# 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_if02557
#
_entry.id if02557
#
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](N)C(O)=O                  ? "L-PEPTIDE LINKING" 
"C6 H15 N4 O2"  175.209 ARG y ARGININE        N[C@@H](CCCNC(N)=[NH2+])C(O)=O   ? "L-PEPTIDE LINKING" 
"C4 H8 N2 O3"   132.118 ASN y ASPARAGINE      N[C@@H](CC(N)=O)C(O)=O           ? "L-PEPTIDE LINKING" 
"C4 H7 N O4"    133.103 ASP y "ASPARTIC ACID" N[C@@H](CC(O)=O)C(O)=O           ? "L-PEPTIDE LINKING" 
"C3 H7 N O2 S"  121.158 CYS y CYSTEINE        N[C@@H](CS)C(O)=O                ? "L-PEPTIDE LINKING" 
"C5 H10 N2 O3"  146.144 GLN y GLUTAMINE       N[C@@H](CCC(N)=O)C(O)=O          ? "L-PEPTIDE LINKING" 
"C5 H9 N O4"    147.129 GLU y "GLUTAMIC ACID" N[C@@H](CCC(O)=O)C(O)=O          ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"    75.067  GLY y GLYCINE         NCC(O)=O                         ? "PEPTIDE LINKING"   
"C6 H10 N3 O2"  156.162 HIS y HISTIDINE       N[C@@H](Cc1c[nH]c[nH+]1)C(O)=O   ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 ILE y ISOLEUCINE      CC[C@H](C)[C@H](N)C(O)=O         ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 LEU y LEUCINE         CC(C)C[C@H](N)C(O)=O             ? "L-PEPTIDE LINKING" 
"C6 H15 N2 O2"  147.195 LYS y LYSINE          N[C@@H](CCCC[NH3+])C(O)=O        ? "L-PEPTIDE LINKING" 
"C5 H11 N O2 S" 149.211 MET y METHIONINE      CSCC[C@H](N)C(O)=O               ? "L-PEPTIDE LINKING" 
"C9 H11 N O2"   165.189 PHE y PHENYLALANINE   N[C@@H](Cc1ccccc1)C(O)=O         ? "L-PEPTIDE LINKING" 
"C5 H9 N O2"    115.130 PRO y PROLINE         OC(=O)[C@@H]1CCCN1               ? "L-PEPTIDE LINKING" 
"C3 H7 N O3"    105.093 SER y SERINE          N[C@@H](CO)C(O)=O                ? "L-PEPTIDE LINKING" 
"C4 H9 N O3"    119.119 THR y THREONINE       C[C@@H](O)[C@H](N)C(O)=O         ? "L-PEPTIDE LINKING" 
"C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN      N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O ? "L-PEPTIDE LINKING" 
"C9 H11 N O3"   181.189 TYR y TYROSINE        N[C@@H](Cc1ccc(O)cc1)C(O)=O      ? "L-PEPTIDE LINKING" 
"C5 H11 N O2"   117.146 VAL y VALINE          CC(C)[C@H](N)C(O)=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 A
_entity_poly.type           polypeptide(L)
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.hetero
_entity_poly_seq.mon_id
_entity_poly_seq.num
1 n MET 1   
1 n ASP 2   
1 n TYR 3   
1 n ILE 4   
1 n LEU 5   
1 n ASP 6   
1 n THR 7   
1 n HIS 8   
1 n THR 9   
1 n LEU 10  
1 n LEU 11  
1 n TRP 12  
1 n HIS 13  
1 n MET 14  
1 n PHE 15  
1 n ASP 16  
1 n SER 17  
1 n GLY 18  
1 n LYS 19  
1 n LEU 20  
1 n THR 21  
1 n SER 22  
1 n LYS 23  
1 n VAL 24  
1 n LYS 25  
1 n ASN 26  
1 n VAL 27  
1 n LEU 28  
1 n SER 29  
1 n ASP 30  
1 n ASN 31  
1 n THR 32  
1 n GLN 33  
1 n PHE 34  
1 n ASN 35  
1 n LYS 36  
1 n TYR 37  
1 n ILE 38  
1 n SER 39  
1 n MET 40  
1 n ALA 41  
1 n THR 42  
1 n LEU 43  
1 n TRP 44  
1 n GLU 45  
1 n ILE 46  
1 n SER 47  
1 n ILE 48  
1 n LYS 49  
1 n ASN 50  
1 n ARG 51  
1 n ILE 52  
1 n GLY 53  
1 n LYS 54  
1 n LEU 55  
1 n PRO 56  
1 n LEU 57  
1 n PRO 58  
1 n HIS 59  
1 n GLY 60  
1 n VAL 61  
1 n THR 62  
1 n GLY 63  
1 n ILE 64  
1 n PHE 65  
1 n SER 66  
1 n ALA 67  
1 n VAL 68  
1 n GLU 69  
1 n SER 70  
1 n TYR 71  
1 n GLY 72  
1 n PHE 73  
1 n SER 74  
1 n ILE 75  
1 n VAL 76  
1 n GLY 77  
1 n ILE 78  
1 n ASN 79  
1 n HIS 80  
1 n GLN 81  
1 n CYS 82  
1 n VAL 83  
1 n ASP 84  
1 n GLU 85  
1 n TYR 86  
1 n ASN 87  
1 n LYS 88  
1 n LEU 89  
1 n PRO 90  
1 n LEU 91  
1 n ILE 92  
1 n HIS 93  
1 n ARG 94  
1 n ASP 95  
1 n PRO 96  
1 n PHE 97  
1 n ASP 98  
1 n GLY 99  
1 n MET 100 
1 n ILE 101 
1 n VAL 102 
1 n ALA 103 
1 n THR 104 
1 n ALA 105 
1 n LYS 106 
1 n VAL 107 
1 n GLY 108 
1 n GLY 109 
1 n MET 110 
1 n THR 111 
1 n ILE 112 
1 n ILE 113 
1 n THR 114 
1 n ALA 115 
1 n ASP 116 
1 n GLU 117 
1 n ASN 118 
1 n MET 119 
1 n GLN 120 
1 n LYS 121 
1 n TYR 122 
1 n ASP 123 
1 n VAL 124 
1 n ALA 125 
1 n CYS 126 
1 n VAL 127 
1 n TRP 128 
#
_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 (3.0.0 @ 2025-11-14 12:26:26)"
_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 93.00
_ma_qa_metric_global.model_id     1
_ma_qa_metric_global.ordinal_id   1
#
_ma_software_group.group_id    1
_ma_software_group.ordinal_id  1
_ma_software_group.software_id 1
#
_ma_target_entity.data_id   1
_ma_target_entity.entity_id 1
_ma_target_entity.origin    .
#
_ma_target_entity_instance.asym_id   A
_ma_target_entity_instance.details   .
_ma_target_entity_instance.entity_id 1
#
loop_
_pdbx_data_usage.details
_pdbx_data_usage.id
_pdbx_data_usage.type
_pdbx_data_usage.url
;Non-commercial use only, by using this file you agree to the terms of use found
at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
To request access to the AlphaFold 3 model parameters, follow the process set
out at https://github.com/google-deepmind/alphafold3. You may only use these if
received directly from Google. Use is subject to terms of use available at
https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.

;
1 license    https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md 
;AlphaFold 3 and its output are not intended for, have not been validated for,
and are not approved for clinical use. They are provided "as-is" without any
warranty of any kind, whether expressed or implied. No warranty is given that
use shall not infringe the rights of any third party.

;
2 disclaimer ?                                                                              
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.hetero
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.seq_id
A 1   1 n MET . 1   A 1   
A 2   1 n ASP . 2   A 2   
A 3   1 n TYR . 3   A 3   
A 4   1 n ILE . 4   A 4   
A 5   1 n LEU . 5   A 5   
A 6   1 n ASP . 6   A 6   
A 7   1 n THR . 7   A 7   
A 8   1 n HIS . 8   A 8   
A 9   1 n THR . 9   A 9   
A 10  1 n LEU . 10  A 10  
A 11  1 n LEU . 11  A 11  
A 12  1 n TRP . 12  A 12  
A 13  1 n HIS . 13  A 13  
A 14  1 n MET . 14  A 14  
A 15  1 n PHE . 15  A 15  
A 16  1 n ASP . 16  A 16  
A 17  1 n SER . 17  A 17  
A 18  1 n GLY . 18  A 18  
A 19  1 n LYS . 19  A 19  
A 20  1 n LEU . 20  A 20  
A 21  1 n THR . 21  A 21  
A 22  1 n SER . 22  A 22  
A 23  1 n LYS . 23  A 23  
A 24  1 n VAL . 24  A 24  
A 25  1 n LYS . 25  A 25  
A 26  1 n ASN . 26  A 26  
A 27  1 n VAL . 27  A 27  
A 28  1 n LEU . 28  A 28  
A 29  1 n SER . 29  A 29  
A 30  1 n ASP . 30  A 30  
A 31  1 n ASN . 31  A 31  
A 32  1 n THR . 32  A 32  
A 33  1 n GLN . 33  A 33  
A 34  1 n PHE . 34  A 34  
A 35  1 n ASN . 35  A 35  
A 36  1 n LYS . 36  A 36  
A 37  1 n TYR . 37  A 37  
A 38  1 n ILE . 38  A 38  
A 39  1 n SER . 39  A 39  
A 40  1 n MET . 40  A 40  
A 41  1 n ALA . 41  A 41  
A 42  1 n THR . 42  A 42  
A 43  1 n LEU . 43  A 43  
A 44  1 n TRP . 44  A 44  
A 45  1 n GLU . 45  A 45  
A 46  1 n ILE . 46  A 46  
A 47  1 n SER . 47  A 47  
A 48  1 n ILE . 48  A 48  
A 49  1 n LYS . 49  A 49  
A 50  1 n ASN . 50  A 50  
A 51  1 n ARG . 51  A 51  
A 52  1 n ILE . 52  A 52  
A 53  1 n GLY . 53  A 53  
A 54  1 n LYS . 54  A 54  
A 55  1 n LEU . 55  A 55  
A 56  1 n PRO . 56  A 56  
A 57  1 n LEU . 57  A 57  
A 58  1 n PRO . 58  A 58  
A 59  1 n HIS . 59  A 59  
A 60  1 n GLY . 60  A 60  
A 61  1 n VAL . 61  A 61  
A 62  1 n THR . 62  A 62  
A 63  1 n GLY . 63  A 63  
A 64  1 n ILE . 64  A 64  
A 65  1 n PHE . 65  A 65  
A 66  1 n SER . 66  A 66  
A 67  1 n ALA . 67  A 67  
A 68  1 n VAL . 68  A 68  
A 69  1 n GLU . 69  A 69  
A 70  1 n SER . 70  A 70  
A 71  1 n TYR . 71  A 71  
A 72  1 n GLY . 72  A 72  
A 73  1 n PHE . 73  A 73  
A 74  1 n SER . 74  A 74  
A 75  1 n ILE . 75  A 75  
A 76  1 n VAL . 76  A 76  
A 77  1 n GLY . 77  A 77  
A 78  1 n ILE . 78  A 78  
A 79  1 n ASN . 79  A 79  
A 80  1 n HIS . 80  A 80  
A 81  1 n GLN . 81  A 81  
A 82  1 n CYS . 82  A 82  
A 83  1 n VAL . 83  A 83  
A 84  1 n ASP . 84  A 84  
A 85  1 n GLU . 85  A 85  
A 86  1 n TYR . 86  A 86  
A 87  1 n ASN . 87  A 87  
A 88  1 n LYS . 88  A 88  
A 89  1 n LEU . 89  A 89  
A 90  1 n PRO . 90  A 90  
A 91  1 n LEU . 91  A 91  
A 92  1 n ILE . 92  A 92  
A 93  1 n HIS . 93  A 93  
A 94  1 n ARG . 94  A 94  
A 95  1 n ASP . 95  A 95  
A 96  1 n PRO . 96  A 96  
A 97  1 n PHE . 97  A 97  
A 98  1 n ASP . 98  A 98  
A 99  1 n GLY . 99  A 99  
A 100 1 n MET . 100 A 100 
A 101 1 n ILE . 101 A 101 
A 102 1 n VAL . 102 A 102 
A 103 1 n ALA . 103 A 103 
A 104 1 n THR . 104 A 104 
A 105 1 n ALA . 105 A 105 
A 106 1 n LYS . 106 A 106 
A 107 1 n VAL . 107 A 107 
A 108 1 n GLY . 108 A 108 
A 109 1 n GLY . 109 A 109 
A 110 1 n MET . 110 A 110 
A 111 1 n THR . 111 A 111 
A 112 1 n ILE . 112 A 112 
A 113 1 n ILE . 113 A 113 
A 114 1 n THR . 114 A 114 
A 115 1 n ALA . 115 A 115 
A 116 1 n ASP . 116 A 116 
A 117 1 n GLU . 117 A 117 
A 118 1 n ASN . 118 A 118 
A 119 1 n MET . 119 A 119 
A 120 1 n GLN . 120 A 120 
A 121 1 n LYS . 121 A 121 
A 122 1 n TYR . 122 A 122 
A 123 1 n ASP . 123 A 123 
A 124 1 n VAL . 124 A 124 
A 125 1 n ALA . 125 A 125 
A 126 1 n CYS . 126 A 126 
A 127 1 n VAL . 127 A 127 
A 128 1 n TRP . 128 A 128 
#
_software.classification other
_software.date           ?
_software.description    "Structure prediction"
_software.name           AlphaFold
_software.pdbx_ordinal   1
_software.type           package
_software.version        "AlphaFold-beta-20231127 (3ba2d0388b83b90ab601e399702e005f73b6587c61cc70b0a0466583b05b47e1)"
#
_struct_asym.entity_id 1
_struct_asym.id        A
#
loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.auth_seq_id
_atom_site.auth_asym_id
_atom_site.pdbx_PDB_model_num
ATOM 1    N N   . MET A 1 1   ? 7.857   -6.507  -11.753 1.00 86.74 1   A 1 
ATOM 2    C CA  . MET A 1 1   ? 7.176   -5.210  -11.545 1.00 91.61 1   A 1 
ATOM 3    C C   . MET A 1 1   ? 6.786   -5.131  -10.081 1.00 93.52 1   A 1 
ATOM 4    O O   . MET A 1 1   ? 6.386   -6.158  -9.535  1.00 91.76 1   A 1 
ATOM 5    C CB  . MET A 1 1   ? 5.958   -5.091  -12.464 1.00 86.72 1   A 1 
ATOM 6    C CG  . MET A 1 1   ? 5.334   -3.685  -12.454 1.00 78.18 1   A 1 
ATOM 7    S SD  . MET A 1 1   ? 4.124   -3.464  -13.780 1.00 75.34 1   A 1 
ATOM 8    C CE  . MET A 1 1   ? 3.808   -1.685  -13.619 1.00 67.12 1   A 1 
ATOM 9    N N   . ASP A 1 2   ? 6.931   -3.961  -9.474  1.00 96.10 2   A 1 
ATOM 10   C CA  . ASP A 1 2   ? 6.694   -3.774  -8.049  1.00 96.78 2   A 1 
ATOM 11   C C   . ASP A 1 2   ? 5.341   -3.092  -7.826  1.00 97.31 2   A 1 
ATOM 12   O O   . ASP A 1 2   ? 5.039   -2.060  -8.436  1.00 96.85 2   A 1 
ATOM 13   C CB  . ASP A 1 2   ? 7.857   -2.991  -7.423  1.00 95.85 2   A 1 
ATOM 14   C CG  . ASP A 1 2   ? 9.180   -3.767  -7.389  1.00 94.09 2   A 1 
ATOM 15   O OD1 . ASP A 1 2   ? 9.192   -4.971  -7.746  1.00 90.59 2   A 1 
ATOM 16   O OD2 . ASP A 1 2   ? 10.184  -3.162  -6.982  1.00 89.96 2   A 1 
ATOM 17   N N   . TYR A 1 3   ? 4.515   -3.675  -6.967  1.00 97.39 3   A 1 
ATOM 18   C CA  . TYR A 1 3   ? 3.193   -3.172  -6.620  1.00 97.56 3   A 1 
ATOM 19   C C   . TYR A 1 3   ? 3.123   -2.826  -5.137  1.00 97.75 3   A 1 
ATOM 20   O O   . TYR A 1 3   ? 3.587   -3.594  -4.299  1.00 97.47 3   A 1 
ATOM 21   C CB  . TYR A 1 3   ? 2.123   -4.201  -6.982  1.00 97.38 3   A 1 
ATOM 22   C CG  . TYR A 1 3   ? 1.946   -4.403  -8.472  1.00 97.29 3   A 1 
ATOM 23   C CD1 . TYR A 1 3   ? 1.061   -3.578  -9.192  1.00 96.29 3   A 1 
ATOM 24   C CD2 . TYR A 1 3   ? 2.661   -5.413  -9.144  1.00 96.36 3   A 1 
ATOM 25   C CE1 . TYR A 1 3   ? 0.877   -3.770  -10.574 1.00 95.54 3   A 1 
ATOM 26   C CE2 . TYR A 1 3   ? 2.484   -5.605  -10.527 1.00 95.70 3   A 1 
ATOM 27   C CZ  . TYR A 1 3   ? 1.585   -4.786  -11.241 1.00 95.87 3   A 1 
ATOM 28   O OH  . TYR A 1 3   ? 1.397   -4.981  -12.573 1.00 94.53 3   A 1 
ATOM 29   N N   . ILE A 1 4   ? 2.481   -1.709  -4.806  1.00 97.82 4   A 1 
ATOM 30   C CA  . ILE A 1 4   ? 2.155   -1.344  -3.426  1.00 98.13 4   A 1 
ATOM 31   C C   . ILE A 1 4   ? 0.636   -1.300  -3.257  1.00 98.14 4   A 1 
ATOM 32   O O   . ILE A 1 4   ? -0.071  -0.721  -4.079  1.00 98.06 4   A 1 
ATOM 33   C CB  . ILE A 1 4   ? 2.891   -0.054  -3.002  1.00 98.09 4   A 1 
ATOM 34   C CG1 . ILE A 1 4   ? 2.713   0.196   -1.492  1.00 97.10 4   A 1 
ATOM 35   C CG2 . ILE A 1 4   ? 2.460   1.163   -3.836  1.00 97.11 4   A 1 
ATOM 36   C CD1 . ILE A 1 4   ? 3.668   1.276   -0.957  1.00 96.44 4   A 1 
ATOM 37   N N   . LEU A 1 5   ? 0.116   -1.953  -2.222  1.00 97.79 5   A 1 
ATOM 38   C CA  . LEU A 1 5   ? -1.313  -1.999  -1.945  1.00 97.61 5   A 1 
ATOM 39   C C   . LEU A 1 5   ? -1.709  -0.808  -1.075  1.00 97.35 5   A 1 
ATOM 40   O O   . LEU A 1 5   ? -1.019  -0.505  -0.097  1.00 97.10 5   A 1 
ATOM 41   C CB  . LEU A 1 5   ? -1.694  -3.321  -1.256  1.00 97.40 5   A 1 
ATOM 42   C CG  . LEU A 1 5   ? -1.701  -4.577  -2.152  1.00 95.03 5   A 1 
ATOM 43   C CD1 . LEU A 1 5   ? -0.310  -5.022  -2.622  1.00 90.54 5   A 1 
ATOM 44   C CD2 . LEU A 1 5   ? -2.319  -5.741  -1.373  1.00 91.31 5   A 1 
ATOM 45   N N   . ASP A 1 6   ? -2.849  -0.189  -1.385  1.00 97.10 6   A 1 
ATOM 46   C CA  . ASP A 1 6   ? -3.506  0.693   -0.423  1.00 96.71 6   A 1 
ATOM 47   C C   . ASP A 1 6   ? -4.113  -0.113  0.745   1.00 96.99 6   A 1 
ATOM 48   O O   . ASP A 1 6   ? -4.223  -1.346  0.711   1.00 96.52 6   A 1 
ATOM 49   C CB  . ASP A 1 6   ? -4.509  1.641   -1.119  1.00 95.14 6   A 1 
ATOM 50   C CG  . ASP A 1 6   ? -5.851  1.024   -1.532  1.00 93.35 6   A 1 
ATOM 51   O OD1 . ASP A 1 6   ? -6.306  0.045   -0.905  1.00 86.79 6   A 1 
ATOM 52   O OD2 . ASP A 1 6   ? -6.477  1.548   -2.464  1.00 88.17 6   A 1 
ATOM 53   N N   . THR A 1 7   ? -4.522  0.597   1.796   1.00 96.95 7   A 1 
ATOM 54   C CA  . THR A 1 7   ? -5.088  -0.015  3.006   1.00 97.20 7   A 1 
ATOM 55   C C   . THR A 1 7   ? -6.367  -0.797  2.714   1.00 97.33 7   A 1 
ATOM 56   O O   . THR A 1 7   ? -6.545  -1.909  3.219   1.00 97.12 7   A 1 
ATOM 57   C CB  . THR A 1 7   ? -5.371  1.065   4.059   1.00 96.88 7   A 1 
ATOM 58   O OG1 . THR A 1 7   ? -4.195  1.798   4.305   1.00 95.09 7   A 1 
ATOM 59   C CG2 . THR A 1 7   ? -5.824  0.458   5.385   1.00 94.71 7   A 1 
ATOM 60   N N   . HIS A 1 8   ? -7.260  -0.265  1.872   1.00 97.15 8   A 1 
ATOM 61   C CA  . HIS A 1 8   ? -8.529  -0.916  1.545   1.00 96.80 8   A 1 
ATOM 62   C C   . HIS A 1 8   ? -8.309  -2.180  0.722   1.00 97.36 8   A 1 
ATOM 63   O O   . HIS A 1 8   ? -8.924  -3.208  1.004   1.00 96.80 8   A 1 
ATOM 64   C CB  . HIS A 1 8   ? -9.442  0.060   0.800   1.00 95.07 8   A 1 
ATOM 65   C CG  . HIS A 1 8   ? -9.930  1.182   1.677   1.00 88.29 8   A 1 
ATOM 66   N ND1 . HIS A 1 8   ? -9.381  2.436   1.764   1.00 74.63 8   A 1 
ATOM 67   C CD2 . HIS A 1 8   ? -10.992 1.134   2.542   1.00 74.05 8   A 1 
ATOM 68   C CE1 . HIS A 1 8   ? -10.094 3.137   2.660   1.00 73.35 8   A 1 
ATOM 69   N NE2 . HIS A 1 8   ? -11.090 2.385   3.167   1.00 75.47 8   A 1 
ATOM 70   N N   . THR A 1 9   ? -7.382  -2.144  -0.237  1.00 97.00 9   A 1 
ATOM 71   C CA  . THR A 1 9   ? -7.016  -3.310  -1.050  1.00 97.53 9   A 1 
ATOM 72   C C   . THR A 1 9   ? -6.498  -4.451  -0.176  1.00 97.70 9   A 1 
ATOM 73   O O   . THR A 1 9   ? -6.935  -5.591  -0.347  1.00 97.38 9   A 1 
ATOM 74   C CB  . THR A 1 9   ? -5.964  -2.939  -2.105  1.00 97.37 9   A 1 
ATOM 75   O OG1 . THR A 1 9   ? -6.487  -1.960  -2.972  1.00 94.51 9   A 1 
ATOM 76   C CG2 . THR A 1 9   ? -5.598  -4.125  -2.994  1.00 94.68 9   A 1 
ATOM 77   N N   . LEU A 1 10  ? -5.630  -4.158  0.799   1.00 97.76 10  A 1 
ATOM 78   C CA  . LEU A 1 10  ? -5.159  -5.164  1.758   1.00 97.74 10  A 1 
ATOM 79   C C   . LEU A 1 10  ? -6.323  -5.740  2.578   1.00 97.56 10  A 1 
ATOM 80   O O   . LEU A 1 10  ? -6.475  -6.960  2.662   1.00 97.30 10  A 1 
ATOM 81   C CB  . LEU A 1 10  ? -4.083  -4.547  2.671   1.00 97.87 10  A 1 
ATOM 82   C CG  . LEU A 1 10  ? -3.591  -5.498  3.783   1.00 97.34 10  A 1 
ATOM 83   C CD1 . LEU A 1 10  ? -2.921  -6.754  3.220   1.00 96.25 10  A 1 
ATOM 84   C CD2 . LEU A 1 10  ? -2.602  -4.781  4.691   1.00 96.54 10  A 1 
ATOM 85   N N   . LEU A 1 11  ? -7.171  -4.886  3.147   1.00 97.85 11  A 1 
ATOM 86   C CA  . LEU A 1 11  ? -8.295  -5.327  3.978   1.00 97.61 11  A 1 
ATOM 87   C C   . LEU A 1 11  ? -9.324  -6.133  3.175   1.00 97.34 11  A 1 
ATOM 88   O O   . LEU A 1 11  ? -9.833  -7.135  3.668   1.00 97.06 11  A 1 
ATOM 89   C CB  . LEU A 1 11  ? -8.950  -4.109  4.646   1.00 97.68 11  A 1 
ATOM 90   C CG  . LEU A 1 11  ? -8.083  -3.421  5.715   1.00 97.26 11  A 1 
ATOM 91   C CD1 . LEU A 1 11  ? -8.780  -2.142  6.175   1.00 96.70 11  A 1 
ATOM 92   C CD2 . LEU A 1 11  ? -7.852  -4.307  6.943   1.00 96.63 11  A 1 
ATOM 93   N N   . TRP A 1 12  ? -9.605  -5.753  1.930   1.00 97.87 12  A 1 
ATOM 94   C CA  . TRP A 1 12  ? -10.479 -6.531  1.056   1.00 97.69 12  A 1 
ATOM 95   C C   . TRP A 1 12  ? -9.850  -7.861  0.659   1.00 97.39 12  A 1 
ATOM 96   O O   . TRP A 1 12  ? -10.545 -8.872  0.671   1.00 96.89 12  A 1 
ATOM 97   C CB  . TRP A 1 12  ? -10.859 -5.723  -0.183  1.00 97.54 12  A 1 
ATOM 98   C CG  . TRP A 1 12  ? -11.748 -4.548  0.050   1.00 96.71 12  A 1 
ATOM 99   C CD1 . TRP A 1 12  ? -12.569 -4.355  1.108   1.00 93.48 12  A 1 
ATOM 100  C CD2 . TRP A 1 12  ? -11.936 -3.386  -0.809  1.00 95.04 12  A 1 
ATOM 101  N NE1 . TRP A 1 12  ? -13.237 -3.159  0.968   1.00 91.85 12  A 1 
ATOM 102  C CE2 . TRP A 1 12  ? -12.887 -2.519  -0.199  1.00 94.08 12  A 1 
ATOM 103  C CE3 . TRP A 1 12  ? -11.395 -2.979  -2.044  1.00 91.45 12  A 1 
ATOM 104  C CZ2 . TRP A 1 12  ? -13.282 -1.308  -0.783  1.00 91.62 12  A 1 
ATOM 105  C CZ3 . TRP A 1 12  ? -11.786 -1.766  -2.639  1.00 89.12 12  A 1 
ATOM 106  C CH2 . TRP A 1 12  ? -12.726 -0.932  -2.011  1.00 88.91 12  A 1 
ATOM 107  N N   . HIS A 1 13  ? -8.560  -7.901  0.394   1.00 97.53 13  A 1 
ATOM 108  C CA  . HIS A 1 13  ? -7.876  -9.167  0.137   1.00 97.16 13  A 1 
ATOM 109  C C   . HIS A 1 13  ? -8.022  -10.145 1.312   1.00 96.86 13  A 1 
ATOM 110  O O   . HIS A 1 13  ? -8.265  -11.332 1.101   1.00 96.00 13  A 1 
ATOM 111  C CB  . HIS A 1 13  ? -6.404  -8.899  -0.192  1.00 97.01 13  A 1 
ATOM 112  C CG  . HIS A 1 13  ? -5.689  -10.146 -0.657  1.00 96.24 13  A 1 
ATOM 113  N ND1 . HIS A 1 13  ? -6.093  -10.973 -1.682  1.00 87.86 13  A 1 
ATOM 114  C CD2 . HIS A 1 13  ? -4.544  -10.677 -0.131  1.00 89.22 13  A 1 
ATOM 115  C CE1 . HIS A 1 13  ? -5.204  -11.978 -1.768  1.00 90.32 13  A 1 
ATOM 116  N NE2 . HIS A 1 13  ? -4.247  -11.832 -0.849  1.00 91.97 13  A 1 
ATOM 117  N N   . MET A 1 14  ? -7.946  -9.626  2.546   1.00 97.31 14  A 1 
ATOM 118  C CA  . MET A 1 14  ? -8.046  -10.428 3.767   1.00 96.81 14  A 1 
ATOM 119  C C   . MET A 1 14  ? -9.477  -10.845 4.135   1.00 96.37 14  A 1 
ATOM 120  O O   . MET A 1 14  ? -9.683  -11.964 4.592   1.00 95.26 14  A 1 
ATOM 121  C CB  . MET A 1 14  ? -7.444  -9.634  4.932   1.00 96.73 14  A 1 
ATOM 122  C CG  . MET A 1 14  ? -5.929  -9.473  4.803   1.00 95.08 14  A 1 
ATOM 123  S SD  . MET A 1 14  ? -5.180  -8.486  6.123   1.00 93.38 14  A 1 
ATOM 124  C CE  . MET A 1 14  ? -5.524  -9.560  7.541   1.00 86.10 14  A 1 
ATOM 125  N N   . PHE A 1 15  ? -10.453 -9.947  3.984   1.00 96.80 15  A 1 
ATOM 126  C CA  . PHE A 1 15  ? -11.784 -10.120 4.583   1.00 96.08 15  A 1 
ATOM 127  C C   . PHE A 1 15  ? -12.938 -10.149 3.576   1.00 95.68 15  A 1 
ATOM 128  O O   . PHE A 1 15  ? -14.013 -10.635 3.911   1.00 93.73 15  A 1 
ATOM 129  C CB  . PHE A 1 15  ? -12.002 -9.017  5.630   1.00 95.96 15  A 1 
ATOM 130  C CG  . PHE A 1 15  ? -10.960 -8.969  6.734   1.00 96.20 15  A 1 
ATOM 131  C CD1 . PHE A 1 15  ? -10.806 -10.059 7.612   1.00 94.46 15  A 1 
ATOM 132  C CD2 . PHE A 1 15  ? -10.144 -7.834  6.886   1.00 94.96 15  A 1 
ATOM 133  C CE1 . PHE A 1 15  ? -9.841  -10.012 8.632   1.00 94.05 15  A 1 
ATOM 134  C CE2 . PHE A 1 15  ? -9.180  -7.788  7.908   1.00 94.34 15  A 1 
ATOM 135  C CZ  . PHE A 1 15  ? -9.031  -8.875  8.780   1.00 94.65 15  A 1 
ATOM 136  N N   . ASP A 1 16  ? -12.746 -9.636  2.357   1.00 95.76 16  A 1 
ATOM 137  C CA  . ASP A 1 16  ? -13.801 -9.524  1.339   1.00 96.22 16  A 1 
ATOM 138  C C   . ASP A 1 16  ? -13.215 -9.493  -0.082  1.00 96.94 16  A 1 
ATOM 139  O O   . ASP A 1 16  ? -13.402 -8.550  -0.859  1.00 96.11 16  A 1 
ATOM 140  C CB  . ASP A 1 16  ? -14.676 -8.297  1.645   1.00 95.09 16  A 1 
ATOM 141  C CG  . ASP A 1 16  ? -15.965 -8.255  0.816   1.00 91.36 16  A 1 
ATOM 142  O OD1 . ASP A 1 16  ? -16.177 -9.155  -0.034  1.00 89.29 16  A 1 
ATOM 143  O OD2 . ASP A 1 16  ? -16.738 -7.295  1.036   1.00 88.25 16  A 1 
ATOM 144  N N   . SER A 1 17  ? -12.508 -10.556 -0.454  1.00 95.97 17  A 1 
ATOM 145  C CA  . SER A 1 17  ? -11.843 -10.663 -1.761  1.00 95.83 17  A 1 
ATOM 146  C C   . SER A 1 17  ? -12.805 -10.579 -2.958  1.00 96.73 17  A 1 
ATOM 147  O O   . SER A 1 17  ? -12.367 -10.368 -4.090  1.00 96.34 17  A 1 
ATOM 148  C CB  . SER A 1 17  ? -11.023 -11.959 -1.821  1.00 94.24 17  A 1 
ATOM 149  O OG  . SER A 1 17  ? -11.868 -13.092 -1.753  1.00 87.66 17  A 1 
ATOM 150  N N   . GLY A 1 18  ? -14.120 -10.710 -2.737  1.00 96.31 18  A 1 
ATOM 151  C CA  . GLY A 1 18  ? -15.158 -10.496 -3.746  1.00 96.90 18  A 1 
ATOM 152  C C   . GLY A 1 18  ? -15.143 -9.084  -4.338  1.00 97.50 18  A 1 
ATOM 153  O O   . GLY A 1 18  ? -15.475 -8.927  -5.511  1.00 96.59 18  A 1 
ATOM 154  N N   . LYS A 1 19  ? -14.687 -8.079  -3.578  1.00 96.60 19  A 1 
ATOM 155  C CA  . LYS A 1 19  ? -14.586 -6.677  -4.024  1.00 96.33 19  A 1 
ATOM 156  C C   . LYS A 1 19  ? -13.423 -6.407  -4.980  1.00 96.65 19  A 1 
ATOM 157  O O   . LYS A 1 19  ? -13.438 -5.392  -5.666  1.00 96.08 19  A 1 
ATOM 158  C CB  . LYS A 1 19  ? -14.460 -5.762  -2.807  1.00 96.25 19  A 1 
ATOM 159  C CG  . LYS A 1 19  ? -15.759 -5.724  -2.007  1.00 95.42 19  A 1 
ATOM 160  C CD  . LYS A 1 19  ? -15.616 -4.750  -0.844  1.00 92.34 19  A 1 
ATOM 161  C CE  . LYS A 1 19  ? -16.941 -4.679  -0.103  1.00 89.40 19  A 1 
ATOM 162  N NZ  . LYS A 1 19  ? -16.790 -3.977  1.185   1.00 81.32 19  A 1 
ATOM 163  N N   . LEU A 1 20  ? -12.436 -7.287  -5.026  1.00 96.96 20  A 1 
ATOM 164  C CA  . LEU A 1 20  ? -11.277 -7.114  -5.894  1.00 97.36 20  A 1 
ATOM 165  C C   . LEU A 1 20  ? -11.626 -7.487  -7.336  1.00 97.57 20  A 1 
ATOM 166  O O   . LEU A 1 20  ? -12.268 -8.516  -7.582  1.00 97.27 20  A 1 
ATOM 167  C CB  . LEU A 1 20  ? -10.094 -7.949  -5.386  1.00 97.42 20  A 1 
ATOM 168  C CG  . LEU A 1 20  ? -9.671  -7.686  -3.933  1.00 96.78 20  A 1 
ATOM 169  C CD1 . LEU A 1 20  ? -8.486  -8.593  -3.606  1.00 95.60 20  A 1 
ATOM 170  C CD2 . LEU A 1 20  ? -9.262  -6.241  -3.696  1.00 95.54 20  A 1 
ATOM 171  N N   . THR A 1 21  ? -11.143 -6.704  -8.296  1.00 97.08 21  A 1 
ATOM 172  C CA  . THR A 1 21  ? -11.268 -7.032  -9.720  1.00 97.03 21  A 1 
ATOM 173  C C   . THR A 1 21  ? -10.452 -8.279  -10.078 1.00 97.14 21  A 1 
ATOM 174  O O   . THR A 1 21  ? -9.485  -8.642  -9.401  1.00 97.06 21  A 1 
ATOM 175  C CB  . THR A 1 21  ? -10.858 -5.865  -10.633 1.00 96.84 21  A 1 
ATOM 176  O OG1 . THR A 1 21  ? -9.480  -5.631  -10.550 1.00 94.95 21  A 1 
ATOM 177  C CG2 . THR A 1 21  ? -11.611 -4.579  -10.319 1.00 94.48 21  A 1 
ATOM 178  N N   . SER A 1 22  ? -10.802 -8.944  -11.193 1.00 97.03 22  A 1 
ATOM 179  C CA  . SER A 1 22  ? -10.031 -10.095 -11.692 1.00 96.69 22  A 1 
ATOM 180  C C   . SER A 1 22  ? -8.573  -9.729  -11.984 1.00 96.59 22  A 1 
ATOM 181  O O   . SER A 1 22  ? -7.674  -10.526 -11.726 1.00 95.86 22  A 1 
ATOM 182  C CB  . SER A 1 22  ? -10.667 -10.654 -12.967 1.00 96.38 22  A 1 
ATOM 183  O OG  . SER A 1 22  ? -12.017 -10.987 -12.718 1.00 84.77 22  A 1 
ATOM 184  N N   . LYS A 1 23  ? -8.332  -8.505  -12.465 1.00 96.38 23  A 1 
ATOM 185  C CA  . LYS A 1 23  ? -6.981  -7.986  -12.719 1.00 95.95 23  A 1 
ATOM 186  C C   . LYS A 1 23  ? -6.162  -7.897  -11.430 1.00 96.30 23  A 1 
ATOM 187  O O   . LYS A 1 23  ? -5.039  -8.392  -11.396 1.00 95.62 23  A 1 
ATOM 188  C CB  . LYS A 1 23  ? -7.105  -6.624  -13.415 1.00 95.22 23  A 1 
ATOM 189  C CG  . LYS A 1 23  ? -5.750  -6.066  -13.873 1.00 89.01 23  A 1 
ATOM 190  C CD  . LYS A 1 23  ? -5.972  -4.702  -14.532 1.00 86.15 23  A 1 
ATOM 191  C CE  . LYS A 1 23  ? -4.662  -4.099  -15.030 1.00 79.21 23  A 1 
ATOM 192  N NZ  . LYS A 1 23  ? -4.874  -2.701  -15.478 1.00 71.56 23  A 1 
ATOM 193  N N   . VAL A 1 24  ? -6.735  -7.329  -10.368 1.00 96.42 24  A 1 
ATOM 194  C CA  . VAL A 1 24  ? -6.080  -7.237  -9.053  1.00 96.75 24  A 1 
ATOM 195  C C   . VAL A 1 24  ? -5.834  -8.625  -8.468  1.00 96.57 24  A 1 
ATOM 196  O O   . VAL A 1 24  ? -4.715  -8.908  -8.047  1.00 96.39 24  A 1 
ATOM 197  C CB  . VAL A 1 24  ? -6.896  -6.351  -8.095  1.00 96.92 24  A 1 
ATOM 198  C CG1 . VAL A 1 24  ? -6.351  -6.387  -6.666  1.00 96.15 24  A 1 
ATOM 199  C CG2 . VAL A 1 24  ? -6.860  -4.900  -8.578  1.00 96.25 24  A 1 
ATOM 200  N N   . LYS A 1 25  ? -6.822  -9.527  -8.521  1.00 96.61 25  A 1 
ATOM 201  C CA  . LYS A 1 25  ? -6.658  -10.916 -8.057  1.00 96.16 25  A 1 
ATOM 202  C C   . LYS A 1 25  ? -5.494  -11.621 -8.750  1.00 95.51 25  A 1 
ATOM 203  O O   . LYS A 1 25  ? -4.700  -12.269 -8.073  1.00 95.16 25  A 1 
ATOM 204  C CB  . LYS A 1 25  ? -7.961  -11.706 -8.265  1.00 96.61 25  A 1 
ATOM 205  C CG  . LYS A 1 25  ? -9.046  -11.260 -7.276  1.00 96.21 25  A 1 
ATOM 206  C CD  . LYS A 1 25  ? -10.391 -11.936 -7.566  1.00 94.49 25  A 1 
ATOM 207  C CE  . LYS A 1 25  ? -11.377 -11.429 -6.519  1.00 91.75 25  A 1 
ATOM 208  N NZ  . LYS A 1 25  ? -12.789 -11.767 -6.802  1.00 85.55 25  A 1 
ATOM 209  N N   . ASN A 1 26  ? -5.354  -11.451 -10.069 1.00 95.99 26  A 1 
ATOM 210  C CA  . ASN A 1 26  ? -4.244  -12.035 -10.829 1.00 95.07 26  A 1 
ATOM 211  C C   . ASN A 1 26  ? -2.885  -11.474 -10.382 1.00 94.89 26  A 1 
ATOM 212  O O   . ASN A 1 26  ? -1.947  -12.241 -10.182 1.00 93.61 26  A 1 
ATOM 213  C CB  . ASN A 1 26  ? -4.470  -11.802 -12.331 1.00 94.39 26  A 1 
ATOM 214  C CG  . ASN A 1 26  ? -5.629  -12.606 -12.905 1.00 85.42 26  A 1 
ATOM 215  O OD1 . ASN A 1 26  ? -6.165  -13.528 -12.316 1.00 77.25 26  A 1 
ATOM 216  N ND2 . ASN A 1 26  ? -6.044  -12.292 -14.109 1.00 75.12 26  A 1 
ATOM 217  N N   . VAL A 1 27  ? -2.784  -10.153 -10.181 1.00 95.34 27  A 1 
ATOM 218  C CA  . VAL A 1 27  ? -1.547  -9.529  -9.670  1.00 95.23 27  A 1 
ATOM 219  C C   . VAL A 1 27  ? -1.207  -10.050 -8.271  1.00 95.01 27  A 1 
ATOM 220  O O   . VAL A 1 27  ? -0.054  -10.389 -8.004  1.00 94.22 27  A 1 
ATOM 221  C CB  . VAL A 1 27  ? -1.659  -7.991  -9.667  1.00 95.46 27  A 1 
ATOM 222  C CG1 . VAL A 1 27  ? -0.472  -7.320  -8.966  1.00 94.15 27  A 1 
ATOM 223  C CG2 . VAL A 1 27  ? -1.708  -7.444  -11.101 1.00 94.03 27  A 1 
ATOM 224  N N   . LEU A 1 28  ? -2.199  -10.153 -7.381  1.00 95.58 28  A 1 
ATOM 225  C CA  . LEU A 1 28  ? -1.985  -10.595 -5.999  1.00 95.32 28  A 1 
ATOM 226  C C   . LEU A 1 28  ? -1.604  -12.079 -5.902  1.00 94.27 28  A 1 
ATOM 227  O O   . LEU A 1 28  ? -0.800  -12.427 -5.042  1.00 92.99 28  A 1 
ATOM 228  C CB  . LEU A 1 28  ? -3.233  -10.281 -5.155  1.00 95.92 28  A 1 
ATOM 229  C CG  . LEU A 1 28  ? -3.523  -8.778  -4.965  1.00 95.66 28  A 1 
ATOM 230  C CD1 . LEU A 1 28  ? -4.792  -8.601  -4.139  1.00 94.80 28  A 1 
ATOM 231  C CD2 . LEU A 1 28  ? -2.389  -8.032  -4.272  1.00 94.85 28  A 1 
ATOM 232  N N   . SER A 1 29  ? -2.118  -12.930 -6.798  1.00 94.47 29  A 1 
ATOM 233  C CA  . SER A 1 29  ? -1.819  -14.370 -6.799  1.00 92.77 29  A 1 
ATOM 234  C C   . SER A 1 29  ? -0.476  -14.735 -7.443  1.00 91.54 29  A 1 
ATOM 235  O O   . SER A 1 29  ? 0.089   -15.777 -7.109  1.00 87.71 29  A 1 
ATOM 236  C CB  . SER A 1 29  ? -2.947  -15.148 -7.481  1.00 91.38 29  A 1 
ATOM 237  O OG  . SER A 1 29  ? -3.099  -14.799 -8.844  1.00 84.53 29  A 1 
ATOM 238  N N   . ASP A 1 30  ? 0.056   -13.905 -8.352  1.00 90.00 30  A 1 
ATOM 239  C CA  . ASP A 1 30  ? 1.309   -14.199 -9.055  1.00 89.08 30  A 1 
ATOM 240  C C   . ASP A 1 30  ? 2.528   -13.757 -8.226  1.00 87.28 30  A 1 
ATOM 241  O O   . ASP A 1 30  ? 2.883   -12.581 -8.176  1.00 84.15 30  A 1 
ATOM 242  C CB  . ASP A 1 30  ? 1.287   -13.575 -10.459 1.00 88.28 30  A 1 
ATOM 243  C CG  . ASP A 1 30  ? 2.488   -14.014 -11.315 1.00 86.45 30  A 1 
ATOM 244  O OD1 . ASP A 1 30  ? 3.522   -14.455 -10.757 1.00 81.74 30  A 1 
ATOM 245  O OD2 . ASP A 1 30  ? 2.389   -13.907 -12.556 1.00 80.73 30  A 1 
ATOM 246  N N   . ASN A 1 31  ? 3.192   -14.715 -7.584  1.00 88.83 31  A 1 
ATOM 247  C CA  . ASN A 1 31  ? 4.413   -14.485 -6.802  1.00 87.09 31  A 1 
ATOM 248  C C   . ASN A 1 31  ? 5.712   -14.696 -7.598  1.00 87.34 31  A 1 
ATOM 249  O O   . ASN A 1 31  ? 6.794   -14.607 -7.031  1.00 83.77 31  A 1 
ATOM 250  C CB  . ASN A 1 31  ? 4.356   -15.329 -5.517  1.00 84.47 31  A 1 
ATOM 251  C CG  . ASN A 1 31  ? 3.306   -14.819 -4.542  1.00 80.66 31  A 1 
ATOM 252  O OD1 . ASN A 1 31  ? 2.930   -13.655 -4.542  1.00 74.76 31  A 1 
ATOM 253  N ND2 . ASN A 1 31  ? 2.804   -15.660 -3.673  1.00 73.29 31  A 1 
ATOM 254  N N   . THR A 1 32  ? 5.609   -14.970 -8.901  1.00 84.05 32  A 1 
ATOM 255  C CA  . THR A 1 32  ? 6.774   -15.240 -9.759  1.00 84.89 32  A 1 
ATOM 256  C C   . THR A 1 32  ? 7.200   -14.008 -10.551 1.00 85.70 32  A 1 
ATOM 257  O O   . THR A 1 32  ? 8.395   -13.773 -10.720 1.00 81.96 32  A 1 
ATOM 258  C CB  . THR A 1 32  ? 6.522   -16.421 -10.704 1.00 83.21 32  A 1 
ATOM 259  O OG1 . THR A 1 32  ? 5.536   -16.147 -11.668 1.00 77.88 32  A 1 
ATOM 260  C CG2 . THR A 1 32  ? 6.108   -17.692 -9.958  1.00 75.62 32  A 1 
ATOM 261  N N   . GLN A 1 33  ? 6.235   -13.208 -11.010 1.00 85.88 33  A 1 
ATOM 262  C CA  . GLN A 1 33  ? 6.482   -12.025 -11.840 1.00 86.41 33  A 1 
ATOM 263  C C   . GLN A 1 33  ? 6.388   -10.708 -11.065 1.00 87.32 33  A 1 
ATOM 264  O O   . GLN A 1 33  ? 6.963   -9.701  -11.489 1.00 83.62 33  A 1 
ATOM 265  C CB  . GLN A 1 33  ? 5.493   -12.010 -13.007 1.00 83.51 33  A 1 
ATOM 266  C CG  . GLN A 1 33  ? 5.675   -13.228 -13.925 1.00 74.31 33  A 1 
ATOM 267  C CD  . GLN A 1 33  ? 4.868   -13.137 -15.213 1.00 67.62 33  A 1 
ATOM 268  O OE1 . GLN A 1 33  ? 4.138   -12.194 -15.491 1.00 62.48 33  A 1 
ATOM 269  N NE2 . GLN A 1 33  ? 4.990   -14.114 -16.085 1.00 59.03 33  A 1 
ATOM 270  N N   . PHE A 1 34  ? 5.648   -10.697 -9.960  1.00 87.69 34  A 1 
ATOM 271  C CA  . PHE A 1 34  ? 5.282   -9.466  -9.270  1.00 88.65 34  A 1 
ATOM 272  C C   . PHE A 1 34  ? 5.703   -9.481  -7.803  1.00 89.06 34  A 1 
ATOM 273  O O   . PHE A 1 34  ? 5.330   -10.379 -7.052  1.00 87.19 34  A 1 
ATOM 274  C CB  . PHE A 1 34  ? 3.772   -9.220  -9.417  1.00 87.51 34  A 1 
ATOM 275  C CG  . PHE A 1 34  ? 3.233   -9.261  -10.841 1.00 86.56 34  A 1 
ATOM 276  C CD1 . PHE A 1 34  ? 3.919   -8.625  -11.892 1.00 81.41 34  A 1 
ATOM 277  C CD2 . PHE A 1 34  ? 2.040   -9.954  -11.120 1.00 81.68 34  A 1 
ATOM 278  C CE1 . PHE A 1 34  ? 3.431   -8.703  -13.210 1.00 78.36 34  A 1 
ATOM 279  C CE2 . PHE A 1 34  ? 1.547   -10.025 -12.435 1.00 80.01 34  A 1 
ATOM 280  C CZ  . PHE A 1 34  ? 2.249   -9.404  -13.483 1.00 81.14 34  A 1 
ATOM 281  N N   . ASN A 1 35  ? 6.401   -8.429  -7.378  1.00 93.66 35  A 1 
ATOM 282  C CA  . ASN A 1 35  ? 6.639   -8.148  -5.964  1.00 94.50 35  A 1 
ATOM 283  C C   . ASN A 1 35  ? 5.496   -7.283  -5.428  1.00 95.50 35  A 1 
ATOM 284  O O   . ASN A 1 35  ? 5.056   -6.339  -6.098  1.00 95.17 35  A 1 
ATOM 285  C CB  . ASN A 1 35  ? 7.990   -7.447  -5.790  1.00 93.54 35  A 1 
ATOM 286  C CG  . ASN A 1 35  ? 9.143   -8.218  -6.392  1.00 91.77 35  A 1 
ATOM 287  O OD1 . ASN A 1 35  ? 9.318   -9.402  -6.158  1.00 85.56 35  A 1 
ATOM 288  N ND2 . ASN A 1 35  ? 9.950   -7.577  -7.204  1.00 84.10 35  A 1 
ATOM 289  N N   . LYS A 1 36  ? 5.004   -7.601  -4.220  1.00 96.81 36  A 1 
ATOM 290  C CA  . LYS A 1 36  ? 3.936   -6.842  -3.558  1.00 96.89 36  A 1 
ATOM 291  C C   . LYS A 1 36  ? 4.439   -6.280  -2.250  1.00 97.21 36  A 1 
ATOM 292  O O   . LYS A 1 36  ? 5.049   -6.992  -1.452  1.00 96.75 36  A 1 
ATOM 293  C CB  . LYS A 1 36  ? 2.670   -7.678  -3.316  1.00 96.07 36  A 1 
ATOM 294  C CG  . LYS A 1 36  ? 1.971   -8.202  -4.571  1.00 94.76 36  A 1 
ATOM 295  C CD  . LYS A 1 36  ? 2.710   -9.402  -5.141  1.00 93.00 36  A 1 
ATOM 296  C CE  . LYS A 1 36  ? 1.763   -10.405 -5.759  1.00 90.72 36  A 1 
ATOM 297  N NZ  . LYS A 1 36  ? 2.512   -11.593 -6.174  1.00 86.91 36  A 1 
ATOM 298  N N   . TYR A 1 37  ? 4.118   -5.025  -2.040  1.00 97.63 37  A 1 
ATOM 299  C CA  . TYR A 1 37  ? 4.538   -4.280  -0.870  1.00 97.89 37  A 1 
ATOM 300  C C   . TYR A 1 37  ? 3.337   -3.716  -0.122  1.00 98.08 37  A 1 
ATOM 301  O O   . TYR A 1 37  ? 2.322   -3.338  -0.714  1.00 97.82 37  A 1 
ATOM 302  C CB  . TYR A 1 37  ? 5.519   -3.181  -1.285  1.00 97.74 37  A 1 
ATOM 303  C CG  . TYR A 1 37  ? 6.779   -3.704  -1.951  1.00 97.56 37  A 1 
ATOM 304  C CD1 . TYR A 1 37  ? 7.907   -4.035  -1.176  1.00 96.35 37  A 1 
ATOM 305  C CD2 . TYR A 1 37  ? 6.817   -3.882  -3.349  1.00 96.36 37  A 1 
ATOM 306  C CE1 . TYR A 1 37  ? 9.072   -4.537  -1.791  1.00 95.36 37  A 1 
ATOM 307  C CE2 . TYR A 1 37  ? 7.977   -4.390  -3.968  1.00 95.53 37  A 1 
ATOM 308  C CZ  . TYR A 1 37  ? 9.107   -4.715  -3.188  1.00 95.57 37  A 1 
ATOM 309  O OH  . TYR A 1 37  ? 10.230  -5.201  -3.785  1.00 94.05 37  A 1 
ATOM 310  N N   . ILE A 1 38  ? 3.483   -3.642  1.189   1.00 97.54 38  A 1 
ATOM 311  C CA  . ILE A 1 38  ? 2.588   -2.919  2.090   1.00 97.29 38  A 1 
ATOM 312  C C   . ILE A 1 38  ? 3.388   -1.768  2.694   1.00 97.47 38  A 1 
ATOM 313  O O   . ILE A 1 38  ? 4.476   -1.982  3.232   1.00 96.75 38  A 1 
ATOM 314  C CB  . ILE A 1 38  ? 2.025   -3.870  3.167   1.00 95.62 38  A 1 
ATOM 315  C CG1 . ILE A 1 38  ? 1.256   -5.068  2.568   1.00 88.96 38  A 1 
ATOM 316  C CG2 . ILE A 1 38  ? 1.120   -3.106  4.146   1.00 88.76 38  A 1 
ATOM 317  C CD1 . ILE A 1 38  ? 0.069   -4.694  1.675   1.00 83.53 38  A 1 
ATOM 318  N N   . SER A 1 39  ? 2.862   -0.549  2.609   1.00 97.44 39  A 1 
ATOM 319  C CA  . SER A 1 39  ? 3.507   0.592   3.257   1.00 97.24 39  A 1 
ATOM 320  C C   . SER A 1 39  ? 3.420   0.474   4.777   1.00 97.35 39  A 1 
ATOM 321  O O   . SER A 1 39  ? 2.386   0.086   5.327   1.00 96.96 39  A 1 
ATOM 322  C CB  . SER A 1 39  ? 2.884   1.914   2.796   1.00 96.61 39  A 1 
ATOM 323  O OG  . SER A 1 39  ? 3.603   2.998   3.369   1.00 93.83 39  A 1 
ATOM 324  N N   . MET A 1 40  ? 4.459   0.904   5.481   1.00 97.04 40  A 1 
ATOM 325  C CA  . MET A 1 40  ? 4.389   1.109   6.928   1.00 97.10 40  A 1 
ATOM 326  C C   . MET A 1 40  ? 3.231   2.054   7.311   1.00 97.25 40  A 1 
ATOM 327  O O   . MET A 1 40  ? 2.637   1.892   8.373   1.00 96.84 40  A 1 
ATOM 328  C CB  . MET A 1 40  ? 5.749   1.649   7.414   1.00 96.47 40  A 1 
ATOM 329  C CG  . MET A 1 40  ? 5.833   1.738   8.939   1.00 93.17 40  A 1 
ATOM 330  S SD  . MET A 1 40  ? 5.608   0.169   9.840   1.00 91.13 40  A 1 
ATOM 331  C CE  . MET A 1 40  ? 7.104   -0.723  9.342   1.00 83.61 40  A 1 
ATOM 332  N N   . ALA A 1 41  ? 2.851   2.999   6.427   1.00 97.01 41  A 1 
ATOM 333  C CA  . ALA A 1 41  ? 1.691   3.872   6.615   1.00 96.83 41  A 1 
ATOM 334  C C   . ALA A 1 41  ? 0.381   3.081   6.731   1.00 97.15 41  A 1 
ATOM 335  O O   . ALA A 1 41  ? -0.406  3.347   7.636   1.00 96.81 41  A 1 
ATOM 336  C CB  . ALA A 1 41  ? 1.607   4.867   5.449   1.00 96.17 41  A 1 
ATOM 337  N N   . THR A 1 42  ? 0.182   2.061   5.886   1.00 97.70 42  A 1 
ATOM 338  C CA  . THR A 1 42  ? -0.987  1.165   5.927   1.00 97.90 42  A 1 
ATOM 339  C C   . THR A 1 42  ? -1.091  0.448   7.273   1.00 98.08 42  A 1 
ATOM 340  O O   . THR A 1 42  ? -2.164  0.371   7.867   1.00 97.93 42  A 1 
ATOM 341  C CB  . THR A 1 42  ? -0.886  0.131   4.794   1.00 97.70 42  A 1 
ATOM 342  O OG1 . THR A 1 42  ? -0.953  0.793   3.552   1.00 96.20 42  A 1 
ATOM 343  C CG2 . THR A 1 42  ? -1.973  -0.933  4.806   1.00 96.41 42  A 1 
ATOM 344  N N   . LEU A 1 43  ? 0.026   -0.040  7.806   1.00 97.64 43  A 1 
ATOM 345  C CA  . LEU A 1 43  ? 0.046   -0.726  9.102   1.00 97.62 43  A 1 
ATOM 346  C C   . LEU A 1 43  ? -0.263  0.233   10.260  1.00 97.76 43  A 1 
ATOM 347  O O   . LEU A 1 43  ? -1.003  -0.128  11.177  1.00 97.49 43  A 1 
ATOM 348  C CB  . LEU A 1 43  ? 1.405   -1.417  9.297   1.00 97.42 43  A 1 
ATOM 349  C CG  . LEU A 1 43  ? 1.733   -2.480  8.231   1.00 96.65 43  A 1 
ATOM 350  C CD1 . LEU A 1 43  ? 3.115   -3.059  8.511   1.00 95.42 43  A 1 
ATOM 351  C CD2 . LEU A 1 43  ? 0.721   -3.627  8.212   1.00 95.31 43  A 1 
ATOM 352  N N   . TRP A 1 44  ? 0.252   1.465   10.205  1.00 97.52 44  A 1 
ATOM 353  C CA  . TRP A 1 44  ? -0.096  2.508   11.165  1.00 97.51 44  A 1 
ATOM 354  C C   . TRP A 1 44  ? -1.569  2.895   11.088  1.00 97.73 44  A 1 
ATOM 355  O O   . TRP A 1 44  ? -2.223  2.965   12.129  1.00 97.51 44  A 1 
ATOM 356  C CB  . TRP A 1 44  ? 0.803   3.731   10.967  1.00 97.01 44  A 1 
ATOM 357  C CG  . TRP A 1 44  ? 2.106   3.638   11.691  1.00 95.69 44  A 1 
ATOM 358  C CD1 . TRP A 1 44  ? 3.331   3.562   11.125  1.00 92.61 44  A 1 
ATOM 359  C CD2 . TRP A 1 44  ? 2.324   3.593   13.132  1.00 93.93 44  A 1 
ATOM 360  N NE1 . TRP A 1 44  ? 4.294   3.476   12.109  1.00 90.60 44  A 1 
ATOM 361  C CE2 . TRP A 1 44  ? 3.729   3.488   13.369  1.00 92.18 44  A 1 
ATOM 362  C CE3 . TRP A 1 44  ? 1.484   3.630   14.268  1.00 89.98 44  A 1 
ATOM 363  C CZ2 . TRP A 1 44  ? 4.269   3.422   14.665  1.00 90.07 44  A 1 
ATOM 364  C CZ3 . TRP A 1 44  ? 2.017   3.562   15.570  1.00 88.56 44  A 1 
ATOM 365  C CH2 . TRP A 1 44  ? 3.406   3.459   15.765  1.00 87.82 44  A 1 
ATOM 366  N N   . GLU A 1 45  ? -2.110  3.072   9.888   1.00 97.48 45  A 1 
ATOM 367  C CA  . GLU A 1 45  ? -3.527  3.395   9.685   1.00 97.62 45  A 1 
ATOM 368  C C   . GLU A 1 45  ? -4.439  2.329   10.301  1.00 97.90 45  A 1 
ATOM 369  O O   . GLU A 1 45  ? -5.322  2.644   11.110  1.00 97.63 45  A 1 
ATOM 370  C CB  . GLU A 1 45  ? -3.793  3.513   8.185   1.00 97.32 45  A 1 
ATOM 371  C CG  . GLU A 1 45  ? -5.206  4.031   7.918   1.00 95.89 45  A 1 
ATOM 372  C CD  . GLU A 1 45  ? -5.582  3.955   6.435   1.00 95.24 45  A 1 
ATOM 373  O OE1 . GLU A 1 45  ? -6.806  4.021   6.189   1.00 91.08 45  A 1 
ATOM 374  O OE2 . GLU A 1 45  ? -4.689  3.733   5.594   1.00 91.93 45  A 1 
ATOM 375  N N   . ILE A 1 46  ? -4.186  1.056   9.973   1.00 98.11 46  A 1 
ATOM 376  C CA  . ILE A 1 46  ? -4.931  -0.085  10.516  1.00 98.27 46  A 1 
ATOM 377  C C   . ILE A 1 46  ? -4.828  -0.114  12.045  1.00 98.31 46  A 1 
ATOM 378  O O   . ILE A 1 46  ? -5.843  -0.246  12.733  1.00 98.19 46  A 1 
ATOM 379  C CB  . ILE A 1 46  ? -4.423  -1.397  9.871   1.00 98.33 46  A 1 
ATOM 380  C CG1 . ILE A 1 46  ? -4.864  -1.455  8.386   1.00 98.08 46  A 1 
ATOM 381  C CG2 . ILE A 1 46  ? -4.940  -2.629  10.627  1.00 98.09 46  A 1 
ATOM 382  C CD1 . ILE A 1 46  ? -4.226  -2.602  7.589   1.00 97.47 46  A 1 
ATOM 383  N N   . SER A 1 47  ? -3.622  0.051   12.586  1.00 98.19 47  A 1 
ATOM 384  C CA  . SER A 1 47  ? -3.379  0.046   14.034  1.00 98.04 47  A 1 
ATOM 385  C C   . SER A 1 47  ? -4.128  1.176   14.749  1.00 98.17 47  A 1 
ATOM 386  O O   . SER A 1 47  ? -4.810  0.937   15.747  1.00 97.98 47  A 1 
ATOM 387  C CB  . SER A 1 47  ? -1.872  0.146   14.296  1.00 97.54 47  A 1 
ATOM 388  O OG  . SER A 1 47  ? -1.609  0.030   15.680  1.00 84.25 47  A 1 
ATOM 389  N N   . ILE A 1 48  ? -4.057  2.396   14.220  1.00 98.00 48  A 1 
ATOM 390  C CA  . ILE A 1 48  ? -4.741  3.572   14.777  1.00 97.92 48  A 1 
ATOM 391  C C   . ILE A 1 48  ? -6.257  3.376   14.723  1.00 97.95 48  A 1 
ATOM 392  O O   . ILE A 1 48  ? -6.929  3.529   15.744  1.00 97.78 48  A 1 
ATOM 393  C CB  . ILE A 1 48  ? -4.292  4.853   14.034  1.00 97.57 48  A 1 
ATOM 394  C CG1 . ILE A 1 48  ? -2.823  5.185   14.390  1.00 96.83 48  A 1 
ATOM 395  C CG2 . ILE A 1 48  ? -5.198  6.052   14.377  1.00 96.71 48  A 1 
ATOM 396  C CD1 . ILE A 1 48  ? -2.171  6.194   13.436  1.00 94.60 48  A 1 
ATOM 397  N N   . LYS A 1 49  ? -6.803  2.983   13.562  1.00 97.88 49  A 1 
ATOM 398  C CA  . LYS A 1 49  ? -8.246  2.762   13.383  1.00 97.71 49  A 1 
ATOM 399  C C   . LYS A 1 49  ? -8.762  1.637   14.283  1.00 97.83 49  A 1 
ATOM 400  O O   . LYS A 1 49  ? -9.841  1.775   14.859  1.00 97.64 49  A 1 
ATOM 401  C CB  . LYS A 1 49  ? -8.560  2.492   11.898  1.00 97.37 49  A 1 
ATOM 402  C CG  . LYS A 1 49  ? -8.478  3.766   11.033  1.00 96.22 49  A 1 
ATOM 403  C CD  . LYS A 1 49  ? -8.767  3.478   9.541   1.00 94.07 49  A 1 
ATOM 404  C CE  . LYS A 1 49  ? -8.791  4.783   8.727   1.00 90.95 49  A 1 
ATOM 405  N NZ  . LYS A 1 49  ? -8.939  4.573   7.261   1.00 84.23 49  A 1 
ATOM 406  N N   . ASN A 1 50  ? -7.995  0.560   14.456  1.00 98.01 50  A 1 
ATOM 407  C CA  . ASN A 1 50  ? -8.332  -0.524  15.381  1.00 97.93 50  A 1 
ATOM 408  C C   . ASN A 1 50  ? -8.330  -0.047  16.838  1.00 97.93 50  A 1 
ATOM 409  O O   . ASN A 1 50  ? -9.311  -0.261  17.553  1.00 97.77 50  A 1 
ATOM 410  C CB  . ASN A 1 50  ? -7.362  -1.699  15.166  1.00 97.94 50  A 1 
ATOM 411  C CG  . ASN A 1 50  ? -7.666  -2.858  16.101  1.00 97.37 50  A 1 
ATOM 412  O OD1 . ASN A 1 50  ? -6.906  -3.194  16.993  1.00 91.77 50  A 1 
ATOM 413  N ND2 . ASN A 1 50  ? -8.802  -3.492  15.940  1.00 92.23 50  A 1 
ATOM 414  N N   . ARG A 1 51  ? -7.287  0.671   17.259  1.00 97.50 51  A 1 
ATOM 415  C CA  . ARG A 1 51  ? -7.137  1.179   18.632  1.00 97.33 51  A 1 
ATOM 416  C C   . ARG A 1 51  ? -8.300  2.073   19.073  1.00 97.43 51  A 1 
ATOM 417  O O   . ARG A 1 51  ? -8.680  2.032   20.237  1.00 97.01 51  A 1 
ATOM 418  C CB  . ARG A 1 51  ? -5.790  1.912   18.742  1.00 97.02 51  A 1 
ATOM 419  C CG  . ARG A 1 51  ? -5.547  2.475   20.149  1.00 95.19 51  A 1 
ATOM 420  C CD  . ARG A 1 51  ? -4.161  3.108   20.238  1.00 93.49 51  A 1 
ATOM 421  N NE  . ARG A 1 51  ? -3.954  3.716   21.565  1.00 89.16 51  A 1 
ATOM 422  C CZ  . ARG A 1 51  ? -2.796  3.967   22.154  1.00 85.92 51  A 1 
ATOM 423  N NH1 . ARG A 1 51  ? -1.660  3.681   21.584  1.00 79.96 51  A 1 
ATOM 424  N NH2 . ARG A 1 51  ? -2.760  4.510   23.337  1.00 78.69 51  A 1 
ATOM 425  N N   . ILE A 1 52  ? -8.844  2.878   18.165  1.00 97.93 52  A 1 
ATOM 426  C CA  . ILE A 1 52  ? -9.972  3.781   18.456  1.00 97.69 52  A 1 
ATOM 427  C C   . ILE A 1 52  ? -11.342 3.150   18.156  1.00 97.56 52  A 1 
ATOM 428  O O   . ILE A 1 52  ? -12.349 3.854   18.135  1.00 96.79 52  A 1 
ATOM 429  C CB  . ILE A 1 52  ? -9.780  5.158   17.777  1.00 97.51 52  A 1 
ATOM 430  C CG1 . ILE A 1 52  ? -9.915  5.043   16.242  1.00 97.15 52  A 1 
ATOM 431  C CG2 . ILE A 1 52  ? -8.446  5.793   18.206  1.00 96.21 52  A 1 
ATOM 432  C CD1 . ILE A 1 52  ? -9.778  6.375   15.497  1.00 95.57 52  A 1 
ATOM 433  N N   . GLY A 1 53  ? -11.399 1.847   17.883  1.00 97.66 53  A 1 
ATOM 434  C CA  . GLY A 1 53  ? -12.644 1.109   17.644  1.00 97.25 53  A 1 
ATOM 435  C C   . GLY A 1 53  ? -13.306 1.350   16.280  1.00 97.36 53  A 1 
ATOM 436  O O   . GLY A 1 53  ? -14.424 0.891   16.065  1.00 96.10 53  A 1 
ATOM 437  N N   . LYS A 1 54  ? -12.639 2.053   15.345  1.00 97.42 54  A 1 
ATOM 438  C CA  . LYS A 1 54  ? -13.159 2.294   13.985  1.00 96.91 54  A 1 
ATOM 439  C C   . LYS A 1 54  ? -12.946 1.116   13.027  1.00 97.11 54  A 1 
ATOM 440  O O   . LYS A 1 54  ? -13.625 1.049   12.010  1.00 96.14 54  A 1 
ATOM 441  C CB  . LYS A 1 54  ? -12.541 3.562   13.384  1.00 96.01 54  A 1 
ATOM 442  C CG  . LYS A 1 54  ? -13.090 4.841   14.019  1.00 90.03 54  A 1 
ATOM 443  C CD  . LYS A 1 54  ? -12.634 6.063   13.214  1.00 84.18 54  A 1 
ATOM 444  C CE  . LYS A 1 54  ? -13.219 7.351   13.805  1.00 79.22 54  A 1 
ATOM 445  N NZ  . LYS A 1 54  ? -12.842 8.535   12.993  1.00 70.34 54  A 1 
ATOM 446  N N   . LEU A 1 55  ? -12.011 0.222   13.335  1.00 97.10 55  A 1 
ATOM 447  C CA  . LEU A 1 55  ? -11.708 -0.972  12.552  1.00 97.24 55  A 1 
ATOM 448  C C   . LEU A 1 55  ? -11.535 -2.166  13.502  1.00 97.41 55  A 1 
ATOM 449  O O   . LEU A 1 55  ? -10.411 -2.448  13.930  1.00 97.06 55  A 1 
ATOM 450  C CB  . LEU A 1 55  ? -10.460 -0.698  11.687  1.00 97.23 55  A 1 
ATOM 451  C CG  . LEU A 1 55  ? -10.047 -1.876  10.785  1.00 96.80 55  A 1 
ATOM 452  C CD1 . LEU A 1 55  ? -11.096 -2.175  9.713   1.00 95.56 55  A 1 
ATOM 453  C CD2 . LEU A 1 55  ? -8.725  -1.540  10.092  1.00 95.47 55  A 1 
ATOM 454  N N   . PRO A 1 56  ? -12.621 -2.855  13.888  1.00 97.42 56  A 1 
ATOM 455  C CA  . PRO A 1 56  ? -12.513 -4.053  14.709  1.00 97.00 56  A 1 
ATOM 456  C C   . PRO A 1 56  ? -11.808 -5.165  13.923  1.00 97.12 56  A 1 
ATOM 457  O O   . PRO A 1 56  ? -12.174 -5.460  12.786  1.00 96.38 56  A 1 
ATOM 458  C CB  . PRO A 1 56  ? -13.950 -4.412  15.093  1.00 96.23 56  A 1 
ATOM 459  C CG  . PRO A 1 56  ? -14.785 -3.834  13.949  1.00 94.19 56  A 1 
ATOM 460  C CD  . PRO A 1 56  ? -14.016 -2.586  13.541  1.00 96.71 56  A 1 
ATOM 461  N N   . LEU A 1 57  ? -10.802 -5.785  14.531  1.00 97.15 57  A 1 
ATOM 462  C CA  . LEU A 1 57  ? -10.023 -6.869  13.934  1.00 97.09 57  A 1 
ATOM 463  C C   . LEU A 1 57  ? -10.191 -8.139  14.774  1.00 96.72 57  A 1 
ATOM 464  O O   . LEU A 1 57  ? -9.831  -8.114  15.953  1.00 95.94 57  A 1 
ATOM 465  C CB  . LEU A 1 57  ? -8.542  -6.462  13.840  1.00 97.17 57  A 1 
ATOM 466  C CG  . LEU A 1 57  ? -8.239  -5.274  12.917  1.00 97.02 57  A 1 
ATOM 467  C CD1 . LEU A 1 57  ? -6.750  -4.935  13.013  1.00 96.28 57  A 1 
ATOM 468  C CD2 . LEU A 1 57  ? -8.568  -5.572  11.453  1.00 96.36 57  A 1 
ATOM 469  N N   . PRO A 1 58  ? -10.667 -9.265  14.196  1.00 96.04 58  A 1 
ATOM 470  C CA  . PRO A 1 58  ? -10.921 -10.505 14.941  1.00 94.86 58  A 1 
ATOM 471  C C   . PRO A 1 58  ? -9.693  -11.043 15.691  1.00 95.01 58  A 1 
ATOM 472  O O   . PRO A 1 58  ? -9.819  -11.582 16.786  1.00 93.18 58  A 1 
ATOM 473  C CB  . PRO A 1 58  ? -11.402 -11.518 13.896  1.00 93.81 58  A 1 
ATOM 474  C CG  . PRO A 1 58  ? -12.017 -10.647 12.803  1.00 92.31 58  A 1 
ATOM 475  C CD  . PRO A 1 58  ? -11.151 -9.394  12.824  1.00 95.15 58  A 1 
ATOM 476  N N   . HIS A 1 59  ? -8.509  -10.859 15.109  1.00 95.71 59  A 1 
ATOM 477  C CA  . HIS A 1 59  ? -7.225  -11.307 15.667  1.00 96.00 59  A 1 
ATOM 478  C C   . HIS A 1 59  ? -6.283  -10.141 16.010  1.00 96.34 59  A 1 
ATOM 479  O O   . HIS A 1 59  ? -5.069  -10.323 16.114  1.00 94.79 59  A 1 
ATOM 480  C CB  . HIS A 1 59  ? -6.594  -12.329 14.709  1.00 95.70 59  A 1 
ATOM 481  C CG  . HIS A 1 59  ? -7.508  -13.493 14.420  1.00 95.06 59  A 1 
ATOM 482  N ND1 . HIS A 1 59  ? -8.024  -14.368 15.350  1.00 83.62 59  A 1 
ATOM 483  C CD2 . HIS A 1 59  ? -8.033  -13.844 13.205  1.00 84.29 59  A 1 
ATOM 484  C CE1 . HIS A 1 59  ? -8.841  -15.221 14.708  1.00 86.09 59  A 1 
ATOM 485  N NE2 . HIS A 1 59  ? -8.876  -14.943 13.402  1.00 88.06 59  A 1 
ATOM 486  N N   . GLY A 1 60  ? -6.833  -8.929  16.162  1.00 95.96 60  A 1 
ATOM 487  C CA  . GLY A 1 60  ? -6.052  -7.718  16.396  1.00 95.77 60  A 1 
ATOM 488  C C   . GLY A 1 60  ? -5.067  -7.417  15.257  1.00 96.69 60  A 1 
ATOM 489  O O   . GLY A 1 60  ? -5.130  -7.987  14.167  1.00 96.22 60  A 1 
ATOM 490  N N   . VAL A 1 61  ? -4.133  -6.505  15.524  1.00 96.68 61  A 1 
ATOM 491  C CA  . VAL A 1 61  ? -3.104  -6.099  14.545  1.00 96.69 61  A 1 
ATOM 492  C C   . VAL A 1 61  ? -2.124  -7.241  14.239  1.00 96.99 61  A 1 
ATOM 493  O O   . VAL A 1 61  ? -1.648  -7.359  13.114  1.00 96.59 61  A 1 
ATOM 494  C CB  . VAL A 1 61  ? -2.363  -4.848  15.055  1.00 95.78 61  A 1 
ATOM 495  C CG1 . VAL A 1 61  ? -1.296  -4.361  14.072  1.00 92.08 61  A 1 
ATOM 496  C CG2 . VAL A 1 61  ? -3.339  -3.683  15.267  1.00 92.27 61  A 1 
ATOM 497  N N   . THR A 1 62  ? -1.892  -8.139  15.196  1.00 97.04 62  A 1 
ATOM 498  C CA  . THR A 1 62  ? -1.056  -9.333  14.983  1.00 97.02 62  A 1 
ATOM 499  C C   . THR A 1 62  ? -1.588  -10.197 13.839  1.00 97.24 62  A 1 
ATOM 500  O O   . THR A 1 62  ? -0.804  -10.684 13.034  1.00 96.75 62  A 1 
ATOM 501  C CB  . THR A 1 62  ? -0.973  -10.173 16.268  1.00 96.20 62  A 1 
ATOM 502  O OG1 . THR A 1 62  ? -0.572  -9.351  17.339  1.00 88.09 62  A 1 
ATOM 503  C CG2 . THR A 1 62  ? 0.040   -11.313 16.171  1.00 86.40 62  A 1 
ATOM 504  N N   . GLY A 1 63  ? -2.912  -10.331 13.709  1.00 97.37 63  A 1 
ATOM 505  C CA  . GLY A 1 63  ? -3.532  -11.051 12.593  1.00 97.28 63  A 1 
ATOM 506  C C   . GLY A 1 63  ? -3.232  -10.424 11.226  1.00 97.58 63  A 1 
ATOM 507  O O   . GLY A 1 63  ? -3.068  -11.152 10.251  1.00 97.29 63  A 1 
ATOM 508  N N   . ILE A 1 64  ? -3.100  -9.095  11.162  1.00 97.54 64  A 1 
ATOM 509  C CA  . ILE A 1 64  ? -2.688  -8.389  9.936   1.00 97.65 64  A 1 
ATOM 510  C C   . ILE A 1 64  ? -1.245  -8.745  9.576   1.00 97.60 64  A 1 
ATOM 511  O O   . ILE A 1 64  ? -0.980  -9.083  8.429   1.00 97.34 64  A 1 
ATOM 512  C CB  . ILE A 1 64  ? -2.852  -6.860  10.076  1.00 97.67 64  A 1 
ATOM 513  C CG1 . ILE A 1 64  ? -4.277  -6.435  10.500  1.00 96.81 64  A 1 
ATOM 514  C CG2 . ILE A 1 64  ? -2.434  -6.132  8.781   1.00 97.25 64  A 1 
ATOM 515  C CD1 . ILE A 1 64  ? -5.391  -6.748  9.509   1.00 94.74 64  A 1 
ATOM 516  N N   . PHE A 1 65  ? -0.327  -8.727  10.541  1.00 97.46 65  A 1 
ATOM 517  C CA  . PHE A 1 65  ? 1.075   -9.068  10.289  1.00 96.90 65  A 1 
ATOM 518  C C   . PHE A 1 65  ? 1.231   -10.511 9.804   1.00 96.86 65  A 1 
ATOM 519  O O   . PHE A 1 65  ? 1.883   -10.737 8.787   1.00 96.31 65  A 1 
ATOM 520  C CB  . PHE A 1 65  ? 1.916   -8.826  11.550  1.00 96.11 65  A 1 
ATOM 521  C CG  . PHE A 1 65  ? 1.946   -7.400  12.079  1.00 94.14 65  A 1 
ATOM 522  C CD1 . PHE A 1 65  ? 1.788   -6.298  11.220  1.00 89.12 65  A 1 
ATOM 523  C CD2 . PHE A 1 65  ? 2.178   -7.176  13.449  1.00 89.15 65  A 1 
ATOM 524  C CE1 . PHE A 1 65  ? 1.852   -4.989  11.729  1.00 86.50 65  A 1 
ATOM 525  C CE2 . PHE A 1 65  ? 2.247   -5.868  13.954  1.00 86.93 65  A 1 
ATOM 526  C CZ  . PHE A 1 65  ? 2.082   -4.772  13.094  1.00 87.04 65  A 1 
ATOM 527  N N   . SER A 1 66  ? 0.564   -11.462 10.457  1.00 97.19 66  A 1 
ATOM 528  C CA  . SER A 1 66  ? 0.585   -12.864 10.032  1.00 97.13 66  A 1 
ATOM 529  C C   . SER A 1 66  ? 0.011   -13.056 8.623   1.00 97.08 66  A 1 
ATOM 530  O O   . SER A 1 66  ? 0.541   -13.849 7.851   1.00 96.63 66  A 1 
ATOM 531  C CB  . SER A 1 66  ? -0.210  -13.729 11.016  1.00 96.94 66  A 1 
ATOM 532  O OG  . SER A 1 66  ? 0.342   -13.640 12.317  1.00 86.31 66  A 1 
ATOM 533  N N   . ALA A 1 67  ? -1.045  -12.321 8.261   1.00 97.05 67  A 1 
ATOM 534  C CA  . ALA A 1 67  ? -1.618  -12.389 6.919   1.00 96.73 67  A 1 
ATOM 535  C C   . ALA A 1 67  ? -0.660  -11.820 5.863   1.00 96.70 67  A 1 
ATOM 536  O O   . ALA A 1 67  ? -0.396  -12.491 4.869   1.00 96.34 67  A 1 
ATOM 537  C CB  . ALA A 1 67  ? -2.964  -11.675 6.917   1.00 96.57 67  A 1 
ATOM 538  N N   . VAL A 1 68  ? -0.083  -10.638 6.097   1.00 96.73 68  A 1 
ATOM 539  C CA  . VAL A 1 68  ? 0.912   -10.012 5.207   1.00 96.52 68  A 1 
ATOM 540  C C   . VAL A 1 68  ? 2.084   -10.962 4.941   1.00 96.15 68  A 1 
ATOM 541  O O   . VAL A 1 68  ? 2.456   -11.173 3.787   1.00 95.61 68  A 1 
ATOM 542  C CB  . VAL A 1 68  ? 1.383   -8.667  5.807   1.00 96.60 68  A 1 
ATOM 543  C CG1 . VAL A 1 68  ? 2.613   -8.081  5.110   1.00 95.72 68  A 1 
ATOM 544  C CG2 . VAL A 1 68  ? 0.270   -7.615  5.703   1.00 95.85 68  A 1 
ATOM 545  N N   . GLU A 1 69  ? 2.606   -11.591 5.995   1.00 95.87 69  A 1 
ATOM 546  C CA  . GLU A 1 69  ? 3.671   -12.593 5.885   1.00 94.94 69  A 1 
ATOM 547  C C   . GLU A 1 69  ? 3.214   -13.821 5.080   1.00 94.51 69  A 1 
ATOM 548  O O   . GLU A 1 69  ? 3.894   -14.232 4.138   1.00 93.88 69  A 1 
ATOM 549  C CB  . GLU A 1 69  ? 4.127   -12.972 7.304   1.00 94.56 69  A 1 
ATOM 550  C CG  . GLU A 1 69  ? 5.311   -13.954 7.310   1.00 83.86 69  A 1 
ATOM 551  C CD  . GLU A 1 69  ? 5.826   -14.266 8.729   1.00 81.37 69  A 1 
ATOM 552  O OE1 . GLU A 1 69  ? 6.977   -14.751 8.832   1.00 72.78 69  A 1 
ATOM 553  O OE2 . GLU A 1 69  ? 5.078   -14.027 9.712   1.00 75.49 69  A 1 
ATOM 554  N N   . SER A 1 70  ? 2.030   -14.366 5.376   1.00 95.64 70  A 1 
ATOM 555  C CA  . SER A 1 70  ? 1.495   -15.553 4.690   1.00 95.31 70  A 1 
ATOM 556  C C   . SER A 1 70  ? 1.235   -15.343 3.192   1.00 95.02 70  A 1 
ATOM 557  O O   . SER A 1 70  ? 1.355   -16.282 2.409   1.00 94.13 70  A 1 
ATOM 558  C CB  . SER A 1 70  ? 0.216   -16.040 5.380   1.00 95.08 70  A 1 
ATOM 559  O OG  . SER A 1 70  ? -0.901  -15.218 5.101   1.00 82.34 70  A 1 
ATOM 560  N N   . TYR A 1 71  ? 0.915   -14.105 2.787   1.00 95.01 71  A 1 
ATOM 561  C CA  . TYR A 1 71  ? 0.744   -13.732 1.382   1.00 94.67 71  A 1 
ATOM 562  C C   . TYR A 1 71  ? 2.076   -13.488 0.657   1.00 94.31 71  A 1 
ATOM 563  O O   . TYR A 1 71  ? 2.081   -13.288 -0.562  1.00 93.01 71  A 1 
ATOM 564  C CB  . TYR A 1 71  ? -0.179  -12.511 1.286   1.00 95.13 71  A 1 
ATOM 565  C CG  . TYR A 1 71  ? -1.580  -12.676 1.856   1.00 95.26 71  A 1 
ATOM 566  C CD1 . TYR A 1 71  ? -2.263  -13.905 1.763   1.00 93.19 71  A 1 
ATOM 567  C CD2 . TYR A 1 71  ? -2.213  -11.578 2.473   1.00 93.82 71  A 1 
ATOM 568  C CE1 . TYR A 1 71  ? -3.559  -14.045 2.297   1.00 93.01 71  A 1 
ATOM 569  C CE2 . TYR A 1 71  ? -3.511  -11.709 3.005   1.00 93.35 71  A 1 
ATOM 570  C CZ  . TYR A 1 71  ? -4.182  -12.945 2.922   1.00 93.80 71  A 1 
ATOM 571  O OH  . TYR A 1 71  ? -5.427  -13.081 3.449   1.00 92.71 71  A 1 
ATOM 572  N N   . GLY A 1 72  ? 3.196   -13.491 1.368   1.00 94.58 72  A 1 
ATOM 573  C CA  . GLY A 1 72  ? 4.509   -13.170 0.811   1.00 94.02 72  A 1 
ATOM 574  C C   . GLY A 1 72  ? 4.668   -11.688 0.456   1.00 94.68 72  A 1 
ATOM 575  O O   . GLY A 1 72  ? 5.458   -11.348 -0.426  1.00 93.69 72  A 1 
ATOM 576  N N   . PHE A 1 73  ? 3.907   -10.802 1.098   1.00 95.23 73  A 1 
ATOM 577  C CA  . PHE A 1 73  ? 4.035   -9.364  0.880   1.00 96.00 73  A 1 
ATOM 578  C C   . PHE A 1 73  ? 5.178   -8.800  1.727   1.00 95.94 73  A 1 
ATOM 579  O O   . PHE A 1 73  ? 5.327   -9.113  2.905   1.00 94.93 73  A 1 
ATOM 580  C CB  . PHE A 1 73  ? 2.715   -8.632  1.163   1.00 96.17 73  A 1 
ATOM 581  C CG  . PHE A 1 73  ? 1.497   -9.043  0.349   1.00 96.62 73  A 1 
ATOM 582  C CD1 . PHE A 1 73  ? 1.607   -9.820  -0.819  1.00 95.02 73  A 1 
ATOM 583  C CD2 . PHE A 1 73  ? 0.219   -8.625  0.777   1.00 95.30 73  A 1 
ATOM 584  C CE1 . PHE A 1 73  ? 0.456   -10.198 -1.537  1.00 94.83 73  A 1 
ATOM 585  C CE2 . PHE A 1 73  ? -0.928  -8.997  0.057   1.00 94.94 73  A 1 
ATOM 586  C CZ  . PHE A 1 73  ? -0.811  -9.789  -1.095  1.00 95.68 73  A 1 
ATOM 587  N N   . SER A 1 74  ? 5.969   -7.922  1.127   1.00 96.35 74  A 1 
ATOM 588  C CA  . SER A 1 74  ? 7.046   -7.227  1.833   1.00 96.59 74  A 1 
ATOM 589  C C   . SER A 1 74  ? 6.541   -5.924  2.447   1.00 97.26 74  A 1 
ATOM 590  O O   . SER A 1 74  ? 5.691   -5.246  1.879   1.00 96.99 74  A 1 
ATOM 591  C CB  . SER A 1 74  ? 8.212   -6.969  0.886   1.00 95.82 74  A 1 
ATOM 592  O OG  . SER A 1 74  ? 8.779   -8.202  0.483   1.00 91.60 74  A 1 
ATOM 593  N N   . ILE A 1 75  ? 7.088   -5.534  3.596   1.00 96.92 75  A 1 
ATOM 594  C CA  . ILE A 1 75  ? 6.785   -4.234  4.204   1.00 97.17 75  A 1 
ATOM 595  C C   . ILE A 1 75  ? 7.836   -3.227  3.741   1.00 97.08 75  A 1 
ATOM 596  O O   . ILE A 1 75  ? 9.035   -3.450  3.916   1.00 96.46 75  A 1 
ATOM 597  C CB  . ILE A 1 75  ? 6.679   -4.338  5.738   1.00 97.11 75  A 1 
ATOM 598  C CG1 . ILE A 1 75  ? 5.533   -5.298  6.140   1.00 96.50 75  A 1 
ATOM 599  C CG2 . ILE A 1 75  ? 6.448   -2.940  6.348   1.00 96.50 75  A 1 
ATOM 600  C CD1 . ILE A 1 75  ? 5.545   -5.697  7.619   1.00 94.56 75  A 1 
ATOM 601  N N   . VAL A 1 76  ? 7.389   -2.103  3.177   1.00 97.04 76  A 1 
ATOM 602  C CA  . VAL A 1 76  ? 8.267   -0.985  2.819   1.00 97.07 76  A 1 
ATOM 603  C C   . VAL A 1 76  ? 8.152   0.125   3.863   1.00 97.16 76  A 1 
ATOM 604  O O   . VAL A 1 76  ? 7.058   0.556   4.241   1.00 96.42 76  A 1 
ATOM 605  C CB  . VAL A 1 76  ? 8.038   -0.525  1.364   1.00 96.14 76  A 1 
ATOM 606  C CG1 . VAL A 1 76  ? 6.642   0.031   1.103   1.00 89.12 76  A 1 
ATOM 607  C CG2 . VAL A 1 76  ? 9.089   0.502   0.936   1.00 89.21 76  A 1 
ATOM 608  N N   . GLY A 1 77  ? 9.302   0.564   4.361   1.00 95.68 77  A 1 
ATOM 609  C CA  . GLY A 1 77  ? 9.403   1.665   5.314   1.00 95.07 77  A 1 
ATOM 610  C C   . GLY A 1 77  ? 9.247   3.032   4.650   1.00 95.77 77  A 1 
ATOM 611  O O   . GLY A 1 77  ? 9.344   3.171   3.433   1.00 94.72 77  A 1 
ATOM 612  N N   . ILE A 1 78  ? 9.050   4.050   5.481   1.00 95.17 78  A 1 
ATOM 613  C CA  . ILE A 1 78  ? 9.011   5.453   5.061   1.00 94.95 78  A 1 
ATOM 614  C C   . ILE A 1 78  ? 10.332  6.102   5.482   1.00 94.85 78  A 1 
ATOM 615  O O   . ILE A 1 78  ? 10.659  6.153   6.666   1.00 92.90 78  A 1 
ATOM 616  C CB  . ILE A 1 78  ? 7.777   6.163   5.658   1.00 93.59 78  A 1 
ATOM 617  C CG1 . ILE A 1 78  ? 6.481   5.473   5.176   1.00 90.51 78  A 1 
ATOM 618  C CG2 . ILE A 1 78  ? 7.774   7.654   5.270   1.00 90.17 78  A 1 
ATOM 619  C CD1 . ILE A 1 78  ? 5.223   5.995   5.870   1.00 86.55 78  A 1 
ATOM 620  N N   . ASN A 1 79  ? 11.098  6.581   4.514   1.00 96.12 79  A 1 
ATOM 621  C CA  . ASN A 1 79  ? 12.355  7.291   4.746   1.00 95.90 79  A 1 
ATOM 622  C C   . ASN A 1 79  ? 12.198  8.798   4.473   1.00 96.69 79  A 1 
ATOM 623  O O   . ASN A 1 79  ? 11.122  9.273   4.111   1.00 96.69 79  A 1 
ATOM 624  C CB  . ASN A 1 79  ? 13.473  6.596   3.933   1.00 94.93 79  A 1 
ATOM 625  C CG  . ASN A 1 79  ? 13.350  6.766   2.427   1.00 94.46 79  A 1 
ATOM 626  O OD1 . ASN A 1 79  ? 12.626  7.602   1.924   1.00 91.74 79  A 1 
ATOM 627  N ND2 . ASN A 1 79  ? 14.080  5.998   1.655   1.00 90.75 79  A 1 
ATOM 628  N N   . HIS A 1 80  ? 13.279  9.561   4.635   1.00 97.03 80  A 1 
ATOM 629  C CA  . HIS A 1 80  ? 13.269  11.011  4.404   1.00 97.25 80  A 1 
ATOM 630  C C   . HIS A 1 80  ? 12.858  11.396  2.969   1.00 97.63 80  A 1 
ATOM 631  O O   . HIS A 1 80  ? 12.152  12.381  2.798   1.00 97.30 80  A 1 
ATOM 632  C CB  . HIS A 1 80  ? 14.641  11.601  4.765   1.00 96.58 80  A 1 
ATOM 633  C CG  . HIS A 1 80  ? 15.757  11.165  3.849   1.00 89.76 80  A 1 
ATOM 634  N ND1 . HIS A 1 80  ? 16.486  10.008  3.948   1.00 76.37 80  A 1 
ATOM 635  C CD2 . HIS A 1 80  ? 16.217  11.836  2.753   1.00 77.62 80  A 1 
ATOM 636  C CE1 . HIS A 1 80  ? 17.366  9.974   2.934   1.00 78.11 80  A 1 
ATOM 637  N NE2 . HIS A 1 80  ? 17.241  11.068  2.176   1.00 81.68 80  A 1 
ATOM 638  N N   . GLN A 1 81  ? 13.213  10.588  1.959   1.00 97.76 81  A 1 
ATOM 639  C CA  . GLN A 1 81  ? 12.832  10.853  0.566   1.00 97.84 81  A 1 
ATOM 640  C C   . GLN A 1 81  ? 11.317  10.736  0.369   1.00 97.98 81  A 1 
ATOM 641  O O   . GLN A 1 81  ? 10.728  11.544  -0.345  1.00 97.62 81  A 1 
ATOM 642  C CB  . GLN A 1 81  ? 13.545  9.875   -0.384  1.00 97.81 81  A 1 
ATOM 643  C CG  . GLN A 1 81  ? 15.072  9.949   -0.303  1.00 94.79 81  A 1 
ATOM 644  C CD  . GLN A 1 81  ? 15.741  8.891   -1.172  1.00 91.11 81  A 1 
ATOM 645  O OE1 . GLN A 1 81  ? 15.449  7.709   -1.102  1.00 83.61 81  A 1 
ATOM 646  N NE2 . GLN A 1 81  ? 16.680  9.267   -2.008  1.00 79.68 81  A 1 
ATOM 647  N N   . CYS A 1 82  ? 10.667  9.776   1.045   1.00 97.53 82  A 1 
ATOM 648  C CA  . CYS A 1 82  ? 9.208   9.661   1.046   1.00 97.44 82  A 1 
ATOM 649  C C   . CYS A 1 82  ? 8.553   10.884  1.702   1.00 97.24 82  A 1 
ATOM 650  O O   . CYS A 1 82  ? 7.547   11.379  1.204   1.00 97.03 82  A 1 
ATOM 651  C CB  . CYS A 1 82  ? 8.776   8.382   1.781   1.00 97.49 82  A 1 
ATOM 652  S SG  . CYS A 1 82  ? 9.509   6.889   1.054   1.00 96.77 82  A 1 
ATOM 653  N N   . VAL A 1 83  ? 9.130   11.402  2.793   1.00 97.46 83  A 1 
ATOM 654  C CA  . VAL A 1 83  ? 8.639   12.621  3.464   1.00 97.09 83  A 1 
ATOM 655  C C   . VAL A 1 83  ? 8.790   13.845  2.557   1.00 96.84 83  A 1 
ATOM 656  O O   . VAL A 1 83  ? 7.861   14.643  2.437   1.00 96.48 83  A 1 
ATOM 657  C CB  . VAL A 1 83  ? 9.365   12.837  4.808   1.00 96.77 83  A 1 
ATOM 658  C CG1 . VAL A 1 83  ? 8.910   14.121  5.512   1.00 96.04 83  A 1 
ATOM 659  C CG2 . VAL A 1 83  ? 9.113   11.672  5.775   1.00 96.06 83  A 1 
ATOM 660  N N   . ASP A 1 84  ? 9.935   13.982  1.886   1.00 97.72 84  A 1 
ATOM 661  C CA  . ASP A 1 84  ? 10.175  15.068  0.935   1.00 97.67 84  A 1 
ATOM 662  C C   . ASP A 1 84  ? 9.209   15.007  -0.254  1.00 97.39 84  A 1 
ATOM 663  O O   . ASP A 1 84  ? 8.694   16.041  -0.682  1.00 97.04 84  A 1 
ATOM 664  C CB  . ASP A 1 84  ? 11.620  15.011  0.416   1.00 97.72 84  A 1 
ATOM 665  C CG  . ASP A 1 84  ? 12.686  15.428  1.430   1.00 93.56 84  A 1 
ATOM 666  O OD1 . ASP A 1 84  ? 12.334  16.100  2.430   1.00 89.26 84  A 1 
ATOM 667  O OD2 . ASP A 1 84  ? 13.872  15.134  1.147   1.00 89.68 84  A 1 
ATOM 668  N N   . GLU A 1 85  ? 8.957   13.807  -0.789  1.00 97.09 85  A 1 
ATOM 669  C CA  . GLU A 1 85  ? 8.004   13.603  -1.883  1.00 97.05 85  A 1 
ATOM 670  C C   . GLU A 1 85  ? 6.568   13.877  -1.429  1.00 96.76 85  A 1 
ATOM 671  O O   . GLU A 1 85  ? 5.847   14.594  -2.116  1.00 96.25 85  A 1 
ATOM 672  C CB  . GLU A 1 85  ? 8.167   12.187  -2.460  1.00 97.09 85  A 1 
ATOM 673  C CG  . GLU A 1 85  ? 7.342   11.952  -3.742  1.00 95.32 85  A 1 
ATOM 674  C CD  . GLU A 1 85  ? 7.703   12.876  -4.916  1.00 95.51 85  A 1 
ATOM 675  O OE1 . GLU A 1 85  ? 6.841   13.042  -5.818  1.00 90.90 85  A 1 
ATOM 676  O OE2 . GLU A 1 85  ? 8.832   13.414  -4.946  1.00 91.73 85  A 1 
ATOM 677  N N   . TYR A 1 86  ? 6.172   13.409  -0.241  1.00 96.75 86  A 1 
ATOM 678  C CA  . TYR A 1 86  ? 4.856   13.680  0.348   1.00 96.25 86  A 1 
ATOM 679  C C   . TYR A 1 86  ? 4.553   15.183  0.416   1.00 95.91 86  A 1 
ATOM 680  O O   . TYR A 1 86  ? 3.467   15.614  0.040   1.00 95.41 86  A 1 
ATOM 681  C CB  . TYR A 1 86  ? 4.790   13.057  1.749   1.00 95.83 86  A 1 
ATOM 682  C CG  . TYR A 1 86  ? 3.499   13.344  2.490   1.00 95.64 86  A 1 
ATOM 683  C CD1 . TYR A 1 86  ? 3.394   14.468  3.337   1.00 94.65 86  A 1 
ATOM 684  C CD2 . TYR A 1 86  ? 2.385   12.510  2.299   1.00 94.65 86  A 1 
ATOM 685  C CE1 . TYR A 1 86  ? 2.177   14.755  3.982   1.00 93.56 86  A 1 
ATOM 686  C CE2 . TYR A 1 86  ? 1.168   12.793  2.943   1.00 93.72 86  A 1 
ATOM 687  C CZ  . TYR A 1 86  ? 1.063   13.919  3.780   1.00 93.51 86  A 1 
ATOM 688  O OH  . TYR A 1 86  ? -0.120  14.197  4.393   1.00 91.95 86  A 1 
ATOM 689  N N   . ASN A 1 87  ? 5.526   15.990  0.843   1.00 96.30 87  A 1 
ATOM 690  C CA  . ASN A 1 87  ? 5.360   17.445  0.946   1.00 95.82 87  A 1 
ATOM 691  C C   . ASN A 1 87  ? 5.246   18.162  -0.411  1.00 95.73 87  A 1 
ATOM 692  O O   . ASN A 1 87  ? 4.822   19.317  -0.451  1.00 94.72 87  A 1 
ATOM 693  C CB  . ASN A 1 87  ? 6.519   18.019  1.776   1.00 95.00 87  A 1 
ATOM 694  C CG  . ASN A 1 87  ? 6.326   17.787  3.262   1.00 86.35 87  A 1 
ATOM 695  O OD1 . ASN A 1 87  ? 5.409   18.292  3.884   1.00 77.39 87  A 1 
ATOM 696  N ND2 . ASN A 1 87  ? 7.184   17.021  3.886   1.00 76.30 87  A 1 
ATOM 697  N N   . LYS A 1 88  ? 5.626   17.508  -1.514  1.00 95.91 88  A 1 
ATOM 698  C CA  . LYS A 1 88  ? 5.498   18.038  -2.883  1.00 95.97 88  A 1 
ATOM 699  C C   . LYS A 1 88  ? 4.189   17.622  -3.555  1.00 95.95 88  A 1 
ATOM 700  O O   . LYS A 1 88  ? 3.872   18.153  -4.618  1.00 95.32 88  A 1 
ATOM 701  C CB  . LYS A 1 88  ? 6.684   17.565  -3.731  1.00 96.04 88  A 1 
ATOM 702  C CG  . LYS A 1 88  ? 8.035   18.110  -3.248  1.00 94.81 88  A 1 
ATOM 703  C CD  . LYS A 1 88  ? 9.156   17.333  -3.943  1.00 93.01 88  A 1 
ATOM 704  C CE  . LYS A 1 88  ? 10.496  17.590  -3.257  1.00 89.56 88  A 1 
ATOM 705  N NZ  . LYS A 1 88  ? 11.465  16.532  -3.622  1.00 83.57 88  A 1 
ATOM 706  N N   . LEU A 1 89  ? 3.456   16.664  -2.984  1.00 95.86 89  A 1 
ATOM 707  C CA  . LEU A 1 89  ? 2.210   16.186  -3.569  1.00 95.58 89  A 1 
ATOM 708  C C   . LEU A 1 89  ? 1.175   17.319  -3.651  1.00 95.29 89  A 1 
ATOM 709  O O   . LEU A 1 89  ? 1.010   18.083  -2.696  1.00 94.59 89  A 1 
ATOM 710  C CB  . LEU A 1 89  ? 1.641   14.995  -2.775  1.00 95.63 89  A 1 
ATOM 711  C CG  . LEU A 1 89  ? 2.488   13.709  -2.822  1.00 95.27 89  A 1 
ATOM 712  C CD1 . LEU A 1 89  ? 1.787   12.618  -2.011  1.00 94.70 89  A 1 
ATOM 713  C CD2 . LEU A 1 89  ? 2.697   13.186  -4.246  1.00 94.66 89  A 1 
ATOM 714  N N   . PRO A 1 90  ? 0.423   17.423  -4.764  1.00 95.21 90  A 1 
ATOM 715  C CA  . PRO A 1 90  ? -0.695  18.348  -4.830  1.00 94.71 90  A 1 
ATOM 716  C C   . PRO A 1 90  ? -1.751  17.969  -3.786  1.00 94.50 90  A 1 
ATOM 717  O O   . PRO A 1 90  ? -2.009  16.789  -3.537  1.00 92.89 90  A 1 
ATOM 718  C CB  . PRO A 1 90  ? -1.221  18.254  -6.265  1.00 93.94 90  A 1 
ATOM 719  C CG  . PRO A 1 90  ? -0.839  16.836  -6.690  1.00 93.12 90  A 1 
ATOM 720  C CD  . PRO A 1 90  ? 0.482   16.593  -5.966  1.00 95.11 90  A 1 
ATOM 721  N N   . LEU A 1 91  ? -2.411  18.973  -3.205  1.00 92.14 91  A 1 
ATOM 722  C CA  . LEU A 1 91  ? -3.457  18.765  -2.203  1.00 90.81 91  A 1 
ATOM 723  C C   . LEU A 1 91  ? -4.780  18.345  -2.874  1.00 89.71 91  A 1 
ATOM 724  O O   . LEU A 1 91  ? -5.716  19.140  -2.983  1.00 85.50 91  A 1 
ATOM 725  C CB  . LEU A 1 91  ? -3.568  20.026  -1.319  1.00 88.76 91  A 1 
ATOM 726  C CG  . LEU A 1 91  ? -4.469  19.834  -0.083  1.00 81.52 91  A 1 
ATOM 727  C CD1 . LEU A 1 91  ? -3.864  18.864  0.937   1.00 77.90 91  A 1 
ATOM 728  C CD2 . LEU A 1 91  ? -4.680  21.177  0.620   1.00 78.14 91  A 1 
ATOM 729  N N   . ILE A 1 92  ? -4.848  17.099  -3.351  1.00 87.78 92  A 1 
ATOM 730  C CA  . ILE A 1 92  ? -6.044  16.517  -3.988  1.00 85.32 92  A 1 
ATOM 731  C C   . ILE A 1 92  ? -7.064  16.084  -2.929  1.00 81.49 92  A 1 
ATOM 732  O O   . ILE A 1 92  ? -8.257  16.368  -3.054  1.00 74.78 92  A 1 
ATOM 733  C CB  . ILE A 1 92  ? -5.638  15.354  -4.927  1.00 85.47 92  A 1 
ATOM 734  C CG1 . ILE A 1 92  ? -4.765  15.899  -6.084  1.00 84.27 92  A 1 
ATOM 735  C CG2 . ILE A 1 92  ? -6.881  14.635  -5.481  1.00 81.65 92  A 1 
ATOM 736  C CD1 . ILE A 1 92  ? -4.159  14.822  -6.991  1.00 78.89 92  A 1 
ATOM 737  N N   . HIS A 1 93  ? -6.601  15.422  -1.864  1.00 76.90 93  A 1 
ATOM 738  C CA  . HIS A 1 93  ? -7.388  15.060  -0.691  1.00 72.76 93  A 1 
ATOM 739  C C   . HIS A 1 93  ? -6.508  15.107  0.566   1.00 74.43 93  A 1 
ATOM 740  O O   . HIS A 1 93  ? -5.296  15.307  0.481   1.00 68.31 93  A 1 
ATOM 741  C CB  . HIS A 1 93  ? -8.056  13.695  -0.905  1.00 64.37 93  A 1 
ATOM 742  C CG  . HIS A 1 93  ? -7.097  12.531  -0.931  1.00 57.63 93  A 1 
ATOM 743  N ND1 . HIS A 1 93  ? -6.119  12.291  -1.870  1.00 50.23 93  A 1 
ATOM 744  C CD2 . HIS A 1 93  ? -7.073  11.512  -0.035  1.00 49.65 93  A 1 
ATOM 745  C CE1 . HIS A 1 93  ? -5.523  11.133  -1.555  1.00 46.13 93  A 1 
ATOM 746  N NE2 . HIS A 1 93  ? -6.074  10.628  -0.448  1.00 48.75 93  A 1 
ATOM 747  N N   . ARG A 1 94  ? -7.132  15.008  1.742   1.00 76.62 94  A 1 
ATOM 748  C CA  . ARG A 1 94  ? -6.450  15.241  3.027   1.00 77.95 94  A 1 
ATOM 749  C C   . ARG A 1 94  ? -6.154  13.972  3.829   1.00 82.94 94  A 1 
ATOM 750  O O   . ARG A 1 94  ? -5.706  14.108  4.963   1.00 78.02 94  A 1 
ATOM 751  C CB  . ARG A 1 94  ? -7.231  16.259  3.875   1.00 70.86 94  A 1 
ATOM 752  C CG  . ARG A 1 94  ? -7.236  17.664  3.258   1.00 61.67 94  A 1 
ATOM 753  C CD  . ARG A 1 94  ? -7.873  18.637  4.251   1.00 54.84 94  A 1 
ATOM 754  N NE  . ARG A 1 94  ? -7.852  20.018  3.736   1.00 45.86 94  A 1 
ATOM 755  C CZ  . ARG A 1 94  ? -8.268  21.094  4.381   1.00 40.32 94  A 1 
ATOM 756  N NH1 . ARG A 1 94  ? -8.767  21.026  5.585   1.00 36.48 94  A 1 
ATOM 757  N NH2 . ARG A 1 94  ? -8.189  22.266  3.818   1.00 33.86 94  A 1 
ATOM 758  N N   . ASP A 1 95  ? -6.417  12.784  3.279   1.00 84.29 95  A 1 
ATOM 759  C CA  . ASP A 1 95  ? -6.031  11.561  3.978   1.00 87.87 95  A 1 
ATOM 760  C C   . ASP A 1 95  ? -4.493  11.460  4.000   1.00 90.42 95  A 1 
ATOM 761  O O   . ASP A 1 95  ? -3.860  11.393  2.944   1.00 89.80 95  A 1 
ATOM 762  C CB  . ASP A 1 95  ? -6.696  10.312  3.387   1.00 85.31 95  A 1 
ATOM 763  C CG  . ASP A 1 95  ? -6.499  9.135   4.358   1.00 80.64 95  A 1 
ATOM 764  O OD1 . ASP A 1 95  ? -5.327  8.865   4.699   1.00 75.56 95  A 1 
ATOM 765  O OD2 . ASP A 1 95  ? -7.511  8.644   4.912   1.00 74.27 95  A 1 
ATOM 766  N N   . PRO A 1 96  ? -3.860  11.520  5.188   1.00 93.34 96  A 1 
ATOM 767  C CA  . PRO A 1 96  ? -2.407  11.498  5.269   1.00 94.49 96  A 1 
ATOM 768  C C   . PRO A 1 96  ? -1.821  10.134  4.891   1.00 95.71 96  A 1 
ATOM 769  O O   . PRO A 1 96  ? -0.706  10.088  4.379   1.00 95.25 96  A 1 
ATOM 770  C CB  . PRO A 1 96  ? -2.085  11.883  6.717   1.00 92.79 96  A 1 
ATOM 771  C CG  . PRO A 1 96  ? -3.306  11.387  7.492   1.00 90.57 96  A 1 
ATOM 772  C CD  . PRO A 1 96  ? -4.452  11.616  6.514   1.00 92.41 96  A 1 
ATOM 773  N N   . PHE A 1 97  ? -2.544  9.032   5.131   1.00 95.52 97  A 1 
ATOM 774  C CA  . PHE A 1 97  ? -2.039  7.687   4.865   1.00 96.14 97  A 1 
ATOM 775  C C   . PHE A 1 97  ? -1.999  7.398   3.367   1.00 96.49 97  A 1 
ATOM 776  O O   . PHE A 1 97  ? -0.977  6.913   2.875   1.00 96.29 97  A 1 
ATOM 777  C CB  . PHE A 1 97  ? -2.882  6.654   5.619   1.00 96.06 97  A 1 
ATOM 778  C CG  . PHE A 1 97  ? -2.880  6.843   7.123   1.00 95.95 97  A 1 
ATOM 779  C CD1 . PHE A 1 97  ? -1.709  6.589   7.860   1.00 94.68 97  A 1 
ATOM 780  C CD2 . PHE A 1 97  ? -4.043  7.281   7.784   1.00 94.94 97  A 1 
ATOM 781  C CE1 . PHE A 1 97  ? -1.701  6.764   9.255   1.00 94.05 97  A 1 
ATOM 782  C CE2 . PHE A 1 97  ? -4.038  7.456   9.178   1.00 93.98 97  A 1 
ATOM 783  C CZ  . PHE A 1 97  ? -2.867  7.195   9.915   1.00 94.17 97  A 1 
ATOM 784  N N   . ASP A 1 98  ? -3.031  7.800   2.624   1.00 95.95 98  A 1 
ATOM 785  C CA  . ASP A 1 98  ? -3.053  7.695   1.165   1.00 96.12 98  A 1 
ATOM 786  C C   . ASP A 1 98  ? -1.906  8.496   0.540   1.00 96.70 98  A 1 
ATOM 787  O O   . ASP A 1 98  ? -1.151  7.980   -0.284  1.00 96.46 98  A 1 
ATOM 788  C CB  . ASP A 1 98  ? -4.395  8.204   0.627   1.00 95.13 98  A 1 
ATOM 789  C CG  . ASP A 1 98  ? -5.592  7.334   1.021   1.00 91.85 98  A 1 
ATOM 790  O OD1 . ASP A 1 98  ? -5.373  6.151   1.363   1.00 88.77 98  A 1 
ATOM 791  O OD2 . ASP A 1 98  ? -6.714  7.876   0.950   1.00 87.58 98  A 1 
ATOM 792  N N   . GLY A 1 99  ? -1.691  9.733   0.994   1.00 96.04 99  A 1 
ATOM 793  C CA  . GLY A 1 99  ? -0.566  10.553  0.546   1.00 96.27 99  A 1 
ATOM 794  C C   . GLY A 1 99  ? 0.798   9.914   0.846   1.00 96.92 99  A 1 
ATOM 795  O O   . GLY A 1 99  ? 1.700   9.952   0.004   1.00 97.04 99  A 1 
ATOM 796  N N   . MET A 1 100 ? 0.958   9.277   2.012   1.00 96.58 100 A 1 
ATOM 797  C CA  . MET A 1 100 ? 2.187   8.538   2.344   1.00 97.11 100 A 1 
ATOM 798  C C   . MET A 1 100 ? 2.397   7.325   1.424   1.00 97.45 100 A 1 
ATOM 799  O O   . MET A 1 100 ? 3.534   7.059   1.021   1.00 97.41 100 A 1 
ATOM 800  C CB  . MET A 1 100 ? 2.155   8.064   3.804   1.00 97.01 100 A 1 
ATOM 801  C CG  . MET A 1 100 ? 2.322   9.200   4.816   1.00 96.00 100 A 1 
ATOM 802  S SD  . MET A 1 100 ? 2.117   8.644   6.537   1.00 94.13 100 A 1 
ATOM 803  C CE  . MET A 1 100 ? 2.030   10.253  7.359   1.00 87.82 100 A 1 
ATOM 804  N N   . ILE A 1 101 ? 1.333   6.598   1.059   1.00 97.25 101 A 1 
ATOM 805  C CA  . ILE A 1 101 ? 1.399   5.479   0.108   1.00 97.52 101 A 1 
ATOM 806  C C   . ILE A 1 101 ? 1.802   5.992   -1.279  1.00 97.63 101 A 1 
ATOM 807  O O   . ILE A 1 101 ? 2.727   5.447   -1.882  1.00 97.69 101 A 1 
ATOM 808  C CB  . ILE A 1 101 ? 0.064   4.699   0.077   1.00 97.61 101 A 1 
ATOM 809  C CG1 . ILE A 1 101 ? -0.184  3.992   1.431   1.00 97.13 101 A 1 
ATOM 810  C CG2 . ILE A 1 101 ? 0.069   3.648   -1.052  1.00 97.15 101 A 1 
ATOM 811  C CD1 . ILE A 1 101 ? -1.629  3.517   1.620   1.00 95.31 101 A 1 
ATOM 812  N N   . VAL A 1 102 ? 1.178   7.070   -1.758  1.00 97.14 102 A 1 
ATOM 813  C CA  . VAL A 1 102 ? 1.514   7.714   -3.039  1.00 97.15 102 A 1 
ATOM 814  C C   . VAL A 1 102 ? 2.983   8.148   -3.070  1.00 97.47 102 A 1 
ATOM 815  O O   . VAL A 1 102 ? 3.706   7.806   -4.007  1.00 97.59 102 A 1 
ATOM 816  C CB  . VAL A 1 102 ? 0.580   8.912   -3.309  1.00 96.81 102 A 1 
ATOM 817  C CG1 . VAL A 1 102 ? 1.029   9.747   -4.515  1.00 96.10 102 A 1 
ATOM 818  C CG2 . VAL A 1 102 ? -0.852  8.446   -3.600  1.00 96.05 102 A 1 
ATOM 819  N N   . ALA A 1 103 ? 3.454   8.842   -2.038  1.00 97.17 103 A 1 
ATOM 820  C CA  . ALA A 1 103 ? 4.848   9.273   -1.949  1.00 97.28 103 A 1 
ATOM 821  C C   . ALA A 1 103 ? 5.822   8.085   -1.950  1.00 97.61 103 A 1 
ATOM 822  O O   . ALA A 1 103 ? 6.831   8.103   -2.657  1.00 97.77 103 A 1 
ATOM 823  C CB  . ALA A 1 103 ? 5.008   10.120  -0.684  1.00 97.14 103 A 1 
ATOM 824  N N   . THR A 1 104 ? 5.491   7.022   -1.209  1.00 97.71 104 A 1 
ATOM 825  C CA  . THR A 1 104 ? 6.297   5.794   -1.172  1.00 97.86 104 A 1 
ATOM 826  C C   . THR A 1 104 ? 6.354   5.131   -2.549  1.00 98.01 104 A 1 
ATOM 827  O O   . THR A 1 104 ? 7.434   4.737   -2.988  1.00 97.99 104 A 1 
ATOM 828  C CB  . THR A 1 104 ? 5.747   4.801   -0.134  1.00 97.80 104 A 1 
ATOM 829  O OG1 . THR A 1 104 ? 5.679   5.401   1.141   1.00 96.62 104 A 1 
ATOM 830  C CG2 . THR A 1 104 ? 6.639   3.570   0.021   1.00 96.71 104 A 1 
ATOM 831  N N   . ALA A 1 105 ? 5.224   5.051   -3.255  1.00 98.13 105 A 1 
ATOM 832  C CA  . ALA A 1 105 ? 5.155   4.494   -4.603  1.00 98.16 105 A 1 
ATOM 833  C C   . ALA A 1 105 ? 6.005   5.289   -5.604  1.00 98.20 105 A 1 
ATOM 834  O O   . ALA A 1 105 ? 6.753   4.694   -6.376  1.00 98.06 105 A 1 
ATOM 835  C CB  . ALA A 1 105 ? 3.687   4.457   -5.040  1.00 98.15 105 A 1 
ATOM 836  N N   . LYS A 1 106 ? 5.938   6.622   -5.555  1.00 97.94 106 A 1 
ATOM 837  C CA  . LYS A 1 106 ? 6.731   7.504   -6.426  1.00 97.88 106 A 1 
ATOM 838  C C   . LYS A 1 106 ? 8.233   7.342   -6.187  1.00 98.04 106 A 1 
ATOM 839  O O   . LYS A 1 106 ? 8.983   7.166   -7.143  1.00 97.78 106 A 1 
ATOM 840  C CB  . LYS A 1 106 ? 6.304   8.965   -6.232  1.00 97.58 106 A 1 
ATOM 841  C CG  . LYS A 1 106 ? 4.918   9.247   -6.837  1.00 96.44 106 A 1 
ATOM 842  C CD  . LYS A 1 106 ? 4.493   10.712  -6.608  1.00 94.86 106 A 1 
ATOM 843  C CE  . LYS A 1 106 ? 5.276   11.717  -7.464  1.00 91.08 106 A 1 
ATOM 844  N NZ  . LYS A 1 106 ? 4.833   11.706  -8.871  1.00 85.94 106 A 1 
ATOM 845  N N   . VAL A 1 107 ? 8.663   7.344   -4.924  1.00 98.18 107 A 1 
ATOM 846  C CA  . VAL A 1 107 ? 10.080  7.154   -4.567  1.00 98.14 107 A 1 
ATOM 847  C C   . VAL A 1 107 ? 10.578  5.767   -4.973  1.00 98.12 107 A 1 
ATOM 848  O O   . VAL A 1 107 ? 11.697  5.636   -5.460  1.00 97.74 107 A 1 
ATOM 849  C CB  . VAL A 1 107 ? 10.297  7.403   -3.059  1.00 98.00 107 A 1 
ATOM 850  C CG1 . VAL A 1 107 ? 11.703  7.013   -2.577  1.00 97.17 107 A 1 
ATOM 851  C CG2 . VAL A 1 107 ? 10.109  8.891   -2.735  1.00 97.28 107 A 1 
ATOM 852  N N   . GLY A 1 108 ? 9.750   4.733   -4.796  1.00 97.99 108 A 1 
ATOM 853  C CA  . GLY A 1 108 ? 10.096  3.347   -5.116  1.00 97.78 108 A 1 
ATOM 854  C C   . GLY A 1 108 ? 9.897   2.951   -6.582  1.00 98.04 108 A 1 
ATOM 855  O O   . GLY A 1 108 ? 10.253  1.834   -6.939  1.00 97.60 108 A 1 
ATOM 856  N N   . GLY A 1 109 ? 9.312   3.808   -7.424  1.00 97.84 109 A 1 
ATOM 857  C CA  . GLY A 1 109 ? 8.936   3.446   -8.795  1.00 97.88 109 A 1 
ATOM 858  C C   . GLY A 1 109 ? 7.894   2.315   -8.858  1.00 98.09 109 A 1 
ATOM 859  O O   . GLY A 1 109 ? 7.943   1.469   -9.756  1.00 97.40 109 A 1 
ATOM 860  N N   . MET A 1 110 ? 6.978   2.264   -7.888  1.00 98.13 110 A 1 
ATOM 861  C CA  . MET A 1 110 ? 5.975   1.208   -7.721  1.00 98.20 110 A 1 
ATOM 862  C C   . MET A 1 110 ? 4.638   1.600   -8.355  1.00 98.25 110 A 1 
ATOM 863  O O   . MET A 1 110 ? 4.278   2.772   -8.433  1.00 97.89 110 A 1 
ATOM 864  C CB  . MET A 1 110 ? 5.770   0.882   -6.231  1.00 97.95 110 A 1 
ATOM 865  C CG  . MET A 1 110 ? 7.062   0.480   -5.515  1.00 97.29 110 A 1 
ATOM 866  S SD  . MET A 1 110 ? 6.835   0.160   -3.743  1.00 96.50 110 A 1 
ATOM 867  C CE  . MET A 1 110 ? 8.546   -0.240  -3.303  1.00 90.86 110 A 1 
ATOM 868  N N   . THR A 1 111 ? 3.853   0.601   -8.749  1.00 97.75 111 A 1 
ATOM 869  C CA  . THR A 1 111 ? 2.459   0.781   -9.174  1.00 97.88 111 A 1 
ATOM 870  C C   . THR A 1 111 ? 1.531   0.567   -7.980  1.00 98.12 111 A 1 
ATOM 871  O O   . THR A 1 111 ? 1.620   -0.457  -7.306  1.00 97.99 111 A 1 
ATOM 872  C CB  . THR A 1 111 ? 2.110   -0.189  -10.310 1.00 97.61 111 A 1 
ATOM 873  O OG1 . THR A 1 111 ? 2.961   0.061   -11.407 1.00 96.47 111 A 1 
ATOM 874  C CG2 . THR A 1 111 ? 0.679   -0.035  -10.822 1.00 96.74 111 A 1 
ATOM 875  N N   . ILE A 1 112 ? 0.609   1.497   -7.732  1.00 98.05 112 A 1 
ATOM 876  C CA  . ILE A 1 112 ? -0.358  1.386   -6.631  1.00 98.08 112 A 1 
ATOM 877  C C   . ILE A 1 112 ? -1.526  0.494   -7.063  1.00 97.96 112 A 1 
ATOM 878  O O   . ILE A 1 112 ? -2.105  0.690   -8.131  1.00 97.64 112 A 1 
ATOM 879  C CB  . ILE A 1 112 ? -0.840  2.770   -6.149  1.00 97.95 112 A 1 
ATOM 880  C CG1 . ILE A 1 112 ? 0.361   3.690   -5.816  1.00 97.21 112 A 1 
ATOM 881  C CG2 . ILE A 1 112 ? -1.746  2.600   -4.914  1.00 97.30 112 A 1 
ATOM 882  C CD1 . ILE A 1 112 ? -0.033  5.093   -5.356  1.00 96.34 112 A 1 
ATOM 883  N N   . ILE A 1 113 ? -1.909  -0.468  -6.225  1.00 97.90 113 A 1 
ATOM 884  C CA  . ILE A 1 113 ? -3.162  -1.210  -6.377  1.00 97.90 113 A 1 
ATOM 885  C C   . ILE A 1 113 ? -4.214  -0.508  -5.518  1.00 97.68 113 A 1 
ATOM 886  O O   . ILE A 1 113 ? -4.163  -0.601  -4.290  1.00 97.32 113 A 1 
ATOM 887  C CB  . ILE A 1 113 ? -3.015  -2.704  -6.012  1.00 97.95 113 A 1 
ATOM 888  C CG1 . ILE A 1 113 ? -1.804  -3.357  -6.720  1.00 96.94 113 A 1 
ATOM 889  C CG2 . ILE A 1 113 ? -4.319  -3.430  -6.390  1.00 97.02 113 A 1 
ATOM 890  C CD1 . ILE A 1 113 ? -1.591  -4.835  -6.367  1.00 94.77 113 A 1 
ATOM 891  N N   . THR A 1 114 ? -5.132  0.219   -6.161  1.00 97.60 114 A 1 
ATOM 892  C CA  . THR A 1 114 ? -6.130  1.041   -5.464  1.00 97.28 114 A 1 
ATOM 893  C C   . THR A 1 114 ? -7.422  1.190   -6.263  1.00 96.53 114 A 1 
ATOM 894  O O   . THR A 1 114 ? -7.388  1.401   -7.476  1.00 95.57 114 A 1 
ATOM 895  C CB  . THR A 1 114 ? -5.557  2.427   -5.115  1.00 96.89 114 A 1 
ATOM 896  O OG1 . THR A 1 114 ? -6.503  3.148   -4.365  1.00 95.30 114 A 1 
ATOM 897  C CG2 . THR A 1 114 ? -5.187  3.302   -6.321  1.00 94.98 114 A 1 
ATOM 898  N N   . ALA A 1 115 ? -8.564  1.122   -5.567  1.00 96.28 115 A 1 
ATOM 899  C CA  . ALA A 1 115 ? -9.863  1.548   -6.095  1.00 95.45 115 A 1 
ATOM 900  C C   . ALA A 1 115 ? -10.147 3.037   -5.838  1.00 95.05 115 A 1 
ATOM 901  O O   . ALA A 1 115 ? -11.156 3.554   -6.314  1.00 93.59 115 A 1 
ATOM 902  C CB  . ALA A 1 115 ? -10.959 0.679   -5.465  1.00 95.12 115 A 1 
ATOM 903  N N   . ASP A 1 116 ? -9.311  3.731   -5.051  1.00 95.59 116 A 1 
ATOM 904  C CA  . ASP A 1 116 ? -9.549  5.119   -4.670  1.00 95.00 116 A 1 
ATOM 905  C C   . ASP A 1 116 ? -9.277  6.064   -5.847  1.00 94.86 116 A 1 
ATOM 906  O O   . ASP A 1 116 ? -8.143  6.256   -6.295  1.00 94.27 116 A 1 
ATOM 907  C CB  . ASP A 1 116 ? -8.745  5.497   -3.414  1.00 94.16 116 A 1 
ATOM 908  C CG  . ASP A 1 116 ? -9.240  6.831   -2.838  1.00 91.20 116 A 1 
ATOM 909  O OD1 . ASP A 1 116 ? -9.362  7.806   -3.616  1.00 87.43 116 A 1 
ATOM 910  O OD2 . ASP A 1 116 ? -9.614  6.869   -1.655  1.00 85.81 116 A 1 
ATOM 911  N N   . GLU A 1 117 ? -10.343 6.699   -6.340  1.00 94.64 117 A 1 
ATOM 912  C CA  . GLU A 1 117 ? -10.271 7.647   -7.453  1.00 94.28 117 A 1 
ATOM 913  C C   . GLU A 1 117 ? -9.422  8.887   -7.131  1.00 94.42 117 A 1 
ATOM 914  O O   . GLU A 1 117 ? -8.929  9.545   -8.045  1.00 93.26 117 A 1 
ATOM 915  C CB  . GLU A 1 117 ? -11.678 8.131   -7.821  1.00 93.53 117 A 1 
ATOM 916  C CG  . GLU A 1 117 ? -12.625 7.036   -8.339  1.00 89.30 117 A 1 
ATOM 917  C CD  . GLU A 1 117 ? -13.989 7.605   -8.769  1.00 84.94 117 A 1 
ATOM 918  O OE1 . GLU A 1 117 ? -14.826 6.809   -9.245  1.00 78.66 117 A 1 
ATOM 919  O OE2 . GLU A 1 117 ? -14.197 8.838   -8.634  1.00 78.22 117 A 1 
ATOM 920  N N   . ASN A 1 118 ? -9.263  9.261   -5.854  1.00 94.12 118 A 1 
ATOM 921  C CA  . ASN A 1 118 ? -8.421  10.396  -5.485  1.00 93.53 118 A 1 
ATOM 922  C C   . ASN A 1 118 ? -6.940  10.025  -5.530  1.00 94.33 118 A 1 
ATOM 923  O O   . ASN A 1 118 ? -6.143  10.824  -6.018  1.00 93.76 118 A 1 
ATOM 924  C CB  . ASN A 1 118 ? -8.816  10.956  -4.119  1.00 92.52 118 A 1 
ATOM 925  C CG  . ASN A 1 118 ? -10.253 11.408  -4.063  1.00 89.23 118 A 1 
ATOM 926  O OD1 . ASN A 1 118 ? -10.712 12.236  -4.848  1.00 83.62 118 A 1 
ATOM 927  N ND2 . ASN A 1 118 ? -11.009 10.877  -3.132  1.00 81.85 118 A 1 
ATOM 928  N N   . MET A 1 119 ? -6.579  8.811   -5.112  1.00 93.91 119 A 1 
ATOM 929  C CA  . MET A 1 119 ? -5.209  8.308   -5.283  1.00 95.04 119 A 1 
ATOM 930  C C   . MET A 1 119 ? -4.840  8.198   -6.765  1.00 95.31 119 A 1 
ATOM 931  O O   . MET A 1 119 ? -3.731  8.563   -7.148  1.00 94.56 119 A 1 
ATOM 932  C CB  . MET A 1 119 ? -5.040  6.950   -4.594  1.00 94.80 119 A 1 
ATOM 933  C CG  . MET A 1 119 ? -5.130  7.048   -3.070  1.00 91.58 119 A 1 
ATOM 934  S SD  . MET A 1 119 ? -4.787  5.485   -2.212  1.00 90.85 119 A 1 
ATOM 935  C CE  . MET A 1 119 ? -2.996  5.369   -2.408  1.00 83.56 119 A 1 
ATOM 936  N N   . GLN A 1 120 ? -5.780  7.786   -7.624  1.00 95.40 120 A 1 
ATOM 937  C CA  . GLN A 1 120 ? -5.576  7.680   -9.076  1.00 95.12 120 A 1 
ATOM 938  C C   . GLN A 1 120 ? -5.377  9.035   -9.786  1.00 95.04 120 A 1 
ATOM 939  O O   . GLN A 1 120 ? -4.934  9.059   -10.932 1.00 94.46 120 A 1 
ATOM 940  C CB  . GLN A 1 120 ? -6.762  6.927   -9.697  1.00 95.22 120 A 1 
ATOM 941  C CG  . GLN A 1 120 ? -6.817  5.447   -9.269  1.00 94.37 120 A 1 
ATOM 942  C CD  . GLN A 1 120 ? -8.074  4.738   -9.762  1.00 93.41 120 A 1 
ATOM 943  O OE1 . GLN A 1 120 ? -8.713  5.114   -10.734 1.00 89.59 120 A 1 
ATOM 944  N NE2 . GLN A 1 120 ? -8.481  3.667   -9.117  1.00 87.36 120 A 1 
ATOM 945  N N   . LYS A 1 121 ? -5.691  10.167  -9.135  1.00 95.00 121 A 1 
ATOM 946  C CA  . LYS A 1 121 ? -5.459  11.520  -9.682  1.00 94.85 121 A 1 
ATOM 947  C C   . LYS A 1 121 ? -4.016  12.003  -9.514  1.00 95.28 121 A 1 
ATOM 948  O O   . LYS A 1 121 ? -3.657  13.009  -10.125 1.00 94.71 121 A 1 
ATOM 949  C CB  . LYS A 1 121 ? -6.414  12.527  -9.028  1.00 94.36 121 A 1 
ATOM 950  C CG  . LYS A 1 121 ? -7.875  12.330  -9.445  1.00 93.10 121 A 1 
ATOM 951  C CD  . LYS A 1 121 ? -8.804  13.108  -8.508  1.00 90.76 121 A 1 
ATOM 952  C CE  . LYS A 1 121 ? -10.250 12.637  -8.715  1.00 88.47 121 A 1 
ATOM 953  N NZ  . LYS A 1 121 ? -11.123 13.027  -7.587  1.00 82.36 121 A 1 
ATOM 954  N N   . TYR A 1 122 ? -3.222  11.353  -8.671  1.00 95.48 122 A 1 
ATOM 955  C CA  . TYR A 1 122 ? -1.806  11.686  -8.555  1.00 95.60 122 A 1 
ATOM 956  C C   . TYR A 1 122 ? -1.030  11.170  -9.768  1.00 95.73 122 A 1 
ATOM 957  O O   . TYR A 1 122 ? -1.386  10.163  -10.375 1.00 94.73 122 A 1 
ATOM 958  C CB  . TYR A 1 122 ? -1.225  11.132  -7.249  1.00 95.53 122 A 1 
ATOM 959  C CG  . TYR A 1 122 ? -1.754  11.816  -6.001  1.00 95.38 122 A 1 
ATOM 960  C CD1 . TYR A 1 122 ? -1.226  13.057  -5.594  1.00 93.86 122 A 1 
ATOM 961  C CD2 . TYR A 1 122 ? -2.768  11.210  -5.241  1.00 94.15 122 A 1 
ATOM 962  C CE1 . TYR A 1 122 ? -1.707  13.685  -4.429  1.00 93.21 122 A 1 
ATOM 963  C CE2 . TYR A 1 122 ? -3.252  11.838  -4.076  1.00 93.42 122 A 1 
ATOM 964  C CZ  . TYR A 1 122 ? -2.720  13.073  -3.668  1.00 93.46 122 A 1 
ATOM 965  O OH  . TYR A 1 122 ? -3.184  13.671  -2.540  1.00 91.84 122 A 1 
ATOM 966  N N   . ASP A 1 123 ? 0.067   11.840  -10.101 1.00 94.92 123 A 1 
ATOM 967  C CA  . ASP A 1 123 ? 0.998   11.408  -11.147 1.00 95.21 123 A 1 
ATOM 968  C C   . ASP A 1 123 ? 1.823   10.202  -10.658 1.00 96.02 123 A 1 
ATOM 969  O O   . ASP A 1 123 ? 2.984   10.322  -10.261 1.00 94.82 123 A 1 
ATOM 970  C CB  . ASP A 1 123 ? 1.858   12.602  -11.583 1.00 93.85 123 A 1 
ATOM 971  C CG  . ASP A 1 123 ? 2.848   12.226  -12.686 1.00 88.73 123 A 1 
ATOM 972  O OD1 . ASP A 1 123 ? 2.473   11.399  -13.545 1.00 84.80 123 A 1 
ATOM 973  O OD2 . ASP A 1 123 ? 3.971   12.773  -12.640 1.00 82.96 123 A 1 
ATOM 974  N N   . VAL A 1 124 ? 1.167   9.041   -10.588 1.00 96.12 124 A 1 
ATOM 975  C CA  . VAL A 1 124 ? 1.722   7.746   -10.180 1.00 96.61 124 A 1 
ATOM 976  C C   . VAL A 1 124 ? 0.969   6.631   -10.906 1.00 97.05 124 A 1 
ATOM 977  O O   . VAL A 1 124 ? -0.229  6.747   -11.176 1.00 96.64 124 A 1 
ATOM 978  C CB  . VAL A 1 124 ? 1.666   7.585   -8.646  1.00 95.93 124 A 1 
ATOM 979  C CG1 . VAL A 1 124 ? 0.236   7.514   -8.094  1.00 90.96 124 A 1 
ATOM 980  C CG2 . VAL A 1 124 ? 2.452   6.365   -8.165  1.00 91.03 124 A 1 
ATOM 981  N N   . ALA A 1 125 ? 1.659   5.547   -11.248 1.00 97.38 125 A 1 
ATOM 982  C CA  . ALA A 1 125 ? 1.013   4.409   -11.893 1.00 97.67 125 A 1 
ATOM 983  C C   . ALA A 1 125 ? 0.038   3.722   -10.923 1.00 98.06 125 A 1 
ATOM 984  O O   . ALA A 1 125 ? 0.406   3.384   -9.801  1.00 97.71 125 A 1 
ATOM 985  C CB  . ALA A 1 125 ? 2.089   3.454   -12.421 1.00 97.06 125 A 1 
ATOM 986  N N   . CYS A 1 126 ? -1.197  3.482   -11.377 1.00 97.66 126 A 1 
ATOM 987  C CA  . CYS A 1 126 ? -2.229  2.788   -10.611 1.00 97.53 126 A 1 
ATOM 988  C C   . CYS A 1 126 ? -2.821  1.620   -11.405 1.00 97.47 126 A 1 
ATOM 989  O O   . CYS A 1 126 ? -2.861  1.632   -12.640 1.00 96.39 126 A 1 
ATOM 990  C CB  . CYS A 1 126 ? -3.319  3.778   -10.175 1.00 96.70 126 A 1 
ATOM 991  S SG  . CYS A 1 126 ? -2.657  4.978   -8.984  1.00 93.49 126 A 1 
ATOM 992  N N   . VAL A 1 127 ? -3.320  0.614   -10.694 1.00 96.95 127 A 1 
ATOM 993  C CA  . VAL A 1 127 ? -4.079  -0.505  -11.258 1.00 96.97 127 A 1 
ATOM 994  C C   . VAL A 1 127 ? -5.278  -0.844  -10.377 1.00 97.24 127 A 1 
ATOM 995  O O   . VAL A 1 127 ? -5.184  -0.835  -9.154  1.00 96.63 127 A 1 
ATOM 996  C CB  . VAL A 1 127 ? -3.160  -1.719  -11.513 1.00 96.01 127 A 1 
ATOM 997  C CG1 . VAL A 1 127 ? -2.616  -2.388  -10.253 1.00 88.42 127 A 1 
ATOM 998  C CG2 . VAL A 1 127 ? -3.868  -2.801  -12.328 1.00 88.69 127 A 1 
ATOM 999  N N   . TRP A 1 128 ? -6.415  -1.170  -11.033 1.00 95.16 128 A 1 
ATOM 1000 C CA  . TRP A 1 128 ? -7.612  -1.722  -10.406 1.00 95.28 128 A 1 
ATOM 1001 C C   . TRP A 1 128 ? -8.246  -2.793  -11.320 1.00 91.00 128 A 1 
ATOM 1002 O O   . TRP A 1 128 ? -8.173  -2.632  -12.555 1.00 83.95 128 A 1 
ATOM 1003 C CB  . TRP A 1 128 ? -8.600  -0.606  -10.037 1.00 93.90 128 A 1 
ATOM 1004 C CG  . TRP A 1 128 ? -9.694  -1.085  -9.137  1.00 91.86 128 A 1 
ATOM 1005 C CD1 . TRP A 1 128 ? -11.005 -1.173  -9.445  1.00 89.87 128 A 1 
ATOM 1006 C CD2 . TRP A 1 128 ? -9.564  -1.632  -7.794  1.00 93.84 128 A 1 
ATOM 1007 N NE1 . TRP A 1 128 ? -11.699 -1.744  -8.397  1.00 88.68 128 A 1 
ATOM 1008 C CE2 . TRP A 1 128 ? -10.854 -2.060  -7.358  1.00 93.01 128 A 1 
ATOM 1009 C CE3 . TRP A 1 128 ? -8.491  -1.836  -6.904  1.00 89.38 128 A 1 
ATOM 1010 C CZ2 . TRP A 1 128 ? -11.048 -2.698  -6.122  1.00 89.20 128 A 1 
ATOM 1011 C CZ3 . TRP A 1 128 ? -8.682  -2.465  -5.655  1.00 89.01 128 A 1 
ATOM 1012 C CH2 . TRP A 1 128 ? -9.952  -2.899  -5.264  1.00 89.17 128 A 1 
ATOM 1013 O OXT . TRP A 1 128 ? -8.811  -3.752  -10.734 1.00 87.70 128 A 1 
#
