  8.288   1.00 52.40 31  K 1 
ATOM 162 C CA  . CYS K 1 31  ? 5.208   -5.019  8.571   1.00 52.07 31  K 1 
ATOM 163 C C   . CYS K 1 31  ? 6.428   -4.242  9.052   1.00 51.37 31  K 1 
ATOM 164 O O   . CYS K 1 31  ? 7.015   -3.466  8.297   1.00 48.55 31  K 1 
ATOM 165 C CB  . CYS K 1 31  ? 5.522   -5.847  7.326   1.00 50.81 31  K 1 
ATOM 166 S SG  . CYS K 1 31  ? 4.072   -6.696  6.671   1.00 48.82 31  K 1 
ATOM 167 N N   . THR K 1 32  ? 6.813   -4.495  10.286  1.00 52.17 32  K 1 
ATOM 168 C CA  . THR K 1 32  ? 8.090   -4.021  10.823  1.00 52.99 32  K 1 
ATOM 169 C C   . THR K 1 32  ? 8.967   -5.237  11.114  1.00 51.57 32  K 1 
ATOM 170 O O   . THR K 1 32  ? 8.745   -5.966  12.078  1.00 48.13 32  K 1 
ATOM 171 C CB  . THR K 1 32  ? 7.902   -3.125  12.060  1.00 52.26 32  K 1 
ATOM 172 O OG1 . THR K 1 32  ? 6.889   -3.614  12.907  1.00 47.98 32  K 1 
ATOM 173 C CG2 . THR K 1 32  ? 7.502   -1.704  11.657  1.00 46.64 32  K 1 
ATOM 174 N N   . GLY K 1 33  ? 9.922   -5.490  10.240  1.00 50.86 33  K 1 
ATOM 175 C CA  . GLY K 1 33  ? 10.748  -6.693  10.301  1.00 51.46 33  K 1 
ATOM 176 C C   . GLY K 1 33  ? 9.917   -7.964  10.090  1.00 51.49 33  K 1 
ATOM 177 O O   . GLY K 1 33  ? 9.265   -8.114  9.064   1.00 49.22 33  K 1 
ATOM 178 N N   . THR K 1 34  ? 9.922   -8.871  11.072  1.00 48.21 34  K 1 
ATOM 179 C CA  . THR K 1 34  ? 9.152   -10.128 11.049  1.00 49.47 34  K 1 
ATOM 180 C C   . THR K 1 34  ? 7.755   -10.000 11.663  1.00 49.90 34  K 1 
ATOM 181 O O   . THR K 1 34  ? 7.020   -10.982 11.709  1.00 47.35 34  K 1 
ATOM 182 C CB  . THR K 1 34  ? 9.929   -11.234 11.779  1.00 47.99 34  K 1 
ATOM 183 O OG1 . THR K 1 34  ? 10.309  -10.781 13.059  1.00 45.11 34  K 1 
ATOM 184 C CG2 . THR K 1 34  ? 11.206  -11.614 11.033  1.00 44.12 34  K 1 
ATOM 185 N N   . THR K 1 35  ? 7.389   -8.833  12.163  1.00 46.78 35  K 1 
ATOM 186 C CA  . THR K 1 35  ? 6.111   -8.610  12.846  1.00 49.48 35  K 1 
ATOM 187 C C   . THR K 1 35  ? 5.125   -7.920  11.912  1.00 50.54 35  K 1 
ATOM 188 O O   . THR K 1 35  ? 5.401   -6.837  11.395  1.00 49.00 35  K 1 
ATOM 189 C CB  . THR K 1 35  ? 6.292   -7.802  14.137  1.00 48.80 35  K 1 
ATOM 190 O OG1 . THR K 1 35  ? 7.322   -8.372  14.916  1.00 44.71 35  K 1 
ATOM 191 C CG2 . THR K 1 35  ? 5.031   -7.810  14.997  1.00 43.40 35  K 1 
ATOM 192 N N   . CYS K 1 36  ? 3.961   -8.547  11.734  1.00 48.04 36  K 1 
ATOM 193 C CA  . CYS K 1 36  ? 2.850   -7.998  10.978  1.00 48.69 36  K 1 
ATOM 194 C C   . CYS K 1 36  ? 1.767   -7.535  11.949  1.00 49.02 36  K 1 
ATOM 195 O O   . CYS K 1 36  ? 1.260   -8.334  12.733  1.00 47.74 36  K 1 
ATOM 196 C CB  . CYS K 1 36  ? 2.290   -9.056  10.023  1.00 48.55 36  K 1 
ATOM 197 S SG  . CYS K 1 36  ? 3.528   -9.962  9.066   1.00 46.22 36  K 1 
ATOM 198 N N   . CYS K 1 37  ? 1.402   -6.279  11.887  1.00 50.31 37  K 1 
ATOM 199 C CA  . CYS K 1 37  ? 0.299   -5.718  12.656  1.00 50.50 37  K 1 
ATOM 200 C C   . CYS K 1 37  ? -0.827  -5.330  11.698  1.00 49.55 37  K 1 
ATOM 201 O O   . CYS K 1 37  ? -0.593  -4.626  10.718  1.00 47.62 37  K 1 
ATOM 202 C CB  . CYS K 1 37  ? 0.794   -4.515  13.467  1.00 50.10 37  K 1 
ATOM 203 S SG  . CYS K 1 37  ? 2.035   -5.035  14.680  1.00 47.92 37  K 1 
ATOM 204 N N   . CYS K 1 38  ? -2.049  -5.765  11.987  1.00 49.29 38  K 1 
ATOM 205 C CA  . CYS K 1 38  ? -3.223  -5.238  11.300  1.00 48.54 38  K 1 
ATOM 206 C C   . CYS K 1 38  ? -3.686  -3.994  12.052  1.00 46.84 38  K 1 
ATOM 207 O O   . CYS K 1 38  ? -4.208  -4.098  13.162  1.00 44.57 38  K 1 
ATOM 208 C CB  . CYS K 1 38  ? -4.332  -6.286  11.201  1.00 47.96 38  K 1 
ATOM 209 S SG  . CYS K 1 38  ? -3.823  -7.853  10.463  1.00 45.88 38  K 1 
ATOM 210 N N   . ALA K 1 39  ? -3.462  -2.841  11.475  1.00 48.55 39  K 1 
ATOM 211 C CA  . ALA K 1 39  ? -3.848  -1.559  12.044  1.00 48.30 39  K 1 
ATOM 212 C C   . ALA K 1 39  ? -4.428  -0.666  10.947  1.00 47.89 39  K 1 
ATOM 213 O O   . ALA K 1 39  ? -4.035  -0.747  9.782   1.00 44.86 39  K 1 
ATOM 214 C CB  . ALA K 1 39  ? -2.637  -0.921  12.740  1.00 46.27 39  K 1 
ATOM 215 N N   . THR K 1 40  ? -5.347  0.204   11.330  1.00 46.98 40  K 1 
ATOM 216 C CA  . THR K 1 40  ? -5.906  1.238   10.442  1.00 47.56 40  K 1 
ATOM 217 C C   . THR K 1 40  ? -4.911  2.366   10.167  1.00 47.57 40  K 1 
ATOM 218 O O   . THR K 1 40  ? -5.076  3.114   9.210   1.00 44.75 40  K 1 
ATOM 219 C CB  . THR K 1 40  ? -7.181  1.829   11.055  1.00 45.86 40  K 1 
ATOM 220 O OG1 . THR K 1 40  ? -6.964  2.127   12.421  1.00 42.18 40  K 1 
ATOM 221 C CG2 . THR K 1 40  ? -8.346  0.843   10.987  1.00 41.02 40  K 1 
ATOM 222 N N   . THR K 1 41  ? -3.889  2.483   10.993  1.00 45.22 41  K 1 
ATOM 223 C CA  . THR K 1 41  ? -2.829  3.487   10.848  1.00 46.18 41  K 1 
ATOM 224 C C   . THR K 1 41  ? -1.477  2.807   10.992  1.00 46.20 41  K 1 
ATOM 225 O O   . THR K 1 41  ? -1.196  2.199   12.024  1.00 44.14 41  K 1 
ATOM 226 C CB  . THR K 1 41  ? -2.977  4.607   11.888  1.00 44.85 41  K 1 
ATOM 227 O OG1 . THR K 1 41  ? -4.308  5.075   11.928  1.00 41.13 41  K 1 
ATOM 228 C CG2 . THR K 1 41  ? -2.085  5.802   11.566  1.00 39.94 41  K 1 
ATOM 229 N N   . CYS K 1 42  ? -0.667  2.895   9.956   1.00 46.42 42  K 1 
ATOM 230 C CA  . CYS K 1 42  ? 0.669   2.320   9.943   1.00 46.96 42  K 1 
ATOM 231 C C   . CYS K 1 42  ? 1.706   3.435   9.832   1.00 46.41 42  K 1 
ATOM 232 O O   . CYS K 1 42  ? 1.728   4.175   8.850   1.00 44.83 42  K 1 
ATOM 233 C CB  . CYS K 1 42  ? 0.811   1.351   8.772   1.00 46.65 42  K 1 
ATOM 234 S SG  . CYS K 1 42  ? -0.335  -0.032  8.736   1.00 45.40 42  K 1 
ATOM 235 N N   . CYS K 1 43  ? 2.588   3.497   10.803  1.00 47.73 43  K 1 
ATOM 236 C CA  . CYS K 1 43  ? 3.800   4.304   10.732  1.00 46.79 43  K 1 
ATOM 237 C C   . CYS K 1 43  ? 4.996   3.355   10.592  1.00 45.71 43  K 1 
ATOM 238 O O   . CYS K 1 43  ? 5.471   2.800   11.580  1.00 42.83 43  K 1 
ATOM 239 C CB  . CYS K 1 43  ? 3.898   5.187   11.983  1.00 46.05 43  K 1 
ATOM 240 S SG  . CYS K 1 43  ? 2.517   6.358   12.058  1.00 43.38 43  K 1 
ATOM 241 N N   . GLY K 1 44  ? 5.443   3.117   9.376   1.00 45.56 44  K 1 
ATOM 242 C CA  . GLY K 1 44  ? 6.563   2.212   9.106   1.00 46.95 44  K 1 
ATOM 243 C C   . GLY K 1 44  ? 6.907   2.145   7.623   1.00 46.80 44  K 1 
ATOM 244 O O   . GLY K 1 44  ? 6.114   2.549   6.775   1.00 45.17 44  K 1 
ATOM 245 N N   . ALA K 1 45  ? 8.097   1.626   7.312   1.00 46.49 45  K 1 
ATOM 246 C CA  . ALA K 1 45  ? 8.711   1.717   5.984   1.00 47.66 45  K 1 
ATOM 247 C C   . ALA K 1 45  ? 7.982   0.950   4.861   1.00 48.11 45  K 1 
ATOM 248 O O   . ALA K 1 45  ? 8.287   1.167   3.691   1.00 45.96 45  K 1 
ATOM 249 C CB  . ALA K 1 45  ? 10.165  1.254   6.120   1.00 45.80 45  K 1 
ATOM 250 N N   . ALA K 1 46  ? 7.060   0.050   5.187   1.00 47.97 46  K 1 
ATOM 251 C CA  . ALA K 1 46  ? 6.303   -0.704  4.196   1.00 48.89 46  K 1 
ATOM 252 C C   . ALA K 1 46  ? 4.891   -0.992  4.711   1.00 49.19 46  K 1 
ATOM 253 O O   . ALA K 1 46  ? 4.671   -1.933  5.471   1.00 47.07 46  K 1 
ATOM 254 C CB  . ALA K 1 46  ? 7.076   -1.982  3.849   1.00 47.30 46  K 1 
ATOM 255 N N   . CYS K 1 47  ? 3.944   -0.185  4.283   1.00 48.16 47  K 1 
ATOM 256 C CA  . CYS K 1 47  ? 2.530   -0.454  4.491   1.00 49.27 47  K 1 
ATOM 257 C C   . CYS K 1 47  ? 1.925   -0.934  3.176   1.00 49.12 47  K 1 
ATOM 258 O O   . CYS K 1 47  ? 1.914   -0.199  2.191   1.00 47.93 47  K 1 
ATOM 259 C CB  . CYS K 1 47  ? 1.829   0.801   5.008   1.00 49.09 47  K 1 
ATOM 260 S SG  . CYS K 1 47  ? 2.484   1.286   6.620   1.00 47.59 47  K 1 
ATOM 261 N N   . ALA K 1 48  ? 1.421   -2.163  3.173   1.00 49.41 48  K 1 
ATOM 262 C CA  . ALA K 1 48  ? 0.669   -2.698  2.053   1.00 49.17 48  K 1 
ATOM 263 C C   . ALA K 1 48  ? -0.809  -2.760  2.448   1.00 48.12 48  K 1 
ATOM 264 O O   . ALA K 1 48  ? -1.192  -3.514  3.342   1.00 46.23 48  K 1 
ATOM 265 C CB  . ALA K 1 48  ? 1.248   -4.058  1.659   1.00 47.95 48  K 1 
ATOM 266 N N   . CYS K 1 49  ? -1.630  -1.968  1.789   1.00 47.64 49  K 1 
ATOM 267 C CA  . CYS K 1 49  ? -3.075  -2.065  1.903   1.00 47.41 49  K 1 
ATOM 268 C C   . CYS K 1 49  ? -3.578  -2.973  0.778   1.00 46.20 49  K 1 
ATOM 269 O O   . CYS K 1 49  ? -3.601  -2.572  -0.383  1.00 44.80 49  K 1 
ATOM 270 C CB  . CYS K 1 49  ? -3.690  -0.664  1.861   1.00 46.55 49  K 1 
ATOM 271 S SG  . CYS K 1 49  ? -3.133  0.377   3.246   1.00 45.09 49  K 1 
ATOM 272 N N   . ALA K 1 50  ? -3.948  -4.201  1.130   1.00 46.25 50  K 1 
ATOM 273 C CA  . ALA K 1 50  ? -4.575  -5.120  0.194   1.00 45.33 50  K 1 
ATOM 274 C C   . ALA K 1 50  ? -6.096  -5.047  0.392   1.00 43.55 50  K 1 
ATOM 275 O O   . ALA K 1 50  ? -6.631  -5.585  1.360   1.00 41.89 50  K 1 
ATOM 276 C CB  . ALA K 1 50  ? -3.990  -6.522  0.394   1.00 44.52 50  K 1 
ATOM 277 N N   . GLY K 1 51  ? -6.787  -4.363  -0.511  1.00 42.94 51  K 1 
ATOM 278 C CA  . GLY K 1 51  ? -8.235  -4.490  -0.628  1.00 42.22 51  K 1 
ATOM 279 C C   . GLY K 1 51  ? -8.583  -5.801  -1.336  1.00 40.72 51  K 1 
ATOM 280 O O   . GLY K 1 51  ? -7.958  -6.135  -2.344  1.00 39.34 51  K 1 
ATOM 281 N N   . ALA K 1 52  ? -9.577  -6.546  -0.831  1.00 40.80 52  K 1 
ATOM 282 C CA  . ALA K 1 52  ? -10.147 -7.644  -1.600  1.00 40.39 52  K 1 
ATOM 283 C C   . ALA K 1 52  ? -10.712 -7.104  -2.928  1.00 39.35 52  K 1 
ATOM 284 O O   . ALA K 1 52  ? -11.170 -5.961  -2.997  1.00 37.72 52  K 1 
ATOM 285 C CB  . ALA K 1 52  ? -11.206 -8.363  -0.760  1.00 39.23 52  K 1 
ATOM 286 N N   . ALA K 1 53  ? -10.674 -7.921  -3.978  1.00 38.18 53  K 1 
ATOM 287 C CA  . ALA K 1 53  ? -11.194 -7.534  -5.284  1.00 37.48 53  K 1 
ATOM 288 C C   . ALA K 1 53  ? -12.633 -7.003  -5.146  1.00 37.17 53  K 1 
ATOM 289 O O   . ALA K 1 53  ? -13.511 -7.697  -4.644  1.00 36.28 53  K 1 
ATOM 290 C CB  . ALA K 1 53  ? -11.108 -8.737  -6.225  1.00 37.07 53  K 1 
ATOM 291 N N   . GLY K 1 54  ? -12.849 -5.760  -5.565  1.00 35.31 54  K 1 
ATOM 292 C CA  . GLY K 1 54  ? -14.148 -5.093  -5.493  1.00 35.01 54  K 1 
ATOM 293 C C   . GLY K 1 54  ? -14.436 -4.303  -4.211  1.00 34.93 54  K 1 
ATOM 294 O O   . GLY K 1 54  ? -15.495 -3.686  -4.130  1.00 33.66 54  K 1 
ATOM 295 N N   . THR K 1 55  ? -13.528 -4.273  -3.245  1.00 36.10 55  K 1 
ATOM 296 C CA  . THR K 1 55  ? -13.682 -3.400  -2.071  1.00 36.31 55  K 1 
ATOM 297 C C   . THR K 1 55  ? -12.707 -2.235  -2.128  1.00 35.86 55  K 1 
ATOM 298 O O   . THR K 1 55  ? -11.495 -2.409  -2.243  1.00 34.60 55  K 1 
ATOM 299 C CB  . THR K 1 55  ? -13.575 -4.162  -0.743  1.00 35.64 55  K 1 
ATOM 300 O OG1 . THR K 1 55  ? -12.441 -4.986  -0.697  1.00 34.02 55  K 1 
ATOM 301 C CG2 . THR K 1 55  ? -14.799 -5.058  -0.533  1.00 33.68 55  K 1 
ATOM 302 N N   . THR K 1 56  ? -13.251 -1.040  -2.030  1.00 37.32 56  K 1 
ATOM 303 C CA  . THR K 1 56  ? -12.463 0.177   -1.851  1.00 37.44 56  K 1 
ATOM 304 C C   . THR K 1 56  ? -11.735 0.070   -0.515  1.00 36.90 56  K 1 
ATOM 305 O O   . THR K 1 56  ? -12.378 -0.104  0.517   1.00 35.53 56  K 1 
ATOM 306 C CB  . THR K 1 56  ? -13.375 1.415   -1.866  1.00 36.55 56  K 1 
ATOM 307 O OG1 . THR K 1 56  ? -14.243 1.360   -2.975  1.00 34.35 56  K 1 
ATOM 308 C CG2 . THR K 1 56  ? -12.591 2.723   -1.982  1.00 33.67 56  K 1 
ATOM 309 N N   . ALA K 1 57  ? -10.413 0.195   -0.528  1.00 39.10 57  K 1 
ATOM 310 C CA  . ALA K 1 57  ? -9.613  0.378   0.679   1.00 39.26 57  K 1 
ATOM 311 C C   . ALA K 1 57  ? -9.870  1.780   1.269   1.00 39.23 57  K 1 
ATOM 312 O O   . ALA K 1 57  ? -8.974  2.611   1.375   1.00 38.51 57  K 1 
ATOM 313 C CB  . ALA K 1 57  ? -8.141  0.099   0.346   1.00 37.97 57  K 1 
ATOM 314 N N   . ALA K 1 58  ? -11.128 2.057   1.607   1.00 38.64 58  K 1 
ATOM 315 C CA  . ALA K 1 58  ? -11.515 3.286   2.266   1.00 39.03 58  K 1 
ATOM 316 C C   . ALA K 1 58  ? -10.983 3.236   3.701   1.00 39.89 58  K 1 
ATOM 317 O O   . ALA K 1 58  ? -11.376 2.382   4.492   1.00 38.75 58  K 1 
ATOM 318 C CB  . ALA K 1 58  ? -13.041 3.438   2.195   1.00 37.58 58  K 1 
ATOM 319 N N   . GLY K 1 59  ? -10.084 4.140   4.014   1.00 39.31 59  K 1 
ATOM 320 C CA  . GLY K 1 59  ? -9.598  4.342   5.380   1.00 40.28 59  K 1 
ATOM 321 C C   . GLY K 1 59  ? -8.151  3.944   5.654   1.00 41.02 59  K 1 
ATOM 322 O O   . GLY K 1 59  ? -7.685  4.187   6.763   1.00 40.04 59  K 1 
ATOM 323 N N   . CYS K 1 60  ? -7.404  3.407   4.693   1.00 40.83 60  K 1 
ATOM 324 C CA  . CYS K 1 60  ? -5.958  3.300   4.848   1.00 42.02 60  K 1 
ATOM 325 C C   . CYS K 1 60  ? -5.314  4.680   4.680   1.00 42.14 60  K 1 
ATOM 326 O O   . CYS K 1 60  ? -4.847  5.047   3.604   1.00 42.01 60  K 1 
ATOM 327 C CB  . CYS K 1 60  ? -5.370  2.269   3.874   1.00 42.19 60  K 1 
ATOM 328 S SG  . CYS K 1 60  ? -5.653  0.528   4.286   1.00 41.25 60  K 1 
ATOM 329 N N   . THR K 1 61  ? -5.275  5.438   5.762   1.00 41.50 61  K 1 
ATOM 330 C CA  . THR K 1 61  ? -4.469  6.658   5.829   1.00 42.30 61  K 1 
ATOM 331 C C   . THR K 1 61  ? -3.059  6.254   6.248   1.00 42.13 61  K 1 
ATOM 332 O O   . THR K 1 61  ? -2.707  6.281   7.423   1.00 40.96 61  K 1 
ATOM 333 C CB  . THR K 1 61  ? -5.081  7.708   6.768   1.00 41.86 61  K 1 
ATOM 334 O OG1 . THR K 1 61  ? -6.479  7.766   6.614   1.00 38.71 61  K 1 
ATOM 335 C CG2 . THR K 1 61  ? -4.538  9.103   6.451   1.00 37.64 61  K 1 
ATOM 336 N N   . CYS K 1 62  ? -2.256  5.818   5.281   1.00 40.70 62  K 1 
ATOM 337 C CA  . CYS K 1 62  ? -0.839  5.581   5.520   1.00 41.62 62  K 1 
ATOM 338 C C   . CYS K 1 62  ? -0.123  6.930   5.584   1.00 41.45 62  K 1 
ATOM 339 O O   . CYS K 1 62  ? 0.205   7.521   4.558   1.00 40.82 62  K 1 
ATOM 340 C CB  . CYS K 1 62  ? -0.271  4.677   4.423   1.00 41.73 62  K 1 
ATOM 341 S SG  . CYS K 1 62  ? -0.921  2.993   4.542   1.00 40.75 62  K 1 
ATOM 342 N N   . THR K 1 63  ? 0.154   7.398   6.789   1.00 43.41 63  K 1 
ATOM 343 C CA  . THR K 1 63  ? 1.072   8.525   6.989   1.00 43.78 63  K 1 
ATOM 344 C C   . THR K 1 63  ? 2.500   7.977   6.996   1.00 42.72 63  K 1 
ATOM 345 O O   . THR K 1 63  ? 3.127   7.825   8.040   1.00 41.44 63  K 1 
ATOM 346 C CB  . THR K 1 63  ? 0.741   9.323   8.262   1.00 43.25 63  K 1 
ATOM 347 O OG1 . THR K 1 63  ? -0.650  9.458   8.425   1.00 40.17 63  K 1 
ATOM 348 C CG2 . THR K 1 63  ? 1.323   10.737  8.188   1.00 39.27 63  K 1 
ATOM 349 N N   . CYS K 1 64  ? 2.984   7.599   5.813   1.00 40.10 64  K 1 
ATOM 350 C CA  . CYS K 1 64  ? 4.359   7.151   5.641   1.00 40.18 64  K 1 
ATOM 351 C C   . CYS K 1 64  ? 5.197   8.335   5.172   1.00 39.38 64  K 1 
ATOM 352 O O   . CYS K 1 64  ? 4.988   8.857   4.080   1.00 38.73 64  K 1 
ATOM 353 C CB  . CYS K 1 64  ? 4.408   5.989   4.645   1.00 39.88 64  K 1 
ATOM 354 S SG  . CYS K 1 64  ? 3.550   4.542   5.316   1.00 38.61 64  K 1 
ATOM 355 N N   . THR K 1 65  ? 6.179   8.714   5.971   1.00 42.59 65  K 1 
ATOM 356 C CA  . THR K 1 65  ? 7.122   9.791   5.616   1.00 43.09 65  K 1 
ATOM 357 C C   . THR K 1 65  ? 8.043   9.406   4.446   1.00 41.88 65  K 1 
ATOM 358 O O   . THR K 1 65  ? 8.623   10.280  3.813   1.00 39.90 65  K 1 
ATOM 359 C CB  . THR K 1 65  ? 7.965   10.193  6.843   1.00 41.90 65  K 1 
ATOM 360 O OG1 . THR K 1 65  ? 7.210   10.084  8.032   1.00 38.78 65  K 1 
ATOM 361 C CG2 . THR K 1 65  ? 8.456   11.639  6.773   1.00 38.27 65  K 1 
ATOM 362 N N   . ALA K 1 66  ? 8.157   8.121   4.137   1.00 40.01 66  K 1 
ATOM 363 C CA  . ALA K 1 66  ? 8.870   7.625   2.964   1.00 41.51 66  K 1 
ATOM 364 C C   . ALA K 1 66  ? 8.311   6.262   2.526   1.00 42.15 66  K 1 
ATOM 365 O O   . ALA K 1 66  ? 8.201   5.345   3.341   1.00 40.12 66  K 1 
ATOM 366 C CB  . ALA K 1 66  ? 10.367  7.534   3.298   1.00 39.63 66  K 1 
ATOM 367 N N   . GLY K 1 67  ? 7.991   6.113   1.239   1.00 42.24 67  K 1 
ATOM 368 C CA  . GLY K 1 67  ? 7.770   4.809   0.608   1.00 43.12 67  K 1 
ATOM 369 C C   . GLY K 1 67  ? 6.403   4.150   0.816   1.00 44.10 67  K 1 
ATOM 370 O O   . GLY K 1 67  ? 6.338   2.939   1.000   1.00 42.31 67  K 1 
ATOM 371 N N   . CYS K 1 68  ? 5.307   4.905   0.755   1.00 42.19 68  K 1 
ATOM 372 C CA  . CYS K 1 68  ? 3.977   4.292   0.698   1.00 43.26 68  K 1 
ATOM 373 C C   . CYS K 1 68  ? 3.683   3.806   -0.734  1.00 43.17 68  K 1 
ATOM 374 O O   . CYS K 1 68  ? 3.506   4.611   -1.646  1.00 42.38 68  K 1 
ATOM 375 C CB  . CYS K 1 68  ? 2.925   5.280   1.225   1.00 43.12 68  K 1 
ATOM 376 S SG  . CYS K 1 68  ? 1.447   4.383   1.737   1.00 42.36 68  K 1 
ATOM 377 N N   . GLY K 1 69  ? 3.654   2.492   -0.924  1.00 43.22 69  K 1 
ATOM 378 C CA  . GLY K 1 69  ? 3.242   1.877   -2.185  1.00 44.41 69  K 1 
ATOM 379 C C   . GLY K 1 69  ? 1.802   1.380   -2.072  1.00 44.28 69  K 1 
ATOM 380 O O   . GLY K 1 69  ? 1.542   0.391   -1.387  1.00 43.16 69  K 1 
ATOM 381 N N   . CYS K 1 70  ? 0.862   2.030   -2.742  1.00 44.53 70  K 1 
ATOM 382 C CA  . CYS K 1 70  ? -0.489  1.505   -2.908  1.00 44.63 70  K 1 
ATOM 383 C C   . CYS K 1 70  ? -0.491  0.537   -4.093  1.00 43.56 70  K 1 
ATOM 384 O O   . CYS K 1 70  ? -0.437  0.960   -5.246  1.00 42.71 70  K 1 
ATOM 385 C CB  . CYS K 1 70  ? -1.479  2.653   -3.115  1.00 44.11 70  K 1 
ATOM 386 S SG  . CYS K 1 70  ? -1.541  3.745   -1.667  1.00 43.64 70  K 1 
ATOM 387 N N   . THR K 1 71  ? -0.559  -0.754  -3.805  1.00 43.59 71  K 1 
ATOM 388 C CA  . THR K 1 71  ? -0.760  -1.754  -4.860  1.00 43.49 71  K 1 
ATOM 389 C C   . THR K 1 71  ? -2.264  -1.956  -5.020  1.00 41.83 71  K 1 
ATOM 390 O O   . THR K 1 71  ? -2.889  -2.656  -4.228  1.00 40.34 71  K 1 
ATOM 391 C CB  . THR K 1 71  ? -0.023  -3.070  -4.556  1.00 43.11 71  K 1 
ATOM 392 O OG1 . THR K 1 71  ? 1.245   -2.825  -3.996  1.00 40.57 71  K 1 
ATOM 393 C CG2 . THR K 1 71  ? 0.207   -3.879  -5.832  1.00 40.00 71  K 1 
ATOM 394 N N   . GLY K 1 72  ? -2.864  -1.302  -6.013  1.00 40.77 72  K 1 
ATOM 395 C CA  . GLY K 1 72  ? -4.248  -1.580  -6.389  1.00 40.33 72  K 1 
ATOM 396 C C   . GLY K 1 72  ? -4.378  -3.027  -6.872  1.00 39.19 72  K 1 
ATOM 397 O O   . GLY K 1 72  ? -3.545  -3.495  -7.650  1.00 37.90 72  K 1 
ATOM 398 N N   . ALA K 1 73  ? -5.417  -3.742  -6.415  1.00 39.41 73  K 1 
ATOM 399 C CA  . ALA K 1 73  ? -5.746  -5.037  -6.991  1.00 39.07 73  K 1 
ATOM 400 C C   . ALA K 1 73  ? -5.984  -4.874  -8.499  1.00 38.55 73  K 1 
ATOM 401 O O   . ALA K 1 73  ? -6.549  -3.875  -8.944  1.00 36.72 73  K 1 
ATOM 402 C CB  . ALA K 1 73  ? -6.966  -5.623  -6.275  1.00 37.33 73  K 1 
ATOM 403 N N   . THR K 1 74  ? -5.543  -5.845  -9.271  1.00 35.10 74  K 1 
ATOM 404 C CA  . THR K 1 74  ? -5.711  -5.885  -10.729 1.00 35.25 74  K 1 
ATOM 405 C C   . THR K 1 74  ? -7.182  -5.659  -11.081 1.00 35.22 74  K 1 
ATOM 406 O O   . THR K 1 74  ? -8.036  -6.465  -10.726 1.00 33.90 74  K 1 
ATOM 407 C CB  . THR K 1 74  ? -5.221  -7.231  -11.303 1.00 34.88 74  K 1 
ATOM 408 O OG1 . THR K 1 74  ? -4.308  -7.874  -10.431 1.00 32.74 74  K 1 
ATOM 409 C CG2 . THR K 1 74  ? -4.499  -7.057  -12.637 1.00 32.08 74  K 1 
ATOM 410 N N   . GLY K 1 75  ? -7.470  -4.546  -11.737 1.00 33.97 75  K 1 
ATOM 411 C CA  . GLY K 1 75  ? -8.830  -4.101  -12.050 1.00 33.92 75  K 1 
ATOM 412 C C   . GLY K 1 75  ? -9.278  -2.813  -11.347 1.00 33.94 75  K 1 
ATOM 413 O O   . GLY K 1 75  ? -10.287 -2.238  -11.743 1.00 33.00 75  K 1 
ATOM 414 N N   . GLY K 1 76  ? -8.535  -2.315  -10.365 1.00 34.70 76  K 1 
ATOM 415 C CA  . GLY K 1 76  ? -8.754  -0.995  -9.780  1.00 34.87 76  K 1 
ATOM 416 C C   . GLY K 1 76  ? -8.158  0.094   -10.668 1.00 34.29 76  K 1 
ATOM 417 O O   . GLY K 1 76  ? -6.945  0.178   -10.815 1.00 33.42 76  K 1 
ATOM 418 N N   . THR K 1 77  ? -9.004  0.914   -11.263 1.00 33.73 77  K 1 
ATOM 419 C CA  . THR K 1 77  ? -8.568  2.072   -12.049 1.00 34.24 77  K 1 
ATOM 420 C C   . THR K 1 77  ? -7.811  3.038   -11.142 1.00 34.29 77  K 1 
ATOM 421 O O   . THR K 1 77  ? -8.366  3.558   -10.174 1.00 33.12 77  K 1 
ATOM 422 C CB  . THR K 1 77  ? -9.767  2.774   -12.708 1.00 33.74 77  K 1 
ATOM 423 O OG1 . THR K 1 77  ? -10.688 1.824   -13.193 1.00 31.72 77  K 1 
ATOM 424 C CG2 . THR K 1 77  ? -9.343  3.630   -13.905 1.00 30.82 77  K 1 
ATOM 425 N N   . ALA K 1 78  ? -6.539  3.259   -11.453 1.00 34.83 78  K 1 
ATOM 426 C CA  . ALA K 1 78  ? -5.713  4.241   -10.779 1.00 34.87 78  K 1 
ATOM 427 C C   . ALA K 1 78  ? -6.346  5.635   -10.906 1.00 35.08 78  K 1 
ATOM 428 O O   . ALA K 1 78  ? -6.709  6.055   -12.001 1.00 34.34 78  K 1 
ATOM 429 C CB  . ALA K 1 78  ? -4.307  4.193   -11.388 1.00 33.60 78  K 1 
ATOM 430 N N   . CYS K 1 79  ? -6.463  6.309   -9.772  1.00 33.52 79  K 1 
ATOM 431 C CA  . CYS K 1 79  ? -6.649  7.750   -9.616  1.00 33.41 79  K 1 
ATOM 432 C C   . CYS K 1 79  ? -7.448  8.482   -10.709 1.00 32.43 79  K 1 
ATOM 433 O O   . CYS K 1 79  ? -6.882  9.203   -11.532 1.00 32.28 79  K 1 
ATOM 434 C CB  . CYS K 1 79  ? -5.259  8.367   -9.457  1.00 33.50 79  K 1 
ATOM 435 S SG  . CYS K 1 79  ? -4.354  7.708   -8.040  1.00 33.09 79  K 1 
ATOM 436 N N   . THR K 1 80  ? -8.765  8.380   -10.670 1.00 32.49 80  K 1 
ATOM 437 C CA  . THR K 1 80  ? -9.615  9.349   -11.361 1.00 32.87 80  K 1 
ATOM 438 C C   . THR K 1 80  ? -10.036 10.426  -10.371 1.00 32.27 80  K 1 
ATOM 439 O O   . THR K 1 80  ? -10.912 10.223  -9.531  1.00 30.43 80  K 1 
ATOM 440 C CB  . THR K 1 80  ? -10.819 8.708   -12.070 1.00 31.79 80  K 1 
ATOM 441 O OG1 . THR K 1 80  ? -11.321 7.608   -11.351 1.00 30.03 80  K 1 
ATOM 442 C CG2 . THR K 1 80  ? -10.426 8.206   -13.460 1.00 29.52 80  K 1 
ATOM 443 N N   . THR K 1 81  ? -9.406  11.567  -10.470 1.00 31.96 81  K 1 
ATOM 444 C CA  . THR K 1 81  ? -9.905  12.801  -9.859  1.00 32.55 81  K 1 
ATOM 445 C C   . THR K 1 81  ? -11.250 13.131  -10.505 1.00 32.18 81  K 1 
ATOM 446 O O   . THR K 1 81  ? -11.302 13.433  -11.694 1.00 30.54 81  K 1 
ATOM 447 C CB  . THR K 1 81  ? -8.909  13.968  -10.076 1.00 31.54 81  K 1 
ATOM 448 O OG1 . THR K 1 81  ? -7.579  13.508  -10.153 1.00 29.26 81  K 1 
ATOM 449 C CG2 . THR K 1 81  ? -8.962  14.972  -8.927  1.00 28.70 81  K 1 
ATOM 450 N N   . GLY K 1 82  ? -12.343 13.052  -9.742  1.00 29.53 82  K 1 
ATOM 451 C CA  . GLY K 1 82  ? -13.627 13.636  -10.155 1.00 29.32 82  K 1 
ATOM 452 C C   . GLY K 1 82  ? -14.676 12.725  -10.806 1.00 29.16 82  K 1 
ATOM 453 O O   . GLY K 1 82  ? -15.595 13.252  -11.429 1.00 27.81 82  K 1 
ATOM 454 N N   . GLY K 1 83  ? -14.613 11.406  -10.663 1.00 27.11 83  K 1 
ATOM 455 C CA  . GLY K 1 83  ? -15.683 10.520  -11.127 1.00 27.42 83  K 1 
ATOM 456 C C   . GLY K 1 83  ? -16.780 10.320  -10.077 1.00 27.23 83  K 1 
ATOM 457 O O   . GLY K 1 83  ? -16.585 9.593   -9.107  1.00 25.57 83  K 1 
ATOM 458 N N   . THR K 1 84  ? -17.946 10.902  -10.278 1.00 29.44 84  K 1 
ATOM 459 C CA  . THR K 1 84  ? -19.180 10.481  -9.597  1.00 30.72 84  K 1 
ATOM 460 C C   . THR K 1 84  ? -19.597 9.111   -10.116 1.00 30.93 84  K 1 
ATOM 461 O O   . THR K 1 84  ? -20.170 9.005   -11.197 1.00 29.35 84  K 1 
ATOM 462 C CB  . THR K 1 84  ? -20.327 11.486  -9.838  1.00 29.81 84  K 1 
ATOM 463 O OG1 . THR K 1 84  ? -20.301 11.946  -11.166 1.00 27.47 84  K 1 
ATOM 464 C CG2 . THR K 1 84  ? -20.232 12.696  -8.918  1.00 26.82 84  K 1 
ATOM 465 N N   . GLY K 1 85  ? -19.337 8.068   -9.351  1.00 27.77 85  K 1 
ATOM 466 C CA  . GLY K 1 85  ? -19.850 6.728   -9.612  1.00 28.51 85  K 1 
ATOM 467 C C   . GLY K 1 85  ? -18.810 5.633   -9.416  1.00 28.84 85  K 1 
ATOM 468 O O   . GLY K 1 85  ? -17.937 5.446   -10.246 1.00 27.62 85  K 1 
ATOM 469 N N   . GLY K 1 86  ? -18.959 4.873   -8.336  1.00 31.54 86  K 1 
ATOM 470 C CA  . GLY K 1 86  ? -18.367 3.549   -8.186  1.00 31.94 86  K 1 
ATOM 471 C C   . GLY K 1 86  ? -16.877 3.502   -7.843  1.00 32.14 86  K 1 
ATOM 472 O O   . GLY K 1 86  ? -16.032 3.453   -8.723  1.00 31.31 86  K 1 
ATOM 473 N N   . GLY K 1 87  ? -16.572 3.372   -6.556  1.00 34.06 87  K 1 
ATOM 474 C CA  . GLY K 1 87  ? -15.422 2.591   -6.086  1.00 34.81 87  K 1 
ATOM 475 C C   . GLY K 1 87  ? -14.011 3.028   -6.493  1.00 35.02 87  K 1 
ATOM 476 O O   . GLY K 1 87  ? -13.172 2.175   -6.759  1.00 34.13 87  K 1 
ATOM 477 N N   . ALA K 1 88  ? -13.712 4.320   -6.516  1.00 36.50 88  K 1 
ATOM 478 C CA  . ALA K 1 88  ? -12.342 4.788   -6.700  1.00 36.81 88  K 1 
ATOM 479 C C   . ALA K 1 88  ? -11.561 4.706   -5.375  1.00 36.86 88  K 1 
ATOM 480 O O   . ALA K 1 88  ? -11.850 5.430   -4.424  1.00 36.24 88  K 1 
ATOM 481 C CB  . ALA K 1 88  ? -12.361 6.199   -7.289  1.00 35.97 88  K 1 
ATOM 482 N N   . ALA K 1 89  ? -10.558 3.836   -5.322  1.00 39.42 89  K 1 
ATOM 483 C CA  . ALA K 1 89  ? -9.509  3.936   -4.315  1.00 40.89 89  K 1 
ATOM 484 C C   . ALA K 1 89  ? -8.666  5.177   -4.642  1.00 41.50 89  K 1 
ATOM 485 O O   . ALA K 1 89  ? -7.766  5.128   -5.472  1.00 40.89 89  K 1 
ATOM 486 C CB  . ALA K 1 89  ? -8.693  2.641   -4.301  1.00 39.97 89  K 1 
ATOM 487 N N   . ALA K 1 90  ? -8.998  6.299   -4.029  1.00 42.23 90  K 1 
ATOM 488 C CA  . ALA K 1 90  ? -8.214  7.511   -4.159  1.00 43.20 90  K 1 
ATOM 489 C C   . ALA K 1 90  ? -6.913  7.348   -3.362  1.00 44.65 90  K 1 
ATOM 490 O O   . ALA K 1 90  ? -6.883  7.572   -2.155  1.00 43.55 90  K 1 
ATOM 491 C CB  . ALA K 1 90  ? -9.057  8.708   -3.708  1.00 41.49 90  K 1 
ATOM 492 N N   . CYS K 1 91  ? -5.838  6.969   -4.044  1.00 41.10 91  K 1 
ATOM 493 C CA  . CYS K 1 91  ? -4.500  7.190   -3.516  1.00 41.96 91  K 1 
ATOM 494 C C   . CYS K 1 91  ? -4.199  8.686   -3.625  1.00 41.82 91  K 1 
ATOM 495 O O   . CYS K 1 91  ? -3.598  9.141   -4.596  1.00 41.91 91  K 1 
ATOM 496 C CB  . CYS K 1 91  ? -3.480  6.332   -4.273  1.00 41.90 91  K 1 
ATOM 497 S SG  . CYS K 1 91  ? -3.761  4.572   -3.968  1.00 41.03 91  K 1 
ATOM 498 N N   . THR K 1 92  ? -4.636  9.447   -2.643  1.00 43.40 92  K 1 
ATOM 499 C CA  . THR K 1 92  ? -4.200  10.840  -2.488  1.00 43.61 92  K 1 
ATOM 500 C C   . THR K 1 92  ? -2.820  10.849  -1.840  1.00 43.00 92  K 1 
ATOM 501 O O   . THR K 1 92  ? -2.654  11.152  -0.667  1.00 41.27 92  K 1 
ATOM 502 C CB  . THR K 1 92  ? -5.213  11.710  -1.714  1.00 42.92 92  K 1 
ATOM 503 O OG1 . THR K 1 92  ? -6.340  10.977  -1.305  1.00 40.29 92  K 1 
ATOM 504 C CG2 . THR K 1 92  ? -5.713  12.861  -2.578  1.00 39.54 92  K 1 
ATOM 505 N N   . GLY K 1 93  ? -1.840  10.466  -2.615  1.00 44.69 93  K 1 
ATOM 506 C CA  . GLY K 1 93  ? -0.434  10.650  -2.297  1.00 45.43 93  K 1 
ATOM 507 C C   . GLY K 1 93  ? 0.224   11.318  -3.492  1.00 45.88 93  K 1 
ATOM 508 O O   . GLY K 1 93  ? 0.612   10.642  -4.434  1.00 44.34 93  K 1 
ATOM 509 N N   . CYS K 1 94  ? 0.313   12.644  -3.475  1.00 42.18 94  K 1 
ATOM 510 C CA  . CYS K 1 94  ? 1.214   13.334  -4.386  1.00 41.89 94  K 1 
ATOM 511 C C   . CYS K 1 94  ? 2.624   12.806  -4.129  1.00 41.40 94  K 1 
ATOM 512 O O   . CYS K 1 94  ? 3.155   12.952  -3.030  1.00 40.33 94  K 1 
ATOM 513 C CB  . CYS K 1 94  ? 1.166   14.848  -4.156  1.00 42.36 94  K 1 
ATOM 514 S SG  . CYS K 1 94  ? -0.264  15.572  -4.990  1.00 41.36 94  K 1 
ATOM 515 N N   . CYS K 1 95  ? 3.239   12.234  -5.155  1.00 42.66 95  K 1 
ATOM 516 C CA  . CYS K 1 95  ? 4.690   12.189  -5.202  1.00 42.93 95  K 1 
ATOM 517 C C   . CYS K 1 95  ? 5.156   13.647  -5.244  1.00 40.93 95  K 1 
ATOM 518 O O   . CYS K 1 95  ? 5.194   14.261  -6.306  1.00 39.47 95  K 1 
ATOM 519 C CB  . CYS K 1 95  ? 5.145   11.397  -6.434  1.00 42.70 95  K 1 
ATOM 520 S SG  . CYS K 1 95  ? 4.600   9.677   -6.335  1.00 42.34 95  K 1 
ATOM 521 N N   . THR K 1 96  ? 5.432   14.212  -4.084  1.00 43.79 96  K 1 
ATOM 522 C CA  . THR K 1 96  ? 6.083   15.523  -4.029  1.00 43.10 96  K 1 
ATOM 523 C C   . THR K 1 96  ? 7.423   15.395  -4.727  1.00 40.59 96  K 1 
ATOM 524 O O   . THR K 1 96  ? 8.254   14.567  -4.367  1.00 37.64 96  K 1 
ATOM 525 C CB  . THR K 1 96  ? 6.239   16.077  -2.604  1.00 42.51 96  K 1 
ATOM 526 O OG1 . THR K 1 96  ? 6.025   15.095  -1.625  1.00 39.73 96  K 1 
ATOM 527 C CG2 . THR K 1 96  ? 5.235   17.195  -2.353  1.00 39.61 96  K 1 
ATOM 528 N N   . GLY K 1 97  ? 7.538   16.136  -5.794  1.00 39.71 97  K 1 
ATOM 529 C CA  . GLY K 1 97  ? 8.444   15.971  -6.907  1.00 39.02 97  K 1 
ATOM 530 C C   . GLY K 1 97  ? 9.868   15.553  -6.558  1.00 37.60 97  K 1 
ATOM 531 O O   . GLY K 1 97  ? 10.544  16.176  -5.745  1.00 35.08 97  K 1 
ATOM 532 N N   . GLY K 1 98  ? 10.351  14.571  -7.325  1.00 38.35 98  K 1 
ATOM 533 C CA  . GLY K 1 98  ? 11.724  14.645  -7.793  1.00 37.65 98  K 1 
ATOM 534 C C   . GLY K 1 98  ? 11.794  15.789  -8.799  1.00 36.04 98  K 1 
ATOM 535 O O   . GLY K 1 98  ? 11.575  15.578  -9.983  1.00 33.81 98  K 1 
ATOM 536 N N   . GLY K 1 99  ? 12.015  17.001  -8.314  1.00 32.33 99  K 1 
ATOM 537 C CA  . GLY K 1 99  ? 12.427  18.098  -9.176  1.00 33.26 99  K 1 
ATOM 538 C C   . GLY K 1 99  ? 13.650  17.645  -9.964  1.00 32.02 99  K 1 
ATOM 539 O O   . GLY K 1 99  ? 14.512  16.946  -9.428  1.00 30.02 99  K 1 
ATOM 540 N N   . ALA K 1 100 ? 13.694  18.017  -11.238 1.00 30.84 100 K 1 
ATOM 541 C CA  . ALA K 1 100 ? 14.845  17.801  -12.101 1.00 32.27 100 K 1 
ATOM 542 C C   . ALA K 1 100 ? 16.073  18.500  -11.502 1.00 32.49 100 K 1 
ATOM 543 O O   . ALA K 1 100 ? 16.376  19.648  -11.805 1.00 31.08 100 K 1 
ATOM 544 C CB  . ALA K 1 100 ? 14.491  18.308  -13.501 1.00 31.17 100 K 1 
ATOM 545 N N   . GLY K 1 101 ? 16.752  17.806  -10.625 1.00 27.65 101 K 1 
ATOM 546 C CA  . GLY K 1 101 ? 17.988  18.214  -9.990  1.00 30.86 101 K 1 
ATOM 547 C C   . GLY K 1 101 ? 18.785  16.957  -9.687  1.00 30.62 101 K 1 
ATOM 548 O O   . GLY K 1 101 ? 18.316  16.085  -8.962  1.00 28.50 101 K 1 
ATOM 549 N N   . ALA K 1 102 ? 19.934  16.840  -10.310 1.00 32.55 102 K 1 
ATOM 550 C CA  . ALA K 1 102 ? 20.845  15.711  -10.201 1.00 34.58 102 K 1 
ATOM 551 C C   . ALA K 1 102 ? 21.102  15.337  -8.731  1.00 34.64 102 K 1 
ATOM 552 O O   . ALA K 1 102 ? 21.755  16.068  -7.992  1.00 32.66 102 K 1 
ATOM 553 C CB  . ALA K 1 102 ? 22.135  16.109  -10.920 1.00 33.56 102 K 1 
ATOM 554 N N   . GLY K 1 103 ? 20.591  14.187  -8.325  1.00 28.48 103 K 1 
ATOM 555 C CA  . GLY K 1 103 ? 20.748  13.658  -6.980  1.00 30.49 103 K 1 
ATOM 556 C C   . GLY K 1 103 ? 20.061  12.307  -6.868  1.00 30.53 103 K 1 
ATOM 557 O O   . GLY K 1 103 ? 18.857  12.216  -6.673  1.00 28.50 103 K 1 
ATOM 558 N N   . THR K 1 104 ? 20.838  11.265  -7.043  1.00 31.06 104 K 1 
ATOM 559 C CA  . THR K 1 104 ? 20.492  9.845   -6.942  1.00 33.36 104 K 1 
ATOM 560 C C   . THR K 1 104 ? 19.719  9.535   -5.662  1.00 33.04 104 K 1 
ATOM 561 O O   . THR K 1 104 ? 20.305  9.550   -4.584  1.00 30.87 104 K 1 
ATOM 562 C CB  . THR K 1 104 ? 21.804  9.038   -6.909  1.00 32.29 104 K 1 
ATOM 563 O OG1 . THR K 1 104 ? 22.745  9.690   -6.080  1.00 30.12 104 K 1 
ATOM 564 C CG2 . THR K 1 104 ? 22.433  8.911   -8.289  1.00 29.93 104 K 1 
ATOM 565 N N   . ALA K 1 105 ? 18.446  9.237   -5.796  1.00 33.41 105 K 1 
ATOM 566 C CA  . ALA K 1 105 ? 17.636  8.213   -5.099  1.00 34.73 105 K 1 
ATOM 567 C C   . ALA K 1 105 ? 16.138  8.566   -5.179  1.00 35.21 105 K 1 
ATOM 568 O O   . ALA K 1 105 ? 15.442  8.713   -4.178  1.00 34.07 105 K 1 
ATOM 569 C CB  . ALA K 1 105 ? 18.066  7.959   -3.639  1.00 33.80 105 K 1 
ATOM 570 N N   . GLY K 1 106 ? 15.623  8.703   -6.389  1.00 34.56 106 K 1 
ATOM 571 C CA  . GLY K 1 106 ? 14.180  8.687   -6.601  1.00 34.91 106 K 1 
ATOM 572 C C   . GLY K 1 106 ? 13.666  7.278   -6.333  1.00 35.24 106 K 1 
ATOM 573 O O   . GLY K 1 106 ? 13.958  6.363   -7.095  1.00 34.05 106 K 1 
ATOM 574 N N   . GLY K 1 107 ? 12.944  7.093   -5.218  1.00 33.89 107 K 1 
ATOM 575 C CA  . GLY K 1 107 ? 12.183  5.867   -5.001  1.00 35.49 107 K 1 
ATOM 576 C C   . GLY K 1 107 ? 11.277  5.650   -6.206  1.00 35.95 107 K 1 
ATOM 577 O O   . GLY K 1 107 ? 10.505  6.532   -6.568  1.00 34.63 107 K 1 
ATOM 578 N N   . ALA K 1 108 ? 11.426  4.491   -6.849  1.00 36.15 108 K 1 
ATOM 579 C CA  . ALA K 1 108 ? 10.663  4.142   -8.031  1.00 37.62 108 K 1 
ATOM 580 C C   . ALA K 1 108 ? 9.165   4.131   -7.686  1.00 38.62 108 K 1 
ATOM 581 O O   . ALA K 1 108 ? 8.671   3.191   -7.072  1.00 37.38 108 K 1 
ATOM 582 C CB  . ALA K 1 108 ? 11.165  2.787   -8.542  1.00 36.58 108 K 1 
ATOM 583 N N   . CYS K 1 109 ? 8.442   5.164   -8.121  1.00 36.53 109 K 1 
ATOM 584 C CA  . CYS K 1 109 ? 7.026   4.984   -8.391  1.00 37.02 109 K 1 
ATOM 585 C C   . CYS K 1 109 ? 6.941   3.921   -9.482  1.00 36.40 109 K 1 
ATOM 586 O O   . CYS K 1 109 ? 7.351   4.150   -10.618 1.00 37.06 109 K 1 
ATOM 587 C CB  . CYS K 1 109 ? 6.378   6.307   -8.815  1.00 37.89 109 K 1 
ATOM 588 S SG  . CYS K 1 109 ? 5.829   7.218   -7.342  1.00 37.43 109 K 1 
ATOM 589 N N   . GLY K 1 110 ? 6.473   2.729   -9.105  1.00 37.12 110 K 1 
ATOM 590 C CA  . GLY K 1 110 ? 6.190   1.684   -10.078 1.00 37.95 110 K 1 
ATOM 591 C C   . GLY K 1 110 ? 5.326   2.270   -11.188 1.00 37.55 110 K 1 
ATOM 592 O O   . GLY K 1 110 ? 4.433   3.074   -10.925 1.00 36.01 110 K 1 
ATOM 593 N N   . THR K 1 111 ? 5.611   1.873   -12.409 1.00 38.28 111 K 1 
ATOM 594 C CA  . THR K 1 111 ? 5.131   2.402   -13.702 1.00 39.24 111 K 1 
ATOM 595 C C   . THR K 1 111 ? 3.610   2.462   -13.914 1.00 39.44 111 K 1 
ATOM 596 O O   . THR K 1 111 ? 3.159   2.691   -15.037 1.00 37.33 111 K 1 
ATOM 597 C CB  . THR K 1 111 ? 5.756   1.569   -14.835 1.00 38.32 111 K 1 
ATOM 598 O OG1 . THR K 1 111 ? 5.965   0.230   -14.411 1.00 35.31 111 K 1 
ATOM 599 C CG2 . THR K 1 111 ? 7.118   2.108   -15.256 1.00 34.73 111 K 1 
ATOM 600 N N   . ALA K 1 112 ? 2.805   2.283   -12.884 1.00 39.08 112 K 1 
ATOM 601 C CA  . ALA K 1 112 ? 1.366   2.463   -12.945 1.00 39.86 112 K 1 
ATOM 602 C C   . ALA K 1 112 ? 0.987   3.839   -12.379 1.00 40.56 112 K 1 
ATOM 603 O O   . ALA K 1 112 ? 0.722   3.987   -11.193 1.00 38.86 112 K 1 
ATOM 604 C CB  . ALA K 1 112 ? 0.698   1.286   -12.234 1.00 37.94 112 K 1 
ATOM 605 N N   . GLY K 1 113 ? 0.943   4.828   -13.265 1.00 39.11 113 K 1 
ATOM 606 C CA  . GLY K 1 113 ? 0.186   6.057   -13.051 1.00 39.97 113 K 1 
ATOM 607 C C   . GLY K 1 113 ? 0.755   7.011   -11.999 1.00 40.61 113 K 1 
ATOM 608 O O   . GLY K 1 113 ? 0.236   7.101   -10.891 1.00 39.21 113 K 1 
ATOM 609 N N   . CYS K 1 114 ? 1.753   7.811   -12.381 1.00 38.79 114 K 1 
ATOM 610 C CA  . CYS K 1 114 ? 1.982   9.074   -11.700 1.00 39.23 114 K 1 
ATOM 611 C C   . CYS K 1 114 ? 0.694   9.899   -11.787 1.00 38.62 114 K 1 
ATOM 612 O O   . CYS K 1 114 ? 0.265   10.266  -12.880 1.00 38.17 114 K 1 
ATOM 613 C CB  . CYS K 1 114 ? 3.149   9.817   -12.360 1.00 39.34 114 K 1 
ATOM 614 S SG  . CYS K 1 114 ? 4.696   8.889   -12.167 1.00 38.63 114 K 1 
ATOM 615 N N   . CYS K 1 115 ? 0.069   10.188  -10.638 1.00 40.02 115 K 1 
ATOM 616 C CA  . CYS K 1 115 ? -0.883  11.290  -10.593 1.00 40.26 115 K 1 
ATOM 617 C C   . CYS K 1 115 ? -0.116  12.547  -10.986 1.00 38.88 115 K 1 
ATOM 618 O O   . CYS K 1 115 ? 0.939   12.824  -10.422 1.00 37.99 115 K 1 
ATOM 619 C CB  . CYS K 1 115 ? -1.496  11.405  -9.199  1.00 40.29 115 K 1 
ATOM 620 S SG  . CYS K 1 115 ? -2.550  9.968   -8.868  1.00 39.28 115 K 1 
ATOM 621 N N   . ALA K 1 116 ? -0.631  13.249  -11.983 1.00 36.34 116 K 1 
ATOM 622 C CA  . ALA K 1 116 ? 0.010   14.438  -12.518 1.00 36.49 116 K 1 
ATOM 623 C C   . ALA K 1 116 ? 0.315   15.436  -11.386 1.00 36.35 116 K 1 
ATOM 624 O O   . ALA K 1 116 ? -0.555  15.745  -10.575 1.00 33.53 116 K 1 
ATOM 625 C CB  . ALA K 1 116 ? -0.909  15.042  -13.586 1.00 34.79 116 K 1 
ATOM 626 N N   . CYS K 1 117 ? 1.532   15.922  -11.348 1.00 35.60 117 K 1 
ATOM 627 C CA  . CYS K 1 117 ? 1.867   17.205  -10.736 1.00 33.82 117 K 1 
ATOM 628 C C   . CYS K 1 117 ? 1.264   18.330  -11.570 1.00 30.85 117 K 1 
ATOM 629 O O   . CYS K 1 117 ? 1.301   18.228  -12.808 1.00 27.57 117 K 1 
ATOM 630 C CB  . CYS K 1 117 ? 3.390   17.365  -10.646 1.00 33.87 117 K 1 
ATOM 631 S SG  . CYS K 1 117 ? 4.116   16.116  -9.540  1.00 31.94 117 K 1 
ATOM 632 O OXT . CYS K 1 117 ? 0.770   19.310  -10.931 1.00 30.50 117 K 1 
#
