JAL-629 add AF examples for FER1_SPIOL. Link and display PAE matrix annotation

diff --git a/examples/AlphaFold/AF-P00221-F1-model_v4.cif b/examples/AlphaFold/AF-P00221-F1-model_v4.cif
new file mode 100644 (file)
index 0000000..94f5907
--- /dev/null
+++ b/examples/AlphaFold/AF-P00221-F1-model_v4.cif
@@ -0,0 +1,1985 @@
+data_AF-P00221-F1
+#
+_entry.id AF-P00221-F1
+#
+loop_
+_atom_type.symbol
+C 
+N 
+O 
+S 
+#
+loop_
+_audit_author.name
+_audit_author.pdbx_ordinal
+"Jumper, John"               1  
+"Evans, Richard"             2  
+"Pritzel, Alexander"         3  
+"Green, Tim"                 4  
+"Figurnov, Michael"          5  
+"Ronneberger, Olaf"          6  
+"Tunyasuvunakool, Kathryn"   7  
+"Bates, Russ"                8  
+"Zidek, Augustin"            9  
+"Potapenko, Anna"            10 
+"Bridgland, Alex"            11 
+"Meyer, Clemens"             12 
+"Kohl, Simon A. A."          13 
+"Ballard, Andrew J."         14 
+"Cowie, Andrew"              15 
+"Romera-Paredes, Bernardino" 16 
+"Nikolov, Stanislav"         17 
+"Jain, Rishub"               18 
+"Adler, Jonas"               19 
+"Back, Trevor"               20 
+"Petersen, Stig"             21 
+"Reiman, David"              22 
+"Clancy, Ellen"              23 
+"Zielinski, Michal"          24 
+"Steinegger, Martin"         25 
+"Pacholska, Michalina"       26 
+"Berghammer, Tamas"          27 
+"Silver, David"              28 
+"Vinyals, Oriol"             29 
+"Senior, Andrew W."          30 
+"Kavukcuoglu, Koray"         31 
+"Kohli, Pushmeet"            32 
+"Hassabis, Demis"            33 
+#
+_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  1.3.9
+#
+loop_
+_chem_comp.formula
+_chem_comp.formula_weight
+_chem_comp.id
+_chem_comp.mon_nstd_flag
+_chem_comp.name
+_chem_comp.pdbx_synonyms
+_chem_comp.type
+"C3 H7 N O2"    89.093  ALA y ALANINE         ? "L-PEPTIDE LINKING" 
+"C6 H15 N4 O2"  175.209 ARG y ARGININE        ? "L-PEPTIDE LINKING" 
+"C4 H8 N2 O3"   132.118 ASN y ASPARAGINE      ? "L-PEPTIDE LINKING" 
+"C4 H7 N O4"    133.103 ASP y "ASPARTIC ACID" ? "L-PEPTIDE LINKING" 
+"C3 H7 N O2 S"  121.158 CYS y CYSTEINE        ? "L-PEPTIDE LINKING" 
+"C5 H10 N2 O3"  146.144 GLN y GLUTAMINE       ? "L-PEPTIDE LINKING" 
+"C5 H9 N O4"    147.129 GLU y "GLUTAMIC ACID" ? "L-PEPTIDE LINKING" 
+"C2 H5 N O2"    75.067  GLY y GLYCINE         ? "PEPTIDE LINKING"   
+"C6 H10 N3 O2"  156.162 HIS y HISTIDINE       ? "L-PEPTIDE LINKING" 
+"C6 H13 N O2"   131.173 ILE y ISOLEUCINE      ? "L-PEPTIDE LINKING" 
+"C6 H13 N O2"   131.173 LEU y LEUCINE         ? "L-PEPTIDE LINKING" 
+"C6 H15 N2 O2"  147.195 LYS y LYSINE          ? "L-PEPTIDE LINKING" 
+"C5 H11 N O2 S" 149.211 MET y METHIONINE      ? "L-PEPTIDE LINKING" 
+"C9 H11 N O2"   165.189 PHE y PHENYLALANINE   ? "L-PEPTIDE LINKING" 
+"C5 H9 N O2"    115.130 PRO y PROLINE         ? "L-PEPTIDE LINKING" 
+"C3 H7 N O3"    105.093 SER y SERINE          ? "L-PEPTIDE LINKING" 
+"C4 H9 N O3"    119.119 THR y THREONINE       ? "L-PEPTIDE LINKING" 
+"C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN      ? "L-PEPTIDE LINKING" 
+"C9 H11 N O3"   181.189 TYR y TYROSINE        ? "L-PEPTIDE LINKING" 
+"C5 H11 N O2"   117.146 VAL y VALINE          ? "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          596
+_citation.page_first              583
+_citation.page_last               589
+_citation.pdbx_database_id_DOI    10.1038/s41586-021-03819-2
+_citation.pdbx_database_id_PubMed 34265844
+_citation.title                   "Highly accurate protein structure prediction with AlphaFold"
+_citation.year                    2021
+#
+loop_
+_citation_author.citation_id
+_citation_author.name
+_citation_author.ordinal
+1 "Jumper, John"               1  
+1 "Evans, Richard"             2  
+1 "Pritzel, Alexander"         3  
+1 "Green, Tim"                 4  
+1 "Figurnov, Michael"          5  
+1 "Ronneberger, Olaf"          6  
+1 "Tunyasuvunakool, Kathryn"   7  
+1 "Bates, Russ"                8  
+1 "Zidek, Augustin"            9  
+1 "Potapenko, Anna"            10 
+1 "Bridgland, Alex"            11 
+1 "Meyer, Clemens"             12 
+1 "Kohl, Simon A. A."          13 
+1 "Ballard, Andrew J."         14 
+1 "Cowie, Andrew"              15 
+1 "Romera-Paredes, Bernardino" 16 
+1 "Nikolov, Stanislav"         17 
+1 "Jain, Rishub"               18 
+1 "Adler, Jonas"               19 
+1 "Back, Trevor"               20 
+1 "Petersen, Stig"             21 
+1 "Reiman, David"              22 
+1 "Clancy, Ellen"              23 
+1 "Zielinski, Michal"          24 
+1 "Steinegger, Martin"         25 
+1 "Pacholska, Michalina"       26 
+1 "Berghammer, Tamas"          27 
+1 "Silver, David"              28 
+1 "Vinyals, Oriol"             29 
+1 "Senior, Andrew W."          30 
+1 "Kavukcuoglu, Koray"         31 
+1 "Kohli, Pushmeet"            32 
+1 "Hassabis, Demis"            33 
+#
+_database_2.database_code AF-P00221-F1
+_database_2.database_id   AlphaFoldDB
+#
+_entity.details                  ?
+_entity.formula_weight           ?
+_entity.id                       1
+_entity.pdbx_description         "Ferredoxin-1, chloroplastic"
+_entity.pdbx_ec                  ?
+_entity.pdbx_fragment            ?
+_entity.pdbx_mutation            ?
+_entity.pdbx_number_of_molecules 1
+_entity.src_method               man
+_entity.type                     polymer
+#
+_entity_poly.entity_id                    1
+_entity_poly.nstd_linkage                 no
+_entity_poly.nstd_monomer                 no
+_entity_poly.pdbx_seq_one_letter_code     
+;MAATTTTMMGMATTFVPKPQAPPMMAALPSNTGRSLFGLKTGSRGGRMTMAAYKVTLVTPTGNVEFQCPDDVYILDAAEE
+EGIDLPYSCRAGSCSSCAGKLKTGSLNQDDQSFLDDDQIDEGWVLTCAAYPVSDVTIETHKEEELTA
+;
+_entity_poly.pdbx_seq_one_letter_code_can 
+;MAATTTTMMGMATTFVPKPQAPPMMAALPSNTGRSLFGLKTGSRGGRMTMAAYKVTLVTPTGNVEFQCPDDVYILDAAEE
+EGIDLPYSCRAGSCSSCAGKLKTGSLNQDDQSFLDDDQIDEGWVLTCAAYPVSDVTIETHKEEELTA
+;
+_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 ALA 2   
+1 n ALA 3   
+1 n THR 4   
+1 n THR 5   
+1 n THR 6   
+1 n THR 7   
+1 n MET 8   
+1 n MET 9   
+1 n GLY 10  
+1 n MET 11  
+1 n ALA 12  
+1 n THR 13  
+1 n THR 14  
+1 n PHE 15  
+1 n VAL 16  
+1 n PRO 17  
+1 n LYS 18  
+1 n PRO 19  
+1 n GLN 20  
+1 n ALA 21  
+1 n PRO 22  
+1 n PRO 23  
+1 n MET 24  
+1 n MET 25  
+1 n ALA 26  
+1 n ALA 27  
+1 n LEU 28  
+1 n PRO 29  
+1 n SER 30  
+1 n ASN 31  
+1 n THR 32  
+1 n GLY 33  
+1 n ARG 34  
+1 n SER 35  
+1 n LEU 36  
+1 n PHE 37  
+1 n GLY 38  
+1 n LEU 39  
+1 n LYS 40  
+1 n THR 41  
+1 n GLY 42  
+1 n SER 43  
+1 n ARG 44  
+1 n GLY 45  
+1 n GLY 46  
+1 n ARG 47  
+1 n MET 48  
+1 n THR 49  
+1 n MET 50  
+1 n ALA 51  
+1 n ALA 52  
+1 n TYR 53  
+1 n LYS 54  
+1 n VAL 55  
+1 n THR 56  
+1 n LEU 57  
+1 n VAL 58  
+1 n THR 59  
+1 n PRO 60  
+1 n THR 61  
+1 n GLY 62  
+1 n ASN 63  
+1 n VAL 64  
+1 n GLU 65  
+1 n PHE 66  
+1 n GLN 67  
+1 n CYS 68  
+1 n PRO 69  
+1 n ASP 70  
+1 n ASP 71  
+1 n VAL 72  
+1 n TYR 73  
+1 n ILE 74  
+1 n LEU 75  
+1 n ASP 76  
+1 n ALA 77  
+1 n ALA 78  
+1 n GLU 79  
+1 n GLU 80  
+1 n GLU 81  
+1 n GLY 82  
+1 n ILE 83  
+1 n ASP 84  
+1 n LEU 85  
+1 n PRO 86  
+1 n TYR 87  
+1 n SER 88  
+1 n CYS 89  
+1 n ARG 90  
+1 n ALA 91  
+1 n GLY 92  
+1 n SER 93  
+1 n CYS 94  
+1 n SER 95  
+1 n SER 96  
+1 n CYS 97  
+1 n ALA 98  
+1 n GLY 99  
+1 n LYS 100 
+1 n LEU 101 
+1 n LYS 102 
+1 n THR 103 
+1 n GLY 104 
+1 n SER 105 
+1 n LEU 106 
+1 n ASN 107 
+1 n GLN 108 
+1 n ASP 109 
+1 n ASP 110 
+1 n GLN 111 
+1 n SER 112 
+1 n PHE 113 
+1 n LEU 114 
+1 n ASP 115 
+1 n ASP 116 
+1 n ASP 117 
+1 n GLN 118 
+1 n ILE 119 
+1 n ASP 120 
+1 n GLU 121 
+1 n GLY 122 
+1 n TRP 123 
+1 n VAL 124 
+1 n LEU 125 
+1 n THR 126 
+1 n CYS 127 
+1 n ALA 128 
+1 n ALA 129 
+1 n TYR 130 
+1 n PRO 131 
+1 n VAL 132 
+1 n SER 133 
+1 n ASP 134 
+1 n VAL 135 
+1 n THR 136 
+1 n ILE 137 
+1 n GLU 138 
+1 n THR 139 
+1 n HIS 140 
+1 n LYS 141 
+1 n GLU 142 
+1 n GLU 143 
+1 n GLU 144 
+1 n LEU 145 
+1 n THR 146 
+1 n ALA 147 
+#
+loop_
+_ma_data.content_type
+_ma_data.id
+_ma_data.name
+"model coordinates" 1 Model             
+"input structure"   2 "Input structure" 
+#
+_ma_model_list.data_id          1
+_ma_model_list.model_group_id   1
+_ma_model_list.model_group_name "AlphaFold Monomer v2.0 model"
+_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 84.43
+_ma_qa_metric_global.model_id     1
+_ma_qa_metric_global.ordinal_id   1
+#
+loop_
+_ma_qa_metric_local.label_asym_id
+_ma_qa_metric_local.label_comp_id
+_ma_qa_metric_local.label_seq_id
+_ma_qa_metric_local.metric_id
+_ma_qa_metric_local.metric_value
+_ma_qa_metric_local.model_id
+_ma_qa_metric_local.ordinal_id
+A MET 1   2 56.42 1 1   
+A ALA 2   2 52.97 1 2   
+A ALA 3   2 60.41 1 3   
+A THR 4   2 75.74 1 4   
+A THR 5   2 73.15 1 5   
+A THR 6   2 67.00 1 6   
+A THR 7   2 68.61 1 7   
+A MET 8   2 67.08 1 8   
+A MET 9   2 67.60 1 9   
+A GLY 10  2 61.80 1 10  
+A MET 11  2 68.90 1 11  
+A ALA 12  2 61.95 1 12  
+A THR 13  2 68.99 1 13  
+A THR 14  2 70.93 1 14  
+A PHE 15  2 65.35 1 15  
+A VAL 16  2 69.16 1 16  
+A PRO 17  2 68.00 1 17  
+A LYS 18  2 66.26 1 18  
+A PRO 19  2 67.49 1 19  
+A GLN 20  2 60.48 1 20  
+A ALA 21  2 63.79 1 21  
+A PRO 22  2 69.72 1 22  
+A PRO 23  2 54.38 1 23  
+A MET 24  2 54.35 1 24  
+A MET 25  2 57.94 1 25  
+A ALA 26  2 54.08 1 26  
+A ALA 27  2 53.27 1 27  
+A LEU 28  2 53.66 1 28  
+A PRO 29  2 58.78 1 29  
+A SER 30  2 56.77 1 30  
+A ASN 31  2 63.36 1 31  
+A THR 32  2 54.93 1 32  
+A GLY 33  2 56.81 1 33  
+A ARG 34  2 51.39 1 34  
+A SER 35  2 52.75 1 35  
+A LEU 36  2 54.39 1 36  
+A PHE 37  2 44.45 1 37  
+A GLY 38  2 51.45 1 38  
+A LEU 39  2 53.14 1 39  
+A LYS 40  2 55.15 1 40  
+A THR 41  2 41.56 1 41  
+A GLY 42  2 47.00 1 42  
+A SER 43  2 57.62 1 43  
+A ARG 44  2 48.74 1 44  
+A GLY 45  2 54.92 1 45  
+A GLY 46  2 56.22 1 46  
+A ARG 47  2 59.12 1 47  
+A MET 48  2 61.00 1 48  
+A THR 49  2 59.24 1 49  
+A MET 50  2 79.45 1 50  
+A ALA 51  2 91.56 1 51  
+A ALA 52  2 95.10 1 52  
+A TYR 53  2 97.39 1 53  
+A LYS 54  2 97.92 1 54  
+A VAL 55  2 98.15 1 55  
+A THR 56  2 98.06 1 56  
+A LEU 57  2 97.93 1 57  
+A VAL 58  2 97.35 1 58  
+A THR 59  2 95.76 1 59  
+A PRO 60  2 93.95 1 60  
+A THR 61  2 93.58 1 61  
+A GLY 62  2 94.71 1 62  
+A ASN 63  2 96.32 1 63  
+A VAL 64  2 96.72 1 64  
+A GLU 65  2 97.27 1 65  
+A PHE 66  2 97.26 1 66  
+A GLN 67  2 97.06 1 67  
+A CYS 68  2 96.89 1 68  
+A PRO 69  2 96.13 1 69  
+A ASP 70  2 95.31 1 70  
+A ASP 71  2 94.63 1 71  
+A VAL 72  2 96.39 1 72  
+A TYR 73  2 97.16 1 73  
+A ILE 74  2 97.32 1 74  
+A LEU 75  2 97.32 1 75  
+A ASP 76  2 96.85 1 76  
+A ALA 77  2 97.02 1 77  
+A ALA 78  2 96.98 1 78  
+A GLU 79  2 96.34 1 79  
+A GLU 80  2 96.41 1 80  
+A GLU 81  2 96.03 1 81  
+A GLY 82  2 95.60 1 82  
+A ILE 83  2 95.50 1 83  
+A ASP 84  2 94.24 1 84  
+A LEU 85  2 95.31 1 85  
+A PRO 86  2 95.42 1 86  
+A TYR 87  2 95.33 1 87  
+A SER 88  2 95.57 1 88  
+A CYS 89  2 96.40 1 89  
+A ARG 90  2 94.02 1 90  
+A ALA 91  2 94.91 1 91  
+A GLY 92  2 95.29 1 92  
+A SER 93  2 95.82 1 93  
+A CYS 94  2 96.09 1 94  
+A SER 95  2 94.83 1 95  
+A SER 96  2 96.73 1 96  
+A CYS 97  2 96.99 1 97  
+A ALA 98  2 97.36 1 98  
+A GLY 99  2 97.46 1 99  
+A LYS 100 2 97.48 1 100 
+A LEU 101 2 98.00 1 101 
+A LYS 102 2 97.25 1 102 
+A THR 103 2 97.23 1 103 
+A GLY 104 2 96.90 1 104 
+A SER 105 2 96.43 1 105 
+A LEU 106 2 96.86 1 106 
+A ASN 107 2 96.33 1 107 
+A GLN 108 2 96.30 1 108 
+A ASP 109 2 95.43 1 109 
+A ASP 110 2 95.52 1 110 
+A GLN 111 2 95.77 1 111 
+A SER 112 2 95.91 1 112 
+A PHE 113 2 96.54 1 113 
+A LEU 114 2 96.33 1 114 
+A ASP 115 2 95.81 1 115 
+A ASP 116 2 95.50 1 116 
+A ASP 117 2 95.97 1 117 
+A GLN 118 2 95.95 1 118 
+A ILE 119 2 95.94 1 119 
+A ASP 120 2 95.31 1 120 
+A GLU 121 2 95.80 1 121 
+A GLY 122 2 96.68 1 122 
+A TRP 123 2 97.54 1 123 
+A VAL 124 2 97.69 1 124 
+A LEU 125 2 97.68 1 125 
+A THR 126 2 97.06 1 126 
+A CYS 127 2 97.42 1 127 
+A ALA 128 2 97.30 1 128 
+A ALA 129 2 97.44 1 129 
+A TYR 130 2 97.59 1 130 
+A PRO 131 2 97.30 1 131 
+A VAL 132 2 96.81 1 132 
+A SER 133 2 97.27 1 133 
+A ASP 134 2 97.85 1 134 
+A VAL 135 2 98.07 1 135 
+A THR 136 2 98.25 1 136 
+A ILE 137 2 98.15 1 137 
+A GLU 138 2 97.71 1 138 
+A THR 139 2 97.28 1 139 
+A HIS 140 2 96.39 1 140 
+A LYS 141 2 96.60 1 141 
+A GLU 142 2 96.32 1 142 
+A GLU 143 2 94.50 1 143 
+A GLU 144 2 94.46 1 144 
+A LEU 145 2 92.47 1 145 
+A THR 146 2 89.15 1 146 
+A ALA 147 2 87.34 1 147 
+#
+_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    "reference database"
+#
+_ma_target_entity_instance.asym_id   A
+_ma_target_entity_instance.details   .
+_ma_target_entity_instance.entity_id 1
+#
+_ma_target_ref_db_details.db_accession                 P00221
+_ma_target_ref_db_details.db_code                      FER1_SPIOL
+_ma_target_ref_db_details.db_name                      UNP
+_ma_target_ref_db_details.gene_name                    PETF
+_ma_target_ref_db_details.ncbi_taxonomy_id             3562
+_ma_target_ref_db_details.organism_scientific          "Spinacia oleracea"
+_ma_target_ref_db_details.seq_db_align_begin           1
+_ma_target_ref_db_details.seq_db_align_end             147
+_ma_target_ref_db_details.seq_db_isoform               ?
+_ma_target_ref_db_details.seq_db_sequence_checksum     76045050A0AA8697
+_ma_target_ref_db_details.seq_db_sequence_version_date 1991-08-01
+_ma_target_ref_db_details.target_entity_id             1
+#
+loop_
+_ma_template_details.ordinal_id
+_ma_template_details.target_asym_id
+_ma_template_details.template_auth_asym_id
+_ma_template_details.template_data_id
+_ma_template_details.template_entity_type
+_ma_template_details.template_id
+_ma_template_details.template_model_num
+_ma_template_details.template_origin
+_ma_template_details.template_trans_matrix_id
+1 A A 2 polymer 1 1 "reference database" 1 
+2 A A 2 polymer 2 1 "reference database" 1 
+3 A N 2 polymer 3 1 "reference database" 1 
+4 A B 2 polymer 4 1 "reference database" 1 
+#
+loop_
+_ma_template_ref_db_details.db_accession_code
+_ma_template_ref_db_details.db_name
+_ma_template_ref_db_details.template_id
+1FRR PDB 1 
+1PFD PDB 2 
+6YEZ PDB 3 
+1IUE PDB 4 
+#
+_ma_template_trans_matrix.id               1
+_ma_template_trans_matrix.rot_matrix[1][1] 1.0
+_ma_template_trans_matrix.rot_matrix[1][2] 0.0
+_ma_template_trans_matrix.rot_matrix[1][3] 0.0
+_ma_template_trans_matrix.rot_matrix[2][1] 0.0
+_ma_template_trans_matrix.rot_matrix[2][2] 1.0
+_ma_template_trans_matrix.rot_matrix[2][3] 0.0
+_ma_template_trans_matrix.rot_matrix[3][1] 0.0
+_ma_template_trans_matrix.rot_matrix[3][2] 0.0
+_ma_template_trans_matrix.rot_matrix[3][3] 1.0
+_ma_template_trans_matrix.tr_vector[1]     0.0
+_ma_template_trans_matrix.tr_vector[2]     0.0
+_ma_template_trans_matrix.tr_vector[3]     0.0
+#
+loop_
+_pdbx_audit_revision_details.data_content_type
+_pdbx_audit_revision_details.description
+_pdbx_audit_revision_details.ordinal
+_pdbx_audit_revision_details.provider
+_pdbx_audit_revision_details.revision_ordinal
+_pdbx_audit_revision_details.type
+"Structure model" "Format fixes, new metadata, initial SwissProt release" 2 repository 2 Remediation 
+"Structure model" "Format fixes, new metadata, initial UniProt release"   3 repository 3 Remediation 
+"Structure model" "Improved prediction accuracy, small format fixes"      4 repository 4 Remediation 
+#
+loop_
+_pdbx_audit_revision_history.data_content_type
+_pdbx_audit_revision_history.major_revision
+_pdbx_audit_revision_history.minor_revision
+_pdbx_audit_revision_history.ordinal
+_pdbx_audit_revision_history.revision_date
+"Structure model" 2 0 2 2021-12-09 
+"Structure model" 3 0 3 2022-06-01 
+"Structure model" 4 0 4 2022-09-30 
+#
+loop_
+_pdbx_data_usage.details
+_pdbx_data_usage.id
+_pdbx_data_usage.name
+_pdbx_data_usage.type
+_pdbx_data_usage.url
+"Data in this file is available under a CC-BY-4.0 license." 1 CC-BY-4.0 license    https://creativecommons.org/licenses/by/4.0/ 
+;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION
+PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS
+USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED
+OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE
+THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE
+A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES
+NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR
+ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE.
+;
+2 ?         disclaimer ?                                            
+#
+_pdbx_database_status.entry_id                      AF-P00221-F1
+_pdbx_database_status.recvd_initial_deposition_date 2022-06-01
+_pdbx_database_status.status_code                   REL
+#
+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_mon_id
+_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 . MET 1   A 1   
+A 2   1 n ALA . ALA 2   A 2   
+A 3   1 n ALA . ALA 3   A 3   
+A 4   1 n THR . THR 4   A 4   
+A 5   1 n THR . THR 5   A 5   
+A 6   1 n THR . THR 6   A 6   
+A 7   1 n THR . THR 7   A 7   
+A 8   1 n MET . MET 8   A 8   
+A 9   1 n MET . MET 9   A 9   
+A 10  1 n GLY . GLY 10  A 10  
+A 11  1 n MET . MET 11  A 11  
+A 12  1 n ALA . ALA 12  A 12  
+A 13  1 n THR . THR 13  A 13  
+A 14  1 n THR . THR 14  A 14  
+A 15  1 n PHE . PHE 15  A 15  
+A 16  1 n VAL . VAL 16  A 16  
+A 17  1 n PRO . PRO 17  A 17  
+A 18  1 n LYS . LYS 18  A 18  
+A 19  1 n PRO . PRO 19  A 19  
+A 20  1 n GLN . GLN 20  A 20  
+A 21  1 n ALA . ALA 21  A 21  
+A 22  1 n PRO . PRO 22  A 22  
+A 23  1 n PRO . PRO 23  A 23  
+A 24  1 n MET . MET 24  A 24  
+A 25  1 n MET . MET 25  A 25  
+A 26  1 n ALA . ALA 26  A 26  
+A 27  1 n ALA . ALA 27  A 27  
+A 28  1 n LEU . LEU 28  A 28  
+A 29  1 n PRO . PRO 29  A 29  
+A 30  1 n SER . SER 30  A 30  
+A 31  1 n ASN . ASN 31  A 31  
+A 32  1 n THR . THR 32  A 32  
+A 33  1 n GLY . GLY 33  A 33  
+A 34  1 n ARG . ARG 34  A 34  
+A 35  1 n SER . SER 35  A 35  
+A 36  1 n LEU . LEU 36  A 36  
+A 37  1 n PHE . PHE 37  A 37  
+A 38  1 n GLY . GLY 38  A 38  
+A 39  1 n LEU . LEU 39  A 39  
+A 40  1 n LYS . LYS 40  A 40  
+A 41  1 n THR . THR 41  A 41  
+A 42  1 n GLY . GLY 42  A 42  
+A 43  1 n SER . SER 43  A 43  
+A 44  1 n ARG . ARG 44  A 44  
+A 45  1 n GLY . GLY 45  A 45  
+A 46  1 n GLY . GLY 46  A 46  
+A 47  1 n ARG . ARG 47  A 47  
+A 48  1 n MET . MET 48  A 48  
+A 49  1 n THR . THR 49  A 49  
+A 50  1 n MET . MET 50  A 50  
+A 51  1 n ALA . ALA 51  A 51  
+A 52  1 n ALA . ALA 52  A 52  
+A 53  1 n TYR . TYR 53  A 53  
+A 54  1 n LYS . LYS 54  A 54  
+A 55  1 n VAL . VAL 55  A 55  
+A 56  1 n THR . THR 56  A 56  
+A 57  1 n LEU . LEU 57  A 57  
+A 58  1 n VAL . VAL 58  A 58  
+A 59  1 n THR . THR 59  A 59  
+A 60  1 n PRO . PRO 60  A 60  
+A 61  1 n THR . THR 61  A 61  
+A 62  1 n GLY . GLY 62  A 62  
+A 63  1 n ASN . ASN 63  A 63  
+A 64  1 n VAL . VAL 64  A 64  
+A 65  1 n GLU . GLU 65  A 65  
+A 66  1 n PHE . PHE 66  A 66  
+A 67  1 n GLN . GLN 67  A 67  
+A 68  1 n CYS . CYS 68  A 68  
+A 69  1 n PRO . PRO 69  A 69  
+A 70  1 n ASP . ASP 70  A 70  
+A 71  1 n ASP . ASP 71  A 71  
+A 72  1 n VAL . VAL 72  A 72  
+A 73  1 n TYR . TYR 73  A 73  
+A 74  1 n ILE . ILE 74  A 74  
+A 75  1 n LEU . LEU 75  A 75  
+A 76  1 n ASP . ASP 76  A 76  
+A 77  1 n ALA . ALA 77  A 77  
+A 78  1 n ALA . ALA 78  A 78  
+A 79  1 n GLU . GLU 79  A 79  
+A 80  1 n GLU . GLU 80  A 80  
+A 81  1 n GLU . GLU 81  A 81  
+A 82  1 n GLY . GLY 82  A 82  
+A 83  1 n ILE . ILE 83  A 83  
+A 84  1 n ASP . ASP 84  A 84  
+A 85  1 n LEU . LEU 85  A 85  
+A 86  1 n PRO . PRO 86  A 86  
+A 87  1 n TYR . TYR 87  A 87  
+A 88  1 n SER . SER 88  A 88  
+A 89  1 n CYS . CYS 89  A 89  
+A 90  1 n ARG . ARG 90  A 90  
+A 91  1 n ALA . ALA 91  A 91  
+A 92  1 n GLY . GLY 92  A 92  
+A 93  1 n SER . SER 93  A 93  
+A 94  1 n CYS . CYS 94  A 94  
+A 95  1 n SER . SER 95  A 95  
+A 96  1 n SER . SER 96  A 96  
+A 97  1 n CYS . CYS 97  A 97  
+A 98  1 n ALA . ALA 98  A 98  
+A 99  1 n GLY . GLY 99  A 99  
+A 100 1 n LYS . LYS 100 A 100 
+A 101 1 n LEU . LEU 101 A 101 
+A 102 1 n LYS . LYS 102 A 102 
+A 103 1 n THR . THR 103 A 103 
+A 104 1 n GLY . GLY 104 A 104 
+A 105 1 n SER . SER 105 A 105 
+A 106 1 n LEU . LEU 106 A 106 
+A 107 1 n ASN . ASN 107 A 107 
+A 108 1 n GLN . GLN 108 A 108 
+A 109 1 n ASP . ASP 109 A 109 
+A 110 1 n ASP . ASP 110 A 110 
+A 111 1 n GLN . GLN 111 A 111 
+A 112 1 n SER . SER 112 A 112 
+A 113 1 n PHE . PHE 113 A 113 
+A 114 1 n LEU . LEU 114 A 114 
+A 115 1 n ASP . ASP 115 A 115 
+A 116 1 n ASP . ASP 116 A 116 
+A 117 1 n ASP . ASP 117 A 117 
+A 118 1 n GLN . GLN 118 A 118 
+A 119 1 n ILE . ILE 119 A 119 
+A 120 1 n ASP . ASP 120 A 120 
+A 121 1 n GLU . GLU 121 A 121 
+A 122 1 n GLY . GLY 122 A 122 
+A 123 1 n TRP . TRP 123 A 123 
+A 124 1 n VAL . VAL 124 A 124 
+A 125 1 n LEU . LEU 125 A 125 
+A 126 1 n THR . THR 126 A 126 
+A 127 1 n CYS . CYS 127 A 127 
+A 128 1 n ALA . ALA 128 A 128 
+A 129 1 n ALA . ALA 129 A 129 
+A 130 1 n TYR . TYR 130 A 130 
+A 131 1 n PRO . PRO 131 A 131 
+A 132 1 n VAL . VAL 132 A 132 
+A 133 1 n SER . SER 133 A 133 
+A 134 1 n ASP . ASP 134 A 134 
+A 135 1 n VAL . VAL 135 A 135 
+A 136 1 n THR . THR 136 A 136 
+A 137 1 n ILE . ILE 137 A 137 
+A 138 1 n GLU . GLU 138 A 138 
+A 139 1 n THR . THR 139 A 139 
+A 140 1 n HIS . HIS 140 A 140 
+A 141 1 n LYS . LYS 141 A 141 
+A 142 1 n GLU . GLU 142 A 142 
+A 143 1 n GLU . GLU 143 A 143 
+A 144 1 n GLU . GLU 144 A 144 
+A 145 1 n LEU . LEU 145 A 145 
+A 146 1 n THR . THR 146 A 146 
+A 147 1 n ALA . ALA 147 A 147 
+#
+loop_
+_software.classification
+_software.date
+_software.description
+_software.name
+_software.pdbx_ordinal
+_software.type
+_software.version
+other ? "Structure prediction" AlphaFold 1 package v2.0 
+other ? "Secondary structure"  dssp      2 library 4    
+#
+_struct_asym.entity_id 1
+_struct_asym.id        A
+#
+loop_
+_struct_conf.beg_auth_asym_id
+_struct_conf.beg_auth_comp_id
+_struct_conf.beg_auth_seq_id
+_struct_conf.beg_label_asym_id
+_struct_conf.beg_label_comp_id
+_struct_conf.beg_label_seq_id
+_struct_conf.conf_type_id
+_struct_conf.end_auth_asym_id
+_struct_conf.end_auth_comp_id
+_struct_conf.end_auth_seq_id
+_struct_conf.end_label_asym_id
+_struct_conf.end_label_comp_id
+_struct_conf.end_label_seq_id
+_struct_conf.id
+_struct_conf.pdbx_beg_PDB_ins_code
+_struct_conf.pdbx_end_PDB_ins_code
+A PRO 17  A PRO 17  HELX_LH_PP_P A PRO 23  A PRO 23  HELX_LH_PP_P1 ? ? 
+A ALA 52  A ALA 52  STRN         A THR 59  A THR 59  STRN1         ? ? 
+A PRO 60  A PRO 60  TURN_TY1_P   A THR 61  A THR 61  TURN_TY1_P1   ? ? 
+A GLY 62  A GLY 62  STRN         A PRO 69  A PRO 69  STRN2         ? ? 
+A ASP 70  A ASP 70  TURN_TY1_P   A ASP 71  A ASP 71  TURN_TY1_P2   ? ? 
+A VAL 72  A VAL 72  BEND         A VAL 72  A VAL 72  BEND1         ? ? 
+A ILE 74  A ILE 74  HELX_RH_AL_P A GLU 80  A GLU 80  HELX_RH_AL_P1 ? ? 
+A GLU 81  A GLU 81  TURN_TY1_P   A GLY 82  A GLY 82  TURN_TY1_P3   ? ? 
+A SER 88  A SER 88  BEND         A SER 88  A SER 88  BEND2         ? ? 
+A ARG 90  A ARG 90  BEND         A GLY 92  A GLY 92  BEND3         ? ? 
+A CYS 94  A CYS 94  BEND         A SER 95  A SER 95  BEND4         ? ? 
+A SER 96  A SER 96  TURN_TY1_P   A CYS 97  A CYS 97  TURN_TY1_P4   ? ? 
+A ALA 98  A ALA 98  STRN         A THR 103 A THR 103 STRN3         ? ? 
+A GLY 104 A GLY 104 BEND         A GLY 104 A GLY 104 BEND5         ? ? 
+A LEU 106 A LEU 106 STRN         A ASN 107 A ASN 107 STRN4         ? ? 
+A ASP 109 A ASP 109 TURN_TY1_P   A ASP 110 A ASP 110 TURN_TY1_P5   ? ? 
+A PHE 113 A PHE 113 BEND         A LEU 114 A LEU 114 BEND6         ? ? 
+A ASP 116 A ASP 116 HELX_RH_AL_P A ASP 120 A ASP 120 HELX_RH_AL_P2 ? ? 
+A GLU 121 A GLU 121 TURN_TY1_P   A GLY 122 A GLY 122 TURN_TY1_P6   ? ? 
+A TRP 123 A TRP 123 STRN         A LEU 125 A LEU 125 STRN5         ? ? 
+A THR 126 A THR 126 HELX_RH_3T_P A ALA 128 A ALA 128 HELX_RH_3T_P1 ? ? 
+A TYR 130 A TYR 130 STRN         A PRO 131 A PRO 131 STRN6         ? ? 
+A VAL 132 A VAL 132 BEND         A SER 133 A SER 133 BEND7         ? ? 
+A VAL 135 A VAL 135 STRN         A GLU 138 A GLU 138 STRN7         ? ? 
+A GLU 142 A GLU 142 HELX_RH_AL_P A THR 146 A THR 146 HELX_RH_AL_P3 ? ? 
+#
+loop_
+_struct_conf_type.criteria
+_struct_conf_type.id
+DSSP HELX_LH_PP_P 
+DSSP STRN         
+DSSP TURN_TY1_P   
+DSSP BEND         
+DSSP HELX_RH_AL_P 
+DSSP HELX_RH_3T_P 
+#
+_struct_ref.db_code                  FER1_SPIOL
+_struct_ref.db_name                  UNP
+_struct_ref.entity_id                1
+_struct_ref.id                       1
+_struct_ref.pdbx_align_begin         1
+_struct_ref.pdbx_align_end           147
+_struct_ref.pdbx_db_accession        P00221
+_struct_ref.pdbx_db_isoform          ?
+_struct_ref.pdbx_seq_one_letter_code 
+;MAATTTTMMGMATTFVPKPQAPPMMAALPSNTGRSLFGLKTGSRGGRMTMAAYKVTLVTPTGNVEFQCPDDVYILDAAEE
+EGIDLPYSCRAGSCSSCAGKLKTGSLNQDDQSFLDDDQIDEGWVLTCAAYPVSDVTIETHKEEELTA
+;
+#
+_struct_ref_seq.align_id                    1
+_struct_ref_seq.db_align_beg                1
+_struct_ref_seq.db_align_end                147
+_struct_ref_seq.pdbx_PDB_id_code            AF-P00221-F1
+_struct_ref_seq.pdbx_auth_seq_align_beg     1
+_struct_ref_seq.pdbx_auth_seq_align_end     147
+_struct_ref_seq.pdbx_db_accession           P00221
+_struct_ref_seq.pdbx_db_align_beg_ins_code  ?
+_struct_ref_seq.pdbx_db_align_end_ins_code  ?
+_struct_ref_seq.pdbx_seq_align_beg_ins_code ?
+_struct_ref_seq.pdbx_seq_align_end_ins_code ?
+_struct_ref_seq.pdbx_strand_id              A
+_struct_ref_seq.ref_id                      1
+_struct_ref_seq.seq_align_beg               1
+_struct_ref_seq.seq_align_end               147
+#
+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.pdbx_formal_charge
+_atom_site.auth_seq_id
+_atom_site.auth_comp_id
+_atom_site.auth_asym_id
+_atom_site.auth_atom_id
+_atom_site.pdbx_PDB_model_num
+_atom_site.pdbx_sifts_xref_db_acc
+_atom_site.pdbx_sifts_xref_db_name
+_atom_site.pdbx_sifts_xref_db_num
+_atom_site.pdbx_sifts_xref_db_res
+ATOM 1    N N   . MET A 1 1   ? -39.014 9.370   -46.392 1.0 56.42 ? 1   MET A N   1 P00221 UNP 1   M 
+ATOM 2    C CA  . MET A 1 1   ? -38.101 9.939   -47.404 1.0 56.42 ? 1   MET A CA  1 P00221 UNP 1   M 
+ATOM 3    C C   . MET A 1 1   ? -37.586 11.272  -46.873 1.0 56.42 ? 1   MET A C   1 P00221 UNP 1   M 
+ATOM 4    C CB  . MET A 1 1   ? -38.814 10.144  -48.758 1.0 56.42 ? 1   MET A CB  1 P00221 UNP 1   M 
+ATOM 5    O O   . MET A 1 1   ? -38.287 12.259  -47.001 1.0 56.42 ? 1   MET A O   1 P00221 UNP 1   M 
+ATOM 6    C CG  . MET A 1 1   ? -39.336 8.853   -49.398 1.0 56.42 ? 1   MET A CG  1 P00221 UNP 1   M 
+ATOM 7    S SD  . MET A 1 1   ? -40.197 9.160   -50.960 1.0 56.42 ? 1   MET A SD  1 P00221 UNP 1   M 
+ATOM 8    C CE  . MET A 1 1   ? -40.798 7.495   -51.352 1.0 56.42 ? 1   MET A CE  1 P00221 UNP 1   M 
+ATOM 9    N N   . ALA A 1 2   ? -36.441 11.282  -46.191 1.0 52.97 ? 2   ALA A N   1 P00221 UNP 2   A 
+ATOM 10   C CA  . ALA A 1 2   ? -35.633 12.474  -45.908 1.0 52.97 ? 2   ALA A CA  1 P00221 UNP 2   A 
+ATOM 11   C C   . ALA A 1 2   ? -34.298 11.969  -45.346 1.0 52.97 ? 2   ALA A C   1 P00221 UNP 2   A 
+ATOM 12   C CB  . ALA A 1 2   ? -36.323 13.418  -44.914 1.0 52.97 ? 2   ALA A CB  1 P00221 UNP 2   A 
+ATOM 13   O O   . ALA A 1 2   ? -34.277 11.276  -44.333 1.0 52.97 ? 2   ALA A O   1 P00221 UNP 2   A 
+ATOM 14   N N   . ALA A 1 3   ? -33.226 12.210  -46.094 1.0 60.41 ? 3   ALA A N   1 P00221 UNP 3   A 
+ATOM 15   C CA  . ALA A 1 3   ? -31.889 11.705  -45.836 1.0 60.41 ? 3   ALA A CA  1 P00221 UNP 3   A 
+ATOM 16   C C   . ALA A 1 3   ? -31.203 12.519  -44.731 1.0 60.41 ? 3   ALA A C   1 P00221 UNP 3   A 
+ATOM 17   C CB  . ALA A 1 3   ? -31.119 11.774  -47.162 1.0 60.41 ? 3   ALA A CB  1 P00221 UNP 3   A 
+ATOM 18   O O   . ALA A 1 3   ? -31.166 13.746  -44.800 1.0 60.41 ? 3   ALA A O   1 P00221 UNP 3   A 
+ATOM 19   N N   . THR A 1 4   ? -30.639 11.836  -43.738 1.0 75.74 ? 4   THR A N   1 P00221 UNP 4   T 
+ATOM 20   C CA  . THR A 1 4   ? -29.713 12.408  -42.759 1.0 75.74 ? 4   THR A CA  1 P00221 UNP 4   T 
+ATOM 21   C C   . THR A 1 4   ? -28.288 12.255  -43.286 1.0 75.74 ? 4   THR A C   1 P00221 UNP 4   T 
+ATOM 22   C CB  . THR A 1 4   ? -29.885 11.755  -41.378 1.0 75.74 ? 4   THR A CB  1 P00221 UNP 4   T 
+ATOM 23   O O   . THR A 1 4   ? -27.767 11.154  -43.439 1.0 75.74 ? 4   THR A O   1 P00221 UNP 4   T 
+ATOM 24   C CG2 . THR A 1 4   ? -31.086 12.351  -40.643 1.0 75.74 ? 4   THR A CG2 1 P00221 UNP 4   T 
+ATOM 25   O OG1 . THR A 1 4   ? -30.133 10.370  -41.494 1.0 75.74 ? 4   THR A OG1 1 P00221 UNP 4   T 
+ATOM 26   N N   . THR A 1 5   ? -27.675 13.384  -43.629 1.0 73.15 ? 5   THR A N   1 P00221 UNP 5   T 
+ATOM 27   C CA  . THR A 1 5   ? -26.292 13.499  -44.093 1.0 73.15 ? 5   THR A CA  1 P00221 UNP 5   T 
+ATOM 28   C C   . THR A 1 5   ? -25.312 13.322  -42.938 1.0 73.15 ? 5   THR A C   1 P00221 UNP 5   T 
+ATOM 29   C CB  . THR A 1 5   ? -26.068 14.866  -44.758 1.0 73.15 ? 5   THR A CB  1 P00221 UNP 5   T 
+ATOM 30   O O   . THR A 1 5   ? -25.357 14.052  -41.950 1.0 73.15 ? 5   THR A O   1 P00221 UNP 5   T 
+ATOM 31   C CG2 . THR A 1 5   ? -26.638 14.892  -46.177 1.0 73.15 ? 5   THR A CG2 1 P00221 UNP 5   T 
+ATOM 32   O OG1 . THR A 1 5   ? -26.727 15.872  -44.019 1.0 73.15 ? 5   THR A OG1 1 P00221 UNP 5   T 
+ATOM 33   N N   . THR A 1 6   ? -24.420 12.351  -43.099 1.0 67.00 ? 6   THR A N   1 P00221 UNP 6   T 
+ATOM 34   C CA  . THR A 1 6   ? -23.256 12.052  -42.263 1.0 67.00 ? 6   THR A CA  1 P00221 UNP 6   T 
+ATOM 35   C C   . THR A 1 6   ? -22.177 13.123  -42.448 1.0 67.00 ? 6   THR A C   1 P00221 UNP 6   T 
+ATOM 36   C CB  . THR A 1 6   ? -22.698 10.685  -42.709 1.0 67.00 ? 6   THR A CB  1 P00221 UNP 6   T 
+ATOM 37   O O   . THR A 1 6   ? -21.684 13.305  -43.560 1.0 67.00 ? 6   THR A O   1 P00221 UNP 6   T 
+ATOM 38   C CG2 . THR A 1 6   ? -21.659 10.094  -41.760 1.0 67.00 ? 6   THR A CG2 1 P00221 UNP 6   T 
+ATOM 39   O OG1 . THR A 1 6   ? -23.744 9.744   -42.826 1.0 67.00 ? 6   THR A OG1 1 P00221 UNP 6   T 
+ATOM 40   N N   . THR A 1 7   ? -21.772 13.797  -41.371 1.0 68.61 ? 7   THR A N   1 P00221 UNP 7   T 
+ATOM 41   C CA  . THR A 1 7   ? -20.586 14.668  -41.358 1.0 68.61 ? 7   THR A CA  1 P00221 UNP 7   T 
+ATOM 42   C C   . THR A 1 7   ? -19.461 13.943  -40.633 1.0 68.61 ? 7   THR A C   1 P00221 UNP 7   T 
+ATOM 43   C CB  . THR A 1 7   ? -20.860 16.037  -40.714 1.0 68.61 ? 7   THR A CB  1 P00221 UNP 7   T 
+ATOM 44   O O   . THR A 1 7   ? -19.570 13.644  -39.447 1.0 68.61 ? 7   THR A O   1 P00221 UNP 7   T 
+ATOM 45   C CG2 . THR A 1 7   ? -19.727 17.030  -40.983 1.0 68.61 ? 7   THR A CG2 1 P00221 UNP 7   T 
+ATOM 46   O OG1 . THR A 1 7   ? -22.024 16.606  -41.266 1.0 68.61 ? 7   THR A OG1 1 P00221 UNP 7   T 
+ATOM 47   N N   . MET A 1 8   ? -18.394 13.636  -41.369 1.0 67.08 ? 8   MET A N   1 P00221 UNP 8   M 
+ATOM 48   C CA  . MET A 1 8   ? -17.144 13.096  -40.846 1.0 67.08 ? 8   MET A CA  1 P00221 UNP 8   M 
+ATOM 49   C C   . MET A 1 8   ? -16.195 14.248  -40.479 1.0 67.08 ? 8   MET A C   1 P00221 UNP 8   M 
+ATOM 50   C CB  . MET A 1 8   ? -16.487 12.177  -41.894 1.0 67.08 ? 8   MET A CB  1 P00221 UNP 8   M 
+ATOM 51   O O   . MET A 1 8   ? -15.835 15.048  -41.336 1.0 67.08 ? 8   MET A O   1 P00221 UNP 8   M 
+ATOM 52   C CG  . MET A 1 8   ? -17.331 10.945  -42.243 1.0 67.08 ? 8   MET A CG  1 P00221 UNP 8   M 
+ATOM 53   S SD  . MET A 1 8   ? -16.394 9.671   -43.131 1.0 67.08 ? 8   MET A SD  1 P00221 UNP 8   M 
+ATOM 54   C CE  . MET A 1 8   ? -17.646 8.366   -43.244 1.0 67.08 ? 8   MET A CE  1 P00221 UNP 8   M 
+ATOM 55   N N   . MET A 1 9   ? -15.749 14.292  -39.227 1.0 67.60 ? 9   MET A N   1 P00221 UNP 9   M 
+ATOM 56   C CA  . MET A 1 9   ? -14.502 14.928  -38.780 1.0 67.60 ? 9   MET A CA  1 P00221 UNP 9   M 
+ATOM 57   C C   . MET A 1 9   ? -13.861 13.880  -37.856 1.0 67.60 ? 9   MET A C   1 P00221 UNP 9   M 
+ATOM 58   C CB  . MET A 1 9   ? -14.779 16.249  -38.030 1.0 67.60 ? 9   MET A CB  1 P00221 UNP 9   M 
+ATOM 59   O O   . MET A 1 9   ? -14.491 13.455  -36.899 1.0 67.60 ? 9   MET A O   1 P00221 UNP 9   M 
+ATOM 60   C CG  . MET A 1 9   ? -14.778 17.512  -38.909 1.0 67.60 ? 9   MET A CG  1 P00221 UNP 9   M 
+ATOM 61   S SD  . MET A 1 9   ? -16.392 18.248  -39.302 1.0 67.60 ? 9   MET A SD  1 P00221 UNP 9   M 
+ATOM 62   C CE  . MET A 1 9   ? -15.832 19.839  -39.972 1.0 67.60 ? 9   MET A CE  1 P00221 UNP 9   M 
+ATOM 63   N N   . GLY A 1 10  ? -12.709 13.281  -38.147 1.0 61.80 ? 10  GLY A N   1 P00221 UNP 10  G 
+ATOM 64   C CA  . GLY A 1 10  ? -11.450 13.942  -38.472 1.0 61.80 ? 10  GLY A CA  1 P00221 UNP 10  G 
+ATOM 65   C C   . GLY A 1 10  ? -10.628 14.061  -37.186 1.0 61.80 ? 10  GLY A C   1 P00221 UNP 10  G 
+ATOM 66   O O   . GLY A 1 10  ? -10.470 15.160  -36.672 1.0 61.80 ? 10  GLY A O   1 P00221 UNP 10  G 
+ATOM 67   N N   . MET A 1 11  ? -10.169 12.933  -36.630 1.0 68.90 ? 11  MET A N   1 P00221 UNP 11  M 
+ATOM 68   C CA  . MET A 1 11  ? -9.299  12.907  -35.449 1.0 68.90 ? 11  MET A CA  1 P00221 UNP 11  M 
+ATOM 69   C C   . MET A 1 11  ? -7.849  12.748  -35.907 1.0 68.90 ? 11  MET A C   1 P00221 UNP 11  M 
+ATOM 70   C CB  . MET A 1 11  ? -9.730  11.809  -34.464 1.0 68.90 ? 11  MET A CB  1 P00221 UNP 11  M 
+ATOM 71   O O   . MET A 1 11  ? -7.453  11.704  -36.420 1.0 68.90 ? 11  MET A O   1 P00221 UNP 11  M 
+ATOM 72   C CG  . MET A 1 11  ? -11.105 12.118  -33.862 1.0 68.90 ? 11  MET A CG  1 P00221 UNP 11  M 
+ATOM 73   S SD  . MET A 1 11  ? -11.617 10.959  -32.571 1.0 68.90 ? 11  MET A SD  1 P00221 UNP 11  M 
+ATOM 74   C CE  . MET A 1 11  ? -13.085 11.820  -31.949 1.0 68.90 ? 11  MET A CE  1 P00221 UNP 11  M 
+ATOM 75   N N   . ALA A 1 12  ? -7.081  13.827  -35.776 1.0 61.95 ? 12  ALA A N   1 P00221 UNP 12  A 
+ATOM 76   C CA  . ALA A 1 12  ? -5.652  13.854  -36.038 1.0 61.95 ? 12  ALA A CA  1 P00221 UNP 12  A 
+ATOM 77   C C   . ALA A 1 12  ? -4.907  13.176  -34.879 1.0 61.95 ? 12  ALA A C   1 P00221 UNP 12  A 
+ATOM 78   C CB  . ALA A 1 12  ? -5.228  15.317  -36.228 1.0 61.95 ? 12  ALA A CB  1 P00221 UNP 12  A 
+ATOM 79   O O   . ALA A 1 12  ? -4.921  13.666  -33.754 1.0 61.95 ? 12  ALA A O   1 P00221 UNP 12  A 
+ATOM 80   N N   . THR A 1 13  ? -4.245  12.056  -35.156 1.0 68.99 ? 13  THR A N   1 P00221 UNP 13  T 
+ATOM 81   C CA  . THR A 1 13  ? -3.341  11.386  -34.216 1.0 68.99 ? 13  THR A CA  1 P00221 UNP 13  T 
+ATOM 82   C C   . THR A 1 13  ? -1.956  12.025  -34.298 1.0 68.99 ? 13  THR A C   1 P00221 UNP 13  T 
+ATOM 83   C CB  . THR A 1 13  ? -3.259  9.881   -34.519 1.0 68.99 ? 13  THR A CB  1 P00221 UNP 13  T 
+ATOM 84   O O   . THR A 1 13  ? -1.209  11.795  -35.252 1.0 68.99 ? 13  THR A O   1 P00221 UNP 13  T 
+ATOM 85   C CG2 . THR A 1 13  ? -4.580  9.169   -34.230 1.0 68.99 ? 13  THR A CG2 1 P00221 UNP 13  T 
+ATOM 86   O OG1 . THR A 1 13  ? -2.949  9.691   -35.883 1.0 68.99 ? 13  THR A OG1 1 P00221 UNP 13  T 
+ATOM 87   N N   . THR A 1 14  ? -1.594  12.836  -33.308 1.0 70.93 ? 14  THR A N   1 P00221 UNP 14  T 
+ATOM 88   C CA  . THR A 1 14  ? -0.216  13.297  -33.105 1.0 70.93 ? 14  THR A CA  1 P00221 UNP 14  T 
+ATOM 89   C C   . THR A 1 14  ? 0.611   12.185  -32.464 1.0 70.93 ? 14  THR A C   1 P00221 UNP 14  T 
+ATOM 90   C CB  . THR A 1 14  ? -0.162  14.578  -32.257 1.0 70.93 ? 14  THR A CB  1 P00221 UNP 14  T 
+ATOM 91   O O   . THR A 1 14  ? 0.535   11.946  -31.263 1.0 70.93 ? 14  THR A O   1 P00221 UNP 14  T 
+ATOM 92   C CG2 . THR A 1 14  ? -0.412  15.813  -33.121 1.0 70.93 ? 14  THR A CG2 1 P00221 UNP 14  T 
+ATOM 93   O OG1 . THR A 1 14  ? -1.151  14.557  -31.254 1.0 70.93 ? 14  THR A OG1 1 P00221 UNP 14  T 
+ATOM 94   N N   . PHE A 1 15  ? 1.408   11.510  -33.290 1.0 65.35 ? 15  PHE A N   1 P00221 UNP 15  F 
+ATOM 95   C CA  . PHE A 1 15  ? 2.501   10.634  -32.877 1.0 65.35 ? 15  PHE A CA  1 P00221 UNP 15  F 
+ATOM 96   C C   . PHE A 1 15  ? 3.608   11.463  -32.206 1.0 65.35 ? 15  PHE A C   1 P00221 UNP 15  F 
+ATOM 97   C CB  . PHE A 1 15  ? 3.057   9.914   -34.122 1.0 65.35 ? 15  PHE A CB  1 P00221 UNP 15  F 
+ATOM 98   O O   . PHE A 1 15  ? 4.233   12.301  -32.856 1.0 65.35 ? 15  PHE A O   1 P00221 UNP 15  F 
+ATOM 99   C CG  . PHE A 1 15  ? 2.510   8.521   -34.363 1.0 65.35 ? 15  PHE A CG  1 P00221 UNP 15  F 
+ATOM 100  C CD1 . PHE A 1 15  ? 3.308   7.404   -34.051 1.0 65.35 ? 15  PHE A CD1 1 P00221 UNP 15  F 
+ATOM 101  C CD2 . PHE A 1 15  ? 1.222   8.331   -34.900 1.0 65.35 ? 15  PHE A CD2 1 P00221 UNP 15  F 
+ATOM 102  C CE1 . PHE A 1 15  ? 2.824   6.103   -34.272 1.0 65.35 ? 15  PHE A CE1 1 P00221 UNP 15  F 
+ATOM 103  C CE2 . PHE A 1 15  ? 0.737   7.028   -35.118 1.0 65.35 ? 15  PHE A CE2 1 P00221 UNP 15  F 
+ATOM 104  C CZ  . PHE A 1 15  ? 1.538   5.915   -34.805 1.0 65.35 ? 15  PHE A CZ  1 P00221 UNP 15  F 
+ATOM 105  N N   . VAL A 1 16  ? 3.879   11.206  -30.924 1.0 69.16 ? 16  VAL A N   1 P00221 UNP 16  V 
+ATOM 106  C CA  . VAL A 1 16  ? 5.053   11.728  -30.209 1.0 69.16 ? 16  VAL A CA  1 P00221 UNP 16  V 
+ATOM 107  C C   . VAL A 1 16  ? 6.105   10.614  -30.129 1.0 69.16 ? 16  VAL A C   1 P00221 UNP 16  V 
+ATOM 108  C CB  . VAL A 1 16  ? 4.685   12.247  -28.804 1.0 69.16 ? 16  VAL A CB  1 P00221 UNP 16  V 
+ATOM 109  O O   . VAL A 1 16  ? 5.853   9.591   -29.492 1.0 69.16 ? 16  VAL A O   1 P00221 UNP 16  V 
+ATOM 110  C CG1 . VAL A 1 16  ? 5.923   12.780  -28.066 1.0 69.16 ? 16  VAL A CG1 1 P00221 UNP 16  V 
+ATOM 111  C CG2 . VAL A 1 16  ? 3.664   13.390  -28.891 1.0 69.16 ? 16  VAL A CG2 1 P00221 UNP 16  V 
+ATOM 112  N N   . PRO A 1 17  ? 7.283   10.760  -30.762 1.0 68.00 ? 17  PRO A N   1 P00221 UNP 17  P 
+ATOM 113  C CA  . PRO A 1 17  ? 8.367   9.795   -30.622 1.0 68.00 ? 17  PRO A CA  1 P00221 UNP 17  P 
+ATOM 114  C C   . PRO A 1 17  ? 9.140   10.019  -29.310 1.0 68.00 ? 17  PRO A C   1 P00221 UNP 17  P 
+ATOM 115  C CB  . PRO A 1 17  ? 9.225   9.974   -31.876 1.0 68.00 ? 17  PRO A CB  1 P00221 UNP 17  P 
+ATOM 116  O O   . PRO A 1 17  ? 9.602   11.122  -29.017 1.0 68.00 ? 17  PRO A O   1 P00221 UNP 17  P 
+ATOM 117  C CG  . PRO A 1 17  ? 9.023   11.444  -32.246 1.0 68.00 ? 17  PRO A CG  1 P00221 UNP 17  P 
+ATOM 118  C CD  . PRO A 1 17  ? 7.616   11.776  -31.748 1.0 68.00 ? 17  PRO A CD  1 P00221 UNP 17  P 
+ATOM 119  N N   . LYS A 1 18  ? 9.303   8.946   -28.527 1.0 66.26 ? 18  LYS A N   1 P00221 UNP 18  K 
+ATOM 120  C CA  . LYS A 1 18  ? 10.091  8.895   -27.284 1.0 66.26 ? 18  LYS A CA  1 P00221 UNP 18  K 
+ATOM 121  C C   . LYS A 1 18  ? 11.603  8.938   -27.597 1.0 66.26 ? 18  LYS A C   1 P00221 UNP 18  K 
+ATOM 122  C CB  . LYS A 1 18  ? 9.671   7.623   -26.519 1.0 66.26 ? 18  LYS A CB  1 P00221 UNP 18  K 
+ATOM 123  O O   . LYS A 1 18  ? 12.047  8.200   -28.480 1.0 66.26 ? 18  LYS A O   1 P00221 UNP 18  K 
+ATOM 124  C CG  . LYS A 1 18  ? 10.240  7.480   -25.097 1.0 66.26 ? 18  LYS A CG  1 P00221 UNP 18  K 
+ATOM 125  C CD  . LYS A 1 18  ? 9.583   6.288   -24.372 1.0 66.26 ? 18  LYS A CD  1 P00221 UNP 18  K 
+ATOM 126  C CE  . LYS A 1 18  ? 10.233  6.032   -23.003 1.0 66.26 ? 18  LYS A CE  1 P00221 UNP 18  K 
+ATOM 127  N NZ  . LYS A 1 18  ? 9.415   5.123   -22.151 1.0 66.26 ? 18  LYS A NZ  1 P00221 UNP 18  K 
+ATOM 128  N N   . PRO A 1 19  ? 12.415  9.751   -26.894 1.0 67.49 ? 19  PRO A N   1 P00221 UNP 19  P 
+ATOM 129  C CA  . PRO A 1 19  ? 13.861  9.796   -27.100 1.0 67.49 ? 19  PRO A CA  1 P00221 UNP 19  P 
+ATOM 130  C C   . PRO A 1 19  ? 14.553  8.556   -26.510 1.0 67.49 ? 19  PRO A C   1 P00221 UNP 19  P 
+ATOM 131  C CB  . PRO A 1 19  ? 14.326  11.109  -26.464 1.0 67.49 ? 19  PRO A CB  1 P00221 UNP 19  P 
+ATOM 132  O O   . PRO A 1 19  ? 14.304  8.164   -25.370 1.0 67.49 ? 19  PRO A O   1 P00221 UNP 19  P 
+ATOM 133  C CG  . PRO A 1 19  ? 13.292  11.364  -25.367 1.0 67.49 ? 19  PRO A CG  1 P00221 UNP 19  P 
+ATOM 134  C CD  . PRO A 1 19  ? 12.006  10.748  -25.916 1.0 67.49 ? 19  PRO A CD  1 P00221 UNP 19  P 
+ATOM 135  N N   . GLN A 1 20  ? 15.431  7.942   -27.305 1.0 60.48 ? 20  GLN A N   1 P00221 UNP 20  Q 
+ATOM 136  C CA  . GLN A 1 20  ? 16.304  6.832   -26.914 1.0 60.48 ? 20  GLN A CA  1 P00221 UNP 20  Q 
+ATOM 137  C C   . GLN A 1 20  ? 17.501  7.354   -26.101 1.0 60.48 ? 20  GLN A C   1 P00221 UNP 20  Q 
+ATOM 138  C CB  . GLN A 1 20  ? 16.795  6.101   -28.179 1.0 60.48 ? 20  GLN A CB  1 P00221 UNP 20  Q 
+ATOM 139  O O   . GLN A 1 20  ? 18.190  8.279   -26.531 1.0 60.48 ? 20  GLN A O   1 P00221 UNP 20  Q 
+ATOM 140  C CG  . GLN A 1 20  ? 15.684  5.314   -28.899 1.0 60.48 ? 20  GLN A CG  1 P00221 UNP 20  Q 
+ATOM 141  C CD  . GLN A 1 20  ? 16.153  4.671   -30.206 1.0 60.48 ? 20  GLN A CD  1 P00221 UNP 20  Q 
+ATOM 142  N NE2 . GLN A 1 20  ? 15.459  3.669   -30.698 1.0 60.48 ? 20  GLN A NE2 1 P00221 UNP 20  Q 
+ATOM 143  O OE1 . GLN A 1 20  ? 17.131  5.056   -30.823 1.0 60.48 ? 20  GLN A OE1 1 P00221 UNP 20  Q 
+ATOM 144  N N   . ALA A 1 21  ? 17.770  6.744   -24.944 1.0 63.79 ? 21  ALA A N   1 P00221 UNP 21  A 
+ATOM 145  C CA  . ALA A 1 21  ? 18.982  6.983   -24.163 1.0 63.79 ? 21  ALA A CA  1 P00221 UNP 21  A 
+ATOM 146  C C   . ALA A 1 21  ? 20.168  6.174   -24.736 1.0 63.79 ? 21  ALA A C   1 P00221 UNP 21  A 
+ATOM 147  C CB  . ALA A 1 21  ? 18.708  6.618   -22.698 1.0 63.79 ? 21  ALA A CB  1 P00221 UNP 21  A 
+ATOM 148  O O   . ALA A 1 21  ? 19.989  4.997   -25.060 1.0 63.79 ? 21  ALA A O   1 P00221 UNP 21  A 
+ATOM 149  N N   . PRO A 1 22  ? 21.377  6.755   -24.859 1.0 69.72 ? 22  PRO A N   1 P00221 UNP 22  P 
+ATOM 150  C CA  . PRO A 1 22  ? 22.566  6.021   -25.281 1.0 69.72 ? 22  PRO A CA  1 P00221 UNP 22  P 
+ATOM 151  C C   . PRO A 1 22  ? 23.206  5.223   -24.125 1.0 69.72 ? 22  PRO A C   1 P00221 UNP 22  P 
+ATOM 152  C CB  . PRO A 1 22  ? 23.510  7.080   -25.849 1.0 69.72 ? 22  PRO A CB  1 P00221 UNP 22  P 
+ATOM 153  O O   . PRO A 1 22  ? 23.093  5.618   -22.961 1.0 69.72 ? 22  PRO A O   1 P00221 UNP 22  P 
+ATOM 154  C CG  . PRO A 1 22  ? 23.172  8.319   -25.020 1.0 69.72 ? 22  PRO A CG  1 P00221 UNP 22  P 
+ATOM 155  C CD  . PRO A 1 22  ? 21.677  8.173   -24.730 1.0 69.72 ? 22  PRO A CD  1 P00221 UNP 22  P 
+ATOM 156  N N   . PRO A 1 23  ? 23.908  4.114   -24.428 1.0 54.38 ? 23  PRO A N   1 P00221 UNP 23  P 
+ATOM 157  C CA  . PRO A 1 23  ? 24.531  3.259   -23.429 1.0 54.38 ? 23  PRO A CA  1 P00221 UNP 23  P 
+ATOM 158  C C   . PRO A 1 23  ? 25.875  3.820   -22.933 1.0 54.38 ? 23  PRO A C   1 P00221 UNP 23  P 
+ATOM 159  C CB  . PRO A 1 23  ? 24.677  1.898   -24.119 1.0 54.38 ? 23  PRO A CB  1 P00221 UNP 23  P 
+ATOM 160  O O   . PRO A 1 23  ? 26.640  4.425   -23.680 1.0 54.38 ? 23  PRO A O   1 P00221 UNP 23  P 
+ATOM 161  C CG  . PRO A 1 23  ? 24.928  2.278   -25.575 1.0 54.38 ? 23  PRO A CG  1 P00221 UNP 23  P 
+ATOM 162  C CD  . PRO A 1 23  ? 24.106  3.552   -25.758 1.0 54.38 ? 23  PRO A CD  1 P00221 UNP 23  P 
+ATOM 163  N N   . MET A 1 24  ? 26.130  3.557   -21.647 1.0 54.35 ? 24  MET A N   1 P00221 UNP 24  M 
+ATOM 164  C CA  . MET A 1 24  ? 27.420  3.347   -20.972 1.0 54.35 ? 24  MET A CA  1 P00221 UNP 24  M 
+ATOM 165  C C   . MET A 1 24  ? 28.663  3.269   -21.879 1.0 54.35 ? 24  MET A C   1 P00221 UNP 24  M 
+ATOM 166  C CB  . MET A 1 24  ? 27.288  2.023   -20.174 1.0 54.35 ? 24  MET A CB  1 P00221 UNP 24  M 
+ATOM 167  O O   . MET A 1 24  ? 28.665  2.495   -22.828 1.0 54.35 ? 24  MET A O   1 P00221 UNP 24  M 
+ATOM 168  C CG  . MET A 1 24  ? 26.918  0.804   -21.048 1.0 54.35 ? 24  MET A CG  1 P00221 UNP 24  M 
+ATOM 169  S SD  . MET A 1 24  ? 26.336  -0.675  -20.187 1.0 54.35 ? 24  MET A SD  1 P00221 UNP 24  M 
+ATOM 170  C CE  . MET A 1 24  ? 25.725  -1.615  -21.619 1.0 54.35 ? 24  MET A CE  1 P00221 UNP 24  M 
+ATOM 171  N N   . MET A 1 25  ? 29.736  3.994   -21.521 1.0 57.94 ? 25  MET A N   1 P00221 UNP 25  M 
+ATOM 172  C CA  . MET A 1 25  ? 31.137  3.522   -21.443 1.0 57.94 ? 25  MET A CA  1 P00221 UNP 25  M 
+ATOM 173  C C   . MET A 1 25  ? 32.107  4.684   -21.139 1.0 57.94 ? 25  MET A C   1 P00221 UNP 25  M 
+ATOM 174  C CB  . MET A 1 25  ? 31.622  2.799   -22.721 1.0 57.94 ? 25  MET A CB  1 P00221 UNP 25  M 
+ATOM 175  O O   . MET A 1 25  ? 32.029  5.750   -21.737 1.0 57.94 ? 25  MET A O   1 P00221 UNP 25  M 
+ATOM 176  C CG  . MET A 1 25  ? 31.249  1.303   -22.751 1.0 57.94 ? 25  MET A CG  1 P00221 UNP 25  M 
+ATOM 177  S SD  . MET A 1 25  ? 32.392  0.111   -22.025 1.0 57.94 ? 25  MET A SD  1 P00221 UNP 25  M 
+ATOM 178  C CE  . MET A 1 25  ? 31.287  -1.331  -22.097 1.0 57.94 ? 25  MET A CE  1 P00221 UNP 25  M 
+ATOM 179  N N   . ALA A 1 26  ? 33.075  4.375   -20.269 1.0 54.08 ? 26  ALA A N   1 P00221 UNP 26  A 
+ATOM 180  C CA  . ALA A 1 26  ? 34.419  4.952   -20.157 1.0 54.08 ? 26  ALA A CA  1 P00221 UNP 26  A 
+ATOM 181  C C   . ALA A 1 26  ? 34.587  6.408   -19.664 1.0 54.08 ? 26  ALA A C   1 P00221 UNP 26  A 
+ATOM 182  C CB  . ALA A 1 26  ? 35.161  4.695   -21.477 1.0 54.08 ? 26  ALA A CB  1 P00221 UNP 26  A 
+ATOM 183  O O   . ALA A 1 26  ? 34.390  7.367   -20.397 1.0 54.08 ? 26  ALA A O   1 P00221 UNP 26  A 
+ATOM 184  N N   . ALA A 1 27  ? 35.151  6.570   -18.462 1.0 53.27 ? 27  ALA A N   1 P00221 UNP 27  A 
+ATOM 185  C CA  . ALA A 1 27  ? 36.600  6.774   -18.296 1.0 53.27 ? 27  ALA A CA  1 P00221 UNP 27  A 
+ATOM 186  C C   . ALA A 1 27  ? 36.923  7.323   -16.892 1.0 53.27 ? 27  ALA A C   1 P00221 UNP 27  A 
+ATOM 187  C CB  . ALA A 1 27  ? 37.186  7.717   -19.361 1.0 53.27 ? 27  ALA A CB  1 P00221 UNP 27  A 
+ATOM 188  O O   . ALA A 1 27  ? 36.566  8.443   -16.539 1.0 53.27 ? 27  ALA A O   1 P00221 UNP 27  A 
+ATOM 189  N N   . LEU A 1 28  ? 37.655  6.530   -16.107 1.0 53.66 ? 28  LEU A N   1 P00221 UNP 28  L 
+ATOM 190  C CA  . LEU A 1 28  ? 38.425  7.000   -14.954 1.0 53.66 ? 28  LEU A CA  1 P00221 UNP 28  L 
+ATOM 191  C C   . LEU A 1 28  ? 39.713  7.659   -15.466 1.0 53.66 ? 28  LEU A C   1 P00221 UNP 28  L 
+ATOM 192  C CB  . LEU A 1 28  ? 38.781  5.786   -14.071 1.0 53.66 ? 28  LEU A CB  1 P00221 UNP 28  L 
+ATOM 193  O O   . LEU A 1 28  ? 40.328  7.138   -16.401 1.0 53.66 ? 28  LEU A O   1 P00221 UNP 28  L 
+ATOM 194  C CG  . LEU A 1 28  ? 37.589  5.186   -13.302 1.0 53.66 ? 28  LEU A CG  1 P00221 UNP 28  L 
+ATOM 195  C CD1 . LEU A 1 28  ? 37.835  3.706   -13.007 1.0 53.66 ? 28  LEU A CD1 1 P00221 UNP 28  L 
+ATOM 196  C CD2 . LEU A 1 28  ? 37.377  5.913   -11.974 1.0 53.66 ? 28  LEU A CD2 1 P00221 UNP 28  L 
+ATOM 197  N N   . PRO A 1 29  ? 40.194  8.715   -14.795 1.0 58.78 ? 29  PRO A N   1 P00221 UNP 29  P 
+ATOM 198  C CA  . PRO A 1 29  ? 41.602  8.685   -14.429 1.0 58.78 ? 29  PRO A CA  1 P00221 UNP 29  P 
+ATOM 199  C C   . PRO A 1 29  ? 41.873  9.128   -12.988 1.0 58.78 ? 29  PRO A C   1 P00221 UNP 29  P 
+ATOM 200  C CB  . PRO A 1 29  ? 42.333  9.560   -15.447 1.0 58.78 ? 29  PRO A CB  1 P00221 UNP 29  P 
+ATOM 201  O O   . PRO A 1 29  ? 41.378  10.136  -12.487 1.0 58.78 ? 29  PRO A O   1 P00221 UNP 29  P 
+ATOM 202  C CG  . PRO A 1 29  ? 41.267  10.542  -15.933 1.0 58.78 ? 29  PRO A CG  1 P00221 UNP 29  P 
+ATOM 203  C CD  . PRO A 1 29  ? 39.944  10.041  -15.343 1.0 58.78 ? 29  PRO A CD  1 P00221 UNP 29  P 
+ATOM 204  N N   . SER A 1 30  ? 42.752  8.344   -12.369 1.0 56.77 ? 30  SER A N   1 P00221 UNP 30  S 
+ATOM 205  C CA  . SER A 1 30  ? 43.668  8.691   -11.289 1.0 56.77 ? 30  SER A CA  1 P00221 UNP 30  S 
+ATOM 206  C C   . SER A 1 30  ? 44.260  10.093  -11.456 1.0 56.77 ? 30  SER A C   1 P00221 UNP 30  S 
+ATOM 207  C CB  . SER A 1 30  ? 44.853  7.710   -11.388 1.0 56.77 ? 30  SER A CB  1 P00221 UNP 30  S 
+ATOM 208  O O   . SER A 1 30  ? 44.618  10.444  -12.576 1.0 56.77 ? 30  SER A O   1 P00221 UNP 30  S 
+ATOM 209  O OG  . SER A 1 30  ? 44.410  6.372   -11.553 1.0 56.77 ? 30  SER A OG  1 P00221 UNP 30  S 
+ATOM 210  N N   . ASN A 1 31  ? 44.463  10.832  -10.357 1.0 63.36 ? 31  ASN A N   1 P00221 UNP 31  N 
+ATOM 211  C CA  . ASN A 1 31  ? 45.768  11.393  -9.957  1.0 63.36 ? 31  ASN A CA  1 P00221 UNP 31  N 
+ATOM 212  C C   . ASN A 1 31  ? 45.614  12.475  -8.859  1.0 63.36 ? 31  ASN A C   1 P00221 UNP 31  N 
+ATOM 213  C CB  . ASN A 1 31  ? 46.575  11.969  -11.150 1.0 63.36 ? 31  ASN A CB  1 P00221 UNP 31  N 
+ATOM 214  O O   . ASN A 1 31  ? 45.147  13.575  -9.115  1.0 63.36 ? 31  ASN A O   1 P00221 UNP 31  N 
+ATOM 215  C CG  . ASN A 1 31  ? 48.038  12.187  -10.869 1.0 63.36 ? 31  ASN A CG  1 P00221 UNP 31  N 
+ATOM 216  N ND2 . ASN A 1 31  ? 48.645  13.181  -11.465 1.0 63.36 ? 31  ASN A ND2 1 P00221 UNP 31  N 
+ATOM 217  O OD1 . ASN A 1 31  ? 48.677  11.424  -10.167 1.0 63.36 ? 31  ASN A OD1 1 P00221 UNP 31  N 
+ATOM 218  N N   . THR A 1 32  ? 46.108  12.141  -7.664  1.0 54.93 ? 32  THR A N   1 P00221 UNP 32  T 
+ATOM 219  C CA  . THR A 1 32  ? 47.033  12.944  -6.839  1.0 54.93 ? 32  THR A CA  1 P00221 UNP 32  T 
+ATOM 220  C C   . THR A 1 32  ? 46.662  14.357  -6.373  1.0 54.93 ? 32  THR A C   1 P00221 UNP 32  T 
+ATOM 221  C CB  . THR A 1 32  ? 48.407  12.958  -7.522  1.0 54.93 ? 32  THR A CB  1 P00221 UNP 32  T 
+ATOM 222  O O   . THR A 1 32  ? 46.634  15.313  -7.138  1.0 54.93 ? 32  THR A O   1 P00221 UNP 32  T 
+ATOM 223  C CG2 . THR A 1 32  ? 49.533  13.643  -6.754  1.0 54.93 ? 32  THR A CG2 1 P00221 UNP 32  T 
+ATOM 224  O OG1 . THR A 1 32  ? 48.804  11.616  -7.640  1.0 54.93 ? 32  THR A OG1 1 P00221 UNP 32  T 
+ATOM 225  N N   . GLY A 1 33  ? 46.630  14.511  -5.043  1.0 56.81 ? 33  GLY A N   1 P00221 UNP 33  G 
+ATOM 226  C CA  . GLY A 1 33  ? 46.861  15.785  -4.352  1.0 56.81 ? 33  GLY A CA  1 P00221 UNP 33  G 
+ATOM 227  C C   . GLY A 1 33  ? 46.065  15.890  -3.048  1.0 56.81 ? 33  GLY A C   1 P00221 UNP 33  G 
+ATOM 228  O O   . GLY A 1 33  ? 44.940  16.353  -3.052  1.0 56.81 ? 33  GLY A O   1 P00221 UNP 33  G 
+ATOM 229  N N   . ARG A 1 34  ? 46.548  15.344  -1.926  1.0 51.39 ? 34  ARG A N   1 P00221 UNP 34  R 
+ATOM 230  C CA  . ARG A 1 34  ? 47.347  16.091  -0.932  1.0 51.39 ? 34  ARG A CA  1 P00221 UNP 34  R 
+ATOM 231  C C   . ARG A 1 34  ? 46.556  17.221  -0.246  1.0 51.39 ? 34  ARG A C   1 P00221 UNP 34  R 
+ATOM 232  C CB  . ARG A 1 34  ? 48.669  16.563  -1.577  1.0 51.39 ? 34  ARG A CB  1 P00221 UNP 34  R 
+ATOM 233  O O   . ARG A 1 34  ? 46.625  18.359  -0.678  1.0 51.39 ? 34  ARG A O   1 P00221 UNP 34  R 
+ATOM 234  C CG  . ARG A 1 34  ? 49.687  17.235  -0.641  1.0 51.39 ? 34  ARG A CG  1 P00221 UNP 34  R 
+ATOM 235  C CD  . ARG A 1 34  ? 51.028  17.363  -1.388  1.0 51.39 ? 34  ARG A CD  1 P00221 UNP 34  R 
+ATOM 236  N NE  . ARG A 1 34  ? 51.769  18.586  -1.017  1.0 51.39 ? 34  ARG A NE  1 P00221 UNP 34  R 
+ATOM 237  N NH1 . ARG A 1 34  ? 52.138  19.415  -3.144  1.0 51.39 ? 34  ARG A NH1 1 P00221 UNP 34  R 
+ATOM 238  N NH2 . ARG A 1 34  ? 52.886  20.539  -1.376  1.0 51.39 ? 34  ARG A NH2 1 P00221 UNP 34  R 
+ATOM 239  C CZ  . ARG A 1 34  ? 52.256  19.499  -1.846  1.0 51.39 ? 34  ARG A CZ  1 P00221 UNP 34  R 
+ATOM 240  N N   . SER A 1 35  ? 45.935  16.919  0.896   1.0 52.75 ? 35  SER A N   1 P00221 UNP 35  S 
+ATOM 241  C CA  . SER A 1 35  ? 46.165  17.685  2.132   1.0 52.75 ? 35  SER A CA  1 P00221 UNP 35  S 
+ATOM 242  C C   . SER A 1 35  ? 45.643  16.922  3.348   1.0 52.75 ? 35  SER A C   1 P00221 UNP 35  S 
+ATOM 243  C CB  . SER A 1 35  ? 45.559  19.093  2.142   1.0 52.75 ? 35  SER A CB  1 P00221 UNP 35  S 
+ATOM 244  O O   . SER A 1 35  ? 44.482  16.532  3.418   1.0 52.75 ? 35  SER A O   1 P00221 UNP 35  S 
+ATOM 245  O OG  . SER A 1 35  ? 46.184  19.813  3.193   1.0 52.75 ? 35  SER A OG  1 P00221 UNP 35  S 
+ATOM 246  N N   . LEU A 1 36  ? 46.551  16.717  4.298   1.0 54.39 ? 36  LEU A N   1 P00221 UNP 36  L 
+ATOM 247  C CA  . LEU A 1 36  ? 46.304  16.287  5.668   1.0 54.39 ? 36  LEU A CA  1 P00221 UNP 36  L 
+ATOM 248  C C   . LEU A 1 36  ? 45.699  17.458  6.468   1.0 54.39 ? 36  LEU A C   1 P00221 UNP 36  L 
+ATOM 249  C CB  . LEU A 1 36  ? 47.669  15.857  6.250   1.0 54.39 ? 36  LEU A CB  1 P00221 UNP 36  L 
+ATOM 250  O O   . LEU A 1 36  ? 45.882  18.612  6.085   1.0 54.39 ? 36  LEU A O   1 P00221 UNP 36  L 
+ATOM 251  C CG  . LEU A 1 36  ? 48.251  14.564  5.636   1.0 54.39 ? 36  LEU A CG  1 P00221 UNP 36  L 
+ATOM 252  C CD1 . LEU A 1 36  ? 49.779  14.610  5.598   1.0 54.39 ? 36  LEU A CD1 1 P00221 UNP 36  L 
+ATOM 253  C CD2 . LEU A 1 36  ? 47.826  13.347  6.457   1.0 54.39 ? 36  LEU A CD2 1 P00221 UNP 36  L 
+ATOM 254  N N   . PHE A 1 37  ? 45.088  17.134  7.612   1.0 44.45 ? 37  PHE A N   1 P00221 UNP 37  F 
+ATOM 255  C CA  . PHE A 1 37  ? 44.546  18.027  8.653   1.0 44.45 ? 37  PHE A CA  1 P00221 UNP 37  F 
+ATOM 256  C C   . PHE A 1 37  ? 43.172  18.655  8.386   1.0 44.45 ? 37  PHE A C   1 P00221 UNP 37  F 
+ATOM 257  C CB  . PHE A 1 37  ? 45.574  19.069  9.126   1.0 44.45 ? 37  PHE A CB  1 P00221 UNP 37  F 
+ATOM 258  O O   . PHE A 1 37  ? 43.037  19.649  7.684   1.0 44.45 ? 37  PHE A O   1 P00221 UNP 37  F 
+ATOM 259  C CG  . PHE A 1 37  ? 46.672  18.475  9.975   1.0 44.45 ? 37  PHE A CG  1 P00221 UNP 37  F 
+ATOM 260  C CD1 . PHE A 1 37  ? 46.537  18.487  11.374  1.0 44.45 ? 37  PHE A CD1 1 P00221 UNP 37  F 
+ATOM 261  C CD2 . PHE A 1 37  ? 47.807  17.891  9.383   1.0 44.45 ? 37  PHE A CD2 1 P00221 UNP 37  F 
+ATOM 262  C CE1 . PHE A 1 37  ? 47.529  17.909  12.182  1.0 44.45 ? 37  PHE A CE1 1 P00221 UNP 37  F 
+ATOM 263  C CE2 . PHE A 1 37  ? 48.793  17.299  10.191  1.0 44.45 ? 37  PHE A CE2 1 P00221 UNP 37  F 
+ATOM 264  C CZ  . PHE A 1 37  ? 48.654  17.310  11.590  1.0 44.45 ? 37  PHE A CZ  1 P00221 UNP 37  F 
+ATOM 265  N N   . GLY A 1 38  ? 42.148  18.114  9.055   1.0 51.45 ? 38  GLY A N   1 P00221 UNP 38  G 
+ATOM 266  C CA  . GLY A 1 38  ? 40.809  18.702  9.051   1.0 51.45 ? 38  GLY A CA  1 P00221 UNP 38  G 
+ATOM 267  C C   . GLY A 1 38  ? 39.759  17.914  9.827   1.0 51.45 ? 38  GLY A C   1 P00221 UNP 38  G 
+ATOM 268  O O   . GLY A 1 38  ? 38.642  17.756  9.355   1.0 51.45 ? 38  GLY A O   1 P00221 UNP 38  G 
+ATOM 269  N N   . LEU A 1 39  ? 40.101  17.397  11.010  1.0 53.14 ? 39  LEU A N   1 P00221 UNP 39  L 
+ATOM 270  C CA  . LEU A 1 39  ? 39.106  16.944  11.979  1.0 53.14 ? 39  LEU A CA  1 P00221 UNP 39  L 
+ATOM 271  C C   . LEU A 1 39  ? 38.278  18.162  12.408  1.0 53.14 ? 39  LEU A C   1 P00221 UNP 39  L 
+ATOM 272  C CB  . LEU A 1 39  ? 39.855  16.323  13.184  1.0 53.14 ? 39  LEU A CB  1 P00221 UNP 39  L 
+ATOM 273  O O   . LEU A 1 39  ? 38.760  18.950  13.219  1.0 53.14 ? 39  LEU A O   1 P00221 UNP 39  L 
+ATOM 274  C CG  . LEU A 1 39  ? 38.945  15.700  14.261  1.0 53.14 ? 39  LEU A CG  1 P00221 UNP 39  L 
+ATOM 275  C CD1 . LEU A 1 39  ? 38.463  14.317  13.825  1.0 53.14 ? 39  LEU A CD1 1 P00221 UNP 39  L 
+ATOM 276  C CD2 . LEU A 1 39  ? 39.703  15.548  15.581  1.0 53.14 ? 39  LEU A CD2 1 P00221 UNP 39  L 
+ATOM 277  N N   . LYS A 1 40  ? 37.055  18.331  11.893  1.0 55.15 ? 40  LYS A N   1 P00221 UNP 40  K 
+ATOM 278  C CA  . LYS A 1 40  ? 36.002  19.040  12.632  1.0 55.15 ? 40  LYS A CA  1 P00221 UNP 40  K 
+ATOM 279  C C   . LYS A 1 40  ? 34.601  18.850  12.045  1.0 55.15 ? 40  LYS A C   1 P00221 UNP 40  K 
+ATOM 280  C CB  . LYS A 1 40  ? 36.336  20.541  12.825  1.0 55.15 ? 40  LYS A CB  1 P00221 UNP 40  K 
+ATOM 281  O O   . LYS A 1 40  ? 34.255  19.392  11.007  1.0 55.15 ? 40  LYS A O   1 P00221 UNP 40  K 
+ATOM 282  C CG  . LYS A 1 40  ? 36.486  20.839  14.329  1.0 55.15 ? 40  LYS A CG  1 P00221 UNP 40  K 
+ATOM 283  C CD  . LYS A 1 40  ? 36.888  22.288  14.604  1.0 55.15 ? 40  LYS A CD  1 P00221 UNP 40  K 
+ATOM 284  C CE  . LYS A 1 40  ? 37.055  22.473  16.118  1.0 55.15 ? 40  LYS A CE  1 P00221 UNP 40  K 
+ATOM 285  N NZ  . LYS A 1 40  ? 36.893  23.892  16.514  1.0 55.15 ? 40  LYS A NZ  1 P00221 UNP 40  K 
+ATOM 286  N N   . THR A 1 41  ? 33.795  18.171  12.861  1.0 41.56 ? 41  THR A N   1 P00221 UNP 41  T 
+ATOM 287  C CA  . THR A 1 41  ? 32.403  18.503  13.207  1.0 41.56 ? 41  THR A CA  1 P00221 UNP 41  T 
+ATOM 288  C C   . THR A 1 41  ? 31.346  18.529  12.107  1.0 41.56 ? 41  THR A C   1 P00221 UNP 41  T 
+ATOM 289  C CB  . THR A 1 41  ? 32.314  19.804  14.033  1.0 41.56 ? 41  THR A CB  1 P00221 UNP 41  T 
+ATOM 290  O O   . THR A 1 41  ? 31.192  19.512  11.393  1.0 41.56 ? 41  THR A O   1 P00221 UNP 41  T 
+ATOM 291  C CG2 . THR A 1 41  ? 32.717  19.566  15.486  1.0 41.56 ? 41  THR A CG2 1 P00221 UNP 41  T 
+ATOM 292  O OG1 . THR A 1 41  ? 33.159  20.815  13.533  1.0 41.56 ? 41  THR A OG1 1 P00221 UNP 41  T 
+ATOM 293  N N   . GLY A 1 42  ? 30.462  17.530  12.182  1.0 47.00 ? 42  GLY A N   1 P00221 UNP 42  G 
+ATOM 294  C CA  . GLY A 1 42  ? 29.032  17.754  11.987  1.0 47.00 ? 42  GLY A CA  1 P00221 UNP 42  G 
+ATOM 295  C C   . GLY A 1 42  ? 28.445  17.043  10.783  1.0 47.00 ? 42  GLY A C   1 P00221 UNP 42  G 
+ATOM 296  O O   . GLY A 1 42  ? 28.078  17.695  9.811   1.0 47.00 ? 42  GLY A O   1 P00221 UNP 42  G 
+ATOM 297  N N   . SER A 1 43  ? 28.259  15.725  10.890  1.0 57.62 ? 43  SER A N   1 P00221 UNP 43  S 
+ATOM 298  C CA  . SER A 1 43  ? 27.234  15.042  10.101  1.0 57.62 ? 43  SER A CA  1 P00221 UNP 43  S 
+ATOM 299  C C   . SER A 1 43  ? 25.874  15.578  10.557  1.0 57.62 ? 43  SER A C   1 P00221 UNP 43  S 
+ATOM 300  C CB  . SER A 1 43  ? 27.340  13.519  10.262  1.0 57.62 ? 43  SER A CB  1 P00221 UNP 43  S 
+ATOM 301  O O   . SER A 1 43  ? 25.264  15.073  11.497  1.0 57.62 ? 43  SER A O   1 P00221 UNP 43  S 
+ATOM 302  O OG  . SER A 1 43  ? 26.536  12.901  9.284   1.0 57.62 ? 43  SER A OG  1 P00221 UNP 43  S 
+ATOM 303  N N   . ARG A 1 44  ? 25.433  16.692  9.964   1.0 48.74 ? 44  ARG A N   1 P00221 UNP 44  R 
+ATOM 304  C CA  . ARG A 1 44  ? 24.026  17.087  9.983   1.0 48.74 ? 44  ARG A CA  1 P00221 UNP 44  R 
+ATOM 305  C C   . ARG A 1 44  ? 23.314  16.088  9.082   1.0 48.74 ? 44  ARG A C   1 P00221 UNP 44  R 
+ATOM 306  C CB  . ARG A 1 44  ? 23.838  18.537  9.498   1.0 48.74 ? 44  ARG A CB  1 P00221 UNP 44  R 
+ATOM 307  O O   . ARG A 1 44  ? 23.161  16.338  7.893   1.0 48.74 ? 44  ARG A O   1 P00221 UNP 44  R 
+ATOM 308  C CG  . ARG A 1 44  ? 24.181  19.584  10.566  1.0 48.74 ? 44  ARG A CG  1 P00221 UNP 44  R 
+ATOM 309  C CD  . ARG A 1 44  ? 23.943  20.990  10.000  1.0 48.74 ? 44  ARG A CD  1 P00221 UNP 44  R 
+ATOM 310  N NE  . ARG A 1 44  ? 24.103  22.036  11.031  1.0 48.74 ? 44  ARG A NE  1 P00221 UNP 44  R 
+ATOM 311  N NH1 . ARG A 1 44  ? 24.420  23.811  9.606   1.0 48.74 ? 44  ARG A NH1 1 P00221 UNP 44  R 
+ATOM 312  N NH2 . ARG A 1 44  ? 24.371  24.163  11.808  1.0 48.74 ? 44  ARG A NH2 1 P00221 UNP 44  R 
+ATOM 313  C CZ  . ARG A 1 44  ? 24.298  23.326  10.811  1.0 48.74 ? 44  ARG A CZ  1 P00221 UNP 44  R 
+ATOM 314  N N   . GLY A 1 45  ? 22.942  14.941  9.651   1.0 54.92 ? 45  GLY A N   1 P00221 UNP 45  G 
+ATOM 315  C CA  . GLY A 1 45  ? 21.943  14.067  9.052   1.0 54.92 ? 45  GLY A CA  1 P00221 UNP 45  G 
+ATOM 316  C C   . GLY A 1 45  ? 20.707  14.916  8.788   1.0 54.92 ? 45  GLY A C   1 P00221 UNP 45  G 
+ATOM 317  O O   . GLY A 1 45  ? 20.055  15.372  9.729   1.0 54.92 ? 45  GLY A O   1 P00221 UNP 45  G 
+ATOM 318  N N   . GLY A 1 46  ? 20.470  15.234  7.517   1.0 56.22 ? 46  GLY A N   1 P00221 UNP 46  G 
+ATOM 319  C CA  . GLY A 1 46  ? 19.290  15.960  7.089   1.0 56.22 ? 46  GLY A CA  1 P00221 UNP 46  G 
+ATOM 320  C C   . GLY A 1 46  ? 18.082  15.105  7.425   1.0 56.22 ? 46  GLY A C   1 P00221 UNP 46  G 
+ATOM 321  O O   . GLY A 1 46  ? 17.857  14.083  6.789   1.0 56.22 ? 46  GLY A O   1 P00221 UNP 46  G 
+ATOM 322  N N   . ARG A 1 47  ? 17.340  15.497  8.460   1.0 59.12 ? 47  ARG A N   1 P00221 UNP 47  R 
+ATOM 323  C CA  . ARG A 1 47  ? 15.985  15.004  8.686   1.0 59.12 ? 47  ARG A CA  1 P00221 UNP 47  R 
+ATOM 324  C C   . ARG A 1 47  ? 15.154  15.527  7.518   1.0 59.12 ? 47  ARG A C   1 P00221 UNP 47  R 
+ATOM 325  C CB  . ARG A 1 47  ? 15.463  15.511  10.043  1.0 59.12 ? 47  ARG A CB  1 P00221 UNP 47  R 
+ATOM 326  O O   . ARG A 1 47  ? 14.759  16.689  7.545   1.0 59.12 ? 47  ARG A O   1 P00221 UNP 47  R 
+ATOM 327  C CG  . ARG A 1 47  ? 16.134  14.809  11.232  1.0 59.12 ? 47  ARG A CG  1 P00221 UNP 47  R 
+ATOM 328  C CD  . ARG A 1 47  ? 15.638  15.409  12.554  1.0 59.12 ? 47  ARG A CD  1 P00221 UNP 47  R 
+ATOM 329  N NE  . ARG A 1 47  ? 15.842  14.475  13.678  1.0 59.12 ? 47  ARG A NE  1 P00221 UNP 47  R 
+ATOM 330  N NH1 . ARG A 1 47  ? 15.577  15.970  15.401  1.0 59.12 ? 47  ARG A NH1 1 P00221 UNP 47  R 
+ATOM 331  N NH2 . ARG A 1 47  ? 15.792  13.792  15.848  1.0 59.12 ? 47  ARG A NH2 1 P00221 UNP 47  R 
+ATOM 332  C CZ  . ARG A 1 47  ? 15.742  14.751  14.966  1.0 59.12 ? 47  ARG A CZ  1 P00221 UNP 47  R 
+ATOM 333  N N   . MET A 1 48  ? 14.995  14.716  6.472   1.0 61.00 ? 48  MET A N   1 P00221 UNP 48  M 
+ATOM 334  C CA  . MET A 1 48  ? 13.955  14.929  5.468   1.0 61.00 ? 48  MET A CA  1 P00221 UNP 48  M 
+ATOM 335  C C   . MET A 1 48  ? 12.645  14.935  6.259   1.0 61.00 ? 48  MET A C   1 P00221 UNP 48  M 
+ATOM 336  C CB  . MET A 1 48  ? 13.972  13.794  4.424   1.0 61.00 ? 48  MET A CB  1 P00221 UNP 48  M 
+ATOM 337  O O   . MET A 1 48  ? 12.292  13.938  6.883   1.0 61.00 ? 48  MET A O   1 P00221 UNP 48  M 
+ATOM 338  C CG  . MET A 1 48  ? 15.235  13.736  3.546   1.0 61.00 ? 48  MET A CG  1 P00221 UNP 48  M 
+ATOM 339  S SD  . MET A 1 48  ? 15.199  14.753  2.043   1.0 61.00 ? 48  MET A SD  1 P00221 UNP 48  M 
+ATOM 340  C CE  . MET A 1 48  ? 16.717  14.196  1.226   1.0 61.00 ? 48  MET A CE  1 P00221 UNP 48  M 
+ATOM 341  N N   . THR A 1 49  ? 12.020  16.099  6.400   1.0 59.24 ? 49  THR A N   1 P00221 UNP 49  T 
+ATOM 342  C CA  . THR A 1 49  ? 10.679  16.179  6.974   1.0 59.24 ? 49  THR A CA  1 P00221 UNP 49  T 
+ATOM 343  C C   . THR A 1 49  ? 9.741   15.592  5.931   1.0 59.24 ? 49  THR A C   1 P00221 UNP 49  T 
+ATOM 344  C CB  . THR A 1 49  ? 10.298  17.632  7.300   1.0 59.24 ? 49  THR A CB  1 P00221 UNP 49  T 
+ATOM 345  O O   . THR A 1 49  ? 9.546   16.231  4.899   1.0 59.24 ? 49  THR A O   1 P00221 UNP 49  T 
+ATOM 346  C CG2 . THR A 1 49  ? 11.093  18.174  8.491   1.0 59.24 ? 49  THR A CG2 1 P00221 UNP 49  T 
+ATOM 347  O OG1 . THR A 1 49  ? 10.578  18.472  6.202   1.0 59.24 ? 49  THR A OG1 1 P00221 UNP 49  T 
+ATOM 348  N N   . MET A 1 50  ? 9.240   14.383  6.175   1.0 79.45 ? 50  MET A N   1 P00221 UNP 50  M 
+ATOM 349  C CA  . MET A 1 50  ? 8.248   13.734  5.314   1.0 79.45 ? 50  MET A CA  1 P00221 UNP 50  M 
+ATOM 350  C C   . MET A 1 50  ? 6.986   14.593  5.291   1.0 79.45 ? 50  MET A C   1 P00221 UNP 50  M 
+ATOM 351  C CB  . MET A 1 50  ? 7.968   12.300  5.803   1.0 79.45 ? 50  MET A CB  1 P00221 UNP 50  M 
+ATOM 352  O O   . MET A 1 50  ? 6.570   15.102  6.342   1.0 79.45 ? 50  MET A O   1 P00221 UNP 50  M 
+ATOM 353  C CG  . MET A 1 50  ? 9.249   11.454  5.922   1.0 79.45 ? 50  MET A CG  1 P00221 UNP 50  M 
+ATOM 354  S SD  . MET A 1 50  ? 10.398  11.565  4.519   1.0 79.45 ? 50  MET A SD  1 P00221 UNP 50  M 
+ATOM 355  C CE  . MET A 1 50  ? 9.469   10.566  3.342   1.0 79.45 ? 50  MET A CE  1 P00221 UNP 50  M 
+ATOM 356  N N   . ALA A 1 51  ? 6.433   14.841  4.104   1.0 91.56 ? 51  ALA A N   1 P00221 UNP 51  A 
+ATOM 357  C CA  . ALA A 1 51  ? 5.160   15.536  4.012   1.0 91.56 ? 51  ALA A CA  1 P00221 UNP 51  A 
+ATOM 358  C C   . ALA A 1 51  ? 4.064   14.578  4.487   1.0 91.56 ? 51  ALA A C   1 P00221 UNP 51  A 
+ATOM 359  C CB  . ALA A 1 51  ? 4.934   16.057  2.588   1.0 91.56 ? 51  ALA A CB  1 P00221 UNP 51  A 
+ATOM 360  O O   . ALA A 1 51  ? 4.138   13.378  4.254   1.0 91.56 ? 51  ALA A O   1 P00221 UNP 51  A 
+ATOM 361  N N   . ALA A 1 52  ? 3.057   15.098  5.181   1.0 95.10 ? 52  ALA A N   1 P00221 UNP 52  A 
+ATOM 362  C CA  . ALA A 1 52  ? 1.871   14.329  5.528   1.0 95.10 ? 52  ALA A CA  1 P00221 UNP 52  A 
+ATOM 363  C C   . ALA A 1 52  ? 0.669   14.971  4.846   1.0 95.10 ? 52  ALA A C   1 P00221 UNP 52  A 
+ATOM 364  C CB  . ALA A 1 52  ? 1.720   14.232  7.050   1.0 95.10 ? 52  ALA A CB  1 P00221 UNP 52  A 
+ATOM 365  O O   . ALA A 1 52  ? 0.546   16.202  4.833   1.0 95.10 ? 52  ALA A O   1 P00221 UNP 52  A 
+ATOM 366  N N   . TYR A 1 53  ? -0.188  14.132  4.283   1.0 97.39 ? 53  TYR A N   1 P00221 UNP 53  Y 
+ATOM 367  C CA  . TYR A 1 53  ? -1.379  14.542  3.561   1.0 97.39 ? 53  TYR A CA  1 P00221 UNP 53  Y 
+ATOM 368  C C   . TYR A 1 53  ? -2.631  14.015  4.246   1.0 97.39 ? 53  TYR A C   1 P00221 UNP 53  Y 
+ATOM 369  C CB  . TYR A 1 53  ? -1.295  14.063  2.112   1.0 97.39 ? 53  TYR A CB  1 P00221 UNP 53  Y 
+ATOM 370  O O   . TYR A 1 53  ? -2.649  12.923  4.824   1.0 97.39 ? 53  TYR A O   1 P00221 UNP 53  Y 
+ATOM 371  C CG  . TYR A 1 53  ? -0.123  14.633  1.337   1.0 97.39 ? 53  TYR A CG  1 P00221 UNP 53  Y 
+ATOM 372  C CD1 . TYR A 1 53  ? -0.064  16.014  1.061   1.0 97.39 ? 53  TYR A CD1 1 P00221 UNP 53  Y 
+ATOM 373  C CD2 . TYR A 1 53  ? 0.915   13.789  0.904   1.0 97.39 ? 53  TYR A CD2 1 P00221 UNP 53  Y 
+ATOM 374  C CE1 . TYR A 1 53  ? 1.043   16.549  0.370   1.0 97.39 ? 53  TYR A CE1 1 P00221 UNP 53  Y 
+ATOM 375  C CE2 . TYR A 1 53  ? 2.005   14.315  0.189   1.0 97.39 ? 53  TYR A CE2 1 P00221 UNP 53  Y 
+ATOM 376  O OH  . TYR A 1 53  ? 3.177   16.206  -0.686  1.0 97.39 ? 53  TYR A OH  1 P00221 UNP 53  Y 
+ATOM 377  C CZ  . TYR A 1 53  ? 2.085   15.698  -0.057  1.0 97.39 ? 53  TYR A CZ  1 P00221 UNP 53  Y 
+ATOM 378  N N   . LYS A 1 54  ? -3.713  14.787  4.142   1.0 97.92 ? 54  LYS A N   1 P00221 UNP 54  K 
+ATOM 379  C CA  . LYS A 1 54  ? -5.016  14.377  4.650   1.0 97.92 ? 54  LYS A CA  1 P00221 UNP 54  K 
+ATOM 380  C C   . LYS A 1 54  ? -5.618  13.329  3.715   1.0 97.92 ? 54  LYS A C   1 P00221 UNP 54  K 
+ATOM 381  C CB  . LYS A 1 54  ? -5.909  15.611  4.825   1.0 97.92 ? 54  LYS A CB  1 P00221 UNP 54  K 
+ATOM 382  O O   . LYS A 1 54  ? -5.936  13.620  2.562   1.0 97.92 ? 54  LYS A O   1 P00221 UNP 54  K 
+ATOM 383  C CG  . LYS A 1 54  ? -7.288  15.203  5.350   1.0 97.92 ? 54  LYS A CG  1 P00221 UNP 54  K 
+ATOM 384  C CD  . LYS A 1 54  ? -8.208  16.406  5.570   1.0 97.92 ? 54  LYS A CD  1 P00221 UNP 54  K 
+ATOM 385  C CE  . LYS A 1 54  ? -9.594  15.814  5.820   1.0 97.92 ? 54  LYS A CE  1 P00221 UNP 54  K 
+ATOM 386  N NZ  . LYS A 1 54  ? -10.628 16.809  6.166   1.0 97.92 ? 54  LYS A NZ  1 P00221 UNP 54  K 
+ATOM 387  N N   . VAL A 1 55  ? -5.860  12.135  4.243   1.0 98.15 ? 55  VAL A N   1 P00221 UNP 55  V 
+ATOM 388  C CA  . VAL A 1 55  ? -6.557  11.056  3.540   1.0 98.15 ? 55  VAL A CA  1 P00221 UNP 55  V 
+ATOM 389  C C   . VAL A 1 55  ? -7.974  10.942  4.088   1.0 98.15 ? 55  VAL A C   1 P00221 UNP 55  V 
+ATOM 390  C CB  . VAL A 1 55  ? -5.793  9.728   3.658   1.0 98.15 ? 55  VAL A CB  1 P00221 UNP 55  V 
+ATOM 391  O O   . VAL A 1 55  ? -8.179  10.772  5.287   1.0 98.15 ? 55  VAL A O   1 P00221 UNP 55  V 
+ATOM 392  C CG1 . VAL A 1 55  ? -6.529  8.611   2.905   1.0 98.15 ? 55  VAL A CG1 1 P00221 UNP 55  V 
+ATOM 393  C CG2 . VAL A 1 55  ? -4.379  9.849   3.078   1.0 98.15 ? 55  VAL A CG2 1 P00221 UNP 55  V 
+ATOM 394  N N   . THR A 1 56  ? -8.963  11.042  3.201   1.0 98.06 ? 56  THR A N   1 P00221 UNP 56  T 
+ATOM 395  C CA  . THR A 1 56  ? -10.382 10.840  3.522   1.0 98.06 ? 56  THR A CA  1 P00221 UNP 56  T 
+ATOM 396  C C   . THR A 1 56  ? -10.857 9.534   2.899   1.0 98.06 ? 56  THR A C   1 P00221 UNP 56  T 
+ATOM 397  C CB  . THR A 1 56  ? -11.229 12.021  3.029   1.0 98.06 ? 56  THR A CB  1 P00221 UNP 56  T 
+ATOM 398  O O   . THR A 1 56  ? -10.897 9.411   1.675   1.0 98.06 ? 56  THR A O   1 P00221 UNP 56  T 
+ATOM 399  C CG2 . THR A 1 56  ? -12.694 11.910  3.457   1.0 98.06 ? 56  THR A CG2 1 P00221 UNP 56  T 
+ATOM 400  O OG1 . THR A 1 56  ? -10.691 13.223  3.538   1.0 98.06 ? 56  THR A OG1 1 P00221 UNP 56  T 
+ATOM 401  N N   . LEU A 1 57  ? -11.231 8.556   3.721   1.0 97.93 ? 57  LEU A N   1 P00221 UNP 57  L 
+ATOM 402  C CA  . LEU A 1 57  ? -11.762 7.276   3.261   1.0 97.93 ? 57  LEU A CA  1 P00221 UNP 57  L 
+ATOM 403  C C   . LEU A 1 57  ? -13.282 7.270   3.401   1.0 97.93 ? 57  LEU A C   1 P00221 UNP 57  L 
+ATOM 404  C CB  . LEU A 1 57  ? -11.137 6.102   4.023   1.0 97.93 ? 57  LEU A CB  1 P00221 UNP 57  L 
+ATOM 405  O O   . LEU A 1 57  ? -13.824 7.414   4.498   1.0 97.93 ? 57  LEU A O   1 P00221 UNP 57  L 
+ATOM 406  C CG  . LEU A 1 57  ? -9.604  6.057   4.017   1.0 97.93 ? 57  LEU A CG  1 P00221 UNP 57  L 
+ATOM 407  C CD1 . LEU A 1 57  ? -9.154  4.961   4.979   1.0 97.93 ? 57  LEU A CD1 1 P00221 UNP 57  L 
+ATOM 408  C CD2 . LEU A 1 57  ? -9.026  5.793   2.628   1.0 97.93 ? 57  LEU A CD2 1 P00221 UNP 57  L 
+ATOM 409  N N   . VAL A 1 58  ? -13.974 7.069   2.286   1.0 97.35 ? 58  VAL A N   1 P00221 UNP 58  V 
+ATOM 410  C CA  . VAL A 1 58  ? -15.422 6.854   2.250   1.0 97.35 ? 58  VAL A CA  1 P00221 UNP 58  V 
+ATOM 411  C C   . VAL A 1 58  ? -15.656 5.351   2.371   1.0 97.35 ? 58  VAL A C   1 P00221 UNP 58  V 
+ATOM 412  C CB  . VAL A 1 58  ? -16.030 7.460   0.973   1.0 97.35 ? 58  VAL A CB  1 P00221 UNP 58  V 
+ATOM 413  O O   . VAL A 1 58  ? -15.510 4.614   1.396   1.0 97.35 ? 58  VAL A O   1 P00221 UNP 58  V 
+ATOM 414  C CG1 . VAL A 1 58  ? -17.543 7.222   0.892   1.0 97.35 ? 58  VAL A CG1 1 P00221 UNP 58  V 
+ATOM 415  C CG2 . VAL A 1 58  ? -15.764 8.969   0.880   1.0 97.35 ? 58  VAL A CG2 1 P00221 UNP 58  V 
+ATOM 416  N N   . THR A 1 59  ? -15.952 4.893   3.589   1.0 95.76 ? 59  THR A N   1 P00221 UNP 59  T 
+ATOM 417  C CA  . THR A 1 59  ? -16.236 3.481   3.891   1.0 95.76 ? 59  THR A CA  1 P00221 UNP 59  T 
+ATOM 418  C C   . THR A 1 59  ? -17.751 3.230   3.931   1.0 95.76 ? 59  THR A C   1 P00221 UNP 59  T 
+ATOM 419  C CB  . THR A 1 59  ? -15.582 3.017   5.210   1.0 95.76 ? 59  THR A CB  1 P00221 UNP 59  T 
+ATOM 420  O O   . THR A 1 59  ? -18.518 4.176   4.129   1.0 95.76 ? 59  THR A O   1 P00221 UNP 59  T 
+ATOM 421  C CG2 . THR A 1 59  ? -14.139 3.486   5.406   1.0 95.76 ? 59  THR A CG2 1 P00221 UNP 59  T 
+ATOM 422  O OG1 . THR A 1 59  ? -16.328 3.444   6.325   1.0 95.76 ? 59  THR A OG1 1 P00221 UNP 59  T 
+ATOM 423  N N   . PRO A 1 60  ? -18.223 1.973   3.824   1.0 93.95 ? 60  PRO A N   1 P00221 UNP 60  P 
+ATOM 424  C CA  . PRO A 1 60  ? -19.646 1.644   3.973   1.0 93.95 ? 60  PRO A CA  1 P00221 UNP 60  P 
+ATOM 425  C C   . PRO A 1 60  ? -20.249 2.051   5.329   1.0 93.95 ? 60  PRO A C   1 P00221 UNP 60  P 
+ATOM 426  C CB  . PRO A 1 60  ? -19.727 0.125   3.778   1.0 93.95 ? 60  PRO A CB  1 P00221 UNP 60  P 
+ATOM 427  O O   . PRO A 1 60  ? -21.447 2.308   5.424   1.0 93.95 ? 60  PRO A O   1 P00221 UNP 60  P 
+ATOM 428  C CG  . PRO A 1 60  ? -18.502 -0.202  2.926   1.0 93.95 ? 60  PRO A CG  1 P00221 UNP 60  P 
+ATOM 429  C CD  . PRO A 1 60  ? -17.465 0.794   3.430   1.0 93.95 ? 60  PRO A CD  1 P00221 UNP 60  P 
+ATOM 430  N N   . THR A 1 61  ? -19.423 2.125   6.377   1.0 93.58 ? 61  THR A N   1 P00221 UNP 61  T 
+ATOM 431  C CA  . THR A 1 61  ? -19.835 2.493   7.744   1.0 93.58 ? 61  THR A CA  1 P00221 UNP 61  T 
+ATOM 432  C C   . THR A 1 61  ? -19.868 4.013   7.954   1.0 93.58 ? 61  THR A C   1 P00221 UNP 61  T 
+ATOM 433  C CB  . THR A 1 61  ? -18.892 1.824   8.760   1.0 93.58 ? 61  THR A CB  1 P00221 UNP 61  T 
+ATOM 434  O O   . THR A 1 61  ? -20.513 4.499   8.884   1.0 93.58 ? 61  THR A O   1 P00221 UNP 61  T 
+ATOM 435  C CG2 . THR A 1 61  ? -19.376 1.916   10.208  1.0 93.58 ? 61  THR A CG2 1 P00221 UNP 61  T 
+ATOM 436  O OG1 . THR A 1 61  ? -18.794 0.446   8.473   1.0 93.58 ? 61  THR A OG1 1 P00221 UNP 61  T 
+ATOM 437  N N   . GLY A 1 62  ? -19.193 4.778   7.094   1.0 94.71 ? 62  GLY A N   1 P00221 UNP 62  G 
+ATOM 438  C CA  . GLY A 1 62  ? -19.093 6.232   7.173   1.0 94.71 ? 62  GLY A CA  1 P00221 UNP 62  G 
+ATOM 439  C C   . GLY A 1 62  ? -17.763 6.772   6.649   1.0 94.71 ? 62  GLY A C   1 P00221 UNP 62  G 
+ATOM 440  O O   . GLY A 1 62  ? -16.882 6.026   6.217   1.0 94.71 ? 62  GLY A O   1 P00221 UNP 62  G 
+ATOM 441  N N   . ASN A 1 63  ? -17.609 8.092   6.708   1.0 96.32 ? 63  ASN A N   1 P00221 UNP 63  N 
+ATOM 442  C CA  . ASN A 1 63  ? -16.379 8.757   6.288   1.0 96.32 ? 63  ASN A CA  1 P00221 UNP 63  N 
+ATOM 443  C C   . ASN A 1 63  ? -15.406 8.851   7.463   1.0 96.32 ? 63  ASN A C   1 P00221 UNP 63  N 
+ATOM 444  C CB  . ASN A 1 63  ? -16.692 10.140  5.700   1.0 96.32 ? 63  ASN A CB  1 P00221 UNP 63  N 
+ATOM 445  O O   . ASN A 1 63  ? -15.789 9.303   8.544   1.0 96.32 ? 63  ASN A O   1 P00221 UNP 63  N 
+ATOM 446  C CG  . ASN A 1 63  ? -17.540 10.089  4.443   1.0 96.32 ? 63  ASN A CG  1 P00221 UNP 63  N 
+ATOM 447  N ND2 . ASN A 1 63  ? -17.931 11.230  3.930   1.0 96.32 ? 63  ASN A ND2 1 P00221 UNP 63  N 
+ATOM 448  O OD1 . ASN A 1 63  ? -17.876 9.053   3.900   1.0 96.32 ? 63  ASN A OD1 1 P00221 UNP 63  N 
+ATOM 449  N N   . VAL A 1 64  ? -14.155 8.471   7.230   1.0 96.72 ? 64  VAL A N   1 P00221 UNP 64  V 
+ATOM 450  C CA  . VAL A 1 64  ? -13.058 8.595   8.197   1.0 96.72 ? 64  VAL A CA  1 P00221 UNP 64  V 
+ATOM 451  C C   . VAL A 1 64  ? -11.926 9.410   7.586   1.0 96.72 ? 64  VAL A C   1 P00221 UNP 64  V 
+ATOM 452  C CB  . VAL A 1 64  ? -12.579 7.229   8.721   1.0 96.72 ? 64  VAL A CB  1 P00221 UNP 64  V 
+ATOM 453  O O   . VAL A 1 64  ? -11.695 9.368   6.379   1.0 96.72 ? 64  VAL A O   1 P00221 UNP 64  V 
+ATOM 454  C CG1 . VAL A 1 64  ? -13.699 6.502   9.475   1.0 96.72 ? 64  VAL A CG1 1 P00221 UNP 64  V 
+ATOM 455  C CG2 . VAL A 1 64  ? -12.073 6.308   7.614   1.0 96.72 ? 64  VAL A CG2 1 P00221 UNP 64  V 
+ATOM 456  N N   . GLU A 1 65  ? -11.240 10.184  8.417   1.0 97.27 ? 65  GLU A N   1 P00221 UNP 65  E 
+ATOM 457  C CA  . GLU A 1 65  ? -10.158 11.069  7.996   1.0 97.27 ? 65  GLU A CA  1 P00221 UNP 65  E 
+ATOM 458  C C   . GLU A 1 65  ? -8.942  10.836  8.885   1.0 97.27 ? 65  GLU A C   1 P00221 UNP 65  E 
+ATOM 459  C CB  . GLU A 1 65  ? -10.580 12.544  8.087   1.0 97.27 ? 65  GLU A CB  1 P00221 UNP 65  E 
+ATOM 460  O O   . GLU A 1 65  ? -9.082  10.760  10.105  1.0 97.27 ? 65  GLU A O   1 P00221 UNP 65  E 
+ATOM 461  C CG  . GLU A 1 65  ? -11.793 12.919  7.220   1.0 97.27 ? 65  GLU A CG  1 P00221 UNP 65  E 
+ATOM 462  C CD  . GLU A 1 65  ? -12.090 14.428  7.259   1.0 97.27 ? 65  GLU A CD  1 P00221 UNP 65  E 
+ATOM 463  O OE1 . GLU A 1 65  ? -12.737 14.962  6.328   1.0 97.27 ? 65  GLU A OE1 1 P00221 UNP 65  E 
+ATOM 464  O OE2 . GLU A 1 65  ? -11.555 15.162  8.124   1.0 97.27 ? 65  GLU A OE2 1 P00221 UNP 65  E 
+ATOM 465  N N   . PHE A 1 66  ? -7.760  10.764  8.282   1.0 97.26 ? 66  PHE A N   1 P00221 UNP 66  F 
+ATOM 466  C CA  . PHE A 1 66  ? -6.496  10.629  9.002   1.0 97.26 ? 66  PHE A CA  1 P00221 UNP 66  F 
+ATOM 467  C C   . PHE A 1 66  ? -5.343  11.282  8.228   1.0 97.26 ? 66  PHE A C   1 P00221 UNP 66  F 
+ATOM 468  C CB  . PHE A 1 66  ? -6.227  9.152   9.318   1.0 97.26 ? 66  PHE A CB  1 P00221 UNP 66  F 
+ATOM 469  O O   . PHE A 1 66  ? -5.514  11.745  7.096   1.0 97.26 ? 66  PHE A O   1 P00221 UNP 66  F 
+ATOM 470  C CG  . PHE A 1 66  ? -5.916  8.288   8.116   1.0 97.26 ? 66  PHE A CG  1 P00221 UNP 66  F 
+ATOM 471  C CD1 . PHE A 1 66  ? -6.950  7.869   7.260   1.0 97.26 ? 66  PHE A CD1 1 P00221 UNP 66  F 
+ATOM 472  C CD2 . PHE A 1 66  ? -4.589  7.912   7.842   1.0 97.26 ? 66  PHE A CD2 1 P00221 UNP 66  F 
+ATOM 473  C CE1 . PHE A 1 66  ? -6.648  7.086   6.138   1.0 97.26 ? 66  PHE A CE1 1 P00221 UNP 66  F 
+ATOM 474  C CE2 . PHE A 1 66  ? -4.301  7.123   6.719   1.0 97.26 ? 66  PHE A CE2 1 P00221 UNP 66  F 
+ATOM 475  C CZ  . PHE A 1 66  ? -5.329  6.696   5.873   1.0 97.26 ? 66  PHE A CZ  1 P00221 UNP 66  F 
+ATOM 476  N N   . GLN A 1 67  ? -4.179  11.379  8.868   1.0 97.06 ? 67  GLN A N   1 P00221 UNP 67  Q 
+ATOM 477  C CA  . GLN A 1 67  ? -2.956  11.909  8.265   1.0 97.06 ? 67  GLN A CA  1 P00221 UNP 67  Q 
+ATOM 478  C C   . GLN A 1 67  ? -2.069  10.753  7.812   1.0 97.06 ? 67  GLN A C   1 P00221 UNP 67  Q 
+ATOM 479  C CB  . GLN A 1 67  ? -2.216  12.791  9.282   1.0 97.06 ? 67  GLN A CB  1 P00221 UNP 67  Q 
+ATOM 480  O O   . GLN A 1 67  ? -1.722  9.900   8.621   1.0 97.06 ? 67  GLN A O   1 P00221 UNP 67  Q 
+ATOM 481  C CG  . GLN A 1 67  ? -2.870  14.168  9.471   1.0 97.06 ? 67  GLN A CG  1 P00221 UNP 67  Q 
+ATOM 482  C CD  . GLN A 1 67  ? -2.617  15.130  8.310   1.0 97.06 ? 67  GLN A CD  1 P00221 UNP 67  Q 
+ATOM 483  N NE2 . GLN A 1 67  ? -3.041  16.369  8.415   1.0 97.06 ? 67  GLN A NE2 1 P00221 UNP 67  Q 
+ATOM 484  O OE1 . GLN A 1 67  ? -2.023  14.822  7.296   1.0 97.06 ? 67  GLN A OE1 1 P00221 UNP 67  Q 
+ATOM 485  N N   . CYS A 1 68  ? -1.678  10.750  6.541   1.0 96.89 ? 68  CYS A N   1 P00221 UNP 68  C 
+ATOM 486  C CA  . CYS A 1 68  ? -0.785  9.744   5.979   1.0 96.89 ? 68  CYS A CA  1 P00221 UNP 68  C 
+ATOM 487  C C   . CYS A 1 68  ? 0.507   10.417  5.495   1.0 96.89 ? 68  CYS A C   1 P00221 UNP 68  C 
+ATOM 488  C CB  . CYS A 1 68  ? -1.514  9.024   4.848   1.0 96.89 ? 68  CYS A CB  1 P00221 UNP 68  C 
+ATOM 489  O O   . CYS A 1 68  ? 0.426   11.353  4.691   1.0 96.89 ? 68  CYS A O   1 P00221 UNP 68  C 
+ATOM 490  S SG  . CYS A 1 68  ? -0.529  7.626   4.233   1.0 96.89 ? 68  CYS A SG  1 P00221 UNP 68  C 
+ATOM 491  N N   . PRO A 1 69  ? 1.686   9.979   5.966   1.0 96.13 ? 69  PRO A N   1 P00221 UNP 69  P 
+ATOM 492  C CA  . PRO A 1 69  ? 2.965   10.376  5.385   1.0 96.13 ? 69  PRO A CA  1 P00221 UNP 69  P 
+ATOM 493  C C   . PRO A 1 69  ? 3.059   10.022  3.894   1.0 96.13 ? 69  PRO A C   1 P00221 UNP 69  P 
+ATOM 494  C CB  . PRO A 1 69  ? 4.031   9.646   6.202   1.0 96.13 ? 69  PRO A CB  1 P00221 UNP 69  P 
+ATOM 495  O O   . PRO A 1 69  ? 2.423   9.075   3.431   1.0 96.13 ? 69  PRO A O   1 P00221 UNP 69  P 
+ATOM 496  C CG  . PRO A 1 69  ? 3.341   9.355   7.533   1.0 96.13 ? 69  PRO A CG  1 P00221 UNP 69  P 
+ATOM 497  C CD  . PRO A 1 69  ? 1.900   9.098   7.105   1.0 96.13 ? 69  PRO A CD  1 P00221 UNP 69  P 
+ATOM 498  N N   . ASP A 1 70  ? 3.862   10.775  3.150   1.0 95.31 ? 70  ASP A N   1 P00221 UNP 70  D 
+ATOM 499  C CA  . ASP A 1 70  ? 4.097   10.590  1.715   1.0 95.31 ? 70  ASP A CA  1 P00221 UNP 70  D 
+ATOM 500  C C   . ASP A 1 70  ? 4.979   9.375   1.372   1.0 95.31 ? 70  ASP A C   1 P00221 UNP 70  D 
+ATOM 501  C CB  . ASP A 1 70  ? 4.626   11.908  1.117   1.0 95.31 ? 70  ASP A CB  1 P00221 UNP 70  D 
+ATOM 502  O O   . ASP A 1 70  ? 5.054   8.980   0.211   1.0 95.31 ? 70  ASP A O   1 P00221 UNP 70  D 
+ATOM 503  C CG  . ASP A 1 70  ? 5.987   12.427  1.615   1.0 95.31 ? 70  ASP A CG  1 P00221 UNP 70  D 
+ATOM 504  O OD1 . ASP A 1 70  ? 6.517   11.955  2.643   1.0 95.31 ? 70  ASP A OD1 1 P00221 UNP 70  D 
+ATOM 505  O OD2 . ASP A 1 70  ? 6.474   13.421  1.023   1.0 95.31 ? 70  ASP A OD2 1 P00221 UNP 70  D 
+ATOM 506  N N   . ASP A 1 71  ? 5.604   8.754   2.375   1.0 94.63 ? 71  ASP A N   1 P00221 UNP 71  D 
+ATOM 507  C CA  . ASP A 1 71  ? 6.423   7.538   2.284   1.0 94.63 ? 71  ASP A CA  1 P00221 UNP 71  D 
+ATOM 508  C C   . ASP A 1 71  ? 5.790   6.291   2.905   1.0 94.63 ? 71  ASP A C   1 P00221 UNP 71  D 
+ATOM 509  C CB  . ASP A 1 71  ? 7.794   7.794   2.915   1.0 94.63 ? 71  ASP A CB  1 P00221 UNP 71  D 
+ATOM 510  O O   . ASP A 1 71  ? 6.451   5.257   3.023   1.0 94.63 ? 71  ASP A O   1 P00221 UNP 71  D 
+ATOM 511  C CG  . ASP A 1 71  ? 7.780   8.101   4.432   1.0 94.63 ? 71  ASP A CG  1 P00221 UNP 71  D 
+ATOM 512  O OD1 . ASP A 1 71  ? 6.756   8.595   4.958   1.0 94.63 ? 71  ASP A OD1 1 P00221 UNP 71  D 
+ATOM 513  O OD2 . ASP A 1 71  ? 8.850   7.917   5.064   1.0 94.63 ? 71  ASP A OD2 1 P00221 UNP 71  D 
+ATOM 514  N N   . VAL A 1 72  ? 4.521   6.368   3.303   1.0 96.39 ? 72  VAL A N   1 P00221 UNP 72  V 
+ATOM 515  C CA  . VAL A 1 72  ? 3.788   5.250   3.902   1.0 96.39 ? 72  VAL A CA  1 P00221 UNP 72  V 
+ATOM 516  C C   . VAL A 1 72  ? 2.587   4.904   3.030   1.0 96.39 ? 72  VAL A C   1 P00221 UNP 72  V 
+ATOM 517  C CB  . VAL A 1 72  ? 3.399   5.565   5.359   1.0 96.39 ? 72  VAL A CB  1 P00221 UNP 72  V 
+ATOM 518  O O   . VAL A 1 72  ? 1.912   5.785   2.494   1.0 96.39 ? 72  VAL A O   1 P00221 UNP 72  V 
+ATOM 519  C CG1 . VAL A 1 72  ? 2.631   4.412   6.015   1.0 96.39 ? 72  VAL A CG1 1 P00221 UNP 72  V 
+ATOM 520  C CG2 . VAL A 1 72  ? 4.644   5.803   6.226   1.0 96.39 ? 72  VAL A CG2 1 P00221 UNP 72  V 
+ATOM 521  N N   . TYR A 1 73  ? 2.308   3.608   2.885   1.0 97.16 ? 73  TYR A N   1 P00221 UNP 73  Y 
+ATOM 522  C CA  . TYR A 1 73  ? 1.112   3.164   2.183   1.0 97.16 ? 73  TYR A CA  1 P00221 UNP 73  Y 
+ATOM 523  C C   . TYR A 1 73  ? -0.148  3.576   2.939   1.0 97.16 ? 73  TYR A C   1 P00221 UNP 73  Y 
+ATOM 524  C CB  . TYR A 1 73  ? 1.123   1.648   1.976   1.0 97.16 ? 73  TYR A CB  1 P00221 UNP 73  Y 
+ATOM 525  O O   . TYR A 1 73  ? -0.243  3.427   4.158   1.0 97.16 ? 73  TYR A O   1 P00221 UNP 73  Y 
+ATOM 526  C CG  . TYR A 1 73  ? 2.229   1.135   1.080   1.0 97.16 ? 73  TYR A CG  1 P00221 UNP 73  Y 
+ATOM 527  C CD1 . TYR A 1 73  ? 2.374   1.637   -0.229  1.0 97.16 ? 73  TYR A CD1 1 P00221 UNP 73  Y 
+ATOM 528  C CD2 . TYR A 1 73  ? 3.085   0.120   1.546   1.0 97.16 ? 73  TYR A CD2 1 P00221 UNP 73  Y 
+ATOM 529  C CE1 . TYR A 1 73  ? 3.349   1.092   -1.083  1.0 97.16 ? 73  TYR A CE1 1 P00221 UNP 73  Y 
+ATOM 530  C CE2 . TYR A 1 73  ? 4.086   -0.398  0.707   1.0 97.16 ? 73  TYR A CE2 1 P00221 UNP 73  Y 
+ATOM 531  O OH  . TYR A 1 73  ? 5.159   -0.437  -1.427  1.0 97.16 ? 73  TYR A OH  1 P00221 UNP 73  Y 
+ATOM 532  C CZ  . TYR A 1 73  ? 4.211   0.083   -0.611  1.0 97.16 ? 73  TYR A CZ  1 P00221 UNP 73  Y 
+ATOM 533  N N   . ILE A 1 74  ? -1.162  4.016   2.196   1.0 97.32 ? 74  ILE A N   1 P00221 UNP 74  I 
+ATOM 534  C CA  . ILE A 1 74  ? -2.444  4.457   2.757   1.0 97.32 ? 74  ILE A CA  1 P00221 UNP 74  I 
+ATOM 535  C C   . ILE A 1 74  ? -3.081  3.376   3.644   1.0 97.32 ? 74  ILE A C   1 P00221 UNP 74  I 
+ATOM 536  C CB  . ILE A 1 74  ? -3.377  4.895   1.606   1.0 97.32 ? 74  ILE A CB  1 P00221 UNP 74  I 
+ATOM 537  O O   . ILE A 1 74  ? -3.637  3.709   4.688   1.0 97.32 ? 74  ILE A O   1 P00221 UNP 74  I 
+ATOM 538  C CG1 . ILE A 1 74  ? -2.829  6.201   0.985   1.0 97.32 ? 74  ILE A CG1 1 P00221 UNP 74  I 
+ATOM 539  C CG2 . ILE A 1 74  ? -4.829  5.089   2.081   1.0 97.32 ? 74  ILE A CG2 1 P00221 UNP 74  I 
+ATOM 540  C CD1 . ILE A 1 74  ? -3.557  6.658   -0.283  1.0 97.32 ? 74  ILE A CD1 1 P00221 UNP 74  I 
+ATOM 541  N N   . LEU A 1 75  ? -2.996  2.097   3.253   1.0 97.32 ? 75  LEU A N   1 P00221 UNP 75  L 
+ATOM 542  C CA  . LEU A 1 75  ? -3.491  0.988   4.074   1.0 97.32 ? 75  LEU A CA  1 P00221 UNP 75  L 
+ATOM 543  C C   . LEU A 1 75  ? -2.756  0.893   5.419   1.0 97.32 ? 75  LEU A C   1 P00221 UNP 75  L 
+ATOM 544  C CB  . LEU A 1 75  ? -3.370  -0.336  3.297   1.0 97.32 ? 75  LEU A CB  1 P00221 UNP 75  L 
+ATOM 545  O O   . LEU A 1 75  ? -3.410  0.764   6.448   1.0 97.32 ? 75  LEU A O   1 P00221 UNP 75  L 
+ATOM 546  C CG  . LEU A 1 75  ? -3.830  -1.569  4.103   1.0 97.32 ? 75  LEU A CG  1 P00221 UNP 75  L 
+ATOM 547  C CD1 . LEU A 1 75  ? -5.321  -1.507  4.427   1.0 97.32 ? 75  LEU A CD1 1 P00221 UNP 75  L 
+ATOM 548  C CD2 . LEU A 1 75  ? -3.589  -2.855  3.318   1.0 97.32 ? 75  LEU A CD2 1 P00221 UNP 75  L 
+ATOM 549  N N   . ASP A 1 76  ? -1.426  0.966   5.415   1.0 96.85 ? 76  ASP A N   1 P00221 UNP 76  D 
+ATOM 550  C CA  . ASP A 1 76  ? -0.616  0.805   6.626   1.0 96.85 ? 76  ASP A CA  1 P00221 UNP 76  D 
+ATOM 551  C C   . ASP A 1 76  ? -0.880  1.951   7.612   1.0 96.85 ? 76  ASP A C   1 P00221 UNP 76  D 
+ATOM 552  C CB  . ASP A 1 76  ? 0.879   0.737   6.259   1.0 96.85 ? 76  ASP A CB  1 P00221 UNP 76  D 
+ATOM 553  O O   . ASP A 1 76  ? -1.127  1.718   8.793   1.0 96.85 ? 76  ASP A O   1 P00221 UNP 76  D 
+ATOM 554  C CG  . ASP A 1 76  ? 1.297   -0.492  5.437   1.0 96.85 ? 76  ASP A CG  1 P00221 UNP 76  D 
+ATOM 555  O OD1 . ASP A 1 76  ? 0.500   -1.449  5.279   1.0 96.85 ? 76  ASP A OD1 1 P00221 UNP 76  D 
+ATOM 556  O OD2 . ASP A 1 76  ? 2.448   -0.496  4.954   1.0 96.85 ? 76  ASP A OD2 1 P00221 UNP 76  D 
+ATOM 557  N N   . ALA A 1 77  ? -0.930  3.189   7.113   1.0 97.02 ? 77  ALA A N   1 P00221 UNP 77  A 
+ATOM 558  C CA  . ALA A 1 77  ? -1.268  4.351   7.930   1.0 97.02 ? 77  ALA A CA  1 P00221 UNP 77  A 
+ATOM 559  C C   . ALA A 1 77  ? -2.718  4.300   8.459   1.0 97.02 ? 77  ALA A C   1 P00221 UNP 77  A 
+ATOM 560  C CB  . ALA A 1 77  ? -0.990  5.601   7.091   1.0 97.02 ? 77  ALA A CB  1 P00221 UNP 77  A 
+ATOM 561  O O   . ALA A 1 77  ? -2.984  4.738   9.576   1.0 97.02 ? 77  ALA A O   1 P00221 UNP 77  A 
+ATOM 562  N N   . ALA A 1 78  ? -3.660  3.734   7.697   1.0 96.98 ? 78  ALA A N   1 P00221 UNP 78  A 
+ATOM 563  C CA  . ALA A 1 78  ? -5.030  3.524   8.164   1.0 96.98 ? 78  ALA A CA  1 P00221 UNP 78  A 
+ATOM 564  C C   . ALA A 1 78  ? -5.096  2.479   9.296   1.0 96.98 ? 78  ALA A C   1 P00221 UNP 78  A 
+ATOM 565  C CB  . ALA A 1 78  ? -5.907  3.134   6.966   1.0 96.98 ? 78  ALA A CB  1 P00221 UNP 78  A 
+ATOM 566  O O   . ALA A 1 78  ? -5.784  2.704   10.294  1.0 96.98 ? 78  ALA A O   1 P00221 UNP 78  A 
+ATOM 567  N N   . GLU A 1 79  ? -4.355  1.370   9.179   1.0 96.34 ? 79  GLU A N   1 P00221 UNP 79  E 
+ATOM 568  C CA  . GLU A 1 79  ? -4.269  0.340   10.223  1.0 96.34 ? 79  GLU A CA  1 P00221 UNP 79  E 
+ATOM 569  C C   . GLU A 1 79  ? -3.676  0.893   11.530  1.0 96.34 ? 79  GLU A C   1 P00221 UNP 79  E 
+ATOM 570  C CB  . GLU A 1 79  ? -3.420  -0.861  9.754   1.0 96.34 ? 79  GLU A CB  1 P00221 UNP 79  E 
+ATOM 571  O O   . GLU A 1 79  ? -4.181  0.578   12.610  1.0 96.34 ? 79  GLU A O   1 P00221 UNP 79  E 
+ATOM 572  C CG  . GLU A 1 79  ? -4.108  -1.783  8.732   1.0 96.34 ? 79  GLU A CG  1 P00221 UNP 79  E 
+ATOM 573  C CD  . GLU A 1 79  ? -3.284  -3.051  8.418   1.0 96.34 ? 79  GLU A CD  1 P00221 UNP 79  E 
+ATOM 574  O OE1 . GLU A 1 79  ? -3.872  -4.098  8.069   1.0 96.34 ? 79  GLU A OE1 1 P00221 UNP 79  E 
+ATOM 575  O OE2 . GLU A 1 79  ? -2.032  -3.064  8.516   1.0 96.34 ? 79  GLU A OE2 1 P00221 UNP 79  E 
+ATOM 576  N N   . GLU A 1 80  ? -2.645  1.742   11.453  1.0 96.41 ? 80  GLU A N   1 P00221 UNP 80  E 
+ATOM 577  C CA  . GLU A 1 80  ? -2.038  2.387   12.630  1.0 96.41 ? 80  GLU A CA  1 P00221 UNP 80  E 
+ATOM 578  C C   . GLU A 1 80  ? -3.024  3.294   13.384  1.0 96.41 ? 80  GLU A C   1 P00221 UNP 80  E 
+ATOM 579  C CB  . GLU A 1 80  ? -0.792  3.193   12.224  1.0 96.41 ? 80  GLU A CB  1 P00221 UNP 80  E 
+ATOM 580  O O   . GLU A 1 80  ? -3.022  3.332   14.617  1.0 96.41 ? 80  GLU A O   1 P00221 UNP 80  E 
+ATOM 581  C CG  . GLU A 1 80  ? 0.406   2.289   11.887  1.0 96.41 ? 80  GLU A CG  1 P00221 UNP 80  E 
+ATOM 582  C CD  . GLU A 1 80  ? 1.729   3.052   11.682  1.0 96.41 ? 80  GLU A CD  1 P00221 UNP 80  E 
+ATOM 583  O OE1 . GLU A 1 80  ? 2.773   2.363   11.584  1.0 96.41 ? 80  GLU A OE1 1 P00221 UNP 80  E 
+ATOM 584  O OE2 . GLU A 1 80  ? 1.738   4.305   11.717  1.0 96.41 ? 80  GLU A OE2 1 P00221 UNP 80  E 
+ATOM 585  N N   . GLU A 1 81  ? -3.921  3.959   12.656  1.0 96.03 ? 81  GLU A N   1 P00221 UNP 81  E 
+ATOM 586  C CA  . GLU A 1 81  ? -4.999  4.785   13.211  1.0 96.03 ? 81  GLU A CA  1 P00221 UNP 81  E 
+ATOM 587  C C   . GLU A 1 81  ? -6.222  3.957   13.663  1.0 96.03 ? 81  GLU A C   1 P00221 UNP 81  E 
+ATOM 588  C CB  . GLU A 1 81  ? -5.372  5.865   12.183  1.0 96.03 ? 81  GLU A CB  1 P00221 UNP 81  E 
+ATOM 589  O O   . GLU A 1 81  ? -7.202  4.499   14.179  1.0 96.03 ? 81  GLU A O   1 P00221 UNP 81  E 
+ATOM 590  C CG  . GLU A 1 81  ? -4.228  6.871   11.949  1.0 96.03 ? 81  GLU A CG  1 P00221 UNP 81  E 
+ATOM 591  C CD  . GLU A 1 81  ? -3.940  7.779   13.159  1.0 96.03 ? 81  GLU A CD  1 P00221 UNP 81  E 
+ATOM 592  O OE1 . GLU A 1 81  ? -2.749  8.015   13.467  1.0 96.03 ? 81  GLU A OE1 1 P00221 UNP 81  E 
+ATOM 593  O OE2 . GLU A 1 81  ? -4.909  8.301   13.761  1.0 96.03 ? 81  GLU A OE2 1 P00221 UNP 81  E 
+ATOM 594  N N   . GLY A 1 82  ? -6.176  2.629   13.504  1.0 95.60 ? 82  GLY A N   1 P00221 UNP 82  G 
+ATOM 595  C CA  . GLY A 1 82  ? -7.244  1.709   13.898  1.0 95.60 ? 82  GLY A CA  1 P00221 UNP 82  G 
+ATOM 596  C C   . GLY A 1 82  ? -8.432  1.674   12.932  1.0 95.60 ? 82  GLY A C   1 P00221 UNP 82  G 
+ATOM 597  O O   . GLY A 1 82  ? -9.535  1.291   13.331  1.0 95.60 ? 82  GLY A O   1 P00221 UNP 82  G 
+ATOM 598  N N   . ILE A 1 83  ? -8.230  2.085   11.679  1.0 95.50 ? 83  ILE A N   1 P00221 UNP 83  I 
+ATOM 599  C CA  . ILE A 1 83  ? -9.231  2.035   10.612  1.0 95.50 ? 83  ILE A CA  1 P00221 UNP 83  I 
+ATOM 600  C C   . ILE A 1 83  ? -9.098  0.700   9.877   1.0 95.50 ? 83  ILE A C   1 P00221 UNP 83  I 
+ATOM 601  C CB  . ILE A 1 83  ? -9.074  3.233   9.652   1.0 95.50 ? 83  ILE A CB  1 P00221 UNP 83  I 
+ATOM 602  O O   . ILE A 1 83  ? -8.067  0.407   9.277   1.0 95.50 ? 83  ILE A O   1 P00221 UNP 83  I 
+ATOM 603  C CG1 . ILE A 1 83  ? -9.211  4.584   10.396  1.0 95.50 ? 83  ILE A CG1 1 P00221 UNP 83  I 
+ATOM 604  C CG2 . ILE A 1 83  ? -10.104 3.132   8.508   1.0 95.50 ? 83  ILE A CG2 1 P00221 UNP 83  I 
+ATOM 605  C CD1 . ILE A 1 83  ? -8.733  5.786   9.571   1.0 95.50 ? 83  ILE A CD1 1 P00221 UNP 83  I 
+ATOM 606  N N   . ASP A 1 84  ? -10.168 -0.092  9.890   1.0 94.24 ? 84  ASP A N   1 P00221 UNP 84  D 
+ATOM 607  C CA  . ASP A 1 84  ? -10.205 -1.381  9.200   1.0 94.24 ? 84  ASP A CA  1 P00221 UNP 84  D 
+ATOM 608  C C   . ASP A 1 84  ? -10.549 -1.202  7.713   1.0 94.24 ? 84  ASP A C   1 P00221 UNP 84  D 
+ATOM 609  C CB  . ASP A 1 84  ? -11.178 -2.321  9.928   1.0 94.24 ? 84  ASP A CB  1 P00221 UNP 84  D 
+ATOM 610  O O   . ASP A 1 84  ? -11.539 -0.552  7.355   1.0 94.24 ? 84  ASP A O   1 P00221 UNP 84  D 
+ATOM 611  C CG  . ASP A 1 84  ? -11.042 -3.785  9.495   1.0 94.24 ? 84  ASP A CG  1 P00221 UNP 84  D 
+ATOM 612  O OD1 . ASP A 1 84  ? -9.917  -4.187  9.126   1.0 94.24 ? 84  ASP A OD1 1 P00221 UNP 84  D 
+ATOM 613  O OD2 . ASP A 1 84  ? -12.060 -4.507  9.597   1.0 94.24 ? 84  ASP A OD2 1 P00221 UNP 84  D 
+ATOM 614  N N   . LEU A 1 85  ? -9.721  -1.779  6.844   1.0 95.31 ? 85  LEU A N   1 P00221 UNP 85  L 
+ATOM 615  C CA  . LEU A 1 85  ? -9.887  -1.774  5.393   1.0 95.31 ? 85  LEU A CA  1 P00221 UNP 85  L 
+ATOM 616  C C   . LEU A 1 85  ? -9.721  -3.190  4.843   1.0 95.31 ? 85  LEU A C   1 P00221 UNP 85  L 
+ATOM 617  C CB  . LEU A 1 85  ? -8.858  -0.835  4.736   1.0 95.31 ? 85  LEU A CB  1 P00221 UNP 85  L 
+ATOM 618  O O   . LEU A 1 85  ? -8.950  -3.975  5.389   1.0 95.31 ? 85  LEU A O   1 P00221 UNP 85  L 
+ATOM 619  C CG  . LEU A 1 85  ? -9.108  0.669   4.905   1.0 95.31 ? 85  LEU A CG  1 P00221 UNP 85  L 
+ATOM 620  C CD1 . LEU A 1 85  ? -8.027  1.422   4.120   1.0 95.31 ? 85  LEU A CD1 1 P00221 UNP 85  L 
+ATOM 621  C CD2 . LEU A 1 85  ? -10.483 1.074   4.361   1.0 95.31 ? 85  LEU A CD2 1 P00221 UNP 85  L 
+ATOM 622  N N   . PRO A 1 86  ? -10.389 -3.532  3.730   1.0 95.42 ? 86  PRO A N   1 P00221 UNP 86  P 
+ATOM 623  C CA  . PRO A 1 86  ? -10.244 -4.851  3.138   1.0 95.42 ? 86  PRO A CA  1 P00221 UNP 86  P 
+ATOM 624  C C   . PRO A 1 86  ? -8.841  -5.013  2.532   1.0 95.42 ? 86  PRO A C   1 P00221 UNP 86  P 
+ATOM 625  C CB  . PRO A 1 86  ? -11.374 -4.946  2.111   1.0 95.42 ? 86  PRO A CB  1 P00221 UNP 86  P 
+ATOM 626  O O   . PRO A 1 86  ? -8.372  -4.173  1.763   1.0 95.42 ? 86  PRO A O   1 P00221 UNP 86  P 
+ATOM 627  C CG  . PRO A 1 86  ? -11.584 -3.496  1.676   1.0 95.42 ? 86  PRO A CG  1 P00221 UNP 86  P 
+ATOM 628  C CD  . PRO A 1 86  ? -11.302 -2.709  2.954   1.0 95.42 ? 86  PRO A CD  1 P00221 UNP 86  P 
+ATOM 629  N N   . TYR A 1 87  ? -8.162  -6.112  2.867   1.0 95.33 ? 87  TYR A N   1 P00221 UNP 87  Y 
+ATOM 630  C CA  . TYR A 1 87  ? -6.882  -6.503  2.275   1.0 95.33 ? 87  TYR A CA  1 P00221 UNP 87  Y 
+ATOM 631  C C   . TYR A 1 87  ? -6.713  -8.026  2.268   1.0 95.33 ? 87  TYR A C   1 P00221 UNP 87  Y 
+ATOM 632  C CB  . TYR A 1 87  ? -5.712  -5.822  3.004   1.0 95.33 ? 87  TYR A CB  1 P00221 UNP 87  Y 
+ATOM 633  O O   . TYR A 1 87  ? -7.380  -8.757  2.997   1.0 95.33 ? 87  TYR A O   1 P00221 UNP 87  Y 
+ATOM 634  C CG  . TYR A 1 87  ? -5.512  -6.249  4.446   1.0 95.33 ? 87  TYR A CG  1 P00221 UNP 87  Y 
+ATOM 635  C CD1 . TYR A 1 87  ? -6.110  -5.500  5.471   1.0 95.33 ? 87  TYR A CD1 1 P00221 UNP 87  Y 
+ATOM 636  C CD2 . TYR A 1 87  ? -4.725  -7.375  4.771   1.0 95.33 ? 87  TYR A CD2 1 P00221 UNP 87  Y 
+ATOM 637  C CE1 . TYR A 1 87  ? -5.940  -5.864  6.816   1.0 95.33 ? 87  TYR A CE1 1 P00221 UNP 87  Y 
+ATOM 638  C CE2 . TYR A 1 87  ? -4.543  -7.740  6.121   1.0 95.33 ? 87  TYR A CE2 1 P00221 UNP 87  Y 
+ATOM 639  O OH  . TYR A 1 87  ? -4.908  -7.275  8.447   1.0 95.33 ? 87  TYR A OH  1 P00221 UNP 87  Y 
+ATOM 640  C CZ  . TYR A 1 87  ? -5.141  -6.975  7.145   1.0 95.33 ? 87  TYR A CZ  1 P00221 UNP 87  Y 
+ATOM 641  N N   . SER A 1 88  ? -5.795  -8.518  1.431   1.0 95.57 ? 88  SER A N   1 P00221 UNP 88  S 
+ATOM 642  C CA  . SER A 1 88  ? -5.434  -9.941  1.392   1.0 95.57 ? 88  SER A CA  1 P00221 UNP 88  S 
+ATOM 643  C C   . SER A 1 88  ? -3.943  -10.141 1.117   1.0 95.57 ? 88  SER A C   1 P00221 UNP 88  S 
+ATOM 644  C CB  . SER A 1 88  ? -6.310  -10.676 0.368   1.0 95.57 ? 88  SER A CB  1 P00221 UNP 88  S 
+ATOM 645  O O   . SER A 1 88  ? -3.199  -10.545 2.006   1.0 95.57 ? 88  SER A O   1 P00221 UNP 88  S 
+ATOM 646  O OG  . SER A 1 88  ? -6.017  -12.057 0.398   1.0 95.57 ? 88  SER A OG  1 P00221 UNP 88  S 
+ATOM 647  N N   . CYS A 1 89  ? -3.477  -9.800  -0.090  1.0 96.40 ? 89  CYS A N   1 P00221 UNP 89  C 
+ATOM 648  C CA  . CYS A 1 89  ? -2.105  -10.079 -0.525  1.0 96.40 ? 89  CYS A CA  1 P00221 UNP 89  C 
+ATOM 649  C C   . CYS A 1 89  ? -1.047  -9.091  0.003   1.0 96.40 ? 89  CYS A C   1 P00221 UNP 89  C 
+ATOM 650  C CB  . CYS A 1 89  ? -2.078  -10.126 -2.061  1.0 96.40 ? 89  CYS A CB  1 P00221 UNP 89  C 
+ATOM 651  O O   . CYS A 1 89  ? 0.110   -9.476  0.141   1.0 96.40 ? 89  CYS A O   1 P00221 UNP 89  C 
+ATOM 652  S SG  . CYS A 1 89  ? -2.555  -8.587  -2.908  1.0 96.40 ? 89  CYS A SG  1 P00221 UNP 89  C 
+ATOM 653  N N   . ARG A 1 90  ? -1.422  -7.821  0.245   1.0 94.02 ? 90  ARG A N   1 P00221 UNP 90  R 
+ATOM 654  C CA  . ARG A 1 90  ? -0.526  -6.698  0.627   1.0 94.02 ? 90  ARG A CA  1 P00221 UNP 90  R 
+ATOM 655  C C   . ARG A 1 90  ? 0.710   -6.514  -0.275  1.0 94.02 ? 90  ARG A C   1 P00221 UNP 90  R 
+ATOM 656  C CB  . ARG A 1 90  ? -0.131  -6.770  2.116   1.0 94.02 ? 90  ARG A CB  1 P00221 UNP 90  R 
+ATOM 657  O O   . ARG A 1 90  ? 1.730   -6.002  0.162   1.0 94.02 ? 90  ARG A O   1 P00221 UNP 90  R 
+ATOM 658  C CG  . ARG A 1 90  ? -1.330  -6.752  3.072   1.0 94.02 ? 90  ARG A CG  1 P00221 UNP 90  R 
+ATOM 659  C CD  . ARG A 1 90  ? -0.886  -6.724  4.543   1.0 94.02 ? 90  ARG A CD  1 P00221 UNP 90  R 
+ATOM 660  N NE  . ARG A 1 90  ? -0.436  -5.388  5.006   1.0 94.02 ? 90  ARG A NE  1 P00221 UNP 90  R 
+ATOM 661  N NH1 . ARG A 1 90  ? -1.367  -5.440  7.122   1.0 94.02 ? 90  ARG A NH1 1 P00221 UNP 90  R 
+ATOM 662  N NH2 . ARG A 1 90  ? -0.231  -3.687  6.539   1.0 94.02 ? 90  ARG A NH2 1 P00221 UNP 90  R 
+ATOM 663  C CZ  . ARG A 1 90  ? -0.662  -4.856  6.201   1.0 94.02 ? 90  ARG A CZ  1 P00221 UNP 90  R 
+ATOM 664  N N   . ALA A 1 91  ? 0.620   -6.942  -1.531  1.0 94.91 ? 91  ALA A N   1 P00221 UNP 91  A 
+ATOM 665  C CA  . ALA A 1 91  ? 1.715   -6.879  -2.502  1.0 94.91 ? 91  ALA A CA  1 P00221 UNP 91  A 
+ATOM 666  C C   . ALA A 1 91  ? 1.319   -6.138  -3.791  1.0 94.91 ? 91  ALA A C   1 P00221 UNP 91  A 
+ATOM 667  C CB  . ALA A 1 91  ? 2.198   -8.313  -2.759  1.0 94.91 ? 91  ALA A CB  1 P00221 UNP 91  A 
+ATOM 668  O O   . ALA A 1 91  ? 1.973   -6.305  -4.815  1.0 94.91 ? 91  ALA A O   1 P00221 UNP 91  A 
+ATOM 669  N N   . GLY A 1 92  ? 0.197   -5.405  -3.778  1.0 95.29 ? 92  GLY A N   1 P00221 UNP 92  G 
+ATOM 670  C CA  . GLY A 1 92  ? -0.312  -4.705  -4.964  1.0 95.29 ? 92  GLY A CA  1 P00221 UNP 92  G 
+ATOM 671  C C   . GLY A 1 92  ? -0.662  -5.630  -6.139  1.0 95.29 ? 92  GLY A C   1 P00221 UNP 92  G 
+ATOM 672  O O   . GLY A 1 92  ? -0.607  -5.203  -7.286  1.0 95.29 ? 92  GLY A O   1 P00221 UNP 92  G 
+ATOM 673  N N   . SER A 1 93  ? -0.968  -6.904  -5.875  1.0 95.82 ? 93  SER A N   1 P00221 UNP 93  S 
+ATOM 674  C CA  . SER A 1 93  ? -1.162  -7.949  -6.897  1.0 95.82 ? 93  SER A CA  1 P00221 UNP 93  S 
+ATOM 675  C C   . SER A 1 93  ? -2.557  -8.589  -6.878  1.0 95.82 ? 93  SER A C   1 P00221 UNP 93  S 
+ATOM 676  C CB  . SER A 1 93  ? -0.066  -9.004  -6.751  1.0 95.82 ? 93  SER A CB  1 P00221 UNP 93  S 
+ATOM 677  O O   . SER A 1 93  ? -2.790  -9.600  -7.539  1.0 95.82 ? 93  SER A O   1 P00221 UNP 93  S 
+ATOM 678  O OG  . SER A 1 93  ? -0.122  -9.627  -5.475  1.0 95.82 ? 93  SER A OG  1 P00221 UNP 93  S 
+ATOM 679  N N   . CYS A 1 94  ? -3.487  -8.025  -6.105  1.0 96.09 ? 94  CYS A N   1 P00221 UNP 94  C 
+ATOM 680  C CA  . CYS A 1 94  ? -4.852  -8.518  -5.947  1.0 96.09 ? 94  CYS A CA  1 P00221 UNP 94  C 
+ATOM 681  C C   . CYS A 1 94  ? -5.857  -7.358  -5.846  1.0 96.09 ? 94  CYS A C   1 P00221 UNP 94  C 
+ATOM 682  C CB  . CYS A 1 94  ? -4.925  -9.441  -4.715  1.0 96.09 ? 94  CYS A CB  1 P00221 UNP 94  C 
+ATOM 683  O O   . CYS A 1 94  ? -5.490  -6.248  -5.466  1.0 96.09 ? 94  CYS A O   1 P00221 UNP 94  C 
+ATOM 684  S SG  . CYS A 1 94  ? -4.602  -8.674  -3.091  1.0 96.09 ? 94  CYS A SG  1 P00221 UNP 94  C 
+ATOM 685  N N   . SER A 1 95  ? -7.134  -7.636  -6.121  1.0 94.83 ? 95  SER A N   1 P00221 UNP 95  S 
+ATOM 686  C CA  . SER A 1 95  ? -8.246  -6.672  -6.091  1.0 94.83 ? 95  SER A CA  1 P00221 UNP 95  S 
+ATOM 687  C C   . SER A 1 95  ? -8.809  -6.374  -4.699  1.0 94.83 ? 95  SER A C   1 P00221 UNP 95  S 
+ATOM 688  C CB  . SER A 1 95  ? -9.391  -7.203  -6.962  1.0 94.83 ? 95  SER A CB  1 P00221 UNP 95  S 
+ATOM 689  O O   . SER A 1 95  ? -9.620  -5.465  -4.558  1.0 94.83 ? 95  SER A O   1 P00221 UNP 95  S 
+ATOM 690  O OG  . SER A 1 95  ? -9.674  -8.556  -6.635  1.0 94.83 ? 95  SER A OG  1 P00221 UNP 95  S 
+ATOM 691  N N   . SER A 1 96  ? -8.403  -7.102  -3.656  1.0 96.73 ? 96  SER A N   1 P00221 UNP 96  S 
+ATOM 692  C CA  . SER A 1 96  ? -9.071  -7.016  -2.346  1.0 96.73 ? 96  SER A CA  1 P00221 UNP 96  S 
+ATOM 693  C C   . SER A 1 96  ? -8.940  -5.653  -1.669  1.0 96.73 ? 96  SER A C   1 P00221 UNP 96  S 
+ATOM 694  C CB  . SER A 1 96  ? -8.566  -8.115  -1.415  1.0 96.73 ? 96  SER A CB  1 P00221 UNP 96  S 
+ATOM 695  O O   . SER A 1 96  ? -9.832  -5.247  -0.934  1.0 96.73 ? 96  SER A O   1 P00221 UNP 96  S 
+ATOM 696  O OG  . SER A 1 96  ? -8.599  -9.362  -2.083  1.0 96.73 ? 96  SER A OG  1 P00221 UNP 96  S 
+ATOM 697  N N   . CYS A 1 97  ? -7.849  -4.928  -1.939  1.0 96.99 ? 97  CYS A N   1 P00221 UNP 97  C 
+ATOM 698  C CA  . CYS A 1 97  ? -7.617  -3.576  -1.423  1.0 96.99 ? 97  CYS A CA  1 P00221 UNP 97  C 
+ATOM 699  C C   . CYS A 1 97  ? -8.096  -2.475  -2.397  1.0 96.99 ? 97  CYS A C   1 P00221 UNP 97  C 
+ATOM 700  C CB  . CYS A 1 97  ? -6.152  -3.458  -0.943  1.0 96.99 ? 97  CYS A CB  1 P00221 UNP 97  C 
+ATOM 701  O O   . CYS A 1 97  ? -7.664  -1.325  -2.301  1.0 96.99 ? 97  CYS A O   1 P00221 UNP 97  C 
+ATOM 702  S SG  . CYS A 1 97  ? -4.885  -3.197  -2.230  1.0 96.99 ? 97  CYS A SG  1 P00221 UNP 97  C 
+ATOM 703  N N   . ALA A 1 98  ? -8.963  -2.818  -3.361  1.0 97.36 ? 98  ALA A N   1 P00221 UNP 98  A 
+ATOM 704  C CA  . ALA A 1 98  ? -9.425  -1.886  -4.382  1.0 97.36 ? 98  ALA A CA  1 P00221 UNP 98  A 
+ATOM 705  C C   . ALA A 1 98  ? -10.331 -0.784  -3.816  1.0 97.36 ? 98  ALA A C   1 P00221 UNP 98  A 
+ATOM 706  C CB  . ALA A 1 98  ? -10.109 -2.632  -5.533  1.0 97.36 ? 98  ALA A CB  1 P00221 UNP 98  A 
+ATOM 707  O O   . ALA A 1 98  ? -11.282 -1.016  -3.056  1.0 97.36 ? 98  ALA A O   1 P00221 UNP 98  A 
+ATOM 708  N N   . GLY A 1 99  ? -10.048 0.433   -4.263  1.0 97.46 ? 99  GLY A N   1 P00221 UNP 99  G 
+ATOM 709  C CA  . GLY A 1 99  ? -10.836 1.628   -4.033  1.0 97.46 ? 99  GLY A CA  1 P00221 UNP 99  G 
+ATOM 710  C C   . GLY A 1 99  ? -10.931 2.494   -5.286  1.0 97.46 ? 99  GLY A C   1 P00221 UNP 99  G 
+ATOM 711  O O   . GLY A 1 99  ? -10.322 2.208   -6.318  1.0 97.46 ? 99  GLY A O   1 P00221 UNP 99  G 
+ATOM 712  N N   . LYS A 1 100 ? -11.693 3.583   -5.179  1.0 97.48 ? 100 LYS A N   1 P00221 UNP 100 K 
+ATOM 713  C CA  . LYS A 1 100 ? -11.872 4.572   -6.243  1.0 97.48 ? 100 LYS A CA  1 P00221 UNP 100 K 
+ATOM 714  C C   . LYS A 1 100 ? -11.452 5.956   -5.767  1.0 97.48 ? 100 LYS A C   1 P00221 UNP 100 K 
+ATOM 715  C CB  . LYS A 1 100 ? -13.329 4.539   -6.736  1.0 97.48 ? 100 LYS A CB  1 P00221 UNP 100 K 
+ATOM 716  O O   . LYS A 1 100 ? -12.020 6.488   -4.813  1.0 97.48 ? 100 LYS A O   1 P00221 UNP 100 K 
+ATOM 717  C CG  . LYS A 1 100 ? -13.491 5.175   -8.122  1.0 97.48 ? 100 LYS A CG  1 P00221 UNP 100 K 
+ATOM 718  C CD  . LYS A 1 100 ? -13.015 4.215   -9.220  1.0 97.48 ? 100 LYS A CD  1 P00221 UNP 100 K 
+ATOM 719  C CE  . LYS A 1 100 ? -13.097 4.892   -10.581 1.0 97.48 ? 100 LYS A CE  1 P00221 UNP 100 K 
+ATOM 720  N NZ  . LYS A 1 100 ? -12.581 4.009   -11.651 1.0 97.48 ? 100 LYS A NZ  1 P00221 UNP 100 K 
+ATOM 721  N N   . LEU A 1 101 ? -10.480 6.555   -6.442  1.0 98.00 ? 101 LEU A N   1 P00221 UNP 101 L 
+ATOM 722  C CA  . LEU A 1 101 ? -10.034 7.917   -6.186  1.0 98.00 ? 101 LEU A CA  1 P00221 UNP 101 L 
+ATOM 723  C C   . LEU A 1 101 ? -11.112 8.913   -6.636  1.0 98.00 ? 101 LEU A C   1 P00221 UNP 101 L 
+ATOM 724  C CB  . LEU A 1 101 ? -8.694  8.134   -6.908  1.0 98.00 ? 101 LEU A CB  1 P00221 UNP 101 L 
+ATOM 725  O O   . LEU A 1 101 ? -11.552 8.899   -7.784  1.0 98.00 ? 101 LEU A O   1 P00221 UNP 101 L 
+ATOM 726  C CG  . LEU A 1 101 ? -8.023  9.486   -6.604  1.0 98.00 ? 101 LEU A CG  1 P00221 UNP 101 L 
+ATOM 727  C CD1 . LEU A 1 101 ? -7.683  9.622   -5.119  1.0 98.00 ? 101 LEU A CD1 1 P00221 UNP 101 L 
+ATOM 728  C CD2 . LEU A 1 101 ? -6.736  9.603   -7.417  1.0 98.00 ? 101 LEU A CD2 1 P00221 UNP 101 L 
+ATOM 729  N N   . LYS A 1 102 ? -11.550 9.788   -5.728  1.0 97.25 ? 102 LYS A N   1 P00221 UNP 102 K 
+ATOM 730  C CA  . LYS A 1 102 ? -12.512 10.864  -6.019  1.0 97.25 ? 102 LYS A CA  1 P00221 UNP 102 K 
+ATOM 731  C C   . LYS A 1 102 ? -11.840 12.201  -6.250  1.0 97.25 ? 102 LYS A C   1 P00221 UNP 102 K 
+ATOM 732  C CB  . LYS A 1 102 ? -13.526 11.002  -4.876  1.0 97.25 ? 102 LYS A CB  1 P00221 UNP 102 K 
+ATOM 733  O O   . LYS A 1 102 ? -12.257 12.950  -7.128  1.0 97.25 ? 102 LYS A O   1 P00221 UNP 102 K 
+ATOM 734  C CG  . LYS A 1 102 ? -14.434 9.786   -4.730  1.0 97.25 ? 102 LYS A CG  1 P00221 UNP 102 K 
+ATOM 735  C CD  . LYS A 1 102 ? -15.290 9.533   -5.983  1.0 97.25 ? 102 LYS A CD  1 P00221 UNP 102 K 
+ATOM 736  C CE  . LYS A 1 102 ? -16.151 8.365   -5.566  1.0 97.25 ? 102 LYS A CE  1 P00221 UNP 102 K 
+ATOM 737  N NZ  . LYS A 1 102 ? -17.104 7.824   -6.558  1.0 97.25 ? 102 LYS A NZ  1 P00221 UNP 102 K 
+ATOM 738  N N   . THR A 1 103 ? -10.846 12.521  -5.431  1.0 97.23 ? 103 THR A N   1 P00221 UNP 103 T 
+ATOM 739  C CA  . THR A 1 103 ? -10.115 13.788  -5.480  1.0 97.23 ? 103 THR A CA  1 P00221 UNP 103 T 
+ATOM 740  C C   . THR A 1 103 ? -8.674  13.581  -5.033  1.0 97.23 ? 103 THR A C   1 P00221 UNP 103 T 
+ATOM 741  C CB  . THR A 1 103 ? -10.760 14.876  -4.599  1.0 97.23 ? 103 THR A CB  1 P00221 UNP 103 T 
+ATOM 742  O O   . THR A 1 103 ? -8.389  12.680  -4.242  1.0 97.23 ? 103 THR A O   1 P00221 UNP 103 T 
+ATOM 743  C CG2 . THR A 1 103 ? -12.205 15.212  -4.970  1.0 97.23 ? 103 THR A CG2 1 P00221 UNP 103 T 
+ATOM 744  O OG1 . THR A 1 103 ? -10.772 14.484  -3.250  1.0 97.23 ? 103 THR A OG1 1 P00221 UNP 103 T 
+ATOM 745  N N   . GLY A 1 104 ? -7.786  14.450  -5.517  1.0 96.90 ? 104 GLY A N   1 P00221 UNP 104 G 
+ATOM 746  C CA  . GLY A 1 104 ? -6.362  14.432  -5.196  1.0 96.90 ? 104 GLY A CA  1 P00221 UNP 104 G 
+ATOM 747  C C   . GLY A 1 104 ? -5.527  13.596  -6.163  1.0 96.90 ? 104 GLY A C   1 P00221 UNP 104 G 
+ATOM 748  O O   . GLY A 1 104 ? -5.995  13.183  -7.224  1.0 96.90 ? 104 GLY A O   1 P00221 UNP 104 G 
+ATOM 749  N N   . SER A 1 105 ? -4.273  13.379  -5.785  1.0 96.43 ? 105 SER A N   1 P00221 UNP 105 S 
+ATOM 750  C CA  . SER A 1 105 ? -3.296  12.592  -6.526  1.0 96.43 ? 105 SER A CA  1 P00221 UNP 105 S 
+ATOM 751  C C   . SER A 1 105 ? -2.557  11.644  -5.589  1.0 96.43 ? 105 SER A C   1 P00221 UNP 105 S 
+ATOM 752  C CB  . SER A 1 105 ? -2.295  13.511  -7.229  1.0 96.43 ? 105 SER A CB  1 P00221 UNP 105 S 
+ATOM 753  O O   . SER A 1 105 ? -2.205  11.997  -4.463  1.0 96.43 ? 105 SER A O   1 P00221 UNP 105 S 
+ATOM 754  O OG  . SER A 1 105 ? -2.957  14.297  -8.205  1.0 96.43 ? 105 SER A OG  1 P00221 UNP 105 S 
+ATOM 755  N N   . LEU A 1 106 ? -2.292  10.442  -6.086  1.0 96.86 ? 106 LEU A N   1 P00221 UNP 106 L 
+ATOM 756  C CA  . LEU A 1 106 ? -1.520  9.412   -5.404  1.0 96.86 ? 106 LEU A CA  1 P00221 UNP 106 L 
+ATOM 757  C C   . LEU A 1 106 ? -0.552  8.757   -6.385  1.0 96.86 ? 106 LEU A C   1 P00221 UNP 106 L 
+ATOM 758  C CB  . LEU A 1 106 ? -2.467  8.422   -4.704  1.0 96.86 ? 106 LEU A CB  1 P00221 UNP 106 L 
+ATOM 759  O O   . LEU A 1 106 ? -0.781  8.781   -7.594  1.0 96.86 ? 106 LEU A O   1 P00221 UNP 106 L 
+ATOM 760  C CG  . LEU A 1 106 ? -3.499  7.707   -5.601  1.0 96.86 ? 106 LEU A CG  1 P00221 UNP 106 L 
+ATOM 761  C CD1 . LEU A 1 106 ? -2.954  6.439   -6.261  1.0 96.86 ? 106 LEU A CD1 1 P00221 UNP 106 L 
+ATOM 762  C CD2 . LEU A 1 106 ? -4.687  7.329   -4.721  1.0 96.86 ? 106 LEU A CD2 1 P00221 UNP 106 L 
+ATOM 763  N N   . ASN A 1 107 ? 0.526   8.195   -5.855  1.0 96.33 ? 107 ASN A N   1 P00221 UNP 107 N 
+ATOM 764  C CA  . ASN A 1 107 ? 1.431   7.322   -6.585  1.0 96.33 ? 107 ASN A CA  1 P00221 UNP 107 N 
+ATOM 765  C C   . ASN A 1 107 ? 1.070   5.875   -6.232  1.0 96.33 ? 107 ASN A C   1 P00221 UNP 107 N 
+ATOM 766  C CB  . ASN A 1 107 ? 2.887   7.696   -6.242  1.0 96.33 ? 107 ASN A CB  1 P00221 UNP 107 N 
+ATOM 767  O O   . ASN A 1 107 ? 0.990   5.544   -5.053  1.0 96.33 ? 107 ASN A O   1 P00221 UNP 107 N 
+ATOM 768  C CG  . ASN A 1 107 ? 3.876   6.848   -7.026  1.0 96.33 ? 107 ASN A CG  1 P00221 UNP 107 N 
+ATOM 769  N ND2 . ASN A 1 107 ? 4.879   7.421   -7.639  1.0 96.33 ? 107 ASN A ND2 1 P00221 UNP 107 N 
+ATOM 770  O OD1 . ASN A 1 107 ? 3.724   5.652   -7.147  1.0 96.33 ? 107 ASN A OD1 1 P00221 UNP 107 N 
+ATOM 771  N N   . GLN A 1 108 ? 0.851   5.033   -7.238  1.0 96.30 ? 108 GLN A N   1 P00221 UNP 108 Q 
+ATOM 772  C CA  . GLN A 1 108 ? 0.638   3.596   -7.060  1.0 96.30 ? 108 GLN A CA  1 P00221 UNP 108 Q 
+ATOM 773  C C   . GLN A 1 108 ? 1.542   2.769   -7.982  1.0 96.30 ? 108 GLN A C   1 P00221 UNP 108 Q 
+ATOM 774  C CB  . GLN A 1 108 ? -0.859  3.247   -7.159  1.0 96.30 ? 108 GLN A CB  1 P00221 UNP 108 Q 
+ATOM 775  O O   . GLN A 1 108 ? 1.148   1.707   -8.437  1.0 96.30 ? 108 GLN A O   1 P00221 UNP 108 Q 
+ATOM 776  C CG  . GLN A 1 108 ? -1.502  3.575   -8.521  1.0 96.30 ? 108 GLN A CG  1 P00221 UNP 108 Q 
+ATOM 777  C CD  . GLN A 1 108 ? -2.982  3.206   -8.556  1.0 96.30 ? 108 GLN A CD  1 P00221 UNP 108 Q 
+ATOM 778  N NE2 . GLN A 1 108 ? -3.791  3.933   -9.297  1.0 96.30 ? 108 GLN A NE2 1 P00221 UNP 108 Q 
+ATOM 779  O OE1 . GLN A 1 108 ? -3.439  2.281   -7.899  1.0 96.30 ? 108 GLN A OE1 1 P00221 UNP 108 Q 
+ATOM 780  N N   . ASP A 1 109 ? 2.751   3.249   -8.280  1.0 95.43 ? 109 ASP A N   1 P00221 UNP 109 D 
+ATOM 781  C CA  . ASP A 1 109 ? 3.690   2.600   -9.209  1.0 95.43 ? 109 ASP A CA  1 P00221 UNP 109 D 
+ATOM 782  C C   . ASP A 1 109 ? 4.161   1.215   -8.715  1.0 95.43 ? 109 ASP A C   1 P00221 UNP 109 D 
+ATOM 783  C CB  . ASP A 1 109 ? 4.913   3.512   -9.438  1.0 95.43 ? 109 ASP A CB  1 P00221 UNP 109 D 
+ATOM 784  O O   . ASP A 1 109 ? 4.617   0.395   -9.511  1.0 95.43 ? 109 ASP A O   1 P00221 UNP 109 D 
+ATOM 785  C CG  . ASP A 1 109 ? 4.617   4.854   -10.128 1.0 95.43 ? 109 ASP A CG  1 P00221 UNP 109 D 
+ATOM 786  O OD1 . ASP A 1 109 ? 3.605   4.956   -10.855 1.0 95.43 ? 109 ASP A OD1 1 P00221 UNP 109 D 
+ATOM 787  O OD2 . ASP A 1 109 ? 5.438   5.792   -9.950  1.0 95.43 ? 109 ASP A OD2 1 P00221 UNP 109 D 
+ATOM 788  N N   . ASP A 1 110 ? 4.030   0.942   -7.412  1.0 95.52 ? 110 ASP A N   1 P00221 UNP 110 D 
+ATOM 789  C CA  . ASP A 1 110 ? 4.407   -0.331  -6.780  1.0 95.52 ? 110 ASP A CA  1 P00221 UNP 110 D 
+ATOM 790  C C   . ASP A 1 110 ? 3.375   -1.455  -7.009  1.0 95.52 ? 110 ASP A C   1 P00221 UNP 110 D 
+ATOM 791  C CB  . ASP A 1 110 ? 4.657   -0.098  -5.274  1.0 95.52 ? 110 ASP A CB  1 P00221 UNP 110 D 
+ATOM 792  O O   . ASP A 1 110 ? 3.621   -2.619  -6.677  1.0 95.52 ? 110 ASP A O   1 P00221 UNP 110 D 
+ATOM 793  C CG  . ASP A 1 110 ? 5.966   0.649   -4.958  1.0 95.52 ? 110 ASP A CG  1 P00221 UNP 110 D 
+ATOM 794  O OD1 . ASP A 1 110 ? 6.852   0.728   -5.839  1.0 95.52 ? 110 ASP A OD1 1 P00221 UNP 110 D 
+ATOM 795  O OD2 . ASP A 1 110 ? 6.114   1.101   -3.799  1.0 95.52 ? 110 ASP A OD2 1 P00221 UNP 110 D 
+ATOM 796  N N   . GLN A 1 111 ? 2.209   -1.136  -7.576  1.0 95.77 ? 111 GLN A N   1 P00221 UNP 111 Q 
+ATOM 797  C CA  . GLN A 1 111 ? 1.164   -2.108  -7.889  1.0 95.77 ? 111 GLN A CA  1 P00221 UNP 111 Q 
+ATOM 798  C C   . GLN A 1 111 ? 1.426   -2.838  -9.223  1.0 95.77 ? 111 GLN A C   1 P00221 UNP 111 Q 
+ATOM 799  C CB  . GLN A 1 111 ? -0.197  -1.401  -7.809  1.0 95.77 ? 111 GLN A CB  1 P00221 UNP 111 Q 
+ATOM 800  O O   . GLN A 1 111 ? 2.146   -2.355  -10.092 1.0 95.77 ? 111 GLN A O   1 P00221 UNP 111 Q 
+ATOM 801  C CG  . GLN A 1 111 ? -0.557  -0.609  -9.080  1.0 95.77 ? 111 GLN A CG  1 P00221 UNP 111 Q 
+ATOM 802  C CD  . GLN A 1 111 ? -1.216  -1.439  -10.160 1.0 95.77 ? 111 GLN A CD  1 P00221 UNP 111 Q 
+ATOM 803  N NE2 . GLN A 1 111 ? -1.048  -1.083  -11.412 1.0 95.77 ? 111 GLN A NE2 1 P00221 UNP 111 Q 
+ATOM 804  O OE1 . GLN A 1 111 ? -1.871  -2.431  -9.882  1.0 95.77 ? 111 GLN A OE1 1 P00221 UNP 111 Q 
+ATOM 805  N N   . SER A 1 112 ? 0.819   -4.013  -9.414  1.0 95.91 ? 112 SER A N   1 P00221 UNP 112 S 
+ATOM 806  C CA  . SER A 1 112 ? 0.989   -4.844  -10.623 1.0 95.91 ? 112 SER A CA  1 P00221 UNP 112 S 
+ATOM 807  C C   . SER A 1 112 ? -0.301  -5.497  -11.139 1.0 95.91 ? 112 SER A C   1 P00221 UNP 112 S 
+ATOM 808  C CB  . SER A 1 112 ? 2.064   -5.908  -10.363 1.0 95.91 ? 112 SER A CB  1 P00221 UNP 112 S 
+ATOM 809  O O   . SER A 1 112 ? -0.243  -6.378  -11.997 1.0 95.91 ? 112 SER A O   1 P00221 UNP 112 S 
+ATOM 810  O OG  . SER A 1 112 ? 1.715   -6.728  -9.258  1.0 95.91 ? 112 SER A OG  1 P00221 UNP 112 S 
+ATOM 811  N N   . PHE A 1 113 ? -1.456  -5.108  -10.600 1.0 96.54 ? 113 PHE A N   1 P00221 UNP 113 F 
+ATOM 812  C CA  . PHE A 1 113 ? -2.754  -5.725  -10.874 1.0 96.54 ? 113 PHE A CA  1 P00221 UNP 113 F 
+ATOM 813  C C   . PHE A 1 113 ? -3.638  -4.888  -11.808 1.0 96.54 ? 113 PHE A C   1 P00221 UNP 113 F 
+ATOM 814  C CB  . PHE A 1 113 ? -3.449  -5.969  -9.533  1.0 96.54 ? 113 PHE A CB  1 P00221 UNP 113 F 
+ATOM 815  O O   . PHE A 1 113 ? -4.209  -5.446  -12.740 1.0 96.54 ? 113 PHE A O   1 P00221 UNP 113 F 
+ATOM 816  C CG  . PHE A 1 113 ? -4.826  -6.586  -9.647  1.0 96.54 ? 113 PHE A CG  1 P00221 UNP 113 F 
+ATOM 817  C CD1 . PHE A 1 113 ? -5.977  -5.778  -9.594  1.0 96.54 ? 113 PHE A CD1 1 P00221 UNP 113 F 
+ATOM 818  C CD2 . PHE A 1 113 ? -4.953  -7.970  -9.864  1.0 96.54 ? 113 PHE A CD2 1 P00221 UNP 113 F 
+ATOM 819  C CE1 . PHE A 1 113 ? -7.245  -6.353  -9.781  1.0 96.54 ? 113 PHE A CE1 1 P00221 UNP 113 F 
+ATOM 820  C CE2 . PHE A 1 113 ? -6.224  -8.544  -10.040 1.0 96.54 ? 113 PHE A CE2 1 P00221 UNP 113 F 
+ATOM 821  C CZ  . PHE A 1 113 ? -7.370  -7.734  -10.005 1.0 96.54 ? 113 PHE A CZ  1 P00221 UNP 113 F 
+ATOM 822  N N   . LEU A 1 114 ? -3.754  -3.582  -11.555 1.0 96.33 ? 114 LEU A N   1 P00221 UNP 114 L 
+ATOM 823  C CA  . LEU A 1 114 ? -4.530  -2.651  -12.371 1.0 96.33 ? 114 LEU A CA  1 P00221 UNP 114 L 
+ATOM 824  C C   . LEU A 1 114 ? -3.795  -2.350  -13.678 1.0 96.33 ? 114 LEU A C   1 P00221 UNP 114 L 
+ATOM 825  C CB  . LEU A 1 114 ? -4.811  -1.339  -11.609 1.0 96.33 ? 114 LEU A CB  1 P00221 UNP 114 L 
+ATOM 826  O O   . LEU A 1 114 ? -2.580  -2.128  -13.664 1.0 96.33 ? 114 LEU A O   1 P00221 UNP 114 L 
+ATOM 827  C CG  . LEU A 1 114 ? -5.566  -1.484  -10.278 1.0 96.33 ? 114 LEU A CG  1 P00221 UNP 114 L 
+ATOM 828  C CD1 . LEU A 1 114 ? -5.686  -0.117  -9.598  1.0 96.33 ? 114 LEU A CD1 1 P00221 UNP 114 L 
+ATOM 829  C CD2 . LEU A 1 114 ? -6.978  -2.038  -10.461 1.0 96.33 ? 114 LEU A CD2 1 P00221 UNP 114 L 
+ATOM 830  N N   . ASP A 1 115 ? -4.537  -2.316  -14.779 1.0 95.81 ? 115 ASP A N   1 P00221 UNP 115 D 
+ATOM 831  C CA  . ASP A 1 115 ? -4.045  -1.814  -16.062 1.0 95.81 ? 115 ASP A CA  1 P00221 UNP 115 D 
+ATOM 832  C C   . ASP A 1 115 ? -4.138  -0.277  -16.155 1.0 95.81 ? 115 ASP A C   1 P00221 UNP 115 D 
+ATOM 833  C CB  . ASP A 1 115 ? -4.740  -2.552  -17.222 1.0 95.81 ? 115 ASP A CB  1 P00221 UNP 115 D 
+ATOM 834  O O   . ASP A 1 115 ? -4.715  0.390   -15.292 1.0 95.81 ? 115 ASP A O   1 P00221 UNP 115 D 
+ATOM 835  C CG  . ASP A 1 115 ? -6.260  -2.373  -17.259 1.0 95.81 ? 115 ASP A CG  1 P00221 UNP 115 D 
+ATOM 836  O OD1 . ASP A 1 115 ? -6.710  -1.214  -17.147 1.0 95.81 ? 115 ASP A OD1 1 P00221 UNP 115 D 
+ATOM 837  O OD2 . ASP A 1 115 ? -6.958  -3.399  -17.427 1.0 95.81 ? 115 ASP A OD2 1 P00221 UNP 115 D 
+ATOM 838  N N   . ASP A 1 116 ? -3.526  0.293   -17.196 1.0 95.50 ? 116 ASP A N   1 P00221 UNP 116 D 
+ATOM 839  C CA  . ASP A 1 116 ? -3.459  1.746   -17.387 1.0 95.50 ? 116 ASP A CA  1 P00221 UNP 116 D 
+ATOM 840  C C   . ASP A 1 116 ? -4.860  2.374   -17.523 1.0 95.50 ? 116 ASP A C   1 P00221 UNP 116 D 
+ATOM 841  C CB  . ASP A 1 116 ? -2.604  2.074   -18.629 1.0 95.50 ? 116 ASP A CB  1 P00221 UNP 116 D 
+ATOM 842  O O   . ASP A 1 116 ? -5.105  3.445   -16.968 1.0 95.50 ? 116 ASP A O   1 P00221 UNP 116 D 
+ATOM 843  C CG  . ASP A 1 116 ? -1.114  1.697   -18.533 1.0 95.50 ? 116 ASP A CG  1 P00221 UNP 116 D 
+ATOM 844  O OD1 . ASP A 1 116 ? -0.602  1.477   -17.414 1.0 95.50 ? 116 ASP A OD1 1 P00221 UNP 116 D 
+ATOM 845  O OD2 . ASP A 1 116 ? -0.464  1.626   -19.607 1.0 95.50 ? 116 ASP A OD2 1 P00221 UNP 116 D 
+ATOM 846  N N   . ASP A 1 117 ? -5.798  1.689   -18.191 1.0 95.97 ? 117 ASP A N   1 P00221 UNP 117 D 
+ATOM 847  C CA  . ASP A 1 117 ? -7.170  2.175   -18.378 1.0 95.97 ? 117 ASP A CA  1 P00221 UNP 117 D 
+ATOM 848  C C   . ASP A 1 117 ? -7.895  2.256   -17.022 1.0 95.97 ? 117 ASP A C   1 P00221 UNP 117 D 
+ATOM 849  C CB  . ASP A 1 117 ? -7.946  1.263   -19.356 1.0 95.97 ? 117 ASP A CB  1 P00221 UNP 117 D 
+ATOM 850  O O   . ASP A 1 117 ? -8.546  3.255   -16.706 1.0 95.97 ? 117 ASP A O   1 P00221 UNP 117 D 
+ATOM 851  C CG  . ASP A 1 117 ? -7.475  1.293   -20.823 1.0 95.97 ? 117 ASP A CG  1 P00221 UNP 117 D 
+ATOM 852  O OD1 . ASP A 1 117 ? -6.917  2.320   -21.273 1.0 95.97 ? 117 ASP A OD1 1 P00221 UNP 117 D 
+ATOM 853  O OD2 . ASP A 1 117 ? -7.742  0.304   -21.550 1.0 95.97 ? 117 ASP A OD2 1 P00221 UNP 117 D 
+ATOM 854  N N   . GLN A 1 118 ? -7.733  1.243   -16.167 1.0 95.95 ? 118 GLN A N   1 P00221 UNP 118 Q 
+ATOM 855  C CA  . GLN A 1 118 ? -8.296  1.236   -14.820 1.0 95.95 ? 118 GLN A CA  1 P00221 UNP 118 Q 
+ATOM 856  C C   . GLN A 1 118 ? -7.694  2.341   -13.938 1.0 95.95 ? 118 GLN A C   1 P00221 UNP 118 Q 
+ATOM 857  C CB  . GLN A 1 118 ? -8.072  -0.139  -14.175 1.0 95.95 ? 118 GLN A CB  1 P00221 UNP 118 Q 
+ATOM 858  O O   . GLN A 1 118 ? -8.418  3.018   -13.196 1.0 95.95 ? 118 GLN A O   1 P00221 UNP 118 Q 
+ATOM 859  C CG  . GLN A 1 118 ? -8.974  -1.221  -14.782 1.0 95.95 ? 118 GLN A CG  1 P00221 UNP 118 Q 
+ATOM 860  C CD  . GLN A 1 118 ? -8.649  -2.616  -14.256 1.0 95.95 ? 118 GLN A CD  1 P00221 UNP 118 Q 
+ATOM 861  N NE2 . GLN A 1 118 ? -9.591  -3.531  -14.310 1.0 95.95 ? 118 GLN A NE2 1 P00221 UNP 118 Q 
+ATOM 862  O OE1 . GLN A 1 118 ? -7.585  -2.911  -13.733 1.0 95.95 ? 118 GLN A OE1 1 P00221 UNP 118 Q 
+ATOM 863  N N   . ILE A 1 119 ? -6.381  2.557   -14.014 1.0 95.94 ? 119 ILE A N   1 P00221 UNP 119 I 
+ATOM 864  C CA  . ILE A 1 119 ? -5.715  3.648   -13.290 1.0 95.94 ? 119 ILE A CA  1 P00221 UNP 119 I 
+ATOM 865  C C   . ILE A 1 119 ? -6.273  5.004   -13.743 1.0 95.94 ? 119 ILE A C   1 P00221 UNP 119 I 
+ATOM 866  C CB  . ILE A 1 119 ? -4.185  3.555   -13.468 1.0 95.94 ? 119 ILE A CB  1 P00221 UNP 119 I 
+ATOM 867  O O   . ILE A 1 119 ? -6.622  5.828   -12.893 1.0 95.94 ? 119 ILE A O   1 P00221 UNP 119 I 
+ATOM 868  C CG1 . ILE A 1 119 ? -3.648  2.296   -12.749 1.0 95.94 ? 119 ILE A CG1 1 P00221 UNP 119 I 
+ATOM 869  C CG2 . ILE A 1 119 ? -3.489  4.820   -12.927 1.0 95.94 ? 119 ILE A CG2 1 P00221 UNP 119 I 
+ATOM 870  C CD1 . ILE A 1 119 ? -2.194  1.970   -13.109 1.0 95.94 ? 119 ILE A CD1 1 P00221 UNP 119 I 
+ATOM 871  N N   . ASP A 1 120 ? -6.433  5.212   -15.051 1.0 95.31 ? 120 ASP A N   1 P00221 UNP 120 D 
+ATOM 872  C CA  . ASP A 1 120 ? -6.968  6.446   -15.636 1.0 95.31 ? 120 ASP A CA  1 P00221 UNP 120 D 
+ATOM 873  C C   . ASP A 1 120 ? -8.439  6.689   -15.269 1.0 95.31 ? 120 ASP A C   1 P00221 UNP 120 D 
+ATOM 874  C CB  . ASP A 1 120 ? -6.807  6.404   -17.167 1.0 95.31 ? 120 ASP A CB  1 P00221 UNP 120 D 
+ATOM 875  O O   . ASP A 1 120 ? -8.857  7.827   -15.036 1.0 95.31 ? 120 ASP A O   1 P00221 UNP 120 D 
+ATOM 876  C CG  . ASP A 1 120 ? -5.413  6.806   -17.671 1.0 95.31 ? 120 ASP A CG  1 P00221 UNP 120 D 
+ATOM 877  O OD1 . ASP A 1 120 ? -4.601  7.318   -16.863 1.0 95.31 ? 120 ASP A OD1 1 P00221 UNP 120 D 
+ATOM 878  O OD2 . ASP A 1 120 ? -5.219  6.767   -18.908 1.0 95.31 ? 120 ASP A OD2 1 P00221 UNP 120 D 
+ATOM 879  N N   . GLU A 1 121 ? -9.235  5.628   -15.130 1.0 95.80 ? 121 GLU A N   1 P00221 UNP 121 E 
+ATOM 880  C CA  . GLU A 1 121 ? -10.590 5.729   -14.590 1.0 95.80 ? 121 GLU A CA  1 P00221 UNP 121 E 
+ATOM 881  C C   . GLU A 1 121 ? -10.610 6.136   -13.105 1.0 95.80 ? 121 GLU A C   1 P00221 UNP 121 E 
+ATOM 882  C CB  . GLU A 1 121 ? -11.328 4.398   -14.751 1.0 95.80 ? 121 GLU A CB  1 P00221 UNP 121 E 
+ATOM 883  O O   . GLU A 1 121 ? -11.679 6.453   -12.576 1.0 95.80 ? 121 GLU A O   1 P00221 UNP 121 E 
+ATOM 884  C CG  . GLU A 1 121 ? -11.754 4.046   -16.178 1.0 95.80 ? 121 GLU A CG  1 P00221 UNP 121 E 
+ATOM 885  C CD  . GLU A 1 121 ? -12.500 2.701   -16.216 1.0 95.80 ? 121 GLU A CD  1 P00221 UNP 121 E 
+ATOM 886  O OE1 . GLU A 1 121 ? -12.871 2.292   -17.337 1.0 95.80 ? 121 GLU A OE1 1 P00221 UNP 121 E 
+ATOM 887  O OE2 . GLU A 1 121 ? -12.804 2.158   -15.117 1.0 95.80 ? 121 GLU A OE2 1 P00221 UNP 121 E 
+ATOM 888  N N   . GLY A 1 122 ? -9.472  6.089   -12.407 1.0 96.68 ? 122 GLY A N   1 P00221 UNP 122 G 
+ATOM 889  C CA  . GLY A 1 122 ? -9.322  6.431   -10.994 1.0 96.68 ? 122 GLY A CA  1 P00221 UNP 122 G 
+ATOM 890  C C   . GLY A 1 122 ? -9.406  5.234   -10.048 1.0 96.68 ? 122 GLY A C   1 P00221 UNP 122 G 
+ATOM 891  O O   . GLY A 1 122 ? -9.763  5.408   -8.883  1.0 96.68 ? 122 GLY A O   1 P00221 UNP 122 G 
+ATOM 892  N N   . TRP A 1 123 ? -9.153  4.012   -10.521 1.0 97.54 ? 123 TRP A N   1 P00221 UNP 123 W 
+ATOM 893  C CA  . TRP A 1 123 ? -8.994  2.858   -9.633  1.0 97.54 ? 123 TRP A CA  1 P00221 UNP 123 W 
+ATOM 894  C C   . TRP A 1 123 ? -7.672  2.934   -8.869  1.0 97.54 ? 123 TRP A C   1 P00221 UNP 123 W 
+ATOM 895  C CB  . TRP A 1 123 ? -9.129  1.551   -10.415 1.0 97.54 ? 123 TRP A CB  1 P00221 UNP 123 W 
+ATOM 896  O O   . TRP A 1 123 ? -6.649  3.372   -9.397  1.0 97.54 ? 123 TRP A O   1 P00221 UNP 123 W 
+ATOM 897  C CG  . TRP A 1 123 ? -10.508 1.316   -10.946 1.0 97.54 ? 123 TRP A CG  1 P00221 UNP 123 W 
+ATOM 898  C CD1 . TRP A 1 123 ? -10.933 1.429   -12.224 1.0 97.54 ? 123 TRP A CD1 1 P00221 UNP 123 W 
+ATOM 899  C CD2 . TRP A 1 123 ? -11.663 0.864   -10.196 1.0 97.54 ? 123 TRP A CD2 1 P00221 UNP 123 W 
+ATOM 900  C CE2 . TRP A 1 123 ? -12.768 0.728   -11.092 1.0 97.54 ? 123 TRP A CE2 1 P00221 UNP 123 W 
+ATOM 901  C CE3 . TRP A 1 123 ? -11.848 0.503   -8.847  1.0 97.54 ? 123 TRP A CE3 1 P00221 UNP 123 W 
+ATOM 902  N NE1 . TRP A 1 123 ? -12.268 1.104   -12.322 1.0 97.54 ? 123 TRP A NE1 1 P00221 UNP 123 W 
+ATOM 903  C CH2 . TRP A 1 123 ? -14.168 -0.071  -9.301  1.0 97.54 ? 123 TRP A CH2 1 P00221 UNP 123 W 
+ATOM 904  C CZ2 . TRP A 1 123 ? -14.017 0.281   -10.651 1.0 97.54 ? 123 TRP A CZ2 1 P00221 UNP 123 W 
+ATOM 905  C CZ3 . TRP A 1 123 ? -13.088 0.024   -8.408  1.0 97.54 ? 123 TRP A CZ3 1 P00221 UNP 123 W 
+ATOM 906  N N   . VAL A 1 124 ? -7.702  2.521   -7.603  1.0 97.69 ? 124 VAL A N   1 P00221 UNP 124 V 
+ATOM 907  C CA  . VAL A 1 124 ? -6.526  2.522   -6.731  1.0 97.69 ? 124 VAL A CA  1 P00221 UNP 124 V 
+ATOM 908  C C   . VAL A 1 124 ? -6.454  1.262   -5.883  1.0 97.69 ? 124 VAL A C   1 P00221 UNP 124 V 
+ATOM 909  C CB  . VAL A 1 124 ? -6.448  3.804   -5.877  1.0 97.69 ? 124 VAL A CB  1 P00221 UNP 124 V 
+ATOM 910  O O   . VAL A 1 124 ? -7.473  0.789   -5.379  1.0 97.69 ? 124 VAL A O   1 P00221 UNP 124 V 
+ATOM 911  C CG1 . VAL A 1 124 ? -7.683  4.047   -4.996  1.0 97.69 ? 124 VAL A CG1 1 P00221 UNP 124 V 
+ATOM 912  C CG2 . VAL A 1 124 ? -5.210  3.798   -4.974  1.0 97.69 ? 124 VAL A CG2 1 P00221 UNP 124 V 
+ATOM 913  N N   . LEU A 1 125 ? -5.241  0.754   -5.667  1.0 97.68 ? 125 LEU A N   1 P00221 UNP 125 L 
+ATOM 914  C CA  . LEU A 1 125 ? -4.957  -0.262  -4.655  1.0 97.68 ? 125 LEU A CA  1 P00221 UNP 125 L 
+ATOM 915  C C   . LEU A 1 125 ? -4.387  0.384   -3.389  1.0 97.68 ? 125 LEU A C   1 P00221 UNP 125 L 
+ATOM 916  C CB  . LEU A 1 125 ? -4.015  -1.318  -5.253  1.0 97.68 ? 125 LEU A CB  1 P00221 UNP 125 L 
+ATOM 917  O O   . LEU A 1 125 ? -3.219  0.760   -3.345  1.0 97.68 ? 125 LEU A O   1 P00221 UNP 125 L 
+ATOM 918  C CG  . LEU A 1 125 ? -4.623  -2.132  -6.411  1.0 97.68 ? 125 LEU A CG  1 P00221 UNP 125 L 
+ATOM 919  C CD1 . LEU A 1 125 ? -3.751  -3.353  -6.675  1.0 97.68 ? 125 LEU A CD1 1 P00221 UNP 125 L 
+ATOM 920  C CD2 . LEU A 1 125 ? -6.037  -2.660  -6.139  1.0 97.68 ? 125 LEU A CD2 1 P00221 UNP 125 L 
+ATOM 921  N N   . THR A 1 126 ? -5.194  0.488   -2.327  1.0 97.06 ? 126 THR A N   1 P00221 UNP 126 T 
+ATOM 922  C CA  . THR A 1 126 ? -4.805  1.192   -1.084  1.0 97.06 ? 126 THR A CA  1 P00221 UNP 126 T 
+ATOM 923  C C   . THR A 1 126 ? -3.589  0.575   -0.390  1.0 97.06 ? 126 THR A C   1 P00221 UNP 126 T 
+ATOM 924  C CB  . THR A 1 126 ? -5.959  1.229   -0.072  1.0 97.06 ? 126 THR A CB  1 P00221 UNP 126 T 
+ATOM 925  O O   . THR A 1 126 ? -2.879  1.260   0.343   1.0 97.06 ? 126 THR A O   1 P00221 UNP 126 T 
+ATOM 926  C CG2 . THR A 1 126 ? -7.185  1.967   -0.612  1.0 97.06 ? 126 THR A CG2 1 P00221 UNP 126 T 
+ATOM 927  O OG1 . THR A 1 126 ? -6.354  -0.084  0.255   1.0 97.06 ? 126 THR A OG1 1 P00221 UNP 126 T 
+ATOM 928  N N   . CYS A 1 127 ? -3.331  -0.709  -0.647  1.0 97.42 ? 127 CYS A N   1 P00221 UNP 127 C 
+ATOM 929  C CA  . CYS A 1 127 ? -2.204  -1.459  -0.111  1.0 97.42 ? 127 CYS A CA  1 P00221 UNP 127 C 
+ATOM 930  C C   . CYS A 1 127 ? -0.864  -1.216  -0.823  1.0 97.42 ? 127 CYS A C   1 P00221 UNP 127 C 
+ATOM 931  C CB  . CYS A 1 127 ? -2.584  -2.945  -0.063  1.0 97.42 ? 127 CYS A CB  1 P00221 UNP 127 C 
+ATOM 932  O O   . CYS A 1 127 ? 0.151   -1.718  -0.353  1.0 97.42 ? 127 CYS A O   1 P00221 UNP 127 C 
+ATOM 933  S SG  . CYS A 1 127 ? -3.025  -3.847  -1.584  1.0 97.42 ? 127 CYS A SG  1 P00221 UNP 127 C 
+ATOM 934  N N   . ALA A 1 128 ? -0.858  -0.487  -1.940  1.0 97.30 ? 128 ALA A N   1 P00221 UNP 128 A 
+ATOM 935  C CA  . ALA A 1 128 ? 0.342   -0.134  -2.701  1.0 97.30 ? 128 ALA A CA  1 P00221 UNP 128 A 
+ATOM 936  C C   . ALA A 1 128 ? 0.251   1.307   -3.243  1.0 97.30 ? 128 ALA A C   1 P00221 UNP 128 A 
+ATOM 937  C CB  . ALA A 1 128 ? 0.563   -1.184  -3.800  1.0 97.30 ? 128 ALA A CB  1 P00221 UNP 128 A 
+ATOM 938  O O   . ALA A 1 128 ? 0.688   1.587   -4.356  1.0 97.30 ? 128 ALA A O   1 P00221 UNP 128 A 
+ATOM 939  N N   . ALA A 1 129 ? -0.375  2.209   -2.478  1.0 97.44 ? 129 ALA A N   1 P00221 UNP 129 A 
+ATOM 940  C CA  . ALA A 1 129 ? -0.588  3.601   -2.863  1.0 97.44 ? 129 ALA A CA  1 P00221 UNP 129 A 
+ATOM 941  C C   . ALA A 1 129 ? -0.025  4.568   -1.815  1.0 97.44 ? 129 ALA A C   1 P00221 UNP 129 A 
+ATOM 942  C CB  . ALA A 1 129 ? -2.084  3.835   -3.097  1.0 97.44 ? 129 ALA A CB  1 P00221 UNP 129 A 
+ATOM 943  O O   . ALA A 1 129 ? -0.355  4.454   -0.633  1.0 97.44 ? 129 ALA A O   1 P00221 UNP 129 A 
+ATOM 944  N N   . TYR A 1 130 ? 0.757   5.545   -2.273  1.0 97.59 ? 130 TYR A N   1 P00221 UNP 130 Y 
+ATOM 945  C CA  . TYR A 1 130 ? 1.282   6.666   -1.493  1.0 97.59 ? 130 TYR A CA  1 P00221 UNP 130 Y 
+ATOM 946  C C   . TYR A 1 130 ? 0.526   7.955   -1.831  1.0 97.59 ? 130 TYR A C   1 P00221 UNP 130 Y 
+ATOM 947  C CB  . TYR A 1 130 ? 2.766   6.887   -1.792  1.0 97.59 ? 130 TYR A CB  1 P00221 UNP 130 Y 
+ATOM 948  O O   . TYR A 1 130 ? 0.332   8.262   -3.014  1.0 97.59 ? 130 TYR A O   1 P00221 UNP 130 Y 
+ATOM 949  C CG  . TYR A 1 130 ? 3.642   5.689   -1.525  1.0 97.59 ? 130 TYR A CG  1 P00221 UNP 130 Y 
+ATOM 950  C CD1 . TYR A 1 130 ? 4.092   5.418   -0.220  1.0 97.59 ? 130 TYR A CD1 1 P00221 UNP 130 Y 
+ATOM 951  C CD2 . TYR A 1 130 ? 4.018   4.858   -2.593  1.0 97.59 ? 130 TYR A CD2 1 P00221 UNP 130 Y 
+ATOM 952  C CE1 . TYR A 1 130 ? 4.939   4.315   0.018   1.0 97.59 ? 130 TYR A CE1 1 P00221 UNP 130 Y 
+ATOM 953  C CE2 . TYR A 1 130 ? 4.871   3.771   -2.360  1.0 97.59 ? 130 TYR A CE2 1 P00221 UNP 130 Y 
+ATOM 954  O OH  . TYR A 1 130 ? 6.175   2.438   -0.877  1.0 97.59 ? 130 TYR A OH  1 P00221 UNP 130 Y 
+ATOM 955  C CZ  . TYR A 1 130 ? 5.341   3.495   -1.060  1.0 97.59 ? 130 TYR A CZ  1 P00221 UNP 130 Y 
+ATOM 956  N N   . PRO A 1 131 ? 0.116   8.759   -0.840  1.0 97.30 ? 131 PRO A N   1 P00221 UNP 131 P 
+ATOM 957  C CA  . PRO A 1 131 ? -0.506  10.047  -1.109  1.0 97.30 ? 131 PRO A CA  1 P00221 UNP 131 P 
+ATOM 958  C C   . PRO A 1 131 ? 0.539   11.065  -1.596  1.0 97.30 ? 131 PRO A C   1 P00221 UNP 131 P 
+ATOM 959  C CB  . PRO A 1 131 ? -1.145  10.449  0.217   1.0 97.30 ? 131 PRO A CB  1 P00221 UNP 131 P 
+ATOM 960  O O   . PRO A 1 131 ? 1.600   11.222  -1.000  1.0 97.30 ? 131 PRO A O   1 P00221 UNP 131 P 
+ATOM 961  C CG  . PRO A 1 131 ? -0.204  9.834   1.255   1.0 97.30 ? 131 PRO A CG  1 P00221 UNP 131 P 
+ATOM 962  C CD  . PRO A 1 131 ? 0.289   8.550   0.593   1.0 97.30 ? 131 PRO A CD  1 P00221 UNP 131 P 
+ATOM 963  N N   . VAL A 1 132 ? 0.222   11.798  -2.668  1.0 96.81 ? 132 VAL A N   1 P00221 UNP 132 V 
+ATOM 964  C CA  . VAL A 1 132 ? 1.050   12.914  -3.184  1.0 96.81 ? 132 VAL A CA  1 P00221 UNP 132 V 
+ATOM 965  C C   . VAL A 1 132 ? 0.378   14.270  -2.919  1.0 96.81 ? 132 VAL A C   1 P00221 UNP 132 V 
+ATOM 966  C CB  . VAL A 1 132 ? 1.374   12.695  -4.679  1.0 96.81 ? 132 VAL A CB  1 P00221 UNP 132 V 
+ATOM 967  O O   . VAL A 1 132 ? 0.996   15.328  -3.028  1.0 96.81 ? 132 VAL A O   1 P00221 UNP 132 V 
+ATOM 968  C CG1 . VAL A 1 132 ? 2.296   13.775  -5.265  1.0 96.81 ? 132 VAL A CG1 1 P00221 UNP 132 V 
+ATOM 969  C CG2 . VAL A 1 132 ? 2.081   11.350  -4.904  1.0 96.81 ? 132 VAL A CG2 1 P00221 UNP 132 V 
+ATOM 970  N N   . SER A 1 133 ? -0.902  14.247  -2.553  1.0 97.27 ? 133 SER A N   1 P00221 UNP 133 S 
+ATOM 971  C CA  . SER A 1 133 ? -1.684  15.384  -2.082  1.0 97.27 ? 133 SER A CA  1 P00221 UNP 133 S 
+ATOM 972  C C   . SER A 1 133 ? -2.727  14.906  -1.075  1.0 97.27 ? 133 SER A C   1 P00221 UNP 133 S 
+ATOM 973  C CB  . SER A 1 133 ? -2.367  16.078  -3.271  1.0 97.27 ? 133 SER A CB  1 P00221 UNP 133 S 
+ATOM 974  O O   . SER A 1 133 ? -2.875  13.706  -0.846  1.0 97.27 ? 133 SER A O   1 P00221 UNP 133 S 
+ATOM 975  O OG  . SER A 1 133 ? -3.466  15.337  -3.781  1.0 97.27 ? 133 SER A OG  1 P00221 UNP 133 S 
+ATOM 976  N N   . ASP A 1 134 ? -3.532  15.828  -0.547  1.0 97.85 ? 134 ASP A N   1 P00221 UNP 134 D 
+ATOM 977  C CA  . ASP A 1 134 ? -4.774  15.451  0.127   1.0 97.85 ? 134 ASP A CA  1 P00221 UNP 134 D 
+ATOM 978  C C   . ASP A 1 134 ? -5.661  14.666  -0.852  1.0 97.85 ? 134 ASP A C   1 P00221 UNP 134 D 
+ATOM 979  C CB  . ASP A 1 134 ? -5.511  16.692  0.653   1.0 97.85 ? 134 ASP A CB  1 P00221 UNP 134 D 
+ATOM 980  O O   . ASP A 1 134 ? -5.862  15.101  -1.993  1.0 97.85 ? 134 ASP A O   1 P00221 UNP 134 D 
+ATOM 981  C CG  . ASP A 1 134 ? -4.764  17.462  1.748   1.0 97.85 ? 134 ASP A CG  1 P00221 UNP 134 D 
+ATOM 982  O OD1 . ASP A 1 134 ? -3.760  16.944  2.289   1.0 97.85 ? 134 ASP A OD1 1 P00221 UNP 134 D 
+ATOM 983  O OD2 . ASP A 1 134 ? -5.228  18.582  2.059   1.0 97.85 ? 134 ASP A OD2 1 P00221 UNP 134 D 
+ATOM 984  N N   . VAL A 1 135 ? -6.160  13.504  -0.425  1.0 98.07 ? 135 VAL A N   1 P00221 UNP 135 V 
+ATOM 985  C CA  . VAL A 1 135 ? -6.908  12.562  -1.274  1.0 98.07 ? 135 VAL A CA  1 P00221 UNP 135 V 
+ATOM 986  C C   . VAL A 1 135 ? -8.220  12.141  -0.627  1.0 98.07 ? 135 VAL A C   1 P00221 UNP 135 V 
+ATOM 987  C CB  . VAL A 1 135 ? -6.091  11.312  -1.675  1.0 98.07 ? 135 VAL A CB  1 P00221 UNP 135 V 
+ATOM 988  O O   . VAL A 1 135 ? -8.335  12.030  0.594   1.0 98.07 ? 135 VAL A O   1 P00221 UNP 135 V 
+ATOM 989  C CG1 . VAL A 1 135 ? -5.014  11.631  -2.711  1.0 98.07 ? 135 VAL A CG1 1 P00221 UNP 135 V 
+ATOM 990  C CG2 . VAL A 1 135 ? -5.441  10.610  -0.483  1.0 98.07 ? 135 VAL A CG2 1 P00221 UNP 135 V 
+ATOM 991  N N   . THR A 1 136 ? -9.223  11.870  -1.461  1.0 98.25 ? 136 THR A N   1 P00221 UNP 136 T 
+ATOM 992  C CA  . THR A 1 136 ? -10.474 11.218  -1.045  1.0 98.25 ? 136 THR A CA  1 P00221 UNP 136 T 
+ATOM 993  C C   . THR A 1 136 ? -10.658 9.925   -1.824  1.0 98.25 ? 136 THR A C   1 P00221 UNP 136 T 
+ATOM 994  C CB  . THR A 1 136 ? -11.687 12.134  -1.231  1.0 98.25 ? 136 THR A CB  1 P00221 UNP 136 T 
+ATOM 995  O O   . THR A 1 136 ? -10.713 9.961   -3.053  1.0 98.25 ? 136 THR A O   1 P00221 UNP 136 T 
+ATOM 996  C CG2 . THR A 1 136 ? -12.981 11.516  -0.704  1.0 98.25 ? 136 THR A CG2 1 P00221 UNP 136 T 
+ATOM 997  O OG1 . THR A 1 136 ? -11.481 13.335  -0.524  1.0 98.25 ? 136 THR A OG1 1 P00221 UNP 136 T 
+ATOM 998  N N   . ILE A 1 137 ? -10.770 8.794   -1.127  1.0 98.15 ? 137 ILE A N   1 P00221 UNP 137 I 
+ATOM 999  C CA  . ILE A 1 137 ? -10.848 7.453   -1.721  1.0 98.15 ? 137 ILE A CA  1 P00221 UNP 137 I 
+ATOM 1000 C C   . ILE A 1 137 ? -12.115 6.751   -1.223  1.0 98.15 ? 137 ILE A C   1 P00221 UNP 137 I 
+ATOM 1001 C CB  . ILE A 1 137 ? -9.566  6.638   -1.412  1.0 98.15 ? 137 ILE A CB  1 P00221 UNP 137 I 
+ATOM 1002 O O   . ILE A 1 137 ? -12.339 6.636   -0.019  1.0 98.15 ? 137 ILE A O   1 P00221 UNP 137 I 
+ATOM 1003 C CG1 . ILE A 1 137 ? -8.301  7.361   -1.938  1.0 98.15 ? 137 ILE A CG1 1 P00221 UNP 137 I 
+ATOM 1004 C CG2 . ILE A 1 137 ? -9.665  5.225   -2.021  1.0 98.15 ? 137 ILE A CG2 1 P00221 UNP 137 I 
+ATOM 1005 C CD1 . ILE A 1 137 ? -6.979  6.732   -1.486  1.0 98.15 ? 137 ILE A CD1 1 P00221 UNP 137 I 
+ATOM 1006 N N   . GLU A 1 138 ? -12.942 6.256   -2.141  1.0 97.71 ? 138 GLU A N   1 P00221 UNP 138 E 
+ATOM 1007 C CA  . GLU A 1 138 ? -13.987 5.281   -1.814  1.0 97.71 ? 138 GLU A CA  1 P00221 UNP 138 E 
+ATOM 1008 C C   . GLU A 1 138 ? -13.362 3.901   -1.649  1.0 97.71 ? 138 GLU A C   1 P00221 UNP 138 E 
+ATOM 1009 C CB  . GLU A 1 138 ? -15.074 5.228   -2.894  1.0 97.71 ? 138 GLU A CB  1 P00221 UNP 138 E 
+ATOM 1010 O O   . GLU A 1 138 ? -12.675 3.424   -2.547  1.0 97.71 ? 138 GLU A O   1 P00221 UNP 138 E 
+ATOM 1011 C CG  . GLU A 1 138 ? -16.048 6.406   -2.812  1.0 97.71 ? 138 GLU A CG  1 P00221 UNP 138 E 
+ATOM 1012 C CD  . GLU A 1 138 ? -17.186 6.332   -3.843  1.0 97.71 ? 138 GLU A CD  1 P00221 UNP 138 E 
+ATOM 1013 O OE1 . GLU A 1 138 ? -18.056 7.229   -3.819  1.0 97.71 ? 138 GLU A OE1 1 P00221 UNP 138 E 
+ATOM 1014 O OE2 . GLU A 1 138 ? -17.132 5.539   -4.811  1.0 97.71 ? 138 GLU A OE2 1 P00221 UNP 138 E 
+ATOM 1015 N N   . THR A 1 139 ? -13.601 3.255   -0.514  1.0 97.28 ? 139 THR A N   1 P00221 UNP 139 T 
+ATOM 1016 C CA  . THR A 1 139 ? -13.034 1.937   -0.204  1.0 97.28 ? 139 THR A CA  1 P00221 UNP 139 T 
+ATOM 1017 C C   . THR A 1 139 ? -14.076 0.835   -0.396  1.0 97.28 ? 139 THR A C   1 P00221 UNP 139 T 
+ATOM 1018 C CB  . THR A 1 139 ? -12.429 1.934   1.206   1.0 97.28 ? 139 THR A CB  1 P00221 UNP 139 T 
+ATOM 1019 O O   . THR A 1 139 ? -15.247 1.124   -0.642  1.0 97.28 ? 139 THR A O   1 P00221 UNP 139 T 
+ATOM 1020 C CG2 . THR A 1 139 ? -11.402 3.054   1.384   1.0 97.28 ? 139 THR A CG2 1 P00221 UNP 139 T 
+ATOM 1021 O OG1 . THR A 1 139 ? -13.421 2.119   2.185   1.0 97.28 ? 139 THR A OG1 1 P00221 UNP 139 T 
+ATOM 1022 N N   . HIS A 1 140 ? -13.661 -0.432  -0.277  1.0 96.39 ? 140 HIS A N   1 P00221 UNP 140 H 
+ATOM 1023 C CA  . HIS A 1 140 ? -14.538 -1.603  -0.441  1.0 96.39 ? 140 HIS A CA  1 P00221 UNP 140 H 
+ATOM 1024 C C   . HIS A 1 140 ? -15.145 -1.709  -1.851  1.0 96.39 ? 140 HIS A C   1 P00221 UNP 140 H 
+ATOM 1025 C CB  . HIS A 1 140 ? -15.606 -1.662  0.670   1.0 96.39 ? 140 HIS A CB  1 P00221 UNP 140 H 
+ATOM 1026 O O   . HIS A 1 140 ? -16.324 -2.018  -2.011  1.0 96.39 ? 140 HIS A O   1 P00221 UNP 140 H 
+ATOM 1027 C CG  . HIS A 1 140 ? -15.077 -1.596  2.078   1.0 96.39 ? 140 HIS A CG  1 P00221 UNP 140 H 
+ATOM 1028 C CD2 . HIS A 1 140 ? -15.161 -2.594  3.008   1.0 96.39 ? 140 HIS A CD2 1 P00221 UNP 140 H 
+ATOM 1029 N ND1 . HIS A 1 140 ? -14.502 -0.509  2.702   1.0 96.39 ? 140 HIS A ND1 1 P00221 UNP 140 H 
+ATOM 1030 C CE1 . HIS A 1 140 ? -14.233 -0.849  3.973   1.0 96.39 ? 140 HIS A CE1 1 P00221 UNP 140 H 
+ATOM 1031 N NE2 . HIS A 1 140 ? -14.637 -2.104  4.205   1.0 96.39 ? 140 HIS A NE2 1 P00221 UNP 140 H 
+ATOM 1032 N N   . LYS A 1 141 ? -14.343 -1.427  -2.885  1.0 96.60 ? 141 LYS A N   1 P00221 UNP 141 K 
+ATOM 1033 C CA  . LYS A 1 141 ? -14.799 -1.389  -4.283  1.0 96.60 ? 141 LYS A CA  1 P00221 UNP 141 K 
+ATOM 1034 C C   . LYS A 1 141 ? -14.374 -2.602  -5.115  1.0 96.60 ? 141 LYS A C   1 P00221 UNP 141 K 
+ATOM 1035 C CB  . LYS A 1 141 ? -14.393 -0.053  -4.928  1.0 96.60 ? 141 LYS A CB  1 P00221 UNP 141 K 
+ATOM 1036 O O   . LYS A 1 141 ? -14.487 -2.563  -6.334  1.0 96.60 ? 141 LYS A O   1 P00221 UNP 141 K 
+ATOM 1037 C CG  . LYS A 1 141 ? -14.998 1.193   -4.269  1.0 96.60 ? 141 LYS A CG  1 P00221 UNP 141 K 
+ATOM 1038 C CD  . LYS A 1 141 ? -16.530 1.125   -4.307  1.0 96.60 ? 141 LYS A CD  1 P00221 UNP 141 K 
+ATOM 1039 C CE  . LYS A 1 141 ? -17.134 2.518   -4.171  1.0 96.60 ? 141 LYS A CE  1 P00221 UNP 141 K 
+ATOM 1040 N NZ  . LYS A 1 141 ? -18.414 2.601   -4.901  1.0 96.60 ? 141 LYS A NZ  1 P00221 UNP 141 K 
+ATOM 1041 N N   . GLU A 1 142 ? -13.924 -3.684  -4.479  1.0 96.32 ? 142 GLU A N   1 P00221 UNP 142 E 
+ATOM 1042 C CA  . GLU A 1 142 ? -13.527 -4.922  -5.170  1.0 96.32 ? 142 GLU A CA  1 P00221 UNP 142 E 
+ATOM 1043 C C   . GLU A 1 142 ? -14.646 -5.481  -6.065  1.0 96.32 ? 142 GLU A C   1 P00221 UNP 142 E 
+ATOM 1044 C CB  . GLU A 1 142 ? -13.081 -5.962  -4.127  1.0 96.32 ? 142 GLU A CB  1 P00221 UNP 142 E 
+ATOM 1045 O O   . GLU A 1 142 ? -14.396 -5.836  -7.216  1.0 96.32 ? 142 GLU A O   1 P00221 UNP 142 E 
+ATOM 1046 C CG  . GLU A 1 142 ? -12.740 -7.315  -4.775  1.0 96.32 ? 142 GLU A CG  1 P00221 UNP 142 E 
+ATOM 1047 C CD  . GLU A 1 142 ? -11.996 -8.269  -3.833  1.0 96.32 ? 142 GLU A CD  1 P00221 UNP 142 E 
+ATOM 1048 O OE1 . GLU A 1 142 ? -11.043 -8.932  -4.314  1.0 96.32 ? 142 GLU A OE1 1 P00221 UNP 142 E 
+ATOM 1049 O OE2 . GLU A 1 142 ? -12.308 -8.303  -2.623  1.0 96.32 ? 142 GLU A OE2 1 P00221 UNP 142 E 
+ATOM 1050 N N   . GLU A 1 143 ? -15.886 -5.507  -5.571  1.0 94.50 ? 143 GLU A N   1 P00221 UNP 143 E 
+ATOM 1051 C CA  . GLU A 1 143 ? -17.037 -5.992  -6.344  1.0 94.50 ? 143 GLU A CA  1 P00221 UNP 143 E 
+ATOM 1052 C C   . GLU A 1 143 ? -17.321 -5.120  -7.574  1.0 94.50 ? 143 GLU A C   1 P00221 UNP 143 E 
+ATOM 1053 C CB  . GLU A 1 143 ? -18.293 -6.039  -5.459  1.0 94.50 ? 143 GLU A CB  1 P00221 UNP 143 E 
+ATOM 1054 O O   . GLU A 1 143 ? -17.719 -5.636  -8.608  1.0 94.50 ? 143 GLU A O   1 P00221 UNP 143 E 
+ATOM 1055 C CG  . GLU A 1 143 ? -18.186 -7.036  -4.293  1.0 94.50 ? 143 GLU A CG  1 P00221 UNP 143 E 
+ATOM 1056 C CD  . GLU A 1 143 ? -19.479 -7.151  -3.462  1.0 94.50 ? 143 GLU A CD  1 P00221 UNP 143 E 
+ATOM 1057 O OE1 . GLU A 1 143 ? -19.496 -7.995  -2.535  1.0 94.50 ? 143 GLU A OE1 1 P00221 UNP 143 E 
+ATOM 1058 O OE2 . GLU A 1 143 ? -20.454 -6.411  -3.736  1.0 94.50 ? 143 GLU A OE2 1 P00221 UNP 143 E 
+ATOM 1059 N N   . GLU A 1 144 ? -17.087 -3.807  -7.491  1.0 94.46 ? 144 GLU A N   1 P00221 UNP 144 E 
+ATOM 1060 C CA  . GLU A 1 144 ? -17.305 -2.878  -8.607  1.0 94.46 ? 144 GLU A CA  1 P00221 UNP 144 E 
+ATOM 1061 C C   . GLU A 1 144 ? -16.183 -2.972  -9.654  1.0 94.46 ? 144 GLU A C   1 P00221 UNP 144 E 
+ATOM 1062 C CB  . GLU A 1 144 ? -17.495 -1.458  -8.031  1.0 94.46 ? 144 GLU A CB  1 P00221 UNP 144 E 
+ATOM 1063 O O   . GLU A 1 144 ? -16.438 -2.761  -10.833 1.0 94.46 ? 144 GLU A O   1 P00221 UNP 144 E 
+ATOM 1064 C CG  . GLU A 1 144 ? -17.913 -0.390  -9.064  1.0 94.46 ? 144 GLU A CG  1 P00221 UNP 144 E 
+ATOM 1065 C CD  . GLU A 1 144 ? -18.100 1.020   -8.460  1.0 94.46 ? 144 GLU A CD  1 P00221 UNP 144 E 
+ATOM 1066 O OE1 . GLU A 1 144 ? -18.119 2.007   -9.229  1.0 94.46 ? 144 GLU A OE1 1 P00221 UNP 144 E 
+ATOM 1067 O OE2 . GLU A 1 144 ? -18.266 1.162   -7.219  1.0 94.46 ? 144 GLU A OE2 1 P00221 UNP 144 E 
+ATOM 1068 N N   . LEU A 1 145 ? -14.961 -3.332  -9.244  1.0 92.47 ? 145 LEU A N   1 P00221 UNP 145 L 
+ATOM 1069 C CA  . LEU A 1 145 ? -13.836 -3.560  -10.158 1.0 92.47 ? 145 LEU A CA  1 P00221 UNP 145 L 
+ATOM 1070 C C   . LEU A 1 145 ? -13.966 -4.881  -10.934 1.0 92.47 ? 145 LEU A C   1 P00221 UNP 145 L 
+ATOM 1071 C CB  . LEU A 1 145 ? -12.540 -3.538  -9.326  1.0 92.47 ? 145 LEU A CB  1 P00221 UNP 145 L 
+ATOM 1072 O O   . LEU A 1 145 ? -13.418 -5.020  -12.024 1.0 92.47 ? 145 LEU A O   1 P00221 UNP 145 L 
+ATOM 1073 C CG  . LEU A 1 145 ? -11.241 -3.708  -10.137 1.0 92.47 ? 145 LEU A CG  1 P00221 UNP 145 L 
+ATOM 1074 C CD1 . LEU A 1 145 ? -11.015 -2.586  -11.148 1.0 92.47 ? 145 LEU A CD1 1 P00221 UNP 145 L 
+ATOM 1075 C CD2 . LEU A 1 145 ? -10.056 -3.706  -9.173  1.0 92.47 ? 145 LEU A CD2 1 P00221 UNP 145 L 
+ATOM 1076 N N   . THR A 1 146 ? -14.643 -5.869  -10.347 1.0 89.15 ? 146 THR A N   1 P00221 UNP 146 T 
+ATOM 1077 C CA  . THR A 1 146 ? -14.746 -7.238  -10.883 1.0 89.15 ? 146 THR A CA  1 P00221 UNP 146 T 
+ATOM 1078 C C   . THR A 1 146 ? -16.092 -7.555  -11.542 1.0 89.15 ? 146 THR A C   1 P00221 UNP 146 T 
+ATOM 1079 C CB  . THR A 1 146 ? -14.414 -8.279  -9.802  1.0 89.15 ? 146 THR A CB  1 P00221 UNP 146 T 
+ATOM 1080 O O   . THR A 1 146 ? -16.254 -8.661  -12.066 1.0 89.15 ? 146 THR A O   1 P00221 UNP 146 T 
+ATOM 1081 C CG2 . THR A 1 146 ? -12.952 -8.206  -9.357  1.0 89.15 ? 146 THR A CG2 1 P00221 UNP 146 T 
+ATOM 1082 O OG1 . THR A 1 146 ? -15.195 -8.107  -8.642  1.0 89.15 ? 146 THR A OG1 1 P00221 UNP 146 T 
+ATOM 1083 N N   . ALA A 1 147 ? -17.037 -6.611  -11.517 1.0 87.34 ? 147 ALA A N   1 P00221 UNP 147 A 
+ATOM 1084 C CA  . ALA A 1 147 ? -18.352 -6.709  -12.156 1.0 87.34 ? 147 ALA A CA  1 P00221 UNP 147 A 
+ATOM 1085 C C   . ALA A 1 147 ? -18.301 -6.389  -13.658 1.0 87.34 ? 147 ALA A C   1 P00221 UNP 147 A 
+ATOM 1086 C CB  . ALA A 1 147 ? -19.326 -5.786  -11.410 1.0 87.34 ? 147 ALA A CB  1 P00221 UNP 147 A 
+ATOM 1087 O O   . ALA A 1 147 ? -19.040 -7.071  -14.409 1.0 87.34 ? 147 ALA A O   1 P00221 UNP 147 A 
+ATOM 1088 O OXT . ALA A 1 147 ? -17.582 -5.437  -14.021 1.0 87.34 ? 147 ALA A OXT 1 P00221 UNP 147 A 
+#

diff --git a/examples/AlphaFold/AF-P00221-F1-model_v4.pdb b/examples/AlphaFold/AF-P00221-F1-model_v4.pdb
new file mode 100644 (file)
index 0000000..82570c2
--- /dev/null
+++ b/examples/AlphaFold/AF-P00221-F1-model_v4.pdb
@@ -0,0 +1,1149 @@
+HEADER                                            01-JUN-22                     
+TITLE     ALPHAFOLD MONOMER V2.0 PREDICTION FOR FERREDOXIN-1, CHLOROPLASTIC     
+TITLE    2 (P00221)                                                             
+COMPND    MOL_ID: 1;                                                            
+COMPND   2 MOLECULE: FERREDOXIN-1, CHLOROPLASTIC;                               
+COMPND   3 CHAIN: A                                                             
+SOURCE    MOL_ID: 1;                                                            
+SOURCE   2 ORGANISM_SCIENTIFIC: SPINACIA OLERACEA;                              
+SOURCE   3 ORGANISM_TAXID: 3562                                                 
+REMARK   1                                                                      
+REMARK   1 REFERENCE 1                                                          
+REMARK   1  AUTH   JOHN JUMPER, RICHARD EVANS, ALEXANDER PRITZEL, TIM GREEN,    
+REMARK   1  AUTH 2 MICHAEL FIGURNOV, OLAF RONNEBERGER, KATHRYN TUNYASUVUNAKOOL, 
+REMARK   1  AUTH 3 RUSS BATES, AUGUSTIN ZIDEK, ANNA POTAPENKO, ALEX BRIDGLAND,  
+REMARK   1  AUTH 4 CLEMENS MEYER, SIMON A A KOHL, ANDREW J BALLARD,             
+REMARK   1  AUTH 5 ANDREW COWIE, BERNARDINO ROMERA-PAREDES, STANISLAV NIKOLOV,  
+REMARK   1  AUTH 6 RISHUB JAIN, JONAS ADLER, TREVOR BACK, STIG PETERSEN,        
+REMARK   1  AUTH 7 DAVID REIMAN, ELLEN CLANCY, MICHAL ZIELINSKI,                
+REMARK   1  AUTH 8 MARTIN STEINEGGER, MICHALINA PACHOLSKA, TAMAS BERGHAMMER,    
+REMARK   1  AUTH 9 DAVID SILVER, ORIOL VINYALS, ANDREW W SENIOR,                
+REMARK   1  AUTH10 KORAY KAVUKCUOGLU, PUSHMEET KOHLI, DEMIS HASSABIS            
+REMARK   1  TITL   HIGHLY ACCURATE PROTEIN STRUCTURE PREDICTION WITH ALPHAFOLD  
+REMARK   1  REF    NATURE                        V. 596   583 2021              
+REMARK   1  REFN                   ISSN 0028-0836                               
+REMARK   1  PMID   34265844                                                     
+REMARK   1  DOI    10.1038/s41586-021-03819-2                                   
+REMARK   1                                                                      
+REMARK   1 DISCLAIMERS                                                          
+REMARK   1 ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE  
+REMARK   1 INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD
+REMARK   1 BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY 
+REMARK   1 OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT 
+REMARK   1 USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD    
+REMARK   1 PARTY. THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR        
+REMARK   1 PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT   
+REMARK   1 CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR 
+REMARK   1 ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE.           
+DBREF  XXXX A    1   147  UNP    P00221   FER1_SPIOL       1    147             
+SEQRES   1 A  147  MET ALA ALA THR THR THR THR MET MET GLY MET ALA THR          
+SEQRES   2 A  147  THR PHE VAL PRO LYS PRO GLN ALA PRO PRO MET MET ALA          
+SEQRES   3 A  147  ALA LEU PRO SER ASN THR GLY ARG SER LEU PHE GLY LEU          
+SEQRES   4 A  147  LYS THR GLY SER ARG GLY GLY ARG MET THR MET ALA ALA          
+SEQRES   5 A  147  TYR LYS VAL THR LEU VAL THR PRO THR GLY ASN VAL GLU          
+SEQRES   6 A  147  PHE GLN CYS PRO ASP ASP VAL TYR ILE LEU ASP ALA ALA          
+SEQRES   7 A  147  GLU GLU GLU GLY ILE ASP LEU PRO TYR SER CYS ARG ALA          
+SEQRES   8 A  147  GLY SER CYS SER SER CYS ALA GLY LYS LEU LYS THR GLY          
+SEQRES   9 A  147  SER LEU ASN GLN ASP ASP GLN SER PHE LEU ASP ASP ASP          
+SEQRES  10 A  147  GLN ILE ASP GLU GLY TRP VAL LEU THR CYS ALA ALA TYR          
+SEQRES  11 A  147  PRO VAL SER ASP VAL THR ILE GLU THR HIS LYS GLU GLU          
+SEQRES  12 A  147  GLU LEU THR ALA                                              
+CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
+ORIGX1      1.000000  0.000000  0.000000        0.00000                         
+ORIGX2      0.000000  1.000000  0.000000        0.00000                         
+ORIGX3      0.000000  0.000000  1.000000        0.00000                         
+SCALE1      1.000000  0.000000  0.000000        0.00000                         
+SCALE2      0.000000  1.000000  0.000000        0.00000                         
+SCALE3      0.000000  0.000000  1.000000        0.00000                         
+MODEL        1                                                                  
+ATOM      1  N   MET A   1     -39.014   9.370 -46.392  1.00 56.42           N  
+ATOM      2  CA  MET A   1     -38.101   9.939 -47.404  1.00 56.42           C  
+ATOM      3  C   MET A   1     -37.586  11.272 -46.873  1.00 56.42           C  
+ATOM      4  CB  MET A   1     -38.814  10.144 -48.758  1.00 56.42           C  
+ATOM      5  O   MET A   1     -38.287  12.259 -47.001  1.00 56.42           O  
+ATOM      6  CG  MET A   1     -39.336   8.853 -49.398  1.00 56.42           C  
+ATOM      7  SD  MET A   1     -40.197   9.160 -50.960  1.00 56.42           S  
+ATOM      8  CE  MET A   1     -40.798   7.495 -51.352  1.00 56.42           C  
+ATOM      9  N   ALA A   2     -36.441  11.282 -46.191  1.00 52.97           N  
+ATOM     10  CA  ALA A   2     -35.633  12.474 -45.908  1.00 52.97           C  
+ATOM     11  C   ALA A   2     -34.298  11.969 -45.346  1.00 52.97           C  
+ATOM     12  CB  ALA A   2     -36.323  13.418 -44.914  1.00 52.97           C  
+ATOM     13  O   ALA A   2     -34.277  11.276 -44.333  1.00 52.97           O  
+ATOM     14  N   ALA A   3     -33.226  12.210 -46.094  1.00 60.41           N  
+ATOM     15  CA  ALA A   3     -31.889  11.705 -45.836  1.00 60.41           C  
+ATOM     16  C   ALA A   3     -31.203  12.519 -44.731  1.00 60.41           C  
+ATOM     17  CB  ALA A   3     -31.119  11.774 -47.162  1.00 60.41           C  
+ATOM     18  O   ALA A   3     -31.166  13.746 -44.800  1.00 60.41           O  
+ATOM     19  N   THR A   4     -30.639  11.836 -43.738  1.00 75.74           N  
+ATOM     20  CA  THR A   4     -29.713  12.408 -42.759  1.00 75.74           C  
+ATOM     21  C   THR A   4     -28.288  12.255 -43.286  1.00 75.74           C  
+ATOM     22  CB  THR A   4     -29.885  11.755 -41.378  1.00 75.74           C  
+ATOM     23  O   THR A   4     -27.767  11.154 -43.439  1.00 75.74           O  
+ATOM     24  CG2 THR A   4     -31.086  12.351 -40.643  1.00 75.74           C  
+ATOM     25  OG1 THR A   4     -30.133  10.370 -41.494  1.00 75.74           O  
+ATOM     26  N   THR A   5     -27.675  13.384 -43.629  1.00 73.15           N  
+ATOM     27  CA  THR A   5     -26.292  13.499 -44.093  1.00 73.15           C  
+ATOM     28  C   THR A   5     -25.312  13.322 -42.938  1.00 73.15           C  
+ATOM     29  CB  THR A   5     -26.068  14.866 -44.758  1.00 73.15           C  
+ATOM     30  O   THR A   5     -25.357  14.052 -41.950  1.00 73.15           O  
+ATOM     31  CG2 THR A   5     -26.638  14.892 -46.177  1.00 73.15           C  
+ATOM     32  OG1 THR A   5     -26.727  15.872 -44.019  1.00 73.15           O  
+ATOM     33  N   THR A   6     -24.420  12.351 -43.099  1.00 67.00           N  
+ATOM     34  CA  THR A   6     -23.256  12.052 -42.263  1.00 67.00           C  
+ATOM     35  C   THR A   6     -22.177  13.123 -42.448  1.00 67.00           C  
+ATOM     36  CB  THR A   6     -22.698  10.685 -42.709  1.00 67.00           C  
+ATOM     37  O   THR A   6     -21.684  13.305 -43.560  1.00 67.00           O  
+ATOM     38  CG2 THR A   6     -21.659  10.094 -41.760  1.00 67.00           C  
+ATOM     39  OG1 THR A   6     -23.744   9.744 -42.826  1.00 67.00           O  
+ATOM     40  N   THR A   7     -21.772  13.797 -41.371  1.00 68.61           N  
+ATOM     41  CA  THR A   7     -20.586  14.668 -41.358  1.00 68.61           C  
+ATOM     42  C   THR A   7     -19.461  13.943 -40.633  1.00 68.61           C  
+ATOM     43  CB  THR A   7     -20.860  16.037 -40.714  1.00 68.61           C  
+ATOM     44  O   THR A   7     -19.570  13.644 -39.447  1.00 68.61           O  
+ATOM     45  CG2 THR A   7     -19.727  17.030 -40.983  1.00 68.61           C  
+ATOM     46  OG1 THR A   7     -22.024  16.606 -41.266  1.00 68.61           O  
+ATOM     47  N   MET A   8     -18.394  13.636 -41.369  1.00 67.08           N  
+ATOM     48  CA  MET A   8     -17.144  13.096 -40.846  1.00 67.08           C  
+ATOM     49  C   MET A   8     -16.195  14.248 -40.479  1.00 67.08           C  
+ATOM     50  CB  MET A   8     -16.487  12.177 -41.894  1.00 67.08           C  
+ATOM     51  O   MET A   8     -15.835  15.048 -41.336  1.00 67.08           O  
+ATOM     52  CG  MET A   8     -17.331  10.945 -42.243  1.00 67.08           C  
+ATOM     53  SD  MET A   8     -16.394   9.671 -43.131  1.00 67.08           S  
+ATOM     54  CE  MET A   8     -17.646   8.366 -43.244  1.00 67.08           C  
+ATOM     55  N   MET A   9     -15.749  14.292 -39.227  1.00 67.60           N  
+ATOM     56  CA  MET A   9     -14.502  14.928 -38.780  1.00 67.60           C  
+ATOM     57  C   MET A   9     -13.861  13.880 -37.856  1.00 67.60           C  
+ATOM     58  CB  MET A   9     -14.779  16.249 -38.030  1.00 67.60           C  
+ATOM     59  O   MET A   9     -14.491  13.455 -36.899  1.00 67.60           O  
+ATOM     60  CG  MET A   9     -14.778  17.512 -38.909  1.00 67.60           C  
+ATOM     61  SD  MET A   9     -16.392  18.248 -39.302  1.00 67.60           S  
+ATOM     62  CE  MET A   9     -15.832  19.839 -39.972  1.00 67.60           C  
+ATOM     63  N   GLY A  10     -12.709  13.281 -38.147  1.00 61.80           N  
+ATOM     64  CA  GLY A  10     -11.450  13.942 -38.472  1.00 61.80           C  
+ATOM     65  C   GLY A  10     -10.628  14.061 -37.186  1.00 61.80           C  
+ATOM     66  O   GLY A  10     -10.470  15.160 -36.672  1.00 61.80           O  
+ATOM     67  N   MET A  11     -10.169  12.933 -36.630  1.00 68.90           N  
+ATOM     68  CA  MET A  11      -9.299  12.907 -35.449  1.00 68.90           C  
+ATOM     69  C   MET A  11      -7.849  12.748 -35.907  1.00 68.90           C  
+ATOM     70  CB  MET A  11      -9.730  11.809 -34.464  1.00 68.90           C  
+ATOM     71  O   MET A  11      -7.453  11.704 -36.420  1.00 68.90           O  
+ATOM     72  CG  MET A  11     -11.105  12.118 -33.862  1.00 68.90           C  
+ATOM     73  SD  MET A  11     -11.617  10.959 -32.571  1.00 68.90           S  
+ATOM     74  CE  MET A  11     -13.085  11.820 -31.949  1.00 68.90           C  
+ATOM     75  N   ALA A  12      -7.081  13.827 -35.776  1.00 61.95           N  
+ATOM     76  CA  ALA A  12      -5.652  13.854 -36.038  1.00 61.95           C  
+ATOM     77  C   ALA A  12      -4.907  13.176 -34.879  1.00 61.95           C  
+ATOM     78  CB  ALA A  12      -5.228  15.317 -36.228  1.00 61.95           C  
+ATOM     79  O   ALA A  12      -4.921  13.666 -33.754  1.00 61.95           O  
+ATOM     80  N   THR A  13      -4.245  12.056 -35.156  1.00 68.99           N  
+ATOM     81  CA  THR A  13      -3.341  11.386 -34.216  1.00 68.99           C  
+ATOM     82  C   THR A  13      -1.956  12.025 -34.298  1.00 68.99           C  
+ATOM     83  CB  THR A  13      -3.259   9.881 -34.519  1.00 68.99           C  
+ATOM     84  O   THR A  13      -1.209  11.795 -35.252  1.00 68.99           O  
+ATOM     85  CG2 THR A  13      -4.580   9.169 -34.230  1.00 68.99           C  
+ATOM     86  OG1 THR A  13      -2.949   9.691 -35.883  1.00 68.99           O  
+ATOM     87  N   THR A  14      -1.594  12.836 -33.308  1.00 70.93           N  
+ATOM     88  CA  THR A  14      -0.216  13.297 -33.105  1.00 70.93           C  
+ATOM     89  C   THR A  14       0.611  12.185 -32.464  1.00 70.93           C  
+ATOM     90  CB  THR A  14      -0.162  14.578 -32.257  1.00 70.93           C  
+ATOM     91  O   THR A  14       0.535  11.946 -31.263  1.00 70.93           O  
+ATOM     92  CG2 THR A  14      -0.412  15.813 -33.121  1.00 70.93           C  
+ATOM     93  OG1 THR A  14      -1.151  14.557 -31.254  1.00 70.93           O  
+ATOM     94  N   PHE A  15       1.408  11.510 -33.290  1.00 65.35           N  
+ATOM     95  CA  PHE A  15       2.501  10.634 -32.877  1.00 65.35           C  
+ATOM     96  C   PHE A  15       3.608  11.463 -32.206  1.00 65.35           C  
+ATOM     97  CB  PHE A  15       3.057   9.914 -34.122  1.00 65.35           C  
+ATOM     98  O   PHE A  15       4.233  12.301 -32.856  1.00 65.35           O  
+ATOM     99  CG  PHE A  15       2.510   8.521 -34.363  1.00 65.35           C  
+ATOM    100  CD1 PHE A  15       3.308   7.404 -34.051  1.00 65.35           C  
+ATOM    101  CD2 PHE A  15       1.222   8.331 -34.900  1.00 65.35           C  
+ATOM    102  CE1 PHE A  15       2.824   6.103 -34.272  1.00 65.35           C  
+ATOM    103  CE2 PHE A  15       0.737   7.028 -35.118  1.00 65.35           C  
+ATOM    104  CZ  PHE A  15       1.538   5.915 -34.805  1.00 65.35           C  
+ATOM    105  N   VAL A  16       3.879  11.206 -30.924  1.00 69.16           N  
+ATOM    106  CA  VAL A  16       5.053  11.728 -30.209  1.00 69.16           C  
+ATOM    107  C   VAL A  16       6.105  10.614 -30.129  1.00 69.16           C  
+ATOM    108  CB  VAL A  16       4.685  12.247 -28.804  1.00 69.16           C  
+ATOM    109  O   VAL A  16       5.853   9.591 -29.492  1.00 69.16           O  
+ATOM    110  CG1 VAL A  16       5.923  12.780 -28.066  1.00 69.16           C  
+ATOM    111  CG2 VAL A  16       3.664  13.390 -28.891  1.00 69.16           C  
+ATOM    112  N   PRO A  17       7.283  10.760 -30.762  1.00 68.00           N  
+ATOM    113  CA  PRO A  17       8.367   9.795 -30.622  1.00 68.00           C  
+ATOM    114  C   PRO A  17       9.140  10.019 -29.310  1.00 68.00           C  
+ATOM    115  CB  PRO A  17       9.225   9.974 -31.876  1.00 68.00           C  
+ATOM    116  O   PRO A  17       9.602  11.122 -29.017  1.00 68.00           O  
+ATOM    117  CG  PRO A  17       9.023  11.444 -32.246  1.00 68.00           C  
+ATOM    118  CD  PRO A  17       7.616  11.776 -31.748  1.00 68.00           C  
+ATOM    119  N   LYS A  18       9.303   8.946 -28.527  1.00 66.26           N  
+ATOM    120  CA  LYS A  18      10.091   8.895 -27.284  1.00 66.26           C  
+ATOM    121  C   LYS A  18      11.603   8.938 -27.597  1.00 66.26           C  
+ATOM    122  CB  LYS A  18       9.671   7.623 -26.519  1.00 66.26           C  
+ATOM    123  O   LYS A  18      12.047   8.200 -28.480  1.00 66.26           O  
+ATOM    124  CG  LYS A  18      10.240   7.480 -25.097  1.00 66.26           C  
+ATOM    125  CD  LYS A  18       9.583   6.288 -24.372  1.00 66.26           C  
+ATOM    126  CE  LYS A  18      10.233   6.032 -23.003  1.00 66.26           C  
+ATOM    127  NZ  LYS A  18       9.415   5.123 -22.151  1.00 66.26           N  
+ATOM    128  N   PRO A  19      12.415   9.751 -26.894  1.00 67.49           N  
+ATOM    129  CA  PRO A  19      13.861   9.796 -27.100  1.00 67.49           C  
+ATOM    130  C   PRO A  19      14.553   8.556 -26.510  1.00 67.49           C  
+ATOM    131  CB  PRO A  19      14.326  11.109 -26.464  1.00 67.49           C  
+ATOM    132  O   PRO A  19      14.304   8.164 -25.370  1.00 67.49           O  
+ATOM    133  CG  PRO A  19      13.292  11.364 -25.367  1.00 67.49           C  
+ATOM    134  CD  PRO A  19      12.006  10.748 -25.916  1.00 67.49           C  
+ATOM    135  N   GLN A  20      15.431   7.942 -27.305  1.00 60.48           N  
+ATOM    136  CA  GLN A  20      16.304   6.832 -26.914  1.00 60.48           C  
+ATOM    137  C   GLN A  20      17.501   7.354 -26.101  1.00 60.48           C  
+ATOM    138  CB  GLN A  20      16.795   6.101 -28.179  1.00 60.48           C  
+ATOM    139  O   GLN A  20      18.190   8.279 -26.531  1.00 60.48           O  
+ATOM    140  CG  GLN A  20      15.684   5.314 -28.899  1.00 60.48           C  
+ATOM    141  CD  GLN A  20      16.153   4.671 -30.206  1.00 60.48           C  
+ATOM    142  NE2 GLN A  20      15.459   3.669 -30.698  1.00 60.48           N  
+ATOM    143  OE1 GLN A  20      17.131   5.056 -30.823  1.00 60.48           O  
+ATOM    144  N   ALA A  21      17.770   6.744 -24.944  1.00 63.79           N  
+ATOM    145  CA  ALA A  21      18.982   6.983 -24.163  1.00 63.79           C  
+ATOM    146  C   ALA A  21      20.168   6.174 -24.736  1.00 63.79           C  
+ATOM    147  CB  ALA A  21      18.708   6.618 -22.698  1.00 63.79           C  
+ATOM    148  O   ALA A  21      19.989   4.997 -25.060  1.00 63.79           O  
+ATOM    149  N   PRO A  22      21.377   6.755 -24.859  1.00 69.72           N  
+ATOM    150  CA  PRO A  22      22.566   6.021 -25.281  1.00 69.72           C  
+ATOM    151  C   PRO A  22      23.206   5.223 -24.125  1.00 69.72           C  
+ATOM    152  CB  PRO A  22      23.510   7.080 -25.849  1.00 69.72           C  
+ATOM    153  O   PRO A  22      23.093   5.618 -22.961  1.00 69.72           O  
+ATOM    154  CG  PRO A  22      23.172   8.319 -25.020  1.00 69.72           C  
+ATOM    155  CD  PRO A  22      21.677   8.173 -24.730  1.00 69.72           C  
+ATOM    156  N   PRO A  23      23.908   4.114 -24.428  1.00 54.38           N  
+ATOM    157  CA  PRO A  23      24.531   3.259 -23.429  1.00 54.38           C  
+ATOM    158  C   PRO A  23      25.875   3.820 -22.933  1.00 54.38           C  
+ATOM    159  CB  PRO A  23      24.677   1.898 -24.119  1.00 54.38           C  
+ATOM    160  O   PRO A  23      26.640   4.425 -23.680  1.00 54.38           O  
+ATOM    161  CG  PRO A  23      24.928   2.278 -25.575  1.00 54.38           C  
+ATOM    162  CD  PRO A  23      24.106   3.552 -25.758  1.00 54.38           C  
+ATOM    163  N   MET A  24      26.130   3.557 -21.647  1.00 54.35           N  
+ATOM    164  CA  MET A  24      27.420   3.347 -20.972  1.00 54.35           C  
+ATOM    165  C   MET A  24      28.663   3.269 -21.879  1.00 54.35           C  
+ATOM    166  CB  MET A  24      27.288   2.023 -20.174  1.00 54.35           C  
+ATOM    167  O   MET A  24      28.665   2.495 -22.828  1.00 54.35           O  
+ATOM    168  CG  MET A  24      26.918   0.804 -21.048  1.00 54.35           C  
+ATOM    169  SD  MET A  24      26.336  -0.675 -20.187  1.00 54.35           S  
+ATOM    170  CE  MET A  24      25.725  -1.615 -21.619  1.00 54.35           C  
+ATOM    171  N   MET A  25      29.736   3.994 -21.521  1.00 57.94           N  
+ATOM    172  CA  MET A  25      31.137   3.522 -21.443  1.00 57.94           C  
+ATOM    173  C   MET A  25      32.107   4.684 -21.139  1.00 57.94           C  
+ATOM    174  CB  MET A  25      31.622   2.799 -22.721  1.00 57.94           C  
+ATOM    175  O   MET A  25      32.029   5.750 -21.737  1.00 57.94           O  
+ATOM    176  CG  MET A  25      31.249   1.303 -22.751  1.00 57.94           C  
+ATOM    177  SD  MET A  25      32.392   0.111 -22.025  1.00 57.94           S  
+ATOM    178  CE  MET A  25      31.287  -1.331 -22.097  1.00 57.94           C  
+ATOM    179  N   ALA A  26      33.075   4.375 -20.269  1.00 54.08           N  
+ATOM    180  CA  ALA A  26      34.419   4.952 -20.157  1.00 54.08           C  
+ATOM    181  C   ALA A  26      34.587   6.408 -19.664  1.00 54.08           C  
+ATOM    182  CB  ALA A  26      35.161   4.695 -21.477  1.00 54.08           C  
+ATOM    183  O   ALA A  26      34.390   7.367 -20.397  1.00 54.08           O  
+ATOM    184  N   ALA A  27      35.151   6.570 -18.462  1.00 53.27           N  
+ATOM    185  CA  ALA A  27      36.600   6.774 -18.296  1.00 53.27           C  
+ATOM    186  C   ALA A  27      36.923   7.323 -16.892  1.00 53.27           C  
+ATOM    187  CB  ALA A  27      37.186   7.717 -19.361  1.00 53.27           C  
+ATOM    188  O   ALA A  27      36.566   8.443 -16.539  1.00 53.27           O  
+ATOM    189  N   LEU A  28      37.655   6.530 -16.107  1.00 53.66           N  
+ATOM    190  CA  LEU A  28      38.425   7.000 -14.954  1.00 53.66           C  
+ATOM    191  C   LEU A  28      39.713   7.659 -15.466  1.00 53.66           C  
+ATOM    192  CB  LEU A  28      38.781   5.786 -14.071  1.00 53.66           C  
+ATOM    193  O   LEU A  28      40.328   7.138 -16.401  1.00 53.66           O  
+ATOM    194  CG  LEU A  28      37.589   5.186 -13.302  1.00 53.66           C  
+ATOM    195  CD1 LEU A  28      37.835   3.706 -13.007  1.00 53.66           C  
+ATOM    196  CD2 LEU A  28      37.377   5.913 -11.974  1.00 53.66           C  
+ATOM    197  N   PRO A  29      40.194   8.715 -14.795  1.00 58.78           N  
+ATOM    198  CA  PRO A  29      41.602   8.685 -14.429  1.00 58.78           C  
+ATOM    199  C   PRO A  29      41.873   9.128 -12.988  1.00 58.78           C  
+ATOM    200  CB  PRO A  29      42.333   9.560 -15.447  1.00 58.78           C  
+ATOM    201  O   PRO A  29      41.378  10.136 -12.487  1.00 58.78           O  
+ATOM    202  CG  PRO A  29      41.267  10.542 -15.933  1.00 58.78           C  
+ATOM    203  CD  PRO A  29      39.944  10.041 -15.343  1.00 58.78           C  
+ATOM    204  N   SER A  30      42.752   8.344 -12.369  1.00 56.77           N  
+ATOM    205  CA  SER A  30      43.668   8.691 -11.289  1.00 56.77           C  
+ATOM    206  C   SER A  30      44.260  10.093 -11.456  1.00 56.77           C  
+ATOM    207  CB  SER A  30      44.853   7.710 -11.388  1.00 56.77           C  
+ATOM    208  O   SER A  30      44.618  10.444 -12.576  1.00 56.77           O  
+ATOM    209  OG  SER A  30      44.410   6.372 -11.553  1.00 56.77           O  
+ATOM    210  N   ASN A  31      44.463  10.832 -10.357  1.00 63.36           N  
+ATOM    211  CA  ASN A  31      45.768  11.393  -9.957  1.00 63.36           C  
+ATOM    212  C   ASN A  31      45.614  12.475  -8.859  1.00 63.36           C  
+ATOM    213  CB  ASN A  31      46.575  11.969 -11.150  1.00 63.36           C  
+ATOM    214  O   ASN A  31      45.147  13.575  -9.115  1.00 63.36           O  
+ATOM    215  CG  ASN A  31      48.038  12.187 -10.869  1.00 63.36           C  
+ATOM    216  ND2 ASN A  31      48.645  13.181 -11.465  1.00 63.36           N  
+ATOM    217  OD1 ASN A  31      48.677  11.424 -10.167  1.00 63.36           O  
+ATOM    218  N   THR A  32      46.108  12.141  -7.664  1.00 54.93           N  
+ATOM    219  CA  THR A  32      47.033  12.944  -6.839  1.00 54.93           C  
+ATOM    220  C   THR A  32      46.662  14.357  -6.373  1.00 54.93           C  
+ATOM    221  CB  THR A  32      48.407  12.958  -7.522  1.00 54.93           C  
+ATOM    222  O   THR A  32      46.634  15.313  -7.138  1.00 54.93           O  
+ATOM    223  CG2 THR A  32      49.533  13.643  -6.754  1.00 54.93           C  
+ATOM    224  OG1 THR A  32      48.804  11.616  -7.640  1.00 54.93           O  
+ATOM    225  N   GLY A  33      46.630  14.511  -5.043  1.00 56.81           N  
+ATOM    226  CA  GLY A  33      46.861  15.785  -4.352  1.00 56.81           C  
+ATOM    227  C   GLY A  33      46.065  15.890  -3.048  1.00 56.81           C  
+ATOM    228  O   GLY A  33      44.940  16.353  -3.052  1.00 56.81           O  
+ATOM    229  N   ARG A  34      46.548  15.344  -1.926  1.00 51.39           N  
+ATOM    230  CA  ARG A  34      47.347  16.091  -0.932  1.00 51.39           C  
+ATOM    231  C   ARG A  34      46.556  17.221  -0.246  1.00 51.39           C  
+ATOM    232  CB  ARG A  34      48.669  16.563  -1.577  1.00 51.39           C  
+ATOM    233  O   ARG A  34      46.625  18.359  -0.678  1.00 51.39           O  
+ATOM    234  CG  ARG A  34      49.687  17.235  -0.641  1.00 51.39           C  
+ATOM    235  CD  ARG A  34      51.028  17.363  -1.388  1.00 51.39           C  
+ATOM    236  NE  ARG A  34      51.769  18.586  -1.017  1.00 51.39           N  
+ATOM    237  NH1 ARG A  34      52.138  19.415  -3.144  1.00 51.39           N  
+ATOM    238  NH2 ARG A  34      52.886  20.539  -1.376  1.00 51.39           N  
+ATOM    239  CZ  ARG A  34      52.256  19.499  -1.846  1.00 51.39           C  
+ATOM    240  N   SER A  35      45.935  16.919   0.896  1.00 52.75           N  
+ATOM    241  CA  SER A  35      46.165  17.685   2.132  1.00 52.75           C  
+ATOM    242  C   SER A  35      45.643  16.922   3.348  1.00 52.75           C  
+ATOM    243  CB  SER A  35      45.559  19.093   2.142  1.00 52.75           C  
+ATOM    244  O   SER A  35      44.482  16.532   3.418  1.00 52.75           O  
+ATOM    245  OG  SER A  35      46.184  19.813   3.193  1.00 52.75           O  
+ATOM    246  N   LEU A  36      46.551  16.717   4.298  1.00 54.39           N  
+ATOM    247  CA  LEU A  36      46.304  16.287   5.668  1.00 54.39           C  
+ATOM    248  C   LEU A  36      45.699  17.458   6.468  1.00 54.39           C  
+ATOM    249  CB  LEU A  36      47.669  15.857   6.250  1.00 54.39           C  
+ATOM    250  O   LEU A  36      45.882  18.612   6.085  1.00 54.39           O  
+ATOM    251  CG  LEU A  36      48.251  14.564   5.636  1.00 54.39           C  
+ATOM    252  CD1 LEU A  36      49.779  14.610   5.598  1.00 54.39           C  
+ATOM    253  CD2 LEU A  36      47.826  13.347   6.457  1.00 54.39           C  
+ATOM    254  N   PHE A  37      45.088  17.134   7.612  1.00 44.45           N  
+ATOM    255  CA  PHE A  37      44.546  18.027   8.653  1.00 44.45           C  
+ATOM    256  C   PHE A  37      43.172  18.655   8.386  1.00 44.45           C  
+ATOM    257  CB  PHE A  37      45.574  19.069   9.126  1.00 44.45           C  
+ATOM    258  O   PHE A  37      43.037  19.649   7.684  1.00 44.45           O  
+ATOM    259  CG  PHE A  37      46.672  18.475   9.975  1.00 44.45           C  
+ATOM    260  CD1 PHE A  37      46.537  18.487  11.374  1.00 44.45           C  
+ATOM    261  CD2 PHE A  37      47.807  17.891   9.383  1.00 44.45           C  
+ATOM    262  CE1 PHE A  37      47.529  17.909  12.182  1.00 44.45           C  
+ATOM    263  CE2 PHE A  37      48.793  17.299  10.191  1.00 44.45           C  
+ATOM    264  CZ  PHE A  37      48.654  17.310  11.590  1.00 44.45           C  
+ATOM    265  N   GLY A  38      42.148  18.114   9.055  1.00 51.45           N  
+ATOM    266  CA  GLY A  38      40.809  18.702   9.051  1.00 51.45           C  
+ATOM    267  C   GLY A  38      39.759  17.914   9.827  1.00 51.45           C  
+ATOM    268  O   GLY A  38      38.642  17.756   9.355  1.00 51.45           O  
+ATOM    269  N   LEU A  39      40.101  17.397  11.010  1.00 53.14           N  
+ATOM    270  CA  LEU A  39      39.106  16.944  11.979  1.00 53.14           C  
+ATOM    271  C   LEU A  39      38.278  18.162  12.408  1.00 53.14           C  
+ATOM    272  CB  LEU A  39      39.855  16.323  13.184  1.00 53.14           C  
+ATOM    273  O   LEU A  39      38.760  18.950  13.219  1.00 53.14           O  
+ATOM    274  CG  LEU A  39      38.945  15.700  14.261  1.00 53.14           C  
+ATOM    275  CD1 LEU A  39      38.463  14.317  13.825  1.00 53.14           C  
+ATOM    276  CD2 LEU A  39      39.703  15.548  15.581  1.00 53.14           C  
+ATOM    277  N   LYS A  40      37.055  18.331  11.893  1.00 55.15           N  
+ATOM    278  CA  LYS A  40      36.002  19.040  12.632  1.00 55.15           C  
+ATOM    279  C   LYS A  40      34.601  18.850  12.045  1.00 55.15           C  
+ATOM    280  CB  LYS A  40      36.336  20.541  12.825  1.00 55.15           C  
+ATOM    281  O   LYS A  40      34.255  19.392  11.007  1.00 55.15           O  
+ATOM    282  CG  LYS A  40      36.486  20.839  14.329  1.00 55.15           C  
+ATOM    283  CD  LYS A  40      36.888  22.288  14.604  1.00 55.15           C  
+ATOM    284  CE  LYS A  40      37.055  22.473  16.118  1.00 55.15           C  
+ATOM    285  NZ  LYS A  40      36.893  23.892  16.514  1.00 55.15           N  
+ATOM    286  N   THR A  41      33.795  18.171  12.861  1.00 41.56           N  
+ATOM    287  CA  THR A  41      32.403  18.503  13.207  1.00 41.56           C  
+ATOM    288  C   THR A  41      31.346  18.529  12.107  1.00 41.56           C  
+ATOM    289  CB  THR A  41      32.314  19.804  14.033  1.00 41.56           C  
+ATOM    290  O   THR A  41      31.192  19.512  11.393  1.00 41.56           O  
+ATOM    291  CG2 THR A  41      32.717  19.566  15.486  1.00 41.56           C  
+ATOM    292  OG1 THR A  41      33.159  20.815  13.533  1.00 41.56           O  
+ATOM    293  N   GLY A  42      30.462  17.530  12.182  1.00 47.00           N  
+ATOM    294  CA  GLY A  42      29.032  17.754  11.987  1.00 47.00           C  
+ATOM    295  C   GLY A  42      28.445  17.043  10.783  1.00 47.00           C  
+ATOM    296  O   GLY A  42      28.078  17.695   9.811  1.00 47.00           O  
+ATOM    297  N   SER A  43      28.259  15.725  10.890  1.00 57.62           N  
+ATOM    298  CA  SER A  43      27.234  15.042  10.101  1.00 57.62           C  
+ATOM    299  C   SER A  43      25.874  15.578  10.557  1.00 57.62           C  
+ATOM    300  CB  SER A  43      27.340  13.519  10.262  1.00 57.62           C  
+ATOM    301  O   SER A  43      25.264  15.073  11.497  1.00 57.62           O  
+ATOM    302  OG  SER A  43      26.536  12.901   9.284  1.00 57.62           O  
+ATOM    303  N   ARG A  44      25.433  16.692   9.964  1.00 48.74           N  
+ATOM    304  CA  ARG A  44      24.026  17.087   9.983  1.00 48.74           C  
+ATOM    305  C   ARG A  44      23.314  16.088   9.082  1.00 48.74           C  
+ATOM    306  CB  ARG A  44      23.838  18.537   9.498  1.00 48.74           C  
+ATOM    307  O   ARG A  44      23.161  16.338   7.893  1.00 48.74           O  
+ATOM    308  CG  ARG A  44      24.181  19.584  10.566  1.00 48.74           C  
+ATOM    309  CD  ARG A  44      23.943  20.990  10.000  1.00 48.74           C  
+ATOM    310  NE  ARG A  44      24.103  22.036  11.031  1.00 48.74           N  
+ATOM    311  NH1 ARG A  44      24.420  23.811   9.606  1.00 48.74           N  
+ATOM    312  NH2 ARG A  44      24.371  24.163  11.808  1.00 48.74           N  
+ATOM    313  CZ  ARG A  44      24.298  23.326  10.811  1.00 48.74           C  
+ATOM    314  N   GLY A  45      22.942  14.941   9.651  1.00 54.92           N  
+ATOM    315  CA  GLY A  45      21.943  14.067   9.052  1.00 54.92           C  
+ATOM    316  C   GLY A  45      20.707  14.916   8.788  1.00 54.92           C  
+ATOM    317  O   GLY A  45      20.055  15.372   9.729  1.00 54.92           O  
+ATOM    318  N   GLY A  46      20.470  15.234   7.517  1.00 56.22           N  
+ATOM    319  CA  GLY A  46      19.290  15.960   7.089  1.00 56.22           C  
+ATOM    320  C   GLY A  46      18.082  15.105   7.425  1.00 56.22           C  
+ATOM    321  O   GLY A  46      17.857  14.083   6.789  1.00 56.22           O  
+ATOM    322  N   ARG A  47      17.340  15.497   8.460  1.00 59.12           N  
+ATOM    323  CA  ARG A  47      15.985  15.004   8.686  1.00 59.12           C  
+ATOM    324  C   ARG A  47      15.154  15.527   7.518  1.00 59.12           C  
+ATOM    325  CB  ARG A  47      15.463  15.511  10.043  1.00 59.12           C  
+ATOM    326  O   ARG A  47      14.759  16.689   7.545  1.00 59.12           O  
+ATOM    327  CG  ARG A  47      16.134  14.809  11.232  1.00 59.12           C  
+ATOM    328  CD  ARG A  47      15.638  15.409  12.554  1.00 59.12           C  
+ATOM    329  NE  ARG A  47      15.842  14.475  13.678  1.00 59.12           N  
+ATOM    330  NH1 ARG A  47      15.577  15.970  15.401  1.00 59.12           N  
+ATOM    331  NH2 ARG A  47      15.792  13.792  15.848  1.00 59.12           N  
+ATOM    332  CZ  ARG A  47      15.742  14.751  14.966  1.00 59.12           C  
+ATOM    333  N   MET A  48      14.995  14.716   6.472  1.00 61.00           N  
+ATOM    334  CA  MET A  48      13.955  14.929   5.468  1.00 61.00           C  
+ATOM    335  C   MET A  48      12.645  14.935   6.259  1.00 61.00           C  
+ATOM    336  CB  MET A  48      13.972  13.794   4.424  1.00 61.00           C  
+ATOM    337  O   MET A  48      12.292  13.938   6.883  1.00 61.00           O  
+ATOM    338  CG  MET A  48      15.235  13.736   3.546  1.00 61.00           C  
+ATOM    339  SD  MET A  48      15.199  14.753   2.043  1.00 61.00           S  
+ATOM    340  CE  MET A  48      16.717  14.196   1.226  1.00 61.00           C  
+ATOM    341  N   THR A  49      12.020  16.099   6.400  1.00 59.24           N  
+ATOM    342  CA  THR A  49      10.679  16.179   6.974  1.00 59.24           C  
+ATOM    343  C   THR A  49       9.741  15.592   5.931  1.00 59.24           C  
+ATOM    344  CB  THR A  49      10.298  17.632   7.300  1.00 59.24           C  
+ATOM    345  O   THR A  49       9.546  16.231   4.899  1.00 59.24           O  
+ATOM    346  CG2 THR A  49      11.093  18.174   8.491  1.00 59.24           C  
+ATOM    347  OG1 THR A  49      10.578  18.472   6.202  1.00 59.24           O  
+ATOM    348  N   MET A  50       9.240  14.383   6.175  1.00 79.45           N  
+ATOM    349  CA  MET A  50       8.248  13.734   5.314  1.00 79.45           C  
+ATOM    350  C   MET A  50       6.986  14.593   5.291  1.00 79.45           C  
+ATOM    351  CB  MET A  50       7.968  12.300   5.803  1.00 79.45           C  
+ATOM    352  O   MET A  50       6.570  15.102   6.342  1.00 79.45           O  
+ATOM    353  CG  MET A  50       9.249  11.454   5.922  1.00 79.45           C  
+ATOM    354  SD  MET A  50      10.398  11.565   4.519  1.00 79.45           S  
+ATOM    355  CE  MET A  50       9.469  10.566   3.342  1.00 79.45           C  
+ATOM    356  N   ALA A  51       6.433  14.841   4.104  1.00 91.56           N  
+ATOM    357  CA  ALA A  51       5.160  15.536   4.012  1.00 91.56           C  
+ATOM    358  C   ALA A  51       4.064  14.578   4.487  1.00 91.56           C  
+ATOM    359  CB  ALA A  51       4.934  16.057   2.588  1.00 91.56           C  
+ATOM    360  O   ALA A  51       4.138  13.378   4.254  1.00 91.56           O  
+ATOM    361  N   ALA A  52       3.057  15.098   5.181  1.00 95.10           N  
+ATOM    362  CA  ALA A  52       1.871  14.329   5.528  1.00 95.10           C  
+ATOM    363  C   ALA A  52       0.669  14.971   4.846  1.00 95.10           C  
+ATOM    364  CB  ALA A  52       1.720  14.232   7.050  1.00 95.10           C  
+ATOM    365  O   ALA A  52       0.546  16.202   4.833  1.00 95.10           O  
+ATOM    366  N   TYR A  53      -0.188  14.132   4.283  1.00 97.39           N  
+ATOM    367  CA  TYR A  53      -1.379  14.542   3.561  1.00 97.39           C  
+ATOM    368  C   TYR A  53      -2.631  14.015   4.246  1.00 97.39           C  
+ATOM    369  CB  TYR A  53      -1.295  14.063   2.112  1.00 97.39           C  
+ATOM    370  O   TYR A  53      -2.649  12.923   4.824  1.00 97.39           O  
+ATOM    371  CG  TYR A  53      -0.123  14.633   1.337  1.00 97.39           C  
+ATOM    372  CD1 TYR A  53      -0.064  16.014   1.061  1.00 97.39           C  
+ATOM    373  CD2 TYR A  53       0.915  13.789   0.904  1.00 97.39           C  
+ATOM    374  CE1 TYR A  53       1.043  16.549   0.370  1.00 97.39           C  
+ATOM    375  CE2 TYR A  53       2.005  14.315   0.189  1.00 97.39           C  
+ATOM    376  OH  TYR A  53       3.177  16.206  -0.686  1.00 97.39           O  
+ATOM    377  CZ  TYR A  53       2.085  15.698  -0.057  1.00 97.39           C  
+ATOM    378  N   LYS A  54      -3.713  14.787   4.142  1.00 97.92           N  
+ATOM    379  CA  LYS A  54      -5.016  14.377   4.650  1.00 97.92           C  
+ATOM    380  C   LYS A  54      -5.618  13.329   3.715  1.00 97.92           C  
+ATOM    381  CB  LYS A  54      -5.909  15.611   4.825  1.00 97.92           C  
+ATOM    382  O   LYS A  54      -5.936  13.620   2.562  1.00 97.92           O  
+ATOM    383  CG  LYS A  54      -7.288  15.203   5.350  1.00 97.92           C  
+ATOM    384  CD  LYS A  54      -8.208  16.406   5.570  1.00 97.92           C  
+ATOM    385  CE  LYS A  54      -9.594  15.814   5.820  1.00 97.92           C  
+ATOM    386  NZ  LYS A  54     -10.628  16.809   6.166  1.00 97.92           N  
+ATOM    387  N   VAL A  55      -5.860  12.135   4.243  1.00 98.15           N  
+ATOM    388  CA  VAL A  55      -6.557  11.056   3.540  1.00 98.15           C  
+ATOM    389  C   VAL A  55      -7.974  10.942   4.088  1.00 98.15           C  
+ATOM    390  CB  VAL A  55      -5.793   9.728   3.658  1.00 98.15           C  
+ATOM    391  O   VAL A  55      -8.179  10.772   5.287  1.00 98.15           O  
+ATOM    392  CG1 VAL A  55      -6.529   8.611   2.905  1.00 98.15           C  
+ATOM    393  CG2 VAL A  55      -4.379   9.849   3.078  1.00 98.15           C  
+ATOM    394  N   THR A  56      -8.963  11.042   3.201  1.00 98.06           N  
+ATOM    395  CA  THR A  56     -10.382  10.840   3.522  1.00 98.06           C  
+ATOM    396  C   THR A  56     -10.857   9.534   2.899  1.00 98.06           C  
+ATOM    397  CB  THR A  56     -11.229  12.021   3.029  1.00 98.06           C  
+ATOM    398  O   THR A  56     -10.897   9.411   1.675  1.00 98.06           O  
+ATOM    399  CG2 THR A  56     -12.694  11.910   3.457  1.00 98.06           C  
+ATOM    400  OG1 THR A  56     -10.691  13.223   3.538  1.00 98.06           O  
+ATOM    401  N   LEU A  57     -11.231   8.556   3.721  1.00 97.93           N  
+ATOM    402  CA  LEU A  57     -11.762   7.276   3.261  1.00 97.93           C  
+ATOM    403  C   LEU A  57     -13.282   7.270   3.401  1.00 97.93           C  
+ATOM    404  CB  LEU A  57     -11.137   6.102   4.023  1.00 97.93           C  
+ATOM    405  O   LEU A  57     -13.824   7.414   4.498  1.00 97.93           O  
+ATOM    406  CG  LEU A  57      -9.604   6.057   4.017  1.00 97.93           C  
+ATOM    407  CD1 LEU A  57      -9.154   4.961   4.979  1.00 97.93           C  
+ATOM    408  CD2 LEU A  57      -9.026   5.793   2.628  1.00 97.93           C  
+ATOM    409  N   VAL A  58     -13.974   7.069   2.286  1.00 97.35           N  
+ATOM    410  CA  VAL A  58     -15.422   6.854   2.250  1.00 97.35           C  
+ATOM    411  C   VAL A  58     -15.656   5.351   2.371  1.00 97.35           C  
+ATOM    412  CB  VAL A  58     -16.030   7.460   0.973  1.00 97.35           C  
+ATOM    413  O   VAL A  58     -15.510   4.614   1.396  1.00 97.35           O  
+ATOM    414  CG1 VAL A  58     -17.543   7.222   0.892  1.00 97.35           C  
+ATOM    415  CG2 VAL A  58     -15.764   8.969   0.880  1.00 97.35           C  
+ATOM    416  N   THR A  59     -15.952   4.893   3.589  1.00 95.76           N  
+ATOM    417  CA  THR A  59     -16.236   3.481   3.891  1.00 95.76           C  
+ATOM    418  C   THR A  59     -17.751   3.230   3.931  1.00 95.76           C  
+ATOM    419  CB  THR A  59     -15.582   3.017   5.210  1.00 95.76           C  
+ATOM    420  O   THR A  59     -18.518   4.176   4.129  1.00 95.76           O  
+ATOM    421  CG2 THR A  59     -14.139   3.486   5.406  1.00 95.76           C  
+ATOM    422  OG1 THR A  59     -16.328   3.444   6.325  1.00 95.76           O  
+ATOM    423  N   PRO A  60     -18.223   1.973   3.824  1.00 93.95           N  
+ATOM    424  CA  PRO A  60     -19.646   1.644   3.973  1.00 93.95           C  
+ATOM    425  C   PRO A  60     -20.249   2.051   5.329  1.00 93.95           C  
+ATOM    426  CB  PRO A  60     -19.727   0.125   3.778  1.00 93.95           C  
+ATOM    427  O   PRO A  60     -21.447   2.308   5.424  1.00 93.95           O  
+ATOM    428  CG  PRO A  60     -18.502  -0.202   2.926  1.00 93.95           C  
+ATOM    429  CD  PRO A  60     -17.465   0.794   3.430  1.00 93.95           C  
+ATOM    430  N   THR A  61     -19.423   2.125   6.377  1.00 93.58           N  
+ATOM    431  CA  THR A  61     -19.835   2.493   7.744  1.00 93.58           C  
+ATOM    432  C   THR A  61     -19.868   4.013   7.954  1.00 93.58           C  
+ATOM    433  CB  THR A  61     -18.892   1.824   8.760  1.00 93.58           C  
+ATOM    434  O   THR A  61     -20.513   4.499   8.884  1.00 93.58           O  
+ATOM    435  CG2 THR A  61     -19.376   1.916  10.208  1.00 93.58           C  
+ATOM    436  OG1 THR A  61     -18.794   0.446   8.473  1.00 93.58           O  
+ATOM    437  N   GLY A  62     -19.193   4.778   7.094  1.00 94.71           N  
+ATOM    438  CA  GLY A  62     -19.093   6.232   7.173  1.00 94.71           C  
+ATOM    439  C   GLY A  62     -17.763   6.772   6.649  1.00 94.71           C  
+ATOM    440  O   GLY A  62     -16.882   6.026   6.217  1.00 94.71           O  
+ATOM    441  N   ASN A  63     -17.609   8.092   6.708  1.00 96.32           N  
+ATOM    442  CA  ASN A  63     -16.379   8.757   6.288  1.00 96.32           C  
+ATOM    443  C   ASN A  63     -15.406   8.851   7.463  1.00 96.32           C  
+ATOM    444  CB  ASN A  63     -16.692  10.140   5.700  1.00 96.32           C  
+ATOM    445  O   ASN A  63     -15.789   9.303   8.544  1.00 96.32           O  
+ATOM    446  CG  ASN A  63     -17.540  10.089   4.443  1.00 96.32           C  
+ATOM    447  ND2 ASN A  63     -17.931  11.230   3.930  1.00 96.32           N  
+ATOM    448  OD1 ASN A  63     -17.876   9.053   3.900  1.00 96.32           O  
+ATOM    449  N   VAL A  64     -14.155   8.471   7.230  1.00 96.72           N  
+ATOM    450  CA  VAL A  64     -13.058   8.595   8.197  1.00 96.72           C  
+ATOM    451  C   VAL A  64     -11.926   9.410   7.586  1.00 96.72           C  
+ATOM    452  CB  VAL A  64     -12.579   7.229   8.721  1.00 96.72           C  
+ATOM    453  O   VAL A  64     -11.695   9.368   6.379  1.00 96.72           O  
+ATOM    454  CG1 VAL A  64     -13.699   6.502   9.475  1.00 96.72           C  
+ATOM    455  CG2 VAL A  64     -12.073   6.308   7.614  1.00 96.72           C  
+ATOM    456  N   GLU A  65     -11.240  10.184   8.417  1.00 97.27           N  
+ATOM    457  CA  GLU A  65     -10.158  11.069   7.996  1.00 97.27           C  
+ATOM    458  C   GLU A  65      -8.942  10.836   8.885  1.00 97.27           C  
+ATOM    459  CB  GLU A  65     -10.580  12.544   8.087  1.00 97.27           C  
+ATOM    460  O   GLU A  65      -9.082  10.760  10.105  1.00 97.27           O  
+ATOM    461  CG  GLU A  65     -11.793  12.919   7.220  1.00 97.27           C  
+ATOM    462  CD  GLU A  65     -12.090  14.428   7.259  1.00 97.27           C  
+ATOM    463  OE1 GLU A  65     -12.737  14.962   6.328  1.00 97.27           O  
+ATOM    464  OE2 GLU A  65     -11.555  15.162   8.124  1.00 97.27           O  
+ATOM    465  N   PHE A  66      -7.760  10.764   8.282  1.00 97.26           N  
+ATOM    466  CA  PHE A  66      -6.496  10.629   9.002  1.00 97.26           C  
+ATOM    467  C   PHE A  66      -5.343  11.282   8.228  1.00 97.26           C  
+ATOM    468  CB  PHE A  66      -6.227   9.152   9.318  1.00 97.26           C  
+ATOM    469  O   PHE A  66      -5.514  11.745   7.096  1.00 97.26           O  
+ATOM    470  CG  PHE A  66      -5.916   8.288   8.116  1.00 97.26           C  
+ATOM    471  CD1 PHE A  66      -6.950   7.869   7.260  1.00 97.26           C  
+ATOM    472  CD2 PHE A  66      -4.589   7.912   7.842  1.00 97.26           C  
+ATOM    473  CE1 PHE A  66      -6.648   7.086   6.138  1.00 97.26           C  
+ATOM    474  CE2 PHE A  66      -4.301   7.123   6.719  1.00 97.26           C  
+ATOM    475  CZ  PHE A  66      -5.329   6.696   5.873  1.00 97.26           C  
+ATOM    476  N   GLN A  67      -4.179  11.379   8.868  1.00 97.06           N  
+ATOM    477  CA  GLN A  67      -2.956  11.909   8.265  1.00 97.06           C  
+ATOM    478  C   GLN A  67      -2.069  10.753   7.812  1.00 97.06           C  
+ATOM    479  CB  GLN A  67      -2.216  12.791   9.282  1.00 97.06           C  
+ATOM    480  O   GLN A  67      -1.722   9.900   8.621  1.00 97.06           O  
+ATOM    481  CG  GLN A  67      -2.870  14.168   9.471  1.00 97.06           C  
+ATOM    482  CD  GLN A  67      -2.617  15.130   8.310  1.00 97.06           C  
+ATOM    483  NE2 GLN A  67      -3.041  16.369   8.415  1.00 97.06           N  
+ATOM    484  OE1 GLN A  67      -2.023  14.822   7.296  1.00 97.06           O  
+ATOM    485  N   CYS A  68      -1.678  10.750   6.541  1.00 96.89           N  
+ATOM    486  CA  CYS A  68      -0.785   9.744   5.979  1.00 96.89           C  
+ATOM    487  C   CYS A  68       0.507  10.417   5.495  1.00 96.89           C  
+ATOM    488  CB  CYS A  68      -1.514   9.024   4.848  1.00 96.89           C  
+ATOM    489  O   CYS A  68       0.426  11.353   4.691  1.00 96.89           O  
+ATOM    490  SG  CYS A  68      -0.529   7.626   4.233  1.00 96.89           S  
+ATOM    491  N   PRO A  69       1.686   9.979   5.966  1.00 96.13           N  
+ATOM    492  CA  PRO A  69       2.965  10.376   5.385  1.00 96.13           C  
+ATOM    493  C   PRO A  69       3.059  10.022   3.894  1.00 96.13           C  
+ATOM    494  CB  PRO A  69       4.031   9.646   6.202  1.00 96.13           C  
+ATOM    495  O   PRO A  69       2.423   9.075   3.431  1.00 96.13           O  
+ATOM    496  CG  PRO A  69       3.341   9.355   7.533  1.00 96.13           C  
+ATOM    497  CD  PRO A  69       1.900   9.098   7.105  1.00 96.13           C  
+ATOM    498  N   ASP A  70       3.862  10.775   3.150  1.00 95.31           N  
+ATOM    499  CA  ASP A  70       4.097  10.590   1.715  1.00 95.31           C  
+ATOM    500  C   ASP A  70       4.979   9.375   1.372  1.00 95.31           C  
+ATOM    501  CB  ASP A  70       4.626  11.908   1.117  1.00 95.31           C  
+ATOM    502  O   ASP A  70       5.054   8.980   0.211  1.00 95.31           O  
+ATOM    503  CG  ASP A  70       5.987  12.427   1.615  1.00 95.31           C  
+ATOM    504  OD1 ASP A  70       6.517  11.955   2.643  1.00 95.31           O  
+ATOM    505  OD2 ASP A  70       6.474  13.421   1.023  1.00 95.31           O  
+ATOM    506  N   ASP A  71       5.604   8.754   2.375  1.00 94.63           N  
+ATOM    507  CA  ASP A  71       6.423   7.538   2.284  1.00 94.63           C  
+ATOM    508  C   ASP A  71       5.790   6.291   2.905  1.00 94.63           C  
+ATOM    509  CB  ASP A  71       7.794   7.794   2.915  1.00 94.63           C  
+ATOM    510  O   ASP A  71       6.451   5.257   3.023  1.00 94.63           O  
+ATOM    511  CG  ASP A  71       7.780   8.101   4.432  1.00 94.63           C  
+ATOM    512  OD1 ASP A  71       6.756   8.595   4.958  1.00 94.63           O  
+ATOM    513  OD2 ASP A  71       8.850   7.917   5.064  1.00 94.63           O  
+ATOM    514  N   VAL A  72       4.521   6.368   3.303  1.00 96.39           N  
+ATOM    515  CA  VAL A  72       3.788   5.250   3.902  1.00 96.39           C  
+ATOM    516  C   VAL A  72       2.587   4.904   3.030  1.00 96.39           C  
+ATOM    517  CB  VAL A  72       3.399   5.565   5.359  1.00 96.39           C  
+ATOM    518  O   VAL A  72       1.912   5.785   2.494  1.00 96.39           O  
+ATOM    519  CG1 VAL A  72       2.631   4.412   6.015  1.00 96.39           C  
+ATOM    520  CG2 VAL A  72       4.644   5.803   6.226  1.00 96.39           C  
+ATOM    521  N   TYR A  73       2.308   3.608   2.885  1.00 97.16           N  
+ATOM    522  CA  TYR A  73       1.112   3.164   2.183  1.00 97.16           C  
+ATOM    523  C   TYR A  73      -0.148   3.576   2.939  1.00 97.16           C  
+ATOM    524  CB  TYR A  73       1.123   1.648   1.976  1.00 97.16           C  
+ATOM    525  O   TYR A  73      -0.243   3.427   4.158  1.00 97.16           O  
+ATOM    526  CG  TYR A  73       2.229   1.135   1.080  1.00 97.16           C  
+ATOM    527  CD1 TYR A  73       2.374   1.637  -0.229  1.00 97.16           C  
+ATOM    528  CD2 TYR A  73       3.085   0.120   1.546  1.00 97.16           C  
+ATOM    529  CE1 TYR A  73       3.349   1.092  -1.083  1.00 97.16           C  
+ATOM    530  CE2 TYR A  73       4.086  -0.398   0.707  1.00 97.16           C  
+ATOM    531  OH  TYR A  73       5.159  -0.437  -1.427  1.00 97.16           O  
+ATOM    532  CZ  TYR A  73       4.211   0.083  -0.611  1.00 97.16           C  
+ATOM    533  N   ILE A  74      -1.162   4.016   2.196  1.00 97.32           N  
+ATOM    534  CA  ILE A  74      -2.444   4.457   2.757  1.00 97.32           C  
+ATOM    535  C   ILE A  74      -3.081   3.376   3.644  1.00 97.32           C  
+ATOM    536  CB  ILE A  74      -3.377   4.895   1.606  1.00 97.32           C  
+ATOM    537  O   ILE A  74      -3.637   3.709   4.688  1.00 97.32           O  
+ATOM    538  CG1 ILE A  74      -2.829   6.201   0.985  1.00 97.32           C  
+ATOM    539  CG2 ILE A  74      -4.829   5.089   2.081  1.00 97.32           C  
+ATOM    540  CD1 ILE A  74      -3.557   6.658  -0.283  1.00 97.32           C  
+ATOM    541  N   LEU A  75      -2.996   2.097   3.253  1.00 97.32           N  
+ATOM    542  CA  LEU A  75      -3.491   0.988   4.074  1.00 97.32           C  
+ATOM    543  C   LEU A  75      -2.756   0.893   5.419  1.00 97.32           C  
+ATOM    544  CB  LEU A  75      -3.370  -0.336   3.297  1.00 97.32           C  
+ATOM    545  O   LEU A  75      -3.410   0.764   6.448  1.00 97.32           O  
+ATOM    546  CG  LEU A  75      -3.830  -1.569   4.103  1.00 97.32           C  
+ATOM    547  CD1 LEU A  75      -5.321  -1.507   4.427  1.00 97.32           C  
+ATOM    548  CD2 LEU A  75      -3.589  -2.855   3.318  1.00 97.32           C  
+ATOM    549  N   ASP A  76      -1.426   0.966   5.415  1.00 96.85           N  
+ATOM    550  CA  ASP A  76      -0.616   0.805   6.626  1.00 96.85           C  
+ATOM    551  C   ASP A  76      -0.880   1.951   7.612  1.00 96.85           C  
+ATOM    552  CB  ASP A  76       0.879   0.737   6.259  1.00 96.85           C  
+ATOM    553  O   ASP A  76      -1.127   1.718   8.793  1.00 96.85           O  
+ATOM    554  CG  ASP A  76       1.297  -0.492   5.437  1.00 96.85           C  
+ATOM    555  OD1 ASP A  76       0.500  -1.449   5.279  1.00 96.85           O  
+ATOM    556  OD2 ASP A  76       2.448  -0.496   4.954  1.00 96.85           O  
+ATOM    557  N   ALA A  77      -0.930   3.189   7.113  1.00 97.02           N  
+ATOM    558  CA  ALA A  77      -1.268   4.351   7.930  1.00 97.02           C  
+ATOM    559  C   ALA A  77      -2.718   4.300   8.459  1.00 97.02           C  
+ATOM    560  CB  ALA A  77      -0.990   5.601   7.091  1.00 97.02           C  
+ATOM    561  O   ALA A  77      -2.984   4.738   9.576  1.00 97.02           O  
+ATOM    562  N   ALA A  78      -3.660   3.734   7.697  1.00 96.98           N  
+ATOM    563  CA  ALA A  78      -5.030   3.524   8.164  1.00 96.98           C  
+ATOM    564  C   ALA A  78      -5.096   2.479   9.296  1.00 96.98           C  
+ATOM    565  CB  ALA A  78      -5.907   3.134   6.966  1.00 96.98           C  
+ATOM    566  O   ALA A  78      -5.784   2.704  10.294  1.00 96.98           O  
+ATOM    567  N   GLU A  79      -4.355   1.370   9.179  1.00 96.34           N  
+ATOM    568  CA  GLU A  79      -4.269   0.340  10.223  1.00 96.34           C  
+ATOM    569  C   GLU A  79      -3.676   0.893  11.530  1.00 96.34           C  
+ATOM    570  CB  GLU A  79      -3.420  -0.861   9.754  1.00 96.34           C  
+ATOM    571  O   GLU A  79      -4.181   0.578  12.610  1.00 96.34           O  
+ATOM    572  CG  GLU A  79      -4.108  -1.783   8.732  1.00 96.34           C  
+ATOM    573  CD  GLU A  79      -3.284  -3.051   8.418  1.00 96.34           C  
+ATOM    574  OE1 GLU A  79      -3.872  -4.098   8.069  1.00 96.34           O  
+ATOM    575  OE2 GLU A  79      -2.032  -3.064   8.516  1.00 96.34           O  
+ATOM    576  N   GLU A  80      -2.645   1.742  11.453  1.00 96.41           N  
+ATOM    577  CA  GLU A  80      -2.038   2.387  12.630  1.00 96.41           C  
+ATOM    578  C   GLU A  80      -3.024   3.294  13.384  1.00 96.41           C  
+ATOM    579  CB  GLU A  80      -0.792   3.193  12.224  1.00 96.41           C  
+ATOM    580  O   GLU A  80      -3.022   3.332  14.617  1.00 96.41           O  
+ATOM    581  CG  GLU A  80       0.406   2.289  11.887  1.00 96.41           C  
+ATOM    582  CD  GLU A  80       1.729   3.052  11.682  1.00 96.41           C  
+ATOM    583  OE1 GLU A  80       2.773   2.363  11.584  1.00 96.41           O  
+ATOM    584  OE2 GLU A  80       1.738   4.305  11.717  1.00 96.41           O  
+ATOM    585  N   GLU A  81      -3.921   3.959  12.656  1.00 96.03           N  
+ATOM    586  CA  GLU A  81      -4.999   4.785  13.211  1.00 96.03           C  
+ATOM    587  C   GLU A  81      -6.222   3.957  13.663  1.00 96.03           C  
+ATOM    588  CB  GLU A  81      -5.372   5.865  12.183  1.00 96.03           C  
+ATOM    589  O   GLU A  81      -7.202   4.499  14.179  1.00 96.03           O  
+ATOM    590  CG  GLU A  81      -4.228   6.871  11.949  1.00 96.03           C  
+ATOM    591  CD  GLU A  81      -3.940   7.779  13.159  1.00 96.03           C  
+ATOM    592  OE1 GLU A  81      -2.749   8.015  13.467  1.00 96.03           O  
+ATOM    593  OE2 GLU A  81      -4.909   8.301  13.761  1.00 96.03           O  
+ATOM    594  N   GLY A  82      -6.176   2.629  13.504  1.00 95.60           N  
+ATOM    595  CA  GLY A  82      -7.244   1.709  13.898  1.00 95.60           C  
+ATOM    596  C   GLY A  82      -8.432   1.674  12.932  1.00 95.60           C  
+ATOM    597  O   GLY A  82      -9.535   1.291  13.331  1.00 95.60           O  
+ATOM    598  N   ILE A  83      -8.230   2.085  11.679  1.00 95.50           N  
+ATOM    599  CA  ILE A  83      -9.231   2.035  10.612  1.00 95.50           C  
+ATOM    600  C   ILE A  83      -9.098   0.700   9.877  1.00 95.50           C  
+ATOM    601  CB  ILE A  83      -9.074   3.233   9.652  1.00 95.50           C  
+ATOM    602  O   ILE A  83      -8.067   0.407   9.277  1.00 95.50           O  
+ATOM    603  CG1 ILE A  83      -9.211   4.584  10.396  1.00 95.50           C  
+ATOM    604  CG2 ILE A  83     -10.104   3.132   8.508  1.00 95.50           C  
+ATOM    605  CD1 ILE A  83      -8.733   5.786   9.571  1.00 95.50           C  
+ATOM    606  N   ASP A  84     -10.168  -0.092   9.890  1.00 94.24           N  
+ATOM    607  CA  ASP A  84     -10.205  -1.381   9.200  1.00 94.24           C  
+ATOM    608  C   ASP A  84     -10.549  -1.202   7.713  1.00 94.24           C  
+ATOM    609  CB  ASP A  84     -11.178  -2.321   9.928  1.00 94.24           C  
+ATOM    610  O   ASP A  84     -11.539  -0.552   7.355  1.00 94.24           O  
+ATOM    611  CG  ASP A  84     -11.042  -3.785   9.495  1.00 94.24           C  
+ATOM    612  OD1 ASP A  84      -9.917  -4.187   9.126  1.00 94.24           O  
+ATOM    613  OD2 ASP A  84     -12.060  -4.507   9.597  1.00 94.24           O  
+ATOM    614  N   LEU A  85      -9.721  -1.779   6.844  1.00 95.31           N  
+ATOM    615  CA  LEU A  85      -9.887  -1.774   5.393  1.00 95.31           C  
+ATOM    616  C   LEU A  85      -9.721  -3.190   4.843  1.00 95.31           C  
+ATOM    617  CB  LEU A  85      -8.858  -0.835   4.736  1.00 95.31           C  
+ATOM    618  O   LEU A  85      -8.950  -3.975   5.389  1.00 95.31           O  
+ATOM    619  CG  LEU A  85      -9.108   0.669   4.905  1.00 95.31           C  
+ATOM    620  CD1 LEU A  85      -8.027   1.422   4.120  1.00 95.31           C  
+ATOM    621  CD2 LEU A  85     -10.483   1.074   4.361  1.00 95.31           C  
+ATOM    622  N   PRO A  86     -10.389  -3.532   3.730  1.00 95.42           N  
+ATOM    623  CA  PRO A  86     -10.244  -4.851   3.138  1.00 95.42           C  
+ATOM    624  C   PRO A  86      -8.841  -5.013   2.532  1.00 95.42           C  
+ATOM    625  CB  PRO A  86     -11.374  -4.946   2.111  1.00 95.42           C  
+ATOM    626  O   PRO A  86      -8.372  -4.173   1.763  1.00 95.42           O  
+ATOM    627  CG  PRO A  86     -11.584  -3.496   1.676  1.00 95.42           C  
+ATOM    628  CD  PRO A  86     -11.302  -2.709   2.954  1.00 95.42           C  
+ATOM    629  N   TYR A  87      -8.162  -6.112   2.867  1.00 95.33           N  
+ATOM    630  CA  TYR A  87      -6.882  -6.503   2.275  1.00 95.33           C  
+ATOM    631  C   TYR A  87      -6.713  -8.026   2.268  1.00 95.33           C  
+ATOM    632  CB  TYR A  87      -5.712  -5.822   3.004  1.00 95.33           C  
+ATOM    633  O   TYR A  87      -7.380  -8.757   2.997  1.00 95.33           O  
+ATOM    634  CG  TYR A  87      -5.512  -6.249   4.446  1.00 95.33           C  
+ATOM    635  CD1 TYR A  87      -6.110  -5.500   5.471  1.00 95.33           C  
+ATOM    636  CD2 TYR A  87      -4.725  -7.375   4.771  1.00 95.33           C  
+ATOM    637  CE1 TYR A  87      -5.940  -5.864   6.816  1.00 95.33           C  
+ATOM    638  CE2 TYR A  87      -4.543  -7.740   6.121  1.00 95.33           C  
+ATOM    639  OH  TYR A  87      -4.908  -7.275   8.447  1.00 95.33           O  
+ATOM    640  CZ  TYR A  87      -5.141  -6.975   7.145  1.00 95.33           C  
+ATOM    641  N   SER A  88      -5.795  -8.518   1.431  1.00 95.57           N  
+ATOM    642  CA  SER A  88      -5.434  -9.941   1.392  1.00 95.57           C  
+ATOM    643  C   SER A  88      -3.943 -10.141   1.117  1.00 95.57           C  
+ATOM    644  CB  SER A  88      -6.310 -10.676   0.368  1.00 95.57           C  
+ATOM    645  O   SER A  88      -3.199 -10.545   2.006  1.00 95.57           O  
+ATOM    646  OG  SER A  88      -6.017 -12.057   0.398  1.00 95.57           O  
+ATOM    647  N   CYS A  89      -3.477  -9.800  -0.090  1.00 96.40           N  
+ATOM    648  CA  CYS A  89      -2.105 -10.079  -0.525  1.00 96.40           C  
+ATOM    649  C   CYS A  89      -1.047  -9.091   0.003  1.00 96.40           C  
+ATOM    650  CB  CYS A  89      -2.078 -10.126  -2.061  1.00 96.40           C  
+ATOM    651  O   CYS A  89       0.110  -9.476   0.141  1.00 96.40           O  
+ATOM    652  SG  CYS A  89      -2.555  -8.587  -2.908  1.00 96.40           S  
+ATOM    653  N   ARG A  90      -1.422  -7.821   0.245  1.00 94.02           N  
+ATOM    654  CA  ARG A  90      -0.526  -6.698   0.627  1.00 94.02           C  
+ATOM    655  C   ARG A  90       0.710  -6.514  -0.275  1.00 94.02           C  
+ATOM    656  CB  ARG A  90      -0.131  -6.770   2.116  1.00 94.02           C  
+ATOM    657  O   ARG A  90       1.730  -6.002   0.162  1.00 94.02           O  
+ATOM    658  CG  ARG A  90      -1.330  -6.752   3.072  1.00 94.02           C  
+ATOM    659  CD  ARG A  90      -0.886  -6.724   4.543  1.00 94.02           C  
+ATOM    660  NE  ARG A  90      -0.436  -5.388   5.006  1.00 94.02           N  
+ATOM    661  NH1 ARG A  90      -1.367  -5.440   7.122  1.00 94.02           N  
+ATOM    662  NH2 ARG A  90      -0.231  -3.687   6.539  1.00 94.02           N  
+ATOM    663  CZ  ARG A  90      -0.662  -4.856   6.201  1.00 94.02           C  
+ATOM    664  N   ALA A  91       0.620  -6.942  -1.531  1.00 94.91           N  
+ATOM    665  CA  ALA A  91       1.715  -6.879  -2.502  1.00 94.91           C  
+ATOM    666  C   ALA A  91       1.319  -6.138  -3.791  1.00 94.91           C  
+ATOM    667  CB  ALA A  91       2.198  -8.313  -2.759  1.00 94.91           C  
+ATOM    668  O   ALA A  91       1.973  -6.305  -4.815  1.00 94.91           O  
+ATOM    669  N   GLY A  92       0.197  -5.405  -3.778  1.00 95.29           N  
+ATOM    670  CA  GLY A  92      -0.312  -4.705  -4.964  1.00 95.29           C  
+ATOM    671  C   GLY A  92      -0.662  -5.630  -6.139  1.00 95.29           C  
+ATOM    672  O   GLY A  92      -0.607  -5.203  -7.286  1.00 95.29           O  
+ATOM    673  N   SER A  93      -0.968  -6.904  -5.875  1.00 95.82           N  
+ATOM    674  CA  SER A  93      -1.162  -7.949  -6.897  1.00 95.82           C  
+ATOM    675  C   SER A  93      -2.557  -8.589  -6.878  1.00 95.82           C  
+ATOM    676  CB  SER A  93      -0.066  -9.004  -6.751  1.00 95.82           C  
+ATOM    677  O   SER A  93      -2.790  -9.600  -7.539  1.00 95.82           O  
+ATOM    678  OG  SER A  93      -0.122  -9.627  -5.475  1.00 95.82           O  
+ATOM    679  N   CYS A  94      -3.487  -8.025  -6.105  1.00 96.09           N  
+ATOM    680  CA  CYS A  94      -4.852  -8.518  -5.947  1.00 96.09           C  
+ATOM    681  C   CYS A  94      -5.857  -7.358  -5.846  1.00 96.09           C  
+ATOM    682  CB  CYS A  94      -4.925  -9.441  -4.715  1.00 96.09           C  
+ATOM    683  O   CYS A  94      -5.490  -6.248  -5.466  1.00 96.09           O  
+ATOM    684  SG  CYS A  94      -4.602  -8.674  -3.091  1.00 96.09           S  
+ATOM    685  N   SER A  95      -7.134  -7.636  -6.121  1.00 94.83           N  
+ATOM    686  CA  SER A  95      -8.246  -6.672  -6.091  1.00 94.83           C  
+ATOM    687  C   SER A  95      -8.809  -6.374  -4.699  1.00 94.83           C  
+ATOM    688  CB  SER A  95      -9.391  -7.203  -6.962  1.00 94.83           C  
+ATOM    689  O   SER A  95      -9.620  -5.465  -4.558  1.00 94.83           O  
+ATOM    690  OG  SER A  95      -9.674  -8.556  -6.635  1.00 94.83           O  
+ATOM    691  N   SER A  96      -8.403  -7.102  -3.656  1.00 96.73           N  
+ATOM    692  CA  SER A  96      -9.071  -7.016  -2.346  1.00 96.73           C  
+ATOM    693  C   SER A  96      -8.940  -5.653  -1.669  1.00 96.73           C  
+ATOM    694  CB  SER A  96      -8.566  -8.115  -1.415  1.00 96.73           C  
+ATOM    695  O   SER A  96      -9.832  -5.247  -0.934  1.00 96.73           O  
+ATOM    696  OG  SER A  96      -8.599  -9.362  -2.083  1.00 96.73           O  
+ATOM    697  N   CYS A  97      -7.849  -4.928  -1.939  1.00 96.99           N  
+ATOM    698  CA  CYS A  97      -7.617  -3.576  -1.423  1.00 96.99           C  
+ATOM    699  C   CYS A  97      -8.096  -2.475  -2.397  1.00 96.99           C  
+ATOM    700  CB  CYS A  97      -6.152  -3.458  -0.943  1.00 96.99           C  
+ATOM    701  O   CYS A  97      -7.664  -1.325  -2.301  1.00 96.99           O  
+ATOM    702  SG  CYS A  97      -4.885  -3.197  -2.230  1.00 96.99           S  
+ATOM    703  N   ALA A  98      -8.963  -2.818  -3.361  1.00 97.36           N  
+ATOM    704  CA  ALA A  98      -9.425  -1.886  -4.382  1.00 97.36           C  
+ATOM    705  C   ALA A  98     -10.331  -0.784  -3.816  1.00 97.36           C  
+ATOM    706  CB  ALA A  98     -10.109  -2.632  -5.533  1.00 97.36           C  
+ATOM    707  O   ALA A  98     -11.282  -1.016  -3.056  1.00 97.36           O  
+ATOM    708  N   GLY A  99     -10.048   0.433  -4.263  1.00 97.46           N  
+ATOM    709  CA  GLY A  99     -10.836   1.628  -4.033  1.00 97.46           C  
+ATOM    710  C   GLY A  99     -10.931   2.494  -5.286  1.00 97.46           C  
+ATOM    711  O   GLY A  99     -10.322   2.208  -6.318  1.00 97.46           O  
+ATOM    712  N   LYS A 100     -11.693   3.583  -5.179  1.00 97.48           N  
+ATOM    713  CA  LYS A 100     -11.872   4.572  -6.243  1.00 97.48           C  
+ATOM    714  C   LYS A 100     -11.452   5.956  -5.767  1.00 97.48           C  
+ATOM    715  CB  LYS A 100     -13.329   4.539  -6.736  1.00 97.48           C  
+ATOM    716  O   LYS A 100     -12.020   6.488  -4.813  1.00 97.48           O  
+ATOM    717  CG  LYS A 100     -13.491   5.175  -8.122  1.00 97.48           C  
+ATOM    718  CD  LYS A 100     -13.015   4.215  -9.220  1.00 97.48           C  
+ATOM    719  CE  LYS A 100     -13.097   4.892 -10.581  1.00 97.48           C  
+ATOM    720  NZ  LYS A 100     -12.581   4.009 -11.651  1.00 97.48           N  
+ATOM    721  N   LEU A 101     -10.480   6.555  -6.442  1.00 98.00           N  
+ATOM    722  CA  LEU A 101     -10.034   7.917  -6.186  1.00 98.00           C  
+ATOM    723  C   LEU A 101     -11.112   8.913  -6.636  1.00 98.00           C  
+ATOM    724  CB  LEU A 101      -8.694   8.134  -6.908  1.00 98.00           C  
+ATOM    725  O   LEU A 101     -11.552   8.899  -7.784  1.00 98.00           O  
+ATOM    726  CG  LEU A 101      -8.023   9.486  -6.604  1.00 98.00           C  
+ATOM    727  CD1 LEU A 101      -7.683   9.622  -5.119  1.00 98.00           C  
+ATOM    728  CD2 LEU A 101      -6.736   9.603  -7.417  1.00 98.00           C  
+ATOM    729  N   LYS A 102     -11.550   9.788  -5.728  1.00 97.25           N  
+ATOM    730  CA  LYS A 102     -12.512  10.864  -6.019  1.00 97.25           C  
+ATOM    731  C   LYS A 102     -11.840  12.201  -6.250  1.00 97.25           C  
+ATOM    732  CB  LYS A 102     -13.526  11.002  -4.876  1.00 97.25           C  
+ATOM    733  O   LYS A 102     -12.257  12.950  -7.128  1.00 97.25           O  
+ATOM    734  CG  LYS A 102     -14.434   9.786  -4.730  1.00 97.25           C  
+ATOM    735  CD  LYS A 102     -15.290   9.533  -5.983  1.00 97.25           C  
+ATOM    736  CE  LYS A 102     -16.151   8.365  -5.566  1.00 97.25           C  
+ATOM    737  NZ  LYS A 102     -17.104   7.824  -6.558  1.00 97.25           N  
+ATOM    738  N   THR A 103     -10.846  12.521  -5.431  1.00 97.23           N  
+ATOM    739  CA  THR A 103     -10.115  13.788  -5.480  1.00 97.23           C  
+ATOM    740  C   THR A 103      -8.674  13.581  -5.033  1.00 97.23           C  
+ATOM    741  CB  THR A 103     -10.760  14.876  -4.599  1.00 97.23           C  
+ATOM    742  O   THR A 103      -8.389  12.680  -4.242  1.00 97.23           O  
+ATOM    743  CG2 THR A 103     -12.205  15.212  -4.970  1.00 97.23           C  
+ATOM    744  OG1 THR A 103     -10.772  14.484  -3.250  1.00 97.23           O  
+ATOM    745  N   GLY A 104      -7.786  14.450  -5.517  1.00 96.90           N  
+ATOM    746  CA  GLY A 104      -6.362  14.432  -5.196  1.00 96.90           C  
+ATOM    747  C   GLY A 104      -5.527  13.596  -6.163  1.00 96.90           C  
+ATOM    748  O   GLY A 104      -5.995  13.183  -7.224  1.00 96.90           O  
+ATOM    749  N   SER A 105      -4.273  13.379  -5.785  1.00 96.43           N  
+ATOM    750  CA  SER A 105      -3.296  12.592  -6.526  1.00 96.43           C  
+ATOM    751  C   SER A 105      -2.557  11.644  -5.589  1.00 96.43           C  
+ATOM    752  CB  SER A 105      -2.295  13.511  -7.229  1.00 96.43           C  
+ATOM    753  O   SER A 105      -2.205  11.997  -4.463  1.00 96.43           O  
+ATOM    754  OG  SER A 105      -2.957  14.297  -8.205  1.00 96.43           O  
+ATOM    755  N   LEU A 106      -2.292  10.442  -6.086  1.00 96.86           N  
+ATOM    756  CA  LEU A 106      -1.520   9.412  -5.404  1.00 96.86           C  
+ATOM    757  C   LEU A 106      -0.552   8.757  -6.385  1.00 96.86           C  
+ATOM    758  CB  LEU A 106      -2.467   8.422  -4.704  1.00 96.86           C  
+ATOM    759  O   LEU A 106      -0.781   8.781  -7.594  1.00 96.86           O  
+ATOM    760  CG  LEU A 106      -3.499   7.707  -5.601  1.00 96.86           C  
+ATOM    761  CD1 LEU A 106      -2.954   6.439  -6.261  1.00 96.86           C  
+ATOM    762  CD2 LEU A 106      -4.687   7.329  -4.721  1.00 96.86           C  
+ATOM    763  N   ASN A 107       0.526   8.195  -5.855  1.00 96.33           N  
+ATOM    764  CA  ASN A 107       1.431   7.322  -6.585  1.00 96.33           C  
+ATOM    765  C   ASN A 107       1.070   5.875  -6.232  1.00 96.33           C  
+ATOM    766  CB  ASN A 107       2.887   7.696  -6.242  1.00 96.33           C  
+ATOM    767  O   ASN A 107       0.990   5.544  -5.053  1.00 96.33           O  
+ATOM    768  CG  ASN A 107       3.876   6.848  -7.026  1.00 96.33           C  
+ATOM    769  ND2 ASN A 107       4.879   7.421  -7.639  1.00 96.33           N  
+ATOM    770  OD1 ASN A 107       3.724   5.652  -7.147  1.00 96.33           O  
+ATOM    771  N   GLN A 108       0.851   5.033  -7.238  1.00 96.30           N  
+ATOM    772  CA  GLN A 108       0.638   3.596  -7.060  1.00 96.30           C  
+ATOM    773  C   GLN A 108       1.542   2.769  -7.982  1.00 96.30           C  
+ATOM    774  CB  GLN A 108      -0.859   3.247  -7.159  1.00 96.30           C  
+ATOM    775  O   GLN A 108       1.148   1.707  -8.437  1.00 96.30           O  
+ATOM    776  CG  GLN A 108      -1.502   3.575  -8.521  1.00 96.30           C  
+ATOM    777  CD  GLN A 108      -2.982   3.206  -8.556  1.00 96.30           C  
+ATOM    778  NE2 GLN A 108      -3.791   3.933  -9.297  1.00 96.30           N  
+ATOM    779  OE1 GLN A 108      -3.439   2.281  -7.899  1.00 96.30           O  
+ATOM    780  N   ASP A 109       2.751   3.249  -8.280  1.00 95.43           N  
+ATOM    781  CA  ASP A 109       3.690   2.600  -9.209  1.00 95.43           C  
+ATOM    782  C   ASP A 109       4.161   1.215  -8.715  1.00 95.43           C  
+ATOM    783  CB  ASP A 109       4.913   3.512  -9.438  1.00 95.43           C  
+ATOM    784  O   ASP A 109       4.617   0.395  -9.511  1.00 95.43           O  
+ATOM    785  CG  ASP A 109       4.617   4.854 -10.128  1.00 95.43           C  
+ATOM    786  OD1 ASP A 109       3.605   4.956 -10.855  1.00 95.43           O  
+ATOM    787  OD2 ASP A 109       5.438   5.792  -9.950  1.00 95.43           O  
+ATOM    788  N   ASP A 110       4.030   0.942  -7.412  1.00 95.52           N  
+ATOM    789  CA  ASP A 110       4.407  -0.331  -6.780  1.00 95.52           C  
+ATOM    790  C   ASP A 110       3.375  -1.455  -7.009  1.00 95.52           C  
+ATOM    791  CB  ASP A 110       4.657  -0.098  -5.274  1.00 95.52           C  
+ATOM    792  O   ASP A 110       3.621  -2.619  -6.677  1.00 95.52           O  
+ATOM    793  CG  ASP A 110       5.966   0.649  -4.958  1.00 95.52           C  
+ATOM    794  OD1 ASP A 110       6.852   0.728  -5.839  1.00 95.52           O  
+ATOM    795  OD2 ASP A 110       6.114   1.101  -3.799  1.00 95.52           O  
+ATOM    796  N   GLN A 111       2.209  -1.136  -7.576  1.00 95.77           N  
+ATOM    797  CA  GLN A 111       1.164  -2.108  -7.889  1.00 95.77           C  
+ATOM    798  C   GLN A 111       1.426  -2.838  -9.223  1.00 95.77           C  
+ATOM    799  CB  GLN A 111      -0.197  -1.401  -7.809  1.00 95.77           C  
+ATOM    800  O   GLN A 111       2.146  -2.355 -10.092  1.00 95.77           O  
+ATOM    801  CG  GLN A 111      -0.557  -0.609  -9.080  1.00 95.77           C  
+ATOM    802  CD  GLN A 111      -1.216  -1.439 -10.160  1.00 95.77           C  
+ATOM    803  NE2 GLN A 111      -1.048  -1.083 -11.412  1.00 95.77           N  
+ATOM    804  OE1 GLN A 111      -1.871  -2.431  -9.882  1.00 95.77           O  
+ATOM    805  N   SER A 112       0.819  -4.013  -9.414  1.00 95.91           N  
+ATOM    806  CA  SER A 112       0.989  -4.844 -10.623  1.00 95.91           C  
+ATOM    807  C   SER A 112      -0.301  -5.497 -11.139  1.00 95.91           C  
+ATOM    808  CB  SER A 112       2.064  -5.908 -10.363  1.00 95.91           C  
+ATOM    809  O   SER A 112      -0.243  -6.378 -11.997  1.00 95.91           O  
+ATOM    810  OG  SER A 112       1.715  -6.728  -9.258  1.00 95.91           O  
+ATOM    811  N   PHE A 113      -1.456  -5.108 -10.600  1.00 96.54           N  
+ATOM    812  CA  PHE A 113      -2.754  -5.725 -10.874  1.00 96.54           C  
+ATOM    813  C   PHE A 113      -3.638  -4.888 -11.808  1.00 96.54           C  
+ATOM    814  CB  PHE A 113      -3.449  -5.969  -9.533  1.00 96.54           C  
+ATOM    815  O   PHE A 113      -4.209  -5.446 -12.740  1.00 96.54           O  
+ATOM    816  CG  PHE A 113      -4.826  -6.586  -9.647  1.00 96.54           C  
+ATOM    817  CD1 PHE A 113      -5.977  -5.778  -9.594  1.00 96.54           C  
+ATOM    818  CD2 PHE A 113      -4.953  -7.970  -9.864  1.00 96.54           C  
+ATOM    819  CE1 PHE A 113      -7.245  -6.353  -9.781  1.00 96.54           C  
+ATOM    820  CE2 PHE A 113      -6.224  -8.544 -10.040  1.00 96.54           C  
+ATOM    821  CZ  PHE A 113      -7.370  -7.734 -10.005  1.00 96.54           C  
+ATOM    822  N   LEU A 114      -3.754  -3.582 -11.555  1.00 96.33           N  
+ATOM    823  CA  LEU A 114      -4.530  -2.651 -12.371  1.00 96.33           C  
+ATOM    824  C   LEU A 114      -3.795  -2.350 -13.678  1.00 96.33           C  
+ATOM    825  CB  LEU A 114      -4.811  -1.339 -11.609  1.00 96.33           C  
+ATOM    826  O   LEU A 114      -2.580  -2.128 -13.664  1.00 96.33           O  
+ATOM    827  CG  LEU A 114      -5.566  -1.484 -10.278  1.00 96.33           C  
+ATOM    828  CD1 LEU A 114      -5.686  -0.117  -9.598  1.00 96.33           C  
+ATOM    829  CD2 LEU A 114      -6.978  -2.038 -10.461  1.00 96.33           C  
+ATOM    830  N   ASP A 115      -4.537  -2.316 -14.779  1.00 95.81           N  
+ATOM    831  CA  ASP A 115      -4.045  -1.814 -16.062  1.00 95.81           C  
+ATOM    832  C   ASP A 115      -4.138  -0.277 -16.155  1.00 95.81           C  
+ATOM    833  CB  ASP A 115      -4.740  -2.552 -17.222  1.00 95.81           C  
+ATOM    834  O   ASP A 115      -4.715   0.390 -15.292  1.00 95.81           O  
+ATOM    835  CG  ASP A 115      -6.260  -2.373 -17.259  1.00 95.81           C  
+ATOM    836  OD1 ASP A 115      -6.710  -1.214 -17.147  1.00 95.81           O  
+ATOM    837  OD2 ASP A 115      -6.958  -3.399 -17.427  1.00 95.81           O  
+ATOM    838  N   ASP A 116      -3.526   0.293 -17.196  1.00 95.50           N  
+ATOM    839  CA  ASP A 116      -3.459   1.746 -17.387  1.00 95.50           C  
+ATOM    840  C   ASP A 116      -4.860   2.374 -17.523  1.00 95.50           C  
+ATOM    841  CB  ASP A 116      -2.604   2.074 -18.629  1.00 95.50           C  
+ATOM    842  O   ASP A 116      -5.105   3.445 -16.968  1.00 95.50           O  
+ATOM    843  CG  ASP A 116      -1.114   1.697 -18.533  1.00 95.50           C  
+ATOM    844  OD1 ASP A 116      -0.602   1.477 -17.414  1.00 95.50           O  
+ATOM    845  OD2 ASP A 116      -0.464   1.626 -19.607  1.00 95.50           O  
+ATOM    846  N   ASP A 117      -5.798   1.689 -18.191  1.00 95.97           N  
+ATOM    847  CA  ASP A 117      -7.170   2.175 -18.378  1.00 95.97           C  
+ATOM    848  C   ASP A 117      -7.895   2.256 -17.022  1.00 95.97           C  
+ATOM    849  CB  ASP A 117      -7.946   1.263 -19.356  1.00 95.97           C  
+ATOM    850  O   ASP A 117      -8.546   3.255 -16.706  1.00 95.97           O  
+ATOM    851  CG  ASP A 117      -7.475   1.293 -20.823  1.00 95.97           C  
+ATOM    852  OD1 ASP A 117      -6.917   2.320 -21.273  1.00 95.97           O  
+ATOM    853  OD2 ASP A 117      -7.742   0.304 -21.550  1.00 95.97           O  
+ATOM    854  N   GLN A 118      -7.733   1.243 -16.167  1.00 95.95           N  
+ATOM    855  CA  GLN A 118      -8.296   1.236 -14.820  1.00 95.95           C  
+ATOM    856  C   GLN A 118      -7.694   2.341 -13.938  1.00 95.95           C  
+ATOM    857  CB  GLN A 118      -8.072  -0.139 -14.175  1.00 95.95           C  
+ATOM    858  O   GLN A 118      -8.418   3.018 -13.196  1.00 95.95           O  
+ATOM    859  CG  GLN A 118      -8.974  -1.221 -14.782  1.00 95.95           C  
+ATOM    860  CD  GLN A 118      -8.649  -2.616 -14.256  1.00 95.95           C  
+ATOM    861  NE2 GLN A 118      -9.591  -3.531 -14.310  1.00 95.95           N  
+ATOM    862  OE1 GLN A 118      -7.585  -2.911 -13.733  1.00 95.95           O  
+ATOM    863  N   ILE A 119      -6.381   2.557 -14.014  1.00 95.94           N  
+ATOM    864  CA  ILE A 119      -5.715   3.648 -13.290  1.00 95.94           C  
+ATOM    865  C   ILE A 119      -6.273   5.004 -13.743  1.00 95.94           C  
+ATOM    866  CB  ILE A 119      -4.185   3.555 -13.468  1.00 95.94           C  
+ATOM    867  O   ILE A 119      -6.622   5.828 -12.893  1.00 95.94           O  
+ATOM    868  CG1 ILE A 119      -3.648   2.296 -12.749  1.00 95.94           C  
+ATOM    869  CG2 ILE A 119      -3.489   4.820 -12.927  1.00 95.94           C  
+ATOM    870  CD1 ILE A 119      -2.194   1.970 -13.109  1.00 95.94           C  
+ATOM    871  N   ASP A 120      -6.433   5.212 -15.051  1.00 95.31           N  
+ATOM    872  CA  ASP A 120      -6.968   6.446 -15.636  1.00 95.31           C  
+ATOM    873  C   ASP A 120      -8.439   6.689 -15.269  1.00 95.31           C  
+ATOM    874  CB  ASP A 120      -6.807   6.404 -17.167  1.00 95.31           C  
+ATOM    875  O   ASP A 120      -8.857   7.827 -15.036  1.00 95.31           O  
+ATOM    876  CG  ASP A 120      -5.413   6.806 -17.671  1.00 95.31           C  
+ATOM    877  OD1 ASP A 120      -4.601   7.318 -16.863  1.00 95.31           O  
+ATOM    878  OD2 ASP A 120      -5.219   6.767 -18.908  1.00 95.31           O  
+ATOM    879  N   GLU A 121      -9.235   5.628 -15.130  1.00 95.80           N  
+ATOM    880  CA  GLU A 121     -10.590   5.729 -14.590  1.00 95.80           C  
+ATOM    881  C   GLU A 121     -10.610   6.136 -13.105  1.00 95.80           C  
+ATOM    882  CB  GLU A 121     -11.328   4.398 -14.751  1.00 95.80           C  
+ATOM    883  O   GLU A 121     -11.679   6.453 -12.576  1.00 95.80           O  
+ATOM    884  CG  GLU A 121     -11.754   4.046 -16.178  1.00 95.80           C  
+ATOM    885  CD  GLU A 121     -12.500   2.701 -16.216  1.00 95.80           C  
+ATOM    886  OE1 GLU A 121     -12.871   2.292 -17.337  1.00 95.80           O  
+ATOM    887  OE2 GLU A 121     -12.804   2.158 -15.117  1.00 95.80           O  
+ATOM    888  N   GLY A 122      -9.472   6.089 -12.407  1.00 96.68           N  
+ATOM    889  CA  GLY A 122      -9.322   6.431 -10.994  1.00 96.68           C  
+ATOM    890  C   GLY A 122      -9.406   5.234 -10.048  1.00 96.68           C  
+ATOM    891  O   GLY A 122      -9.763   5.408  -8.883  1.00 96.68           O  
+ATOM    892  N   TRP A 123      -9.153   4.012 -10.521  1.00 97.54           N  
+ATOM    893  CA  TRP A 123      -8.994   2.858  -9.633  1.00 97.54           C  
+ATOM    894  C   TRP A 123      -7.672   2.934  -8.869  1.00 97.54           C  
+ATOM    895  CB  TRP A 123      -9.129   1.551 -10.415  1.00 97.54           C  
+ATOM    896  O   TRP A 123      -6.649   3.372  -9.397  1.00 97.54           O  
+ATOM    897  CG  TRP A 123     -10.508   1.316 -10.946  1.00 97.54           C  
+ATOM    898  CD1 TRP A 123     -10.933   1.429 -12.224  1.00 97.54           C  
+ATOM    899  CD2 TRP A 123     -11.663   0.864 -10.196  1.00 97.54           C  
+ATOM    900  CE2 TRP A 123     -12.768   0.728 -11.092  1.00 97.54           C  
+ATOM    901  CE3 TRP A 123     -11.848   0.503  -8.847  1.00 97.54           C  
+ATOM    902  NE1 TRP A 123     -12.268   1.104 -12.322  1.00 97.54           N  
+ATOM    903  CH2 TRP A 123     -14.168  -0.071  -9.301  1.00 97.54           C  
+ATOM    904  CZ2 TRP A 123     -14.017   0.281 -10.651  1.00 97.54           C  
+ATOM    905  CZ3 TRP A 123     -13.088   0.024  -8.408  1.00 97.54           C  
+ATOM    906  N   VAL A 124      -7.702   2.521  -7.603  1.00 97.69           N  
+ATOM    907  CA  VAL A 124      -6.526   2.522  -6.731  1.00 97.69           C  
+ATOM    908  C   VAL A 124      -6.454   1.262  -5.883  1.00 97.69           C  
+ATOM    909  CB  VAL A 124      -6.448   3.804  -5.877  1.00 97.69           C  
+ATOM    910  O   VAL A 124      -7.473   0.789  -5.379  1.00 97.69           O  
+ATOM    911  CG1 VAL A 124      -7.683   4.047  -4.996  1.00 97.69           C  
+ATOM    912  CG2 VAL A 124      -5.210   3.798  -4.974  1.00 97.69           C  
+ATOM    913  N   LEU A 125      -5.241   0.754  -5.667  1.00 97.68           N  
+ATOM    914  CA  LEU A 125      -4.957  -0.262  -4.655  1.00 97.68           C  
+ATOM    915  C   LEU A 125      -4.387   0.384  -3.389  1.00 97.68           C  
+ATOM    916  CB  LEU A 125      -4.015  -1.318  -5.253  1.00 97.68           C  
+ATOM    917  O   LEU A 125      -3.219   0.760  -3.345  1.00 97.68           O  
+ATOM    918  CG  LEU A 125      -4.623  -2.132  -6.411  1.00 97.68           C  
+ATOM    919  CD1 LEU A 125      -3.751  -3.353  -6.675  1.00 97.68           C  
+ATOM    920  CD2 LEU A 125      -6.037  -2.660  -6.139  1.00 97.68           C  
+ATOM    921  N   THR A 126      -5.194   0.488  -2.327  1.00 97.06           N  
+ATOM    922  CA  THR A 126      -4.805   1.192  -1.084  1.00 97.06           C  
+ATOM    923  C   THR A 126      -3.589   0.575  -0.390  1.00 97.06           C  
+ATOM    924  CB  THR A 126      -5.959   1.229  -0.072  1.00 97.06           C  
+ATOM    925  O   THR A 126      -2.879   1.260   0.343  1.00 97.06           O  
+ATOM    926  CG2 THR A 126      -7.185   1.967  -0.612  1.00 97.06           C  
+ATOM    927  OG1 THR A 126      -6.354  -0.084   0.255  1.00 97.06           O  
+ATOM    928  N   CYS A 127      -3.331  -0.709  -0.647  1.00 97.42           N  
+ATOM    929  CA  CYS A 127      -2.204  -1.459  -0.111  1.00 97.42           C  
+ATOM    930  C   CYS A 127      -0.864  -1.216  -0.823  1.00 97.42           C  
+ATOM    931  CB  CYS A 127      -2.584  -2.945  -0.063  1.00 97.42           C  
+ATOM    932  O   CYS A 127       0.151  -1.718  -0.353  1.00 97.42           O  
+ATOM    933  SG  CYS A 127      -3.025  -3.847  -1.584  1.00 97.42           S  
+ATOM    934  N   ALA A 128      -0.858  -0.487  -1.940  1.00 97.30           N  
+ATOM    935  CA  ALA A 128       0.342  -0.134  -2.701  1.00 97.30           C  
+ATOM    936  C   ALA A 128       0.251   1.307  -3.243  1.00 97.30           C  
+ATOM    937  CB  ALA A 128       0.563  -1.184  -3.800  1.00 97.30           C  
+ATOM    938  O   ALA A 128       0.688   1.587  -4.356  1.00 97.30           O  
+ATOM    939  N   ALA A 129      -0.375   2.209  -2.478  1.00 97.44           N  
+ATOM    940  CA  ALA A 129      -0.588   3.601  -2.863  1.00 97.44           C  
+ATOM    941  C   ALA A 129      -0.025   4.568  -1.815  1.00 97.44           C  
+ATOM    942  CB  ALA A 129      -2.084   3.835  -3.097  1.00 97.44           C  
+ATOM    943  O   ALA A 129      -0.355   4.454  -0.633  1.00 97.44           O  
+ATOM    944  N   TYR A 130       0.757   5.545  -2.273  1.00 97.59           N  
+ATOM    945  CA  TYR A 130       1.282   6.666  -1.493  1.00 97.59           C  
+ATOM    946  C   TYR A 130       0.526   7.955  -1.831  1.00 97.59           C  
+ATOM    947  CB  TYR A 130       2.766   6.887  -1.792  1.00 97.59           C  
+ATOM    948  O   TYR A 130       0.332   8.262  -3.014  1.00 97.59           O  
+ATOM    949  CG  TYR A 130       3.642   5.689  -1.525  1.00 97.59           C  
+ATOM    950  CD1 TYR A 130       4.092   5.418  -0.220  1.00 97.59           C  
+ATOM    951  CD2 TYR A 130       4.018   4.858  -2.593  1.00 97.59           C  
+ATOM    952  CE1 TYR A 130       4.939   4.315   0.018  1.00 97.59           C  
+ATOM    953  CE2 TYR A 130       4.871   3.771  -2.360  1.00 97.59           C  
+ATOM    954  OH  TYR A 130       6.175   2.438  -0.877  1.00 97.59           O  
+ATOM    955  CZ  TYR A 130       5.341   3.495  -1.060  1.00 97.59           C  
+ATOM    956  N   PRO A 131       0.116   8.759  -0.840  1.00 97.30           N  
+ATOM    957  CA  PRO A 131      -0.506  10.047  -1.109  1.00 97.30           C  
+ATOM    958  C   PRO A 131       0.539  11.065  -1.596  1.00 97.30           C  
+ATOM    959  CB  PRO A 131      -1.145  10.449   0.217  1.00 97.30           C  
+ATOM    960  O   PRO A 131       1.600  11.222  -1.000  1.00 97.30           O  
+ATOM    961  CG  PRO A 131      -0.204   9.834   1.255  1.00 97.30           C  
+ATOM    962  CD  PRO A 131       0.289   8.550   0.593  1.00 97.30           C  
+ATOM    963  N   VAL A 132       0.222  11.798  -2.668  1.00 96.81           N  
+ATOM    964  CA  VAL A 132       1.050  12.914  -3.184  1.00 96.81           C  
+ATOM    965  C   VAL A 132       0.378  14.270  -2.919  1.00 96.81           C  
+ATOM    966  CB  VAL A 132       1.374  12.695  -4.679  1.00 96.81           C  
+ATOM    967  O   VAL A 132       0.996  15.328  -3.028  1.00 96.81           O  
+ATOM    968  CG1 VAL A 132       2.296  13.775  -5.265  1.00 96.81           C  
+ATOM    969  CG2 VAL A 132       2.081  11.350  -4.904  1.00 96.81           C  
+ATOM    970  N   SER A 133      -0.902  14.247  -2.553  1.00 97.27           N  
+ATOM    971  CA  SER A 133      -1.684  15.384  -2.082  1.00 97.27           C  
+ATOM    972  C   SER A 133      -2.727  14.906  -1.075  1.00 97.27           C  
+ATOM    973  CB  SER A 133      -2.367  16.078  -3.271  1.00 97.27           C  
+ATOM    974  O   SER A 133      -2.875  13.706  -0.846  1.00 97.27           O  
+ATOM    975  OG  SER A 133      -3.466  15.337  -3.781  1.00 97.27           O  
+ATOM    976  N   ASP A 134      -3.532  15.828  -0.547  1.00 97.85           N  
+ATOM    977  CA  ASP A 134      -4.774  15.451   0.127  1.00 97.85           C  
+ATOM    978  C   ASP A 134      -5.661  14.666  -0.852  1.00 97.85           C  
+ATOM    979  CB  ASP A 134      -5.511  16.692   0.653  1.00 97.85           C  
+ATOM    980  O   ASP A 134      -5.862  15.101  -1.993  1.00 97.85           O  
+ATOM    981  CG  ASP A 134      -4.764  17.462   1.748  1.00 97.85           C  
+ATOM    982  OD1 ASP A 134      -3.760  16.944   2.289  1.00 97.85           O  
+ATOM    983  OD2 ASP A 134      -5.228  18.582   2.059  1.00 97.85           O  
+ATOM    984  N   VAL A 135      -6.160  13.504  -0.425  1.00 98.07           N  
+ATOM    985  CA  VAL A 135      -6.908  12.562  -1.274  1.00 98.07           C  
+ATOM    986  C   VAL A 135      -8.220  12.141  -0.627  1.00 98.07           C  
+ATOM    987  CB  VAL A 135      -6.091  11.312  -1.675  1.00 98.07           C  
+ATOM    988  O   VAL A 135      -8.335  12.030   0.594  1.00 98.07           O  
+ATOM    989  CG1 VAL A 135      -5.014  11.631  -2.711  1.00 98.07           C  
+ATOM    990  CG2 VAL A 135      -5.441  10.610  -0.483  1.00 98.07           C  
+ATOM    991  N   THR A 136      -9.223  11.870  -1.461  1.00 98.25           N  
+ATOM    992  CA  THR A 136     -10.474  11.218  -1.045  1.00 98.25           C  
+ATOM    993  C   THR A 136     -10.658   9.925  -1.824  1.00 98.25           C  
+ATOM    994  CB  THR A 136     -11.687  12.134  -1.231  1.00 98.25           C  
+ATOM    995  O   THR A 136     -10.713   9.961  -3.053  1.00 98.25           O  
+ATOM    996  CG2 THR A 136     -12.981  11.516  -0.704  1.00 98.25           C  
+ATOM    997  OG1 THR A 136     -11.481  13.335  -0.524  1.00 98.25           O  
+ATOM    998  N   ILE A 137     -10.770   8.794  -1.127  1.00 98.15           N  
+ATOM    999  CA  ILE A 137     -10.848   7.453  -1.721  1.00 98.15           C  
+ATOM   1000  C   ILE A 137     -12.115   6.751  -1.223  1.00 98.15           C  
+ATOM   1001  CB  ILE A 137      -9.566   6.638  -1.412  1.00 98.15           C  
+ATOM   1002  O   ILE A 137     -12.339   6.636  -0.019  1.00 98.15           O  
+ATOM   1003  CG1 ILE A 137      -8.301   7.361  -1.938  1.00 98.15           C  
+ATOM   1004  CG2 ILE A 137      -9.665   5.225  -2.021  1.00 98.15           C  
+ATOM   1005  CD1 ILE A 137      -6.979   6.732  -1.486  1.00 98.15           C  
+ATOM   1006  N   GLU A 138     -12.942   6.256  -2.141  1.00 97.71           N  
+ATOM   1007  CA  GLU A 138     -13.987   5.281  -1.814  1.00 97.71           C  
+ATOM   1008  C   GLU A 138     -13.362   3.901  -1.649  1.00 97.71           C  
+ATOM   1009  CB  GLU A 138     -15.074   5.228  -2.894  1.00 97.71           C  
+ATOM   1010  O   GLU A 138     -12.675   3.424  -2.547  1.00 97.71           O  
+ATOM   1011  CG  GLU A 138     -16.048   6.406  -2.812  1.00 97.71           C  
+ATOM   1012  CD  GLU A 138     -17.186   6.332  -3.843  1.00 97.71           C  
+ATOM   1013  OE1 GLU A 138     -18.056   7.229  -3.819  1.00 97.71           O  
+ATOM   1014  OE2 GLU A 138     -17.132   5.539  -4.811  1.00 97.71           O  
+ATOM   1015  N   THR A 139     -13.601   3.255  -0.514  1.00 97.28           N  
+ATOM   1016  CA  THR A 139     -13.034   1.937  -0.204  1.00 97.28           C  
+ATOM   1017  C   THR A 139     -14.076   0.835  -0.396  1.00 97.28           C  
+ATOM   1018  CB  THR A 139     -12.429   1.934   1.206  1.00 97.28           C  
+ATOM   1019  O   THR A 139     -15.247   1.124  -0.642  1.00 97.28           O  
+ATOM   1020  CG2 THR A 139     -11.402   3.054   1.384  1.00 97.28           C  
+ATOM   1021  OG1 THR A 139     -13.421   2.119   2.185  1.00 97.28           O  
+ATOM   1022  N   HIS A 140     -13.661  -0.432  -0.277  1.00 96.39           N  
+ATOM   1023  CA  HIS A 140     -14.538  -1.603  -0.441  1.00 96.39           C  
+ATOM   1024  C   HIS A 140     -15.145  -1.709  -1.851  1.00 96.39           C  
+ATOM   1025  CB  HIS A 140     -15.606  -1.662   0.670  1.00 96.39           C  
+ATOM   1026  O   HIS A 140     -16.324  -2.018  -2.011  1.00 96.39           O  
+ATOM   1027  CG  HIS A 140     -15.077  -1.596   2.078  1.00 96.39           C  
+ATOM   1028  CD2 HIS A 140     -15.161  -2.594   3.008  1.00 96.39           C  
+ATOM   1029  ND1 HIS A 140     -14.502  -0.509   2.702  1.00 96.39           N  
+ATOM   1030  CE1 HIS A 140     -14.233  -0.849   3.973  1.00 96.39           C  
+ATOM   1031  NE2 HIS A 140     -14.637  -2.104   4.205  1.00 96.39           N  
+ATOM   1032  N   LYS A 141     -14.343  -1.427  -2.885  1.00 96.60           N  
+ATOM   1033  CA  LYS A 141     -14.799  -1.389  -4.283  1.00 96.60           C  
+ATOM   1034  C   LYS A 141     -14.374  -2.602  -5.115  1.00 96.60           C  
+ATOM   1035  CB  LYS A 141     -14.393  -0.053  -4.928  1.00 96.60           C  
+ATOM   1036  O   LYS A 141     -14.487  -2.563  -6.334  1.00 96.60           O  
+ATOM   1037  CG  LYS A 141     -14.998   1.193  -4.269  1.00 96.60           C  
+ATOM   1038  CD  LYS A 141     -16.530   1.125  -4.307  1.00 96.60           C  
+ATOM   1039  CE  LYS A 141     -17.134   2.518  -4.171  1.00 96.60           C  
+ATOM   1040  NZ  LYS A 141     -18.414   2.601  -4.901  1.00 96.60           N  
+ATOM   1041  N   GLU A 142     -13.924  -3.684  -4.479  1.00 96.32           N  
+ATOM   1042  CA  GLU A 142     -13.527  -4.922  -5.170  1.00 96.32           C  
+ATOM   1043  C   GLU A 142     -14.646  -5.481  -6.065  1.00 96.32           C  
+ATOM   1044  CB  GLU A 142     -13.081  -5.962  -4.127  1.00 96.32           C  
+ATOM   1045  O   GLU A 142     -14.396  -5.836  -7.216  1.00 96.32           O  
+ATOM   1046  CG  GLU A 142     -12.740  -7.315  -4.775  1.00 96.32           C  
+ATOM   1047  CD  GLU A 142     -11.996  -8.269  -3.833  1.00 96.32           C  
+ATOM   1048  OE1 GLU A 142     -11.043  -8.932  -4.314  1.00 96.32           O  
+ATOM   1049  OE2 GLU A 142     -12.308  -8.303  -2.623  1.00 96.32           O  
+ATOM   1050  N   GLU A 143     -15.886  -5.507  -5.571  1.00 94.50           N  
+ATOM   1051  CA  GLU A 143     -17.037  -5.992  -6.344  1.00 94.50           C  
+ATOM   1052  C   GLU A 143     -17.321  -5.120  -7.574  1.00 94.50           C  
+ATOM   1053  CB  GLU A 143     -18.293  -6.039  -5.459  1.00 94.50           C  
+ATOM   1054  O   GLU A 143     -17.719  -5.636  -8.608  1.00 94.50           O  
+ATOM   1055  CG  GLU A 143     -18.186  -7.036  -4.293  1.00 94.50           C  
+ATOM   1056  CD  GLU A 143     -19.479  -7.151  -3.462  1.00 94.50           C  
+ATOM   1057  OE1 GLU A 143     -19.496  -7.995  -2.535  1.00 94.50           O  
+ATOM   1058  OE2 GLU A 143     -20.454  -6.411  -3.736  1.00 94.50           O  
+ATOM   1059  N   GLU A 144     -17.087  -3.807  -7.491  1.00 94.46           N  
+ATOM   1060  CA  GLU A 144     -17.305  -2.878  -8.607  1.00 94.46           C  
+ATOM   1061  C   GLU A 144     -16.183  -2.972  -9.654  1.00 94.46           C  
+ATOM   1062  CB  GLU A 144     -17.495  -1.458  -8.031  1.00 94.46           C  
+ATOM   1063  O   GLU A 144     -16.438  -2.761 -10.833  1.00 94.46           O  
+ATOM   1064  CG  GLU A 144     -17.913  -0.390  -9.064  1.00 94.46           C  
+ATOM   1065  CD  GLU A 144     -18.100   1.020  -8.460  1.00 94.46           C  
+ATOM   1066  OE1 GLU A 144     -18.119   2.007  -9.229  1.00 94.46           O  
+ATOM   1067  OE2 GLU A 144     -18.266   1.162  -7.219  1.00 94.46           O  
+ATOM   1068  N   LEU A 145     -14.961  -3.332  -9.244  1.00 92.47           N  
+ATOM   1069  CA  LEU A 145     -13.836  -3.560 -10.158  1.00 92.47           C  
+ATOM   1070  C   LEU A 145     -13.966  -4.881 -10.934  1.00 92.47           C  
+ATOM   1071  CB  LEU A 145     -12.540  -3.538  -9.326  1.00 92.47           C  
+ATOM   1072  O   LEU A 145     -13.418  -5.020 -12.024  1.00 92.47           O  
+ATOM   1073  CG  LEU A 145     -11.241  -3.708 -10.137  1.00 92.47           C  
+ATOM   1074  CD1 LEU A 145     -11.015  -2.586 -11.148  1.00 92.47           C  
+ATOM   1075  CD2 LEU A 145     -10.056  -3.706  -9.173  1.00 92.47           C  
+ATOM   1076  N   THR A 146     -14.643  -5.869 -10.347  1.00 89.15           N  
+ATOM   1077  CA  THR A 146     -14.746  -7.238 -10.883  1.00 89.15           C  
+ATOM   1078  C   THR A 146     -16.092  -7.555 -11.542  1.00 89.15           C  
+ATOM   1079  CB  THR A 146     -14.414  -8.279  -9.802  1.00 89.15           C  
+ATOM   1080  O   THR A 146     -16.254  -8.661 -12.066  1.00 89.15           O  
+ATOM   1081  CG2 THR A 146     -12.952  -8.206  -9.357  1.00 89.15           C  
+ATOM   1082  OG1 THR A 146     -15.195  -8.107  -8.642  1.00 89.15           O  
+ATOM   1083  N   ALA A 147     -17.037  -6.611 -11.517  1.00 87.34           N  
+ATOM   1084  CA  ALA A 147     -18.352  -6.709 -12.156  1.00 87.34           C  
+ATOM   1085  C   ALA A 147     -18.301  -6.389 -13.658  1.00 87.34           C  
+ATOM   1086  CB  ALA A 147     -19.326  -5.786 -11.410  1.00 87.34           C  
+ATOM   1087  O   ALA A 147     -19.040  -7.071 -14.409  1.00 87.34           O  
+ATOM   1088  OXT ALA A 147     -17.582  -5.437 -14.021  1.00 87.34           O  
+TER    1089      ALA A 147                                                      
+ENDMDL                                                                          
+END                                                                             
\ No newline at end of file

diff --git a/examples/AlphaFold/AF-P00221-F1-predicted_aligned_error_v4.json b/examples/AlphaFold/AF-P00221-F1-predicted_aligned_error_v4.json
new file mode 100644 (file)
index 0000000..fb021a8
--- /dev/null
+++ b/examples/AlphaFold/AF-P00221-F1-predicted_aligned_error_v4.json
@@ -0,0 +1 @@
+[{"predicted_aligned_error":[[0,1,4,4,6,7,9,14,15,16,16,15,14,15,18,17,20,18,19,19,21,21,21,24,25,25,24,26,27,26,27,28,30,29,29,29,29,29,29,29,29,30,30,30,30,30,30,30,29,31,30,31,31,31,31,30,30,30,29,30,30,30,30,30,30,31,30,30,31,31,30,31,30,31,30,31,31,30,31,31,30,31,30,30,31,30,30,28,28,31,31,31,30,29,31,30,30,31,31,31,31,31,30,31,30,31,31,30,30,31,30,30,30,31,30,31,30,30,31,30,31,31,30,31,30,31,30,31,30,31,31,31,30,31,30,30,31,30,30,30,30,31,29,30,31,29,30],[3,0,1,3,4,6,6,8,11,13,14,15,12,14,17,16,18,19,19,19,19,21,22,24,26,24,25,26,26,27,29,28,30,29,29,29,30,30,30,31,30,31,31,31,31,31,31,31,30,31,31,31,31,31,31,30,31,30,31,30,30,30,30,30,30,31,30,31,31,31,30,30,30,31,31,30,31,31,30,30,31,31,30,30,31,30,31,29,28,31,30,31,29,28,31,30,31,31,31,31,31,30,30,31,31,31,31,31,30,31,30,30,31,31,30,30,30,31,31,31,31,31,31,31,30,31,30,30,31,30,30,30,30,31,31,30,31,30,31,31,31,31,30,30,31,29,29],[6,3,0,1,3,5,5,6,8,10,13,13,12,14,17,16,18,19,20,21,19,21,22,23,26,24,24,27,26,27,28,28,30,29,29,30,30,30,30,30,29,30,30,31,31,31,31,31,30,31,31,31,31,31,31,31,31,30,30,30,30,31,30,30,30,31,31,31,31,31,30,31,31,31,31,31,31,31,31,30,31,31,31,30,31,30,31,30,28,31,30,31,29,28,31,30,31,31,31,31,31,30,30,31,30,31,30,31,30,31,30,30,31,31,30,30,30,30,31,31,31,31,31,31,30,31,30,30,31,31,31,31,31,31,31,30,31,30,31,31,31,31,30,30,31,30,30],[6,6,3,0,1,4,4,5,5,7,10,10,11,12,16,16,17,17,17,18,17,18,18,20,22,22,21,24,25,26,27,26,29,28,28,29,29,30,29,30,28,30,29,30,30,30,30,30,30,31,30,30,30,31,31,31,30,30,30,29,30,30,30,30,30,30,30,30,30,30,29,30,30,30,31,30,30,30,30,30,30,30,30,29,31,30,30,28,26,31,28,31,27,28,31,30,31,31,31,30,31,30,29,30,30,30,30,30,30,30,30,29,30,31,29,30,30,30,31,30,30,30,30,31,30,31,30,30,31,30,30,30,30,30,30,30,31,30,31,31,31,30,30,30,31,29,29],[6,6,7,3,0,1,3,4,5,5,7,9,10,10,13,14,17,16,17,18,16,18,18,21,22,21,21,24,24,26,27,26,28,27,27,28,30,30,29,30,27,29,28,30,29,30,30,30,30,31,30,30,30,30,31,31,30,30,30,29,30,30,29,30,30,30,30,30,30,30,29,30,29,30,30,30,30,30,30,30,30,29,30,29,31,30,30,28,26,31,27,30,26,28,31,30,30,30,30,30,30,30,29,30,29,30,30,30,30,30,30,29,30,31,29,30,30,30,31,30,30,30,30,30,30,30,29,29,31,30,30,30,30,30,30,30,30,29,30,30,30,30,29,30,31,29,29],[7,6,7,7,3,0,1,4,4,6,5,7,9,9,12,13,16,16,17,17,16,17,18,20,22,21,21,24,24,26,27,27,28,27,27,28,29,30,29,30,27,29,28,30,29,30,30,30,30,30,30,30,30,30,31,30,30,30,30,29,30,30,30,30,30,30,30,30,30,30,29,30,29,31,30,30,30,30,30,30,30,29,30,29,31,30,30,28,25,31,27,30,26,28,31,30,30,31,31,30,30,30,29,30,29,30,30,30,30,30,30,29,30,31,29,30,30,30,31,30,30,30,30,30,30,31,29,30,31,30,30,30,30,30,30,30,30,30,30,31,30,30,30,30,31,29,29],[8,5,6,7,7,3,0,1,5,5,5,5,7,8,11,13,15,16,17,17,15,17,18,19,21,20,21,23,24,26,27,26,28,27,26,28,29,29,29,30,28,29,28,30,29,29,30,30,30,31,30,30,30,31,30,30,30,31,30,29,30,30,30,30,30,30,30,30,30,30,29,30,29,31,30,30,30,30,31,30,30,29,30,29,31,30,30,29,26,31,28,30,27,29,31,30,30,31,31,31,31,30,30,31,30,30,30,30,30,30,30,29,30,31,30,30,30,30,31,30,31,30,30,30,30,31,29,30,31,30,30,31,30,31,30,30,31,30,30,30,31,30,29,30,31,29,30],[10,7,6,5,6,5,3,0,1,4,5,6,6,7,11,12,15,19,18,16,17,17,19,19,21,20,21,24,24,26,27,26,27,26,26,28,29,29,29,30,28,29,29,29,30,29,30,30,29,30,30,30,30,31,30,30,30,31,30,30,30,30,30,30,30,30,30,30,30,30,29,30,30,31,30,30,30,30,30,30,30,30,30,30,31,30,30,30,27,31,27,31,28,29,31,30,31,30,31,31,31,30,30,31,30,30,30,30,30,30,30,29,30,31,30,30,30,30,30,31,31,31,30,31,29,31,30,29,30,30,31,30,30,30,31,30,31,30,30,30,31,30,30,30,31,29,30],[13,9,7,5,5,6,6,3,0,2,4,6,5,6,9,10,12,12,16,15,17,16,17,18,20,20,21,23,23,25,27,26,27,26,26,27,29,29,29,29,27,29,29,30,29,30,30,30,30,30,30,30,30,31,30,30,31,31,30,30,30,31,30,30,30,30,30,30,30,30,29,30,30,30,30,30,30,30,31,30,30,30,30,30,31,30,30,29,27,31,28,31,28,29,30,30,31,30,31,31,31,31,30,31,30,31,30,30,30,30,29,29,31,31,30,31,31,31,30,31,31,31,30,31,29,31,30,28,30,30,30,31,30,31,31,30,31,31,30,31,31,30,30,31,31,29,30],[15,12,9,7,5,6,6,5,3,0,1,4,4,5,7,8,10,11,14,14,15,15,17,18,21,20,21,22,23,24,26,26,28,27,27,28,29,29,30,30,28,29,29,30,30,30,30,30,30,30,30,30,30,31,31,31,31,31,30,30,30,31,30,30,30,30,30,30,30,30,30,30,30,31,31,30,30,30,30,30,30,30,31,30,31,30,30,30,27,31,28,31,29,29,31,30,31,31,31,31,31,31,30,31,30,31,30,30,30,30,31,29,31,31,30,30,31,31,31,30,31,31,30,31,30,31,29,30,30,30,31,30,31,31,31,31,31,30,31,31,31,31,30,31,31,30,29],[19,15,12,10,8,6,6,7,6,3,0,2,5,5,7,7,10,12,14,15,17,14,17,18,20,20,20,23,22,23,25,24,26,24,24,26,29,28,29,29,27,29,29,29,29,30,30,29,30,30,30,30,31,31,30,31,30,31,30,30,31,31,30,30,31,30,30,30,31,30,30,30,30,30,30,30,30,30,31,30,30,30,30,30,31,30,30,30,28,31,28,31,28,30,30,31,31,31,31,31,30,31,30,31,30,30,30,30,30,30,30,29,31,31,30,31,31,30,30,31,31,31,31,31,29,31,30,29,30,31,30,30,30,31,30,31,30,31,30,31,31,30,30,31,31,30,30],[21,17,14,12,10,7,6,7,7,6,3,0,1,3,5,6,7,7,11,12,15,15,16,18,20,18,19,21,21,22,24,25,26,25,25,27,29,28,29,29,27,29,29,29,30,30,30,30,30,31,30,30,30,31,30,31,30,31,31,30,30,31,30,30,30,30,30,30,30,30,29,30,30,30,30,30,30,30,30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,3,3,3,4,3,4,3,3,2,2,2,2,2,3,2,2,2,2,2,2,3,3,3,3,3,3,3,3,3,3,3,3,2,2,3,2,2,2,2,1,1,1,0,1,1,1,2,2,2,3,3,4,4,4,4,4,5],[26,27,28,28,27,27,28,26,26,26,27,27,27,27,27,28,26,28,26,27,26,26,25,25,24,26,26,26,24,26,25,24,24,23,21,23,24,23,20,21,18,17,16,16,13,11,10,6,5,4,2,2,1,1,1,1,2,2,2,3,3,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,3,2,2,3,2,3,2,3,3,3,3,3,3,3,3,3,3,3,3,2,2,2,2,1,1,1,1,2,2,2,2,3,3,3,3,3,3,3,3,3,2,3,2,2,2,2,2,2,2,2,2,2,1,1,1,0,1,1,1,2,2,2,2,3,3,3,3,3,4],[26,26,27,29,29,28,29,27,28,28,28,28,28,28,28,28,26,29,27,27,25,26,26,26,26,26,25,25,25,25,26,24,24,24,20,24,24,22,21,21,20,19,17,18,13,12,12,7,6,4,3,2,1,2,1,1,1,2,2,2,3,2,2,2,2,2,2,2,2,2,3,3,3,2,2,3,3,2,3,3,3,3,3,3,3,3,3,3,4,3,3,3,3,3,3,3,3,2,2,2,2,1,2,2,2,2,2,3,3,3,3,3,3,3,3,3,3,3,3,3,3,2,2,2,2,2,2,2,2,2,2,2,1,1,0,1,1,1,2,2,2,3,3,3,3,3,4],[27,27,28,28,28,28,28,28,28,28,28,27,27,27,27,28,26,28,27,27,25,26,26,26,26,26,25,25,25,25,26,25,25,25,22,24,23,21,21,21,18,18,16,16,13,11,10,7,6,4,3,2,1,1,1,1,1,1,1,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,3,2,2,2,2,2,2,2,3,3,3,3,2,3,3,2,2,2,2,1,1,1,1,1,1,1,2,2,2,2,2,2,3,2,2,3,3,3,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,1,1,1,0,1,1,1,2,2,2,2,2,2,3,3],[27,27,27,28,28,28,28,28,29,28,28,28,28,28,28,28,27,29,28,26,27,27,27,27,27,28,26,26,26,26,26,25,25,26,22,24,25,23,21,22,19,19,17,18,14,13,11,8,7,4,3,2,2,2,1,1,1,1,1,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,3,2,3,2,2,2,2,2,2,3,2,3,2,2,2,2,2,2,1,1,1,1,1,1,1,2,2,2,2,3,3,3,3,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,1,1,1,0,1,1,1,1,2,2,2,2,3,3],[28,27,27,27,27,27,28,27,27,28,27,27,28,28,28,28,26,27,27,26,26,27,26,27,26,27,26,25,26,25,26,25,25,25,23,24,25,22,21,22,19,18,17,18,14,12,10,8,6,5,3,3,2,2,2,1,1,2,1,2,2,2,2,2,2,2,2,2,3,3,3,3,2,2,2,2,2,2,2,3,3,2,2,2,2,2,2,2,2,2,3,2,2,2,2,2,2,1,1,1,1,2,2,2,2,2,2,2,2,3,2,3,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,2,1,1,1,0,1,1,2,2,2,2,2,3,3],[28,27,28,29,29,28,28,28,28,29,29,28,29,29,29,29,28,29,28,27,27,27,27,28,28,29,28,28,28,27,28,27,27,27,24,27,27,25,25,24,21,20,19,18,15,14,13,10,9,6,5,4,3,3,2,2,2,1,2,2,3,3,3,3,3,3,4,4,4,4,4,4,4,3,2,3,3,3,3,4,4,4,2,3,2,2,3,3,3,3,3,3,3,3,3,2,2,2,2,2,2,2,2,2,3,3,3,3,3,4,3,3,3,3,4,3,4,3,3,3,3,3,2,2,2,2,3,3,3,3,3,3,3,2,2,2,1,1,0,2,2,2,2,3,3,3,4],[27,27,28,27,28,27,28,28,28,28,28,28,28,28,29,29,27,27,27,26,26,27,27,27,27,27,26,27,27,26,27,26,26,26,23,27,26,25,24,23,21,20,18,19,15,14,12,10,7,6,5,4,4,3,3,3,2,2,3,3,3,3,3,3,3,3,3,3,4,4,4,3,3,3,2,3,3,3,3,3,3,4,3,3,2,2,3,3,3,3,3,4,3,3,2,2,2,2,2,2,2,3,3,3,3,3,3,3,4,4,3,4,3,3,3,3,3,3,3,3,3,3,3,2,2,2,3,3,3,3,3,4,4,3,3,2,2,1,1,0,1,2,2,2,3,3,4],[27,26,27,28,28,28,28,28,28,28,28,27,29,28,29,29,27,28,27,27,27,28,27,28,27,27,26,27,27,26,28,27,26,27,24,26,27,24,24,25,21,20,19,20,15,13,12,11,9,8,8,6,5,5,3,3,3,2,3,4,3,3,3,3,3,3,4,4,5,5,5,4,3,3,3,3,3,3,3,4,4,3,3,3,2,2,3,3,3,3,4,3,3,3,2,2,2,2,2,2,2,2,3,4,4,5,3,4,4,4,4,4,3,3,3,3,3,3,3,3,3,3,2,2,3,2,3,3,3,4,4,4,5,4,4,3,2,3,1,1,0,1,2,2,2,2,3],[27,28,28,28,28,28,29,28,28,29,29,29,29,29,30,29,29,29,29,26,28,28,28,27,28,29,29,27,28,28,28,28,28,28,26,27,28,25,25,24,23,21,21,21,16,15,15,12,8,8,6,4,5,4,3,3,3,3,3,3,3,3,3,3,4,4,4,6,5,5,4,5,4,3,3,3,4,3,3,4,4,4,3,3,3,3,3,2,4,4,4,4,3,3,2,2,4,2,2,2,3,3,3,4,4,4,4,3,4,4,4,3,2,2,3,3,3,2,3,3,3,3,2,2,2,3,3,3,3,4,4,4,5,4,4,3,3,2,2,2,1,0,1,1,1,2,2],[27,26,26,27,27,26,27,27,27,28,27,27,27,28,28,28,26,28,26,25,26,27,26,26,27,27,27,27,26,25,26,26,25,25,24,26,26,24,24,22,21,20,19,19,15,15,14,11,9,7,7,6,7,7,6,6,4,4,4,4,4,4,5,5,6,6,6,6,6,6,5,5,4,4,3,4,5,4,4,4,5,4,4,3,3,3,3,3,3,3,4,3,3,3,2,2,3,2,3,3,4,3,5,5,6,5,5,5,5,4,4,4,3,3,3,5,4,4,3,4,3,4,3,3,3,3,3,4,5,5,6,6,7,6,6,4,3,3,2,3,2,1,0,1,1,2,3],[27,27,27,27,27,27,28,27,27,28,28,27,28,28,28,28,26,28,27,24,27,27,27,27,28,28,27,28,27,26,27,27,26,27,25,27,26,25,25,23,22,22,21,23,18,16,17,14,11,10,10,8,7,7,6,4,4,4,4,4,4,5,5,5,6,7,6,8,7,6,6,7,5,4,4,5,6,5,5,5,6,5,4,4,3,4,4,3,4,3,4,3,3,3,3,3,3,3,3,3,3,3,4,5,4,4,4,4,4,4,4,4,3,3,3,3,3,3,3,3,3,3,3,3,3,4,4,4,4,5,5,6,6,6,5,4,4,3,3,3,3,1,1,0,1,2,2],[27,28,28,28,29,28,29,28,29,29,29,30,29,29,30,30,28,29,29,25,28,28,28,28,29,30,29,28,28,28,28,28,28,28,27,28,28,26,27,26,24,22,22,22,18,15,15,12,11,11,9,7,6,7,7,6,4,4,4,5,5,6,5,6,5,7,7,8,8,6,7,7,5,5,4,6,6,5,5,6,6,6,5,5,4,4,4,4,4,4,6,4,4,3,3,3,3,3,3,3,5,4,5,5,5,6,4,6,5,5,5,4,3,3,3,3,3,4,3,4,3,3,2,5,3,6,5,5,7,5,7,5,7,6,6,5,5,4,4,3,2,2,2,1,0,1,2],[27,27,28,29,29,28,28,27,28,28,28,28,29,28,29,29,28,29,28,27,27,28,27,27,28,28,28,28,27,28,28,28,27,28,26,27,28,25,26,26,24,22,22,22,19,17,18,14,13,10,9,7,8,8,8,8,5,5,5,6,7,7,7,9,7,7,8,8,8,7,8,8,7,7,5,7,7,7,7,7,7,7,7,7,5,6,6,5,6,7,6,6,5,6,3,5,5,3,4,4,4,5,6,8,6,7,5,5,6,6,5,5,5,4,5,5,5,4,4,5,5,4,3,4,3,5,5,5,6,7,7,6,7,7,6,6,5,4,5,4,3,3,4,2,1,0,1],[26,25,26,26,27,27,27,27,27,28,27,28,26,27,27,28,28,28,28,25,28,27,27,27,27,28,28,27,28,26,28,27,28,28,27,27,28,27,26,26,24,24,23,23,22,22,21,17,19,16,18,14,17,17,14,14,12,11,10,13,13,13,12,16,14,15,15,14,15,14,14,14,10,11,9,11,14,14,10,12,14,13,14,14,9,10,9,8,9,11,10,7,7,6,4,7,6,5,7,8,8,10,13,14,12,12,11,9,10,10,7,9,5,6,7,9,7,6,7,8,8,8,5,6,5,7,10,8,10,12,13,13,16,17,12,12,9,8,8,6,6,6,4,5,2,1,0]],"max_predicted_aligned_error":31.75}]
\ No newline at end of file

diff --git a/src/jalview/gui/StructureChooser.java b/src/jalview/gui/StructureChooser.java
index 5612469..0823652 100644 (file)
--- a/src/jalview/gui/StructureChooser.java
+++ b/src/jalview/gui/StructureChooser.java
@@ -25,6 +25,7 @@ import java.awt.event.ActionEvent;
 import java.awt.event.ActionListener;
 import java.awt.event.ItemEvent;
 import java.io.File;
+import java.io.IOException;
 import java.util.ArrayList;
 import java.util.Collection;
 import java.util.HashSet;
@@ -43,10 +44,13 @@ import javax.swing.JTable;
 import javax.swing.SwingUtilities;
 import javax.swing.table.AbstractTableModel;
 
+import org.json.simple.parser.ParseException;
+
 import jalview.api.structures.JalviewStructureDisplayI;
 import jalview.bin.Cache;
 import jalview.bin.Console;
 import jalview.bin.Jalview;
+import jalview.datamodel.AlignmentI;
 import jalview.datamodel.PDBEntry;
 import jalview.datamodel.SequenceI;
 import jalview.fts.api.FTSData;
@@ -63,6 +67,7 @@ import jalview.gui.structurechooser.ThreeDBStructureChooserQuerySource;
 import jalview.io.DataSourceType;
 import jalview.io.JalviewFileChooser;
 import jalview.io.JalviewFileView;
+import jalview.io.StructureFile;
 import jalview.jbgui.FilterOption;
 import jalview.jbgui.GStructureChooser;
 import jalview.structure.StructureImportSettings.TFType;
@@ -73,6 +78,7 @@ import jalview.util.Platform;
 import jalview.util.StringUtils;
 import jalview.ws.DBRefFetcher;
 import jalview.ws.DBRefFetcher.FetchFinishedListenerI;
+import jalview.ws.dbsources.EBIAlfaFold;
 import jalview.ws.seqfetcher.DbSourceProxy;
 import jalview.ws.sifts.SiftsSettings;
 
@@ -1262,8 +1268,19 @@ public class StructureChooser extends GStructureChooser
         }
         else if (currentView == VIEWS_FROM_FILE)
         {
-          SequenceI userSelectedSeq = ((AssociateSeqOptions) fileChooserAssSeqPanel
-                  .getCmb_assSeq().getSelectedItem()).getSequence();
+
+          // TEMPFAC NOT WORKING
+          TFType tft = (TFType) StructureChooser.this.combo_tempFacAs
+                  .getSelectedItem();
+          if (tft != null && tft != TFType.DEFAULT)
+          {
+            ssm.setAddTempFacAnnot(true);
+          }
+
+          AssociateSeqOptions assSeqOpt = (AssociateSeqOptions) fileChooserAssSeqPanel
+                  .getCmb_assSeq().getSelectedItem();
+
+          SequenceI userSelectedSeq = assSeqOpt.getSequence();
           if (userSelectedSeq != null)
           {
             selectedSequence = userSelectedSeq;
@@ -1272,21 +1289,30 @@ public class StructureChooser extends GStructureChooser
                   .associatePdbWithSeq(selectedPdbFileName,
                           DataSourceType.FILE, selectedSequence, true,
                           Desktop.instance);
-          /* LOOK AT
-          public PDBEntry associatePdbWithSeq(String choice, DataSourceType file,
-                  SequenceI sequence, boolean prompt,
-                  StructureSelectionManagerProvider ssmp)
-          IN AssociatePdbFileWithSeq */
 
+          List<SequenceI> seqList = new ArrayList<>();
+          seqList.add(selectedSequence);
+          SequenceI[] seqArray = new SequenceI[] { selectedSequence };
+          StructureFile sf = ssm.computeMapping(true, seqArray, null,
+                  selectedPdbFileName, DataSourceType.FILE, null);
+          // EBIAlfaFold.addAlphaFoldPAEToStructure(pdbAlignment, pae, index,
+          // structIdOrFile, isStructId);
+          StructureMapping[] sm = ssm.getMapping(fileEntry.getFile());
           // DO SOMETHING WITH
-          if (StructureChooser.this.localPdbPaeMatrixFileName != null)
+          String paeFilename = StructureChooser.this.localPdbPaeMatrixFileName;
+          File paeFile = paeFilename == null ? null : new File(paeFilename);
+          if (paeFilename != null && paeFile.exists())
           {
-
-          }
-          if (StructureChooser.this.combo_tempFacAs
-                  .getSelectedItem() != null)
-          {
-
+            AlignmentI al = StructureChooser.this.ap.getAlignment();
+            try
+            {
+              EBIAlfaFold.importPaeJSONAsContactMatrixToSequence(al,
+                      paeFile, -1, selectedSequence.getName());
+            } catch (IOException | ParseException e)
+            {
+              // TODO Auto-generated catch block
+              e.printStackTrace();
+            }
           }
 
           sViewer = launchStructureViewer(ssm, new PDBEntry[] { fileEntry },

diff --git a/src/jalview/ws/dbsources/EBIAlfaFold.java b/src/jalview/ws/dbsources/EBIAlfaFold.java
index bee1ae9..672f0ac 100644 (file)
--- a/src/jalview/ws/dbsources/EBIAlfaFold.java
+++ b/src/jalview/ws/dbsources/EBIAlfaFold.java
@@ -358,6 +358,14 @@ public class EBIAlfaFold extends EbiFileRetrievedProxy
   }
 
   public static boolean importPaeJSONAsContactMatrixToSequence(
+          AlignmentI pdbAlignment, File paeFile, int index, String seqId)
+          throws FileNotFoundException, IOException, ParseException
+  {
+    return importPaeJSONAsContactMatrixToSequence(pdbAlignment,
+            new FileInputStream(paeFile), index, seqId);
+  }
+
+  public static boolean importPaeJSONAsContactMatrixToSequence(
           AlignmentI pdbAlignment, InputStream pae_input, int index,
           String seqId) throws IOException, ParseException
   {
@@ -431,10 +439,17 @@ public class EBIAlfaFold extends EbiFileRetrievedProxy
   }
 
   public static boolean importPaeJSONAsContactMatrixToStructure(
+          StructureMapping sm, File paeFile)
+          throws FileNotFoundException, IOException, ParseException
+  {
+    return importPaeJSONAsContactMatrixToStructure(sm,
+            new FileInputStream(paeFile));
+  }
+
+  public static boolean importPaeJSONAsContactMatrixToStructure(
           StructureMapping sm, InputStream paeInput)
           throws IOException, ParseException
   {
-
     JSONObject pae_obj = parseJSONtoPAEContactMatrix(paeInput);
     if (pae_obj == null)
     {